A0A061ICI5_CRIGR Loading...

Calcium release activated channel regulator 2B

AlphaFold DB , UniProt , Accession A0A061ICI5, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Cracr2b, Length 394 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
1M52.2Low41.7Very low250 Ų250133.8 Ų133.8100%1.23286%0.864SS**  0115.10-73.1-166.9179.900107.9
2A34.7Very low40.8Very low105 Ų105128.8 Ų128.887%0.86886%0.855SS**  trans173.8116.5156.100000109.1
3S42Very low40.1Very low112 Ų112134.2 Ų134.278%0.78386%0.861SS**  trans-72.8-168154.5-47.60000109.2
4P56Low39.6Very low128 Ų128138.1 Ų138.183%0.83186%0.862SS**  cis-141.5-176.2-5.534.3-11.5000115.1
5G34Very low39Very low77 Ų77140.9 Ų140.979%0.79486%0.861SS**  trans103.8119.1137.400000120
6Q44.3Very low38.6Very low193 Ų193142.6 Ų142.690%0.90286%0.857SS**  trans-70.1156.8153.2-81.3-168.4-17.400110.3
7P44.9Very low38.8Very low128 Ų128145.1 Ų145.183%0.83186%0.857SS**  -147.6175.463.835.3-12000116.6
8G39Very low38.6Very low70 Ų70143.5 Ų143.572%0.72285%0.849SS**  trans-76.9175.2174.600000114.6
9P42.5Very low38.2Very low135 Ų135147.3 Ų147.388%0.87785%0.854SS**  -142.8160.5113.336.2-20.9000113.9
10G35.8Very low37.9Very low69 Ų69143.1 Ų143.171%0.71184%0.843SS**  trans-94.6166.3168.400000112.7
11E33.6Very low37.8Very low205 Ų205144.5 Ų144.596%0.95885%0.845SS**  trans169.7128.4155.7-96.1171.9-171.600103.1
12G30.6Very low37.3Very low73 Ų73137.3 Ų137.375%0.75382%0.82SS**  cis124.799.932.700000105.6
13Q31.1Very low37.5Very low200 Ų200136 Ų13694%0.93581%0.808SS**  trans-145.1101.7159.7-104.7176.6-9.100107.8
14E33.8Very low37.5Very low188 Ų188132.5 Ų132.588%0.87979%0.79SS**  trans-57.9144.6156.5-61.8173.1157.100108.6
15E30.8Very low37.2Very low181 Ų181132.3 Ų132.385%0.84678%0.778SS**  -170.3131.9122.6-102.5173.2-163.500111.8
16E31.8Very low38.2Very low168 Ų168135.2 Ų135.279%0.78577%0.765SS**  trans73.791.3151-64.5-166.9145.100120.1T18E16-T18 PolarHBondContact O-N 3.32Å
17E41.5Very low38.8Very low184 Ų184129.7 Ų129.786%0.8675%0.746SS**  -44.3119.5129.2-73.4-175.9151.100110.6
18T36.2Very low39.7Very low117 Ų117128.6 Ų128.672%0.71873%0.729SS**  177.3110.2129.339.60000108.3E16E16-T18 PolarHBondContact O-N 3.32Å
19K30.3Very low41Very low216 Ų216126.6 Ų126.694%0.93970%0.703SS**  trans-176.7120142.2-105.9155.4-174.9172.60112.6
20G32.1Very low42.1Very low62 Ų62123.5 Ų123.564%0.63968%0.679SS**  trans8472.4130.600000115.5S22G20-S22 PolarHBondContact O-N 2.8Å
21I37.4Very low43.7Very low174 Ų174125.6 Ų125.689%0.89267%0.67SS**THydrogen-bonded Turntrans-56.886.4151.1-58.1163.4000107.3
22S41.2Very low45.5Very low99 Ų99121.3 Ų121.369%0.69265%0.65SS**THydrogen-bonded Turntrans-173-11.7164.8-167.10000114.6G20G20-S22 PolarHBondContact O-N 2.8Å
23A39.2Very low47.4Very low76 Ų76118 Ų11863%0.62862%0.616SS**SBendtrans-98.6-18.9-175.400000115.2H25A23-H25 PolarHBondContact O-N 2.84Å
24G40.5Very low49.2Very low39 Ų39113.8 Ų113.840%0.40260%0.596SS.*THydrogen-bonded Turntrans-72.7-23.6-17700000115.4R26 P27 E28G24-R26 VanDerWaalsContact C-N 3.3Å; G24-R26 PolarHBondContact O-N 3.33Å; G24-P27 VanDerWaalsContact O-CD 3.29Å; G24-P27 WeakPolarHBondContact O-CD 3.44Å; G24-P27 WeakPolarHBondContact O-CG 3.38Å; G24-E28 WeakPolarHBondContact O-CG 3.42Å
25H51Low51.1Low124 Ų124110 Ų11057%0.57458%0.579SS**Hα-helixtrans-74-14.7-175.6-71.393.7000114.2A23 V29A23-H25 PolarHBondContact O-N 2.84Å; H25-V29 WeakPolarHBondContact O-CB 3.23Å; H25-V29 WeakPolarHBondContact O-CG2 3.37Å; H25-V29 PolarHBondContact O-N 3.28Å
26R53.8Low53.1Low139 Ų139104.9 Ų104.953%0.52556%0.556SS.*Hα-helixtrans-75.4-51-178.8-76.7-176.4171.4167.3-3114.2G24 E28 L30 V97 E98G24-R26 VanDerWaalsContact C-N 3.3Å; G24-R26 PolarHBondContact O-N 3.33Å; R26-E28 VanDerWaalsContact C-N 3.35Å; R26-L30 WeakPolarHBondContact O-CG 3.42Å; R26-L30 PolarHBondContact O-N 3.19Å; R26-V97 HydrophobicContact CG-CG1 3.87Å; R26-E98 PolarHBondContact NH2-O 3.42Å
27P58.4Low55Low77 Ų7797.7 Ų97.750%0.552%0.523SS..Hα-helixtrans-68.1-36.2177.325.3-34000111.9G24 L30 Q31G24-P27 VanDerWaalsContact O-CD 3.29Å; G24-P27 WeakPolarHBondContact O-CD 3.44Å; G24-P27 WeakPolarHBondContact O-CG 3.38Å; P27-L30 PolarHBondContact O-N 3.08Å; P27-Q31 VanDerWaalsContact O-CB 3.26Å; P27-Q31 WeakPolarHBondContact O-CB 3.05Å; P27-Q31 PolarHBondContact O-N 2.85Å
28E64Low56.6Low104 Ų10495 Ų9549%0.48651%0.514SS..Hα-helixtrans-65.6-42.5-179.4-67.9173.4-172.800112.2G24 R26 Q31 Q32G24-E28 WeakPolarHBondContact O-CG 3.42Å; R26-E28 VanDerWaalsContact C-N 3.35Å; E28-Q31 PolarHBondContact O-N 3.46Å; E28-Q32 WeakPolarHBondContact O-CB 3.29Å; E28-Q32 VanDerWaalsContact O-CG 3.29Å; E28-Q32 WeakPolarHBondContact O-CG 3.48Å; E28-Q32 PolarHBondContact O-N 3.27Å
29V64.4Low58.2Low28 Ų2894.4 Ų94.417%0.1751%0.506CS..Hα-helixtrans-68.8-36.6178.1171.70000111.9H25 A33 V95H25-V29 WeakPolarHBondContact O-CB 3.23Å; H25-V29 WeakPolarHBondContact O-CG2 3.37Å; H25-V29 PolarHBondContact O-N 3.28Å; V29-A33 WeakPolarHBondContact O-CB 3.32Å; V29-A33 PolarHBondContact O-N 3.49Å; V29-V95 HydrophobicContact CG1-CB 4.2Å; V29-V95 HydrophobicContact CG1-CG1 3.9Å; V29-V95 HydrophobicContact CG2-CG1 4.44Å
30L66.7Low60.2Low71 Ų7184.4 Ų84.437%0.37246%0.463SS..Hα-helixtrans-70.3-34.6174.7-72.5173.5000112.1R26 P27 A33 Q34R26-L30 WeakPolarHBondContact O-CG 3.42Å; R26-L30 PolarHBondContact O-N 3.19Å; P27-L30 PolarHBondContact O-N 3.08Å; L30-A33 PolarHBondContact O-N 3.03Å; L30-Q34 WeakPolarHBondContact O-CG 3.47Å; L30-Q34 PolarHBondContact O-N 2.9Å
31Q69.4Low62.3Low113 Ų11382.2 Ų82.253%0.52844%0.436SS..Hα-helixtrans-71.1-42176.6-167.6166.14.500111.2P27 E28 A33 Q34 E35P27-Q31 VanDerWaalsContact O-CB 3.26Å; P27-Q31 WeakPolarHBondContact O-CB 3.05Å; P27-Q31 PolarHBondContact O-N 2.85Å; E28-Q31 PolarHBondContact O-N 3.46Å; Q31-A33 VanDerWaalsContact C-N 3.32Å; Q31-A33 PolarHBondContact O-N 3.48Å; Q31-Q34 WeakPolarHBondContact O-CB 3.34Å; Q31-Q34 PolarHBondContact O-N 3.24Å; Q31-Q34 VanDerWaalsContact O-N 3.15Å; Q31-E35 WeakPolarHBondContact O-CG 3.18Å; Q31-E35 PolarHBondContact O-N 3.37Å
32Q71.5Confident63.7Low114 Ų11481.1 Ų81.153%0.53343%0.425SS..Hα-helixtrans-61.4-38.6171.1-74.6174.8-2.600112E28 Q34 E35 L36E28-Q32 WeakPolarHBondContact O-CB 3.29Å; E28-Q32 VanDerWaalsContact O-CG 3.29Å; E28-Q32 WeakPolarHBondContact O-CG 3.48Å; E28-Q32 PolarHBondContact O-N 3.27Å; Q32-Q34 VanDerWaalsContact C-N 3.34Å; Q32-Q34 PolarHBondContact O-N 3.29Å; Q32-E35 PolarHBondContact O-N 3.49Å; Q32-L36 WeakPolarHBondContact O-CB 3.23Å; Q32-L36 VanDerWaalsContact O-CG 3.29Å; Q32-L36 WeakPolarHBondContact O-CG 3.38Å; Q32-L36 PolarHBondContact O-N 2.95Å
33A69.9Low64.9Low4 Ų481.6 Ų81.63%0.03342%0.42CS..Hα-helixtrans-66.6-33.5174.500000112.7V29 L30 Q31 F37 F87 L91V29-A33 WeakPolarHBondContact O-CB 3.32Å; V29-A33 PolarHBondContact O-N 3.49Å; L30-A33 PolarHBondContact O-N 3.03Å; Q31-A33 VanDerWaalsContact C-N 3.32Å; Q31-A33 PolarHBondContact O-N 3.48Å; A33-F37 WeakPolarHBondContact O-CB 3.35Å; A33-F37 PolarHBondContact O-N 3.1Å; A33-F87 WeakPolarHBondContact O-CE1 3.44Å; A33-L91 HydrophobicContact CB-CB 4.44Å
34Q69.4Low66.2Low111 Ų11182.1 Ų82.152%0.51942%0.424SS..Hα-helixtrans-71.1-40.3173.6-75174.820.100112.2L30 Q31 Q32 L36 F37 L38 C88L30-Q34 WeakPolarHBondContact O-CG 3.47Å; L30-Q34 PolarHBondContact O-N 2.9Å; Q31-Q34 WeakPolarHBondContact O-CB 3.34Å; Q31-Q34 PolarHBondContact O-N 3.24Å; Q31-Q34 VanDerWaalsContact O-N 3.15Å; Q32-Q34 VanDerWaalsContact C-N 3.34Å; Q32-Q34 PolarHBondContact O-N 3.29Å; Q34-L36 VanDerWaalsContact C-N 3.34Å; Q34-F37 WeakPolarHBondContact O-CB 3.17Å; Q34-F37 PolarHBondContact O-N 3.27Å; Q34-L38 WeakPolarHBondContact O-CD1 3.27Å; Q34-L38 PolarHBondContact O-N 3.29Å; Q34-C88 VanDerWaalsContact CG-SG 3.51Å
35E73.4Confident67.7Low110 Ų11084.6 Ų84.651%0.51442%0.424SS..Hα-helixtrans-63.3-42174.5-72.6174.1-173.300111.2Q31 Q32 F37 L38 L39Q31-E35 WeakPolarHBondContact O-CG 3.18Å; Q31-E35 PolarHBondContact O-N 3.37Å; Q32-E35 PolarHBondContact O-N 3.49Å; E35-F37 VanDerWaalsContact C-N 3.34Å; E35-F37 PolarHBondContact O-N 2.91Å; E35-L38 PolarHBondContact O-N 3.08Å; E35-L39 WeakPolarHBondContact O-CG 3.37Å; E35-L39 PolarHBondContact O-N 2.89Å
36L72.1Confident68.6Low72 Ų7280.8 Ų80.838%0.37742%0.418SS..Hα-helixtrans-61.5-42.6171.9-73.1170.9000111.4Q32 Q34 L38 L39 C40 F87Q32-L36 WeakPolarHBondContact O-CB 3.23Å; Q32-L36 VanDerWaalsContact O-CG 3.29Å; Q32-L36 WeakPolarHBondContact O-CG 3.38Å; Q32-L36 PolarHBondContact O-N 2.95Å; Q34-L36 VanDerWaalsContact C-N 3.34Å; L36-L38 VanDerWaalsContact C-N 3.29Å; L36-L38 PolarHBondContact O-N 2.97Å; L36-L39 HydrophobicContact CD2-CD1 4.39Å; L36-L39 WeakPolarHBondContact O-CB 3.43Å; L36-L39 PolarHBondContact O-N 3.29Å; L36-C40 PolarHBondContact O-N 3.05Å; L36-C40 PolarHBondContact O-SG 3.39Å; L36-F87 HydrophobicContact CB-CE1 4.17Å; L36-F87 HydrophobicContact CB-CZ 4.44Å
37F73.5Confident69.7Low18 Ų1877.8 Ų77.88%0.07941%0.409CS..Hα-helixtrans-57.2-43.1176.7-176.8-89.4000112.4A33 Q34 E35 L39 C40 D41 I48 A84 F87A33-F37 WeakPolarHBondContact O-CB 3.35Å; A33-F37 PolarHBondContact O-N 3.1Å; Q34-F37 WeakPolarHBondContact O-CB 3.17Å; Q34-F37 PolarHBondContact O-N 3.27Å; E35-F37 VanDerWaalsContact C-N 3.34Å; E35-F37 PolarHBondContact O-N 2.91Å; F37-L39 VanDerWaalsContact C-N 3.32Å; F37-L39 PolarHBondContact O-N 2.9Å; F37-C40 WeakPolarHBondContact O-CB 3.25Å; F37-C40 PolarHBondContact O-N 3.42Å; F37-D41 HydrophobicContact CE1-CB 4.42Å; F37-D41 PolarHBondContact O-N 3.36Å; F37-I48 HydrophobicContact CD2-CD1 3.18Å; F37-I48 HydrophobicContact CD2-CG1 3.83Å; F37-I48 HydrophobicContact CE2-CD1 3.41Å; F37-I48 VanDerWaalsContact CE2-CD1 3.41Å; F37-I48 HydrophobicContact CE2-CG1 3.51Å; F37-I48 HydrophobicContact CG-CD1 4.03Å; F37-I48 HydrophobicContact CZ-CD1 4.4Å; F37-I48 HydrophobicContact CZ-CG1 4.15Å; F37-A84 HydrophobicContact CD1-CB 3.88Å; F37-A84 HydrophobicContact CD2-CB 4.12Å; F37-A84 HydrophobicContact CE1-CB 3.56Å; F37-A84 HydrophobicContact CE2-CB 3.83Å; F37-A84 VanDerWaalsContact CE2-N 3.3Å; F37-A84 HydrophobicContact CG-CB 4.16Å; F37-A84 VanDerWaalsContact CZ-CA 3.48Å; F37-A84 HydrophobicContact CZ-CB 3.54Å; F37-F87 HydrophobicContact CB-CD1 3.84Å; F37-F87 HydrophobicContact CB-CE1 4.08Å; F37-F87 HydrophobicContact CD2-CB 3.81Å; F37-F87 AromaticContact CD2-CD1 3.87Å; F37-F87 HydrophobicContact CD2-CD1 3.87Å; F37-F87 AromaticContact CD2-CG 3.92Å; F37-F87 HydrophobicContact CD2-CG 3.92Å; F37-F87 HydrophobicContact CE2-CB 4.32Å; F37-F87 HydrophobicContact CG-CD1 4.36Å
38L74.2Confident70.6Confident128 Ų12874.1 Ų74.167%0.6739%0.385SS*.Hα-helixtrans-66.6-31.6176-80.4148.8000112.9Q34 E35 L36Q34-L38 WeakPolarHBondContact O-CD1 3.27Å; Q34-L38 PolarHBondContact O-N 3.29Å; E35-L38 PolarHBondContact O-N 3.08Å; L36-L38 VanDerWaalsContact C-N 3.29Å; L36-L38 PolarHBondContact O-N 2.97Å
39L69.6Low71.5Confident104 Ų10470.1 Ų70.155%0.54537%0.368SS..Hα-helixtrans-73.7-33174.6-70.4167.2000112.4E35 L36 F37E35-L39 WeakPolarHBondContact O-CG 3.37Å; E35-L39 PolarHBondContact O-N 2.89Å; L36-L39 HydrophobicContact CD2-CD1 4.39Å; L36-L39 WeakPolarHBondContact O-CB 3.43Å; L36-L39 PolarHBondContact O-N 3.29Å; F37-L39 VanDerWaalsContact C-N 3.32Å; F37-L39 PolarHBondContact O-N 2.9Å
40C72.7Confident72.2Confident6 Ų673.6 Ų73.64%0.04138%0.378CS..Hα-helixtrans-69.2-44.1173.9-54.80000111.6L36 F37 K42 I48 L56L36-C40 PolarHBondContact O-N 3.05Å; L36-C40 PolarHBondContact O-SG 3.39Å; F37-C40 WeakPolarHBondContact O-CB 3.25Å; F37-C40 PolarHBondContact O-N 3.42Å; C40-K42 PolarHBondContact O-N 3.04Å; C40-I48 HydrophobicContact CB-CD1 3.39Å; C40-I48 HydrophobicContact CB-CG1 3.65Å; C40-I48 HydrophobicContact CB-CG2 4.19Å; C40-L56 HydrophobicContact CB-CD1 4.02Å; C40-L56 WeakPolarHBondContact SG-CD1 3.37Å
41D75.3Confident72.5Confident16 Ų1677.6 Ų77.69%0.08640%0.395CS..  trans-91.966.4-174.7-173.517.1000112.2F37 D43 A44 K45 G46F37-D41 HydrophobicContact CE1-CB 4.42Å; F37-D41 PolarHBondContact O-N 3.36Å; D41-D43 PolarHBondContact O-N 3.13Å; D41-D43 VanDerWaalsContact O-N 3.14Å; D41-A44 PolarHBondContact O-N 3.44Å; D41-A44 VanDerWaalsContact O-N 3.11Å; D41-A44 PolarHBondContact OD1-N 3.22Å; D41-K45 VanDerWaalsContact CG-N 3.29Å; D41-K45 WeakPolarHBondContact OD1-CB 3.44Å; D41-K45 PolarHBondContact OD1-N 2.98Å; D41-K45 PolarHBondContact OD2-N 3.06Å; D41-G46 WeakPolarHBondContact OD2-CA 3.5Å; D41-G46 PolarHBondContact OD2-N 3.08Å
42K67Low72.9Confident151 Ų15173.8 Ų73.866%0.65738%0.378SS*.THydrogen-bonded Turntrans-60.2-22.7-179-66.4-179.9-1801730113.8C40C40-K42 PolarHBondContact O-N 3.04Å
43D67.2Low73.1Confident108 Ų10868.7 Ų68.758%0.57835%0.354SS*.THydrogen-bonded Turntrans-984.5-177.9-65.7-33.8000113D41 K45D41-D43 PolarHBondContact O-N 3.13Å; D41-D43 VanDerWaalsContact O-N 3.14Å; D43-K45 HydrophobicContact CB-CD 3.78Å; D43-K45 VanDerWaalsContact CB-CE 3.46Å; D43-K45 HydrophobicContact CB-CG 3.79Å; D43-K45 PolarHBondContact O-N 2.95Å; D43-K45 WeakPolarHBondContact OD2-CE 3.44Å; D43-K45 IonicContact OD2-NZ 2.96Å; D43-K45 PolarHBondContact OD2-NZ 3.32Å
44A66.6Low73.1Confident88 Ų8872.1 Ų72.173%0.72737%0.37SS*.  trans51.538.6-177.800000113.6D41 G46D41-A44 PolarHBondContact O-N 3.44Å; D41-A44 VanDerWaalsContact O-N 3.11Å; D41-A44 PolarHBondContact OD1-N 3.22Å; A44-G46 VanDerWaalsContact C-N 3.26Å; A44-G46 PolarHBondContact O-N 3.38Å
45K71.1Confident73.2Confident91 Ų9168.8 Ų68.840%0.39637%0.365SS..  trans-72.6-19.7-178.8-69.8161.2174.11580112.3D41 D43 F47 D52D41-K45 VanDerWaalsContact CG-N 3.29Å; D41-K45 WeakPolarHBondContact OD1-CB 3.44Å; D41-K45 PolarHBondContact OD1-N 2.98Å; D41-K45 PolarHBondContact OD2-N 3.06Å; D43-K45 HydrophobicContact CB-CD 3.78Å; D43-K45 VanDerWaalsContact CB-CE 3.46Å; D43-K45 HydrophobicContact CB-CG 3.79Å; D43-K45 PolarHBondContact O-N 2.95Å; D43-K45 WeakPolarHBondContact OD2-CE 3.44Å; D43-K45 IonicContact OD2-NZ 2.96Å; D43-K45 PolarHBondContact OD2-NZ 3.32Å; K45-F47 VanDerWaalsContact C-N 3.27Å; K45-F47 HydrophobicContact CB-CD1 4.07Å; K45-F47 HydrophobicContact CB-CE1 3.79Å; K45-F47 HydrophobicContact CB-CE2 4.4Å; K45-F47 HydrophobicContact CB-CG 4.49Å; K45-F47 HydrophobicContact CB-CZ 3.97Å; K45-F47 HydrophobicContact CG-CZ 4.48Å; K45-F47 WeakPolarHBondContact O-CD1 3.48Å; K45-F47 WeakPolarHBondContact O-CE1 3.48Å; K45-D52 IonicContact NZ-OD1 2.73Å
46G70.3Confident72.9Confident43 Ų4364.7 Ų64.744%0.44335%0.347SS..SBendtrans80.44.9-175.600000114D41 A44D41-G46 WeakPolarHBondContact OD2-CA 3.5Å; D41-G46 PolarHBondContact OD2-N 3.08Å; A44-G46 VanDerWaalsContact C-N 3.26Å; A44-G46 PolarHBondContact O-N 3.38Å
47F78Confident72.5Confident76 Ų7666.1 Ų66.133%0.33335%0.352SS..EExtended strand (participates in β ladder)trans-149.2147.317858.6-90.7000110.7K45 T49 F81 L82K45-F47 VanDerWaalsContact C-N 3.27Å; K45-F47 HydrophobicContact CB-CD1 4.07Å; K45-F47 HydrophobicContact CB-CE1 3.79Å; K45-F47 HydrophobicContact CB-CE2 4.4Å; K45-F47 HydrophobicContact CB-CG 4.49Å; K45-F47 HydrophobicContact CB-CZ 3.97Å; K45-F47 HydrophobicContact CG-CZ 4.48Å; K45-F47 WeakPolarHBondContact O-CD1 3.48Å; K45-F47 WeakPolarHBondContact O-CE1 3.48Å; F47-T49 HydrophobicContact CD2-CG2 3.98Å; F47-T49 HydrophobicContact CE2-CG2 3.79Å; F47-F81 HydrophobicContact CB-CB 4.34Å; F47-F81 HydrophobicContact CD2-CB 3.96Å; F47-F81 AromaticContact CD2-CD1 3.84Å; F47-F81 HydrophobicContact CD2-CD1 3.84Å; F47-F81 HydrophobicContact CD2-CG 4.01Å; F47-F81 AromaticContact CE2-CD1 3.99Å; F47-F81 HydrophobicContact CE2-CD1 3.99Å; F47-F81 HydrophobicContact CE2-CE1 4.34Å; F47-F81 HydrophobicContact CE2-CG 4.37Å; F47-F81 HydrophobicContact CG-CB 4.45Å; F47-L82 CarbonylContact C-O 3.54Å; F47-L82 VanDerWaalsContact CA-O 3.32Å; F47-L82 WeakPolarHBondContact CA-O 3.33Å
48I77.4Confident71.9Confident0 Ų069.8 Ų69.80%038%0.379CS..EExtended strand (participates in β ladder)trans-100.8122.1179.1-62.7168.1000108.8F37 C40 D52 L53 F71 F81 L82 F87F37-I48 HydrophobicContact CD2-CD1 3.18Å; F37-I48 HydrophobicContact CD2-CG1 3.83Å; F37-I48 HydrophobicContact CE2-CD1 3.41Å; F37-I48 VanDerWaalsContact CE2-CD1 3.41Å; F37-I48 HydrophobicContact CE2-CG1 3.51Å; F37-I48 HydrophobicContact CG-CD1 4.03Å; F37-I48 HydrophobicContact CZ-CD1 4.4Å; F37-I48 HydrophobicContact CZ-CG1 4.15Å; C40-I48 HydrophobicContact CB-CD1 3.39Å; C40-I48 HydrophobicContact CB-CG1 3.65Å; C40-I48 HydrophobicContact CB-CG2 4.19Å; I48-D52 HydrophobicContact CG2-CB 4.1Å; I48-L53 HydrophobicContact CG2-CB 4.11Å; I48-L53 HydrophobicContact CG2-CD1 4.03Å; I48-F71 WeakPolarHBondContact O-CE2 3.34Å; I48-F81 WeakPolarHBondContact O-CA 3.44Å; I48-L82 HydrophobicContact CB-CB 4.32Å; I48-L82 PolarHBondContact N-O 3.27Å; I48-L82 PolarHBondContact O-N 2.99Å; I48-F87 HydrophobicContact CD1-CD1 4.48Å; I48-F87 HydrophobicContact CD1-CD2 3.87Å; I48-F87 HydrophobicContact CD1-CE2 4.04Å; I48-F87 HydrophobicContact CD1-CG 4.1Å; I48-F87 HydrophobicContact CD1-CZ 4.4Å
49T81.6Confident71.4Confident21 Ų2169.1 Ų69.113%0.12938%0.376CS..EExtended strand (participates in β ladder)trans-88.2164.3171.578.30000111.1F47 Q51 D52 L53 F81F47-T49 HydrophobicContact CD2-CG2 3.98Å; F47-T49 HydrophobicContact CE2-CG2 3.79Å; T49-Q51 PolarHBondContact O-N 3.07Å; T49-D52 VanDerWaalsContact CB-OD2 3.25Å; T49-D52 WeakPolarHBondContact CB-OD2 3.29Å; T49-D52 WeakPolarHBondContact CG2-OD2 3.41Å; T49-D52 PolarHBondContact N-OD2 2.93Å; T49-D52 PolarHBondContact O-N 3.43Å; T49-D52 PolarHBondContact OG1-N 3.37Å; T49-D52 PolarHBondContact OG1-OD2 3.37Å; T49-L53 PolarHBondContact O-N 3.17Å; T49-L53 VanDerWaalsContact O-N 3.12Å; T49-F81 HydrophobicContact CG2-CD1 3.35Å; T49-F81 HydrophobicContact CG2-CE1 3.39Å
50R79.8Confident71.1Confident100 Ų10068 Ų6838%0.37737%0.371SS..Hα-helixtrans-53.4-38.4175.5-66.6175-178.8-139.63.2112.8Q54 E68 F71R50-Q54 VanDerWaalsContact O-CG 3.27Å; R50-Q54 WeakPolarHBondContact O-CG 3.29Å; R50-Q54 PolarHBondContact O-N 2.9Å; R50-E68 VanDerWaalsContact CD-OE1 3.26Å; R50-E68 WeakPolarHBondContact CD-OE1 3.4Å; R50-E68 IonicContact CZ-OE1 3.31Å; R50-E68 IonicContact NE-OE1 3.4Å; R50-E68 IonicContact NH1-OE1 3.65Å; R50-E68 PolarHBondContact NH1-OE1 3.35Å; R50-F71 HydrophobicContact CG-CD1 3.67Å; R50-F71 HydrophobicContact CG-CD2 4.32Å; R50-F71 HydrophobicContact CG-CE1 3.53Å; R50-F71 HydrophobicContact CG-CE2 4.18Å; R50-F71 HydrophobicContact CG-CG 4.08Å; R50-F71 HydrophobicContact CG-CZ 3.79Å
51Q73.6Confident70.5Confident156 Ų15674 Ų7473%0.72941%0.409SS*.Hα-helixtrans-70.5-35.2178.9-68.5179.7200112.1T49 Q54 G55T49-Q51 PolarHBondContact O-N 3.07Å; Q51-Q54 PolarHBondContact O-N 2.88Å; Q51-G55 PolarHBondContact O-N 2.73Å
52D77.4Confident70Confident32 Ų3276.1 Ų76.117%0.17142%0.42CS..Hα-helixtrans-68.2-38178.1-56.3-41000111K45 I48 T49 G55K45-D52 IonicContact NZ-OD1 2.73Å; I48-D52 HydrophobicContact CG2-CB 4.1Å; T49-D52 VanDerWaalsContact CB-OD2 3.25Å; T49-D52 WeakPolarHBondContact CB-OD2 3.29Å; T49-D52 WeakPolarHBondContact CG2-OD2 3.41Å; T49-D52 PolarHBondContact N-OD2 2.93Å; T49-D52 PolarHBondContact O-N 3.43Å; T49-D52 PolarHBondContact OG1-N 3.37Å; T49-D52 PolarHBondContact OG1-OD2 3.37Å; D52-G55 PolarHBondContact O-N 3.39Å
53L74.7Confident70.4Confident8 Ų871.9 Ų71.94%0.04241%0.407CS..Hα-helixtrans-70.7-37.6175.4-156.9104.4000112.3I48 T49 G55 L56 L67 F71 F87I48-L53 HydrophobicContact CG2-CB 4.11Å; I48-L53 HydrophobicContact CG2-CD1 4.03Å; T49-L53 PolarHBondContact O-N 3.17Å; T49-L53 VanDerWaalsContact O-N 3.12Å; L53-G55 PolarHBondContact O-N 3.21Å; L53-L56 WeakPolarHBondContact O-CB 3.44Å; L53-L56 PolarHBondContact O-N 3.09Å; L53-L67 HydrophobicContact CD2-CB 3.97Å; L53-L67 HydrophobicContact CD2-CD2 3.77Å; L53-L67 HydrophobicContact CD2-CG 4.49Å; L53-L67 VanDerWaalsContact CD2-O 3.22Å; L53-L67 WeakPolarHBondContact CD2-O 3.26Å; L53-L67 HydrophobicContact CG-CD2 4.23Å; L53-F71 HydrophobicContact CB-CD2 4.31Å; L53-F71 HydrophobicContact CD2-CB 4.14Å; L53-F71 HydrophobicContact CD2-CD2 4.35Å; L53-F87 HydrophobicContact CD1-CE2 4.02Å
54Q71.2Confident70.6Confident75 Ų7568.7 Ų68.735%0.3539%0.392SS..Hα-helixtrans-65.8-27.4173.1-72.9173.56.900112.2R50 Q51 L56 Q57 E68R50-Q54 VanDerWaalsContact O-CG 3.27Å; R50-Q54 WeakPolarHBondContact O-CG 3.29Å; R50-Q54 PolarHBondContact O-N 2.9Å; Q51-Q54 PolarHBondContact O-N 2.88Å; Q54-L56 PolarHBondContact O-N 3.3Å; Q54-Q57 WeakPolarHBondContact O-CB 3.37Å; Q54-Q57 PolarHBondContact O-N 3.03Å; Q54-Q57 VanDerWaalsContact O-N 3.15Å; Q54-E68 PolarHBondContact NE2-OE2 3.12Å
55G71.1Confident70.9Confident41 Ų4170.8 Ų70.842%0.42339%0.387SS..G310 helixtrans-64.1-14.2174.500000114.9Q51 D52 L53 Q57Q51-G55 PolarHBondContact O-N 2.73Å; D52-G55 PolarHBondContact O-N 3.39Å; L53-G55 PolarHBondContact O-N 3.21Å; G55-Q57 VanDerWaalsContact C-N 3.32Å
56L66Low71Confident24 Ų2471 Ų7113%0.12639%0.39CS..G310 helixtrans-87.8-0.1176.6-63.3156.9000113.2C40 L53 Q54 S58 D59 L60C40-L56 HydrophobicContact CB-CD1 4.02Å; C40-L56 WeakPolarHBondContact SG-CD1 3.37Å; L53-L56 WeakPolarHBondContact O-CB 3.44Å; L53-L56 PolarHBondContact O-N 3.09Å; Q54-L56 PolarHBondContact O-N 3.3Å; L56-S58 PolarHBondContact O-N 3.48Å; L56-S58 VanDerWaalsContact O-N 3.12Å; L56-D59 PolarHBondContact O-N 2.96Å; L56-L60 PolarHBondContact O-N 3.08Å
57Q63.6Low71.2Confident103 Ų10369.3 Ų69.348%0.48137%0.37SS..G310 helixtrans-58.4-22.8177.2-171.3-176.514.900112.9Q54 G55 L67Q54-Q57 WeakPolarHBondContact O-CB 3.37Å; Q54-Q57 PolarHBondContact O-N 3.03Å; Q54-Q57 VanDerWaalsContact O-N 3.15Å; G55-Q57 VanDerWaalsContact C-N 3.32Å; Q57-L67 HydrophobicContact CB-CD1 4.35Å
58S61.5Low71.1Confident94 Ų9467.6 Ų67.666%0.65736%0.363SS*.G310 helixtrans-75.9-25.9174.460.50000113.7L56L56-S58 PolarHBondContact O-N 3.48Å; L56-S58 VanDerWaalsContact O-N 3.12Å
59D64.8Low71.1Confident115 Ų11570.3 Ų70.362%0.61539%0.385SS*.THydrogen-bonded Turntrans-110.9-15.8-165.8-58.7-10.6000111.9L56L56-D59 PolarHBondContact O-N 2.96Å
60L63.1Low70.8Confident81 Ų8171.9 Ų71.942%0.42440%0.395SS..SBendtrans-127.4135179.6-144.473.7000111L56 L62L56-L60 PolarHBondContact O-N 3.08Å; L60-L62 HydrophobicContact CD2-CD1 3.69Å; L60-L62 HydrophobicContact CD2-CG 4.19Å; L60-L62 PolarHBondContact O-N 3.25Å
61P60.3Low70.7Confident130 Ų13067.1 Ų67.184%0.84438%0.377SS*.  trans-78.759.9-177.933.7-37.5000112.3
62L64.6Low71.1Confident62 Ų6264.9 Ų64.933%0.32537%0.366SS..  trans-123.2144.9176.7-64.9-179.5000111L60 L67L60-L62 HydrophobicContact CD2-CD1 3.69Å; L60-L62 HydrophobicContact CD2-CG 4.19Å; L60-L62 PolarHBondContact O-N 3.25Å; L62-L67 HydrophobicContact CB-CD1 4.45Å; L62-L67 HydrophobicContact CB-CD2 4.44Å; L62-L67 HydrophobicContact CB-CG 4.05Å; L62-L67 HydrophobicContact CD1-CD2 4.07Å; L62-L67 HydrophobicContact CD1-CG 4.48Å
63T75.3Confident71.2Confident62 Ų6265.1 Ų65.138%0.3837%0.371SS..  trans-75.8154.1175.1810000110.2E65 Q66 L67T63-E65 VanDerWaalsContact CB-OE2 3.23Å; T63-E65 WeakPolarHBondContact CB-OE2 3.5Å; T63-E65 PolarHBondContact O-N 3.05Å; T63-E65 PolarHBondContact OG1-OE2 2.92Å; T63-Q66 WeakPolarHBondContact O-CB 3.48Å; T63-Q66 PolarHBondContact O-N 2.86Å; T63-Q66 WeakPolarHBondContact OG1-CG 3.44Å; T63-Q66 PolarHBondContact OG1-N 3.41Å; T63-L67 PolarHBondContact O-N 3.44Å
64P70.6Confident71.3Confident41 Ų4165.1 Ų65.127%0.26637%0.371SS..Hα-helixtrans-63.2-28.9-176.925.4-31000111.7Q66 L67 E68P64-Q66 VanDerWaalsContact C-N 3.35Å; P64-L67 PolarHBondContact O-N 2.96Å; P64-E68 PolarHBondContact O-N 3.49Å
65E73.7Confident71.7Confident132 Ų13261.7 Ų61.762%0.61736%0.355SS*.Hα-helixtrans-69-33174.2-52.878-166.800112.3T63 A69T63-E65 VanDerWaalsContact CB-OE2 3.23Å; T63-E65 WeakPolarHBondContact CB-OE2 3.5Å; T63-E65 PolarHBondContact O-N 3.05Å; T63-E65 PolarHBondContact OG1-OE2 2.92Å; E65-A69 WeakPolarHBondContact O-CB 3.19Å; E65-A69 PolarHBondContact O-N 3.33Å; E65-A69 VanDerWaalsContact O-N 3.07Å
66Q73.4Confident71.8Confident96 Ų9666.3 Ų66.345%0.44937%0.365SS..Hα-helixtrans-73.4-38.2175.6-69.4170.6-22.500111.4T63 P64 E68 A69 V70T63-Q66 WeakPolarHBondContact O-CB 3.48Å; T63-Q66 PolarHBondContact O-N 2.86Å; T63-Q66 WeakPolarHBondContact OG1-CG 3.44Å; T63-Q66 PolarHBondContact OG1-N 3.41Å; P64-Q66 VanDerWaalsContact C-N 3.35Å; Q66-E68 VanDerWaalsContact C-N 3.34Å; Q66-A69 PolarHBondContact O-N 3.38Å; Q66-V70 VanDerWaalsContact O-CG2 3.27Å; Q66-V70 WeakPolarHBondContact O-CG2 3.19Å; Q66-V70 PolarHBondContact O-N 3.07Å
67L72.7Confident72Confident7 Ų767.9 Ų67.94%0.03738%0.382CS..Hα-helixtrans-64.7-39.2174.1-78166.7000111.6L53 Q57 L62 T63 P64 V70 F71L53-L67 HydrophobicContact CD2-CB 3.97Å; L53-L67 HydrophobicContact CD2-CD2 3.77Å; L53-L67 HydrophobicContact CD2-CG 4.49Å; L53-L67 VanDerWaalsContact CD2-O 3.22Å; L53-L67 WeakPolarHBondContact CD2-O 3.26Å; L53-L67 HydrophobicContact CG-CD2 4.23Å; Q57-L67 HydrophobicContact CB-CD1 4.35Å; L62-L67 HydrophobicContact CB-CD1 4.45Å; L62-L67 HydrophobicContact CB-CD2 4.44Å; L62-L67 HydrophobicContact CB-CG 4.05Å; L62-L67 HydrophobicContact CD1-CD2 4.07Å; L62-L67 HydrophobicContact CD1-CG 4.48Å; T63-L67 PolarHBondContact O-N 3.44Å; P64-L67 PolarHBondContact O-N 2.96Å; L67-V70 PolarHBondContact O-N 3.21Å; L67-F71 WeakPolarHBondContact O-CB 3.4Å; L67-F71 PolarHBondContact O-N 3.39Å
68E77.5Confident72.3Confident40 Ų4070.5 Ų70.519%0.18739%0.394CS..Hα-helixtrans-64.1-44.1173.9-161.870.6-15600111.6R50 Q54 P64 Q66 V70 F71 E72R50-E68 VanDerWaalsContact CD-OE1 3.26Å; R50-E68 WeakPolarHBondContact CD-OE1 3.4Å; R50-E68 IonicContact CZ-OE1 3.31Å; R50-E68 IonicContact NE-OE1 3.4Å; R50-E68 IonicContact NH1-OE1 3.65Å; R50-E68 PolarHBondContact NH1-OE1 3.35Å; Q54-E68 PolarHBondContact NE2-OE2 3.12Å; P64-E68 PolarHBondContact O-N 3.49Å; Q66-E68 VanDerWaalsContact C-N 3.34Å; E68-V70 VanDerWaalsContact C-N 3.32Å; E68-V70 PolarHBondContact O-N 3.2Å; E68-F71 WeakPolarHBondContact O-CB 3.47Å; E68-F71 PolarHBondContact O-N 2.92Å; E68-E72 WeakPolarHBondContact O-CG 3.25Å; E68-E72 PolarHBondContact O-N 3.02Å
69A77.1Confident72.9Confident56 Ų5669.7 Ų69.746%0.46339%0.385SS..Hα-helixtrans-63.1-37.9176.100000112.5E65 Q66 S73E65-A69 WeakPolarHBondContact O-CB 3.19Å; E65-A69 PolarHBondContact O-N 3.33Å; E65-A69 VanDerWaalsContact O-N 3.07Å; Q66-A69 PolarHBondContact O-N 3.38Å; A69-S73 WeakPolarHBondContact O-CB 3.22Å; A69-S73 PolarHBondContact O-N 3.27Å; A69-S73 VanDerWaalsContact O-N 3.09Å; A69-S73 PolarHBondContact O-OG 3.02Å
70V75.6Confident73.2Confident54 Ų5465.2 Ų65.233%0.32737%0.366SS..Hα-helixtrans-64.6-45.1172.9170.70000110.1Q66 L67 E68 E72 S73 L74Q66-V70 VanDerWaalsContact O-CG2 3.27Å; Q66-V70 WeakPolarHBondContact O-CG2 3.19Å; Q66-V70 PolarHBondContact O-N 3.07Å; L67-V70 PolarHBondContact O-N 3.21Å; E68-V70 VanDerWaalsContact C-N 3.32Å; E68-V70 PolarHBondContact O-N 3.2Å; V70-E72 PolarHBondContact O-N 3.12Å; V70-S73 PolarHBondContact O-N 3.18Å; V70-S73 PolarHBondContact O-OG 3.45Å; V70-L74 HydrophobicContact CG1-CD1 3.72Å; V70-L74 HydrophobicContact CG1-CG 4.31Å; V70-L74 VanDerWaalsContact O-CG 3.27Å; V70-L74 WeakPolarHBondContact O-CG 3.27Å; V70-L74 PolarHBondContact O-N 3.15Å
71F77.9Confident74Confident0 Ų066.1 Ų66.10%037%0.367CS..Hα-helixtrans-58.4-49.4177.2-167.9-84.5000112.1I48 R50 L53 L67 E68 S73 L74 D75 L82I48-F71 WeakPolarHBondContact O-CE2 3.34Å; R50-F71 HydrophobicContact CG-CD1 3.67Å; R50-F71 HydrophobicContact CG-CD2 4.32Å; R50-F71 HydrophobicContact CG-CE1 3.53Å; R50-F71 HydrophobicContact CG-CE2 4.18Å; R50-F71 HydrophobicContact CG-CG 4.08Å; R50-F71 HydrophobicContact CG-CZ 3.79Å; L53-F71 HydrophobicContact CB-CD2 4.31Å; L53-F71 HydrophobicContact CD2-CB 4.14Å; L53-F71 HydrophobicContact CD2-CD2 4.35Å; L67-F71 WeakPolarHBondContact O-CB 3.4Å; L67-F71 PolarHBondContact O-N 3.39Å; E68-F71 WeakPolarHBondContact O-CB 3.47Å; E68-F71 PolarHBondContact O-N 2.92Å; F71-S73 PolarHBondContact O-N 2.9Å; F71-L74 PolarHBondContact O-N 3.18Å; F71-D75 HydrophobicContact CD1-CB 4.31Å; F71-D75 HydrophobicContact CE1-CB 4.09Å; F71-D75 WeakPolarHBondContact O-CB 3.31Å; F71-D75 PolarHBondContact O-N 3.15Å; F71-L82 HydrophobicContact CD2-CD1 3.47Å; F71-L82 VanDerWaalsContact CD2-CD1 3.47Å; F71-L82 HydrophobicContact CD2-CG 4.11Å; F71-L82 HydrophobicContact CE1-CG 4.48Å; F71-L82 HydrophobicContact CE2-CB 4.39Å; F71-L82 HydrophobicContact CE2-CD1 3.52Å; F71-L82 HydrophobicContact CE2-CG 3.67Å; F71-L82 HydrophobicContact CG-CD1 4.11Å; F71-L82 HydrophobicContact CZ-CD1 4.18Å; F71-L82 HydrophobicContact CZ-CG 3.88Å
72E81.3Confident74.8Confident109 Ų10959.9 Ų59.951%0.50933%0.326SS..Hα-helixtrans-61.6-33.1178.3-72.2-174.1163.400112.6E68 V70E68-E72 WeakPolarHBondContact O-CG 3.25Å; E68-E72 PolarHBondContact O-N 3.02Å; V70-E72 PolarHBondContact O-N 3.12Å
73S78.8Confident75.5Confident38 Ų3859.7 Ų59.727%0.26633%0.328SS..Hα-helixtrans-76.4-27.2178.677.40000114.2A69 V70 F71 F94A69-S73 WeakPolarHBondContact O-CB 3.22Å; A69-S73 PolarHBondContact O-N 3.27Å; A69-S73 VanDerWaalsContact O-N 3.09Å; A69-S73 PolarHBondContact O-OG 3.02Å; V70-S73 PolarHBondContact O-N 3.18Å; V70-S73 PolarHBondContact O-OG 3.45Å; F71-S73 PolarHBondContact O-N 2.9Å; S73-F94 VanDerWaalsContact CB-CZ 3.45Å; S73-F94 VanDerWaalsContact OG-CE2 3.23Å; S73-F94 WeakPolarHBondContact OG-CE2 3.47Å; S73-F94 WeakPolarHBondContact OG-CZ 3.38Å
74L77.5Confident75.3Confident7 Ų758.7 Ų58.74%0.03733%0.326CS..Hα-helixtrans-84.3-32.5175.4-65.2173.2000111.1V70 F71 Q76 L82 F87 L91 F94V70-L74 HydrophobicContact CG1-CD1 3.72Å; V70-L74 HydrophobicContact CG1-CG 4.31Å; V70-L74 VanDerWaalsContact O-CG 3.27Å; V70-L74 WeakPolarHBondContact O-CG 3.27Å; V70-L74 PolarHBondContact O-N 3.15Å; F71-L74 PolarHBondContact O-N 3.18Å; L74-Q76 VanDerWaalsContact C-N 3.27Å; L74-Q76 PolarHBondContact O-N 2.83Å; L74-L82 VanDerWaalsContact C-CD2 3.44Å; L74-L82 HydrophobicContact CB-CD1 3.81Å; L74-L82 HydrophobicContact CB-CD2 3.73Å; L74-L82 HydrophobicContact CB-CG 4.46Å; L74-L82 HydrophobicContact CD1-CD1 4.13Å; L74-F87 HydrophobicContact CD1-CD2 3.99Å; L74-F87 HydrophobicContact CD1-CE2 4.2Å; L74-L91 HydrophobicContact CD1-CD1 3.86Å; L74-L91 HydrophobicContact CD2-CD1 4.46Å; L74-F94 HydrophobicContact CD2-CD2 4.05Å; L74-F94 HydrophobicContact CD2-CE2 4.35Å
75D80.3Confident75.3Confident3 Ų366 Ų662%0.01635%0.348CS..  trans-85.963.6-179.8-173.113.1000111F71 A77 H78 T79 G80 L82F71-D75 HydrophobicContact CD1-CB 4.31Å; F71-D75 HydrophobicContact CE1-CB 4.09Å; F71-D75 WeakPolarHBondContact O-CB 3.31Å; F71-D75 PolarHBondContact O-N 3.15Å; D75-A77 PolarHBondContact O-N 3.33Å; D75-A77 VanDerWaalsContact O-N 3.15Å; D75-H78 PolarHBondContact O-N 3Å; D75-H78 PolarHBondContact O-ND1 3.43Å; D75-H78 WeakPolarHBondContact OD1-CA 3.45Å; D75-H78 PolarHBondContact OD1-N 3.41Å; D75-H78 WeakPolarHBondContact OD2-CA 3.42Å; D75-T79 PolarHBondContact OD1-N 3.41Å; D75-T79 PolarHBondContact OD1-OG1 3.06Å; D75-T79 PolarHBondContact OD2-N 3.05Å; D75-T79 VanDerWaalsContact OD2-N 3.15Å; D75-G80 WeakPolarHBondContact OD2-CA 3.5Å; D75-G80 PolarHBondContact OD2-N 3.15Å; D75-L82 HydrophobicContact CB-CD2 3.72Å; D75-L82 HydrophobicContact CB-CG 4.45Å
76Q71.8Confident75.5Confident138 Ų13862.9 Ų62.965%0.64533%0.333SS*.THydrogen-bonded Turntrans-62.5-18.9177.3-62.3-176.96.600112.8L74L74-Q76 VanDerWaalsContact C-N 3.27Å; L74-Q76 PolarHBondContact O-N 2.83Å
77A70Confident75.6Confident58 Ų5858.7 Ų58.748%0.47931%0.314SS..THydrogen-bonded Turntrans-90.6-5178.300000112.9D75 T79D75-A77 PolarHBondContact O-N 3.33Å; D75-A77 VanDerWaalsContact O-N 3.15Å; A77-T79 HydrophobicContact CB-CG2 3.65Å; A77-T79 PolarHBondContact O-N 3.08Å; A77-T79 VanDerWaalsContact O-N 3.16Å
78H69.8Low75.5Confident158 Ų15858.9 Ų58.973%0.73132%0.316SS*.  trans4836.7-175.8-58.1-49.4000113.2D75 G80D75-H78 PolarHBondContact O-N 3Å; D75-H78 PolarHBondContact O-ND1 3.43Å; D75-H78 WeakPolarHBondContact OD1-CA 3.45Å; D75-H78 PolarHBondContact OD1-N 3.41Å; D75-H78 WeakPolarHBondContact OD2-CA 3.42Å; H78-G80 VanDerWaalsContact C-N 3.29Å
79T74.1Confident75.3Confident76 Ų7661.3 Ų61.347%0.46633%0.329SS..  trans-81.4-13.7-176.454.50000111.9D75 A77 F81D75-T79 PolarHBondContact OD1-N 3.41Å; D75-T79 PolarHBondContact OD1-OG1 3.06Å; D75-T79 PolarHBondContact OD2-N 3.05Å; D75-T79 VanDerWaalsContact OD2-N 3.15Å; A77-T79 HydrophobicContact CB-CG2 3.65Å; A77-T79 PolarHBondContact O-N 3.08Å; A77-T79 VanDerWaalsContact O-N 3.16Å; T79-F81 WeakPolarHBondContact O-CD2 3.44Å; T79-F81 PolarHBondContact O-N 2.91Å; T79-F81 PolarHBondContact OG1-O 3.2Å
80G72.3Confident75.1Confident21 Ų2159 Ų5922%0.21631%0.31CS..SBendtrans80.61-177.100000113.9D75 H78D75-G80 WeakPolarHBondContact OD2-CA 3.5Å; D75-G80 PolarHBondContact OD2-N 3.15Å; H78-G80 VanDerWaalsContact C-N 3.29Å
81F79Confident74.9Confident100 Ų10058.2 Ų58.244%0.43930%0.304SS..EExtended strand (participates in β ladder)trans-146131.1-178.9-52.8-67000110.5F47 I48 T49 T79F47-F81 HydrophobicContact CB-CB 4.34Å; F47-F81 HydrophobicContact CD2-CB 3.96Å; F47-F81 AromaticContact CD2-CD1 3.84Å; F47-F81 HydrophobicContact CD2-CD1 3.84Å; F47-F81 HydrophobicContact CD2-CG 4.01Å; F47-F81 AromaticContact CE2-CD1 3.99Å; F47-F81 HydrophobicContact CE2-CD1 3.99Å; F47-F81 HydrophobicContact CE2-CE1 4.34Å; F47-F81 HydrophobicContact CE2-CG 4.37Å; F47-F81 HydrophobicContact CG-CB 4.45Å; I48-F81 WeakPolarHBondContact O-CA 3.44Å; T49-F81 HydrophobicContact CG2-CD1 3.35Å; T49-F81 HydrophobicContact CG2-CE1 3.39Å; T79-F81 WeakPolarHBondContact O-CD2 3.44Å; T79-F81 PolarHBondContact O-N 2.91Å; T79-F81 PolarHBondContact OG1-O 3.2Å
82L77.5Confident74.4Confident0 Ų058.8 Ų58.80%031%0.31CS..EExtended strand (participates in β ladder)trans-95.1120179.6-68.9171.2000110.7F47 I48 F71 L74 D75 F87F47-L82 CarbonylContact C-O 3.54Å; F47-L82 VanDerWaalsContact CA-O 3.32Å; F47-L82 WeakPolarHBondContact CA-O 3.33Å; I48-L82 HydrophobicContact CB-CB 4.32Å; I48-L82 PolarHBondContact N-O 3.27Å; I48-L82 PolarHBondContact O-N 2.99Å; F71-L82 HydrophobicContact CD2-CD1 3.47Å; F71-L82 VanDerWaalsContact CD2-CD1 3.47Å; F71-L82 HydrophobicContact CD2-CG 4.11Å; F71-L82 HydrophobicContact CE1-CG 4.48Å; F71-L82 HydrophobicContact CE2-CB 4.39Å; F71-L82 HydrophobicContact CE2-CD1 3.52Å; F71-L82 HydrophobicContact CE2-CG 3.67Å; F71-L82 HydrophobicContact CG-CD1 4.11Å; F71-L82 HydrophobicContact CZ-CD1 4.18Å; F71-L82 HydrophobicContact CZ-CG 3.88Å; L74-L82 VanDerWaalsContact C-CD2 3.44Å; L74-L82 HydrophobicContact CB-CD1 3.81Å; L74-L82 HydrophobicContact CB-CD2 3.73Å; L74-L82 HydrophobicContact CB-CG 4.46Å; L74-L82 HydrophobicContact CD1-CD1 4.13Å; D75-L82 HydrophobicContact CB-CD2 3.72Å; D75-L82 HydrophobicContact CB-CG 4.45Å; L82-F87 HydrophobicContact CD1-CD2 4.3Å
83T78.6Confident73.8Confident58 Ų5860 Ų6036%0.35631%0.314SS..EExtended strand (participates in β ladder)trans-75.4157.2171.2630000111.2R85 E86 F87T83-R85 PolarHBondContact O-N 3.44Å; T83-R85 VanDerWaalsContact O-N 3.08Å; T83-E86 WeakPolarHBondContact CB-OE2 3.33Å; T83-E86 PolarHBondContact N-OE2 3.2Å; T83-E86 PolarHBondContact O-N 3.3Å; T83-E86 VanDerWaalsContact OG1-CG 3.31Å; T83-E86 WeakPolarHBondContact OG1-CG 3.26Å; T83-E86 PolarHBondContact OG1-N 3.46Å; T83-E86 PolarHBondContact OG1-OE2 2.95Å; T83-F87 PolarHBondContact O-N 3.3Å
84A71.5Confident72.9Confident40 Ų4064.3 Ų64.333%0.33133%0.328SS..Hα-helixtrans-51.3-37.4178.900000113.4F37 C88F37-A84 HydrophobicContact CD1-CB 3.88Å; F37-A84 HydrophobicContact CD2-CB 4.12Å; F37-A84 HydrophobicContact CE1-CB 3.56Å; F37-A84 HydrophobicContact CE2-CB 3.83Å; F37-A84 VanDerWaalsContact CE2-N 3.3Å; F37-A84 HydrophobicContact CG-CB 4.16Å; F37-A84 VanDerWaalsContact CZ-CA 3.48Å; F37-A84 HydrophobicContact CZ-CB 3.54Å; A84-C88 WeakPolarHBondContact O-CB 2.9Å; A84-C88 PolarHBondContact O-N 2.94Å; A84-C88 VanDerWaalsContact O-N 3.07Å; A84-C88 PolarHBondContact O-SG 2.92Å
85R70.6Confident72.2Confident194 Ų19468.1 Ų68.173%0.73235%0.351SS*.Hα-helixtrans-71-42.4179.4-173.8174.8178.9-144.40.2112T83 L89T83-R85 PolarHBondContact O-N 3.44Å; T83-R85 VanDerWaalsContact O-N 3.08Å; R85-L89 HydrophobicContact CG-CD1 3.66Å; R85-L89 HydrophobicContact CG-CG 4.4Å; R85-L89 VanDerWaalsContact O-CB 3.22Å; R85-L89 WeakPolarHBondContact O-CB 3.27Å; R85-L89 WeakPolarHBondContact O-CD1 3.21Å; R85-L89 WeakPolarHBondContact O-CG 3.35Å; R85-L89 PolarHBondContact O-N 2.87Å
86E77.6Confident70.7Confident67 Ų6770.7 Ų70.731%0.31338%0.379SS..Hα-helixtrans-68.2-41.5178.4-71.3160.7160.900111.3T83 G90T83-E86 WeakPolarHBondContact CB-OE2 3.33Å; T83-E86 PolarHBondContact N-OE2 3.2Å; T83-E86 PolarHBondContact O-N 3.3Å; T83-E86 VanDerWaalsContact OG1-CG 3.31Å; T83-E86 WeakPolarHBondContact OG1-CG 3.26Å; T83-E86 PolarHBondContact OG1-N 3.46Å; T83-E86 PolarHBondContact OG1-OE2 2.95Å; E86-G90 WeakPolarHBondContact O-CA 3.38Å; E86-G90 PolarHBondContact O-N 3.19Å
87F76.3Confident69.7Low9 Ų966.7 Ų66.74%0.03936%0.363CS..Hα-helixtrans-61.6-51176.1-173.7-99.3000111.8A33 L36 F37 I48 L53 L74 L82 T83 G90 L91A33-F87 WeakPolarHBondContact O-CE1 3.44Å; L36-F87 HydrophobicContact CB-CE1 4.17Å; L36-F87 HydrophobicContact CB-CZ 4.44Å; F37-F87 HydrophobicContact CB-CD1 3.84Å; F37-F87 HydrophobicContact CB-CE1 4.08Å; F37-F87 HydrophobicContact CD2-CB 3.81Å; F37-F87 AromaticContact CD2-CD1 3.87Å; F37-F87 HydrophobicContact CD2-CD1 3.87Å; F37-F87 AromaticContact CD2-CG 3.92Å; F37-F87 HydrophobicContact CD2-CG 3.92Å; F37-F87 HydrophobicContact CE2-CB 4.32Å; F37-F87 HydrophobicContact CG-CD1 4.36Å; I48-F87 HydrophobicContact CD1-CD1 4.48Å; I48-F87 HydrophobicContact CD1-CD2 3.87Å; I48-F87 HydrophobicContact CD1-CE2 4.04Å; I48-F87 HydrophobicContact CD1-CG 4.1Å; I48-F87 HydrophobicContact CD1-CZ 4.4Å; L53-F87 HydrophobicContact CD1-CE2 4.02Å; L74-F87 HydrophobicContact CD1-CD2 3.99Å; L74-F87 HydrophobicContact CD1-CE2 4.2Å; L82-F87 HydrophobicContact CD1-CD2 4.3Å; T83-F87 PolarHBondContact O-N 3.3Å; F87-G90 PolarHBondContact O-N 3.09Å; F87-L91 HydrophobicContact CD1-CD1 3.8Å; F87-L91 HydrophobicContact CD2-CD1 3.67Å; F87-L91 HydrophobicContact CE1-CD1 3.53Å; F87-L91 HydrophobicContact CE2-CD1 3.38Å; F87-L91 HydrophobicContact CG-CD1 3.88Å; F87-L91 HydrophobicContact CZ-CD1 3.32Å; F87-L91 WeakPolarHBondContact O-CB 3.43Å; F87-L91 WeakPolarHBondContact O-CD1 3.5Å; F87-L91 PolarHBondContact O-N 3.05Å
88C71.8Confident68.4Low11 Ų1172 Ų727%0.07438%0.378CS..Hα-helixtrans-67.8-40-178.4-63.90000112.8Q34 A84 G92Q34-C88 VanDerWaalsContact CG-SG 3.51Å; A84-C88 WeakPolarHBondContact O-CB 2.9Å; A84-C88 PolarHBondContact O-N 2.94Å; A84-C88 VanDerWaalsContact O-N 3.07Å; A84-C88 PolarHBondContact O-SG 2.92Å; C88-G92 PolarHBondContact O-N 2.68Å
89L73.1Confident67.2Low91 Ų9169.3 Ų69.348%0.47638%0.377SS..Hα-helixtrans-71.7-37.4177.9-71.8171.8000112R85 K93R85-L89 HydrophobicContact CG-CD1 3.66Å; R85-L89 HydrophobicContact CG-CG 4.4Å; R85-L89 VanDerWaalsContact O-CB 3.22Å; R85-L89 WeakPolarHBondContact O-CB 3.27Å; R85-L89 WeakPolarHBondContact O-CD1 3.21Å; R85-L89 WeakPolarHBondContact O-CG 3.35Å; R85-L89 PolarHBondContact O-N 2.87Å; L89-K93 WeakPolarHBondContact O-CG 3.34Å; L89-K93 PolarHBondContact O-N 3.04Å
90G73.1Confident65.6Low6 Ų670.6 Ų70.66%0.06240%0.395CS..Hα-helixtrans-69.4-48.1177.900000111.7E86 F87 G92 K93 F94E86-G90 WeakPolarHBondContact O-CA 3.38Å; E86-G90 PolarHBondContact O-N 3.19Å; F87-G90 PolarHBondContact O-N 3.09Å; G90-G92 VanDerWaalsContact C-N 3.31Å; G90-G92 PolarHBondContact O-N 3.35Å; G90-K93 WeakPolarHBondContact O-CB 3.22Å; G90-K93 PolarHBondContact O-N 3.15Å; G90-K93 VanDerWaalsContact O-N 3.08Å; G90-F94 WeakPolarHBondContact O-CD2 3.45Å; G90-F94 PolarHBondContact O-N 3.17Å
91L70.9Confident63.9Low39 Ų3977.8 Ų77.820%0.20442%0.423CS..Hα-helixtrans-62.1-37.7174.7-98.1113.5000112.4A33 L74 F87 K93 F94 V95A33-L91 HydrophobicContact CB-CB 4.44Å; L74-L91 HydrophobicContact CD1-CD1 3.86Å; L74-L91 HydrophobicContact CD2-CD1 4.46Å; F87-L91 HydrophobicContact CD1-CD1 3.8Å; F87-L91 HydrophobicContact CD2-CD1 3.67Å; F87-L91 HydrophobicContact CE1-CD1 3.53Å; F87-L91 HydrophobicContact CE2-CD1 3.38Å; F87-L91 HydrophobicContact CG-CD1 3.88Å; F87-L91 HydrophobicContact CZ-CD1 3.32Å; F87-L91 WeakPolarHBondContact O-CB 3.43Å; F87-L91 WeakPolarHBondContact O-CD1 3.5Å; F87-L91 PolarHBondContact O-N 3.05Å; L91-K93 PolarHBondContact O-N 3.32Å; L91-F94 PolarHBondContact O-N 3.29Å; L91-F94 VanDerWaalsContact O-N 3.1Å; L91-V95 VanDerWaalsContact O-CG2 3.32Å; L91-V95 WeakPolarHBondContact O-CG2 3.45Å; L91-V95 PolarHBondContact O-N 3.42Å
92G67.9Low61.7Low11 Ų1176.8 Ų76.811%0.11344%0.441CS..Hα-helixtrans-58.7-33.4174.300000113.2C88 G90 V97C88-G92 PolarHBondContact O-N 2.68Å; G90-G92 VanDerWaalsContact C-N 3.31Å; G90-G92 PolarHBondContact O-N 3.35Å; G92-V97 WeakPolarHBondContact O-CB 3.34Å; G92-V97 PolarHBondContact O-N 3.11Å
93K66.8Low59.5Low135 Ų13580.6 Ų80.659%0.58748%0.481SS*.Hα-helixtrans-74.9-38.4173.6-67.6171.8-175.7179.50112.2L89 G90 L91 G96L89-K93 WeakPolarHBondContact O-CG 3.34Å; L89-K93 PolarHBondContact O-N 3.04Å; G90-K93 WeakPolarHBondContact O-CB 3.22Å; G90-K93 PolarHBondContact O-N 3.15Å; G90-K93 VanDerWaalsContact O-N 3.08Å; L91-K93 PolarHBondContact O-N 3.32Å; K93-G96 PolarHBondContact O-N 3.06Å
94F60.7Low57.1Low129 Ų12982.8 Ų82.857%0.56650%0.499SS*.Hα-helixtrans-71.8-30.1179.5-90.1-80.6000114.1S73 L74 G90 L91 G96S73-F94 VanDerWaalsContact CB-CZ 3.45Å; S73-F94 VanDerWaalsContact OG-CE2 3.23Å; S73-F94 WeakPolarHBondContact OG-CE2 3.47Å; S73-F94 WeakPolarHBondContact OG-CZ 3.38Å; L74-F94 HydrophobicContact CD2-CD2 4.05Å; L74-F94 HydrophobicContact CD2-CE2 4.35Å; G90-F94 WeakPolarHBondContact O-CD2 3.45Å; G90-F94 PolarHBondContact O-N 3.17Å; L91-F94 PolarHBondContact O-N 3.29Å; L91-F94 VanDerWaalsContact O-N 3.1Å; F94-G96 PolarHBondContact O-N 3.45Å
95V62.3Low55.2Low86 Ų8686.1 Ų86.152%0.52152%0.519SS..THydrogen-bonded Turntrans-81.96.3177.9-179.90000112V29 L91V29-V95 HydrophobicContact CG1-CB 4.2Å; V29-V95 HydrophobicContact CG1-CG1 3.9Å; V29-V95 HydrophobicContact CG2-CG1 4.44Å; L91-V95 VanDerWaalsContact O-CG2 3.32Å; L91-V95 WeakPolarHBondContact O-CG2 3.45Å; L91-V95 PolarHBondContact O-N 3.42Å
96G49.9Very low53.4Low58 Ų5883.2 Ų83.260%0.59852%0.517SS*.THydrogen-bonded Turntrans82.527.1171.100000114.6K93 F94 E98K93-G96 PolarHBondContact O-N 3.06Å; F94-G96 PolarHBondContact O-N 3.45Å; G96-E98 VanDerWaalsContact C-N 3.26Å; G96-E98 PolarHBondContact O-N 2.91Å; G96-E98 VanDerWaalsContact O-N 3.08Å
97V50.7Low51.2Low53 Ų5390.9 Ų90.932%0.32154%0.544SS..  trans-83.974.6169.4-168.70000108.9R26 G92 S99R26-V97 HydrophobicContact CG-CG1 3.87Å; G92-V97 WeakPolarHBondContact O-CB 3.34Å; G92-V97 PolarHBondContact O-N 3.11Å; V97-S99 PolarHBondContact O-N 3.09Å
98E43.3Very low49.3Very low170 Ų17097.1 Ų97.179%0.79458%0.583SS**  trans-62.6127.3171.3-71.6-172.8160.200110.2R26 G96 A100R26-E98 PolarHBondContact NH2-O 3.42Å; G96-E98 VanDerWaalsContact C-N 3.26Å; G96-E98 PolarHBondContact O-N 2.91Å; G96-E98 VanDerWaalsContact O-N 3.08Å; E98-A100 PolarHBondContact O-N 3.15Å
99S43.1Very low47.8Very low102 Ų102101.6 Ų101.671%0.71361%0.612SS**  trans-77.298.2170.5-169.90000108.6V97 Q101V97-S99 PolarHBondContact O-N 3.09Å; S99-Q101 VanDerWaalsContact C-N 3.26Å; S99-Q101 PolarHBondContact O-N 3.43Å
100A41.6Very low45.9Very low102 Ų102105.7 Ų105.784%0.84363%0.629SS**  trans-69.986.1163.400000109.3E98E98-A100 PolarHBondContact O-N 3.15Å
101Q35.5Very low44.5Very low172 Ų172114.5 Ų114.580%0.80467%0.668SS**  trans-137.2109.4157.3-150.715615.300107.1S99S99-Q101 VanDerWaalsContact C-N 3.26Å; S99-Q101 PolarHBondContact O-N 3.43Å
102G32.5Very low42.8Very low79 Ų79118.9 Ų118.981%0.81470%0.696SS**  trans-51.2149.6179.700000111.9
103G31.8Very low41.5Very low81 Ų81127.6 Ų127.684%0.83573%0.731SS**  cis90.183.149.900000109
104S28.5Very low40.1Very low104 Ų104130.1 Ų130.173%0.72775%0.746SS**  trans175.5113.6142.5-169.40000111.6
105S31.5Very low38.9Very low110 Ų110128 Ų12877%0.76975%0.747SS**  179.881.3128.6-1660000106.8
106L31.9Very low37.9Very low132 Ų132129.4 Ų129.469%0.69176%0.76SS**  55100.794.2-73.4152.9000111.5
107R32.3Very low37.3Very low228 Ų228132.9 Ų132.986%0.8677%0.77SS**  41.793.985.7-71.5-90.7-175.3171.5-0.3111P109R107-P109 WeakPolarHBondContact O-CD 3.32Å
108T36.4Very low36.6Very low140 Ų140134.1 Ų134.186%0.85979%0.793SS**  trans-64.1133.4154.7380000109.3
109P40.5Very low36.1Very low106 Ų106129.4 Ų129.469%0.68879%0.79SS**  -139.9135129.226.2-7.1000113.6R107R107-P109 WeakPolarHBondContact O-CD 3.32Å
110E32.1Very low35.7Very low177 Ų177127.4 Ų127.483%0.82778%0.777SS**  trans53.6115.8131.4-62.5-177.1152.600121.1
111E44.5Very low36Very low191 Ų191130 Ų13089%0.89378%0.775SS**  trans-3.8118.3136.6-56-176164.300115.9
112T35.2Very low36.7Very low130 Ų130127.8 Ų127.880%0.79877%0.765SS**  trans-137113.2152.4-580000109.1E114T112-E114 PolarHBondContact O-N 3.05Å
113F39.7Very low37.7Very low194 Ų194129.8 Ų129.885%0.85175%0.753SS**  trans-57.1118171.3-165.6-96000109.9
114E38.7Very low38.8Very low189 Ų189131.2 Ų131.288%0.88374%0.742SS**  trans-104120.3165.6-80.1-166.8167.700110.6T112T112-E114 PolarHBondContact O-N 3.05Å
115S35Very low40.4Very low84 Ų84131.4 Ų131.459%0.58773%0.734SS**  trans-66.3132.1-171.8-177.70000112.3T117S115-T117 PolarHBondContact O-N 3.05Å
116S42.3Very low42Very low115 Ų115128 Ų12880%0.80471%0.708SS**  trans-44.8118.8155.751.60000111.6
117T36.8Very low43.6Very low131 Ų131123.2 Ų123.280%0.80468%0.684SS**  trans-139.3113158.6-59.60000103.6S115S115-T117 PolarHBondContact O-N 3.05Å
118G36.1Very low45.7Very low79 Ų79119 Ų11981%0.81467%0.674SS**  cis109.976.435.600000108.5
119G31.5Very low47.6Very low71 Ų71115.3 Ų115.373%0.73265%0.651SS**  trans120.4105.8155.500000117.1
120S35.2Very low49.4Very low61 Ų61110.3 Ų110.343%0.42762%0.619SS.*  177.2118.4108.4-172.40000109.4E122 E123S120-E122 PolarHBondContact O-N 3.34Å; S120-E122 PolarHBondContact OG-N 3.49Å; S120-E123 PolarHBondContact O-N 3.04Å; S120-E123 VanDerWaalsContact O-N 3.08Å
121L47.9Very low51.7Low155 Ų155104.1 Ų104.181%0.81259%0.594SS**THydrogen-bonded Turntrans-63.4-4.6173.1-77.8157.5000113.1
122E51.2Low53.5Low126 Ų12697.8 Ų97.859%0.58957%0.569SS**Hα-helixtrans-83-20.3172.7-59.7-175.9168.300112.7S120 D126S120-E122 PolarHBondContact O-N 3.34Å; S120-E122 PolarHBondContact OG-N 3.49Å; E122-D126 WeakPolarHBondContact O-CB 3.47Å; E122-D126 PolarHBondContact O-N 3.31Å
123E52.2Low55.6Low122 Ų12293.1 Ų93.157%0.5754%0.542SS*.Hα-helixtrans-71.9-31.1-179.8-70.6-178.1173.400112.2S120 V127S120-E123 PolarHBondContact O-N 3.04Å; S120-E123 VanDerWaalsContact O-N 3.08Å; E123-V127 WeakPolarHBondContact O-CG2 3.43Å; E123-V127 PolarHBondContact O-N 2.97Å
124D55.2Low57.7Low110 Ų11084 Ų8459%0.58850%0.501SS*.Hα-helixtrans-73.1-43.3178.4-87-17.6000112.5D126 V127 E128D124-D126 VanDerWaalsContact C-N 3.32Å; D124-D126 PolarHBondContact O-N 3.21Å; D124-V127 WeakPolarHBondContact O-CB 3.4Å; D124-V127 PolarHBondContact O-N 3.14Å; D124-E128 PolarHBondContact O-N 2.92Å; D124-E128 VanDerWaalsContact O-N 3.09Å
125D61.3Low59.9Low108 Ų10881 Ų8158%0.57849%0.488SS*.Hα-helixtrans-63.8-38.1174.7-75.6-24.5000111.5V127 T129D125-V127 VanDerWaalsContact C-N 3.27Å; D125-V127 PolarHBondContact O-N 3.04Å; D125-T129 WeakPolarHBondContact O-CB 3.26Å; D125-T129 VanDerWaalsContact O-CG2 3.22Å; D125-T129 WeakPolarHBondContact O-CG2 3.47Å; D125-T129 PolarHBondContact O-N 3.49Å; D125-T129 VanDerWaalsContact O-N 3.11Å; D125-T129 PolarHBondContact O-OG1 3.3Å
126D65.7Low62.2Low40 Ų4085.3 Ų85.321%0.21450%0.496CS..Hα-helixtrans-68.4-23.2174.1-76.8-18.4000111.9E122 D124 T129 F130 V154 R158E122-D126 WeakPolarHBondContact O-CB 3.47Å; E122-D126 PolarHBondContact O-N 3.31Å; D124-D126 VanDerWaalsContact C-N 3.32Å; D124-D126 PolarHBondContact O-N 3.21Å; D126-T129 WeakPolarHBondContact CA-OG1 3.33Å; D126-T129 PolarHBondContact O-OG1 2.95Å; D126-F130 WeakPolarHBondContact O-CB 3.47Å; D126-F130 PolarHBondContact O-N 3.1Å; D126-V154 HydrophobicContact CB-CG2 4.45Å; D126-R158 IonicContact OD2-CZ 3.56Å; D126-R158 IonicContact OD2-NH2 2.9Å; D126-R158 PolarHBondContact OD2-NH2 2.83Å
127V66.8Low64.1Low30 Ų3081.5 Ų81.518%0.18247%0.466CS..Hα-helixtrans-75.5-50.6173.2-170.80000111.4E123 D124 D125 T129 F130 C131E123-V127 WeakPolarHBondContact O-CG2 3.43Å; E123-V127 PolarHBondContact O-N 2.97Å; D124-V127 WeakPolarHBondContact O-CB 3.4Å; D124-V127 PolarHBondContact O-N 3.14Å; D125-V127 VanDerWaalsContact C-N 3.27Å; D125-V127 PolarHBondContact O-N 3.04Å; V127-T129 VanDerWaalsContact C-N 3.31Å; V127-T129 PolarHBondContact O-N 3.38Å; V127-F130 PolarHBondContact O-N 3Å; V127-C131 WeakPolarHBondContact O-CB 3.49Å; V127-C131 PolarHBondContact O-N 2.86Å; V127-C131 PolarHBondContact O-SG 3.36Å; V127-C131 VanDerWaalsContact O-SG 3.33Å
128E74.6Confident66.2Low140 Ų14077.4 Ų77.465%0.65445%0.45SS*.Hα-helixtrans-65.3-39.1-176.3-70.6-167.216800111.1D124 T132D124-E128 PolarHBondContact O-N 2.92Å; D124-E128 VanDerWaalsContact O-N 3.09Å; E128-T132 WeakPolarHBondContact O-CB 3.47Å; E128-T132 VanDerWaalsContact O-CG2 3.23Å; E128-T132 WeakPolarHBondContact O-CG2 3.22Å; E128-T132 PolarHBondContact O-N 3.04Å; E128-T132 PolarHBondContact O-OG1 3.21Å
129T76.8Confident68.6Low62 Ų6273.7 Ų73.738%0.3841%0.411SS..Hα-helixtrans-66.5-37.2175.354.50000112.5D125 D126 V127 T132 S133D125-T129 WeakPolarHBondContact O-CB 3.26Å; D125-T129 VanDerWaalsContact O-CG2 3.22Å; D125-T129 WeakPolarHBondContact O-CG2 3.47Å; D125-T129 PolarHBondContact O-N 3.49Å; D125-T129 VanDerWaalsContact O-N 3.11Å; D125-T129 PolarHBondContact O-OG1 3.3Å; D126-T129 WeakPolarHBondContact CA-OG1 3.33Å; D126-T129 PolarHBondContact O-OG1 2.95Å; V127-T129 VanDerWaalsContact C-N 3.31Å; V127-T129 PolarHBondContact O-N 3.38Å; T129-T132 WeakPolarHBondContact CA-OG1 3.17Å; T129-T132 PolarHBondContact O-OG1 3.35Å; T129-T132 VanDerWaalsContact O-OG1 3.06Å; T129-S133 WeakPolarHBondContact O-CB 3.33Å; T129-S133 PolarHBondContact O-N 3.19Å; T129-S133 VanDerWaalsContact O-N 3.14Å; T129-S133 PolarHBondContact O-OG 3.5Å
130F79.4Confident71Confident2 Ų271.8 Ų71.81%0.00939%0.389CS..Hα-helixtrans-67.2-49.3173.6172.1-109.9000112.7D126 V127 T132 S133 L134 V149 R150 W153D126-F130 WeakPolarHBondContact O-CB 3.47Å; D126-F130 PolarHBondContact O-N 3.1Å; V127-F130 PolarHBondContact O-N 3Å; F130-T132 PolarHBondContact O-N 3.11Å; F130-S133 PolarHBondContact O-N 3.07Å; F130-S133 VanDerWaalsContact O-N 3.14Å; F130-L134 HydrophobicContact CD1-CD1 3.78Å; F130-L134 HydrophobicContact CD2-CD1 4.19Å; F130-L134 HydrophobicContact CD2-CG 4.27Å; F130-L134 HydrophobicContact CE1-CD1 3.2Å; F130-L134 HydrophobicContact CE1-CG 4.24Å; F130-L134 HydrophobicContact CE2-CD1 3.68Å; F130-L134 HydrophobicContact CE2-CD2 4.14Å; F130-L134 HydrophobicContact CE2-CG 3.86Å; F130-L134 HydrophobicContact CG-CD1 4.26Å; F130-L134 HydrophobicContact CZ-CD1 3.17Å; F130-L134 HydrophobicContact CZ-CD2 4.17Å; F130-L134 HydrophobicContact CZ-CG 3.87Å; F130-L134 PolarHBondContact O-N 3.1Å; F130-V149 HydrophobicContact CE2-CG1 4.25Å; F130-V149 HydrophobicContact CZ-CB 4.44Å; F130-V149 HydrophobicContact CZ-CG1 4.02Å; F130-R150 HydrophobicContact CD1-CB 3.98Å; F130-R150 HydrophobicContact CD1-CG 3.68Å; F130-R150 HydrophobicContact CE1-CB 3.43Å; F130-R150 VanDerWaalsContact CE1-CB 3.43Å; F130-R150 HydrophobicContact CE1-CG 3.69Å; F130-R150 HydrophobicContact CE2-CB 4.32Å; F130-R150 HydrophobicContact CG-CG 4.16Å; F130-R150 HydrophobicContact CZ-CB 3.6Å; F130-R150 HydrophobicContact CZ-CG 4.18Å; F130-W153 HydrophobicContact CD2-CB 3.68Å; F130-W153 AromaticContact CD2-CD1 3.55Å; F130-W153 AromaticContact CD2-CD2 3.95Å; F130-W153 HydrophobicContact CD2-CD2 3.95Å; F130-W153 AromaticContact CD2-CG 3.43Å; F130-W153 HydrophobicContact CD2-CG 3.43Å; F130-W153 VanDerWaalsContact CD2-CG 3.43Å; F130-W153 HydrophobicContact CE2-CB 3.56Å; F130-W153 HydrophobicContact CE2-CD2 4.1Å; F130-W153 AromaticContact CE2-CG 3.7Å; F130-W153 HydrophobicContact CE2-CG 3.7Å
131C78.8Confident73.2Confident46 Ų4679.4 Ų79.431%0.31141%0.408SS..Hα-helixtrans-60.5-46.6179-71.50000111.4V127 S133 L134 E135V127-C131 WeakPolarHBondContact O-CB 3.49Å; V127-C131 PolarHBondContact O-N 2.86Å; V127-C131 PolarHBondContact O-SG 3.36Å; V127-C131 VanDerWaalsContact O-SG 3.33Å; C131-S133 PolarHBondContact O-N 3.12Å; C131-L134 PolarHBondContact O-N 3.27Å; C131-E135 WeakPolarHBondContact O-CB 3.4Å; C131-E135 VanDerWaalsContact O-CG 3.27Å; C131-E135 WeakPolarHBondContact O-CG 3.36Å; C131-E135 PolarHBondContact O-N 2.98Å
132T82.6Confident74.9Confident58 Ų5874.2 Ų74.236%0.35638%0.383SS..Hα-helixtrans-64.2-29.3176.555.10000112.9E128 T129 F130 K136E128-T132 WeakPolarHBondContact O-CB 3.47Å; E128-T132 VanDerWaalsContact O-CG2 3.23Å; E128-T132 WeakPolarHBondContact O-CG2 3.22Å; E128-T132 PolarHBondContact O-N 3.04Å; E128-T132 PolarHBondContact O-OG1 3.21Å; T129-T132 WeakPolarHBondContact CA-OG1 3.17Å; T129-T132 PolarHBondContact O-OG1 3.35Å; T129-T132 VanDerWaalsContact O-OG1 3.06Å; F130-T132 PolarHBondContact O-N 3.11Å; T132-K136 WeakPolarHBondContact O-CD 3.31Å; T132-K136 WeakPolarHBondContact O-CG 3.44Å; T132-K136 PolarHBondContact O-N 3.33Å; T132-K136 VanDerWaalsContact O-N 3.13Å
133S80.8Confident76.4Confident33 Ų3368.6 Ų68.623%0.23136%0.357CS..Hα-helixtrans-74.6-43.9175.9-59.80000111.7T129 F130 C131 E135 K136 L137T129-S133 WeakPolarHBondContact O-CB 3.33Å; T129-S133 PolarHBondContact O-N 3.19Å; T129-S133 VanDerWaalsContact O-N 3.14Å; T129-S133 PolarHBondContact O-OG 3.5Å; F130-S133 PolarHBondContact O-N 3.07Å; F130-S133 VanDerWaalsContact O-N 3.14Å; C131-S133 PolarHBondContact O-N 3.12Å; S133-E135 VanDerWaalsContact C-N 3.3Å; S133-E135 PolarHBondContact O-N 2.86Å; S133-K136 PolarHBondContact O-N 2.93Å; S133-L137 WeakPolarHBondContact O-CB 3.44Å; S133-L137 WeakPolarHBondContact O-CD1 3.47Å; S133-L137 VanDerWaalsContact O-CG 3.29Å; S133-L137 WeakPolarHBondContact O-CG 3.42Å; S133-L137 PolarHBondContact O-N 3.02Å; S133-L137 VanDerWaalsContact O-N 3.07Å
134L83.2Confident77.5Confident1 Ų164.1 Ų64.11%0.00534%0.344CS..Hα-helixtrans-63.1-34.2172.7-73.9169.6000113F130 C131 L137 G138 V139 A140 V149 L171F130-L134 HydrophobicContact CD1-CD1 3.78Å; F130-L134 HydrophobicContact CD2-CD1 4.19Å; F130-L134 HydrophobicContact CD2-CG 4.27Å; F130-L134 HydrophobicContact CE1-CD1 3.2Å; F130-L134 HydrophobicContact CE1-CG 4.24Å; F130-L134 HydrophobicContact CE2-CD1 3.68Å; F130-L134 HydrophobicContact CE2-CD2 4.14Å; F130-L134 HydrophobicContact CE2-CG 3.86Å; F130-L134 HydrophobicContact CG-CD1 4.26Å; F130-L134 HydrophobicContact CZ-CD1 3.17Å; F130-L134 HydrophobicContact CZ-CD2 4.17Å; F130-L134 HydrophobicContact CZ-CG 3.87Å; F130-L134 PolarHBondContact O-N 3.1Å; C131-L134 PolarHBondContact O-N 3.27Å; L134-L137 CarbonylContact O-C 2.97Å; L134-G138 PolarHBondContact O-N 3.19Å; L134-V139 HydrophobicContact CB-CG2 3.92Å; L134-V139 HydrophobicContact CD2-CB 4.44Å; L134-V139 HydrophobicContact CD2-CG2 3.24Å; L134-V139 HydrophobicContact CG-CG2 4.16Å; L134-V139 WeakPolarHBondContact O-CG2 3.23Å; L134-V139 PolarHBondContact O-N 2.99Å; L134-A140 HydrophobicContact CB-CB 4.06Å; L134-A140 PolarHBondContact O-N 3.25Å; L134-V149 HydrophobicContact CD2-CG1 4.48Å; L134-L171 HydrophobicContact CD2-CD1 4.39Å
135E85.2Confident78.6Confident127 Ų12768.2 Ų68.259%0.59336%0.359SS*.Hα-helixtrans-68.4-43.4175.6-77.8173.9-179.600111.8C131 S133 L137 G138 A140C131-E135 WeakPolarHBondContact O-CB 3.4Å; C131-E135 VanDerWaalsContact O-CG 3.27Å; C131-E135 WeakPolarHBondContact O-CG 3.36Å; C131-E135 PolarHBondContact O-N 2.98Å; S133-E135 VanDerWaalsContact C-N 3.3Å; S133-E135 PolarHBondContact O-N 2.86Å; E135-L137 VanDerWaalsContact C-N 3.26Å; E135-L137 PolarHBondContact O-N 2.87Å; E135-G138 WeakPolarHBondContact O-CA 3.5Å; E135-G138 PolarHBondContact O-N 3.14Å; E135-A140 HydrophobicContact CG-CB 3.89Å
136K83.8Confident79.7Confident174 Ų17467.2 Ų67.276%0.75735%0.351SS*.Hα-helixtrans-62.5-35.4174.7-73.6165.5-171.1165.70112.3T132 S133 G138T132-K136 WeakPolarHBondContact O-CD 3.31Å; T132-K136 WeakPolarHBondContact O-CG 3.44Å; T132-K136 PolarHBondContact O-N 3.33Å; T132-K136 VanDerWaalsContact O-N 3.13Å; S133-K136 PolarHBondContact O-N 2.93Å; K136-G138 VanDerWaalsContact C-N 3.29Å
137L81.4Confident80.5Confident36 Ų3674.7 Ų74.719%0.18838%0.377CS..Hα-helixtrans-76.6-16.7172.9-67.5164.9000111.6S133 L134 E135 V139 W153 E168 M172S133-L137 WeakPolarHBondContact O-CB 3.44Å; S133-L137 WeakPolarHBondContact O-CD1 3.47Å; S133-L137 VanDerWaalsContact O-CG 3.29Å; S133-L137 WeakPolarHBondContact O-CG 3.42Å; S133-L137 PolarHBondContact O-N 3.02Å; S133-L137 VanDerWaalsContact O-N 3.07Å; L134-L137 CarbonylContact O-C 2.97Å; E135-L137 VanDerWaalsContact C-N 3.26Å; E135-L137 PolarHBondContact O-N 2.87Å; L137-V139 HydrophobicContact CB-CG1 4.36Å; L137-V139 HydrophobicContact CB-CG2 3.87Å; L137-V139 PolarHBondContact O-N 2.68Å; L137-W153 HydrophobicContact CD1-CH2 3.87Å; L137-W153 HydrophobicContact CD1-CZ3 4.21Å; L137-E168 HydrophobicContact CD1-CB 4.23Å; L137-E168 HydrophobicContact CD1-CG 3.7Å; L137-E168 HydrophobicContact CD2-CB 4.14Å; L137-E168 HydrophobicContact CD2-CG 4.2Å; L137-M172 HydrophobicContact CB-SD 3.85Å; L137-M172 HydrophobicContact CD2-CG 4.36Å; L137-M172 HydrophobicContact CD2-SD 4.25Å; L137-M172 WeakPolarHBondContact O-CE 3.39Å
138G81.2Confident81.4Confident44 Ų4475.2 Ų75.245%0.45438%0.384SS..THydrogen-bonded Turntrans72.713.7-178.700000114.2L134 E135 K136L134-G138 PolarHBondContact O-N 3.19Å; E135-G138 WeakPolarHBondContact O-CA 3.5Å; E135-G138 PolarHBondContact O-N 3.14Å; K136-G138 VanDerWaalsContact C-N 3.29Å
139V86.9Confident82Confident1 Ų169.2 Ų69.21%0.00636%0.357CS..  trans-91.2-10.9179.3-64.70000112.5L134 L137 R141 V142 L143 L171 M172 S175L134-V139 HydrophobicContact CB-CG2 3.92Å; L134-V139 HydrophobicContact CD2-CB 4.44Å; L134-V139 HydrophobicContact CD2-CG2 3.24Å; L134-V139 HydrophobicContact CG-CG2 4.16Å; L134-V139 WeakPolarHBondContact O-CG2 3.23Å; L134-V139 PolarHBondContact O-N 2.99Å; L137-V139 HydrophobicContact CB-CG1 4.36Å; L137-V139 HydrophobicContact CB-CG2 3.87Å; L137-V139 PolarHBondContact O-N 2.68Å; V139-R141 VanDerWaalsContact C-N 3.3Å; V139-R141 PolarHBondContact O-N 3.48Å; V139-V142 PolarHBondContact O-N 2.8Å; V139-L143 HydrophobicContact CB-CD1 4.37Å; V139-L143 PolarHBondContact O-N 3.06Å; V139-L171 HydrophobicContact CG1-CB 4.33Å; V139-L171 WeakPolarHBondContact CG1-O 3.41Å; V139-M172 HydrophobicContact CG1-CG 4.39Å; V139-M172 HydrophobicContact CG1-SD 3.61Å; V139-S175 VanDerWaalsContact CG1-OG 3.28Å; V139-S175 WeakPolarHBondContact CG1-OG 3.43Å
140A81.3Confident82.3Confident32 Ų3270.8 Ų70.826%0.26436%0.356SS..Hα-helixtrans-56.7-35.6-174.700000114.2L134 E135 V142 G144L134-A140 HydrophobicContact CB-CB 4.06Å; L134-A140 PolarHBondContact O-N 3.25Å; E135-A140 HydrophobicContact CG-CB 3.89Å; A140-V142 PolarHBondContact O-N 3.14Å; A140-G144 VanDerWaalsContact O-CA 3.28Å; A140-G144 WeakPolarHBondContact O-CA 3.29Å; A140-G144 PolarHBondContact O-N 3.15Å
141R81.8Confident82.6Confident220 Ų22074.3 Ų74.383%0.8338%0.378SS*.Hα-helixtrans-63.7-24.1-179.2-71.5-178.779.8-161.86.9114.2V139V139-R141 VanDerWaalsContact C-N 3.3Å; V139-R141 PolarHBondContact O-N 3.48Å
142V82.6Confident83Confident47 Ų4777.2 Ų77.229%0.28539%0.389SS..Hα-helixtrans-116-34.8-172.6-1780000112V139 A140 L178 E179V139-V142 PolarHBondContact O-N 2.8Å; A140-V142 PolarHBondContact O-N 3.14Å; V142-L178 HydrophobicContact CG1-CB 3.55Å; V142-L178 HydrophobicContact CG1-CD1 3.4Å; V142-L178 HydrophobicContact CG1-CG 4.1Å; V142-E179 HydrophobicContact CG2-CG 3.61Å
143L81.9Confident83.1Confident7 Ų774.7 Ų74.74%0.03737%0.373CS..Hα-helixtrans-114.1-6.4-174-59.2178.3000113.4V139 E145 Q146 L171 A174 L178V139-L143 HydrophobicContact CB-CD1 4.37Å; V139-L143 PolarHBondContact O-N 3.06Å; L143-E145 VanDerWaalsContact C-N 3.27Å; L143-E145 PolarHBondContact O-N 2.86Å; L143-Q146 PolarHBondContact O-N 3.16Å; L143-Q146 VanDerWaalsContact O-N 3.1Å; L143-L171 HydrophobicContact CD1-CB 4.16Å; L143-L171 HydrophobicContact CD1-CD2 3.68Å; L143-A174 HydrophobicContact CD1-CB 4.47Å; L143-L178 HydrophobicContact CD2-CD1 3.92Å
144G76.2Confident83.3Confident29 Ų2974.5 Ų74.530%0.29937%0.371SS..THydrogen-bonded Turntrans-64-27.8-174.200000114.7A140A140-G144 VanDerWaalsContact O-CA 3.28Å; A140-G144 WeakPolarHBondContact O-CA 3.29Å; A140-G144 PolarHBondContact O-N 3.15Å
145E77.5Confident83.5Confident196 Ų19681.7 Ų81.792%0.91640%0.398SS*.THydrogen-bonded Turntrans-88.6-5.7178.5-61.5-177.7173.700113L143 W147L143-E145 VanDerWaalsContact C-N 3.27Å; L143-E145 PolarHBondContact O-N 2.86Å; E145-W147 PolarHBondContact O-N 3.38Å
146Q85.4Confident83.6Confident87 Ų8777.5 Ų77.541%0.40738%0.379SS..  trans-83103.1-175.6-62.5-165.322.300111.5L143 A148 V149 R150L143-Q146 PolarHBondContact O-N 3.16Å; L143-Q146 VanDerWaalsContact O-N 3.1Å; Q146-A148 PolarHBondContact O-N 2.81Å; Q146-A148 VanDerWaalsContact O-N 3.15Å; Q146-V149 HydrophobicContact CB-CB 4.29Å; Q146-V149 HydrophobicContact CB-CG2 3.83Å; Q146-V149 WeakPolarHBondContact O-CB 3.43Å; Q146-V149 PolarHBondContact O-N 3.46Å; Q146-R150 PolarHBondContact O-N 3.45Å
147W81.9Confident83.6Confident197 Ų19773.3 Ų73.375%0.74636%0.362SS*.Hα-helixtrans-53.2-36.2177.877.8-93.5000112.9E145 V149 R150 T151E145-W147 PolarHBondContact O-N 3.38Å; W147-V149 VanDerWaalsContact C-N 3.34Å; W147-V149 PolarHBondContact O-N 3.34Å; W147-R150 WeakPolarHBondContact O-CB 3.2Å; W147-R150 PolarHBondContact O-N 2.94Å; W147-T151 PolarHBondContact O-N 3.42Å; W147-T151 PolarHBondContact O-OG1 3.22Å; W147-T151 VanDerWaalsContact O-OG1 3.08Å
148A86.6Confident83.7Confident40 Ų4079.7 Ų79.733%0.33138%0.384SS..Hα-helixtrans-64.4-37.1-179.800000112.5Q146 L152Q146-A148 PolarHBondContact O-N 2.81Å; Q146-A148 VanDerWaalsContact O-N 3.15Å; A148-L152 WeakPolarHBondContact O-CB 3.41Å; A148-L152 WeakPolarHBondContact O-CD1 3.37Å; A148-L152 VanDerWaalsContact O-CG 3.25Å; A148-L152 WeakPolarHBondContact O-CG 3.46Å; A148-L152 PolarHBondContact O-N 2.98Å; A148-L152 VanDerWaalsContact O-N 3.08Å
149V86.7Confident84.1Confident15 Ų1583.5 Ų83.59%0.09139%0.39CS..Hα-helixtrans-67.8-40.8175.9178.60000110F130 L134 Q146 W147 L152 W153 L171F130-V149 HydrophobicContact CE2-CG1 4.25Å; F130-V149 HydrophobicContact CZ-CB 4.44Å; F130-V149 HydrophobicContact CZ-CG1 4.02Å; L134-V149 HydrophobicContact CD2-CG1 4.48Å; Q146-V149 HydrophobicContact CB-CB 4.29Å; Q146-V149 HydrophobicContact CB-CG2 3.83Å; Q146-V149 WeakPolarHBondContact O-CB 3.43Å; Q146-V149 PolarHBondContact O-N 3.46Å; W147-V149 VanDerWaalsContact C-N 3.34Å; W147-V149 PolarHBondContact O-N 3.34Å; V149-L152 PolarHBondContact O-N 2.85Å; V149-W153 WeakPolarHBondContact O-CB 3.46Å; V149-W153 PolarHBondContact O-N 3.21Å; V149-L171 HydrophobicContact CG1-CD1 3.85Å; V149-L171 HydrophobicContact CG1-CD2 3.55Å; V149-L171 HydrophobicContact CG1-CG 4.38Å; V149-L171 HydrophobicContact CG2-CD2 4.15Å
150R84Confident84Confident95 Ų9591.3 Ų91.336%0.35842%0.419SS..Hα-helixtrans-62.2-48.8176.2-175.7171.5159.7-158.7-18.3112.5F130 Q146 W147 L152 W153 V154F130-R150 HydrophobicContact CD1-CB 3.98Å; F130-R150 HydrophobicContact CD1-CG 3.68Å; F130-R150 HydrophobicContact CE1-CB 3.43Å; F130-R150 VanDerWaalsContact CE1-CB 3.43Å; F130-R150 HydrophobicContact CE1-CG 3.69Å; F130-R150 HydrophobicContact CE2-CB 4.32Å; F130-R150 HydrophobicContact CG-CG 4.16Å; F130-R150 HydrophobicContact CZ-CB 3.6Å; F130-R150 HydrophobicContact CZ-CG 4.18Å; Q146-R150 PolarHBondContact O-N 3.45Å; W147-R150 WeakPolarHBondContact O-CB 3.2Å; W147-R150 PolarHBondContact O-N 2.94Å; R150-L152 VanDerWaalsContact C-N 3.34Å; R150-L152 PolarHBondContact O-N 3.38Å; R150-W153 PolarHBondContact O-N 3.47Å; R150-V154 WeakPolarHBondContact O-CG2 3.31Å; R150-V154 PolarHBondContact O-N 2.96Å; R150-V154 VanDerWaalsContact O-N 3.09Å
151T85.6Confident84.1Confident76 Ų7693.8 Ų93.847%0.46643%0.433SS..Hα-helixtrans-63.3-40.4179.1-55.30000111.9W147 R155W147-T151 PolarHBondContact O-N 3.42Å; W147-T151 PolarHBondContact O-OG1 3.22Å; W147-T151 VanDerWaalsContact O-OG1 3.08Å; T151-R155 VanDerWaalsContact O-CB 3.25Å; T151-R155 WeakPolarHBondContact O-CB 3.36Å; T151-R155 PolarHBondContact O-N 3.49Å; T151-R155 VanDerWaalsContact O-N 3.13Å
152L85.8Confident84.3Confident106 Ų10691.9 Ų91.956%0.55543%0.433SS*.Hα-helixtrans-66.4-40.2176.7-74.9169000112.1A148 V149 R150 L156A148-L152 WeakPolarHBondContact O-CB 3.41Å; A148-L152 WeakPolarHBondContact O-CD1 3.37Å; A148-L152 VanDerWaalsContact O-CG 3.25Å; A148-L152 WeakPolarHBondContact O-CG 3.46Å; A148-L152 PolarHBondContact O-N 2.98Å; A148-L152 VanDerWaalsContact O-N 3.08Å; V149-L152 PolarHBondContact O-N 2.85Å; R150-L152 VanDerWaalsContact C-N 3.34Å; R150-L152 PolarHBondContact O-N 3.38Å; L152-L156 WeakPolarHBondContact O-CB 3.17Å; L152-L156 PolarHBondContact O-N 3.11Å
153W86.4Confident84.6Confident5 Ų593.4 Ų93.42%0.01944%0.44CS..Hα-helixtrans-62.4-52.4178.4-173.5-82000112.5F130 L137 V149 R150 R155 L156 Q157 L164 L167 E168 L171F130-W153 HydrophobicContact CD2-CB 3.68Å; F130-W153 AromaticContact CD2-CD1 3.55Å; F130-W153 AromaticContact CD2-CD2 3.95Å; F130-W153 HydrophobicContact CD2-CD2 3.95Å; F130-W153 AromaticContact CD2-CG 3.43Å; F130-W153 HydrophobicContact CD2-CG 3.43Å; F130-W153 VanDerWaalsContact CD2-CG 3.43Å; F130-W153 HydrophobicContact CE2-CB 3.56Å; F130-W153 HydrophobicContact CE2-CD2 4.1Å; F130-W153 AromaticContact CE2-CG 3.7Å; F130-W153 HydrophobicContact CE2-CG 3.7Å; L137-W153 HydrophobicContact CD1-CH2 3.87Å; L137-W153 HydrophobicContact CD1-CZ3 4.21Å; V149-W153 WeakPolarHBondContact O-CB 3.46Å; V149-W153 PolarHBondContact O-N 3.21Å; R150-W153 PolarHBondContact O-N 3.47Å; W153-R155 VanDerWaalsContact C-N 3.3Å; W153-R155 PolarHBondContact O-N 3.01Å; W153-L156 PolarHBondContact O-N 3.08Å; W153-Q157 WeakPolarHBondContact O-CB 3.45Å; W153-Q157 PolarHBondContact O-N 3.14Å; W153-L164 HydrophobicContact CD2-CD1 3.84Å; W153-L164 HydrophobicContact CE3-CD1 3.96Å; W153-L164 HydrophobicContact CG-CD1 4.43Å; W153-L164 HydrophobicContact CH2-CD1 4.06Å; W153-L164 HydrophobicContact CH2-CD2 4.48Å; W153-L164 HydrophobicContact CH2-CG 4.14Å; W153-L164 HydrophobicContact CZ2-CD1 3.95Å; W153-L164 HydrophobicContact CZ2-CD2 4.1Å; W153-L164 HydrophobicContact CZ2-CG 4.17Å; W153-L164 HydrophobicContact CZ3-CD1 4.06Å; W153-L164 HydrophobicContact CZ3-CG 4.48Å; W153-L167 HydrophobicContact CB-CD2 4.48Å; W153-L167 HydrophobicContact CD2-CD2 4.5Å; W153-L167 HydrophobicContact CE3-CD2 3.7Å; W153-L167 HydrophobicContact CE3-CG 4.33Å; W153-L167 HydrophobicContact CZ3-CD2 4.36Å; W153-E168 HydrophobicContact CH2-CG 3.5Å; W153-E168 VanDerWaalsContact CH2-CG 3.5Å; W153-E168 WeakPolarHBondContact CH2-OE1 3.48Å; W153-E168 HydrophobicContact CZ3-CG 3.65Å; W153-L171 HydrophobicContact CE3-CD1 3.96Å; W153-L171 HydrophobicContact CZ3-CD1 3.97Å
154V84.8Confident84.8Confident29 Ų2994.6 Ų94.618%0.17645%0.446CS..Hα-helixtrans-61.3-40.5179.2174.80000111D126 R150 R158D126-V154 HydrophobicContact CB-CG2 4.45Å; R150-V154 WeakPolarHBondContact O-CG2 3.31Å; R150-V154 PolarHBondContact O-N 2.96Å; R150-V154 VanDerWaalsContact O-N 3.09Å; V154-R158 WeakPolarHBondContact O-CG 3.28Å; V154-R158 PolarHBondContact O-N 2.71Å
155R85.6Confident85.3Confident152 Ų15294.9 Ų94.957%0.57445%0.448SS*.Hα-helixtrans-68-43.1178.3-170.4175-176.9-179.6-0.4112.4T151 W153 Q157 R158 E159T151-R155 VanDerWaalsContact O-CB 3.25Å; T151-R155 WeakPolarHBondContact O-CB 3.36Å; T151-R155 PolarHBondContact O-N 3.49Å; T151-R155 VanDerWaalsContact O-N 3.13Å; W153-R155 VanDerWaalsContact C-N 3.3Å; W153-R155 PolarHBondContact O-N 3.01Å; R155-Q157 VanDerWaalsContact C-N 3.34Å; R155-R158 PolarHBondContact O-N 2.83Å; R155-E159 HydrophobicContact CG-CG 4.35Å; R155-E159 WeakPolarHBondContact CG-OE1 3.21Å; R155-E159 IonicContact CZ-OE1 3.71Å; R155-E159 IonicContact NE-OE1 2.81Å; R155-E159 PolarHBondContact NE-OE1 3.29Å; R155-E159 IonicContact NE-OE2 3.69Å; R155-E159 IonicContact NH2-OE1 3.62Å; R155-E159 WeakPolarHBondContact O-CB 3.25Å; R155-E159 PolarHBondContact O-N 3.23Å
156L87.2Confident85.8Confident39 Ų3988 Ų8820%0.20443%0.425CS..Hα-helixtrans-67.1-37.8179.7-163.364.7000111.4L152 W153 R158 R160 L163 L164 L167L152-L156 WeakPolarHBondContact O-CB 3.17Å; L152-L156 PolarHBondContact O-N 3.11Å; W153-L156 PolarHBondContact O-N 3.08Å; L156-R158 VanDerWaalsContact C-N 3.32Å; L156-R158 PolarHBondContact O-N 2.84Å; L156-R160 HydrophobicContact CD1-CB 4.32Å; L156-R160 CarbonylContact O-C 3.6Å; L156-R160 WeakPolarHBondContact O-CA 3.32Å; L156-R160 PolarHBondContact O-N 2.65Å; L156-R160 VanDerWaalsContact O-O 3.06Å; L156-L163 HydrophobicContact CD1-CB 3.8Å; L156-L163 HydrophobicContact CD1-CD1 4.11Å; L156-L163 HydrophobicContact CD2-CB 4.02Å; L156-L163 HydrophobicContact CG-CB 4.12Å; L156-L164 HydrophobicContact CD2-CD1 4.45Å; L156-L167 HydrophobicContact CD2-CB 3.73Å; L156-L167 HydrophobicContact CD2-CD2 3.71Å; L156-L167 HydrophobicContact CD2-CG 4.31Å
157Q85.1Confident85.9Confident86 Ų8685.4 Ų85.440%0.40241%0.414SS..Hα-helixtrans-61.5-37.4175.3-173.2175.3-1.500112.6W153 R155W153-Q157 WeakPolarHBondContact O-CB 3.45Å; W153-Q157 PolarHBondContact O-N 3.14Å; R155-Q157 VanDerWaalsContact C-N 3.34Å
158R84.1Confident86.3Confident171 Ų17179 Ų7965%0.64539%0.392SS*.Hα-helixtrans-81.1-42.1179.1-69.6179.8180-164.50.2113.4D126 V154 R155 L156D126-R158 IonicContact OD2-CZ 3.56Å; D126-R158 IonicContact OD2-NH2 2.9Å; D126-R158 PolarHBondContact OD2-NH2 2.83Å; V154-R158 WeakPolarHBondContact O-CG 3.28Å; V154-R158 PolarHBondContact O-N 2.71Å; R155-R158 PolarHBondContact O-N 2.83Å; L156-R158 VanDerWaalsContact C-N 3.32Å; L156-R158 PolarHBondContact O-N 2.84Å
159E88.1Confident86.4Confident124 Ų12484.1 Ų84.158%0.57941%0.409SS*.Hα-helixtrans-91.3-38.6-171.8-65.5179.3-167.500113.1R155R155-E159 HydrophobicContact CG-CG 4.35Å; R155-E159 WeakPolarHBondContact CG-OE1 3.21Å; R155-E159 IonicContact CZ-OE1 3.71Å; R155-E159 IonicContact NE-OE1 2.81Å; R155-E159 PolarHBondContact NE-OE1 3.29Å; R155-E159 IonicContact NE-OE2 3.69Å; R155-E159 IonicContact NH2-OE1 3.62Å; R155-E159 WeakPolarHBondContact O-CB 3.25Å; R155-E159 PolarHBondContact O-N 3.23Å
160R85.6Confident86.7Confident164 Ų16487.9 Ų87.962%0.61943%0.432SS*.  trans-152.580.8-175.3-67.7-164.5-179-178.91.6112.5L156 E162 L163L156-R160 HydrophobicContact CD1-CB 4.32Å; L156-R160 CarbonylContact O-C 3.6Å; L156-R160 WeakPolarHBondContact O-CA 3.32Å; L156-R160 PolarHBondContact O-N 2.65Å; L156-R160 VanDerWaalsContact O-O 3.06Å; R160-E162 PolarHBondContact O-N 2.91Å; R160-E162 VanDerWaalsContact O-N 3.15Å; R160-L163 HydrophobicContact CB-CD1 4.08Å; R160-L163 HydrophobicContact CB-CG 4.41Å; R160-L163 PolarHBondContact O-N 2.84Å
161P82.6Confident87Confident85 Ų8583.9 Ų83.955%0.55242%0.418SS*.G310 helixtrans-63.4-23.6-177.925.9-35.1000113.6L163 L164P161-L163 PolarHBondContact O-N 3Å; P161-L164 VanDerWaalsContact O-CB 3.31Å; P161-L164 WeakPolarHBondContact O-CB 3.44Å; P161-L164 PolarHBondContact O-N 3.2Å
162E87.8Confident87.2Confident180 Ų18084.1 Ų84.184%0.84142%0.415SS*.G310 helixtrans-60.6-25.2177.7-62.3165.3-168.500113.6R160R160-E162 PolarHBondContact O-N 2.91Å; R160-E162 VanDerWaalsContact O-N 3.15Å
163L87.2Confident87.5Confident79 Ų7988.3 Ų88.341%0.41442%0.423SS..G310 helixtrans-92.3-6.6-178.3-67.3175.8000113.2L156 R160 P161 G165 A166 L167L156-L163 HydrophobicContact CD1-CB 3.8Å; L156-L163 HydrophobicContact CD1-CD1 4.11Å; L156-L163 HydrophobicContact CD2-CB 4.02Å; L156-L163 HydrophobicContact CG-CB 4.12Å; R160-L163 HydrophobicContact CB-CD1 4.08Å; R160-L163 HydrophobicContact CB-CG 4.41Å; R160-L163 PolarHBondContact O-N 2.84Å; P161-L163 PolarHBondContact O-N 3Å; L163-G165 VanDerWaalsContact C-N 3.31Å; L163-G165 PolarHBondContact O-N 2.69Å; L163-A166 PolarHBondContact O-N 2.98Å; L163-A166 VanDerWaalsContact O-N 3.12Å; L163-L167 PolarHBondContact O-N 2.97Å; L163-L167 VanDerWaalsContact O-N 3.07Å
164L86.8Confident87.7Confident32 Ų3289.9 Ų89.917%0.16844%0.437CS..Hα-helixtrans-60.2-41.9-177.3-165.369.4000111.2W153 L156 P161 A166 L167 E168W153-L164 HydrophobicContact CD2-CD1 3.84Å; W153-L164 HydrophobicContact CE3-CD1 3.96Å; W153-L164 HydrophobicContact CG-CD1 4.43Å; W153-L164 HydrophobicContact CH2-CD1 4.06Å; W153-L164 HydrophobicContact CH2-CD2 4.48Å; W153-L164 HydrophobicContact CH2-CG 4.14Å; W153-L164 HydrophobicContact CZ2-CD1 3.95Å; W153-L164 HydrophobicContact CZ2-CD2 4.1Å; W153-L164 HydrophobicContact CZ2-CG 4.17Å; W153-L164 HydrophobicContact CZ3-CD1 4.06Å; W153-L164 HydrophobicContact CZ3-CG 4.48Å; L156-L164 HydrophobicContact CD2-CD1 4.45Å; P161-L164 VanDerWaalsContact O-CB 3.31Å; P161-L164 WeakPolarHBondContact O-CB 3.44Å; P161-L164 PolarHBondContact O-N 3.2Å; L164-A166 VanDerWaalsContact C-N 3.32Å; L164-A166 PolarHBondContact O-N 3.29Å; L164-L167 HydrophobicContact CD1-CD2 4.5Å; L164-L167 WeakPolarHBondContact O-CB 3.42Å; L164-L167 PolarHBondContact O-N 2.94Å; L164-L167 VanDerWaalsContact O-N 3.1Å; L164-E168 WeakPolarHBondContact O-CG 3.5Å; L164-E168 PolarHBondContact O-N 2.92Å
165G86.4Confident88Confident34 Ų3488.8 Ų88.835%0.35143%0.431SS..Hα-helixtrans-61.5-35.917600000113.7L163 E168 E169L163-G165 VanDerWaalsContact C-N 3.31Å; L163-G165 PolarHBondContact O-N 2.69Å; G165-E168 WeakPolarHBondContact O-CB 3.28Å; G165-E168 PolarHBondContact O-N 3.17Å; G165-E169 WeakPolarHBondContact O-CG 3.34Å; G165-E169 PolarHBondContact O-N 3.23Å
166A88.7Confident88.2Confident52 Ų5284 Ų8443%0.4342%0.424SS..Hα-helixtrans-70.4-35.317500000111.9L163 L164 V170L163-A166 PolarHBondContact O-N 2.98Å; L163-A166 VanDerWaalsContact O-N 3.12Å; L164-A166 VanDerWaalsContact C-N 3.32Å; L164-A166 PolarHBondContact O-N 3.29Å; A166-V170 VanDerWaalsContact O-CG2 3.32Å; A166-V170 WeakPolarHBondContact O-CG2 3.27Å; A166-V170 PolarHBondContact O-N 3Å; A166-V170 VanDerWaalsContact O-N 3.14Å
167L87.3Confident88.5Confident33 Ų3386 Ų8617%0.17344%0.44CS..Hα-helixtrans-65.4-43.1171.9179.265.5000110.8W153 L156 L163 L164 E169 V170 L171W153-L167 HydrophobicContact CB-CD2 4.48Å; W153-L167 HydrophobicContact CD2-CD2 4.5Å; W153-L167 HydrophobicContact CE3-CD2 3.7Å; W153-L167 HydrophobicContact CE3-CG 4.33Å; W153-L167 HydrophobicContact CZ3-CD2 4.36Å; L156-L167 HydrophobicContact CD2-CB 3.73Å; L156-L167 HydrophobicContact CD2-CD2 3.71Å; L156-L167 HydrophobicContact CD2-CG 4.31Å; L163-L167 PolarHBondContact O-N 2.97Å; L163-L167 VanDerWaalsContact O-N 3.07Å; L164-L167 HydrophobicContact CD1-CD2 4.5Å; L164-L167 WeakPolarHBondContact O-CB 3.42Å; L164-L167 PolarHBondContact O-N 2.94Å; L164-L167 VanDerWaalsContact O-N 3.1Å; L167-E169 PolarHBondContact O-N 3.3Å; L167-V170 PolarHBondContact O-N 3.07Å; L167-L171 HydrophobicContact CD1-CD1 4.3Å; L167-L171 HydrophobicContact CD1-CG 4.19Å; L167-L171 HydrophobicContact CD2-CD1 4.49Å; L167-L171 HydrophobicContact CG-CD1 3.94Å; L167-L171 HydrophobicContact CG-CG 4.26Å; L167-L171 WeakPolarHBondContact O-CB 3.29Å; L167-L171 VanDerWaalsContact O-CG 3.26Å; L167-L171 WeakPolarHBondContact O-CG 3.44Å; L167-L171 PolarHBondContact O-N 3.43Å
168E89.2Confident88.8Confident63 Ų6385.8 Ų85.829%0.29444%0.441SS..Hα-helixtrans-56.4-48.5175-70.2176.6175.500111.5L137 W153 L164 G165 V170 L171 M172L137-E168 HydrophobicContact CD1-CB 4.23Å; L137-E168 HydrophobicContact CD1-CG 3.7Å; L137-E168 HydrophobicContact CD2-CB 4.14Å; L137-E168 HydrophobicContact CD2-CG 4.2Å; W153-E168 HydrophobicContact CH2-CG 3.5Å; W153-E168 VanDerWaalsContact CH2-CG 3.5Å; W153-E168 WeakPolarHBondContact CH2-OE1 3.48Å; W153-E168 HydrophobicContact CZ3-CG 3.65Å; L164-E168 WeakPolarHBondContact O-CG 3.5Å; L164-E168 PolarHBondContact O-N 2.92Å; G165-E168 WeakPolarHBondContact O-CB 3.28Å; G165-E168 PolarHBondContact O-N 3.17Å; E168-V170 VanDerWaalsContact C-N 3.32Å; E168-V170 PolarHBondContact O-N 3.35Å; E168-L171 PolarHBondContact O-N 2.96Å; E168-M172 WeakPolarHBondContact O-CB 3.2Å; E168-M172 WeakPolarHBondContact O-CG 3.38Å; E168-M172 PolarHBondContact O-N 2.9Å
169E90.1Very high89.2Confident147 Ų14779.7 Ų79.769%0.68742%0.42SS*.Hα-helixtrans-59.7-40.8176.6-73-178.4-178.900112.8G165 L167 R173G165-E169 WeakPolarHBondContact O-CG 3.34Å; G165-E169 PolarHBondContact O-N 3.23Å; L167-E169 PolarHBondContact O-N 3.3Å; E169-R173 VanDerWaalsContact O-CB 3.31Å; E169-R173 WeakPolarHBondContact O-CB 3.38Å; E169-R173 PolarHBondContact O-N 2.82Å
170V92.3Very high89.6Confident94 Ų9475.7 Ų75.757%0.5741%0.408SS*.Hα-helixtrans-66.8-43.2176.5171.40000111A166 L167 E168 R173 A174A166-V170 VanDerWaalsContact O-CG2 3.32Å; A166-V170 WeakPolarHBondContact O-CG2 3.27Å; A166-V170 PolarHBondContact O-N 3Å; A166-V170 VanDerWaalsContact O-N 3.14Å; L167-V170 PolarHBondContact O-N 3.07Å; E168-V170 VanDerWaalsContact C-N 3.32Å; E168-V170 PolarHBondContact O-N 3.35Å; V170-R173 PolarHBondContact O-N 2.97Å; V170-A174 WeakPolarHBondContact O-CB 3.49Å; V170-A174 PolarHBondContact O-N 2.89Å
171L90.1Very high90Very high11 Ų1170.3 Ų70.36%0.05840%0.399CS..Hα-helixtrans-65.6-42177.8-67.9174.5000111.4L134 V139 L143 V149 W153 L167 E168 R173 A174 S175L134-L171 HydrophobicContact CD2-CD1 4.39Å; V139-L171 HydrophobicContact CG1-CB 4.33Å; V139-L171 WeakPolarHBondContact CG1-O 3.41Å; L143-L171 HydrophobicContact CD1-CB 4.16Å; L143-L171 HydrophobicContact CD1-CD2 3.68Å; V149-L171 HydrophobicContact CG1-CD1 3.85Å; V149-L171 HydrophobicContact CG1-CD2 3.55Å; V149-L171 HydrophobicContact CG1-CG 4.38Å; V149-L171 HydrophobicContact CG2-CD2 4.15Å; W153-L171 HydrophobicContact CE3-CD1 3.96Å; W153-L171 HydrophobicContact CZ3-CD1 3.97Å; L167-L171 HydrophobicContact CD1-CD1 4.3Å; L167-L171 HydrophobicContact CD1-CG 4.19Å; L167-L171 HydrophobicContact CD2-CD1 4.49Å; L167-L171 HydrophobicContact CG-CD1 3.94Å; L167-L171 HydrophobicContact CG-CG 4.26Å; L167-L171 WeakPolarHBondContact O-CB 3.29Å; L167-L171 VanDerWaalsContact O-CG 3.26Å; L167-L171 WeakPolarHBondContact O-CG 3.44Å; L167-L171 PolarHBondContact O-N 3.43Å; E168-L171 PolarHBondContact O-N 2.96Å; L171-R173 VanDerWaalsContact C-N 3.34Å; L171-R173 PolarHBondContact O-N 3.28Å; L171-A174 PolarHBondContact O-N 2.88Å; L171-S175 WeakPolarHBondContact O-CB 3.4Å; L171-S175 PolarHBondContact O-N 3.42Å; L171-S175 PolarHBondContact O-OG 3.47Å
172M89.3Confident90.6Very high81 Ų8168 Ų6840%0.39939%0.386SS..Hα-helixtrans-58.6-45.1173.2-74-59.1-67.700112L137 V139 E168 S175 A176L137-M172 HydrophobicContact CB-SD 3.85Å; L137-M172 HydrophobicContact CD2-CG 4.36Å; L137-M172 HydrophobicContact CD2-SD 4.25Å; L137-M172 WeakPolarHBondContact O-CE 3.39Å; V139-M172 HydrophobicContact CG1-CG 4.39Å; V139-M172 HydrophobicContact CG1-SD 3.61Å; E168-M172 WeakPolarHBondContact O-CB 3.2Å; E168-M172 WeakPolarHBondContact O-CG 3.38Å; E168-M172 PolarHBondContact O-N 2.9Å; M172-S175 PolarHBondContact O-OG 3.3Å; M172-A176 VanDerWaalsContact O-CB 3.31Å; M172-A176 WeakPolarHBondContact O-CB 3.49Å; M172-A176 PolarHBondContact O-N 3.37Å
173R92.4Very high91Very high194 Ų19466.6 Ų66.673%0.73237%0.374SS*.Hα-helixtrans-72.2-39.9-179.7-166.5164-177.4172.4-0.7111.7E169 V170 L171 A176 C177E169-R173 VanDerWaalsContact O-CB 3.31Å; E169-R173 WeakPolarHBondContact O-CB 3.38Å; E169-R173 PolarHBondContact O-N 2.82Å; V170-R173 PolarHBondContact O-N 2.97Å; L171-R173 VanDerWaalsContact C-N 3.34Å; L171-R173 PolarHBondContact O-N 3.28Å; R173-A176 PolarHBondContact O-N 3.42Å; R173-C177 WeakPolarHBondContact O-CB 3.43Å; R173-C177 PolarHBondContact O-N 3.4Å; R173-C177 PolarHBondContact O-SG 3.18Å
174A91.3Very high91.5Very high37 Ų3769.2 Ų69.231%0.30638%0.384SS..Hα-helixtrans-65-43.3176.600000111.7L143 V170 L171 C177 L178L143-A174 HydrophobicContact CD1-CB 4.47Å; V170-A174 WeakPolarHBondContact O-CB 3.49Å; V170-A174 PolarHBondContact O-N 2.89Å; L171-A174 PolarHBondContact O-N 2.88Å; A174-C177 PolarHBondContact O-N 3.4Å; A174-L178 WeakPolarHBondContact O-CB 3.3Å; A174-L178 VanDerWaalsContact O-CG 3.29Å; A174-L178 WeakPolarHBondContact O-CG 3.31Å; A174-L178 PolarHBondContact O-N 2.96Å
175S90Very high92Very high7 Ų774.3 Ų74.35%0.04940%0.401CS..Hα-helixtrans-63.7-45.4175.571.70000111V139 L171 M172 C177 L178 E179V139-S175 VanDerWaalsContact CG1-OG 3.28Å; V139-S175 WeakPolarHBondContact CG1-OG 3.43Å; L171-S175 WeakPolarHBondContact O-CB 3.4Å; L171-S175 PolarHBondContact O-N 3.42Å; L171-S175 PolarHBondContact O-OG 3.47Å; M172-S175 PolarHBondContact O-OG 3.3Å; S175-C177 VanDerWaalsContact C-N 3.31Å; S175-C177 PolarHBondContact O-N 2.95Å; S175-L178 PolarHBondContact O-N 3.36Å; S175-E179 WeakPolarHBondContact O-CG 3.36Å; S175-E179 PolarHBondContact O-N 3.06Å
176A91.8Very high92.5Very high52 Ų5275.7 Ų75.743%0.4340%0.4SS..Hα-helixtrans-59.3-41.8177.300000112M172 R173 A180M172-A176 VanDerWaalsContact O-CB 3.31Å; M172-A176 WeakPolarHBondContact O-CB 3.49Å; M172-A176 PolarHBondContact O-N 3.37Å; R173-A176 PolarHBondContact O-N 3.42Å; A176-A180 VanDerWaalsContact O-CB 3.3Å; A176-A180 WeakPolarHBondContact O-CB 3.41Å; A176-A180 PolarHBondContact O-N 2.97Å
177C93.4Very high93Very high80 Ų8075 Ų7554%0.54140%0.397SS..Hα-helixtrans-64.3-44.6174.9-73.70000112.5R173 A174 S175 A180 A181R173-C177 WeakPolarHBondContact O-CB 3.43Å; R173-C177 PolarHBondContact O-N 3.4Å; R173-C177 PolarHBondContact O-SG 3.18Å; A174-C177 PolarHBondContact O-N 3.4Å; S175-C177 VanDerWaalsContact C-N 3.31Å; S175-C177 PolarHBondContact O-N 2.95Å; C177-A180 PolarHBondContact O-N 3.24Å; C177-A181 WeakPolarHBondContact O-CB 3.32Å; C177-A181 PolarHBondContact O-N 3.39Å
178L91.4Very high93.5Very high82 Ų8279 Ų7943%0.42942%0.419SS..Hα-helixtrans-67-40.2178.9-74.2171.4000112.1V142 L143 A174 S175 A181 A182V142-L178 HydrophobicContact CG1-CB 3.55Å; V142-L178 HydrophobicContact CG1-CD1 3.4Å; V142-L178 HydrophobicContact CG1-CG 4.1Å; L143-L178 HydrophobicContact CD2-CD1 3.92Å; A174-L178 WeakPolarHBondContact O-CB 3.3Å; A174-L178 VanDerWaalsContact O-CG 3.29Å; A174-L178 WeakPolarHBondContact O-CG 3.31Å; A174-L178 PolarHBondContact O-N 2.96Å; S175-L178 PolarHBondContact O-N 3.36Å; L178-A181 PolarHBondContact O-N 2.82Å; L178-A182 WeakPolarHBondContact O-CB 3.35Å; L178-A182 PolarHBondContact O-N 2.94Å
179E92.3Very high93.9Very high42 Ų4279.2 Ų79.220%0.19642%0.42CS..Hα-helixtrans-68.6-35.8174.7-65.2-169160.800112.2V142 S175 A182 R183V142-E179 HydrophobicContact CG2-CG 3.61Å; S175-E179 WeakPolarHBondContact O-CG 3.36Å; S175-E179 PolarHBondContact O-N 3.06Å; E179-A182 PolarHBondContact O-N 3.41Å; E179-R183 WeakPolarHBondContact O-CB 3.15Å; E179-R183 VanDerWaalsContact O-CG 3.25Å; E179-R183 WeakPolarHBondContact O-CG 3.48Å; E179-R183 PolarHBondContact O-N 2.82Å; E179-R183 IonicContact OE2-CZ 3.56Å; E179-R183 IonicContact OE2-NH1 2.68Å; E179-R183 PolarHBondContact OE2-NH1 3.34Å; E179-R183 VanDerWaalsContact OE2-NH1 3.16Å; E179-R183 IonicContact OE2-NH2 3.36Å; E179-R183 PolarHBondContact OE2-NH2 3.34Å
180A95.1Very high94.3Very high40 Ų4076.8 Ų76.833%0.33141%0.408SS..Hα-helixtrans-62-46.917300000110.8A176 C177 A182 R183 E184A176-A180 VanDerWaalsContact O-CB 3.3Å; A176-A180 WeakPolarHBondContact O-CB 3.41Å; A176-A180 PolarHBondContact O-N 2.97Å; C177-A180 PolarHBondContact O-N 3.24Å; A180-A182 VanDerWaalsContact C-N 3.33Å; A180-A182 PolarHBondContact O-N 3.13Å; A180-R183 PolarHBondContact O-N 3.44Å; A180-E184 WeakPolarHBondContact O-CG 3.36Å; A180-E184 PolarHBondContact O-N 3.2Å
181A95.3Very high94.6Very high51 Ų5174.5 Ų74.542%0.42140%0.399SS..Hα-helixtrans-61.8-38.5175.200000112.6C177 L178 E184 R185C177-A181 WeakPolarHBondContact O-CB 3.32Å; C177-A181 PolarHBondContact O-N 3.39Å; L178-A181 PolarHBondContact O-N 2.82Å; A181-E184 PolarHBondContact O-N 3.36Å; A181-R185 WeakPolarHBondContact O-CB 3.18Å; A181-R185 PolarHBondContact O-N 2.66Å
182A94.7Very high95Very high36 Ų3679 Ų7930%0.29842%0.423SS..Hα-helixtrans-64.4-43.5174.800000111.8L178 E179 A180 E184 R185 D186L178-A182 WeakPolarHBondContact O-CB 3.35Å; L178-A182 PolarHBondContact O-N 2.94Å; E179-A182 PolarHBondContact O-N 3.41Å; A180-A182 VanDerWaalsContact C-N 3.33Å; A180-A182 PolarHBondContact O-N 3.13Å; A182-E184 VanDerWaalsContact C-N 3.35Å; A182-E184 PolarHBondContact O-N 3.48Å; A182-R185 PolarHBondContact O-N 2.94Å; A182-D186 PolarHBondContact O-N 2.77Å
183R96.1Very high95.4Very high151 Ų15182.5 Ų82.557%0.5743%0.431SS*.Hα-helixtrans-63.2-40175-71173.4-172.1105.34.9112E179 A180 G187E179-R183 WeakPolarHBondContact O-CB 3.15Å; E179-R183 VanDerWaalsContact O-CG 3.25Å; E179-R183 WeakPolarHBondContact O-CG 3.48Å; E179-R183 PolarHBondContact O-N 2.82Å; E179-R183 IonicContact OE2-CZ 3.56Å; E179-R183 IonicContact OE2-NH1 2.68Å; E179-R183 PolarHBondContact OE2-NH1 3.34Å; E179-R183 VanDerWaalsContact OE2-NH1 3.16Å; E179-R183 IonicContact OE2-NH2 3.36Å; E179-R183 PolarHBondContact OE2-NH2 3.34Å; A180-R183 PolarHBondContact O-N 3.44Å; R183-G187 PolarHBondContact O-N 3.13Å
184E96.8Very high95.7Very high135 Ų13580.5 Ų80.563%0.63142%0.424SS*.Hα-helixtrans-63.6-46.6174.6-74.6175.5-173.600111.5A180 A181 A182 D186 G187 L188A180-E184 WeakPolarHBondContact O-CG 3.36Å; A180-E184 PolarHBondContact O-N 3.2Å; A181-E184 PolarHBondContact O-N 3.36Å; A182-E184 VanDerWaalsContact C-N 3.35Å; A182-E184 PolarHBondContact O-N 3.48Å; E184-D186 PolarHBondContact O-N 2.87Å; E184-G187 PolarHBondContact O-N 3.5Å; E184-L188 WeakPolarHBondContact O-CG 3.25Å; E184-L188 PolarHBondContact O-N 2.9Å
185R97.3Very high96.1Very high138 Ų13886.9 Ų86.952%0.52144%0.44SS..Hα-helixtrans-56.8-50.7174.7-175.8-159.765.1-160.3-4.5111A181 A182 G187 L188 E189A181-R185 WeakPolarHBondContact O-CB 3.18Å; A181-R185 PolarHBondContact O-N 2.66Å; A182-R185 PolarHBondContact O-N 2.94Å; R185-G187 VanDerWaalsContact C-N 3.26Å; R185-G187 PolarHBondContact O-N 3.22Å; R185-L188 PolarHBondContact O-N 2.91Å; R185-L188 VanDerWaalsContact O-N 3.13Å; R185-E189 WeakPolarHBondContact CD-OE1 3.49Å; R185-E189 HydrophobicContact CG-CG 4.45Å; R185-E189 WeakPolarHBondContact CG-OE1 3.4Å; R185-E189 IonicContact NE-OE1 3.95Å; R185-E189 PolarHBondContact NE-OE1 2.93Å; R185-E189 WeakPolarHBondContact O-CG 3.41Å; R185-E189 PolarHBondContact O-N 3.27Å
186D97.8Very high96.5Very high64 Ų6492 Ų9234%0.34246%0.464SS..Hα-helixtrans-62.5-36.1179.9-64.7-8.9000111.3A182 E184 Q190A182-D186 PolarHBondContact O-N 2.77Å; E184-D186 PolarHBondContact O-N 2.87Å; D186-Q190 WeakPolarHBondContact O-CB 3.47Å; D186-Q190 WeakPolarHBondContact O-CG 3.48Å; D186-Q190 PolarHBondContact O-N 2.84Å
187G98.3Very high96.8Very high36 Ų3691.3 Ų91.337%0.37146%0.455SS..Hα-helixtrans-63.9-43173.100000113R183 E184 R185 Q190 A191R183-G187 PolarHBondContact O-N 3.13Å; E184-G187 PolarHBondContact O-N 3.5Å; R185-G187 VanDerWaalsContact C-N 3.26Å; R185-G187 PolarHBondContact O-N 3.22Å; G187-Q190 PolarHBondContact O-N 3.16Å; G187-A191 WeakPolarHBondContact O-CB 3.41Å; G187-A191 PolarHBondContact O-N 3.39Å
188L98.2Very high97Very high118 Ų11890.4 Ų90.462%0.61844%0.443SS*.Hα-helixtrans-66.8-43.4175.1-69.5175.1000111.7E184 R185 Q190 A191 L192E184-L188 WeakPolarHBondContact O-CG 3.25Å; E184-L188 PolarHBondContact O-N 2.9Å; R185-L188 PolarHBondContact O-N 2.91Å; R185-L188 VanDerWaalsContact O-N 3.13Å; L188-Q190 VanDerWaalsContact C-N 3.33Å; L188-Q190 PolarHBondContact O-N 2.8Å; L188-A191 PolarHBondContact O-N 3.03Å; L188-L192 WeakPolarHBondContact O-CG 3.48Å; L188-L192 PolarHBondContact O-N 3.44Å
189E98.2Very high97.4Very high68 Ų6892 Ų9232%0.31845%0.448SS..Hα-helixtrans-60.1-43.3175.4-75.1-179.9-160.200111.5R185 L192 R193R185-E189 WeakPolarHBondContact CD-OE1 3.49Å; R185-E189 HydrophobicContact CG-CG 4.45Å; R185-E189 WeakPolarHBondContact CG-OE1 3.4Å; R185-E189 IonicContact NE-OE1 3.95Å; R185-E189 PolarHBondContact NE-OE1 2.93Å; R185-E189 WeakPolarHBondContact O-CG 3.41Å; R185-E189 PolarHBondContact O-N 3.27Å; E189-L192 PolarHBondContact O-N 3.18Å; E189-R193 WeakPolarHBondContact O-CB 3.2Å; E189-R193 VanDerWaalsContact O-CG 3.31Å; E189-R193 WeakPolarHBondContact O-CG 3.42Å; E189-R193 PolarHBondContact O-N 3.5Å; E189-R193 IonicContact OE2-NH2 3.86Å
190Q98.4Very high97.7Very high96 Ų9694.8 Ų94.845%0.44946%0.461SS..Hα-helixtrans-65.1-39.5175.2-72.8171.929.800112.1D186 G187 L188 R193 R194D186-Q190 WeakPolarHBondContact O-CB 3.47Å; D186-Q190 WeakPolarHBondContact O-CG 3.48Å; D186-Q190 PolarHBondContact O-N 2.84Å; G187-Q190 PolarHBondContact O-N 3.16Å; L188-Q190 VanDerWaalsContact C-N 3.33Å; L188-Q190 PolarHBondContact O-N 2.8Å; Q190-R193 PolarHBondContact O-N 2.95Å; Q190-R194 WeakPolarHBondContact O-CB 3.43Å; Q190-R194 VanDerWaalsContact O-CG 3.25Å; Q190-R194 WeakPolarHBondContact O-CG 3.41Å; Q190-R194 PolarHBondContact O-N 2.89Å
191A98.4Very high97.8Very high45 Ų4599.2 Ų99.237%0.37247%0.469SS..Hα-helixtrans-64.1-42.4175.800000111.7G187 L188 R194 R195G187-A191 WeakPolarHBondContact O-CB 3.41Å; G187-A191 PolarHBondContact O-N 3.39Å; L188-A191 PolarHBondContact O-N 3.03Å; A191-R194 PolarHBondContact O-N 3.36Å; A191-R195 WeakPolarHBondContact O-CG 3.4Å; A191-R195 PolarHBondContact O-N 2.97Å
192L98.4Very high98Very high107 Ų107102.4 Ų102.456%0.5648%0.476SS*.Hα-helixtrans-62-49.7174.5-74.5173.6000111.4L188 E189 R194 R195 E196L188-L192 WeakPolarHBondContact O-CG 3.48Å; L188-L192 PolarHBondContact O-N 3.44Å; E189-L192 PolarHBondContact O-N 3.18Å; L192-R194 VanDerWaalsContact C-N 3.27Å; L192-R194 PolarHBondContact O-N 2.96Å; L192-R195 CarbonylContact O-C 3.55Å; L192-R195 WeakPolarHBondContact O-CA 3.37Å; L192-R195 WeakPolarHBondContact O-CB 3.42Å; L192-R195 PolarHBondContact O-N 3.48Å; L192-E196 WeakPolarHBondContact O-CG 3.31Å; L192-E196 PolarHBondContact O-N 2.9Å
193R98.6Very high98.2Very high153 Ų153103 Ų10358%0.57748%0.475SS*.Hα-helixtrans-57.9-39176.5-72.6176.4-172.5156.312.4112.4E189 Q190 S197E189-R193 WeakPolarHBondContact O-CB 3.2Å; E189-R193 VanDerWaalsContact O-CG 3.31Å; E189-R193 WeakPolarHBondContact O-CG 3.42Å; E189-R193 PolarHBondContact O-N 3.5Å; E189-R193 IonicContact OE2-NH2 3.86Å; Q190-R193 PolarHBondContact O-N 2.95Å; R193-S197 WeakPolarHBondContact O-CB 3.48Å; R193-S197 PolarHBondContact O-N 2.87Å; R193-S197 PolarHBondContact O-OG 2.79Å
194R98.6Very high98.3Very high152 Ų152101.6 Ų101.657%0.57447%0.47SS*.Hα-helixtrans-62.5-47.4174.2-74172.5-168.5160.97.8110.8Q190 A191 L192 S197 E198Q190-R194 WeakPolarHBondContact O-CB 3.43Å; Q190-R194 VanDerWaalsContact O-CG 3.25Å; Q190-R194 WeakPolarHBondContact O-CG 3.41Å; Q190-R194 PolarHBondContact O-N 2.89Å; A191-R194 PolarHBondContact O-N 3.36Å; L192-R194 VanDerWaalsContact C-N 3.27Å; L192-R194 PolarHBondContact O-N 2.96Å; R194-S197 PolarHBondContact O-N 3.24Å; R194-S197 PolarHBondContact O-OG 3.34Å; R194-E198 WeakPolarHBondContact O-CB 3.26Å; R194-E198 VanDerWaalsContact O-CG 3.32Å; R194-E198 WeakPolarHBondContact O-CG 3.43Å; R194-E198 PolarHBondContact O-N 2.84Å
195R98.6Very high98.4Very high171 Ų17196.2 Ų96.265%0.64545%0.45SS*.Hα-helixtrans-63-42.9177.8-72.8-64.7-175.9-172.48113.3A191 L192 E198 H199A191-R195 WeakPolarHBondContact O-CG 3.4Å; A191-R195 PolarHBondContact O-N 2.97Å; L192-R195 CarbonylContact O-C 3.55Å; L192-R195 WeakPolarHBondContact O-CA 3.37Å; L192-R195 WeakPolarHBondContact O-CB 3.42Å; L192-R195 PolarHBondContact O-N 3.48Å; R195-E198 WeakPolarHBondContact CD-OE2 3.32Å; R195-E198 IonicContact CZ-OE2 3.39Å; R195-E198 IonicContact NE-OE2 2.66Å; R195-E198 IonicContact NH1-OE2 3.92Å; R195-E198 PolarHBondContact NH1-OE2 2.88Å; R195-E198 PolarHBondContact O-N 3.23Å; R195-H199 WeakPolarHBondContact O-CB 3.38Å; R195-H199 PolarHBondContact O-N 3.22Å
196E98.4Very high98.4Very high116 Ų11695 Ų9554%0.54245%0.453SS..Hα-helixtrans-58.9-49.1173.6-72.3169173.200110.3L192 E198 H199 E200L192-E196 WeakPolarHBondContact O-CG 3.31Å; L192-E196 PolarHBondContact O-N 2.9Å; E196-E198 VanDerWaalsContact C-N 3.33Å; E196-E198 PolarHBondContact O-N 3.32Å; E196-H199 PolarHBondContact O-N 2.79Å; E196-E200 WeakPolarHBondContact O-CG 3.25Å; E196-E200 PolarHBondContact O-N 3.4Å
197S98.4Very high98.4Very high37 Ų3799.1 Ų99.126%0.25947%0.465SS..Hα-helixtrans-67-31179.573.10000113.7R193 R194 R201R193-S197 WeakPolarHBondContact O-CB 3.48Å; R193-S197 PolarHBondContact O-N 2.87Å; R193-S197 PolarHBondContact O-OG 2.79Å; R194-S197 PolarHBondContact O-N 3.24Å; R194-S197 PolarHBondContact O-OG 3.34Å; S197-R201 WeakPolarHBondContact O-CB 3.32Å; S197-R201 VanDerWaalsContact O-CG 3.31Å; S197-R201 WeakPolarHBondContact O-CG 3.43Å; S197-R201 VanDerWaalsContact O-CZ 3.26Å; S197-R201 PolarHBondContact O-N 3.21Å; S197-R201 VanDerWaalsContact O-N 3.13Å; S197-R201 PolarHBondContact O-NE 3.45Å; S197-R201 VanDerWaalsContact O-NE 3.13Å; S197-R201 PolarHBondContact OG-NH2 3.29Å
198E98.5Very high98.5Very high60 Ų60102.6 Ų102.628%0.2847%0.472SS..Hα-helixtrans-65.4-50.5170.9-76.8166.3-166.800110.7R194 R195 E196 E200 R201 E202R194-E198 WeakPolarHBondContact O-CB 3.26Å; R194-E198 VanDerWaalsContact O-CG 3.32Å; R194-E198 WeakPolarHBondContact O-CG 3.43Å; R194-E198 PolarHBondContact O-N 2.84Å; R195-E198 WeakPolarHBondContact CD-OE2 3.32Å; R195-E198 IonicContact CZ-OE2 3.39Å; R195-E198 IonicContact NE-OE2 2.66Å; R195-E198 IonicContact NH1-OE2 3.92Å; R195-E198 PolarHBondContact NH1-OE2 2.88Å; R195-E198 PolarHBondContact O-N 3.23Å; E196-E198 VanDerWaalsContact C-N 3.33Å; E196-E198 PolarHBondContact O-N 3.32Å; E198-E200 PolarHBondContact O-N 2.85Å; E198-R201 WeakPolarHBondContact O-CA 3.49Å; E198-R201 WeakPolarHBondContact O-CB 3.38Å; E198-R201 PolarHBondContact O-N 3.37Å; E198-E202 WeakPolarHBondContact O-CG 3.41Å; E198-E202 PolarHBondContact O-N 2.88Å
199H98.5Very high98.5Very high115 Ų115102.1 Ų102.153%0.53247%0.467SS..Hα-helixtrans-60.1-44.2177.9-17660.3000111.9R195 E196 R201 E202 V203R195-H199 WeakPolarHBondContact O-CB 3.38Å; R195-H199 PolarHBondContact O-N 3.22Å; E196-H199 PolarHBondContact O-N 2.79Å; H199-R201 VanDerWaalsContact C-N 3.27Å; H199-R201 PolarHBondContact O-N 2.98Å; H199-E202 PolarHBondContact O-N 2.97Å; H199-V203 WeakPolarHBondContact O-CB 3.5Å; H199-V203 VanDerWaalsContact O-CG2 3.26Å; H199-V203 WeakPolarHBondContact O-CG2 3.12Å; H199-V203 PolarHBondContact O-N 3.02Å
200E98.5Very high98.5Very high101 Ų101103.1 Ų103.147%0.47247%0.474SS..Hα-helixtrans-61.5-36.2175-70.8179.7-176.400112.5E196 E198 R204E196-E200 WeakPolarHBondContact O-CG 3.25Å; E196-E200 PolarHBondContact O-N 3.4Å; E198-E200 PolarHBondContact O-N 2.85Å; E200-R204 WeakPolarHBondContact O-CB 3.27Å; E200-R204 VanDerWaalsContact O-CG 3.27Å; E200-R204 WeakPolarHBondContact O-CG 3.35Å; E200-R204 PolarHBondContact O-N 3.19Å; E200-R204 PolarHBondContact O-NE 2.88Å; E200-R204 IonicContact OE2-CZ 3.93Å; E200-R204 IonicContact OE2-NH1 3.7Å; E200-R204 PolarHBondContact OE2-NH1 3.42Å; E200-R204 IonicContact OE2-NH2 3.56Å; E200-R204 PolarHBondContact OE2-NH2 3.32Å
201R98.5Very high98.4Very high134 Ų134105 Ų10551%0.50648%0.483SS..Hα-helixtrans-67.6-43.1175.5-81.3-180-99.3109.6-2.9111.3S197 E198 H199 R204 G205S197-R201 WeakPolarHBondContact O-CB 3.32Å; S197-R201 VanDerWaalsContact O-CG 3.31Å; S197-R201 WeakPolarHBondContact O-CG 3.43Å; S197-R201 VanDerWaalsContact O-CZ 3.26Å; S197-R201 PolarHBondContact O-N 3.21Å; S197-R201 VanDerWaalsContact O-N 3.13Å; S197-R201 PolarHBondContact O-NE 3.45Å; S197-R201 VanDerWaalsContact O-NE 3.13Å; S197-R201 PolarHBondContact OG-NH2 3.29Å; E198-R201 WeakPolarHBondContact O-CA 3.49Å; E198-R201 WeakPolarHBondContact O-CB 3.38Å; E198-R201 PolarHBondContact O-N 3.37Å; H199-R201 VanDerWaalsContact C-N 3.27Å; H199-R201 PolarHBondContact O-N 2.98Å; R201-R204 PolarHBondContact O-N 3.07Å; R201-G205 PolarHBondContact O-N 2.91Å
202E98.4Very high98.4Very high118 Ų118108.6 Ų108.655%0.55149%0.492SS*.Hα-helixtrans-61.8-47.9175.1-71170.3-171.500111.2E198 H199 R204 G205 L206E198-E202 WeakPolarHBondContact O-CG 3.41Å; E198-E202 PolarHBondContact O-N 2.88Å; H199-E202 PolarHBondContact O-N 2.97Å; E202-R204 PolarHBondContact O-N 3.06Å; E202-G205 PolarHBondContact O-N 3.43Å; E202-L206 WeakPolarHBondContact O-CG 3.31Å; E202-L206 PolarHBondContact O-N 3.18Å
203V98.6Very high98.4Very high48 Ų48109 Ų10929%0.29149%0.491SS..Hα-helixtrans-59.6-47.2177.81710000110.8H199 G205 L206 Y207H199-V203 WeakPolarHBondContact O-CB 3.5Å; H199-V203 VanDerWaalsContact O-CG2 3.26Å; H199-V203 WeakPolarHBondContact O-CG2 3.12Å; H199-V203 PolarHBondContact O-N 3.02Å; V203-G205 PolarHBondContact O-N 2.96Å; V203-L206 PolarHBondContact O-N 3.13Å; V203-Y207 HydrophobicContact CG1-CD2 3.75Å; V203-Y207 HydrophobicContact CG1-CE2 3.45Å; V203-Y207 VanDerWaalsContact CG1-CE2 3.45Å; V203-Y207 WeakPolarHBondContact O-CD2 3.44Å; V203-Y207 PolarHBondContact O-N 3.45Å; V203-Y207 VanDerWaalsContact O-N 3.07Å
204R98.6Very high98.3Very high122 Ų122105.3 Ų105.346%0.4648%0.482SS..Hα-helixtrans-58.3-46.9174.8-77.7-179.1-75.8-120.5-2.3111.8E200 R201 E202 L206 Y207 E208E200-R204 WeakPolarHBondContact O-CB 3.27Å; E200-R204 VanDerWaalsContact O-CG 3.27Å; E200-R204 WeakPolarHBondContact O-CG 3.35Å; E200-R204 PolarHBondContact O-N 3.19Å; E200-R204 PolarHBondContact O-NE 2.88Å; E200-R204 IonicContact OE2-CZ 3.93Å; E200-R204 IonicContact OE2-NH1 3.7Å; E200-R204 PolarHBondContact OE2-NH1 3.42Å; E200-R204 IonicContact OE2-NH2 3.56Å; E200-R204 PolarHBondContact OE2-NH2 3.32Å; R201-R204 PolarHBondContact O-N 3.07Å; E202-R204 PolarHBondContact O-N 3.06Å; R204-L206 PolarHBondContact O-N 2.86Å; R204-Y207 PolarHBondContact O-N 3.38Å; R204-E208 WeakPolarHBondContact O-CG 3.39Å; R204-E208 PolarHBondContact O-N 3.48Å
205G98.5Very high98.3Very high21 Ų2199.9 Ų99.922%0.21647%0.474CS..Hα-helixtrans-58.9-43.5177.300000112.9R201 E202 V203 Y207 E208 E209R201-G205 PolarHBondContact O-N 2.91Å; E202-G205 PolarHBondContact O-N 3.43Å; V203-G205 PolarHBondContact O-N 2.96Å; G205-Y207 VanDerWaalsContact C-N 3.34Å; G205-Y207 PolarHBondContact O-N 3.45Å; G205-E208 PolarHBondContact O-N 2.98Å; G205-E209 WeakPolarHBondContact O-CB 3.27Å; G205-E209 WeakPolarHBondContact O-CG 3.46Å; G205-E209 PolarHBondContact O-N 3.13Å
206L98.6Very high98.2Very high112 Ų11296.4 Ų96.459%0.58647%0.465SS*.Hα-helixtrans-63.3-38176.7-69174000112.6E202 V203 R204 L210E202-L206 WeakPolarHBondContact O-CG 3.31Å; E202-L206 PolarHBondContact O-N 3.18Å; V203-L206 PolarHBondContact O-N 3.13Å; R204-L206 PolarHBondContact O-N 2.86Å; L206-L210 WeakPolarHBondContact O-CB 3.41Å; L206-L210 PolarHBondContact O-N 3.24Å
207Y98.4Very high98Very high151 Ų15196.5 Ų96.559%0.59247%0.465SS*.Hα-helixtrans-66.5-45.1174-79.7-67.9000111.9V203 R204 G205 E209 L210 E211V203-Y207 HydrophobicContact CG1-CD2 3.75Å; V203-Y207 HydrophobicContact CG1-CE2 3.45Å; V203-Y207 VanDerWaalsContact CG1-CE2 3.45Å; V203-Y207 WeakPolarHBondContact O-CD2 3.44Å; V203-Y207 PolarHBondContact O-N 3.45Å; V203-Y207 VanDerWaalsContact O-N 3.07Å; R204-Y207 PolarHBondContact O-N 3.38Å; G205-Y207 VanDerWaalsContact C-N 3.34Å; G205-Y207 PolarHBondContact O-N 3.45Å; Y207-E209 VanDerWaalsContact C-N 3.35Å; Y207-E209 PolarHBondContact O-N 2.92Å; Y207-L210 PolarHBondContact O-N 2.88Å; Y207-E211 WeakPolarHBondContact O-CB 3.48Å; Y207-E211 WeakPolarHBondContact O-CG 3.26Å; Y207-E211 PolarHBondContact O-N 3.43Å
208E98.4Very high97.9Very high110 Ų110102.4 Ų102.451%0.51448%0.482SS..Hα-helixtrans-61.1-42.5177.3-70.6169.5-167.600111.7R204 G205 E211 Q212R204-E208 WeakPolarHBondContact O-CG 3.39Å; R204-E208 PolarHBondContact O-N 3.48Å; G205-E208 PolarHBondContact O-N 2.98Å; E208-E211 PolarHBondContact O-N 2.85Å; E208-Q212 WeakPolarHBondContact O-CB 3.39Å; E208-Q212 VanDerWaalsContact O-CG 3.26Å; E208-Q212 WeakPolarHBondContact O-CG 3.36Å; E208-Q212 PolarHBondContact O-N 3.36Å
209E98.5Very high97.6Very high107 Ų107105.3 Ų105.350%0.550%0.495SS..Hα-helixtrans-62.6-43.8174.7-74.9175.7-165.200111.8G205 Y207 E211 Q212 Q213G205-E209 WeakPolarHBondContact O-CB 3.27Å; G205-E209 WeakPolarHBondContact O-CG 3.46Å; G205-E209 PolarHBondContact O-N 3.13Å; Y207-E209 VanDerWaalsContact C-N 3.35Å; Y207-E209 PolarHBondContact O-N 2.92Å; E209-E211 VanDerWaalsContact C-N 3.35Å; E209-Q212 PolarHBondContact O-N 3.37Å; E209-Q213 WeakPolarHBondContact O-CB 3.47Å; E209-Q213 VanDerWaalsContact O-CG 3.27Å; E209-Q213 WeakPolarHBondContact O-CG 3.33Å; E209-Q213 PolarHBondContact O-N 3.01Å
210L97.9Very high97.4Very high89 Ų89106 Ų10647%0.46649%0.493SS..Hα-helixtrans-63.3-42.4177-179.364.3000111.4L206 Y207 Q213 L214L206-L210 WeakPolarHBondContact O-CB 3.41Å; L206-L210 PolarHBondContact O-N 3.24Å; Y207-L210 PolarHBondContact O-N 2.88Å; L210-Q213 PolarHBondContact O-N 3.28Å; L210-L214 HydrophobicContact CD1-CD1 4.1Å; L210-L214 HydrophobicContact CG-CD1 4.07Å; L210-L214 WeakPolarHBondContact O-CB 3.36Å; L210-L214 PolarHBondContact O-N 3.46Å
211E98.1Very high97Very high136 Ų136103.7 Ų103.764%0.63649%0.487SS*.Hα-helixtrans-63.5-42.7176.8-75.8179.7-179.300112Y207 E208 E209 L214 G215Y207-E211 WeakPolarHBondContact O-CB 3.48Å; Y207-E211 WeakPolarHBondContact O-CG 3.26Å; Y207-E211 PolarHBondContact O-N 3.43Å; E208-E211 PolarHBondContact O-N 2.85Å; E209-E211 VanDerWaalsContact C-N 3.35Å; E211-L214 PolarHBondContact O-N 2.93Å; E211-G215 PolarHBondContact O-N 3.38Å
212Q98Very high96.6Very high120 Ų120102.7 Ų102.756%0.56149%0.488SS*.Hα-helixtrans-60.5-47.7174.1-73.6171.329.300111E208 E209 L214 G215 E216E208-Q212 WeakPolarHBondContact O-CB 3.39Å; E208-Q212 VanDerWaalsContact O-CG 3.26Å; E208-Q212 WeakPolarHBondContact O-CG 3.36Å; E208-Q212 PolarHBondContact O-N 3.36Å; E209-Q212 PolarHBondContact O-N 3.37Å; Q212-L214 PolarHBondContact O-N 3.35Å; Q212-G215 PolarHBondContact O-N 2.93Å; Q212-E216 WeakPolarHBondContact O-CG 3.49Å; Q212-E216 PolarHBondContact O-N 3.43Å
213Q97.9Very high96.1Very high116 Ų11699 Ų9954%0.54248%0.476SS..Hα-helixtrans-61.9-42.8177.6-72.1175.712.600112.2E209 L210 E216 Q217E209-Q213 WeakPolarHBondContact O-CB 3.47Å; E209-Q213 VanDerWaalsContact O-CG 3.27Å; E209-Q213 WeakPolarHBondContact O-CG 3.33Å; E209-Q213 PolarHBondContact O-N 3.01Å; L210-Q213 PolarHBondContact O-N 3.28Å; Q213-E216 PolarHBondContact O-N 2.88Å; Q213-Q217 WeakPolarHBondContact O-CB 3.19Å; Q213-Q217 WeakPolarHBondContact O-CG 3.21Å; Q213-Q217 PolarHBondContact O-N 2.86Å
214L97.6Very high95.6Very high75 Ų75103.9 Ų103.939%0.39350%0.495SS..Hα-helixtrans-63.2-42.3175.5-111.7130.8000111.5L210 E211 Q212 R218L210-L214 HydrophobicContact CD1-CD1 4.1Å; L210-L214 HydrophobicContact CG-CD1 4.07Å; L210-L214 WeakPolarHBondContact O-CB 3.36Å; L210-L214 PolarHBondContact O-N 3.46Å; E211-L214 PolarHBondContact O-N 2.93Å; Q212-L214 PolarHBondContact O-N 3.35Å; L214-R218 VanDerWaalsContact CD2-NH2 3.31Å; L214-R218 WeakPolarHBondContact O-CB 3.39Å; L214-R218 WeakPolarHBondContact O-CD 3.33Å; L214-R218 WeakPolarHBondContact O-CG 3.43Å; L214-R218 PolarHBondContact O-N 3.22Å
215G97.7Very high95.1Very high39 Ų39104.9 Ų104.940%0.40250%0.503SS..Hα-helixtrans-59.9-49.1175.200000112.1E211 Q212 R218 H219E211-G215 PolarHBondContact O-N 3.38Å; Q212-G215 PolarHBondContact O-N 2.93Å; G215-R218 PolarHBondContact O-N 3.35Å; G215-H219 WeakPolarHBondContact O-CB 3.48Å; G215-H219 PolarHBondContact O-N 2.91Å
216E96.7Very high94.6Very high97 Ų97108 Ų10845%0.45351%0.514SS..Hα-helixtrans-62.3-45.3177.2-74.5-174.3-160.300112.6Q212 Q213 R218 H219 R220Q212-E216 WeakPolarHBondContact O-CG 3.49Å; Q212-E216 PolarHBondContact O-N 3.43Å; Q213-E216 PolarHBondContact O-N 2.88Å; E216-R218 VanDerWaalsContact C-N 3.33Å; E216-R218 PolarHBondContact O-N 2.9Å; E216-H219 PolarHBondContact O-N 3.36Å; E216-R220 WeakPolarHBondContact O-CB 3.48Å; E216-R220 VanDerWaalsContact O-CG 3.25Å; E216-R220 WeakPolarHBondContact O-CG 3.26Å; E216-R220 PolarHBondContact O-N 2.95Å; E216-R220 IonicContact OE2-CZ 3.53Å; E216-R220 IonicContact OE2-NH2 3.42Å; E216-R220 PolarHBondContact OE2-NH2 2.91Å
217Q94.7Very high93.9Very high119 Ų119107.3 Ų107.356%0.55651%0.511SS*.Hα-helixtrans-63.9-40.2178.4-71.4-69.4-2.200111.5Q213 C221Q213-Q217 WeakPolarHBondContact O-CB 3.19Å; Q213-Q217 WeakPolarHBondContact O-CG 3.21Å; Q213-Q217 PolarHBondContact O-N 2.86Å; Q217-C221 WeakPolarHBondContact O-CB 3.37Å; Q217-C221 PolarHBondContact O-N 2.9Å
218R94.7Very high93.5Very high160 Ų160102.6 Ų102.660%0.60450%0.499SS*.Hα-helixtrans-61.4-47.9173.4-74.5168.3-178.1-174.53.3111L214 G215 E216 C221 Q222L214-R218 VanDerWaalsContact CD2-NH2 3.31Å; L214-R218 WeakPolarHBondContact O-CB 3.39Å; L214-R218 WeakPolarHBondContact O-CD 3.33Å; L214-R218 WeakPolarHBondContact O-CG 3.43Å; L214-R218 PolarHBondContact O-N 3.22Å; G215-R218 PolarHBondContact O-N 3.35Å; E216-R218 VanDerWaalsContact C-N 3.33Å; E216-R218 PolarHBondContact O-N 2.9Å; R218-C221 PolarHBondContact O-N 3.47Å; R218-Q222 WeakPolarHBondContact O-CB 3.14Å; R218-Q222 VanDerWaalsContact O-CG 3.23Å; R218-Q222 WeakPolarHBondContact O-CG 3.23Å; R218-Q222 PolarHBondContact O-N 3.14Å
219H93.5Very high93.2Very high121 Ų121106.1 Ų106.156%0.5651%0.507SS*.Hα-helixtrans-63.5-46.4178.4-170.7-67000111.7G215 E216 C221 Q222 S223G215-H219 WeakPolarHBondContact O-CB 3.48Å; G215-H219 PolarHBondContact O-N 2.91Å; E216-H219 PolarHBondContact O-N 3.36Å; H219-C221 VanDerWaalsContact C-N 3.34Å; H219-C221 PolarHBondContact O-N 2.8Å; H219-Q222 PolarHBondContact O-N 3.28Å; H219-S223 PolarHBondContact CE1-OG 2.81Å; H219-S223 PolarHBondContact ND1-OG 3.41Å; H219-S223 PolarHBondContact O-N 2.82Å; H219-S223 PolarHBondContact O-OG 3.13Å; H219-S223 VanDerWaalsContact O-OG 3.1Å
220R93.6Very high92.9Very high131 Ų131105.5 Ų105.549%0.49450%0.504SS..Hα-helixtrans-58.6-44.7176.6-72.9175.1-165.5-177.88.7111.6E216 S223 Q224E216-R220 WeakPolarHBondContact O-CB 3.48Å; E216-R220 VanDerWaalsContact O-CG 3.25Å; E216-R220 WeakPolarHBondContact O-CG 3.26Å; E216-R220 PolarHBondContact O-N 2.95Å; E216-R220 IonicContact OE2-CZ 3.53Å; E216-R220 IonicContact OE2-NH2 3.42Å; E216-R220 PolarHBondContact OE2-NH2 2.91Å; R220-S223 PolarHBondContact O-N 3.4Å; R220-Q224 WeakPolarHBondContact O-CB 3.25Å; R220-Q224 WeakPolarHBondContact O-CG 3.43Å; R220-Q224 PolarHBondContact O-N 3.47Å
221C90.7Very high92.7Very high52 Ų52107.1 Ų107.135%0.35151%0.51SS..Hα-helixtrans-63.6-41.1176.4-176.30000112Q217 R218 H219 K225Q217-C221 WeakPolarHBondContact O-CB 3.37Å; Q217-C221 PolarHBondContact O-N 2.9Å; R218-C221 PolarHBondContact O-N 3.47Å; H219-C221 VanDerWaalsContact C-N 3.34Å; H219-C221 PolarHBondContact O-N 2.8Å; C221-K225 WeakPolarHBondContact O-CB 3.19Å; C221-K225 VanDerWaalsContact O-CG 3.26Å; C221-K225 WeakPolarHBondContact O-CG 3.31Å; C221-K225 PolarHBondContact O-N 3.1Å; C221-K225 VanDerWaalsContact O-N 3.13Å; C221-K225 WeakPolarHBondContact SG-CE 3.28Å; C221-K225 PolarHBondContact SG-NZ 2.9Å; C221-K225 VanDerWaalsContact SG-NZ 3.35Å
222Q89.8Confident92.5Very high112 Ų112106.5 Ų106.552%0.52351%0.506SS..Hα-helixtrans-65.1-49.4175.5-73.2171.119.200111.4R218 H219 Q224 K225 L226R218-Q222 WeakPolarHBondContact O-CB 3.14Å; R218-Q222 VanDerWaalsContact O-CG 3.23Å; R218-Q222 WeakPolarHBondContact O-CG 3.23Å; R218-Q222 PolarHBondContact O-N 3.14Å; H219-Q222 PolarHBondContact O-N 3.28Å; Q222-Q224 PolarHBondContact O-N 3.19Å; Q222-K225 PolarHBondContact O-N 3.2Å; Q222-K225 VanDerWaalsContact O-N 3.14Å; Q222-L226 HydrophobicContact CB-CD1 4.34Å; Q222-L226 VanDerWaalsContact O-CB 3.31Å; Q222-L226 WeakPolarHBondContact O-CB 3.34Å; Q222-L226 VanDerWaalsContact O-CG 3.28Å; Q222-L226 WeakPolarHBondContact O-CG 3.37Å; Q222-L226 PolarHBondContact O-N 2.81Å
223S88.1Confident92.5Very high42 Ų42107.6 Ų107.629%0.29451%0.505SS..Hα-helixtrans-61.1-42.7178.1-580000112.3H219 R220 K225 L227H219-S223 PolarHBondContact CE1-OG 2.81Å; H219-S223 PolarHBondContact ND1-OG 3.41Å; H219-S223 PolarHBondContact O-N 2.82Å; H219-S223 PolarHBondContact O-OG 3.13Å; H219-S223 VanDerWaalsContact O-OG 3.1Å; R220-S223 PolarHBondContact O-N 3.4Å; S223-K225 VanDerWaalsContact C-N 3.26Å; S223-K225 PolarHBondContact O-N 3.44Å; S223-L227 WeakPolarHBondContact O-CB 3.23Å; S223-L227 PolarHBondContact O-N 2.86Å
224Q87.9Confident92.5Very high149 Ų149103.6 Ų103.670%0.69650%0.495SS*.Hα-helixtrans-64-29176.1-80.1-179.21000113.3R220 Q222 P228R220-Q224 WeakPolarHBondContact O-CB 3.25Å; R220-Q224 WeakPolarHBondContact O-CG 3.43Å; R220-Q224 PolarHBondContact O-N 3.47Å; Q222-Q224 PolarHBondContact O-N 3.19Å; Q224-P228 WeakPolarHBondContact O-CD 3.33Å; Q224-P228 VanDerWaalsContact O-CG 3.23Å; Q224-P228 WeakPolarHBondContact O-CG 3.28Å
225K88.1Confident92.5Very high144 Ų144105.8 Ų105.863%0.62650%0.504SS*.Hα-helixtrans-90-35.8179.9-72.6175-179.5175.90113.2C221 Q222 S223 R229C221-K225 WeakPolarHBondContact O-CB 3.19Å; C221-K225 VanDerWaalsContact O-CG 3.26Å; C221-K225 WeakPolarHBondContact O-CG 3.31Å; C221-K225 PolarHBondContact O-N 3.1Å; C221-K225 VanDerWaalsContact O-N 3.13Å; C221-K225 WeakPolarHBondContact SG-CE 3.28Å; C221-K225 PolarHBondContact SG-NZ 2.9Å; C221-K225 VanDerWaalsContact SG-NZ 3.35Å; Q222-K225 PolarHBondContact O-N 3.2Å; Q222-K225 VanDerWaalsContact O-N 3.14Å; S223-K225 VanDerWaalsContact C-N 3.26Å; S223-K225 PolarHBondContact O-N 3.44Å; K225-R229 WeakPolarHBondContact O-CB 3.4Å
226L88.4Confident92.5Very high85 Ų85108.9 Ų108.945%0.44551%0.51SS..Hα-helixtrans-76.4-47.6-175.2-71.9170.2000111.6Q222 R229 E230Q222-L226 HydrophobicContact CB-CD1 4.34Å; Q222-L226 VanDerWaalsContact O-CB 3.31Å; Q222-L226 WeakPolarHBondContact O-CB 3.34Å; Q222-L226 VanDerWaalsContact O-CG 3.28Å; Q222-L226 WeakPolarHBondContact O-CG 3.37Å; Q222-L226 PolarHBondContact O-N 2.81Å; L226-R229 PolarHBondContact O-N 3.22Å; L226-E230 WeakPolarHBondContact O-CB 3.1Å; L226-E230 WeakPolarHBondContact O-CG 3.05Å; L226-E230 PolarHBondContact O-N 3.22Å
227L83.9Confident92.6Very high99 Ų99108.8 Ų108.852%0.51851%0.51SS..Hα-helixtrans-59.4-53.3-175.8-77.4163000112.8S223 R229 E230 E231S223-L227 WeakPolarHBondContact O-CB 3.23Å; S223-L227 PolarHBondContact O-N 2.86Å; L227-R229 VanDerWaalsContact C-N 3.26Å; L227-R229 PolarHBondContact O-N 3.28Å; L227-E230 PolarHBondContact O-N 3.21Å; L227-E231 WeakPolarHBondContact O-CG 3.34Å; L227-E231 PolarHBondContact O-N 3.01Å
228P90.2Very high92.8Very high52 Ų52108 Ų10834%0.33851%0.509SS..Hα-helixtrans-65.7-30.5179.1-21.234.7000112.7Q224 Q232Q224-P228 WeakPolarHBondContact O-CD 3.33Å; Q224-P228 VanDerWaalsContact O-CG 3.23Å; Q224-P228 WeakPolarHBondContact O-CG 3.28Å; P228-Q232 VanDerWaalsContact O-CB 3.28Å; P228-Q232 WeakPolarHBondContact O-CB 3.48Å; P228-Q232 WeakPolarHBondContact O-CG 3.46Å; P228-Q232 PolarHBondContact O-N 3.26Å
229R91.6Very high93Very high183 Ų183105.5 Ų105.569%0.69150%0.504SS*.Hα-helixtrans-71.3-38.7178.4-175.1178.5-179.8174.80.5111.6K225 L226 L227 R233K225-R229 WeakPolarHBondContact O-CB 3.4Å; L226-R229 PolarHBondContact O-N 3.22Å; L227-R229 VanDerWaalsContact C-N 3.26Å; L227-R229 PolarHBondContact O-N 3.28Å; R229-R233 WeakPolarHBondContact O-CB 3.45Å; R229-R233 PolarHBondContact O-N 2.89Å
230E91.9Very high93.2Very high95 Ų95104.9 Ų104.944%0.44450%0.504SS..Hα-helixtrans-68.6-41.7174.9-74175.9172.200111.4L226 L227 R233 G234L226-E230 WeakPolarHBondContact O-CB 3.1Å; L226-E230 WeakPolarHBondContact O-CG 3.05Å; L226-E230 PolarHBondContact O-N 3.22Å; L227-E230 PolarHBondContact O-N 3.21Å; E230-R233 PolarHBondContact O-N 3.46Å; E230-G234 PolarHBondContact O-N 3.26Å
231E93.6Very high93.4Very high123 Ų123103.3 Ų103.358%0.57550%0.503SS*.Hα-helixtrans-60.6-48.4172.5-71.6172.8173.200111.3L227 R233 G234 H235L227-E231 WeakPolarHBondContact O-CG 3.34Å; L227-E231 PolarHBondContact O-N 3.01Å; E231-R233 VanDerWaalsContact C-N 3.32Å; E231-R233 PolarHBondContact O-N 3.41Å; E231-G234 PolarHBondContact O-N 3.41Å; E231-H235 PolarHBondContact O-CD2 2.86Å; E231-H235 PolarHBondContact O-N 3.11Å
232Q94.8Very high93.8Very high122 Ų122103.5 Ų103.557%0.5750%0.502SS*.Hα-helixtrans-59.4-41.9175.1-75.6166.213.400112P228 H235 L236P228-Q232 VanDerWaalsContact O-CB 3.28Å; P228-Q232 WeakPolarHBondContact O-CB 3.48Å; P228-Q232 WeakPolarHBondContact O-CG 3.46Å; P228-Q232 PolarHBondContact O-N 3.26Å; Q232-H235 PolarHBondContact O-N 3.22Å; Q232-L236 VanDerWaalsContact O-CG 3.31Å; Q232-L236 WeakPolarHBondContact O-CG 3.39Å; Q232-L236 PolarHBondContact O-N 3.42Å
233R97Very high94.2Very high143 Ų143105.2 Ų105.254%0.5450%0.504SS..Hα-helixtrans-61.6-47.5175.6-171.5-174.971.2-149-7.6110.8R229 E230 E231 H235 L236 E237R229-R233 WeakPolarHBondContact O-CB 3.45Å; R229-R233 PolarHBondContact O-N 2.89Å; E230-R233 PolarHBondContact O-N 3.46Å; E231-R233 VanDerWaalsContact C-N 3.32Å; E231-R233 PolarHBondContact O-N 3.41Å; R233-H235 VanDerWaalsContact C-N 3.35Å; R233-H235 PolarHBondContact O-N 2.98Å; R233-L236 PolarHBondContact O-N 2.89Å; R233-E237 WeakPolarHBondContact CD-OE1 3.31Å; R233-E237 HydrophobicContact CG-CG 4.49Å; R233-E237 WeakPolarHBondContact CG-OE1 3.33Å; R233-E237 IonicContact NE-OE1 2.77Å; R233-E237 PolarHBondContact NE-OE1 3.3Å; R233-E237 WeakPolarHBondContact O-CB 3.3Å; R233-E237 VanDerWaalsContact O-CG 3.31Å; R233-E237 WeakPolarHBondContact O-CG 3.31Å; R233-E237 PolarHBondContact O-N 3.4Å
234G97.4Very high94.7Very high32 Ų32108.6 Ų108.633%0.3352%0.515SS..Hα-helixtrans-62.5-39.4177.900000113E230 E231 E237 L238E230-G234 PolarHBondContact O-N 3.26Å; E231-G234 PolarHBondContact O-N 3.41Å; G234-E237 PolarHBondContact O-N 3.31Å; G234-L238 WeakPolarHBondContact O-CB 3.49Å; G234-L238 PolarHBondContact O-N 2.93Å
235H98.2Very high95.3Very high122 Ų122105.5 Ų105.557%0.56550%0.501SS*.Hα-helixtrans-61-47.2173.4-80.9-62.9000111.9E231 Q232 R233 L238 E239E231-H235 PolarHBondContact O-CD2 2.86Å; E231-H235 PolarHBondContact O-N 3.11Å; Q232-H235 PolarHBondContact O-N 3.22Å; R233-H235 VanDerWaalsContact C-N 3.35Å; R233-H235 PolarHBondContact O-N 2.98Å; H235-L238 PolarHBondContact O-N 2.87Å; H235-E239 WeakPolarHBondContact O-CG 3.48Å; H235-E239 PolarHBondContact O-N 3.31Å
236L98.1Very high95.8Very high104 Ų104103.4 Ų103.455%0.54549%0.493SS..Hα-helixtrans-64.6-39.8177.8-70.4170.3000112.2Q232 R233 L238 E239 L240Q232-L236 VanDerWaalsContact O-CG 3.31Å; Q232-L236 WeakPolarHBondContact O-CG 3.39Å; Q232-L236 PolarHBondContact O-N 3.42Å; R233-L236 PolarHBondContact O-N 2.89Å; L236-L238 VanDerWaalsContact C-N 3.35Å; L236-E239 PolarHBondContact O-N 3.45Å; L236-L240 WeakPolarHBondContact O-CB 3.42Å; L236-L240 VanDerWaalsContact O-CG 3.3Å; L236-L240 WeakPolarHBondContact O-CG 3.34Å; L236-L240 PolarHBondContact O-N 2.88Å
237E98.3Very high96.2Very high94 Ų94105.3 Ų105.344%0.43950%0.503SS..Hα-helixtrans-61.4-43.6175.3-75168.2-174.200111.3R233 G234 L240 Q241R233-E237 WeakPolarHBondContact CD-OE1 3.31Å; R233-E237 HydrophobicContact CG-CG 4.49Å; R233-E237 WeakPolarHBondContact CG-OE1 3.33Å; R233-E237 IonicContact NE-OE1 2.77Å; R233-E237 PolarHBondContact NE-OE1 3.3Å; R233-E237 WeakPolarHBondContact O-CB 3.3Å; R233-E237 VanDerWaalsContact O-CG 3.31Å; R233-E237 WeakPolarHBondContact O-CG 3.31Å; R233-E237 PolarHBondContact O-N 3.4Å; G234-E237 PolarHBondContact O-N 3.31Å; E237-L240 PolarHBondContact O-N 2.91Å; E237-Q241 VanDerWaalsContact O-CG 3.29Å; E237-Q241 WeakPolarHBondContact O-CG 3.44Å; E237-Q241 PolarHBondContact O-N 2.97Å
238L98.4Very high96.9Very high104 Ų104107 Ų10755%0.54551%0.508SS..Hα-helixtrans-65.2-43.9176.5-165.278.5000111.4G234 H235 L236 L240 Q241 T242G234-L238 WeakPolarHBondContact O-CB 3.49Å; G234-L238 PolarHBondContact O-N 2.93Å; H235-L238 PolarHBondContact O-N 2.87Å; L236-L238 VanDerWaalsContact C-N 3.35Å; L238-L240 PolarHBondContact O-N 3.27Å; L238-Q241 PolarHBondContact O-N 3.47Å; L238-T242 WeakPolarHBondContact O-CG2 3.38Å; L238-T242 PolarHBondContact O-N 3.37Å; L238-T242 PolarHBondContact O-OG1 3.37Å
239E98.6Very high97.3Very high107 Ų107110.9 Ų110.950%0.552%0.516SS..Hα-helixtrans-59.6-45.4175.7-76.3-178.5-177.600111.4H235 L236 Q241 T242 R243H235-E239 WeakPolarHBondContact O-CG 3.48Å; H235-E239 PolarHBondContact O-N 3.31Å; L236-E239 PolarHBondContact O-N 3.45Å; E239-Q241 PolarHBondContact O-N 3.49Å; E239-T242 WeakPolarHBondContact CA-OG1 3.3Å; E239-T242 PolarHBondContact O-N 2.81Å; E239-T242 PolarHBondContact O-OG1 3.48Å; E239-R243 VanDerWaalsContact O-CG 3.3Å; E239-R243 WeakPolarHBondContact O-CG 3.37Å; E239-R243 PolarHBondContact O-N 3.41Å
240L98.6Very high97.7Very high107 Ų107104.8 Ų104.856%0.5651%0.505SS*.Hα-helixtrans-59.6-47.3175.7-74.5173.4000111.5L236 E237 L238 T242 R243 E244L236-L240 WeakPolarHBondContact O-CB 3.42Å; L236-L240 VanDerWaalsContact O-CG 3.3Å; L236-L240 WeakPolarHBondContact O-CG 3.34Å; L236-L240 PolarHBondContact O-N 2.88Å; E237-L240 PolarHBondContact O-N 2.91Å; L238-L240 PolarHBondContact O-N 3.27Å; L240-T242 VanDerWaalsContact C-N 3.32Å; L240-T242 PolarHBondContact O-N 3.12Å; L240-R243 PolarHBondContact O-N 3.26Å; L240-R243 VanDerWaalsContact O-N 3.12Å; L240-E244 WeakPolarHBondContact O-CB 3.3Å; L240-E244 WeakPolarHBondContact O-CG 3.48Å; L240-E244 PolarHBondContact O-N 2.86Å
241Q98.7Very high98Very high99 Ų99101.1 Ų101.146%0.46349%0.493SS..Hα-helixtrans-59.4-42176.8-73.2172.88.500112.3E237 L238 E239 R243 E244 Q245E237-Q241 VanDerWaalsContact O-CG 3.29Å; E237-Q241 WeakPolarHBondContact O-CG 3.44Å; E237-Q241 PolarHBondContact O-N 2.97Å; L238-Q241 PolarHBondContact O-N 3.47Å; E239-Q241 PolarHBondContact O-N 3.49Å; Q241-R243 VanDerWaalsContact C-N 3.32Å; Q241-R243 PolarHBondContact O-N 2.92Å; Q241-E244 PolarHBondContact O-N 3.38Å; Q241-Q245 VanDerWaalsContact O-CG 3.3Å; Q241-Q245 WeakPolarHBondContact O-CG 3.5Å; Q241-Q245 PolarHBondContact O-N 3.3Å
242T98.7Very high98.2Very high56 Ų5699.7 Ų99.734%0.34449%0.489SS..Hα-helixtrans-63.7-40176.559.30000111.7L238 E239 L240 Q245 E246L238-T242 WeakPolarHBondContact O-CG2 3.38Å; L238-T242 PolarHBondContact O-N 3.37Å; L238-T242 PolarHBondContact O-OG1 3.37Å; E239-T242 WeakPolarHBondContact CA-OG1 3.3Å; E239-T242 PolarHBondContact O-N 2.81Å; E239-T242 PolarHBondContact O-OG1 3.48Å; L240-T242 VanDerWaalsContact C-N 3.32Å; L240-T242 PolarHBondContact O-N 3.12Å; T242-Q245 PolarHBondContact O-N 2.97Å; T242-E246 WeakPolarHBondContact O-CG 3.34Å; T242-E246 PolarHBondContact O-N 2.98Å
243R98.6Very high98.4Very high147 Ų147102.1 Ų102.156%0.55549%0.492SS*.Hα-helixtrans-69.6-39.6178-68.5-70.6152.481.68.5112.2E239 L240 Q241 E246 L247E239-R243 VanDerWaalsContact O-CG 3.3Å; E239-R243 WeakPolarHBondContact O-CG 3.37Å; E239-R243 PolarHBondContact O-N 3.41Å; L240-R243 PolarHBondContact O-N 3.26Å; L240-R243 VanDerWaalsContact O-N 3.12Å; Q241-R243 VanDerWaalsContact C-N 3.32Å; Q241-R243 PolarHBondContact O-N 2.92Å; R243-E246 WeakPolarHBondContact CD-OE2 3.48Å; R243-E246 IonicContact NE-OE2 3.16Å; R243-E246 PolarHBondContact NE-OE2 3.42Å; R243-E246 PolarHBondContact O-N 2.98Å; R243-L247 VanDerWaalsContact O-CG 3.3Å; R243-L247 WeakPolarHBondContact O-CG 3.5Å; R243-L247 PolarHBondContact O-N 2.71Å
244E98.6Very high98.5Very high113 Ų113100.8 Ų100.853%0.52849%0.492SS..Hα-helixtrans-58.9-47.1172.9-74.2173171.600110.9L240 Q241 E246 L247 E248L240-E244 WeakPolarHBondContact O-CB 3.3Å; L240-E244 WeakPolarHBondContact O-CG 3.48Å; L240-E244 PolarHBondContact O-N 2.86Å; Q241-E244 PolarHBondContact O-N 3.38Å; E244-E246 VanDerWaalsContact C-N 3.35Å; E244-E246 PolarHBondContact O-N 3Å; E244-L247 WeakPolarHBondContact O-CB 3.21Å; E244-L247 PolarHBondContact O-N 3.03Å; E244-E248 WeakPolarHBondContact O-CG 3.3Å; E244-E248 PolarHBondContact O-N 2.84Å
245Q98.7Very high98.6Very high85 Ų85106.3 Ų106.340%0.39750%0.503SS..Hα-helixtrans-62.8-38.8175.9-70.2174.220.700112.9Q241 T242 L247 E248 R249Q241-Q245 VanDerWaalsContact O-CG 3.3Å; Q241-Q245 WeakPolarHBondContact O-CG 3.5Å; Q241-Q245 PolarHBondContact O-N 3.3Å; T242-Q245 PolarHBondContact O-N 2.97Å; Q245-L247 VanDerWaalsContact C-N 3.35Å; Q245-E248 PolarHBondContact O-N 3.19Å; Q245-R249 WeakPolarHBondContact O-CB 3.29Å; Q245-R249 WeakPolarHBondContact O-CG 3.35Å; Q245-R249 PolarHBondContact O-N 3.41Å
246E98.6Very high98.6Very high99 Ų99105.5 Ų105.546%0.46350%0.5SS..Hα-helixtrans-63.2-41.8174.6-75.6173175.300111.6T242 R243 E244 R249 A250T242-E246 WeakPolarHBondContact O-CG 3.34Å; T242-E246 PolarHBondContact O-N 2.98Å; R243-E246 WeakPolarHBondContact CD-OE2 3.48Å; R243-E246 IonicContact NE-OE2 3.16Å; R243-E246 PolarHBondContact NE-OE2 3.42Å; R243-E246 PolarHBondContact O-N 2.98Å; E244-E246 VanDerWaalsContact C-N 3.35Å; E244-E246 PolarHBondContact O-N 3Å; E246-R249 PolarHBondContact O-N 3.46Å; E246-A250 WeakPolarHBondContact O-CB 3.36Å; E246-A250 PolarHBondContact O-N 3.42Å
247L98.7Very high98.6Very high126 Ų126105.3 Ų105.366%0.6650%0.499SS*.Hα-helixtrans-64.9-41.6176-72.1172.5000111.8R243 E244 Q245 A250 G251R243-L247 VanDerWaalsContact O-CG 3.3Å; R243-L247 WeakPolarHBondContact O-CG 3.5Å; R243-L247 PolarHBondContact O-N 2.71Å; E244-L247 WeakPolarHBondContact O-CB 3.21Å; E244-L247 PolarHBondContact O-N 3.03Å; Q245-L247 VanDerWaalsContact C-N 3.35Å; L247-A250 PolarHBondContact O-N 2.81Å; L247-G251 PolarHBondContact O-N 3.47Å
248E98.6Very high98.6Very high134 Ų134104.7 Ų104.763%0.62650%0.496SS*.Hα-helixtrans-60.6-46.9174.3-72.9177.4169.600111.5E244 Q245 A250 G251 L252E244-E248 WeakPolarHBondContact O-CG 3.3Å; E244-E248 PolarHBondContact O-N 2.84Å; Q245-E248 PolarHBondContact O-N 3.19Å; E248-A250 PolarHBondContact O-N 3.24Å; E248-G251 PolarHBondContact O-N 3.34Å; E248-L252 WeakPolarHBondContact O-CG 3.28Å; E248-L252 PolarHBondContact O-N 2.87Å
249R98.8Very high98.6Very high134 Ų134105.8 Ų105.851%0.50650%0.498SS..Hα-helixtrans-61.6-43176.5-69.9167.8-167.8152.89.2111.7Q245 E246 G251 L252 R253Q245-R249 WeakPolarHBondContact O-CB 3.29Å; Q245-R249 WeakPolarHBondContact O-CG 3.35Å; Q245-R249 PolarHBondContact O-N 3.41Å; E246-R249 PolarHBondContact O-N 3.46Å; R249-G251 VanDerWaalsContact C-N 3.34Å; R249-L252 PolarHBondContact O-N 3.27Å; R249-R253 WeakPolarHBondContact O-CG 3.38Å; R249-R253 PolarHBondContact O-N 2.85Å; R249-R253 VanDerWaalsContact O-N 3.08Å
250A98.6Very high98.6Very high54 Ų54106.1 Ų106.145%0.44650%0.5SS..Hα-helixtrans-63.7-41.4176.200000111.3E246 L247 E248 L252 R253 Q254E246-A250 WeakPolarHBondContact O-CB 3.36Å; E246-A250 PolarHBondContact O-N 3.42Å; L247-A250 PolarHBondContact O-N 2.81Å; E248-A250 PolarHBondContact O-N 3.24Å; A250-L252 PolarHBondContact O-N 2.9Å; A250-R253 PolarHBondContact O-N 3.4Å; A250-Q254 WeakPolarHBondContact O-CB 3.34Å; A250-Q254 PolarHBondContact O-N 3.23Å
251G98.7Very high98.6Very high19 Ų19106.6 Ų106.620%0.19650%0.502CS..Hα-helixtrans-63.1-39.7176.400000113.1L247 E248 R249 Q254 R255L247-G251 PolarHBondContact O-N 3.47Å; E248-G251 PolarHBondContact O-N 3.34Å; R249-G251 VanDerWaalsContact C-N 3.34Å; G251-Q254 PolarHBondContact O-N 2.95Å; G251-R255 VanDerWaalsContact O-CG 3.31Å; G251-R255 WeakPolarHBondContact O-CG 3.45Å; G251-R255 PolarHBondContact O-N 2.96Å; G251-R255 VanDerWaalsContact O-N 3.08Å
252L98.7Very high98.6Very high93 Ų93108.1 Ų108.149%0.48751%0.509SS..Hα-helixtrans-63.5-47.9173.2-68.6174.5000111.5E248 R249 A250 Q254 R255 E256E248-L252 WeakPolarHBondContact O-CG 3.28Å; E248-L252 PolarHBondContact O-N 2.87Å; R249-L252 PolarHBondContact O-N 3.27Å; A250-L252 PolarHBondContact O-N 2.9Å; L252-Q254 VanDerWaalsContact C-N 3.3Å; L252-Q254 PolarHBondContact O-N 3.43Å; L252-R255 PolarHBondContact O-N 3.19Å; L252-E256 WeakPolarHBondContact O-CG 3.4Å; L252-E256 PolarHBondContact O-N 3.08Å
253R98.7Very high98.6Very high172 Ų172107.9 Ų107.965%0.64951%0.513SS*.Hα-helixtrans-59.7-40.1176.3-71.2176.2-178.2-170.81.4112.3R249 A250 E256 L257R249-R253 WeakPolarHBondContact O-CG 3.38Å; R249-R253 PolarHBondContact O-N 2.85Å; R249-R253 VanDerWaalsContact O-N 3.08Å; A250-R253 PolarHBondContact O-N 3.4Å; R253-E256 PolarHBondContact O-N 3.37Å; R253-L257 WeakPolarHBondContact O-CB 3.46Å; R253-L257 VanDerWaalsContact O-CG 3.28Å; R253-L257 WeakPolarHBondContact O-CG 3.49Å; R253-L257 PolarHBondContact O-N 2.85Å
254Q98.6Very high98.6Very high115 Ų115108.2 Ų108.254%0.53751%0.514SS..Hα-helixtrans-61.3-47.5176.5-178179.9-14.100110.9A250 G251 L252 E256 L257 E258A250-Q254 WeakPolarHBondContact O-CB 3.34Å; A250-Q254 PolarHBondContact O-N 3.23Å; G251-Q254 PolarHBondContact O-N 2.95Å; L252-Q254 VanDerWaalsContact C-N 3.3Å; L252-Q254 PolarHBondContact O-N 3.43Å; Q254-E256 VanDerWaalsContact C-N 3.33Å; Q254-E256 PolarHBondContact O-N 3.38Å; Q254-L257 PolarHBondContact O-N 3.3Å; Q254-E258 HydrophobicContact CG-CG 4.42Å; Q254-E258 WeakPolarHBondContact CG-OE1 3.42Å; Q254-E258 PolarHBondContact NE2-OE1 2.92Å; Q254-E258 WeakPolarHBondContact O-CB 3.39Å; Q254-E258 VanDerWaalsContact O-CG 3.31Å; Q254-E258 WeakPolarHBondContact O-CG 3.31Å; Q254-E258 PolarHBondContact O-N 3.43Å
255R98.7Very high98.6Very high149 Ų149106.3 Ų106.356%0.56251%0.511SS*.Hα-helixtrans-61.3-41.4177.3-68.6168.5-169.9155.34.4112G251 L252 E258 Q259G251-R255 VanDerWaalsContact O-CG 3.31Å; G251-R255 WeakPolarHBondContact O-CG 3.45Å; G251-R255 PolarHBondContact O-N 2.96Å; G251-R255 VanDerWaalsContact O-N 3.08Å; L252-R255 PolarHBondContact O-N 3.19Å; R255-E258 PolarHBondContact O-N 2.94Å; R255-Q259 WeakPolarHBondContact O-CB 3.37Å; R255-Q259 VanDerWaalsContact O-CG 3.26Å; R255-Q259 WeakPolarHBondContact O-CG 3.31Å; R255-Q259 PolarHBondContact O-N 2.95Å
256E98.8Very high98.6Very high105 Ų105104.4 Ų104.449%0.49151%0.509SS..Hα-helixtrans-60.6-46.1175.4-72.3169.3-175.100111.5L252 R253 Q254 Q259 Q260L252-E256 WeakPolarHBondContact O-CG 3.4Å; L252-E256 PolarHBondContact O-N 3.08Å; R253-E256 PolarHBondContact O-N 3.37Å; Q254-E256 VanDerWaalsContact C-N 3.33Å; Q254-E256 PolarHBondContact O-N 3.38Å; E256-Q259 PolarHBondContact O-N 3.45Å; E256-Q260 VanDerWaalsContact O-CG 3.31Å; E256-Q260 WeakPolarHBondContact O-CG 3.41Å; E256-Q260 PolarHBondContact O-N 2.86Å
257L98.6Very high98.6Very high100 Ų100104.1 Ų104.152%0.52451%0.508SS..Hα-helixtrans-65.9-40177.6-70.1173.2000112.1R253 Q254 Q259 Q260 L261R253-L257 WeakPolarHBondContact O-CB 3.46Å; R253-L257 VanDerWaalsContact O-CG 3.28Å; R253-L257 WeakPolarHBondContact O-CG 3.49Å; R253-L257 PolarHBondContact O-N 2.85Å; Q254-L257 PolarHBondContact O-N 3.3Å; L257-Q259 VanDerWaalsContact C-N 3.35Å; L257-Q260 PolarHBondContact O-N 3.08Å; L257-L261 WeakPolarHBondContact O-CG 3.29Å; L257-L261 PolarHBondContact O-N 3.5Å
258E98.6Very high98.6Very high81 Ų81103.7 Ų103.738%0.37950%0.502SS..Hα-helixtrans-60.8-44174.5-75.3170-17700111.3Q254 R255 L261 Q262Q254-E258 HydrophobicContact CG-CG 4.42Å; Q254-E258 WeakPolarHBondContact CG-OE1 3.42Å; Q254-E258 PolarHBondContact NE2-OE1 2.92Å; Q254-E258 WeakPolarHBondContact O-CB 3.39Å; Q254-E258 VanDerWaalsContact O-CG 3.31Å; Q254-E258 WeakPolarHBondContact O-CG 3.31Å; Q254-E258 PolarHBondContact O-N 3.43Å; R255-E258 PolarHBondContact O-N 2.94Å; E258-L261 PolarHBondContact O-N 3.21Å; E258-Q262 VanDerWaalsContact O-CG 3.29Å; E258-Q262 WeakPolarHBondContact O-CG 3.26Å; E258-Q262 PolarHBondContact O-N 2.7Å
259Q98.7Very high98.6Very high126 Ų126102.6 Ų102.659%0.58950%0.501SS*.Hα-helixtrans-62.9-42.1174.8-72.6171.21400111.9R255 E256 L257 Q262 A263R255-Q259 WeakPolarHBondContact O-CB 3.37Å; R255-Q259 VanDerWaalsContact O-CG 3.26Å; R255-Q259 WeakPolarHBondContact O-CG 3.31Å; R255-Q259 PolarHBondContact O-N 2.95Å; E256-Q259 PolarHBondContact O-N 3.45Å; L257-Q259 VanDerWaalsContact C-N 3.35Å; Q259-Q262 PolarHBondContact O-N 3.26Å; Q259-A263 WeakPolarHBondContact O-CB 3.49Å; Q259-A263 PolarHBondContact O-N 3.44Å
260Q98.6Very high98.6Very high114 Ų114102 Ų10253%0.53350%0.504SS..Hα-helixtrans-62.4-43.2175.7-72.9174.319.400111.7E256 L257 A263 R264E256-Q260 VanDerWaalsContact O-CG 3.31Å; E256-Q260 WeakPolarHBondContact O-CG 3.41Å; E256-Q260 PolarHBondContact O-N 2.86Å; L257-Q260 PolarHBondContact O-N 3.08Å; Q260-A263 PolarHBondContact O-N 3.43Å; Q260-R264 WeakPolarHBondContact O-CB 3.25Å; Q260-R264 VanDerWaalsContact O-CG 3.31Å; Q260-R264 WeakPolarHBondContact O-CG 3.43Å; Q260-R264 PolarHBondContact O-N 3.31Å
261L98.6Very high98.6Very high118 Ų118101.9 Ų101.962%0.61850%0.502SS*.Hα-helixtrans-62-45.7175.8-73.7173.5000111.1L257 E258 A263 R264 T265L257-L261 WeakPolarHBondContact O-CG 3.29Å; L257-L261 PolarHBondContact O-N 3.5Å; E258-L261 PolarHBondContact O-N 3.21Å; L261-A263 PolarHBondContact O-N 3.46Å; L261-R264 PolarHBondContact O-N 3.47Å; L261-T265 WeakPolarHBondContact O-CG2 3.31Å; L261-T265 PolarHBondContact O-N 3.36Å; L261-T265 PolarHBondContact O-OG1 2.92Å
262Q98.6Very high98.6Very high130 Ų130106.4 Ų106.461%0.60752%0.519SS*.Hα-helixtrans-58.9-47.4176.5-72.9172.65.200111.7E258 Q259 R264 T265 A266E258-Q262 VanDerWaalsContact O-CG 3.29Å; E258-Q262 WeakPolarHBondContact O-CG 3.26Å; E258-Q262 PolarHBondContact O-N 2.7Å; Q259-Q262 PolarHBondContact O-N 3.26Å; Q262-R264 PolarHBondContact O-N 3.33Å; Q262-T265 WeakPolarHBondContact CA-OG1 3.48Å; Q262-T265 PolarHBondContact O-N 3.14Å; Q262-T265 PolarHBondContact O-OG1 3.33Å; Q262-A266 PolarHBondContact O-N 3.37Å
263A98.6Very high98.5Very high51 Ų51104.1 Ų104.142%0.42151%0.513SS..Hα-helixtrans-58.9-45.9176.200000111.8Q259 Q260 L261 T265 A266 E267Q259-A263 WeakPolarHBondContact O-CB 3.49Å; Q259-A263 PolarHBondContact O-N 3.44Å; Q260-A263 PolarHBondContact O-N 3.43Å; L261-A263 PolarHBondContact O-N 3.46Å; A263-T265 VanDerWaalsContact C-N 3.35Å; A263-T265 PolarHBondContact O-N 3Å; A263-A266 WeakPolarHBondContact O-CB 3.31Å; A263-A266 PolarHBondContact O-N 3.21Å; A263-E267 WeakPolarHBondContact O-CG 3.23Å; A263-E267 PolarHBondContact O-N 2.92Å
264R98.5Very high98.5Very high155 Ų155101.4 Ų101.459%0.58551%0.508SS*.Hα-helixtrans-62.4-39.2176.1-71.5-56.4-169.9-174.1-0.2112.8Q260 L261 Q262 A266 E267 Q268Q260-R264 WeakPolarHBondContact O-CB 3.25Å; Q260-R264 VanDerWaalsContact O-CG 3.31Å; Q260-R264 WeakPolarHBondContact O-CG 3.43Å; Q260-R264 PolarHBondContact O-N 3.31Å; L261-R264 PolarHBondContact O-N 3.47Å; Q262-R264 PolarHBondContact O-N 3.33Å; R264-A266 VanDerWaalsContact C-N 3.35Å; R264-E267 VanDerWaalsContact CD-OE2 3.26Å; R264-E267 WeakPolarHBondContact CD-OE2 3.32Å; R264-E267 IonicContact CZ-OE2 2.93Å; R264-E267 IonicContact NE-OE2 2.83Å; R264-E267 IonicContact NH1-OE1 2.89Å; R264-E267 IonicContact NH1-OE2 3.69Å; R264-E267 PolarHBondContact NH1-OE2 2.9Å; R264-E267 PolarHBondContact O-N 3.4Å; R264-Q268 WeakPolarHBondContact O-CB 3.44Å; R264-Q268 VanDerWaalsContact O-CG 3.25Å; R264-Q268 WeakPolarHBondContact O-CG 3.5Å; R264-Q268 PolarHBondContact O-N 2.94Å
265T98.4Very high98.5Very high73 Ų73100.3 Ų100.345%0.44850%0.502SS..Hα-helixtrans-66.1-38.517657.20000111.8L261 Q262 A263 Q268 L269L261-T265 WeakPolarHBondContact O-CG2 3.31Å; L261-T265 PolarHBondContact O-N 3.36Å; L261-T265 PolarHBondContact O-OG1 2.92Å; Q262-T265 WeakPolarHBondContact CA-OG1 3.48Å; Q262-T265 PolarHBondContact O-N 3.14Å; Q262-T265 PolarHBondContact O-OG1 3.33Å; A263-T265 VanDerWaalsContact C-N 3.35Å; A263-T265 PolarHBondContact O-N 3Å; T265-Q268 PolarHBondContact O-N 2.92Å; T265-L269 VanDerWaalsContact O-CG 3.32Å; T265-L269 WeakPolarHBondContact O-CG 3.44Å; T265-L269 PolarHBondContact O-N 3.34Å
266A98.5Very high98.5Very high45 Ų4596 Ų9637%0.37249%0.493SS..Hα-helixtrans-63.6-48.5174.500000111.3Q262 A263 R264 Q268 L269 E270Q262-A266 PolarHBondContact O-N 3.37Å; A263-A266 WeakPolarHBondContact O-CB 3.31Å; A263-A266 PolarHBondContact O-N 3.21Å; R264-A266 VanDerWaalsContact C-N 3.35Å; A266-Q268 VanDerWaalsContact C-N 3.29Å; A266-Q268 PolarHBondContact O-N 2.95Å; A266-L269 PolarHBondContact O-N 2.82Å; A266-L269 VanDerWaalsContact O-N 3.14Å; A266-E270 WeakPolarHBondContact O-CG 3.42Å; A266-E270 PolarHBondContact O-N 2.92Å
267E98.4Very high98.5Very high92 Ų9296.8 Ų96.843%0.4350%0.496SS..Hα-helixtrans-56.6-41.9174.6-71.9173.4-177.700112A263 R264 E270 A271A263-E267 WeakPolarHBondContact O-CG 3.23Å; A263-E267 PolarHBondContact O-N 2.92Å; R264-E267 VanDerWaalsContact CD-OE2 3.26Å; R264-E267 WeakPolarHBondContact CD-OE2 3.32Å; R264-E267 IonicContact CZ-OE2 2.93Å; R264-E267 IonicContact NE-OE2 2.83Å; R264-E267 IonicContact NH1-OE1 2.89Å; R264-E267 IonicContact NH1-OE2 3.69Å; R264-E267 PolarHBondContact NH1-OE2 2.9Å; R264-E267 PolarHBondContact O-N 3.4Å; E267-E270 PolarHBondContact O-N 3.15Å; E267-A271 WeakPolarHBondContact O-CB 3.33Å; E267-A271 PolarHBondContact O-N 2.78Å
268Q98.4Very high98.5Very high117 Ų11797.9 Ų97.955%0.54750%0.502SS..Hα-helixtrans-63.9-42.7176.9-77.11754.100112.2R264 T265 A266 A271 Q272R264-Q268 WeakPolarHBondContact O-CB 3.44Å; R264-Q268 VanDerWaalsContact O-CG 3.25Å; R264-Q268 WeakPolarHBondContact O-CG 3.5Å; R264-Q268 PolarHBondContact O-N 2.94Å; T265-Q268 PolarHBondContact O-N 2.92Å; A266-Q268 VanDerWaalsContact C-N 3.29Å; A266-Q268 PolarHBondContact O-N 2.95Å; Q268-A271 PolarHBondContact O-N 3.1Å; Q268-Q272 WeakPolarHBondContact O-CB 3.26Å; Q268-Q272 VanDerWaalsContact O-CG 3.23Å; Q268-Q272 WeakPolarHBondContact O-CG 3.3Å; Q268-Q272 PolarHBondContact O-N 2.73Å
269L98.5Very high98.5Very high112 Ų112100.5 Ų100.559%0.58651%0.509SS*.Hα-helixtrans-64.9-41.4176.8-71.2171.7000111.4T265 A266 Q272 A273T265-L269 VanDerWaalsContact O-CG 3.32Å; T265-L269 WeakPolarHBondContact O-CG 3.44Å; T265-L269 PolarHBondContact O-N 3.34Å; A266-L269 PolarHBondContact O-N 2.82Å; A266-L269 VanDerWaalsContact O-N 3.14Å; L269-Q272 PolarHBondContact O-N 3.08Å; L269-A273 WeakPolarHBondContact O-CB 3.4Å; L269-A273 PolarHBondContact O-N 3.48Å
270E98.5Very high98.4Very high122 Ų122102.1 Ų102.157%0.5751%0.509SS*.Hα-helixtrans-62.6-46.6174.7-72.3179-176.900111.8A266 E267 Q272 A273 Q274A266-E270 WeakPolarHBondContact O-CG 3.42Å; A266-E270 PolarHBondContact O-N 2.92Å; E267-E270 PolarHBondContact O-N 3.15Å; E270-Q272 VanDerWaalsContact C-N 3.32Å; E270-Q272 PolarHBondContact O-N 3.49Å; E270-A273 WeakPolarHBondContact O-CB 3.36Å; E270-A273 PolarHBondContact O-N 3.22Å; E270-Q274 WeakPolarHBondContact O-CG 3.26Å; E270-Q274 PolarHBondContact O-N 2.75Å
271A98.3Very high98.4Very high51 Ų5199 Ų9942%0.42150%0.503SS..Hα-helixtrans-62.1-39.6176.700000111.9E267 Q268 Q274 H275E267-A271 WeakPolarHBondContact O-CB 3.33Å; E267-A271 PolarHBondContact O-N 2.78Å; Q268-A271 PolarHBondContact O-N 3.1Å; A271-Q274 PolarHBondContact O-N 3.44Å; A271-H275 VanDerWaalsContact O-CB 3.26Å; A271-H275 WeakPolarHBondContact O-CB 3.34Å; A271-H275 PolarHBondContact O-N 3.26Å
272Q98.5Very high98.4Very high114 Ų114100.2 Ų100.253%0.53350%0.5SS..Hα-helixtrans-62.8-44.6173.2-74.8172.812.500111.4Q268 L269 E270 Q274 H275 T276Q268-Q272 WeakPolarHBondContact O-CB 3.26Å; Q268-Q272 VanDerWaalsContact O-CG 3.23Å; Q268-Q272 WeakPolarHBondContact O-CG 3.3Å; Q268-Q272 PolarHBondContact O-N 2.73Å; L269-Q272 PolarHBondContact O-N 3.08Å; E270-Q272 VanDerWaalsContact C-N 3.32Å; E270-Q272 PolarHBondContact O-N 3.49Å; Q272-Q274 PolarHBondContact O-N 2.98Å; Q272-H275 PolarHBondContact O-N 2.89Å; Q272-T276 WeakPolarHBondContact O-CG2 3.48Å; Q272-T276 PolarHBondContact O-N 3.41Å; Q272-T276 PolarHBondContact O-OG1 2.89Å
273A98.4Very high98.4Very high45 Ų4599.6 Ų99.637%0.37250%0.497SS..Hα-helixtrans-59.4-49176.500000111.1L269 E270 H275 T276 Q277L269-A273 WeakPolarHBondContact O-CB 3.4Å; L269-A273 PolarHBondContact O-N 3.48Å; E270-A273 WeakPolarHBondContact O-CB 3.36Å; E270-A273 PolarHBondContact O-N 3.22Å; A273-H275 VanDerWaalsContact C-N 3.33Å; A273-H275 PolarHBondContact O-N 3.47Å; A273-T276 PolarHBondContact O-N 3.26Å; A273-T276 PolarHBondContact O-OG1 3.18Å; A273-Q277 WeakPolarHBondContact O-CG 3.34Å; A273-Q277 PolarHBondContact O-N 2.91Å
274Q98.1Very high98.4Very high115 Ų115101 Ų10154%0.53750%0.501SS..Hα-helixtrans-59.1-43.5175.7-69.3172.93.700111.8E270 A271 Q272 T276 Q277 L278E270-Q274 WeakPolarHBondContact O-CG 3.26Å; E270-Q274 PolarHBondContact O-N 2.75Å; A271-Q274 PolarHBondContact O-N 3.44Å; Q272-Q274 PolarHBondContact O-N 2.98Å; Q274-T276 PolarHBondContact O-N 2.86Å; Q274-Q277 WeakPolarHBondContact O-CB 3.33Å; Q274-Q277 PolarHBondContact O-N 3.43Å; Q274-L278 WeakPolarHBondContact O-CG 3.44Å; Q274-L278 PolarHBondContact O-N 2.91Å
275H98.4Very high98.4Very high91 Ų9198.9 Ų98.942%0.42150%0.499SS..Hα-helixtrans-63.7-41.9178.6-172.461.1000112.1A271 Q272 A273 Q277 L278 R279A271-H275 VanDerWaalsContact O-CB 3.26Å; A271-H275 WeakPolarHBondContact O-CB 3.34Å; A271-H275 PolarHBondContact O-N 3.26Å; Q272-H275 PolarHBondContact O-N 2.89Å; A273-H275 VanDerWaalsContact C-N 3.33Å; A273-H275 PolarHBondContact O-N 3.47Å; H275-Q277 VanDerWaalsContact C-N 3.33Å; H275-Q277 PolarHBondContact O-N 3.38Å; H275-L278 PolarHBondContact O-N 3.43Å; H275-R279 VanDerWaalsContact CD2-CZ 3.48Å; H275-R279 PolarHBondContact CD2-NE 3.4Å; H275-R279 PolarHBondContact CD2-NH2 3.35Å; H275-R279 PolarHBondContact NE2-NE 3.46Å; H275-R279 PolarHBondContact NE2-NH2 3.03Å; H275-R279 WeakPolarHBondContact O-CG 3.34Å; H275-R279 PolarHBondContact O-N 3.41Å
276T98.3Very high98.4Very high59 Ų59101.9 Ų101.936%0.36250%0.503SS..Hα-helixtrans-64.4-37.2174.463.40000112.3Q272 A273 Q274 R279 R280Q272-T276 WeakPolarHBondContact O-CG2 3.48Å; Q272-T276 PolarHBondContact O-N 3.41Å; Q272-T276 PolarHBondContact O-OG1 2.89Å; A273-T276 PolarHBondContact O-N 3.26Å; A273-T276 PolarHBondContact O-OG1 3.18Å; Q274-T276 PolarHBondContact O-N 2.86Å; T276-R279 PolarHBondContact O-N 3.5Å; T276-R280 VanDerWaalsContact O-CG 3.3Å; T276-R280 WeakPolarHBondContact O-CG 3.46Å; T276-R280 PolarHBondContact O-N 3.47Å; T276-R280 VanDerWaalsContact O-N 3.08Å
277Q98.4Very high98.3Very high122 Ų122102.4 Ų102.457%0.5751%0.507SS*.Hα-helixtrans-63.9-46.5174.8-71.1171.8-3.600111.5A273 Q274 H275 R280 A281A273-Q277 WeakPolarHBondContact O-CG 3.34Å; A273-Q277 PolarHBondContact O-N 2.91Å; Q274-Q277 WeakPolarHBondContact O-CB 3.33Å; Q274-Q277 PolarHBondContact O-N 3.43Å; H275-Q277 VanDerWaalsContact C-N 3.33Å; H275-Q277 PolarHBondContact O-N 3.38Å; Q277-R280 PolarHBondContact O-N 3.35Å; Q277-A281 PolarHBondContact O-N 3.22Å
278L98.5Very high98.3Very high122 Ų122103.6 Ų103.664%0.63951%0.512SS*.Hα-helixtrans-63.6-40.5177.3-71.9174.1000112.3Q274 H275 R280 A281 Y282Q274-L278 WeakPolarHBondContact O-CG 3.44Å; Q274-L278 PolarHBondContact O-N 2.91Å; H275-L278 PolarHBondContact O-N 3.43Å; L278-R280 PolarHBondContact O-N 2.87Å; L278-A281 PolarHBondContact O-N 2.88Å; L278-Y282 WeakPolarHBondContact O-CB 3.47Å; L278-Y282 PolarHBondContact O-N 2.85Å
279R98.6Very high98.3Very high137 Ų137102.5 Ų102.552%0.51751%0.51SS..Hα-helixtrans-58.8-47.4174.2-75.7-174.6-161.3-173.76111.6H275 T276 A281 Y282 E283H275-R279 VanDerWaalsContact CD2-CZ 3.48Å; H275-R279 PolarHBondContact CD2-NE 3.4Å; H275-R279 PolarHBondContact CD2-NH2 3.35Å; H275-R279 PolarHBondContact NE2-NE 3.46Å; H275-R279 PolarHBondContact NE2-NH2 3.03Å; H275-R279 WeakPolarHBondContact O-CG 3.34Å; H275-R279 PolarHBondContact O-N 3.41Å; T276-R279 PolarHBondContact O-N 3.5Å; R279-A281 VanDerWaalsContact C-N 3.33Å; R279-A281 PolarHBondContact O-N 2.9Å; R279-Y282 WeakPolarHBondContact O-CB 3.38Å; R279-Y282 PolarHBondContact O-N 3.5Å; R279-E283 WeakPolarHBondContact O-CG 3.42Å; R279-E283 PolarHBondContact O-N 3.31Å
280R98.4Very high98.3Very high160 Ų160100.2 Ų100.260%0.60450%0.498SS*.Hα-helixtrans-59.7-44.2176.8-70171.1-172.7166.73.9111.4T276 Q277 L278 E283 V284T276-R280 VanDerWaalsContact O-CG 3.3Å; T276-R280 WeakPolarHBondContact O-CG 3.46Å; T276-R280 PolarHBondContact O-N 3.47Å; T276-R280 VanDerWaalsContact O-N 3.08Å; Q277-R280 PolarHBondContact O-N 3.35Å; L278-R280 PolarHBondContact O-N 2.87Å; R280-E283 PolarHBondContact O-N 3.43Å; R280-V284 WeakPolarHBondContact O-CG2 3.46Å; R280-V284 PolarHBondContact O-N 3.38Å
281A98.1Very high98.3Very high48 Ų4899.6 Ų99.640%0.39750%0.495SS..Hα-helixtrans-63-42.2176.800000112.1Q277 L278 R279 V284 I285Q277-A281 PolarHBondContact O-N 3.22Å; L278-A281 PolarHBondContact O-N 2.88Å; R279-A281 VanDerWaalsContact C-N 3.33Å; R279-A281 PolarHBondContact O-N 2.9Å; A281-V284 PolarHBondContact O-N 2.9Å; A281-I285 WeakPolarHBondContact O-CG1 3.37Å; A281-I285 PolarHBondContact O-N 2.96Å
282Y98.1Very high98.2Very high144 Ų14499 Ų9957%0.56549%0.491SS*.Hα-helixtrans-61.5-44.6175173.4-96.9000112L278 R279 V284 I285 R286L278-Y282 WeakPolarHBondContact O-CB 3.47Å; L278-Y282 PolarHBondContact O-N 2.85Å; R279-Y282 WeakPolarHBondContact O-CB 3.38Å; R279-Y282 PolarHBondContact O-N 3.5Å; Y282-V284 VanDerWaalsContact C-N 3.33Å; Y282-V284 PolarHBondContact O-N 2.99Å; Y282-I285 PolarHBondContact O-N 3.46Å; Y282-R286 VanDerWaalsContact O-CB 3.28Å; Y282-R286 WeakPolarHBondContact O-CB 3.43Å; Y282-R286 PolarHBondContact O-N 3.21Å
283E98.4Very high98.2Very high117 Ų11798.3 Ų98.355%0.54749%0.487SS..Hα-helixtrans-60.5-41.7176.4-74.1166.4-172.400111.8R279 R280 R286 A287R279-E283 WeakPolarHBondContact O-CG 3.42Å; R279-E283 PolarHBondContact O-N 3.31Å; R280-E283 PolarHBondContact O-N 3.43Å; E283-R286 PolarHBondContact O-N 2.92Å; E283-A287 WeakPolarHBondContact O-CB 3.5Å; E283-A287 PolarHBondContact O-N 3.29Å
284V98.4Very high98.1Very high81 Ų81102.7 Ų102.749%0.49150%0.5SS..Hα-helixtrans-62.9-47.9175.5171.40000111.4R280 A281 Y282 R286 A287 Q288R280-V284 WeakPolarHBondContact O-CG2 3.46Å; R280-V284 PolarHBondContact O-N 3.38Å; A281-V284 PolarHBondContact O-N 2.9Å; Y282-V284 VanDerWaalsContact C-N 3.33Å; Y282-V284 PolarHBondContact O-N 2.99Å; V284-R286 VanDerWaalsContact C-N 3.3Å; V284-R286 PolarHBondContact O-N 3.41Å; V284-A287 PolarHBondContact O-N 2.89Å; V284-Q288 WeakPolarHBondContact O-CG 3.36Å; V284-Q288 PolarHBondContact O-N 3.48Å
285I98.1Very high98.1Very high109 Ų109102.3 Ų102.356%0.55950%0.498SS*.Hα-helixtrans-63.9-39.4178.7-67.1167.4000110.6A281 Y282 Q288 L289A281-I285 WeakPolarHBondContact O-CG1 3.37Å; A281-I285 PolarHBondContact O-N 2.96Å; Y282-I285 PolarHBondContact O-N 3.46Å; I285-Q288 WeakPolarHBondContact O-CB 3.34Å; I285-Q288 PolarHBondContact O-N 2.88Å; I285-L289 WeakPolarHBondContact O-CB 3.4Å; I285-L289 PolarHBondContact O-N 2.89Å
286R98.4Very high98Very high137 Ų137102.7 Ų102.752%0.51750%0.503SS..Hα-helixtrans-62.2-46.3175.9-176177.2177.6176.11.4111.4Y282 E283 V284 Q288 L289 D290Y282-R286 VanDerWaalsContact O-CB 3.28Å; Y282-R286 WeakPolarHBondContact O-CB 3.43Å; Y282-R286 PolarHBondContact O-N 3.21Å; E283-R286 PolarHBondContact O-N 2.92Å; V284-R286 VanDerWaalsContact C-N 3.3Å; V284-R286 PolarHBondContact O-N 3.41Å; R286-Q288 VanDerWaalsContact C-N 3.29Å; R286-Q288 PolarHBondContact O-N 3.12Å; R286-L289 WeakPolarHBondContact O-CB 3.28Å; R286-L289 PolarHBondContact O-N 3.38Å; R286-L289 VanDerWaalsContact O-N 3.12Å; R286-D290 VanDerWaalsContact O-CG 3.29Å; R286-D290 PolarHBondContact O-N 3.29Å
287A97.8Very high98Very high56 Ų56103.5 Ų103.546%0.46351%0.511SS..Hα-helixtrans-60.6-38.9175.600000112.2E283 V284 D290 Q291E283-A287 WeakPolarHBondContact O-CB 3.5Å; E283-A287 PolarHBondContact O-N 3.29Å; V284-A287 PolarHBondContact O-N 2.89Å; A287-D290 PolarHBondContact O-N 2.99Å; A287-Q291 WeakPolarHBondContact O-CB 3.48Å; A287-Q291 PolarHBondContact O-N 3.32Å
288Q97.8Very high98Very high116 Ų116106 Ų10654%0.54252%0.515SS..Hα-helixtrans-64.9-39.1173.8-71.5174.4-5.600112.4V284 I285 R286 A292V284-Q288 WeakPolarHBondContact O-CG 3.36Å; V284-Q288 PolarHBondContact O-N 3.48Å; I285-Q288 WeakPolarHBondContact O-CB 3.34Å; I285-Q288 PolarHBondContact O-N 2.88Å; R286-Q288 VanDerWaalsContact C-N 3.29Å; R286-Q288 PolarHBondContact O-N 3.12Å; Q288-A292 WeakPolarHBondContact O-CB 3.33Å; Q288-A292 PolarHBondContact O-N 2.94Å
289L98.4Very high97.9Very high94 Ų94105.2 Ų105.249%0.49251%0.511SS..Hα-helixtrans-65.1-46.9176.2-179.865.1000111I285 R286 Q291 A292 Q293I285-L289 WeakPolarHBondContact O-CB 3.4Å; I285-L289 PolarHBondContact O-N 2.89Å; R286-L289 WeakPolarHBondContact O-CB 3.28Å; R286-L289 PolarHBondContact O-N 3.38Å; R286-L289 VanDerWaalsContact O-N 3.12Å; L289-Q291 VanDerWaalsContact C-N 3.33Å; L289-Q291 PolarHBondContact O-N 3.01Å; L289-A292 PolarHBondContact O-N 2.83Å; L289-A292 VanDerWaalsContact O-N 3.17Å; L289-Q293 HydrophobicContact CD1-CG 4.5Å; L289-Q293 WeakPolarHBondContact O-CG 3.49Å; L289-Q293 PolarHBondContact O-N 2.86Å
290D98.1Very high97.8Very high65 Ų65104.3 Ų104.335%0.34851%0.513SS..Hα-helixtrans-59.7-45.6177.5-65.5-23.6000110R286 A287 A292 Q293 E294R286-D290 VanDerWaalsContact O-CG 3.29Å; R286-D290 PolarHBondContact O-N 3.29Å; A287-D290 PolarHBondContact O-N 2.99Å; D290-A292 PolarHBondContact O-N 3.31Å; D290-Q293 PolarHBondContact O-N 3.45Å; D290-E294 WeakPolarHBondContact O-CG 3.31Å; D290-E294 PolarHBondContact O-N 2.83Å
291Q98.1Very high97.7Very high108 Ų10898.4 Ų98.451%0.50550%0.502SS..Hα-helixtrans-60.2-42.6174.4-174.6-18010.600112.5A287 L289 E294 Q295A287-Q291 WeakPolarHBondContact O-CB 3.48Å; A287-Q291 PolarHBondContact O-N 3.32Å; L289-Q291 VanDerWaalsContact C-N 3.33Å; L289-Q291 PolarHBondContact O-N 3.01Å; Q291-E294 PolarHBondContact O-N 3.5Å; Q291-Q295 WeakPolarHBondContact O-CB 3.36Å; Q291-Q295 VanDerWaalsContact O-CG 3.24Å; Q291-Q295 WeakPolarHBondContact O-CG 3.42Å; Q291-Q295 PolarHBondContact O-N 2.9Å
292A97.3Very high97.7Very high40 Ų4099.4 Ų99.433%0.33150%0.498SS..Hα-helixtrans-65.6-38.7177.200000111.9Q288 L289 D290 Q295 L296Q288-A292 WeakPolarHBondContact O-CB 3.33Å; Q288-A292 PolarHBondContact O-N 2.94Å; L289-A292 PolarHBondContact O-N 2.83Å; L289-A292 VanDerWaalsContact O-N 3.17Å; D290-A292 PolarHBondContact O-N 3.31Å; A292-Q295 PolarHBondContact O-N 3.32Å; A292-L296 WeakPolarHBondContact O-CB 3.38Å; A292-L296 VanDerWaalsContact O-CG 3.3Å; A292-L296 WeakPolarHBondContact O-CG 3.37Å; A292-L296 PolarHBondContact O-N 3.38Å
293Q97.6Very high97.6Very high98 Ų9895.1 Ų95.146%0.45849%0.493SS..Hα-helixtrans-65.9-41.6175.1-73176.72.100112.1L289 D290 L296 S297L289-Q293 HydrophobicContact CD1-CG 4.5Å; L289-Q293 WeakPolarHBondContact O-CG 3.49Å; L289-Q293 PolarHBondContact O-N 2.86Å; D290-Q293 PolarHBondContact O-N 3.45Å; Q293-L296 PolarHBondContact O-N 2.87Å; Q293-S297 WeakPolarHBondContact O-CB 3.24Å; Q293-S297 PolarHBondContact O-N 3.33Å; Q293-S297 PolarHBondContact O-OG 3.39Å
294E97.6Very high97.5Very high138 Ų13895.5 Ų95.565%0.64550%0.495SS*.Hα-helixtrans-61.6-44173.3-73.7176.9178.900111.2D290 Q291 S297 R298D290-E294 WeakPolarHBondContact O-CG 3.31Å; D290-E294 PolarHBondContact O-N 2.83Å; Q291-E294 PolarHBondContact O-N 3.5Å; E294-S297 PolarHBondContact O-N 3.42Å; E294-R298 WeakPolarHBondContact O-CB 3.46Å; E294-R298 PolarHBondContact O-N 2.95Å
295Q97.1Very high97.4Very high106 Ų10693.2 Ų93.250%0.49549%0.488SS..Hα-helixtrans-61.1-44174.9-74173.417800112Q291 A292 R298 L299Q291-Q295 WeakPolarHBondContact O-CB 3.36Å; Q291-Q295 VanDerWaalsContact O-CG 3.24Å; Q291-Q295 WeakPolarHBondContact O-CG 3.42Å; Q291-Q295 PolarHBondContact O-N 2.9Å; A292-Q295 PolarHBondContact O-N 3.32Å; Q295-R298 PolarHBondContact O-N 3.43Å; Q295-L299 WeakPolarHBondContact O-CB 3.3Å; Q295-L299 VanDerWaalsContact O-CG 3.31Å; Q295-L299 WeakPolarHBondContact O-CG 3.5Å; Q295-L299 PolarHBondContact O-N 2.95Å
296L97.5Very high97.3Very high100 Ų10096.2 Ų96.252%0.52449%0.492SS..Hα-helixtrans-62.2-48.4176.1-74.7171.5000111.1A292 Q293 R298 L299 E300A292-L296 WeakPolarHBondContact O-CB 3.38Å; A292-L296 VanDerWaalsContact O-CG 3.3Å; A292-L296 WeakPolarHBondContact O-CG 3.37Å; A292-L296 PolarHBondContact O-N 3.38Å; Q293-L296 PolarHBondContact O-N 2.87Å; L296-R298 VanDerWaalsContact C-N 3.27Å; L296-R298 PolarHBondContact O-N 2.86Å; L296-L299 PolarHBondContact O-N 2.93Å; L296-L299 VanDerWaalsContact O-N 3.13Å; L296-E300 WeakPolarHBondContact O-CB 3.47Å; L296-E300 WeakPolarHBondContact O-CG 3.26Å; L296-E300 PolarHBondContact O-N 2.83Å
297S97.3Very high97.1Very high75 Ų7594.9 Ų94.952%0.52449%0.491SS..Hα-helixtrans-59.1-40.2178.3-56.50000111.7Q293 E294 G301Q293-S297 WeakPolarHBondContact O-CB 3.24Å; Q293-S297 PolarHBondContact O-N 3.33Å; Q293-S297 PolarHBondContact O-OG 3.39Å; E294-S297 PolarHBondContact O-N 3.42Å; S297-G301 PolarHBondContact O-N 2.89Å
298R98Very high97Very high176 Ų17696.5 Ų96.566%0.66449%0.489SS*.Hα-helixtrans-63.4-48.8174.2178.3-179.2169.7169.91.8111.7E294 Q295 L296 E300 G301 E302E294-R298 WeakPolarHBondContact O-CB 3.46Å; E294-R298 PolarHBondContact O-N 2.95Å; Q295-R298 PolarHBondContact O-N 3.43Å; L296-R298 VanDerWaalsContact C-N 3.27Å; L296-R298 PolarHBondContact O-N 2.86Å; R298-E300 VanDerWaalsContact C-N 3.34Å; R298-E300 PolarHBondContact O-N 3.17Å; R298-G301 PolarHBondContact O-N 2.86Å; R298-E302 IonicContact CZ-OE1 3.99Å; R298-E302 IonicContact NE-OE1 4Å; R298-E302 PolarHBondContact NE-OE1 3.09Å; R298-E302 IonicContact NH2-OE1 3.91Å; R298-E302 WeakPolarHBondContact O-CG 3.36Å; R298-E302 PolarHBondContact O-N 2.91Å
299L97.1Very high96.9Very high104 Ų10495.1 Ų95.155%0.54548%0.483SS..Hα-helixtrans-64.5-38179.4-72174.2000112Q295 L296 E302 A303Q295-L299 WeakPolarHBondContact O-CB 3.3Å; Q295-L299 VanDerWaalsContact O-CG 3.31Å; Q295-L299 WeakPolarHBondContact O-CG 3.5Å; Q295-L299 PolarHBondContact O-N 2.95Å; L296-L299 PolarHBondContact O-N 2.93Å; L296-L299 VanDerWaalsContact O-N 3.13Å; L299-E302 PolarHBondContact O-N 2.81Å; L299-A303 VanDerWaalsContact O-CB 3.28Å; L299-A303 WeakPolarHBondContact O-CB 3.48Å; L299-A303 PolarHBondContact O-N 3.42Å
300E96.7Very high96.7Very high118 Ų11893.8 Ų93.855%0.55148%0.479SS*.Hα-helixtrans-62.2-46.1172.5-74.6177.9172.900111.2L296 R298 A303 Q304L296-E300 WeakPolarHBondContact O-CB 3.47Å; L296-E300 WeakPolarHBondContact O-CG 3.26Å; L296-E300 PolarHBondContact O-N 2.83Å; R298-E300 VanDerWaalsContact C-N 3.34Å; R298-E300 PolarHBondContact O-N 3.17Å; E300-A303 PolarHBondContact O-N 3.45Å; E300-Q304 WeakPolarHBondContact O-CB 3.44Å; E300-Q304 VanDerWaalsContact O-CG 3.26Å; E300-Q304 WeakPolarHBondContact O-CG 3.31Å; E300-Q304 PolarHBondContact O-N 2.82Å
301G96.9Very high96.5Very high37 Ų3795.6 Ų95.638%0.38149%0.485SS..Hα-helixtrans-61.2-42.2174.300000112.9S297 R298 Q304 G305S297-G301 PolarHBondContact O-N 2.89Å; R298-G301 PolarHBondContact O-N 2.86Å; G301-Q304 PolarHBondContact O-N 3.48Å; G301-G305 PolarHBondContact O-N 2.89Å
302E97.1Very high96.4Very high68 Ų6897.2 Ų97.232%0.31849%0.487SS..Hα-helixtrans-63.9-41.5174-72.8177-166.300111.8R298 L299 G305 R306R298-E302 IonicContact CZ-OE1 3.99Å; R298-E302 IonicContact NE-OE1 4Å; R298-E302 PolarHBondContact NE-OE1 3.09Å; R298-E302 IonicContact NH2-OE1 3.91Å; R298-E302 WeakPolarHBondContact O-CG 3.36Å; R298-E302 PolarHBondContact O-N 2.91Å; L299-E302 PolarHBondContact O-N 2.81Å; E302-G305 PolarHBondContact O-N 2.93Å; E302-R306 WeakPolarHBondContact O-CB 3.4Å; E302-R306 VanDerWaalsContact O-CG 3.31Å; E302-R306 WeakPolarHBondContact O-CG 3.35Å; E302-R306 PolarHBondContact O-N 3.41Å; E302-R306 IonicContact OE2-NH2 3.02Å
303A96.3Very high96.3Very high55 Ų5599 Ų9946%0.45549%0.491SS..Hα-helixtrans-66.5-42.7177.200000112L299 E300 R306 Q307L299-A303 VanDerWaalsContact O-CB 3.28Å; L299-A303 WeakPolarHBondContact O-CB 3.48Å; L299-A303 PolarHBondContact O-N 3.42Å; E300-A303 PolarHBondContact O-N 3.45Å; A303-R306 PolarHBondContact O-N 2.81Å; A303-Q307 WeakPolarHBondContact O-CB 3.34Å; A303-Q307 PolarHBondContact O-N 3.34Å
304Q96.3Very high96.2Very high125 Ų12598.7 Ų98.758%0.58450%0.496SS*.Hα-helixtrans-61.5-47.2172.8-73.4172.53.400110.9E300 G301 R306 Q307 E308E300-Q304 WeakPolarHBondContact O-CB 3.44Å; E300-Q304 VanDerWaalsContact O-CG 3.26Å; E300-Q304 WeakPolarHBondContact O-CG 3.31Å; E300-Q304 PolarHBondContact O-N 2.82Å; G301-Q304 PolarHBondContact O-N 3.48Å; Q304-R306 PolarHBondContact O-N 3.27Å; Q304-Q307 CarbonylContact O-C 3.59Å; Q304-Q307 WeakPolarHBondContact O-CB 3.37Å; Q304-Q307 PolarHBondContact O-N 3.26Å; Q304-Q307 VanDerWaalsContact O-N 3.09Å; Q304-E308 WeakPolarHBondContact O-CG 3.46Å; Q304-E308 PolarHBondContact O-N 3.41Å
305G95.9Very high96.1Very high33 Ų3396.8 Ų96.834%0.3449%0.493SS..Hα-helixtrans-60-41.9176.300000112.9G301 E302 E308 Q309G301-G305 PolarHBondContact O-N 2.89Å; E302-G305 PolarHBondContact O-N 2.93Å; G305-E308 PolarHBondContact O-N 3.35Å; G305-Q309 WeakPolarHBondContact O-CB 3.47Å; G305-Q309 PolarHBondContact O-N 2.84Å
306R95.9Very high96.1Very high171 Ų17193.9 Ų93.965%0.64549%0.487SS*.Hα-helixtrans-62.3-42.2172.2-74.4177.2-167.6161.210111.6E302 A303 Q304 Q309 T310E302-R306 WeakPolarHBondContact O-CB 3.4Å; E302-R306 VanDerWaalsContact O-CG 3.31Å; E302-R306 WeakPolarHBondContact O-CG 3.35Å; E302-R306 PolarHBondContact O-N 3.41Å; E302-R306 IonicContact OE2-NH2 3.02Å; A303-R306 PolarHBondContact O-N 2.81Å; Q304-R306 PolarHBondContact O-N 3.27Å; R306-Q309 PolarHBondContact O-N 3.4Å; R306-T310 WeakPolarHBondContact O-CG2 3.28Å; R306-T310 PolarHBondContact O-N 2.98Å; R306-T310 PolarHBondContact O-OG1 3.13Å
307Q94.2Very high96.1Very high109 Ų10993.4 Ų93.451%0.50949%0.488SS..Hα-helixtrans-66.5-40.8178.7-178.764.7-000112.3A303 Q304 Q309 T310 Q311A303-Q307 WeakPolarHBondContact O-CB 3.34Å; A303-Q307 PolarHBondContact O-N 3.34Å; Q304-Q307 CarbonylContact O-C 3.59Å; Q304-Q307 WeakPolarHBondContact O-CB 3.37Å; Q304-Q307 PolarHBondContact O-N 3.26Å; Q304-Q307 VanDerWaalsContact O-N 3.09Å; Q307-Q309 VanDerWaalsContact C-N 3.31Å; Q307-T310 WeakPolarHBondContact CA-OG1 3.28Å; Q307-T310 PolarHBondContact O-N 2.84Å; Q307-T310 PolarHBondContact O-OG1 2.87Å; Q307-T310 PolarHBondContact OE1-OG1 3.16Å; Q307-Q311 WeakPolarHBondContact O-CB 3.38Å; Q307-Q311 VanDerWaalsContact O-CG 3.22Å; Q307-Q311 WeakPolarHBondContact O-CG 3.47Å; Q307-Q311 PolarHBondContact O-N 3.47Å
308E95.9Very high95.9Very high90 Ų9092.6 Ų92.642%0.42148%0.482SS..Hα-helixtrans-62.8-41.3171.9-72.5-176.4-173.300111.2Q304 G305 Q311 R312Q304-E308 WeakPolarHBondContact O-CG 3.46Å; Q304-E308 PolarHBondContact O-N 3.41Å; G305-E308 PolarHBondContact O-N 3.35Å; E308-Q311 PolarHBondContact O-N 2.88Å; E308-R312 VanDerWaalsContact O-CG 3.28Å; E308-R312 WeakPolarHBondContact O-CG 3.36Å; E308-R312 PolarHBondContact O-N 3.41Å; E308-R312 IonicContact OE2-CZ 3.67Å; E308-R312 IonicContact OE2-NH1 3.64Å; E308-R312 IonicContact OE2-NH2 3.85Å; E308-R312 PolarHBondContact OE2-NH2 2.9Å
309Q95.1Very high95.8Very high87 Ų8792.3 Ų92.341%0.40748%0.481SS..Hα-helixtrans-64.7-45.8177.9-170.859.932.800111.5G305 R306 Q307 Q311 R312 D313G305-Q309 WeakPolarHBondContact O-CB 3.47Å; G305-Q309 PolarHBondContact O-N 2.84Å; R306-Q309 PolarHBondContact O-N 3.4Å; Q307-Q309 VanDerWaalsContact C-N 3.31Å; Q309-Q311 VanDerWaalsContact C-N 3.3Å; Q309-Q311 PolarHBondContact O-N 3.5Å; Q309-R312 WeakPolarHBondContact O-CB 3.44Å; Q309-R312 PolarHBondContact O-N 2.8Å; Q309-R312 VanDerWaalsContact O-N 3.16Å; Q309-D313 PolarHBondContact NE2-OD1 3.42Å; Q309-D313 WeakPolarHBondContact O-CB 3.22Å; Q309-D313 PolarHBondContact O-N 3.34Å
310T94.6Very high95.7Very high66 Ų6691.2 Ų91.241%0.40548%0.476SS..Hα-helixtrans-62-38.6175.457.60000111.5R306 Q307 D313 V314R306-T310 WeakPolarHBondContact O-CG2 3.28Å; R306-T310 PolarHBondContact O-N 2.98Å; R306-T310 PolarHBondContact O-OG1 3.13Å; Q307-T310 WeakPolarHBondContact CA-OG1 3.28Å; Q307-T310 PolarHBondContact O-N 2.84Å; Q307-T310 PolarHBondContact O-OG1 2.87Å; Q307-T310 PolarHBondContact OE1-OG1 3.16Å; T310-D313 PolarHBondContact O-N 3.06Å; T310-V314 WeakPolarHBondContact O-CB 3.43Å; T310-V314 WeakPolarHBondContact O-CG2 3.28Å; T310-V314 PolarHBondContact O-N 2.88Å
311Q95Very high95.6Very high104 Ų10491.2 Ų91.249%0.48648%0.477SS..Hα-helixtrans-61.5-46.4172.6-73.417314.600111.8Q307 E308 Q309 V314 V315Q307-Q311 WeakPolarHBondContact O-CB 3.38Å; Q307-Q311 VanDerWaalsContact O-CG 3.22Å; Q307-Q311 WeakPolarHBondContact O-CG 3.47Å; Q307-Q311 PolarHBondContact O-N 3.47Å; E308-Q311 PolarHBondContact O-N 2.88Å; Q309-Q311 VanDerWaalsContact C-N 3.3Å; Q309-Q311 PolarHBondContact O-N 3.5Å; Q311-V314 PolarHBondContact O-N 2.93Å; Q311-V315 WeakPolarHBondContact O-CB 3.48Å; Q311-V315 VanDerWaalsContact O-CG2 3.28Å; Q311-V315 WeakPolarHBondContact O-CG2 3.23Å; Q311-V315 PolarHBondContact O-N 3.21Å
312R95.1Very high95.4Very high141 Ų14194 Ų9453%0.53248%0.481SS..Hα-helixtrans-60.2-45175.8-72.5172.8-170.6137.112.4111.3E308 Q309 V315 A316E308-R312 VanDerWaalsContact O-CG 3.28Å; E308-R312 WeakPolarHBondContact O-CG 3.36Å; E308-R312 PolarHBondContact O-N 3.41Å; E308-R312 IonicContact OE2-CZ 3.67Å; E308-R312 IonicContact OE2-NH1 3.64Å; E308-R312 IonicContact OE2-NH2 3.85Å; E308-R312 PolarHBondContact OE2-NH2 2.9Å; Q309-R312 WeakPolarHBondContact O-CB 3.44Å; Q309-R312 PolarHBondContact O-N 2.8Å; Q309-R312 VanDerWaalsContact O-N 3.16Å; R312-V315 PolarHBondContact O-N 2.85Å; R312-A316 WeakPolarHBondContact O-CB 3.41Å; R312-A316 PolarHBondContact O-N 3.27Å
313D95.3Very high95.3Very high78 Ų7896.3 Ų96.342%0.41749%0.49SS..Hα-helixtrans-65.1-44.6179.1-66.2-20.2000111Q309 T310 V315 A316 V317Q309-D313 PolarHBondContact NE2-OD1 3.42Å; Q309-D313 WeakPolarHBondContact O-CB 3.22Å; Q309-D313 PolarHBondContact O-N 3.34Å; T310-D313 PolarHBondContact O-N 3.06Å; D313-V315 VanDerWaalsContact C-N 3.34Å; D313-V315 PolarHBondContact O-N 3.43Å; D313-A316 PolarHBondContact O-N 3.44Å; D313-V317 WeakPolarHBondContact O-CB 3.32Å; D313-V317 VanDerWaalsContact O-CG2 3.28Å; D313-V317 WeakPolarHBondContact O-CG2 3.44Å; D313-V317 PolarHBondContact O-N 2.7Å
314V96.3Very high95.2Very high92 Ų9299.9 Ų99.956%0.55850%0.497SS*.Hα-helixtrans-59.8-43.7174.7167.30000111.1T310 Q311 S318T310-V314 WeakPolarHBondContact O-CB 3.43Å; T310-V314 WeakPolarHBondContact O-CG2 3.28Å; T310-V314 PolarHBondContact O-N 2.88Å; Q311-V314 PolarHBondContact O-N 2.93Å; V314-S318 VanDerWaalsContact O-CB 3.23Å; V314-S318 WeakPolarHBondContact O-CB 3.32Å; V314-S318 PolarHBondContact O-N 3.41Å; V314-S318 PolarHBondContact O-OG 3.33Å
315V95.7Very high95.1Very high98 Ų9899.2 Ų99.259%0.59449%0.492SS*.Hα-helixtrans-64.4-43.3175.7169.90000111Q311 R312 D313 S318 R319Q311-V315 WeakPolarHBondContact O-CB 3.48Å; Q311-V315 VanDerWaalsContact O-CG2 3.28Å; Q311-V315 WeakPolarHBondContact O-CG2 3.23Å; Q311-V315 PolarHBondContact O-N 3.21Å; R312-V315 PolarHBondContact O-N 2.85Å; D313-V315 VanDerWaalsContact C-N 3.34Å; D313-V315 PolarHBondContact O-N 3.43Å; V315-S318 PolarHBondContact O-N 2.94Å; V315-R319 WeakPolarHBondContact O-CB 3.28Å; V315-R319 PolarHBondContact O-N 3.42Å
316A96.6Very high95.1Very high45 Ų45101.5 Ų101.537%0.37250%0.496SS..Hα-helixtrans-63.6-47.2178.100000112R312 D313 R319 N320R312-A316 WeakPolarHBondContact O-CB 3.41Å; R312-A316 PolarHBondContact O-N 3.27Å; D313-A316 PolarHBondContact O-N 3.44Å; A316-R319 PolarHBondContact O-N 3.42Å; A316-N320 WeakPolarHBondContact O-CB 3.41Å; A316-N320 VanDerWaalsContact O-CG 3.28Å; A316-N320 PolarHBondContact O-N 2.8Å; A316-N320 PolarHBondContact O-ND2 2.88Å
317V96.4Very high95Very high90 Ų9096 Ų9655%0.54548%0.484SS..Hα-helixtrans-61.5-45.6175.1171.90000110.5D313 R319 N320 M321D313-V317 WeakPolarHBondContact O-CB 3.32Å; D313-V317 VanDerWaalsContact O-CG2 3.28Å; D313-V317 WeakPolarHBondContact O-CG2 3.44Å; D313-V317 PolarHBondContact O-N 2.7Å; V317-R319 VanDerWaalsContact C-N 3.33Å; V317-R319 PolarHBondContact O-N 3.18Å; V317-N320 PolarHBondContact O-N 2.82Å; V317-M321 VanDerWaalsContact O-CB 3.31Å; V317-M321 WeakPolarHBondContact O-CB 3.17Å; V317-M321 PolarHBondContact O-N 3.11Å
318S94.3Very high95Very high57 Ų5795.4 Ų95.440%0.39948%0.484SS..Hα-helixtrans-60.6-42.6177.3-60.80000111.8V314 V315 M321 Q322V314-S318 VanDerWaalsContact O-CB 3.23Å; V314-S318 WeakPolarHBondContact O-CB 3.32Å; V314-S318 PolarHBondContact O-N 3.41Å; V314-S318 PolarHBondContact O-OG 3.33Å; V315-S318 PolarHBondContact O-N 2.94Å; S318-M321 PolarHBondContact O-N 2.86Å; S318-Q322 WeakPolarHBondContact O-CB 3.31Å; S318-Q322 PolarHBondContact O-N 3.04Å
319R95.7Very high94.9Very high171 Ų17194.6 Ų94.665%0.64548%0.482SS*.Hα-helixtrans-63.9-42175.4-174.2179.7-178.3-172.11111.6V315 A316 V317 Q322 K323V315-R319 WeakPolarHBondContact O-CB 3.28Å; V315-R319 PolarHBondContact O-N 3.42Å; A316-R319 PolarHBondContact O-N 3.42Å; V317-R319 VanDerWaalsContact C-N 3.33Å; V317-R319 PolarHBondContact O-N 3.18Å; R319-Q322 PolarHBondContact O-N 2.89Å; R319-K323 WeakPolarHBondContact O-CG 3.38Å; R319-K323 PolarHBondContact O-N 3.48Å
320N95.5Very high94.8Very high81 Ų8198.4 Ų98.443%0.43349%0.492SS..Hα-helixtrans-66.4-45.6177.2-73.1-16.5000111.4A316 V317 Q322 K323 E324A316-N320 WeakPolarHBondContact O-CB 3.41Å; A316-N320 VanDerWaalsContact O-CG 3.28Å; A316-N320 PolarHBondContact O-N 2.8Å; A316-N320 PolarHBondContact O-ND2 2.88Å; V317-N320 PolarHBondContact O-N 2.82Å; N320-Q322 VanDerWaalsContact C-N 3.27Å; N320-Q322 PolarHBondContact O-N 3.46Å; N320-K323 WeakPolarHBondContact O-CA 3.43Å; N320-K323 WeakPolarHBondContact O-CB 3.37Å; N320-K323 PolarHBondContact O-N 2.9Å; N320-E324 PolarHBondContact O-N 3.42Å
321M93.4Very high94.7Very high117 Ų117100.1 Ų100.158%0.57650%0.496SS*.Hα-helixtrans-60.2-36.4174.8-174.2165.858.700111.8V317 S318 E324 K325V317-M321 VanDerWaalsContact O-CB 3.31Å; V317-M321 WeakPolarHBondContact O-CB 3.17Å; V317-M321 PolarHBondContact O-N 3.11Å; S318-M321 PolarHBondContact O-N 2.86Å; M321-E324 PolarHBondContact O-N 2.91Å; M321-K325 WeakPolarHBondContact O-CB 3.38Å; M321-K325 PolarHBondContact O-N 3.33Å
322Q93.1Very high94.6Very high97 Ų9799.1 Ų99.145%0.45349%0.493SS..Hα-helixtrans-67-39173.5-172.170-5.300112.2S318 R319 N320 K325 L326S318-Q322 WeakPolarHBondContact O-CB 3.31Å; S318-Q322 PolarHBondContact O-N 3.04Å; R319-Q322 PolarHBondContact O-N 2.89Å; N320-Q322 VanDerWaalsContact C-N 3.27Å; N320-Q322 PolarHBondContact O-N 3.46Å; Q322-K325 PolarHBondContact O-N 2.98Å; Q322-L326 VanDerWaalsContact O-CG 3.31Å; Q322-L326 WeakPolarHBondContact O-CG 3.31Å; Q322-L326 PolarHBondContact O-N 3.33Å
323K94.9Very high94.4Very high116 Ų11697.1 Ų97.150%0.50449%0.49SS..Hα-helixtrans-62.9-44.9173.1-69.8172.1-177.5172.50111.2R319 N320 L326 S327R319-K323 WeakPolarHBondContact O-CG 3.38Å; R319-K323 PolarHBondContact O-N 3.48Å; N320-K323 WeakPolarHBondContact O-CA 3.43Å; N320-K323 WeakPolarHBondContact O-CB 3.37Å; N320-K323 PolarHBondContact O-N 2.9Å; K323-L326 PolarHBondContact O-N 3.48Å; K323-S327 WeakPolarHBondContact O-CB 3.49Å; K323-S327 PolarHBondContact O-N 3.28Å
324E93.9Very high94.2Very high130 Ų13098.1 Ų98.161%0.60750%0.495SS*.Hα-helixtrans-61.9-45.8175.8-72.2-177.5176.600111.4N320 M321 L326 S327 L328N320-E324 PolarHBondContact O-N 3.42Å; M321-E324 PolarHBondContact O-N 2.91Å; E324-L326 VanDerWaalsContact C-N 3.34Å; E324-L326 PolarHBondContact O-N 2.78Å; E324-S327 CarbonylContact O-C 3.48Å; E324-S327 WeakPolarHBondContact O-CA 3.33Å; E324-S327 WeakPolarHBondContact O-CB 3.48Å; E324-S327 PolarHBondContact O-N 3.5Å; E324-S327 VanDerWaalsContact O-N 3.11Å; E324-L328 WeakPolarHBondContact O-CB 3.45Å; E324-L328 VanDerWaalsContact O-CG 3.32Å; E324-L328 WeakPolarHBondContact O-CG 3.3Å; E324-L328 PolarHBondContact O-N 2.89Å
325K94.5Very high93.9Very high111 Ų11198.3 Ų98.348%0.48349%0.492SS..Hα-helixtrans-54.3-48.4173.6179-172.2174-178.10111.7M321 Q322 S327 L328 L329M321-K325 WeakPolarHBondContact O-CB 3.38Å; M321-K325 PolarHBondContact O-N 3.33Å; Q322-K325 PolarHBondContact O-N 2.98Å; K325-S327 VanDerWaalsContact C-N 3.34Å; K325-L328 PolarHBondContact O-N 2.83Å; K325-L329 HydrophobicContact CG-CD1 4.21Å; K325-L329 WeakPolarHBondContact O-CB 3.34Å; K325-L329 VanDerWaalsContact O-CG 3.3Å; K325-L329 WeakPolarHBondContact O-CG 3.5Å; K325-L329 PolarHBondContact O-N 3.31Å
326L95.3Very high93.7Very high81 Ų81101.6 Ų101.642%0.42449%0.494SS..Hα-helixtrans-64.8-38.2177.7-70.1173.2000111.9Q322 K323 E324 L329 R330Q322-L326 VanDerWaalsContact O-CG 3.31Å; Q322-L326 WeakPolarHBondContact O-CG 3.31Å; Q322-L326 PolarHBondContact O-N 3.33Å; K323-L326 PolarHBondContact O-N 3.48Å; E324-L326 VanDerWaalsContact C-N 3.34Å; E324-L326 PolarHBondContact O-N 2.78Å; L326-L329 PolarHBondContact O-N 2.99Å; L326-R330 WeakPolarHBondContact O-CG 3.32Å; L326-R330 PolarHBondContact O-N 3.38Å
327S93.8Very high93.4Very high56 Ų56104.2 Ų104.239%0.39250%0.498SS..Hα-helixtrans-62.9-45.7174.1-172.90000111.8K323 E324 K325 R330 Q331K323-S327 WeakPolarHBondContact O-CB 3.49Å; K323-S327 PolarHBondContact O-N 3.28Å; E324-S327 CarbonylContact O-C 3.48Å; E324-S327 WeakPolarHBondContact O-CA 3.33Å; E324-S327 WeakPolarHBondContact O-CB 3.48Å; E324-S327 PolarHBondContact O-N 3.5Å; E324-S327 VanDerWaalsContact O-N 3.11Å; K325-S327 VanDerWaalsContact C-N 3.34Å; S327-R330 PolarHBondContact O-N 3.37Å; S327-Q331 WeakPolarHBondContact O-CG 3.46Å; S327-Q331 PolarHBondContact O-N 3.46Å
328L94.4Very high93Very high96 Ų96104 Ų10450%0.50349%0.494SS..Hα-helixtrans-64.3-39.8176.2-70.1172.3000111.7E324 K325 Q331 L332E324-L328 WeakPolarHBondContact O-CB 3.45Å; E324-L328 VanDerWaalsContact O-CG 3.32Å; E324-L328 WeakPolarHBondContact O-CG 3.3Å; E324-L328 PolarHBondContact O-N 2.89Å; K325-L328 PolarHBondContact O-N 2.83Å; L328-Q331 PolarHBondContact O-N 2.81Å; L328-L332 WeakPolarHBondContact O-CG 3.42Å; L328-L332 PolarHBondContact O-N 3.04Å
329L93.4Very high92.7Very high73 Ų73105 Ų10538%0.38250%0.495SS..Hα-helixtrans-61.9-44174.1-75.8171.6000111.7K325 L326 Q331 L332 E333K325-L329 HydrophobicContact CG-CD1 4.21Å; K325-L329 WeakPolarHBondContact O-CB 3.34Å; K325-L329 VanDerWaalsContact O-CG 3.3Å; K325-L329 WeakPolarHBondContact O-CG 3.5Å; K325-L329 PolarHBondContact O-N 3.31Å; L326-L329 PolarHBondContact O-N 2.99Å; L329-Q331 VanDerWaalsContact C-N 3.35Å; L329-Q331 PolarHBondContact O-N 3.44Å; L329-L332 WeakPolarHBondContact O-CB 3.45Å; L329-L332 PolarHBondContact O-N 2.87Å; L329-E333 WeakPolarHBondContact O-CG 3.45Å; L329-E333 PolarHBondContact O-N 2.86Å
330R92.8Very high92.3Very high166 Ų166101.5 Ų101.563%0.62649%0.488SS*.Hα-helixtrans-61.2-42.2173.3-72.2170.7-176.1174.2-0112L326 S327 L332 E333 L334L326-R330 WeakPolarHBondContact O-CG 3.32Å; L326-R330 PolarHBondContact O-N 3.38Å; S327-R330 PolarHBondContact O-N 3.37Å; R330-L332 VanDerWaalsContact C-N 3.33Å; R330-L332 PolarHBondContact O-N 2.93Å; R330-E333 PolarHBondContact O-N 3.28Å; R330-L334 WeakPolarHBondContact O-CB 3.37Å; R330-L334 PolarHBondContact O-N 2.78Å
331Q92.6Very high91.8Very high102 Ų102104.7 Ų104.748%0.47749%0.494SS..Hα-helixtrans-61.9-40.7174.6-72.7173.8-2.700111.6S327 L328 L329 L334 L335S327-Q331 WeakPolarHBondContact O-CG 3.46Å; S327-Q331 PolarHBondContact O-N 3.46Å; L328-Q331 PolarHBondContact O-N 2.81Å; L329-Q331 VanDerWaalsContact C-N 3.35Å; L329-Q331 PolarHBondContact O-N 3.44Å; Q331-L334 PolarHBondContact O-N 2.92Å; Q331-L335 WeakPolarHBondContact O-CB 3.33Å; Q331-L335 WeakPolarHBondContact O-CG 3.49Å; Q331-L335 PolarHBondContact O-N 2.85Å
332L92.8Very high91.4Very high83 Ų83104 Ų10444%0.43549%0.492SS..Hα-helixtrans-65.3-39.1174-76.2170.6000112.4L328 L329 R330 L335 R336L328-L332 WeakPolarHBondContact O-CG 3.42Å; L328-L332 PolarHBondContact O-N 3.04Å; L329-L332 WeakPolarHBondContact O-CB 3.45Å; L329-L332 PolarHBondContact O-N 2.87Å; R330-L332 VanDerWaalsContact C-N 3.33Å; R330-L332 PolarHBondContact O-N 2.93Å; L332-L335 PolarHBondContact O-N 3.34Å; L332-R336 WeakPolarHBondContact O-CB 3.42Å; L332-R336 VanDerWaalsContact O-CG 3.28Å; L332-R336 WeakPolarHBondContact O-CG 3.49Å; L332-R336 PolarHBondContact O-N 2.84Å
333E91.8Very high90.8Very high100 Ų100105.7 Ų105.747%0.46749%0.494SS..Hα-helixtrans-62.2-48.9173.5-76.3166.5-179.400111.1L329 R330 L335 R336 E337L329-E333 WeakPolarHBondContact O-CG 3.45Å; L329-E333 PolarHBondContact O-N 2.86Å; R330-E333 PolarHBondContact O-N 3.28Å; E333-L335 VanDerWaalsContact C-N 3.3Å; E333-L335 PolarHBondContact O-N 3.37Å; E333-R336 CarbonylContact O-C 3.58Å; E333-R336 WeakPolarHBondContact O-CA 3.28Å; E333-R336 WeakPolarHBondContact O-CB 3.47Å; E333-R336 PolarHBondContact O-N 3.2Å; E333-E337 WeakPolarHBondContact O-CG 3.4Å; E333-E337 PolarHBondContact O-N 3.48Å
334L91.8Very high90.2Very high99 Ų99104.3 Ų104.352%0.51849%0.493SS..Hα-helixtrans-55-44.3172.6-86.6150.6000112R330 Q331 E337 L338R330-L334 WeakPolarHBondContact O-CB 3.37Å; R330-L334 PolarHBondContact O-N 2.78Å; Q331-L334 PolarHBondContact O-N 2.92Å; L334-E337 PolarHBondContact O-N 3.35Å; L334-L338 WeakPolarHBondContact O-CB 3.3Å; L334-L338 VanDerWaalsContact O-CG 3.3Å; L334-L338 WeakPolarHBondContact O-CG 3.49Å; L334-L338 PolarHBondContact O-N 2.86Å
335L90.1Very high89.6Confident95 Ų95103.6 Ų103.650%0.49749%0.49SS..Hα-helixtrans-66.5-35.2175.9-74.8172.1000112.7Q331 L332 E333 N339Q331-L335 WeakPolarHBondContact O-CB 3.33Å; Q331-L335 WeakPolarHBondContact O-CG 3.49Å; Q331-L335 PolarHBondContact O-N 2.85Å; L332-L335 PolarHBondContact O-N 3.34Å; E333-L335 VanDerWaalsContact C-N 3.3Å; E333-L335 PolarHBondContact O-N 3.37Å; L335-N339 WeakPolarHBondContact O-CB 3.35Å; L335-N339 PolarHBondContact O-N 3.27Å; L335-N339 PolarHBondContact O-ND2 3.43Å
336R91.6Very high88.9Confident167 Ų167104.5 Ų104.563%0.6349%0.49SS*.Hα-helixtrans-68.2-44.1174.3-76.2171.1-178.6167.30.7111.2L332 E333 N339 L340L332-R336 WeakPolarHBondContact O-CB 3.42Å; L332-R336 VanDerWaalsContact O-CG 3.28Å; L332-R336 WeakPolarHBondContact O-CG 3.49Å; L332-R336 PolarHBondContact O-N 2.84Å; E333-R336 CarbonylContact O-C 3.58Å; E333-R336 WeakPolarHBondContact O-CA 3.28Å; E333-R336 WeakPolarHBondContact O-CB 3.47Å; E333-R336 PolarHBondContact O-N 3.2Å; R336-N339 CarbonylContact O-C 3.59Å; R336-N339 PolarHBondContact O-N 2.79Å; R336-L340 WeakPolarHBondContact O-CB 3.46Å; R336-L340 PolarHBondContact O-N 2.77Å
337E89.2Confident88Confident100 Ų100103.7 Ų103.747%0.46749%0.486SS..Hα-helixtrans-61.9-43.2174.7-73.5177.2-170.400111.4E333 L334 L340 R341E333-E337 WeakPolarHBondContact O-CG 3.4Å; E333-E337 PolarHBondContact O-N 3.48Å; L334-E337 PolarHBondContact O-N 3.35Å; E337-L340 WeakPolarHBondContact O-CB 3.19Å; E337-L340 PolarHBondContact O-N 3.43Å; E337-R341 WeakPolarHBondContact O-CB 3.37Å; E337-R341 WeakPolarHBondContact O-CG 3.31Å; E337-R341 PolarHBondContact O-N 3.43Å
338L88.6Confident87Confident85 Ų85102.7 Ų102.745%0.44548%0.481SS..Hα-helixtrans-63.7-43.9173.5-75.9168.6000111.6L334 L340 R341 L342L334-L338 WeakPolarHBondContact O-CB 3.3Å; L334-L338 VanDerWaalsContact O-CG 3.3Å; L334-L338 WeakPolarHBondContact O-CG 3.49Å; L334-L338 PolarHBondContact O-N 2.86Å; L338-L340 VanDerWaalsContact C-N 3.28Å; L338-L340 PolarHBondContact O-N 3.29Å; L338-R341 PolarHBondContact O-N 2.87Å; L338-L342 VanDerWaalsContact O-CB 3.31Å; L338-L342 WeakPolarHBondContact O-CB 3.33Å; L338-L342 WeakPolarHBondContact O-CG 3.06Å; L338-L342 PolarHBondContact O-N 3.27Å
339N87.7Confident85.5Confident79 Ų79101.6 Ų101.642%0.42248%0.481SS..Hα-helixtrans-63.1-36.3174.1-91.1-80000112.2L335 R336 R343L335-N339 WeakPolarHBondContact O-CB 3.35Å; L335-N339 PolarHBondContact O-N 3.27Å; L335-N339 PolarHBondContact O-ND2 3.43Å; R336-N339 CarbonylContact O-C 3.59Å; R336-N339 PolarHBondContact O-N 2.79Å; N339-R343 WeakPolarHBondContact O-CB 3.48Å; N339-R343 WeakPolarHBondContact O-CG 3.46Å; N339-R343 PolarHBondContact O-N 2.71Å
340L88.2Confident84Confident97 Ų97102.7 Ų102.751%0.50848%0.484SS..Hα-helixtrans-66.1-50.3175.4-166.679.1000109.6R336 E337 L338 L342 R343 D344R336-L340 WeakPolarHBondContact O-CB 3.46Å; R336-L340 PolarHBondContact O-N 2.77Å; E337-L340 WeakPolarHBondContact O-CB 3.19Å; E337-L340 PolarHBondContact O-N 3.43Å; L338-L340 VanDerWaalsContact C-N 3.28Å; L338-L340 PolarHBondContact O-N 3.29Å; L340-L342 VanDerWaalsContact C-N 3.35Å; L340-L342 PolarHBondContact O-N 2.79Å; L340-R343 CarbonylContact O-C 3.47Å; L340-R343 WeakPolarHBondContact O-CA 3.22Å; L340-R343 WeakPolarHBondContact O-CB 3.26Å; L340-R343 PolarHBondContact O-N 2.73Å; L340-D344 WeakPolarHBondContact O-CB 3.39Å; L340-D344 PolarHBondContact O-N 3.04Å
341R84.8Confident82.4Confident148 Ų14899.4 Ų99.456%0.55848%0.482SS*.Hα-helixtrans-58-44.5175.2-73.1179.7-172.2177.55.9112.3E337 L338 R343 D344 E345E337-R341 WeakPolarHBondContact O-CB 3.37Å; E337-R341 WeakPolarHBondContact O-CG 3.31Å; E337-R341 PolarHBondContact O-N 3.43Å; L338-R341 PolarHBondContact O-N 2.87Å; R341-R343 VanDerWaalsContact C-N 3.29Å; R341-R343 PolarHBondContact O-N 2.86Å; R341-D344 PolarHBondContact O-N 3.39Å; R341-E345 WeakPolarHBondContact O-CB 3.21Å; R341-E345 WeakPolarHBondContact O-CG 3.43Å; R341-E345 PolarHBondContact O-N 2.75Å
342L83.5Confident80.7Confident103 Ų103102.3 Ų102.354%0.53949%0.493SS..Hα-helixtrans-64.7-34.2176.3-72.7170.6000111.8L338 L340 R346L338-L342 VanDerWaalsContact O-CB 3.31Å; L338-L342 WeakPolarHBondContact O-CB 3.33Å; L338-L342 WeakPolarHBondContact O-CG 3.06Å; L338-L342 PolarHBondContact O-N 3.27Å; L340-L342 VanDerWaalsContact C-N 3.35Å; L340-L342 PolarHBondContact O-N 2.79Å; L342-R346 WeakPolarHBondContact O-CB 3.33Å; L342-R346 PolarHBondContact O-N 2.9Å
343R81.7Confident78.9Confident132 Ų132104.6 Ų104.650%0.49851%0.505SS..Hα-helixtrans-70.4-45171.6-76.7170.8-173.2167.82.2111.5N339 L340 R341 E345 R346 D347N339-R343 WeakPolarHBondContact O-CB 3.48Å; N339-R343 WeakPolarHBondContact O-CG 3.46Å; N339-R343 PolarHBondContact O-N 2.71Å; L340-R343 CarbonylContact O-C 3.47Å; L340-R343 WeakPolarHBondContact O-CA 3.22Å; L340-R343 WeakPolarHBondContact O-CB 3.26Å; L340-R343 PolarHBondContact O-N 2.73Å; R341-R343 VanDerWaalsContact C-N 3.29Å; R341-R343 PolarHBondContact O-N 2.86Å; R343-E345 VanDerWaalsContact C-N 3.3Å; R343-E345 PolarHBondContact O-N 2.71Å; R343-R346 CarbonylContact O-C 3.57Å; R343-R346 WeakPolarHBondContact O-CB 3.48Å; R343-R346 PolarHBondContact O-N 3.19Å; R343-D347 VanDerWaalsContact O-CB 3.26Å; R343-D347 WeakPolarHBondContact O-CB 3.26Å; R343-D347 PolarHBondContact O-N 3.45Å
344D82.1Confident76.7Confident87 Ų87107.1 Ų107.147%0.46552%0.521SS..Hα-helixtrans-63.2-39176.9-64.4-27000110.6L340 R341 A348L340-D344 WeakPolarHBondContact O-CB 3.39Å; L340-D344 PolarHBondContact O-N 3.04Å; R341-D344 PolarHBondContact O-N 3.39Å; D344-A348 WeakPolarHBondContact O-CA 3.2Å; D344-A348 WeakPolarHBondContact O-CB 3.3Å; D344-A348 PolarHBondContact O-N 3.3Å
345E81.1Confident74.1Confident116 Ų116105.7 Ų105.754%0.54253%0.531SS..Hα-helixtrans-66.7-41.8173-76.5172.7-17500111.4R341 R343 C349R341-E345 WeakPolarHBondContact O-CB 3.21Å; R341-E345 WeakPolarHBondContact O-CG 3.43Å; R341-E345 PolarHBondContact O-N 2.75Å; R343-E345 VanDerWaalsContact C-N 3.3Å; R343-E345 PolarHBondContact O-N 2.71Å; E345-C349 WeakPolarHBondContact O-CB 3.33Å; E345-C349 PolarHBondContact O-N 2.9Å; E345-C349 PolarHBondContact O-SG 3.13Å
346R79.5Confident71.4Confident129 Ų129105.4 Ų105.449%0.48754%0.537SS..Hα-helixtrans-64-47.2173.1-179-16365.8-174.91.3111.2L342 R343 A348 C349 E350L342-R346 WeakPolarHBondContact O-CB 3.33Å; L342-R346 PolarHBondContact O-N 2.9Å; R343-R346 CarbonylContact O-C 3.57Å; R343-R346 WeakPolarHBondContact O-CB 3.48Å; R343-R346 PolarHBondContact O-N 3.19Å; R346-A348 VanDerWaalsContact C-N 3.32Å; R346-A348 PolarHBondContact O-N 3.49Å; R346-C349 CarbonylContact O-C 3.58Å; R346-C349 WeakPolarHBondContact O-CA 3.33Å; R346-C349 VanDerWaalsContact O-CB 3.28Å; R346-C349 WeakPolarHBondContact O-CB 3.28Å; R346-C349 PolarHBondContact O-N 3.38Å; R346-E350 IonicContact NE-OE1 3.4Å; R346-E350 WeakPolarHBondContact O-CG 3.44Å; R346-E350 PolarHBondContact O-N 2.78Å
347D77.5Confident68.6Low64 Ų64103.1 Ų103.134%0.34255%0.546SS..Hα-helixtrans-70.1-32-178.9-63.4-1000110R343 E350 T351R343-D347 VanDerWaalsContact O-CB 3.26Å; R343-D347 WeakPolarHBondContact O-CB 3.26Å; R343-D347 PolarHBondContact O-N 3.45Å; D347-E350 PolarHBondContact O-N 2.91Å; D347-T351 WeakPolarHBondContact O-CB 3.37Å; D347-T351 VanDerWaalsContact O-CG2 3.3Å; D347-T351 WeakPolarHBondContact O-CG2 3.41Å; D347-T351 PolarHBondContact O-N 3.49Å; D347-T351 PolarHBondContact O-OG1 3.33Å
348A72.3Confident65.7Low36 Ų36106.9 Ų106.930%0.29856%0.563SS.*Hα-helixtrans-65.7-36.6167.300000111.9D344 R346 T351 K352D344-A348 WeakPolarHBondContact O-CA 3.2Å; D344-A348 WeakPolarHBondContact O-CB 3.3Å; D344-A348 PolarHBondContact O-N 3.3Å; R346-A348 VanDerWaalsContact C-N 3.32Å; R346-A348 PolarHBondContact O-N 3.49Å; A348-T351 VanDerWaalsContact CA-OG1 3.26Å; A348-T351 WeakPolarHBondContact CA-OG1 3.19Å; A348-T351 PolarHBondContact O-OG1 2.78Å; A348-T351 VanDerWaalsContact O-OG1 3.13Å; A348-K352 WeakPolarHBondContact O-CB 3.38Å; A348-K352 WeakPolarHBondContact O-CD 3.33Å; A348-K352 WeakPolarHBondContact O-CG 3.1Å; A348-K352 PolarHBondContact O-N 2.95Å
349C62.1Low63.1Low73 Ų73113.7 Ų113.749%0.49358%0.583SS.*Hα-helixtrans-68.8-38.8170.9-76.30000112E345 R346 K352 L353E345-C349 WeakPolarHBondContact O-CB 3.33Å; E345-C349 PolarHBondContact O-N 2.9Å; E345-C349 PolarHBondContact O-SG 3.13Å; R346-C349 CarbonylContact O-C 3.58Å; R346-C349 WeakPolarHBondContact O-CA 3.33Å; R346-C349 VanDerWaalsContact O-CB 3.28Å; R346-C349 WeakPolarHBondContact O-CB 3.28Å; R346-C349 PolarHBondContact O-N 3.38Å; C349-K352 PolarHBondContact O-N 3.05Å; C349-L353 PolarHBondContact O-N 3.05Å
350E62.6Low60.3Low95 Ų95120 Ų12044%0.44461%0.606SS.*Hα-helixtrans-70-39.8176.9-73.9179-173.800112.1R346 D347 K352 L353 L354R346-E350 IonicContact NE-OE1 3.4Å; R346-E350 WeakPolarHBondContact O-CG 3.44Å; R346-E350 PolarHBondContact O-N 2.78Å; D347-E350 PolarHBondContact O-N 2.91Å; E350-K352 VanDerWaalsContact C-N 3.32Å; E350-K352 PolarHBondContact O-N 3.35Å; E350-L353 CarbonylContact O-C 3.58Å; E350-L353 WeakPolarHBondContact O-CA 3.39Å; E350-L353 WeakPolarHBondContact O-CB 3.48Å; E350-L353 PolarHBondContact O-N 2.78Å; E350-L353 VanDerWaalsContact O-N 3.09Å; E350-L354 WeakPolarHBondContact O-CG 3.48Å; E350-L354 PolarHBondContact O-N 2.9Å
351T59.1Low57.7Low97 Ų97119.8 Ų119.860%0.59562%0.619SS**Hα-helixtrans-68.9-29.6172.950.10000112.4D347 A348D347-T351 WeakPolarHBondContact O-CB 3.37Å; D347-T351 VanDerWaalsContact O-CG2 3.3Å; D347-T351 WeakPolarHBondContact O-CG2 3.41Å; D347-T351 PolarHBondContact O-N 3.49Å; D347-T351 PolarHBondContact O-OG1 3.33Å; A348-T351 VanDerWaalsContact CA-OG1 3.26Å; A348-T351 WeakPolarHBondContact CA-OG1 3.19Å; A348-T351 PolarHBondContact O-OG1 2.78Å; A348-T351 VanDerWaalsContact O-OG1 3.13Å
352K56.5Low55.3Low163 Ų163121.1 Ų121.171%0.70964%0.636SS**Hα-helixtrans-69.7-30.5167-74168.4-172.1176.10112.7A348 C349 E350A348-K352 WeakPolarHBondContact O-CB 3.38Å; A348-K352 WeakPolarHBondContact O-CD 3.33Å; A348-K352 WeakPolarHBondContact O-CG 3.1Å; A348-K352 PolarHBondContact O-N 2.95Å; C349-K352 PolarHBondContact O-N 3.05Å; E350-K352 VanDerWaalsContact C-N 3.32Å; E350-K352 PolarHBondContact O-N 3.35Å
353L55.3Low52.8Low131 Ų131120.3 Ų120.369%0.68664%0.644SS**Hα-helixtrans-76-31.9174.6-85.7156.6000113.1C349 E350 G355C349-L353 PolarHBondContact O-N 3.05Å; E350-L353 CarbonylContact O-C 3.58Å; E350-L353 WeakPolarHBondContact O-CA 3.39Å; E350-L353 WeakPolarHBondContact O-CB 3.48Å; E350-L353 PolarHBondContact O-N 2.78Å; E350-L353 VanDerWaalsContact O-N 3.09Å; L353-G355 VanDerWaalsContact C-N 3.25Å; L353-G355 PolarHBondContact O-N 3.09Å
354L44.8Very low50.4Low154 Ų154122.3 Ų122.381%0.80666%0.663SS**THydrogen-bonded Turntrans-79.1-2.2179.7-69.4170.3000114.3E350E350-L354 WeakPolarHBondContact O-CG 3.48Å; E350-L354 PolarHBondContact O-N 2.9Å
355G37.9Very low48.2Very low69 Ų69121.9 Ų121.971%0.71167%0.672SS**THydrogen-bonded Turntrans-89.7-3175.800000116.2L353L353-G355 VanDerWaalsContact C-N 3.25Å; L353-G355 PolarHBondContact O-N 3.09Å
356S34.3Very low45.7Very low89 Ų89125.5 Ų125.562%0.62269%0.688SS**SBendtrans-148.3111174.973.90000114.5
357S31.6Very low44.1Very low118 Ų118128.7 Ų128.783%0.82571%0.706SS**  trans82.387.2150.4-60.30000120.7
358H29.7Very low42.7Very low179 Ų179131.7 Ų131.783%0.82973%0.728SS**  30114.9117.4-84-3.6000122.9
359R32.8Very low40.7Very low228 Ų228133.2 Ų133.286%0.8675%0.748SS**  125.5110.7128-74.8-172.1-141.6-166.35.8115.4
360K30Very low40.6Very low211 Ų211135.3 Ų135.392%0.91776%0.76SS**  178.8131.3109.9-96.5168.3-175.8176.20111
361A32.8Very low39.1Very low93 Ų93136 Ų13677%0.76977%0.771SS**  trans-88.1146165.400000109.9
362L33.4Very low38Very low177 Ų177142 Ų14293%0.92779%0.785SS**  trans-167.8127.8135.9-106.9147.1000110.5
363A32.1Very low37.1Very low85 Ų85139.8 Ų139.870%0.70279%0.789SS**  trans-73.9160.2175.500000112
364I30.7Very low36.2Very low175 Ų175138.1 Ų138.190%0.89779%0.787SS**  trans-156.5135.9137.7-89.4139.3000108.5
365A36.9Very low35.9Very low78 Ų78135.5 Ų135.565%0.64578%0.78SS**  trans-87.1158-178.900000113
366H28.6Very low35.8Very low192 Ų192137.1 Ų137.189%0.88978%0.78SS**  156135127.8-99.2-97.7000112.6
367K45.3Very low36.1Very low196 Ų196138.8 Ų138.885%0.85279%0.79SS**  trans-65.4163.2162.2-79.7-165.1179.4-171.40110.6
368P48.5Very low36.2Very low126 Ų126136.5 Ų136.582%0.81879%0.785SS**  cis-144.6179.549.333.1-8.1000116.5
369G29.3Very low36.7Very low69 Ų69140.2 Ų140.271%0.71179%0.792SS**  trans-72.4-150.9173.200000112.9
370P59.6Low36.9Very low116 Ų116134.3 Ų134.375%0.75379%0.792SS**  cis-137.8-167.6-22.528-3000112.9
371T31.8Very low37.4Very low110 Ų110135.6 Ų135.668%0.67579%0.791SS**  trans70.3120141.927.30000123.1
372Y36.9Very low39.3Very low222 Ų222135.6 Ų135.687%0.87178%0.783SS**  trans51.4134.3130.8-81.8-103.9000121.5
373C36.5Very low40.5Very low118 Ų118132.5 Ų132.580%0.79777%0.774SS**  175107.7120-155.50000107.9
374C37.3Very low41.3Very low96 Ų96139.3 Ų139.365%0.64978%0.781SS**  73.2138.284.1-153.70000116.2
375C37.4Very low41.8Very low98 Ų98142.8 Ų142.866%0.66278%0.783SS**  trans94.2102.7130.7-72.30000117.2
376C37Very low41.8Very low104 Ų104142.6 Ų142.670%0.70379%0.788SS**  147.8123.390.7-91.40000115.6
377C40.5Very low42.9Very low123 Ų123139.4 Ų139.483%0.83179%0.788SS**  75.7136.2121.9-540000124
378G33.6Very low42.8Very low70 Ų70133.9 Ų133.972%0.72279%0.786SS**  trans148.271.2150.700000113.3
379W40.1Very low43Very low257 Ų257137.2 Ų137.297%0.97379%0.79SS**  29.8113.797-73.870.6000116.9
380A36.4Very low43.9Very low104 Ų104141.6 Ų141.686%0.8680%0.797SS**  -173.4136.412900000112.6
381R41.2Very low44.2Very low238 Ų238142 Ų14290%0.89880%0.799SS**  trans-152.3173.7165.6-137.5-163.2-171.4-129.91.6106.8
382P72.1Confident44.7Very low94 Ų94142.4 Ų142.461%0.6181%0.807SS**  -118.6-156.1-77.134.2-13.4000111.2
383P57.8Low45.1Very low112 Ų112136 Ų13673%0.72780%0.8SS**  -156155.390.136.9-15.6000120.1
384R49.9Very low45.7Very low228 Ų228145.7 Ų145.786%0.8682%0.82SS**  trans29.1141.2135-54.4-178-175.2-103.34.6120
385R40.5Very low46.1Very low248 Ų248148.2 Ų148.294%0.93683%0.828SS**  -168.4162.956-82.1178.3176.7-113.62106.7
386G37.6Very low46.6Very low73 Ų73150.8 Ų150.875%0.75384%0.837SS**  cis-175.4168.412.300000111.6
387S51.3Low47.1Very low126 Ų126153.4 Ų153.488%0.88184%0.844SS**  trans-76144.7171.145.40000112.1
388G42.5Very low47.5Very low79 Ų79155.2 Ų155.281%0.81485%0.845SS**  trans-155.4112164.200000110.9
389H53.1Low48.4Very low196 Ų196160.6 Ų160.691%0.90785%0.853SS**  trans-71.2158.7168.2-90.8-74000111.6
390L47.6Very low48.9Very low162 Ų162154.1 Ų154.185%0.84885%0.845SS**  trans-51179.3159.8-60.4163000112.4
391P66.6Low49.8Very low123 Ų123157.7 Ų157.780%0.79984%0.844SS**  cis-132.6-177.9-5.835-14.4000113.3
392S42.2Very low50.5Low120 Ų120151.5 Ų151.584%0.83984%0.84SS**  174.8149.4127.4-157.20000113.7
393A46.4Very low48.7Very low88 Ų88156.3 Ų156.373%0.72786%0.859SS**  trans-39.1143.6173.500000118
394R48.7Very low47.9Very low321 Ų321160.4 Ų160.4100%1.21187%0.871SS**  -156.40116.4-116.9-177.8-172.1-160.91.8111.3

Retrieved 394 of 394 residues in 63.7 ms (Link to these results)