A0A3Q0KT91_SCHMA Loading...

Ragulator complex protein LAMTOR1

AlphaFold DB , UniProt , Accession A0A3Q0KT91, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 128 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
1M44.5Very low47.4Very low250 Ų250148.9 Ų148.9100%1.23283%0.829SS**  0108.40-67.5-161.9-165.100107.7
2G44.4Very low48Very low73 Ų73146.7 Ų146.775%0.75382%0.822SS**  trans-159.498.1177.300000107.2S4G2-S4 PolarHBondContact O-N 3.33Å
3H47.8Very low48.5Very low196 Ų196146.2 Ų146.291%0.90782%0.816SS**  trans-77106.6174.9-80.680.3000107.5S5H3-S5 PolarHBondContact O-N 3.26Å
4S46.3Very low49Very low110 Ų110144.4 Ų144.477%0.76980%0.798SS**  trans-81.5109.2166-169.50000107.4G2 H6G2-S4 PolarHBondContact O-N 3.33Å; S4-H6 PolarHBondContact O-N 3.2Å
5S48.5Very low49.6Very low106 Ų106139.4 Ų139.474%0.74178%0.775SS**  trans-75.6105.216947.20000107.8H3 M7H3-S5 PolarHBondContact O-N 3.26Å; S5-M7 PolarHBondContact O-N 3.29Å
6H48.7Very low50.4Low176 Ų176139.6 Ų139.682%0.81577%0.768SS**  trans-68.9109.5160.1-99.6-49.1000107.1S4 E8S4-H6 PolarHBondContact O-N 3.2Å; H6-E8 PolarHBondContact O-N 3.49Å
7M45.7Very low51.7Low172 Ų172135.6 Ų135.685%0.84775%0.753SS**  trans-61.1115.4158.5-79.7176.3170.600106.9S5 D9S5-M7 PolarHBondContact O-N 3.29Å; M7-D9 PolarHBondContact O-N 2.82Å
8E45.5Very low53.4Low186 Ų186133.1 Ų133.187%0.86974%0.738SS**  trans-65.2115.2165.4-70.4175.6160.200107.4H6H6-E8 PolarHBondContact O-N 3.49Å
9D47.6Very low55Low143 Ų143129.2 Ų129.277%0.76572%0.715SS**  trans-58.3129.3165-78.7-40.1000107.8M7 V11M7-D9 PolarHBondContact O-N 2.82Å; D9-V11 PolarHBondContact O-N 2.91Å
10P48.5Very low56.6Low110 Ų110127 Ų12771%0.71470%0.702SS**  trans-64.9107.517526.5-31000107.5T12P10-T12 PolarHBondContact O-N 3.3Å
11V54Low58.1Low116 Ų116124.3 Ų124.370%0.70369%0.69SS**  trans-61.194.2163.9-179.60000105.8D9 N13D9-V11 PolarHBondContact O-N 2.91Å; V11-N13 WeakPolarHBondContact CG1-OD1 3.42Å; V11-N13 PolarHBondContact O-N 2.77Å
12T54.3Low60.2Low122 Ų122118.2 Ų118.275%0.74866%0.66SS**  trans-6389162.842.50000106.2P10 E14P10-T12 PolarHBondContact O-N 3.3Å; T12-E14 PolarHBondContact O-N 3.09Å
13N55.1Low62.3Low140 Ų140119.9 Ų119.975%0.74965%0.649SS**  trans-65.174.1163.8-77.1-34.2000107.4V11V11-N13 WeakPolarHBondContact CG1-OD1 3.42Å; V11-N13 PolarHBondContact O-N 2.77Å
14E55.8Low64.3Low121 Ų121113.8 Ų113.857%0.56563%0.625SS**  trans-55.2123.6152.7-76.8-165.5163.500105.6T12 Q16 I19T12-E14 PolarHBondContact O-N 3.09Å; E14-Q16 PolarHBondContact O-N 2.82Å; E14-Q16 VanDerWaalsContact O-N 3.09Å; E14-I19 HydrophobicContact CB-CD1 4.29Å; E14-I19 HydrophobicContact CB-CG1 4.32Å
15P57.7Low66.4Low70 Ų70112.6 Ų112.646%0.45561%0.611SS.*  trans-58.6126.3-179.224.5-31000106.4S17 D18P15-S17 CarbonylContact O-C 3.52Å; P15-S17 PolarHBondContact O-N 2.8Å; P15-D18 HydrophobicContact CG-CB 4.3Å; P15-D18 VanDerWaalsContact CG-OD2 3.26Å; P15-D18 WeakPolarHBondContact CG-OD2 3.26Å; P15-D18 PolarHBondContact O-N 2.73Å
16Q62.1Low68.4Low142 Ų142112.3 Ų112.366%0.66460%0.6SS**Hα-helixtrans-44.8-27.3-178.1-158.99313.800113.3E14 N20E14-Q16 PolarHBondContact O-N 2.82Å; E14-Q16 VanDerWaalsContact O-N 3.09Å; Q16-N20 WeakPolarHBondContact O-CB 3.42Å; Q16-N20 PolarHBondContact O-N 3.29Å; Q16-N20 PolarHBondContact O-ND2 3.41Å
17S73.2Confident70.4Confident73 Ų73108.4 Ų108.451%0.5158%0.584SS.*Hα-helixtrans-49.1-48167.41710000114.8P15 N20 T21P15-S17 CarbonylContact O-C 3.52Å; P15-S17 PolarHBondContact O-N 2.8Å; S17-N20 PolarHBondContact O-N 2.79Å; S17-T21 WeakPolarHBondContact O-CB 3.34Å; S17-T21 PolarHBondContact O-N 3.46Å; S17-T21 PolarHBondContact O-OG1 3.34Å
18D82.2Confident72.6Confident90 Ų90105.6 Ų105.648%0.48157%0.567SS.*Hα-helixtrans-71-42.1-175.6-70.7-7.5000110.6P15 T21 M22P15-D18 HydrophobicContact CG-CB 4.3Å; P15-D18 VanDerWaalsContact CG-OD2 3.26Å; P15-D18 WeakPolarHBondContact CG-OD2 3.26Å; P15-D18 PolarHBondContact O-N 2.73Å; D18-T21 PolarHBondContact O-N 3.34Å; D18-M22 WeakPolarHBondContact O-CB 3.37Å; D18-M22 PolarHBondContact O-N 2.93Å
19I83Confident74.8Confident58 Ų58100.6 Ų100.630%0.29755%0.549SS..Hα-helixtrans-61.1-47.3174.2-60.8174.7000110.4E14 T21 M22 M23E14-I19 HydrophobicContact CB-CD1 4.29Å; E14-I19 HydrophobicContact CB-CG1 4.32Å; I19-T21 VanDerWaalsContact C-N 3.32Å; I19-T21 PolarHBondContact O-N 2.83Å; I19-M22 PolarHBondContact O-N 2.78Å; I19-M23 HydrophobicContact CG2-CE 3.76Å; I19-M23 HydrophobicContact CG2-CG 4.48Å; I19-M23 HydrophobicContact CG2-SD 4.31Å; I19-M23 WeakPolarHBondContact O-CB 3.48Å; I19-M23 WeakPolarHBondContact O-CG 3.35Å; I19-M23 PolarHBondContact O-N 3.42Å
20N86.5Confident76.8Confident85 Ų8596 Ų9646%0.45553%0.531SS..Hα-helixtrans-63.1-38.3178.3-73-17.9000112.2Q16 S17 T24Q16-N20 WeakPolarHBondContact O-CB 3.42Å; Q16-N20 PolarHBondContact O-N 3.29Å; Q16-N20 PolarHBondContact O-ND2 3.41Å; S17-N20 PolarHBondContact O-N 2.79Å; N20-T24 WeakPolarHBondContact O-CB 3.31Å; N20-T24 PolarHBondContact O-N 2.88Å; N20-T24 PolarHBondContact O-OG1 3.04Å
21T88.4Confident78.8Confident72 Ų7296.6 Ų96.644%0.44252%0.524SS..Hα-helixtrans-67.5-44.1176.7-59.40000111S17 D18 I19 T24 N25S17-T21 WeakPolarHBondContact O-CB 3.34Å; S17-T21 PolarHBondContact O-N 3.46Å; S17-T21 PolarHBondContact O-OG1 3.34Å; D18-T21 PolarHBondContact O-N 3.34Å; I19-T21 VanDerWaalsContact C-N 3.32Å; I19-T21 PolarHBondContact O-N 2.83Å; T21-T24 PolarHBondContact O-N 3.01Å; T21-N25 VanDerWaalsContact O-CG 3.27Å; T21-N25 PolarHBondContact O-N 2.95Å; T21-N25 PolarHBondContact O-ND2 3.37Å
22M88Confident80.4Confident122 Ų12298 Ų9860%0.60153%0.527SS*.Hα-helixtrans-60.7-48.4175.8-173.9-178.8-170.200111.2D18 I19 T24 N25 I26D18-M22 WeakPolarHBondContact O-CB 3.37Å; D18-M22 PolarHBondContact O-N 2.93Å; I19-M22 PolarHBondContact O-N 2.78Å; M22-T24 VanDerWaalsContact C-N 3.34Å; M22-T24 PolarHBondContact O-N 2.9Å; M22-N25 PolarHBondContact O-N 2.97Å; M22-I26 HydrophobicContact CE-CD1 4.36Å; M22-I26 HydrophobicContact CG-CD1 3.97Å; M22-I26 VanDerWaalsContact O-CG1 3.31Å; M22-I26 WeakPolarHBondContact O-CG1 3.41Å; M22-I26 PolarHBondContact O-N 2.99Å
23M88.8Confident82Confident108 Ų10899.2 Ų99.253%0.53253%0.525SS..Hα-helixtrans-58.6-44.8176.4-73.8-175.1179.100111.8I19 N25 I26 I27I19-M23 HydrophobicContact CG2-CE 3.76Å; I19-M23 HydrophobicContact CG2-CG 4.48Å; I19-M23 HydrophobicContact CG2-SD 4.31Å; I19-M23 WeakPolarHBondContact O-CB 3.48Å; I19-M23 WeakPolarHBondContact O-CG 3.35Å; I19-M23 PolarHBondContact O-N 3.42Å; M23-N25 VanDerWaalsContact C-N 3.31Å; M23-N25 PolarHBondContact O-N 3.18Å; M23-I26 PolarHBondContact O-N 3.31Å; M23-I27 VanDerWaalsContact O-CG1 3.31Å; M23-I27 WeakPolarHBondContact O-CG1 3.31Å; M23-I27 PolarHBondContact O-N 3.49Å
24T91.3Very high83.5Confident67 Ų6797.7 Ų97.741%0.41152%0.52SS..Hα-helixtrans-60.6-41.4176.9-58.50000111.7N20 T21 M22 I27 K28N20-T24 WeakPolarHBondContact O-CB 3.31Å; N20-T24 PolarHBondContact O-N 2.88Å; N20-T24 PolarHBondContact O-OG1 3.04Å; T21-T24 PolarHBondContact O-N 3.01Å; M22-T24 VanDerWaalsContact C-N 3.34Å; M22-T24 PolarHBondContact O-N 2.9Å; T24-I27 PolarHBondContact O-N 3.39Å; T24-K28 HydrophobicContact CG2-CD 4.33Å; T24-K28 WeakPolarHBondContact O-CG 3.31Å; T24-K28 PolarHBondContact O-N 2.95Å
25N90.5Very high84.7Confident86 Ų8698.3 Ų98.346%0.4653%0.532SS..Hα-helixtrans-67.5-41.2177.4-70.8-21.8000111.9T21 M22 M23 K28 V29T21-N25 VanDerWaalsContact O-CG 3.27Å; T21-N25 PolarHBondContact O-N 2.95Å; T21-N25 PolarHBondContact O-ND2 3.37Å; M22-N25 PolarHBondContact O-N 2.97Å; M23-N25 VanDerWaalsContact C-N 3.31Å; M23-N25 PolarHBondContact O-N 3.18Å; N25-K28 PolarHBondContact O-N 3.26Å; N25-V29 VanDerWaalsContact O-CG2 3.31Å; N25-V29 WeakPolarHBondContact O-CG2 3.35Å; N25-V29 PolarHBondContact O-N 3.4Å
26I89.9Confident85.9Confident100 Ų100100.5 Ų100.551%0.51354%0.54SS..Hα-helixtrans-59.9-46.8175.6-69.2165.4000110.4M22 M23 V29 A30M22-I26 HydrophobicContact CE-CD1 4.36Å; M22-I26 HydrophobicContact CG-CD1 3.97Å; M22-I26 VanDerWaalsContact O-CG1 3.31Å; M22-I26 WeakPolarHBondContact O-CG1 3.41Å; M22-I26 PolarHBondContact O-N 2.99Å; M23-I26 PolarHBondContact O-N 3.31Å; I26-V29 PolarHBondContact O-N 2.66Å; I26-A30 WeakPolarHBondContact O-CB 3.29Å; I26-A30 PolarHBondContact O-N 3.14Å
27I90.7Very high86.9Confident93 Ų9398.8 Ų98.848%0.47755%0.55SS.*Hα-helixtrans-61.1-47.9179-67.3165.2000110.4M23 T24 V29 A30 E31M23-I27 VanDerWaalsContact O-CG1 3.31Å; M23-I27 WeakPolarHBondContact O-CG1 3.31Å; M23-I27 PolarHBondContact O-N 3.49Å; T24-I27 PolarHBondContact O-N 3.39Å; I27-V29 VanDerWaalsContact C-N 3.3Å; I27-V29 PolarHBondContact O-N 3.22Å; I27-A30 WeakPolarHBondContact O-CB 3.26Å; I27-A30 PolarHBondContact O-N 3.22Å; I27-A30 VanDerWaalsContact O-N 3.13Å; I27-E31 HydrophobicContact CG2-CG 4.22Å; I27-E31 WeakPolarHBondContact O-CG 3.28Å; I27-E31 PolarHBondContact O-N 3.33Å
28K92.2Very high87.4Confident114 Ų11497.9 Ų97.950%0.49655%0.552SS.*Hα-helixtrans-60.7-37.2177.7-74.5176.8179.41790113.3T24 N25 N32T24-K28 HydrophobicContact CG2-CD 4.33Å; T24-K28 WeakPolarHBondContact O-CG 3.31Å; T24-K28 PolarHBondContact O-N 2.95Å; N25-K28 PolarHBondContact O-N 3.26Å; K28-N32 PolarHBondContact O-N 3.29Å; K28-N32 PolarHBondContact O-ND2 2.93Å; K28-N32 VanDerWaalsContact O-ND2 3.14Å
29V90.5Very high87.1Confident80 Ų8097.1 Ų97.149%0.48556%0.559SS.*Hα-helixtrans-67.4-44175.4170.50000110.3N25 I26 I27 N32 Q33N25-V29 VanDerWaalsContact O-CG2 3.31Å; N25-V29 WeakPolarHBondContact O-CG2 3.35Å; N25-V29 PolarHBondContact O-N 3.4Å; I26-V29 PolarHBondContact O-N 2.66Å; I27-V29 VanDerWaalsContact C-N 3.3Å; I27-V29 PolarHBondContact O-N 3.22Å; V29-N32 PolarHBondContact O-N 2.84Å; V29-Q33 VanDerWaalsContact O-CG 3.28Å; V29-Q33 WeakPolarHBondContact O-CG 3.41Å; V29-Q33 PolarHBondContact O-N 3.06Å
30A89.8Confident86.5Confident47 Ų4799.6 Ų99.639%0.38858%0.576SS.*Hα-helixtrans-62.5-44.517700000111.8I26 I27 N32 Q33 V34I26-A30 WeakPolarHBondContact O-CB 3.29Å; I26-A30 PolarHBondContact O-N 3.14Å; I27-A30 WeakPolarHBondContact O-CB 3.26Å; I27-A30 PolarHBondContact O-N 3.22Å; I27-A30 VanDerWaalsContact O-N 3.13Å; A30-N32 VanDerWaalsContact C-N 3.28Å; A30-N32 PolarHBondContact O-N 3.13Å; A30-Q33 PolarHBondContact O-N 3.4Å; A30-V34 PolarHBondContact O-N 2.95Å; A30-V34 VanDerWaalsContact O-N 3.09Å
31E90.9Very high85.5Confident123 Ų123104 Ų10458%0.57560%0.6SS**Hα-helixtrans-58.2-37.2176.9-74.7173.6164.400112.5I27 Q33 V34I27-E31 HydrophobicContact CG2-CG 4.22Å; I27-E31 WeakPolarHBondContact O-CG 3.28Å; I27-E31 PolarHBondContact O-N 3.33Å; E31-Q33 VanDerWaalsContact C-N 3.33Å; E31-V34 WeakPolarHBondContact O-CG2 3.34Å
32N87.2Confident84.4Confident144 Ų144109 Ų10977%0.7761%0.612SS**THydrogen-bonded Turntrans-80.5-9.5176.8-71.5-34000114.2K28 V29 A30K28-N32 PolarHBondContact O-N 3.29Å; K28-N32 PolarHBondContact O-ND2 2.93Å; K28-N32 VanDerWaalsContact O-ND2 3.14Å; V29-N32 PolarHBondContact O-N 2.84Å; A30-N32 VanDerWaalsContact C-N 3.28Å; A30-N32 PolarHBondContact O-N 3.13Å
33Q87.8Confident83.2Confident149 Ų149107.2 Ų107.270%0.69661%0.605SS**THydrogen-bonded Turntrans-103.5-18.1-179.5-74.3179.2-0.200113.3V29 A30 E31V29-Q33 VanDerWaalsContact O-CG 3.28Å; V29-Q33 WeakPolarHBondContact O-CG 3.41Å; V29-Q33 PolarHBondContact O-N 3.06Å; A30-Q33 PolarHBondContact O-N 3.4Å; E31-Q33 VanDerWaalsContact C-N 3.33Å
34V86.5Confident82.1Confident108 Ų108107.1 Ų107.166%0.65561%0.612SS**  trans-84.4139175.9-64.90000110.6A30 E31A30-V34 PolarHBondContact O-N 2.95Å; A30-V34 VanDerWaalsContact O-N 3.09Å; E31-V34 WeakPolarHBondContact O-CG2 3.34Å
35V82.1Confident81Confident134 Ų134105.6 Ų105.681%0.81260%0.601SS**  trans-96.1125.4171.3178.70000108A37V35-A37 PolarHBondContact O-N 2.92Å; V35-A37 VanDerWaalsContact O-N 3.14Å
36D83.5Confident80.5Confident116 Ų116105.9 Ų105.962%0.6260%0.603SS**  trans-73.1102.5171.3-177.42.4000109.7G38 A39D36-G38 PolarHBondContact O-N 3.3Å; D36-G38 WeakPolarHBondContact OD1-CA 3.5Å; D36-G38 PolarHBondContact OD1-N 3.48Å; D36-A39 HydrophobicContact CB-CB 4.15Å; D36-A39 WeakPolarHBondContact O-CB 3.5Å; D36-A39 PolarHBondContact O-N 3.3Å
37A82.5Confident80.2Confident106 Ų106105.1 Ų105.188%0.87661%0.606SS**THydrogen-bonded Turntrans-66.2-11.9177.900000113.5V35V35-A37 PolarHBondContact O-N 2.92Å; V35-A37 VanDerWaalsContact O-N 3.14Å
38G82.7Confident80.1Confident54 Ų54106.9 Ų106.956%0.55761%0.613SS**THydrogen-bonded Turntrans-97.5-3.717600000114.4D36 T40D36-G38 PolarHBondContact O-N 3.3Å; D36-G38 WeakPolarHBondContact OD1-CA 3.5Å; D36-G38 PolarHBondContact OD1-N 3.48Å; G38-T40 PolarHBondContact O-N 3.11Å
39A76.6Confident79.9Confident74 Ų74106.1 Ų106.161%0.61261%0.611SS**  trans-64109.2176.200000109.6D36D36-A39 HydrophobicContact CB-CB 4.15Å; D36-A39 WeakPolarHBondContact O-CB 3.5Å; D36-A39 PolarHBondContact O-N 3.3Å
40T69.5Low79.8Confident109 Ų109106.8 Ų106.867%0.66961%0.608SS**  trans-94.1155.3171.362.30000109.1G38 Y42G38-T40 PolarHBondContact O-N 3.11Å; T40-Y42 PolarHBondContact O-N 2.89Å
41D66Low79.9Confident177 Ų177109.7 Ų109.795%0.94762%0.616SS**SBendtrans-61.85.1176.6-64.7-38.3000114.2N43D41-N43 PolarHBondContact O-N 3.47Å
42Y65Low80Confident178 Ų178107.8 Ų107.870%0.69861%0.608SS**  trans-63.5108.2173.5-176.4-103.4000109.3T40 P44T40-Y42 PolarHBondContact O-N 2.89Å; Y42-P44 HydrophobicContact CD1-CB 4.43Å; Y42-P44 HydrophobicContact CE1-CB 4.46Å; Y42-P44 WeakPolarHBondContact O-CD 3.42Å; Y42-P44 VanDerWaalsContact O-N 3.13Å
43N64.3Low80.2Confident84 Ų84105.8 Ų105.845%0.44959%0.589SS.*  trans-66108.2170-172.34.2000108D41 L45D41-N43 PolarHBondContact O-N 3.47Å; N43-L45 PolarHBondContact O-N 3.06Å; N43-L45 VanDerWaalsContact O-N 3.15Å; N43-L45 VanDerWaalsContact OD1-CD1 3.29Å; N43-L45 WeakPolarHBondContact OD1-CD1 3.31Å; N43-L45 WeakPolarHBondContact OD1-CG 3.38Å; N43-L45 PolarHBondContact OD1-N 3.12Å
44P65.4Low80.4Confident106 Ų106101.3 Ų101.369%0.68857%0.574SS**  trans-75.4-2-174.534-35.6000112.3Y42 D46Y42-P44 HydrophobicContact CD1-CB 4.43Å; Y42-P44 HydrophobicContact CE1-CB 4.46Å; Y42-P44 WeakPolarHBondContact O-CD 3.42Å; Y42-P44 VanDerWaalsContact O-N 3.13Å; P44-D46 PolarHBondContact O-N 3.38Å; P44-D46 VanDerWaalsContact O-N 3.13Å
45L68.6Low80.7Confident35 Ų35102.5 Ų102.518%0.18357%0.567CS.*SBendtrans-59.6120.3175.3-62172.7000108.3N43 E49N43-L45 PolarHBondContact O-N 3.06Å; N43-L45 VanDerWaalsContact O-N 3.15Å; N43-L45 VanDerWaalsContact OD1-CD1 3.29Å; N43-L45 WeakPolarHBondContact OD1-CD1 3.31Å; N43-L45 WeakPolarHBondContact OD1-CG 3.38Å; N43-L45 PolarHBondContact OD1-N 3.12Å; L45-E49 HydrophobicContact CB-CB 4.47Å; L45-E49 HydrophobicContact CD2-CG 3.95Å; L45-E49 VanDerWaalsContact CD2-OE1 3.26Å; L45-E49 WeakPolarHBondContact CD2-OE1 3.49Å; L45-E49 VanDerWaalsContact CD2-OE2 3.31Å; L45-E49 WeakPolarHBondContact CD2-OE2 3.15Å
46D79.7Confident81.3Confident92 Ų92103.3 Ų103.349%0.49256%0.556SS.*  trans-51.8145.6167.6175.939.1000109.1P44 Q48 E49 H50P44-D46 PolarHBondContact O-N 3.38Å; P44-D46 VanDerWaalsContact O-N 3.13Å; D46-Q48 PolarHBondContact O-N 3.3Å; D46-Q48 VanDerWaalsContact OD2-CB 3.31Å; D46-Q48 WeakPolarHBondContact OD2-CB 3.24Å; D46-E49 WeakPolarHBondContact O-CA 3.5Å; D46-E49 WeakPolarHBondContact O-CB 3.29Å; D46-E49 PolarHBondContact O-N 2.98Å; D46-H50 PolarHBondContact O-N 2.89Å
47S83Confident81.8Confident84 Ų84103.1 Ų103.159%0.58755%0.548SS*.Hα-helixtrans-51.9-35.5-178.361.20000112.1I51S47-I51 WeakPolarHBondContact O-CD1 3.33Å; S47-I51 VanDerWaalsContact O-CG1 3.26Å; S47-I51 WeakPolarHBondContact O-CG1 3.35Å; S47-I51 PolarHBondContact O-N 3.28Å; S47-I51 VanDerWaalsContact O-N 3.11Å
48Q88.1Confident82.4Confident131 Ų131101 Ų10161%0.61253%0.531SS*.Hα-helixtrans-67.8-43.2176-170.8175.7-30.600112.1D46 H50 I51 E52D46-Q48 PolarHBondContact O-N 3.3Å; D46-Q48 VanDerWaalsContact OD2-CB 3.31Å; D46-Q48 WeakPolarHBondContact OD2-CB 3.24Å; Q48-H50 VanDerWaalsContact C-N 3.33Å; Q48-H50 PolarHBondContact O-N 3.47Å; Q48-I51 PolarHBondContact O-N 3.49Å; Q48-E52 WeakPolarHBondContact O-CG 3.31Å; Q48-E52 PolarHBondContact O-N 3.28Å
49E89.2Confident82.9Confident98 Ų98102.5 Ų102.546%0.45852%0.523SS..Hα-helixtrans-64.8-39.1177.1-168.8179.4173.100111.3L45 D46 I51 E52 R53L45-E49 HydrophobicContact CB-CB 4.47Å; L45-E49 HydrophobicContact CD2-CG 3.95Å; L45-E49 VanDerWaalsContact CD2-OE1 3.26Å; L45-E49 WeakPolarHBondContact CD2-OE1 3.49Å; L45-E49 VanDerWaalsContact CD2-OE2 3.31Å; L45-E49 WeakPolarHBondContact CD2-OE2 3.15Å; D46-E49 WeakPolarHBondContact O-CA 3.5Å; D46-E49 WeakPolarHBondContact O-CB 3.29Å; D46-E49 PolarHBondContact O-N 2.98Å; E49-I51 PolarHBondContact O-N 3.48Å; E49-E52 PolarHBondContact O-N 2.75Å; E49-R53 HydrophobicContact CG-CG 4.42Å; E49-R53 WeakPolarHBondContact O-CB 3.49Å; E49-R53 WeakPolarHBondContact O-CG 3.27Å; E49-R53 PolarHBondContact O-N 2.93Å
50H87.6Confident83.6Confident93 Ų93101 Ų10143%0.43151%0.509SS..Hα-helixtrans-61.8-43.1175.2-174.9-86000112.3D46 Q48 S54D46-H50 PolarHBondContact O-N 2.89Å; Q48-H50 VanDerWaalsContact C-N 3.33Å; Q48-H50 PolarHBondContact O-N 3.47Å; H50-S54 VanDerWaalsContact O-CB 3.27Å; H50-S54 WeakPolarHBondContact O-CB 3.43Å; H50-S54 PolarHBondContact O-N 3.43Å; H50-S54 PolarHBondContact O-OG 3.3Å
51I91.3Very high84.5Confident109 Ų109100.5 Ų100.556%0.55950%0.5SS*.Hα-helixtrans-64-47.7176.9-70.3164.8000110.5S47 Q48 E49 S54 R55S47-I51 WeakPolarHBondContact O-CD1 3.33Å; S47-I51 VanDerWaalsContact O-CG1 3.26Å; S47-I51 WeakPolarHBondContact O-CG1 3.35Å; S47-I51 PolarHBondContact O-N 3.28Å; S47-I51 VanDerWaalsContact O-N 3.11Å; Q48-I51 PolarHBondContact O-N 3.49Å; E49-I51 PolarHBondContact O-N 3.48Å; I51-S54 PolarHBondContact O-N 2.93Å; I51-R55 PolarHBondContact O-N 2.96Å
52E92.7Very high85.6Confident83 Ų8396 Ų9639%0.38849%0.488SS..Hα-helixtrans-64.6-41.5-179.6-73.6-63.3170.400112.4Q48 E49 R55 Y56Q48-E52 WeakPolarHBondContact O-CG 3.31Å; Q48-E52 PolarHBondContact O-N 3.28Å; E49-E52 PolarHBondContact O-N 2.75Å; E52-R55 VanDerWaalsContact CD-NH2 3.33Å; E52-R55 PolarHBondContact O-N 2.9Å; E52-R55 IonicContact OE1-CZ 3.24Å; E52-R55 IonicContact OE1-NH2 2.66Å; E52-R55 PolarHBondContact OE1-NH2 3.33Å; E52-R55 IonicContact OE2-CZ 3.79Å; E52-R55 VanDerWaalsContact OE2-CZ 3.24Å; E52-R55 IonicContact OE2-NE 3.06Å; E52-R55 PolarHBondContact OE2-NE 3.41Å; E52-R55 IonicContact OE2-NH2 3.9Å; E52-R55 PolarHBondContact OE2-NH2 2.97Å; E52-Y56 WeakPolarHBondContact O-CB 3.29Å; E52-Y56 PolarHBondContact O-N 2.87Å
53R91.6Very high86.7Confident101 Ų10197 Ų9738%0.38149%0.49SS..Hα-helixtrans-64.4-41.4174.6-77.2-177.663.6176.3-2.3112.1E49 R55 Y56 Y57E49-R53 HydrophobicContact CG-CG 4.42Å; E49-R53 WeakPolarHBondContact O-CB 3.49Å; E49-R53 WeakPolarHBondContact O-CG 3.27Å; E49-R53 PolarHBondContact O-N 2.93Å; R53-R55 VanDerWaalsContact C-N 3.33Å; R53-R55 PolarHBondContact O-N 3.49Å; R53-Y56 PolarHBondContact O-N 2.97Å; R53-Y57 HydrophobicContact CB-CE2 4.27Å; R53-Y57 PolarHBondContact NH2-OH 2.88Å; R53-Y57 WeakPolarHBondContact O-CD2 3.49Å; R53-Y57 PolarHBondContact O-N 2.79Å
54S92.2Very high87.6Confident55 Ų5599 Ų9939%0.38550%0.497SS..Hα-helixtrans-62.1-42.2176.5-65.20000111.2H50 I51 Y57 A58H50-S54 VanDerWaalsContact O-CB 3.27Å; H50-S54 WeakPolarHBondContact O-CB 3.43Å; H50-S54 PolarHBondContact O-N 3.43Å; H50-S54 PolarHBondContact O-OG 3.3Å; I51-S54 PolarHBondContact O-N 2.93Å; S54-Y57 PolarHBondContact O-N 3Å; S54-A58 WeakPolarHBondContact O-CB 3.26Å; S54-A58 PolarHBondContact O-N 2.97Å
55R94.2Very high88.3Confident134 Ų13499.5 Ų99.551%0.50650%0.5SS..Hα-helixtrans-61.4-48173.5-176.917169.5146.1-1.9111.6I51 E52 R53 Y57 A58 E59I51-R55 PolarHBondContact O-N 2.96Å; E52-R55 VanDerWaalsContact CD-NH2 3.33Å; E52-R55 PolarHBondContact O-N 2.9Å; E52-R55 IonicContact OE1-CZ 3.24Å; E52-R55 IonicContact OE1-NH2 2.66Å; E52-R55 PolarHBondContact OE1-NH2 3.33Å; E52-R55 IonicContact OE2-CZ 3.79Å; E52-R55 VanDerWaalsContact OE2-CZ 3.24Å; E52-R55 IonicContact OE2-NE 3.06Å; E52-R55 PolarHBondContact OE2-NE 3.41Å; E52-R55 IonicContact OE2-NH2 3.9Å; E52-R55 PolarHBondContact OE2-NH2 2.97Å; R53-R55 VanDerWaalsContact C-N 3.33Å; R53-R55 PolarHBondContact O-N 3.49Å; R55-Y57 VanDerWaalsContact C-N 3.35Å; R55-Y57 PolarHBondContact O-N 3.35Å; R55-A58 PolarHBondContact O-N 3.15Å; R55-E59 HydrophobicContact CG-CG 4.5Å; R55-E59 WeakPolarHBondContact CG-OE1 3.13Å; R55-E59 WeakPolarHBondContact O-CB 3.39Å; R55-E59 WeakPolarHBondContact O-CG 3.27Å; R55-E59 PolarHBondContact O-N 3.45Å
56Y94.4Very high88.5Confident150 Ų150104.4 Ų104.459%0.58853%0.526SS*.Hα-helixtrans-57.1-45.2176.8173.8-96.1000112.5E52 R53 E59 S60E52-Y56 WeakPolarHBondContact O-CB 3.29Å; E52-Y56 PolarHBondContact O-N 2.87Å; R53-Y56 PolarHBondContact O-N 2.97Å; Y56-E59 PolarHBondContact O-N 3.11Å; Y56-S60 VanDerWaalsContact O-CB 3.29Å; Y56-S60 WeakPolarHBondContact O-CB 3.12Å; Y56-S60 PolarHBondContact O-N 3.22Å; Y56-S60 PolarHBondContact O-OG 3.13Å
57Y94Very high88.2Confident112 Ų112102.5 Ų102.544%0.43953%0.528SS..Hα-helixtrans-67.8-41.5178.2-65.6-43000112.4R53 S54 R55 E59 S60 I61R53-Y57 HydrophobicContact CB-CE2 4.27Å; R53-Y57 PolarHBondContact NH2-OH 2.88Å; R53-Y57 WeakPolarHBondContact O-CD2 3.49Å; R53-Y57 PolarHBondContact O-N 2.79Å; S54-Y57 PolarHBondContact O-N 3Å; R55-Y57 VanDerWaalsContact C-N 3.35Å; R55-Y57 PolarHBondContact O-N 3.35Å; Y57-E59 PolarHBondContact O-N 3.34Å; Y57-S60 PolarHBondContact O-N 3.32Å; Y57-I61 WeakPolarHBondContact O-CB 3.44Å; Y57-I61 VanDerWaalsContact O-CG1 3.27Å; Y57-I61 WeakPolarHBondContact O-CG1 3.44Å; Y57-I61 PolarHBondContact O-N 3.02Å
58A93.7Very high87.8Confident63 Ų63104.1 Ų104.152%0.52154%0.537SS..Hα-helixtrans-60.4-45175.900000111.6S54 R55 A62S54-A58 WeakPolarHBondContact O-CB 3.26Å; S54-A58 PolarHBondContact O-N 2.97Å; R55-A58 PolarHBondContact O-N 3.15Å; A58-A62 VanDerWaalsContact O-CB 3.24Å; A58-A62 WeakPolarHBondContact O-CB 3.43Å; A58-A62 PolarHBondContact O-N 3.09Å
59E94.4Very high87.2Confident84 Ų84102.6 Ų102.639%0.39354%0.538SS..Hα-helixtrans-65.5-39.9176.1-71.5-179.9-164.600112.4R55 Y56 Y57 A62 R63R55-E59 HydrophobicContact CG-CG 4.5Å; R55-E59 WeakPolarHBondContact CG-OE1 3.13Å; R55-E59 WeakPolarHBondContact O-CB 3.39Å; R55-E59 WeakPolarHBondContact O-CG 3.27Å; R55-E59 PolarHBondContact O-N 3.45Å; Y56-E59 PolarHBondContact O-N 3.11Å; Y57-E59 PolarHBondContact O-N 3.34Å; E59-A62 PolarHBondContact O-N 2.79Å; E59-R63 VanDerWaalsContact O-CG 3.29Å; E59-R63 WeakPolarHBondContact O-CG 3.44Å; E59-R63 PolarHBondContact O-N 3.03Å; E59-R63 VanDerWaalsContact O-N 3.12Å; E59-R63 IonicContact OE2-NH2 3.22Å
60S91.9Very high86.6Confident44 Ų44104.1 Ų104.131%0.30856%0.557SS.*Hα-helixtrans-65.8-46178.8-62.10000111.7Y56 Y57 A62 R63 Q64Y56-S60 VanDerWaalsContact O-CB 3.29Å; Y56-S60 WeakPolarHBondContact O-CB 3.12Å; Y56-S60 PolarHBondContact O-N 3.22Å; Y56-S60 PolarHBondContact O-OG 3.13Å; Y57-S60 PolarHBondContact O-N 3.32Å; S60-A62 VanDerWaalsContact C-N 3.35Å; S60-R63 PolarHBondContact O-N 3.03Å; S60-Q64 PolarHBondContact O-N 3.18Å
61I88.5Confident86.1Confident97 Ų97106.1 Ų106.150%0.49757%0.57SS.*Hα-helixtrans-65.6-39.1177.4-67.3167.5000110.6Y57 R63 Q64 L66Y57-I61 WeakPolarHBondContact O-CB 3.44Å; Y57-I61 VanDerWaalsContact O-CG1 3.27Å; Y57-I61 WeakPolarHBondContact O-CG1 3.44Å; Y57-I61 PolarHBondContact O-N 3.02Å; I61-R63 VanDerWaalsContact C-N 3.28Å; I61-R63 PolarHBondContact O-N 3.19Å; I61-Q64 PolarHBondContact O-N 2.87Å; I61-L66 HydrophobicContact CG2-CD2 4.47Å
62A88.2Confident85.6Confident83 Ų83105.1 Ų105.169%0.68657%0.571SS**Hα-helixtrans-66.5-27.6177.900000113.5A58 E59 S60A58-A62 VanDerWaalsContact O-CB 3.24Å; A58-A62 WeakPolarHBondContact O-CB 3.43Å; A58-A62 PolarHBondContact O-N 3.09Å; E59-A62 PolarHBondContact O-N 2.79Å; S60-A62 VanDerWaalsContact C-N 3.35Å
63R87.4Confident85.1Confident198 Ų198107.7 Ų107.775%0.74759%0.592SS**Hα-helixtrans-90.3-19.9177.1-69.1176.6-169.1-1799.8113.4E59 S60 I61E59-R63 VanDerWaalsContact O-CG 3.29Å; E59-R63 WeakPolarHBondContact O-CG 3.44Å; E59-R63 PolarHBondContact O-N 3.03Å; E59-R63 VanDerWaalsContact O-N 3.12Å; E59-R63 IonicContact OE2-NH2 3.22Å; S60-R63 PolarHBondContact O-N 3.03Å; I61-R63 VanDerWaalsContact C-N 3.28Å; I61-R63 PolarHBondContact O-N 3.19Å
64Q84.3Confident84.8Confident126 Ų126110.9 Ų110.959%0.58961%0.609SS**SBendtrans-65133.1174.9-167.8169.41.900108.1S60 I61 L66S60-Q64 PolarHBondContact O-N 3.18Å; I61-Q64 PolarHBondContact O-N 2.87Å; Q64-L66 VanDerWaalsContact C-N 3.32Å; Q64-L66 PolarHBondContact O-N 3.14Å
65P78.6Confident84.4Confident117 Ų117115.7 Ų115.776%0.7663%0.629SS**  trans-59.5103.2168.523.3-30.6000107G67P65-G67 PolarHBondContact O-N 2.81Å; P65-G67 VanDerWaalsContact O-N 3.11Å
66L73.2Confident83.9Confident138 Ų138114.3 Ų114.372%0.72364%0.637SS**PPolyproline II helixtrans-59.8120.5170.4-65.6172.3000104.8I61 Q64I61-L66 HydrophobicContact CG2-CD2 4.47Å; Q64-L66 VanDerWaalsContact C-N 3.32Å; Q64-L66 PolarHBondContact O-N 3.14Å
67G74.6Confident83.5Confident52 Ų52117.8 Ų117.854%0.53665%0.65SS.*PPolyproline II helixtrans-53.1173.9166.900000110.1P65 P69P65-G67 PolarHBondContact O-N 2.81Å; P65-G67 VanDerWaalsContact O-N 3.11Å; G67-P69 VanDerWaalsContact O-N 3.14Å
68P74Confident82.9Confident118 Ų118117.7 Ų117.777%0.76666%0.66SS**SBendtrans-48.2132.1174.723.1-32.9000108.6
69P74.6Confident82.4Confident100 Ų100120.1 Ų120.165%0.64966%0.659SS**PPolyproline II helixtrans-51.4141.3178.922.9-33000107.4G67 L71G67-P69 VanDerWaalsContact O-N 3.14Å; P69-L71 PolarHBondContact O-N 2.79Å
70P76.4Confident81.9Confident129 Ų129120 Ų12084%0.83868%0.681SS**  trans-53.7110.7177.522.6-31.6000107
71L77.3Confident81.8Confident136 Ų136122.1 Ų122.171%0.71269%0.689SS**  trans-60.6140177.7-72.8170.8000106.6P69 V73P69-L71 PolarHBondContact O-N 2.79Å; L71-V73 PolarHBondContact O-N 3.12Å; L71-V73 VanDerWaalsContact O-N 3.12Å
72P81.8Confident81.7Confident88 Ų88122.1 Ų122.157%0.57170%0.695SS**  trans-51.9128.5172.420.6-29.6000107.8F74P72-F74 VanDerWaalsContact C-N 3.34Å; P72-F74 HydrophobicContact CG-CE2 3.85Å; P72-F74 HydrophobicContact CG-CZ 3.87Å; P72-F74 WeakPolarHBondContact O-CD2 3.19Å; P72-F74 PolarHBondContact O-N 2.86Å
73V82.7Confident81.9Confident137 Ų137120.3 Ų120.383%0.8368%0.68SS**  trans-65.1100.2178.1179.10000106.8L71 L75L71-V73 PolarHBondContact O-N 3.12Å; L71-V73 VanDerWaalsContact O-N 3.12Å; V73-L75 PolarHBondContact O-N 3.32Å
74F83.6Confident82Confident168 Ų168113.8 Ų113.874%0.73767%0.665SS**PPolyproline II helixtrans-72.8124.4171.5-68.3-78.4000108P72P72-F74 VanDerWaalsContact C-N 3.34Å; P72-F74 HydrophobicContact CG-CE2 3.85Å; P72-F74 HydrophobicContact CG-CZ 3.87Å; P72-F74 WeakPolarHBondContact O-CD2 3.19Å; P72-F74 PolarHBondContact O-N 2.86Å
75L84.1Confident82.2Confident155 Ų155111.5 Ų111.581%0.81266%0.656SS**PPolyproline II helixtrans-60.2137.4172.3-64.7177000109.1V73 R77V73-L75 PolarHBondContact O-N 3.32Å; L75-R77 PolarHBondContact O-N 3.45Å
76P84.3Confident82.6Confident105 Ų105112.7 Ų112.768%0.68265%0.654SS**PPolyproline II helixtrans-59.1131.9179.624.3-33000109.6T78P76-T78 PolarHBondContact O-N 3.05Å
77R85.6Confident83.4Confident224 Ų224112.6 Ų112.685%0.84565%0.654SS**  trans-69106.9171.1-178.8178.7-70.3167.3-1.9107.9L75 F79L75-R77 PolarHBondContact O-N 3.45Å; R77-F79 VanDerWaalsContact CG-O 3.27Å; R77-F79 WeakPolarHBondContact CG-O 3.27Å
78T82.5Confident84.1Confident109 Ų109112.3 Ų112.367%0.66965%0.647SS**  trans-76.2-27.6-177.646.60000112.9P76P76-T78 PolarHBondContact O-N 3.05Å
79F82Confident85Confident114 Ų114112.8 Ų112.850%0.565%0.65SS.*  trans-143.5144-177.5-56.5-85.1000112.6R77 I85R77-F79 VanDerWaalsContact CG-O 3.27Å; R77-F79 WeakPolarHBondContact CG-O 3.27Å; F79-I85 HydrophobicContact CB-CD1 3.86Å; F79-I85 HydrophobicContact CB-CG1 4.12Å; F79-I85 HydrophobicContact CD1-CD1 4.43Å; F79-I85 HydrophobicContact CD1-CG1 4.07Å; F79-I85 HydrophobicContact CD2-CD1 3.14Å; F79-I85 HydrophobicContact CD2-CG1 3.65Å; F79-I85 HydrophobicContact CE1-CG1 4.43Å; F79-I85 HydrophobicContact CE2-CD1 3.75Å; F79-I85 HydrophobicContact CE2-CG1 4.04Å; F79-I85 HydrophobicContact CG-CD1 3.55Å; F79-I85 HydrophobicContact CG-CG1 3.66Å; F79-I85 HydrophobicContact CZ-CG1 4.41Å
80G85.3Confident85.8Confident81 Ų81115.4 Ų115.484%0.83566%0.658SS**SBendtrans-81.4-24.5177.600000114.3
81N88.8Confident86.6Confident90 Ų90113.7 Ų113.748%0.48165%0.645SS.*  trans-128.1110.2174.4179.66.4000108.7A83 S84N81-A83 VanDerWaalsContact C-N 3.25Å; N81-A83 PolarHBondContact O-N 2.85Å; N81-A83 WeakPolarHBondContact OD1-CB 3.42Å; N81-A83 PolarHBondContact OD1-N 3.26Å; N81-A83 VanDerWaalsContact OD1-N 3.08Å; N81-S84 PolarHBondContact O-N 3.23Å; N81-S84 PolarHBondContact O-OG 3.26Å
82P87.4Confident87.5Confident96 Ų96113.5 Ų113.562%0.62364%0.64SS**SBendtrans-67-26.1-179.725.9-33.2000113S84 I85P82-S84 VanDerWaalsContact C-N 3.31Å; P82-S84 PolarHBondContact O-N 3.44Å; P82-I85 WeakPolarHBondContact O-CB 3.37Å; P82-I85 PolarHBondContact O-N 2.62Å
83A90.6Very high88.2Confident45 Ų45115.5 Ų115.537%0.37265%0.645SS.*Hα-helixtrans-64.5-36-179.100000112.1N81 I85 I86 D87N81-A83 VanDerWaalsContact C-N 3.25Å; N81-A83 PolarHBondContact O-N 2.85Å; N81-A83 WeakPolarHBondContact OD1-CB 3.42Å; N81-A83 PolarHBondContact OD1-N 3.26Å; N81-A83 VanDerWaalsContact OD1-N 3.08Å; A83-I85 PolarHBondContact O-N 3.48Å; A83-I85 VanDerWaalsContact O-N 3.15Å; A83-I86 PolarHBondContact O-N 3.15Å; A83-I86 VanDerWaalsContact O-N 3.1Å; A83-D87 PolarHBondContact O-N 3.36Å
84S89.5Confident88.8Confident62 Ų62112 Ų11243%0.43463%0.63SS.*Hα-helixtrans-67.1-17-179.761.20000114N81 P82 A88N81-S84 PolarHBondContact O-N 3.23Å; N81-S84 PolarHBondContact O-OG 3.26Å; P82-S84 VanDerWaalsContact C-N 3.31Å; P82-S84 PolarHBondContact O-N 3.44Å; S84-A88 PolarHBondContact O-N 3.09Å
85I88.8Confident89.4Confident77 Ų77108.4 Ų108.440%0.39562%0.616SS.*Hα-helixtrans-73.9-40.5174.6-54.2168.5000110F79 P82 A83 D87 A88F79-I85 HydrophobicContact CB-CD1 3.86Å; F79-I85 HydrophobicContact CB-CG1 4.12Å; F79-I85 HydrophobicContact CD1-CD1 4.43Å; F79-I85 HydrophobicContact CD1-CG1 4.07Å; F79-I85 HydrophobicContact CD2-CD1 3.14Å; F79-I85 HydrophobicContact CD2-CG1 3.65Å; F79-I85 HydrophobicContact CE1-CG1 4.43Å; F79-I85 HydrophobicContact CE2-CD1 3.75Å; F79-I85 HydrophobicContact CE2-CG1 4.04Å; F79-I85 HydrophobicContact CG-CD1 3.55Å; F79-I85 HydrophobicContact CG-CG1 3.66Å; F79-I85 HydrophobicContact CZ-CG1 4.41Å; P82-I85 WeakPolarHBondContact O-CB 3.37Å; P82-I85 PolarHBondContact O-N 2.62Å; A83-I85 PolarHBondContact O-N 3.48Å; A83-I85 VanDerWaalsContact O-N 3.15Å; I85-D87 VanDerWaalsContact C-N 3.29Å; I85-A88 WeakPolarHBondContact O-CB 3.49Å; I85-A88 PolarHBondContact O-N 3.04Å
86I87.7Confident90Very high143 Ų143104.4 Ų104.473%0.73359%0.594SS**Hα-helixtrans-69.1-35.3-178-59.4173.7000110A83 A88A83-I86 PolarHBondContact O-N 3.15Å; A83-I86 VanDerWaalsContact O-N 3.1Å; I86-A88 VanDerWaalsContact C-N 3.31Å
87D90.4Very high90.6Very high135 Ų135103 Ų10372%0.72258%0.581SS**THydrogen-bonded Turntrans-83.9-4.2178.3-61.7-30.8000113.5A83 I85A83-D87 PolarHBondContact O-N 3.36Å; I85-D87 VanDerWaalsContact C-N 3.29Å
88A89.2Confident91.2Very high46 Ų4699.1 Ų99.138%0.3857%0.572SS.*SBendtrans-67149.8178.700000110.9S84 I85 I86 L90S84-A88 PolarHBondContact O-N 3.09Å; I85-A88 WeakPolarHBondContact O-CB 3.49Å; I85-A88 PolarHBondContact O-N 3.04Å; I86-A88 VanDerWaalsContact C-N 3.31Å; A88-L90 PolarHBondContact O-N 3.38Å
89P92.3Very high91.8Very high128 Ų12899.3 Ų99.383%0.83157%0.568SS**PPolyproline II helixtrans-53.1133.1172-2534.3000111.1
90L92.7Very high92.5Very high156 Ų156100 Ų10082%0.81757%0.568SS**PPolyproline II helixtrans-69.7153.1173.5-62.5177.7000110A88 E92A88-L90 PolarHBondContact O-N 3.38Å; L90-E92 PolarHBondContact O-N 3.46Å
91V93.1Very high93.1Very high92 Ų92100.5 Ų100.556%0.55855%0.548SS*.PPolyproline II helixtrans-52.6135169.6179.70000109.4E95 I96V91-E95 HydrophobicContact CG1-CB 3.95Å; V91-E95 VanDerWaalsContact CG1-OE2 3.28Å; V91-E95 WeakPolarHBondContact CG1-OE2 3.39Å; V91-I96 HydrophobicContact CG1-CD1 4.41Å; V91-I96 HydrophobicContact CG1-CG1 3.89Å
92E95.7Very high93.5Very high133 Ų133100.7 Ų100.762%0.62155%0.549SS*.PPolyproline II helixtrans-71.1147.5-176.9-66.2-169179.200111.2L90 A94 E95 I96L90-E92 PolarHBondContact O-N 3.46Å; E92-A94 PolarHBondContact O-N 3.31Å; E92-E95 HydrophobicContact CB-CG 4.26Å; E92-E95 PolarHBondContact N-OE2 3.05Å; E92-E95 PolarHBondContact O-N 3.41Å; E92-E95 VanDerWaalsContact O-N 3.12Å; E92-I96 PolarHBondContact O-N 3.34Å; E92-I96 VanDerWaalsContact O-N 3.15Å
93I95.7Very high93.9Very high129 Ų12998.9 Ų98.966%0.66254%0.542SS*.Hα-helixtrans-59.9-31.2177.3-65.4174000111.1I96 N97I93-I96 PolarHBondContact O-N 3.12Å; I93-N97 WeakPolarHBondContact O-CB 3.39Å; I93-N97 PolarHBondContact O-N 3.43Å; I93-N97 PolarHBondContact O-ND2 3.22Å
94A96.2Very high94.1Very high63 Ų63102.6 Ų102.652%0.52155%0.55SS..Hα-helixtrans-60.4-47.9175.700000111.7E92 I96 N97 E98E92-A94 PolarHBondContact O-N 3.31Å; A94-I96 PolarHBondContact O-N 3.36Å; A94-N97 PolarHBondContact O-N 3.44Å; A94-E98 PolarHBondContact O-N 2.98Å
95E95.9Very high94.4Very high94 Ų94103.8 Ų103.844%0.43955%0.548SS..Hα-helixtrans-62.4-42.5177.3-61.2175.6127.700111.2V91 E92 N97 E98 I99V91-E95 HydrophobicContact CG1-CB 3.95Å; V91-E95 VanDerWaalsContact CG1-OE2 3.28Å; V91-E95 WeakPolarHBondContact CG1-OE2 3.39Å; E92-E95 HydrophobicContact CB-CG 4.26Å; E92-E95 PolarHBondContact N-OE2 3.05Å; E92-E95 PolarHBondContact O-N 3.41Å; E92-E95 VanDerWaalsContact O-N 3.12Å; E95-N97 VanDerWaalsContact C-N 3.3Å; E95-N97 PolarHBondContact O-N 3.37Å; E95-E98 PolarHBondContact O-N 2.82Å; E95-I99 WeakPolarHBondContact O-CG1 3.49Å; E95-I99 PolarHBondContact O-N 3.08Å
96I96.8Very high94.6Very high71 Ų71104 Ų10436%0.36455%0.55SS..Hα-helixtrans-61.6-40.2176.4-64171.1000111.1V91 E92 I93 A94 R100V91-I96 HydrophobicContact CG1-CD1 4.41Å; V91-I96 HydrophobicContact CG1-CG1 3.89Å; E92-I96 PolarHBondContact O-N 3.34Å; E92-I96 VanDerWaalsContact O-N 3.15Å; I93-I96 PolarHBondContact O-N 3.12Å; A94-I96 PolarHBondContact O-N 3.36Å; I96-R100 WeakPolarHBondContact O-CB 3.5Å; I96-R100 PolarHBondContact O-N 2.94Å
97N97.2Very high94.8Very high76 Ų76100 Ų10041%0.40654%0.538SS..Hα-helixtrans-69.3-39.5179-73.4-24.7000112I93 A94 E95 R100 Q101I93-N97 WeakPolarHBondContact O-CB 3.39Å; I93-N97 PolarHBondContact O-N 3.43Å; I93-N97 PolarHBondContact O-ND2 3.22Å; A94-N97 PolarHBondContact O-N 3.44Å; E95-N97 VanDerWaalsContact C-N 3.3Å; E95-N97 PolarHBondContact O-N 3.37Å; N97-R100 PolarHBondContact O-N 3.4Å; N97-R100 PolarHBondContact OD1-NH1 3.15Å; N97-Q101 WeakPolarHBondContact O-CB 3.46Å; N97-Q101 PolarHBondContact O-N 3.3Å
98E96.9Very high94.8Very high141 Ų14197.1 Ų97.166%0.65953%0.526SS*.Hα-helixtrans-61.1-49.6174.3-175.3178.5-174.100111.2A94 E95 R100 Q101 L102A94-E98 PolarHBondContact O-N 2.98Å; E95-E98 PolarHBondContact O-N 2.82Å; E98-R100 VanDerWaalsContact C-N 3.28Å; E98-R100 PolarHBondContact O-N 3.26Å; E98-Q101 WeakPolarHBondContact O-CB 3.33Å; E98-Q101 PolarHBondContact O-N 3.46Å; E98-Q101 VanDerWaalsContact O-N 3.08Å; E98-L102 PolarHBondContact O-N 3.47Å
99I96.7Very high94.7Very high114 Ų114100.7 Ų100.759%0.58553%0.533SS*.Hα-helixtrans-59.1-41.3176.5-67.2166.6000110.8E95 Q101 L102 A103E95-I99 WeakPolarHBondContact O-CG1 3.49Å; E95-I99 PolarHBondContact O-N 3.08Å; I99-Q101 VanDerWaalsContact C-N 3.32Å; I99-Q101 PolarHBondContact O-N 3.36Å; I99-L102 PolarHBondContact O-N 2.88Å; I99-A103 WeakPolarHBondContact O-CB 3.41Å; I99-A103 PolarHBondContact O-N 3.48Å
100R96.6Very high94.4Very high129 Ų12999.1 Ų99.149%0.48752%0.52SS..Hα-helixtrans-64.2-38.6177.2-172-177.4-62119.91.8111.9I96 N97 E98 K104I96-R100 WeakPolarHBondContact O-CB 3.5Å; I96-R100 PolarHBondContact O-N 2.94Å; N97-R100 PolarHBondContact O-N 3.4Å; N97-R100 PolarHBondContact OD1-NH1 3.15Å; E98-R100 VanDerWaalsContact C-N 3.28Å; E98-R100 PolarHBondContact O-N 3.26Å; R100-K104 WeakPolarHBondContact O-CG 3.28Å; R100-K104 PolarHBondContact O-N 3.01Å
101Q96.8Very high94Very high91 Ų9197.3 Ų97.343%0.42551%0.508SS..Hα-helixtrans-67.2-47.5177.9-178.256.727.300110.8N97 E98 I99 A103 K104 E105N97-Q101 WeakPolarHBondContact O-CB 3.46Å; N97-Q101 PolarHBondContact O-N 3.3Å; E98-Q101 WeakPolarHBondContact O-CB 3.33Å; E98-Q101 PolarHBondContact O-N 3.46Å; E98-Q101 VanDerWaalsContact O-N 3.08Å; I99-Q101 VanDerWaalsContact C-N 3.32Å; I99-Q101 PolarHBondContact O-N 3.36Å; Q101-A103 VanDerWaalsContact C-N 3.3Å; Q101-A103 PolarHBondContact O-N 2.93Å; Q101-K104 WeakPolarHBondContact O-CB 3.49Å; Q101-K104 PolarHBondContact O-N 3.04Å; Q101-E105 WeakPolarHBondContact CG-OE1 3.44Å; Q101-E105 PolarHBondContact NE2-OE1 3.27Å; Q101-E105 PolarHBondContact O-N 3.34Å
102L96.5Very high93.6Very high94 Ų9497.9 Ų97.949%0.49250%0.504SS..Hα-helixtrans-57.6-42.4175.5-176.566.7000112E98 I99 K104 E105 N106E98-L102 PolarHBondContact O-N 3.47Å; I99-L102 PolarHBondContact O-N 2.88Å; L102-K104 VanDerWaalsContact C-N 3.31Å; L102-K104 PolarHBondContact O-N 2.95Å; L102-E105 PolarHBondContact O-N 3.4Å; L102-N106 WeakPolarHBondContact O-CB 3.43Å; L102-N106 PolarHBondContact O-N 3.26Å; L102-N106 PolarHBondContact O-ND2 3.42Å
103A96.5Very high92.9Very high57 Ų5798.4 Ų98.447%0.47151%0.508SS..Hα-helixtrans-62-37.3176.900000112.6I99 Q101 A107I99-A103 WeakPolarHBondContact O-CB 3.41Å; I99-A103 PolarHBondContact O-N 3.48Å; Q101-A103 VanDerWaalsContact C-N 3.3Å; Q101-A103 PolarHBondContact O-N 2.93Å; A103-A107 WeakPolarHBondContact O-CB 3.49Å; A103-A107 PolarHBondContact O-N 3.33Å
104K95.6Very high92Very high124 Ų12497.2 Ų97.254%0.53951%0.507SS..Hα-helixtrans-68-44.3175.5-73.6175.4178.8-178.60111.9R100 Q101 L102 N106 A107 V108R100-K104 WeakPolarHBondContact O-CG 3.28Å; R100-K104 PolarHBondContact O-N 3.01Å; Q101-K104 WeakPolarHBondContact O-CB 3.49Å; Q101-K104 PolarHBondContact O-N 3.04Å; L102-K104 VanDerWaalsContact C-N 3.31Å; L102-K104 PolarHBondContact O-N 2.95Å; K104-N106 VanDerWaalsContact C-N 3.34Å; K104-A107 WeakPolarHBondContact O-CB 3.34Å; K104-A107 PolarHBondContact O-N 3.14Å; K104-V108 PolarHBondContact O-N 3.38Å
105E94.5Very high90.7Very high87 Ų8797.9 Ų97.941%0.40751%0.505SS..Hα-helixtrans-60.6-45.4177.2-70.7169-169.900110.8Q101 L102 A107 V108 F109Q101-E105 WeakPolarHBondContact CG-OE1 3.44Å; Q101-E105 PolarHBondContact NE2-OE1 3.27Å; Q101-E105 PolarHBondContact O-N 3.34Å; L102-E105 PolarHBondContact O-N 3.4Å; E105-A107 VanDerWaalsContact C-N 3.32Å; E105-A107 PolarHBondContact O-N 3.2Å; E105-V108 WeakPolarHBondContact O-CB 3.37Å; E105-V108 PolarHBondContact O-N 3.23Å; E105-V108 VanDerWaalsContact O-N 3.14Å; E105-F109 VanDerWaalsContact O-CD2 3.28Å; E105-F109 WeakPolarHBondContact O-CD2 3.45Å; E105-F109 PolarHBondContact O-N 3.08Å
106N93.2Very high89.3Confident80 Ų80100.5 Ų100.543%0.42852%0.517SS..Hα-helixtrans-63-36.2175.8-72.9-19.1000113.3L102 K104 V108 F109 V110L102-N106 WeakPolarHBondContact O-CB 3.43Å; L102-N106 PolarHBondContact O-N 3.26Å; L102-N106 PolarHBondContact O-ND2 3.42Å; K104-N106 VanDerWaalsContact C-N 3.34Å; N106-V108 VanDerWaalsContact C-N 3.28Å; N106-V108 PolarHBondContact O-N 2.88Å; N106-F109 PolarHBondContact O-N 3.29Å; N106-V110 WeakPolarHBondContact O-CG2 3.47Å; N106-V110 PolarHBondContact O-N 3.32Å
107A92.1Very high87.8Confident59 Ų59106.4 Ų106.449%0.48854%0.544SS..Hα-helixtrans-63.7-34.5175.900000112.3A103 K104 E105 H111A103-A107 WeakPolarHBondContact O-CB 3.49Å; A103-A107 PolarHBondContact O-N 3.33Å; K104-A107 WeakPolarHBondContact O-CB 3.34Å; K104-A107 PolarHBondContact O-N 3.14Å; E105-A107 VanDerWaalsContact C-N 3.32Å; E105-A107 PolarHBondContact O-N 3.2Å; A107-H111 WeakPolarHBondContact O-CB 3.28Å; A107-H111 PolarHBondContact O-N 3.03Å
108V90.4Very high86.3Confident76 Ų76111.1 Ų111.146%0.46156%0.56SS.*Hα-helixtrans-63.3-48173.7176.10000110.3K104 E105 N106 V110 H111 E112K104-V108 PolarHBondContact O-N 3.38Å; E105-V108 WeakPolarHBondContact O-CB 3.37Å; E105-V108 PolarHBondContact O-N 3.23Å; E105-V108 VanDerWaalsContact O-N 3.14Å; N106-V108 VanDerWaalsContact C-N 3.28Å; N106-V108 PolarHBondContact O-N 2.88Å; V108-V110 VanDerWaalsContact C-N 3.34Å; V108-V110 PolarHBondContact O-N 3.45Å; V108-H111 WeakPolarHBondContact O-CB 3.42Å; V108-H111 PolarHBondContact O-N 3.12Å; V108-H111 VanDerWaalsContact O-N 3.08Å; V108-E112 HydrophobicContact CG1-CG 4.34Å; V108-E112 WeakPolarHBondContact CG1-OE1 3.43Å; V108-E112 WeakPolarHBondContact O-CG 3.48Å; V108-E112 PolarHBondContact O-N 2.99Å
109F87.4Confident84.9Confident120 Ų120111.6 Ų111.653%0.52657%0.567SS.*Hα-helixtrans-60.3-41.9178.2-64-53.1000112.9E105 N106 H111 E112 M113E105-F109 VanDerWaalsContact O-CD2 3.28Å; E105-F109 WeakPolarHBondContact O-CD2 3.45Å; E105-F109 PolarHBondContact O-N 3.08Å; N106-F109 PolarHBondContact O-N 3.29Å; F109-H111 VanDerWaalsContact C-N 3.3Å; F109-H111 PolarHBondContact O-N 3.1Å; F109-E112 PolarHBondContact O-N 3.28Å; F109-M113 WeakPolarHBondContact O-CG 3.41Å; F109-M113 PolarHBondContact O-N 2.97Å
110V87Confident83.4Confident95 Ų95113.4 Ų113.458%0.57658%0.578SS**Hα-helixtrans-62.8-39175.6173.30000111.1N106 V108 M113 T114N106-V110 WeakPolarHBondContact O-CG2 3.47Å; N106-V110 PolarHBondContact O-N 3.32Å; V108-V110 VanDerWaalsContact C-N 3.34Å; V108-V110 PolarHBondContact O-N 3.45Å; V110-M113 PolarHBondContact O-N 3.31Å; V110-T114 PolarHBondContact O-N 3.19Å
111H84.2Confident82.1Confident118 Ų118115.1 Ų115.155%0.54660%0.596SS.*Hα-helixtrans-67-43.8176.5-171.452.5000112A107 V108 F109 M113 T114 T115A107-H111 WeakPolarHBondContact O-CB 3.28Å; A107-H111 PolarHBondContact O-N 3.03Å; V108-H111 WeakPolarHBondContact O-CB 3.42Å; V108-H111 PolarHBondContact O-N 3.12Å; V108-H111 VanDerWaalsContact O-N 3.08Å; F109-H111 VanDerWaalsContact C-N 3.3Å; F109-H111 PolarHBondContact O-N 3.1Å; H111-M113 VanDerWaalsContact C-N 3.26Å; H111-M113 PolarHBondContact O-N 2.94Å; H111-T114 WeakPolarHBondContact O-CA 3.42Å; H111-T114 PolarHBondContact O-N 3.47Å; H111-T114 PolarHBondContact O-OG1 3.38Å; H111-T115 PolarHBondContact O-N 3.18Å; H111-T115 VanDerWaalsContact O-N 3.12Å; H111-T115 PolarHBondContact O-OG1 3.15Å
112E84.2Confident80.8Confident105 Ų105116.3 Ų116.349%0.49160%0.604SS.*Hα-helixtrans-59.9-36176.5-72.6175.617800112.4V108 F109 T114 T115V108-E112 HydrophobicContact CG1-CG 4.34Å; V108-E112 WeakPolarHBondContact CG1-OE1 3.43Å; V108-E112 WeakPolarHBondContact O-CG 3.48Å; V108-E112 PolarHBondContact O-N 2.99Å; F109-E112 PolarHBondContact O-N 3.28Å; E112-T114 PolarHBondContact O-N 3.4Å; E112-T115 PolarHBondContact O-N 2.92Å; E112-T115 PolarHBondContact O-OG1 3.01Å
113M80.4Confident79.5Confident143 Ų143115.7 Ų115.770%0.70461%0.613SS**Hα-helixtrans-62.8-31173-71.6179.269.400112.8F109 V110 H111F109-M113 WeakPolarHBondContact O-CG 3.41Å; F109-M113 PolarHBondContact O-N 2.97Å; V110-M113 PolarHBondContact O-N 3.31Å; H111-M113 VanDerWaalsContact C-N 3.26Å; H111-M113 PolarHBondContact O-N 2.94Å
114T76.2Confident77.9Confident104 Ų104120.4 Ų120.464%0.63863%0.625SS**Hα-helixtrans-81.4-28.8178.655.10000113.7V110 H111 E112V110-T114 PolarHBondContact O-N 3.19Å; H111-T114 WeakPolarHBondContact O-CA 3.42Å; H111-T114 PolarHBondContact O-N 3.47Å; H111-T114 PolarHBondContact O-OG1 3.38Å; E112-T114 PolarHBondContact O-N 3.4Å
115T69.1Low76.5Confident78 Ų78123.8 Ų123.848%0.47964%0.64SS.*  trans-96.411.2-17353.10000114.1H111 E112 E117H111-T115 PolarHBondContact O-N 3.18Å; H111-T115 VanDerWaalsContact O-N 3.12Å; H111-T115 PolarHBondContact O-OG1 3.15Å; E112-T115 PolarHBondContact O-N 2.92Å; E112-T115 PolarHBondContact O-OG1 3.01Å; T115-E117 PolarHBondContact O-N 3.08Å
116Q67.2Low74.9Confident149 Ų149126.8 Ų126.870%0.69666%0.658SS**  trans-56.3105.3173.3-69.9-170.9-11.500108.9K118Q116-K118 PolarHBondContact O-N 2.93Å
117E65.6Low72.8Confident195 Ų195132.3 Ų132.391%0.91168%0.682SS**  trans-53112.5172.1-91.5-172.1158.600106.5T115T115-E117 PolarHBondContact O-N 3.08Å
118K66.2Low71Confident175 Ų175137.8 Ų137.876%0.76173%0.727SS**  trans-75.3128.3168.2-66.5-178.8179.1175.80105.3Q116 D120Q116-K118 PolarHBondContact O-N 2.93Å; K118-D120 PolarHBondContact O-N 3.32Å
119D66.8Low70Confident151 Ų151140.9 Ų140.981%0.80774%0.74SS**  trans-45.2132.8161.6-72-41.3000108.1L121D119-L121 PolarHBondContact O-N 3.34Å
120D65.9Low69.1Low152 Ų152142 Ų14281%0.81375%0.752SS**  trans-54.9106.9177.3-98.7-26.1000108.4K118 I122K118-D120 PolarHBondContact O-N 3.32Å; D120-I122 PolarHBondContact O-N 3.07Å; D120-I122 VanDerWaalsContact O-N 3.15Å
121L68.4Low68.1Low164 Ų164144.6 Ų144.686%0.85976%0.762SS**SBendtrans-66.8-10.9175.2-94.6116.2000112D119D119-L121 PolarHBondContact O-N 3.34Å
122I69Low67.1Low116 Ų116146.2 Ų146.260%0.59577%0.774SS**  trans-106.499.1-176.1-53.9177.3000108.7D120 H124D120-I122 PolarHBondContact O-N 3.07Å; D120-I122 VanDerWaalsContact O-N 3.15Å; I122-H124 PolarHBondContact O-N 2.81Å
123A68.7Low66.1Low81 Ų81148.8 Ų148.867%0.66979%0.792SS**  trans-77.1111.116600000109.4F125A123-F125 PolarHBondContact O-N 3.19Å
124H64.7Low65.1Low157 Ų157149.1 Ų149.173%0.72780%0.798SS**  trans-72.5110.3170.1-73.6-66.7000109.8I122 N126I122-H124 PolarHBondContact O-N 2.81Å; H124-N126 PolarHBondContact O-N 2.77Å; H124-N126 VanDerWaalsContact O-N 3.09Å
125F65.4Low64.3Low195 Ų195152.4 Ų152.486%0.85581%0.809SS**  trans-70.1102.3168.2-85.1-88.8000109.4A123 Q127A123-F125 PolarHBondContact O-N 3.19Å; F125-Q127 PolarHBondContact O-N 2.95Å
126N61.2Low64Low149 Ų149158.1 Ų158.180%0.79784%0.835SS**  trans-74.9118.3165.1-70.6-29.9000108.3H124 A128H124-N126 PolarHBondContact O-N 2.77Å; H124-N126 VanDerWaalsContact O-N 3.09Å; N126-A128 PolarHBondContact O-N 3.25Å
127Q49.1Very low63.7Low197 Ų197158.8 Ų158.892%0.92185%0.846SS**  trans-66115.6170.8-74.8178.6-28.100108.8F125F125-Q127 PolarHBondContact O-N 2.95Å
128A53.3Low63.5Low174 Ų174155.5 Ų155.5100%1.43884%0.84SS**  trans-81.60164.900000110.5N126N126-A128 PolarHBondContact O-N 3.25Å

Retrieved 128 of 128 residues in 107 ms (Link to these results)