A0A096MXT9_PAPAN Loading...

Mitochondrial import inner membrane translocase subunit TIM17

Essential component of the TIM23 complex, a complex that mediates the translocation of transit peptide-containing proteins across the mitochondrial inner membrane.

AlphaFold DB (A0A2K6D2H8), UniProt , Accession A0A096MXT9, Species PAPAN (Papio anubis, Olive baboon), Gene TIMM17B, Length 172 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.2Very low59Low244 Ų244142.4 Ų142.4100%1.20271%0.714SS**  0680-81.5-166.5-96.800109.2
2E34Very low61.3Low188 Ų188134.8 Ų134.888%0.87967%0.671SS**  trans-119.972.8156-84.2-175.5125.900105.4Y4E2-Y4 PolarHBondContact O-N 3Å
3E40.3Very low63.5Low197 Ų197127.2 Ų127.292%0.92163%0.634SS**  trans-81.661.8168.1-160.1163.114100107
4Y43.6Very low65.6Low217 Ų217123.8 Ų123.885%0.85162%0.623SS**  trans-152.554.4-175.3-146.9-86000110.8E2E2-Y4 PolarHBondContact O-N 3Å
5A48.5Very low67.5Low105 Ų105122.1 Ų122.187%0.86862%0.617SS**SBendtrans-124.81.1177.700000114.6
6R54.6Low69Low109 Ų109117.3 Ų117.341%0.41159%0.593SS.*SBendtrans-135.5120.5175.3-145.8175.5177.995.4-11.6108.8R12 D77R6-R12 VanDerWaalsContact CZ-NH2 3.28Å; R6-R12 VanDerWaalsContact NE-CZ 3.28Å; R6-R12 VanDerWaalsContact NE-NH1 3.12Å; R6-D77 IonicContact NH2-OD2 2.93Å; R6-D77 PolarHBondContact NH2-OD2 2.92Å
7E62.5Low70.5Confident88 Ų88112.5 Ų112.541%0.41157%0.573SS.*PPolyproline II helixtrans-59.1135.3174.9-59.4-164150.600109.8W11E7-W11 VanDerWaalsContact CD-CD1 3.49Å
8P74.8Confident71.8Confident101 Ų101108.2 Ų108.266%0.65656%0.561SS**PPolyproline II helixtrans-62.8141.5-179.525-32.8000110.6W11P8-W11 PolarHBondContact O-N 3.04Å
9C81.1Confident73.1Confident68 Ų68103.8 Ų103.846%0.45954%0.544SS..THydrogen-bonded Turntrans-60.1126166-46.40000107.2C78C9-C78 HydrophobicContact CB-CB 3.89Å; C9-C78 WeakPolarHBondContact CB-SG 3.45Å; C9-C78 WeakPolarHBondContact SG-CB 3.46Å; C9-C78 CovalentContact SG-SG 2.04Å; C9-C78 PolarHBondContact SG-SG 3.41Å
10P85.1Confident74.2Confident95 Ų9599.3 Ų99.362%0.61752%0.523SS*.THydrogen-bonded Turncis-100.7-2.126.537.8-36.7000116.3R12 I13 V14P10-R12 VanDerWaalsContact C-N 3.33Å; P10-R12 PolarHBondContact O-N 3.39Å; P10-I13 WeakPolarHBondContact O-CB 3.17Å; P10-I13 PolarHBondContact O-N 3.45Å; P10-V14 PolarHBondContact O-N 3.24Å
11W87.9Confident75.3Confident154 Ų15498.7 Ų98.758%0.58352%0.516SS*.Hα-helixtrans-65.3-39.4-170.7-158.2-132.4000112.3E7 P8 I13 V14 D15E7-W11 VanDerWaalsContact CD-CD1 3.49Å; P8-W11 PolarHBondContact O-N 3.04Å; W11-I13 VanDerWaalsContact C-N 3.26Å; W11-I13 PolarHBondContact O-N 2.8Å; W11-V14 HydrophobicContact CE3-CB 4.11Å; W11-V14 HydrophobicContact CE3-CG1 4.43Å; W11-V14 HydrophobicContact CE3-CG2 4.25Å; W11-V14 HydrophobicContact CH2-CG1 4.41Å; W11-V14 HydrophobicContact CZ3-CB 4.13Å; W11-V14 HydrophobicContact CZ3-CG1 3.95Å; W11-V14 HydrophobicContact CZ3-CG2 4.32Å; W11-V14 PolarHBondContact O-N 2.81Å; W11-D15 PolarHBondContact O-N 3.28Å
12R86.5Confident78.1Confident51 Ų5190.5 Ų90.519%0.19248%0.48CS..Hα-helixtrans-52.3-39.2170-174.3-179.3178.686.512.3114R6 P10 D16R6-R12 VanDerWaalsContact CZ-NH2 3.28Å; R6-R12 VanDerWaalsContact NE-CZ 3.28Å; R6-R12 VanDerWaalsContact NE-NH1 3.12Å; P10-R12 VanDerWaalsContact C-N 3.33Å; P10-R12 PolarHBondContact O-N 3.39Å; R12-D16 WeakPolarHBondContact CG-OD2 3.42Å; R12-D16 IonicContact NE-OD2 3.71Å; R12-D16 VanDerWaalsContact O-CB 3.28Å; R12-D16 WeakPolarHBondContact O-CB 3.48Å; R12-D16 VanDerWaalsContact O-CG 3.24Å; R12-D16 PolarHBondContact O-N 3.39Å
13I90.2Very high81.1Confident37 Ų3788.2 Ų88.219%0.1947%0.471CS..Hα-helixtrans-67.1-42.9-179.8-62.7162.1000109.9P10 W11 C17 T75P10-I13 WeakPolarHBondContact O-CB 3.17Å; P10-I13 PolarHBondContact O-N 3.45Å; W11-I13 VanDerWaalsContact C-N 3.26Å; W11-I13 PolarHBondContact O-N 2.8Å; I13-C17 VanDerWaalsContact O-CB 3.31Å; I13-C17 WeakPolarHBondContact O-CB 3.36Å; I13-C17 PolarHBondContact O-N 2.69Å; I13-C17 PolarHBondContact O-SG 3.36Å; I13-T75 HydrophobicContact CD1-CG2 3.78Å; I13-T75 HydrophobicContact CG1-CG2 4.13Å; I13-T75 HydrophobicContact CG2-CG2 3.77Å
14V92.6Very high83.7Confident79 Ų7978.9 Ų78.948%0.47943%0.428SS..Hα-helixtrans-66-44.1179.2179.80000110.4P10 W11 C17 G18P10-V14 PolarHBondContact O-N 3.24Å; W11-V14 HydrophobicContact CE3-CB 4.11Å; W11-V14 HydrophobicContact CE3-CG1 4.43Å; W11-V14 HydrophobicContact CE3-CG2 4.25Å; W11-V14 HydrophobicContact CH2-CG1 4.41Å; W11-V14 HydrophobicContact CZ3-CB 4.13Å; W11-V14 HydrophobicContact CZ3-CG1 3.95Å; W11-V14 HydrophobicContact CZ3-CG2 4.32Å; W11-V14 PolarHBondContact O-N 2.81Å; V14-C17 PolarHBondContact O-N 3.38Å; V14-G18 PolarHBondContact O-N 3.05Å
15D93.1Very high86.3Confident99 Ų9970.8 Ų70.853%0.52940%0.401SS..Hα-helixtrans-62.9-47.8177.2-168.758000111.5W11 C17 G18 G19W11-D15 PolarHBondContact O-N 3.28Å; D15-C17 PolarHBondContact O-N 3.31Å; D15-G18 PolarHBondContact O-N 3.21Å; D15-G19 PolarHBondContact O-N 3.49Å
16D92.5Very high88.6Confident44 Ų4471.4 Ų71.424%0.23539%0.388CS..Hα-helixtrans-64.6-37.3178.1-73.7-32.8000112.2R12 A20 S74R12-D16 WeakPolarHBondContact CG-OD2 3.42Å; R12-D16 IonicContact NE-OD2 3.71Å; R12-D16 VanDerWaalsContact O-CB 3.28Å; R12-D16 WeakPolarHBondContact O-CB 3.48Å; R12-D16 VanDerWaalsContact O-CG 3.24Å; R12-D16 PolarHBondContact O-N 3.39Å; D16-A20 WeakPolarHBondContact O-CB 3.32Å; D16-A20 PolarHBondContact O-N 2.82Å; D16-S74 WeakPolarHBondContact CB-OG 3.15Å; D16-S74 VanDerWaalsContact OD2-CB 3.31Å; D16-S74 WeakPolarHBondContact OD2-CB 3.31Å; D16-S74 PolarHBondContact OD2-OG 2.97Å
17C94.1Very high90.5Very high37 Ų3768.2 Ų68.225%0.2539%0.389CS..Hα-helixtrans-61.3-49.1172.5-740000111.7I13 V14 D15 F21 G71I13-C17 VanDerWaalsContact O-CB 3.31Å; I13-C17 WeakPolarHBondContact O-CB 3.36Å; I13-C17 PolarHBondContact O-N 2.69Å; I13-C17 PolarHBondContact O-SG 3.36Å; V14-C17 PolarHBondContact O-N 3.38Å; D15-C17 PolarHBondContact O-N 3.31Å; C17-F21 WeakPolarHBondContact O-CB 3.19Å; C17-F21 PolarHBondContact O-N 3.39Å; C17-G71 WeakPolarHBondContact SG-CA 3.37Å
18G94.8Very high92Very high35 Ų3564.3 Ų64.336%0.36137%0.373SS..Hα-helixtrans-68.2-43.5-178.100000112.3V14 D15 F21 T22V14-G18 PolarHBondContact O-N 3.05Å; D15-G18 PolarHBondContact O-N 3.21Å; G18-F21 PolarHBondContact O-N 2.94Å; G18-T22 WeakPolarHBondContact O-CG2 3.47Å; G18-T22 PolarHBondContact O-N 2.88Å; G18-T22 PolarHBondContact O-OG1 2.04Å; G18-T22 VanDerWaalsContact O-OG1 3.07Å
19G95Very high93Very high24 Ų2460 Ų6025%0.24735%0.347CS..Hα-helixtrans-59.1-49.3173.300000111.4D15 F21 T22 M23D15-G19 PolarHBondContact O-N 3.49Å; G19-F21 PolarHBondContact O-N 3.12Å; G19-T22 PolarHBondContact O-N 2.99Å; G19-T22 PolarHBondContact O-OG1 3.03Å; G19-M23 WeakPolarHBondContact O-CG 3.28Å; G19-M23 PolarHBondContact O-N 2.91Å
20A95.4Very high93.7Very high14 Ų1461 Ų6112%0.11635%0.35CS..Hα-helixtrans-64.5-39.7177.100000112.3D16 G24 F66D16-A20 WeakPolarHBondContact O-CB 3.32Å; D16-A20 PolarHBondContact O-N 2.82Å; A20-G24 PolarHBondContact O-N 2.99Å; A20-F66 HydrophobicContact CB-CB 4.35Å; A20-F66 VanDerWaalsContact CB-O 3.26Å; A20-F66 WeakPolarHBondContact CB-O 3.28Å; A20-F66 VanDerWaalsContact O-CB 3.28Å; A20-F66 WeakPolarHBondContact O-CB 3.27Å
21F97.2Very high94.2Very high86 Ų8662.4 Ų62.438%0.37735%0.347SS..Hα-helixtrans-58.3-51.1174.9-179.4-101.7000111.7C17 G18 G19 G24 V25 G63 A67C17-F21 WeakPolarHBondContact O-CB 3.19Å; C17-F21 PolarHBondContact O-N 3.39Å; G18-F21 PolarHBondContact O-N 2.94Å; G19-F21 PolarHBondContact O-N 3.12Å; F21-G24 PolarHBondContact O-N 3.24Å; F21-V25 HydrophobicContact CD1-CG2 4.09Å; F21-V25 HydrophobicContact CD2-CG2 4.34Å; F21-V25 HydrophobicContact CE1-CG2 3.64Å; F21-V25 HydrophobicContact CE2-CG2 3.9Å; F21-V25 HydrophobicContact CG-CG2 4.43Å; F21-V25 HydrophobicContact CZ-CG2 3.53Å; F21-V25 WeakPolarHBondContact O-CG2 3.39Å; F21-V25 PolarHBondContact O-N 2.72Å; F21-G63 WeakPolarHBondContact CD2-O 3Å; F21-A67 HydrophobicContact CB-CB 3.84Å; F21-A67 HydrophobicContact CD2-CB 4.14Å; F21-A67 HydrophobicContact CG-CB 4.48Å
22T96.8Very high94.6Very high72 Ų7255.8 Ų55.844%0.44232%0.323SS..Hα-helixtrans-64.1-44-178.353.30000111.5G18 G19 G24 V25 I26G18-T22 WeakPolarHBondContact O-CG2 3.47Å; G18-T22 PolarHBondContact O-N 2.88Å; G18-T22 PolarHBondContact O-OG1 2.04Å; G18-T22 VanDerWaalsContact O-OG1 3.07Å; G19-T22 PolarHBondContact O-N 2.99Å; G19-T22 PolarHBondContact O-OG1 3.03Å; T22-G24 VanDerWaalsContact C-N 3.31Å; T22-G24 PolarHBondContact O-N 3.28Å; T22-V25 PolarHBondContact O-N 2.88Å; T22-I26 WeakPolarHBondContact O-CB 3.15Å; T22-I26 VanDerWaalsContact O-CG1 3.27Å; T22-I26 WeakPolarHBondContact O-CG1 3.29Å; T22-I26 PolarHBondContact O-N 3.06Å
23M96.1Very high94.9Very high140 Ų14054.9 Ų54.969%0.6933%0.326SS*.Hα-helixtrans-57.5-43.9172.5-70.5-164.6-143.600111.8G19 G27G19-M23 WeakPolarHBondContact O-CG 3.28Å; G19-M23 PolarHBondContact O-N 2.91Å; M23-G27 PolarHBondContact O-N 2.86Å
24G95.6Very high95.1Very high2 Ų257.7 Ų57.72%0.02134%0.34CS..Hα-helixtrans-67.3-38.7178.700000113.5A20 F21 T22 G28A20-G24 PolarHBondContact O-N 2.99Å; F21-G24 PolarHBondContact O-N 3.24Å; T22-G24 VanDerWaalsContact C-N 3.31Å; T22-G24 PolarHBondContact O-N 3.28Å; G24-G28 VanDerWaalsContact O-CA 3.25Å; G24-G28 WeakPolarHBondContact O-CA 3.45Å; G24-G28 PolarHBondContact O-N 3.14Å
25V97.1Very high95.1Very high46 Ų4659 Ų5928%0.27934%0.339SS..Hα-helixtrans-68.9-43.9176.2170.80000111.2F21 T22 G29F21-V25 HydrophobicContact CD1-CG2 4.09Å; F21-V25 HydrophobicContact CD2-CG2 4.34Å; F21-V25 HydrophobicContact CE1-CG2 3.64Å; F21-V25 HydrophobicContact CE2-CG2 3.9Å; F21-V25 HydrophobicContact CG-CG2 4.43Å; F21-V25 HydrophobicContact CZ-CG2 3.53Å; F21-V25 WeakPolarHBondContact O-CG2 3.39Å; F21-V25 PolarHBondContact O-N 2.72Å; T22-V25 PolarHBondContact O-N 2.88Å; V25-G29 VanDerWaalsContact O-CA 3.29Å; V25-G29 WeakPolarHBondContact O-CA 3.39Å; V25-G29 PolarHBondContact O-N 3.31Å
26I96.8Very high95Very high119 Ų11954.7 Ų54.761%0.6132%0.319SS*.Hα-helixtrans-68.7-54.3-179.8-65.5168.3000109.7T22 G29 V30T22-I26 WeakPolarHBondContact O-CB 3.15Å; T22-I26 VanDerWaalsContact O-CG1 3.27Å; T22-I26 WeakPolarHBondContact O-CG1 3.29Å; T22-I26 PolarHBondContact O-N 3.06Å; I26-G29 PolarHBondContact O-N 2.95Å; I26-V30 WeakPolarHBondContact O-CG2 3.46Å; I26-V30 PolarHBondContact O-N 2.98Å
27G95.1Very high95Very high42 Ų4256 Ų5643%0.43332%0.323SS..Hα-helixtrans-63.8-46.3-179.600000112.4M23 G29 V30 F31M23-G27 PolarHBondContact O-N 2.86Å; G27-G29 VanDerWaalsContact C-N 3.34Å; G27-G29 PolarHBondContact O-N 3.42Å; G27-V30 PolarHBondContact O-N 3.38Å; G27-F31 WeakPolarHBondContact O-CB 3.42Å; G27-F31 PolarHBondContact O-N 2.93Å
28G94.6Very high94.8Very high6 Ų663.9 Ų63.96%0.06235%0.347CS..Hα-helixtrans-64.2-37.9175.100000112.4G24 Q32G24-G28 VanDerWaalsContact O-CA 3.25Å; G24-G28 WeakPolarHBondContact O-CA 3.45Å; G24-G28 PolarHBondContact O-N 3.14Å; G28-Q32 VanDerWaalsContact O-CB 3.26Å; G28-Q32 WeakPolarHBondContact O-CB 3.25Å; G28-Q32 WeakPolarHBondContact O-CG 3.29Å; G28-Q32 PolarHBondContact O-N 2.89Å
29G95.9Very high94.6Very high11 Ų1169.1 Ų69.111%0.11337%0.367CS..Hα-helixtrans-62.1-50.9175.500000112.1V25 I26 G27 F31 Q32 A33 V55V25-G29 VanDerWaalsContact O-CA 3.29Å; V25-G29 WeakPolarHBondContact O-CA 3.39Å; V25-G29 PolarHBondContact O-N 3.31Å; I26-G29 PolarHBondContact O-N 2.95Å; G27-G29 VanDerWaalsContact C-N 3.34Å; G27-G29 PolarHBondContact O-N 3.42Å; G29-F31 PolarHBondContact O-N 2.89Å; G29-Q32 PolarHBondContact O-N 2.82Å; G29-A33 VanDerWaalsContact O-CB 3.25Å; G29-A33 WeakPolarHBondContact O-CB 3.23Å; G29-A33 PolarHBondContact O-N 3.42Å; G29-V55 WeakPolarHBondContact O-CG2 3.34Å
30V96.4Very high94.4Very high88 Ų8868.7 Ų68.753%0.53336%0.361SS..Hα-helixtrans-60.8-47.7177.3173.80000110.9I26 G27 Q32 A33 I34I26-V30 WeakPolarHBondContact O-CG2 3.46Å; I26-V30 PolarHBondContact O-N 2.98Å; G27-V30 PolarHBondContact O-N 3.38Å; V30-Q32 PolarHBondContact O-N 3.44Å; V30-A33 WeakPolarHBondContact O-CB 3.36Å; V30-A33 PolarHBondContact O-N 2.97Å; V30-I34 HydrophobicContact CG1-CD1 4.09Å; V30-I34 WeakPolarHBondContact O-CG1 3.13Å; V30-I34 PolarHBondContact O-N 2.92Å; V30-I34 VanDerWaalsContact O-N 3.12Å
31F94.9Very high94Very high124 Ų12472.3 Ų72.354%0.54438%0.383SS..Hα-helixtrans-61.3-44.8-179.7-177.3-99.7000112.1G27 G29 I34 K35G27-F31 WeakPolarHBondContact O-CB 3.42Å; G27-F31 PolarHBondContact O-N 2.93Å; G29-F31 PolarHBondContact O-N 2.89Å; F31-I34 PolarHBondContact O-N 2.93Å; F31-K35 HydrophobicContact CE1-CD 3.98Å; F31-K35 HydrophobicContact CZ-CD 4.41Å; F31-K35 WeakPolarHBondContact O-CB 3.31Å; F31-K35 PolarHBondContact O-N 2.86Å
32Q95.9Very high93.4Very high16 Ų1674.1 Ų74.18%0.07540%0.401CS..Hα-helixtrans-75.7-24179.7-60.3-65.937.600112.9G28 G29 V30 G36 V55 R58 I62G28-Q32 VanDerWaalsContact O-CB 3.26Å; G28-Q32 WeakPolarHBondContact O-CB 3.25Å; G28-Q32 WeakPolarHBondContact O-CG 3.29Å; G28-Q32 PolarHBondContact O-N 2.89Å; G29-Q32 PolarHBondContact O-N 2.82Å; V30-Q32 PolarHBondContact O-N 3.44Å; Q32-G36 WeakPolarHBondContact O-CA 3.13Å; Q32-G36 PolarHBondContact O-N 2.73Å; Q32-V55 HydrophobicContact CB-CG2 4.49Å; Q32-R58 HydrophobicContact CG-CB 3.91Å; Q32-I62 HydrophobicContact CG-CD1 3.9Å
33A93.9Very high92.9Very high31 Ų3172.4 Ų72.426%0.25640%0.398SS..Hα-helixtrans-63.8-49170.700000110.4G29 V30 F37 S51 V55G29-A33 VanDerWaalsContact O-CB 3.25Å; G29-A33 WeakPolarHBondContact O-CB 3.23Å; G29-A33 PolarHBondContact O-N 3.42Å; V30-A33 WeakPolarHBondContact O-CB 3.36Å; V30-A33 PolarHBondContact O-N 2.97Å; A33-F37 VanDerWaalsContact O-CB 3.28Å; A33-F37 WeakPolarHBondContact O-CB 3.32Å; A33-F37 PolarHBondContact O-N 3.34Å; A33-S51 VanDerWaalsContact CA-OG 3.25Å; A33-S51 WeakPolarHBondContact CA-OG 3.33Å; A33-S51 PolarHBondContact O-OG 3.02Å; A33-V55 HydrophobicContact CB-CG2 3.62Å
34I93.9Very high92.6Very high97 Ų9771.8 Ų71.850%0.49740%0.396SS..Hα-helixtrans-65-49.8178.2-62.6166.5000110.3V30 F31 G36 F37 R38V30-I34 HydrophobicContact CG1-CD1 4.09Å; V30-I34 WeakPolarHBondContact O-CG1 3.13Å; V30-I34 PolarHBondContact O-N 2.92Å; V30-I34 VanDerWaalsContact O-N 3.12Å; F31-I34 PolarHBondContact O-N 2.93Å; I34-G36 PolarHBondContact O-N 3.29Å; I34-F37 PolarHBondContact O-N 2.9Å; I34-R38 WeakPolarHBondContact O-CG 3.14Å; I34-R38 PolarHBondContact O-N 3.43Å
35K92.6Very high92.3Very high105 Ų10582.3 Ų82.346%0.45744%0.435SS..Hα-helixtrans-63.2-42.7-179.8-171.4171.6-175.9165.40111.7F31 F37 R38 N39F31-K35 HydrophobicContact CE1-CD 3.98Å; F31-K35 HydrophobicContact CZ-CD 4.41Å; F31-K35 WeakPolarHBondContact O-CB 3.31Å; F31-K35 PolarHBondContact O-N 2.86Å; K35-F37 VanDerWaalsContact C-N 3.35Å; K35-R38 PolarHBondContact O-N 3.42Å; K35-N39 VanDerWaalsContact O-CB 3.25Å; K35-N39 WeakPolarHBondContact O-CB 3.31Å; K35-N39 PolarHBondContact O-N 2.93Å
36G90.9Very high91.9Very high10 Ų1085.4 Ų85.410%0.10345%0.447CS..Hα-helixtrans-65.4-36.3177.400000112.8Q32 I34 A40Q32-G36 WeakPolarHBondContact O-CA 3.13Å; Q32-G36 PolarHBondContact O-N 2.73Å; I34-G36 PolarHBondContact O-N 3.29Å; G36-A40 VanDerWaalsContact O-CB 3.22Å; G36-A40 WeakPolarHBondContact O-CB 3Å; G36-A40 PolarHBondContact O-N 3.41Å
37F91.1Very high91.6Very high71 Ų7183.8 Ų83.831%0.31143%0.433SS..Hα-helixtrans-69.3-40.4174.7-171.3-90.9000112.3A33 I34 K35 R47 L48A33-F37 VanDerWaalsContact O-CB 3.28Å; A33-F37 WeakPolarHBondContact O-CB 3.32Å; A33-F37 PolarHBondContact O-N 3.34Å; I34-F37 PolarHBondContact O-N 2.9Å; K35-F37 VanDerWaalsContact C-N 3.35Å; F37-R47 HydrophobicContact CD2-CB 3.56Å; F37-R47 HydrophobicContact CE2-CB 3.48Å; F37-R47 VanDerWaalsContact CE2-CB 3.48Å; F37-R47 HydrophobicContact CE2-CG 4.49Å; F37-R47 HydrophobicContact CG-CB 4.11Å; F37-R47 HydrophobicContact CZ-CB 4Å; F37-L48 HydrophobicContact CD2-CD2 4.35Å; F37-L48 HydrophobicContact CE2-CD2 4.11Å; F37-L48 HydrophobicContact CE2-CG 4.43Å
38R90.5Very high91.5Very high203 Ų20386.2 Ų86.277%0.76644%0.436SS*.Hα-helixtrans-72.7-33.8179.7-71.7179.269.7170.22.1113.5I34 K35I34-R38 WeakPolarHBondContact O-CG 3.14Å; I34-R38 PolarHBondContact O-N 3.43Å; K35-R38 PolarHBondContact O-N 3.42Å
39N91.7Very high91.4Very high144 Ų14495.4 Ų95.477%0.7747%0.468SS*.Hα-helixtrans-91.2-5.2-175.9-161.266.5000113.8K35K35-N39 VanDerWaalsContact O-CB 3.25Å; K35-N39 WeakPolarHBondContact O-CB 3.31Å; K35-N39 PolarHBondContact O-N 2.93Å
40A90.5Very high91.2Very high15 Ų1596.2 Ų96.212%0.12448%0.476CS..SBendtrans-82.6152.9179.600000112.2G36 R47G36-A40 VanDerWaalsContact O-CB 3.22Å; G36-A40 WeakPolarHBondContact O-CB 3Å; G36-A40 PolarHBondContact O-N 3.41Å; A40-R47 HydrophobicContact CB-CB 4.33Å; A40-R47 HydrophobicContact CB-CG 4.09Å
41P86.1Confident91Very high90 Ų9092.8 Ų92.858%0.58446%0.456SS*.PPolyproline II helixtrans-60.4158.6-178.921.9-29.7000112.2H46 R47P41-H46 HydrophobicContact CG-CB 4.05Å; P41-R47 WeakPolarHBondContact O-CG 3.47Å
42V84.4Confident91Very high124 Ų12491.3 Ų91.375%0.75246%0.458SS*.SBendtrans-56.5139.7-176.7-62.50000111.6
43G87.4Confident90.9Very high37 Ų3795 Ų9538%0.38148%0.478SS..SBendtrans114.1127-175.800000113.1R45 H46 R47G43-R45 VanDerWaalsContact C-N 3.29Å; G43-R45 PolarHBondContact O-N 3.38Å; G43-H46 PolarHBondContact O-N 2.92Å; G43-H46 VanDerWaalsContact O-N 3.11Å; G43-R47 WeakPolarHBondContact O-CG 3.22Å; G43-R47 PolarHBondContact O-N 3.46Å
44I88.9Confident90.9Very high127 Ų12794.4 Ų94.465%0.65147%0.473SS*.Hα-helixtrans-56.8-41.5-174.6-67.6170.5000111.6H46 R47 L48I44-H46 PolarHBondContact O-N 3.07Å; I44-R47 PolarHBondContact O-N 3.04Å; I44-L48 HydrophobicContact CG2-CD1 3.85Å; I44-L48 HydrophobicContact CG2-CG 4.27Å; I44-L48 WeakPolarHBondContact O-CB 3.18Å; I44-L48 VanDerWaalsContact O-CG 3.31Å; I44-L48 WeakPolarHBondContact O-CG 3.37Å; I44-L48 PolarHBondContact O-N 2.92Å
45R89.4Confident91Very high222 Ų22291.7 Ų91.784%0.83846%0.461SS*.Hα-helixtrans-61.2-44177.4-75.4-178.1161-165.8-4.8113G43 R49G43-R45 VanDerWaalsContact C-N 3.29Å; G43-R45 PolarHBondContact O-N 3.38Å; R45-R49 WeakPolarHBondContact O-CB 3.27Å; R45-R49 PolarHBondContact O-N 3.2Å
46H89.1Confident91.1Very high112 Ų11296.4 Ų96.452%0.51948%0.475SS..Hα-helixtrans-70.2-36.5178.6-66.9-71.9000111.9P41 G43 I44 G50P41-H46 HydrophobicContact CG-CB 4.05Å; G43-H46 PolarHBondContact O-N 2.92Å; G43-H46 VanDerWaalsContact O-N 3.11Å; I44-H46 PolarHBondContact O-N 3.07Å; H46-G50 PolarHBondContact O-N 3.2Å
47R91.3Very high91.3Very high84 Ų84100 Ų10032%0.31749%0.492SS..Hα-helixtrans-66.9-43.8176.1-67.9-174.7174.6-172.1-1.2113.4F37 A40 P41 G43 I44 G50 S51F37-R47 HydrophobicContact CD2-CB 3.56Å; F37-R47 HydrophobicContact CE2-CB 3.48Å; F37-R47 VanDerWaalsContact CE2-CB 3.48Å; F37-R47 HydrophobicContact CE2-CG 4.49Å; F37-R47 HydrophobicContact CG-CB 4.11Å; F37-R47 HydrophobicContact CZ-CB 4Å; A40-R47 HydrophobicContact CB-CB 4.33Å; A40-R47 HydrophobicContact CB-CG 4.09Å; P41-R47 WeakPolarHBondContact O-CG 3.47Å; G43-R47 WeakPolarHBondContact O-CG 3.22Å; G43-R47 PolarHBondContact O-N 3.46Å; I44-R47 PolarHBondContact O-N 3.04Å; R47-G50 PolarHBondContact O-N 2.9Å; R47-S51 VanDerWaalsContact O-CB 3.23Å; R47-S51 WeakPolarHBondContact O-CB 3.11Å; R47-S51 PolarHBondContact O-N 3.33Å
48L92.2Very high91.5Very high94 Ų94102.1 Ų102.149%0.49250%0.497SS..Hα-helixtrans-63.4-47.2174.8-69.5174.9000110.7F37 I44 G50 S51 T52F37-L48 HydrophobicContact CD2-CD2 4.35Å; F37-L48 HydrophobicContact CE2-CD2 4.11Å; F37-L48 HydrophobicContact CE2-CG 4.43Å; I44-L48 HydrophobicContact CG2-CD1 3.85Å; I44-L48 HydrophobicContact CG2-CG 4.27Å; I44-L48 WeakPolarHBondContact O-CB 3.18Å; I44-L48 VanDerWaalsContact O-CG 3.31Å; I44-L48 WeakPolarHBondContact O-CG 3.37Å; I44-L48 PolarHBondContact O-N 2.92Å; L48-G50 PolarHBondContact O-N 3.39Å; L48-S51 WeakPolarHBondContact O-CB 3.44Å; L48-S51 PolarHBondContact O-N 2.76Å; L48-T52 PolarHBondContact O-N 2.98Å; L48-T52 PolarHBondContact O-OG1 2.52Å
49R92Very high91.7Very high199 Ų19992.7 Ų92.775%0.75146%0.463SS*.Hα-helixtrans-62.5-40.8178.1-167.9174.5179.9-176.9-0.4112.6R45 N53R45-R49 WeakPolarHBondContact O-CB 3.27Å; R45-R49 PolarHBondContact O-N 3.2Å; R49-N53 WeakPolarHBondContact O-CB 3.32Å; R49-N53 PolarHBondContact O-N 2.89Å
50G91.9Very high91.8Very high27 Ų2788.9 Ų88.928%0.27845%0.446SS..Hα-helixtrans-65-42175.400000112.5H46 R47 L48 N53 A54H46-G50 PolarHBondContact O-N 3.2Å; R47-G50 PolarHBondContact O-N 2.9Å; L48-G50 PolarHBondContact O-N 3.39Å; G50-N53 PolarHBondContact O-N 2.68Å; G50-A54 VanDerWaalsContact O-CB 3.29Å; G50-A54 WeakPolarHBondContact O-CB 3.19Å; G50-A54 PolarHBondContact O-N 2.82Å
51S93.2Very high92.1Very high16 Ų1694 Ų9411%0.11247%0.468CS..Hα-helixtrans-61.1-52.7174.1-174.90000111.7A33 R47 L48 N53 A54 V55A33-S51 VanDerWaalsContact CA-OG 3.25Å; A33-S51 WeakPolarHBondContact CA-OG 3.33Å; A33-S51 PolarHBondContact O-OG 3.02Å; R47-S51 VanDerWaalsContact O-CB 3.23Å; R47-S51 WeakPolarHBondContact O-CB 3.11Å; R47-S51 PolarHBondContact O-N 3.33Å; L48-S51 WeakPolarHBondContact O-CB 3.44Å; L48-S51 PolarHBondContact O-N 2.76Å; S51-N53 VanDerWaalsContact C-N 3.3Å; S51-N53 PolarHBondContact O-N 2.93Å; S51-A54 PolarHBondContact O-N 3.43Å; S51-A54 VanDerWaalsContact O-N 3.14Å; S51-V55 WeakPolarHBondContact O-CG2 3.24Å; S51-V55 PolarHBondContact O-N 3.47Å
52T94.3Very high92.5Very high94 Ų9491.8 Ų91.858%0.57745%0.45SS*.Hα-helixtrans-59.5-41.3178.9-50.20000111.9L48 R56L48-T52 PolarHBondContact O-N 2.98Å; L48-T52 PolarHBondContact O-OG1 2.52Å; T52-R56 VanDerWaalsContact O-CB 3.27Å; T52-R56 WeakPolarHBondContact O-CB 3.42Å; T52-R56 PolarHBondContact O-N 3.35Å
53N94.1Very high93.1Very high94 Ų9485.9 Ų85.950%0.50341%0.414SS..Hα-helixtrans-66.9-41.5177.4-165.543.6000112R49 G50 S51 R56 I57R49-N53 WeakPolarHBondContact O-CB 3.32Å; R49-N53 PolarHBondContact O-N 2.89Å; G50-N53 PolarHBondContact O-N 2.68Å; S51-N53 VanDerWaalsContact C-N 3.3Å; S51-N53 PolarHBondContact O-N 2.93Å; N53-R56 PolarHBondContact O-N 2.83Å; N53-I57 WeakPolarHBondContact O-CG1 3.31Å; N53-I57 PolarHBondContact O-N 3.35Å; N53-I57 VanDerWaalsContact O-N 3.09Å; N53-I57 WeakPolarHBondContact OD1-CD1 3.5Å
54A93.9Very high93.5Very high17 Ų1785.3 Ų85.314%0.1441%0.409CS..Hα-helixtrans-62.6-44.317700000112G50 S51 R58G50-A54 VanDerWaalsContact O-CB 3.29Å; G50-A54 WeakPolarHBondContact O-CB 3.19Å; G50-A54 PolarHBondContact O-N 2.82Å; S51-A54 PolarHBondContact O-N 3.43Å; S51-A54 VanDerWaalsContact O-N 3.14Å; A54-R58 VanDerWaalsContact O-CB 3.26Å; A54-R58 WeakPolarHBondContact O-CB 3.16Å; A54-R58 WeakPolarHBondContact O-CG 3.23Å; A54-R58 PolarHBondContact O-N 2.74Å
55V96.1Very high93.8Very high41 Ų4183.2 Ų83.225%0.24841%0.405CS..Hα-helixtrans-61.9-51175.3174.90000110.3G29 Q32 A33 S51 I57 R58 A59G29-V55 WeakPolarHBondContact O-CG2 3.34Å; Q32-V55 HydrophobicContact CB-CG2 4.49Å; A33-V55 HydrophobicContact CB-CG2 3.62Å; S51-V55 WeakPolarHBondContact O-CG2 3.24Å; S51-V55 PolarHBondContact O-N 3.47Å; V55-I57 VanDerWaalsContact C-N 3.29Å; V55-I57 PolarHBondContact O-N 2.88Å; V55-R58 PolarHBondContact O-N 2.67Å; V55-A59 HydrophobicContact CG1-CB 4.15Å; V55-A59 WeakPolarHBondContact O-CB 3.37Å; V55-A59 PolarHBondContact O-N 2.84Å
56R94.4Very high94.1Very high203 Ų20377.4 Ų77.477%0.76639%0.386SS*.Hα-helixtrans-58.1-40.3-176.2-174.9177.4-179.7177.30.6113T52 N53 P60T52-R56 VanDerWaalsContact O-CB 3.27Å; T52-R56 WeakPolarHBondContact O-CB 3.42Å; T52-R56 PolarHBondContact O-N 3.35Å; N53-R56 PolarHBondContact O-N 2.83Å; R56-P60 WeakPolarHBondContact O-CD 3.46Å; R56-P60 WeakPolarHBondContact O-CG 3.47Å
57I94.6Very high94.4Very high86 Ų8673 Ų7344%0.44137%0.369SS..Hα-helixtrans-81.7-42.3-177.4-62.4169.2000110.9N53 V55 Q61N53-I57 WeakPolarHBondContact O-CG1 3.31Å; N53-I57 PolarHBondContact O-N 3.35Å; N53-I57 VanDerWaalsContact O-N 3.09Å; N53-I57 WeakPolarHBondContact OD1-CD1 3.5Å; V55-I57 VanDerWaalsContact C-N 3.29Å; V55-I57 PolarHBondContact O-N 2.88Å; I57-Q61 WeakPolarHBondContact O-CG 3.26Å; I57-Q61 PolarHBondContact O-OE1 2.96Å
58R94.9Very high94.7Very high115 Ų11573.1 Ų73.143%0.43438%0.379SS..Hα-helixtrans-98.2-29.8-166.5-59.2-172.1179.6-178.7-4.9114.6Q32 A54 V55 Q61 I62Q32-R58 HydrophobicContact CG-CB 3.91Å; A54-R58 VanDerWaalsContact O-CB 3.26Å; A54-R58 WeakPolarHBondContact O-CB 3.16Å; A54-R58 WeakPolarHBondContact O-CG 3.23Å; A54-R58 PolarHBondContact O-N 2.74Å; V55-R58 PolarHBondContact O-N 2.67Å; R58-Q61 PolarHBondContact O-N 3.02Å; R58-I62 VanDerWaalsContact O-CG1 3.31Å; R58-I62 WeakPolarHBondContact O-CG1 3.39Å; R58-I62 PolarHBondContact O-N 2.96Å
59A94.9Very high94.8Very high5 Ų572.6 Ų72.64%0.04137%0.371CS..Hα-helixtrans-57.2-46.9177.900000113.1V55 Q61 I62 G63V55-A59 HydrophobicContact CG1-CB 4.15Å; V55-A59 WeakPolarHBondContact O-CB 3.37Å; V55-A59 PolarHBondContact O-N 2.84Å; A59-Q61 VanDerWaalsContact C-N 3.34Å; A59-Q61 PolarHBondContact O-N 3.46Å; A59-I62 PolarHBondContact O-N 3.39Å; A59-G63 PolarHBondContact O-N 2.99Å
60P94.6Very high94.9Very high65 Ų6563.3 Ų63.342%0.42234%0.337SS..Hα-helixtrans-69.4-29.7177.526.9-34.9000113.2R56 G64R56-P60 WeakPolarHBondContact O-CD 3.46Å; R56-P60 WeakPolarHBondContact O-CG 3.47Å; P60-G64 PolarHBondContact O-N 3.41Å
61Q95.6Very high95Very high123 Ų12362.4 Ų62.458%0.57533%0.327SS*.Hα-helixtrans-67.5-42.2175.6-68.1177.3-29.700111.8I57 R58 A59 S65I57-Q61 WeakPolarHBondContact O-CG 3.26Å; I57-Q61 PolarHBondContact O-OE1 2.96Å; R58-Q61 PolarHBondContact O-N 3.02Å; A59-Q61 VanDerWaalsContact C-N 3.34Å; A59-Q61 PolarHBondContact O-N 3.46Å; Q61-S65 PolarHBondContact O-N 3.25Å; Q61-S65 VanDerWaalsContact O-N 3.12Å; Q61-S65 PolarHBondContact O-OG 2.94Å
62I95.9Very high95.1Very high42 Ų4263.5 Ų63.522%0.21533%0.332CS..Hα-helixtrans-66.1-50.1174.7-65.3167.1000109Q32 R58 A59 G64 S65 F66Q32-I62 HydrophobicContact CG-CD1 3.9Å; R58-I62 VanDerWaalsContact O-CG1 3.31Å; R58-I62 WeakPolarHBondContact O-CG1 3.39Å; R58-I62 PolarHBondContact O-N 2.96Å; A59-I62 PolarHBondContact O-N 3.39Å; I62-G64 VanDerWaalsContact C-N 3.32Å; I62-G64 PolarHBondContact O-N 3.48Å; I62-S65 WeakPolarHBondContact O-CB 3.45Å; I62-S65 PolarHBondContact O-N 3.43Å; I62-F66 HydrophobicContact CG2-CD2 3.79Å; I62-F66 HydrophobicContact CG2-CE2 3.76Å; I62-F66 WeakPolarHBondContact O-CD2 3.29Å; I62-F66 PolarHBondContact O-N 3.33Å
63G96.4Very high95.1Very high0 Ų060.4 Ų60.40%031%0.31CS..Hα-helixtrans-51.5-48.217500000113.1F21 A59 S65 F66 A67F21-G63 WeakPolarHBondContact CD2-O 3Å; A59-G63 PolarHBondContact O-N 2.99Å; G63-S65 VanDerWaalsContact C-N 3.31Å; G63-S65 PolarHBondContact O-N 3.25Å; G63-F66 PolarHBondContact O-N 3.1Å; G63-A67 WeakPolarHBondContact O-CB 3.2Å; G63-A67 PolarHBondContact O-N 3.48Å
64G96Very high95Very high26 Ų2656 Ų5627%0.26829%0.286SS..Hα-helixtrans-61.1-38.2176.700000113.1P60 I62 A67 V68P60-G64 PolarHBondContact O-N 3.41Å; I62-G64 VanDerWaalsContact C-N 3.32Å; I62-G64 PolarHBondContact O-N 3.48Å; G64-A67 PolarHBondContact O-N 3.11Å; G64-V68 WeakPolarHBondContact O-CG2 3.32Å; G64-V68 PolarHBondContact O-N 3.46Å
65S95.1Very high94.9Very high82 Ų8258 Ų5857%0.57330%0.297SS*.Hα-helixtrans-65.6-40.9176.5-54.90000111.8Q61 I62 G63 W69Q61-S65 PolarHBondContact O-N 3.25Å; Q61-S65 VanDerWaalsContact O-N 3.12Å; Q61-S65 PolarHBondContact O-OG 2.94Å; I62-S65 WeakPolarHBondContact O-CB 3.45Å; I62-S65 PolarHBondContact O-N 3.43Å; G63-S65 VanDerWaalsContact C-N 3.31Å; G63-S65 PolarHBondContact O-N 3.25Å; S65-W69 WeakPolarHBondContact O-CB 3.36Å; S65-W69 PolarHBondContact O-N 3.33Å; S65-W69 VanDerWaalsContact O-N 3.08Å
66F95.2Very high94.8Very high101 Ų10157.5 Ų57.544%0.44329%0.293SS..Hα-helixtrans-67.2-39.6173.8-86-90.4000112.1A20 I62 G63 V68 W69 G70A20-F66 HydrophobicContact CB-CB 4.35Å; A20-F66 VanDerWaalsContact CB-O 3.26Å; A20-F66 WeakPolarHBondContact CB-O 3.28Å; A20-F66 VanDerWaalsContact O-CB 3.28Å; A20-F66 WeakPolarHBondContact O-CB 3.27Å; I62-F66 HydrophobicContact CG2-CD2 3.79Å; I62-F66 HydrophobicContact CG2-CE2 3.76Å; I62-F66 WeakPolarHBondContact O-CD2 3.29Å; I62-F66 PolarHBondContact O-N 3.33Å; G63-F66 PolarHBondContact O-N 3.1Å; F66-V68 PolarHBondContact O-N 2.84Å; F66-W69 PolarHBondContact O-N 3.07Å; F66-G70 PolarHBondContact O-N 3.33Å
67A96.3Very high94.6Very high19 Ų1948 Ų4816%0.15726%0.257CS..Hα-helixtrans-60.2-46.1176.200000111.9F21 G63 G64 W69 G70 G71F21-A67 HydrophobicContact CB-CB 3.84Å; F21-A67 HydrophobicContact CD2-CB 4.14Å; F21-A67 HydrophobicContact CG-CB 4.48Å; G63-A67 WeakPolarHBondContact O-CB 3.2Å; G63-A67 PolarHBondContact O-N 3.48Å; G64-A67 PolarHBondContact O-N 3.11Å; A67-W69 VanDerWaalsContact C-N 3.33Å; A67-W69 PolarHBondContact O-N 3.5Å; A67-G70 PolarHBondContact O-N 2.99Å; A67-G71 PolarHBondContact O-N 2.84Å
68V96.1Very high94.4Very high87 Ų8744.5 Ų44.553%0.52724%0.241SC..Hα-helixtrans-63.6-41.2176.9172.60000110.8G64 F66 L72 L103G64-V68 WeakPolarHBondContact O-CG2 3.32Å; G64-V68 PolarHBondContact O-N 3.46Å; F66-V68 PolarHBondContact O-N 2.84Å; V68-L72 WeakPolarHBondContact O-CB 3.18Å; V68-L72 PolarHBondContact O-N 3.23Å; V68-L103 HydrophobicContact CG1-CD2 3.73Å
69W94.6Very high94Very high83 Ų8340.5 Ų40.531%0.31424%0.235SC..Hα-helixtrans-63.3-50.8176.5-176.189.8000112S65 F66 A67 L72 F73 T99 L103 L123S65-W69 WeakPolarHBondContact O-CB 3.36Å; S65-W69 PolarHBondContact O-N 3.33Å; S65-W69 VanDerWaalsContact O-N 3.08Å; F66-W69 PolarHBondContact O-N 3.07Å; A67-W69 VanDerWaalsContact C-N 3.33Å; A67-W69 PolarHBondContact O-N 3.5Å; W69-L72 PolarHBondContact O-N 3.39Å; W69-F73 VanDerWaalsContact O-CB 3.31Å; W69-F73 WeakPolarHBondContact O-CB 3.42Å; W69-F73 PolarHBondContact O-N 3.08Å; W69-T99 HydrophobicContact CG-CG2 4.21Å; W69-L103 HydrophobicContact CB-CD1 4.21Å; W69-L103 HydrophobicContact CG-CD1 4.28Å; W69-L123 HydrophobicContact CH2-CD2 4.41Å
70G94.1Very high93.7Very high4 Ų441.7 Ų41.74%0.04124%0.24CC..Hα-helixtrans-62.8-44.3179.500000112.3F66 A67 F73 S74F66-G70 PolarHBondContact O-N 3.33Å; A67-G70 PolarHBondContact O-N 2.99Å; G70-F73 PolarHBondContact O-N 2.65Å; G70-S74 PolarHBondContact O-N 3.34Å; G70-S74 PolarHBondContact O-OG 2.86Å
71G94.6Very high93.3Very high7 Ų740.1 Ų40.17%0.07223%0.229CC..Hα-helixtrans-62.1-46.5176.200000113.5C17 A67 S74 T75C17-G71 WeakPolarHBondContact SG-CA 3.37Å; A67-G71 PolarHBondContact O-N 2.84Å; G71-S74 PolarHBondContact O-N 3.26Å; G71-T75 WeakPolarHBondContact O-CG2 3.37Å; G71-T75 PolarHBondContact O-N 3.45Å; G71-T75 PolarHBondContact O-OG1 3.32Å
72L94.5Very high92.7Very high39 Ų3944 Ų4420%0.20424%0.239CC..Hα-helixtrans-64.7-43.4179-177.760.2000111.2V68 W69 S74 T75 I76 T99 V102 L103V68-L72 WeakPolarHBondContact O-CB 3.18Å; V68-L72 PolarHBondContact O-N 3.23Å; W69-L72 PolarHBondContact O-N 3.39Å; L72-S74 PolarHBondContact O-N 3.45Å; L72-T75 WeakPolarHBondContact CA-OG1 3.5Å; L72-T75 PolarHBondContact O-N 3.49Å; L72-T75 PolarHBondContact O-OG1 3.39Å; L72-I76 HydrophobicContact CD1-CD1 3.82Å; L72-I76 HydrophobicContact CD1-CG1 4.24Å; L72-I76 HydrophobicContact CG-CD1 3.85Å; L72-I76 VanDerWaalsContact O-CG1 3.29Å; L72-I76 WeakPolarHBondContact O-CG1 3.33Å; L72-I76 PolarHBondContact O-N 3.49Å; L72-T99 HydrophobicContact CB-CG2 4.09Å; L72-T99 HydrophobicContact CD2-CG2 3.95Å; L72-T99 HydrophobicContact CG-CG2 4.02Å; L72-V102 HydrophobicContact CD1-CG1 4.4Å; L72-V102 HydrophobicContact CD2-CB 3.89Å; L72-V102 HydrophobicContact CD2-CG1 3.62Å; L72-L103 HydrophobicContact CD2-CD2 3.87Å; L72-L103 HydrophobicContact CD2-CG 3.9Å
73F94.5Very high92.2Very high30 Ų3049 Ų4913%0.13227%0.265CS..Hα-helixtrans-53.8-53.3173.6171.9-102.7000111.7W69 G70 T75 I76 D77 S95 T99 L123W69-F73 VanDerWaalsContact O-CB 3.31Å; W69-F73 WeakPolarHBondContact O-CB 3.42Å; W69-F73 PolarHBondContact O-N 3.08Å; G70-F73 PolarHBondContact O-N 2.65Å; F73-T75 PolarHBondContact O-N 2.87Å; F73-I76 PolarHBondContact O-N 3.19Å; F73-D77 PolarHBondContact O-N 3.47Å; F73-S95 WeakPolarHBondContact CE2-OG 3.41Å; F73-T99 VanDerWaalsContact CA-OG1 3.25Å; F73-T99 WeakPolarHBondContact CA-OG1 3.35Å; F73-T99 HydrophobicContact CB-CG2 4.36Å; F73-T99 PolarHBondContact N-OG1 2.83Å; F73-L123 HydrophobicContact CD2-CD1 3.67Å; F73-L123 HydrophobicContact CE2-CD1 3.08Å; F73-L123 HydrophobicContact CZ-CD1 3.79Å
74S92.6Very high91.6Very high0 Ų055.7 Ų55.70%029%0.29CS..Hα-helixtrans-68.4-33.2-177.4-54.50000113D16 G70 G71 L72 C78D16-S74 WeakPolarHBondContact CB-OG 3.15Å; D16-S74 VanDerWaalsContact OD2-CB 3.31Å; D16-S74 WeakPolarHBondContact OD2-CB 3.31Å; D16-S74 PolarHBondContact OD2-OG 2.97Å; G70-S74 PolarHBondContact O-N 3.34Å; G70-S74 PolarHBondContact O-OG 2.86Å; G71-S74 PolarHBondContact O-N 3.26Å; L72-S74 PolarHBondContact O-N 3.45Å; S74-C78 WeakPolarHBondContact O-CB 3.49Å; S74-C78 PolarHBondContact O-N 3.27Å; S74-C78 PolarHBondContact O-SG 3.36Å; S74-C78 VanDerWaalsContact O-SG 3.38Å
75T92.5Very high90.7Very high60 Ų6057.6 Ų57.637%0.36831%0.311SS..Hα-helixtrans-64.1-41173.2600000111.9I13 G71 L72 F73 G79I13-T75 HydrophobicContact CD1-CG2 3.78Å; I13-T75 HydrophobicContact CG1-CG2 4.13Å; I13-T75 HydrophobicContact CG2-CG2 3.77Å; G71-T75 WeakPolarHBondContact O-CG2 3.37Å; G71-T75 PolarHBondContact O-N 3.45Å; G71-T75 PolarHBondContact O-OG1 3.32Å; L72-T75 WeakPolarHBondContact CA-OG1 3.5Å; L72-T75 PolarHBondContact O-N 3.49Å; L72-T75 PolarHBondContact O-OG1 3.39Å; F73-T75 PolarHBondContact O-N 2.87Å; T75-G79 PolarHBondContact O-N 2.84Å
76I92.8Very high89.9Confident30 Ų3060.3 Ų60.315%0.15431%0.312CS..Hα-helixtrans-72.2-43179.6-64.1164.8000110L72 F73 G79 L80 L98L72-I76 HydrophobicContact CD1-CD1 3.82Å; L72-I76 HydrophobicContact CD1-CG1 4.24Å; L72-I76 HydrophobicContact CG-CD1 3.85Å; L72-I76 VanDerWaalsContact O-CG1 3.29Å; L72-I76 WeakPolarHBondContact O-CG1 3.33Å; L72-I76 PolarHBondContact O-N 3.49Å; F73-I76 PolarHBondContact O-N 3.19Å; I76-G79 PolarHBondContact O-N 3.44Å; I76-L80 HydrophobicContact CG2-CD1 4.11Å; I76-L80 HydrophobicContact CG2-CG 4.33Å; I76-L80 WeakPolarHBondContact O-CG 3.33Å; I76-L80 PolarHBondContact O-N 3.49Å; I76-L98 HydrophobicContact CD1-CB 3.94Å; I76-L98 HydrophobicContact CG2-CB 4.17Å; I76-L98 HydrophobicContact CG2-CD1 3.72Å
77D91.1Very high89Confident4 Ų461.6 Ų61.62%0.02132%0.319CS..Hα-helixtrans-60.6-51.3176.7-171.648.2000111.4R6 F73 G79 L80 V81R6-D77 IonicContact NH2-OD2 2.93Å; R6-D77 PolarHBondContact NH2-OD2 2.92Å; F73-D77 PolarHBondContact O-N 3.47Å; D77-G79 VanDerWaalsContact C-N 3.27Å; D77-G79 PolarHBondContact O-N 2.94Å; D77-L80 PolarHBondContact O-N 3.48Å; D77-L80 VanDerWaalsContact O-N 3.14Å; D77-V81 WeakPolarHBondContact O-CG2 3.22Å; D77-V81 PolarHBondContact O-N 2.91Å
78C89.6Confident88.3Confident13 Ų1364.2 Ų64.29%0.08833%0.331CS..Hα-helixtrans-54.4-42.5173.1-82.90000112.3C9 S74 R82C9-C78 HydrophobicContact CB-CB 3.89Å; C9-C78 WeakPolarHBondContact CB-SG 3.45Å; C9-C78 WeakPolarHBondContact SG-CB 3.46Å; C9-C78 CovalentContact SG-SG 2.04Å; C9-C78 PolarHBondContact SG-SG 3.41Å; S74-C78 WeakPolarHBondContact O-CB 3.49Å; S74-C78 PolarHBondContact O-N 3.27Å; S74-C78 PolarHBondContact O-SG 3.36Å; S74-C78 VanDerWaalsContact O-SG 3.38Å; C78-R82 WeakPolarHBondContact O-CB 3.38Å; C78-R82 PolarHBondContact O-N 3.3Å
79G87.7Confident87.7Confident30 Ų3062.7 Ų62.731%0.30932%0.322SS..Hα-helixtrans-64.3-43.9177.200000112.8T75 I76 D77 R82 L83T75-G79 PolarHBondContact O-N 2.84Å; I76-G79 PolarHBondContact O-N 3.44Å; D77-G79 VanDerWaalsContact C-N 3.27Å; D77-G79 PolarHBondContact O-N 2.94Å; G79-R82 PolarHBondContact O-N 3.38Å; G79-L83 WeakPolarHBondContact O-CB 3.27Å; G79-L83 VanDerWaalsContact O-CG 3.29Å; G79-L83 WeakPolarHBondContact O-CG 3.45Å; G79-L83 PolarHBondContact O-N 2.97Å
80L86.9Confident87.2Confident31 Ų3166.7 Ų66.716%0.16234%0.338CS..Hα-helixtrans-65.4-42.9178.1-72.8176000111.9I76 D77 R82 L83 R84 N91 T94I76-L80 HydrophobicContact CG2-CD1 4.11Å; I76-L80 HydrophobicContact CG2-CG 4.33Å; I76-L80 WeakPolarHBondContact O-CG 3.33Å; I76-L80 PolarHBondContact O-N 3.49Å; D77-L80 PolarHBondContact O-N 3.48Å; D77-L80 VanDerWaalsContact O-N 3.14Å; L80-R82 VanDerWaalsContact C-N 3.33Å; L80-R82 PolarHBondContact O-N 3.01Å; L80-L83 PolarHBondContact O-N 3.25Å; L80-R84 WeakPolarHBondContact O-CB 3.39Å; L80-R84 WeakPolarHBondContact O-CG 3.46Å; L80-R84 PolarHBondContact O-N 2.67Å; L80-N91 HydrophobicContact CB-CB 4.5Å; L80-T94 HydrophobicContact CD1-CG2 4.24Å
81V86.8Confident87Confident32 Ų3266.6 Ų66.619%0.19434%0.336CS..Hα-helixtrans-61.3-43.7174.4173.90000110.3D77 L83 G85 E87D77-V81 WeakPolarHBondContact O-CG2 3.22Å; D77-V81 PolarHBondContact O-N 2.91Å; V81-L83 VanDerWaalsContact C-N 3.33Å; V81-L83 PolarHBondContact O-N 3.39Å; V81-G85 WeakPolarHBondContact O-CA 3.47Å; V81-G85 PolarHBondContact O-N 2.94Å; V81-E87 HydrophobicContact CG1-CG 3.97Å; V81-E87 HydrophobicContact CG2-CG 4.1Å
82R84.1Confident86.6Confident203 Ų20366.9 Ų66.977%0.76634%0.337SS*.Hα-helixtrans-65.2-34.2178.6-178.158.7-172.986.9-5.1113.4C78 G79 L80C78-R82 WeakPolarHBondContact O-CB 3.38Å; C78-R82 PolarHBondContact O-N 3.3Å; G79-R82 PolarHBondContact O-N 3.38Å; L80-R82 VanDerWaalsContact C-N 3.33Å; L80-R82 PolarHBondContact O-N 3.01Å
83L84.9Confident86.5Confident148 Ų14866.8 Ų66.878%0.77534%0.336SS*.Hα-helixtrans-79.2-40.4179.4-72.9172.2000112.7G79 L80 V81G79-L83 WeakPolarHBondContact O-CB 3.27Å; G79-L83 VanDerWaalsContact O-CG 3.29Å; G79-L83 WeakPolarHBondContact O-CG 3.45Å; G79-L83 PolarHBondContact O-N 2.97Å; L80-L83 PolarHBondContact O-N 3.25Å; V81-L83 VanDerWaalsContact C-N 3.33Å; V81-L83 PolarHBondContact O-N 3.39Å
84R83.7Confident86.4Confident140 Ų14067.7 Ų67.753%0.52834%0.344SS..Hα-helixtrans-95.7-18.5-173.2-59.7-178.285.7-176.16.7113.5L80 K86 N91L80-R84 WeakPolarHBondContact O-CB 3.39Å; L80-R84 WeakPolarHBondContact O-CG 3.46Å; L80-R84 PolarHBondContact O-N 2.67Å; R84-K86 PolarHBondContact O-N 2.89Å; R84-K86 VanDerWaalsContact O-N 3.12Å; R84-N91 PolarHBondContact NH1-OD1 3.19Å
85G77.6Confident86.4Confident67 Ų6767.7 Ų67.769%0.69134%0.344SS*.SBendtrans60.717.1-176.900000113.8V81V81-G85 WeakPolarHBondContact O-CA 3.47Å; V81-G85 PolarHBondContact O-N 2.94Å
86K78Confident86.4Confident139 Ų13964.8 Ų64.860%0.60433%0.327SS*.  trans-135138.4-177.2-70.2178.9-179.4165.10109.2R84 N91R84-K86 PolarHBondContact O-N 2.89Å; R84-K86 VanDerWaalsContact O-N 3.12Å; K86-N91 PolarHBondContact O-ND2 2.89Å
87E75.4Confident86.5Confident128 Ų12864.7 Ų64.760%0.59833%0.33SS*.  trans-105.595.5176.6-60.7-164.7162.800108.8V81V81-E87 HydrophobicContact CG1-CG 3.97Å; V81-E87 HydrophobicContact CG2-CG 4.1Å
88D82.3Confident86.6Confident74 Ų7468.1 Ų68.140%0.39635%0.348SS..  trans-116.7153178.1-66.3-51.4000110W90 N91D88-W90 HydrophobicContact CB-CB 4.39Å; D88-W90 PolarHBondContact O-N 3.13Å; D88-N91 WeakPolarHBondContact O-CB 3.39Å; D88-N91 PolarHBondContact O-N 3.5Å
89P82.9Confident86.9Confident54 Ų5467.5 Ų67.535%0.35134%0.344SS..Hα-helixtrans-54.2-23.4173.3-26.234.3000113.6N91 S92 I93 E127 I131P89-N91 PolarHBondContact O-N 3.37Å; P89-S92 PolarHBondContact O-N 3.37Å; P89-I93 WeakPolarHBondContact O-CG1 3.45Å; P89-I93 PolarHBondContact O-N 3.17Å; P89-I93 VanDerWaalsContact O-N 3.13Å; P89-E127 HydrophobicContact CB-CB 4.44Å; P89-I131 HydrophobicContact CG-CD1 4.14Å
90W84.6Confident87.2Confident168 Ų16866.4 Ų66.464%0.63633%0.333SS*.Hα-helixtrans-61.9-27.8172.7-87108.2000113.9D88 T94D88-W90 HydrophobicContact CB-CB 4.39Å; D88-W90 PolarHBondContact O-N 3.13Å; W90-T94 WeakPolarHBondContact O-CB 3.27Å; W90-T94 PolarHBondContact O-N 3.45Å; W90-T94 PolarHBondContact O-OG1 2.87Å
91N89.3Confident87.6Confident2 Ų265.8 Ų65.81%0.01133%0.332CS..Hα-helixtrans-69.1-45.9176.6-66.7-10.8000110.4L80 R84 K86 D88 P89 T94 S95L80-N91 HydrophobicContact CB-CB 4.5Å; R84-N91 PolarHBondContact NH1-OD1 3.19Å; K86-N91 PolarHBondContact O-ND2 2.89Å; D88-N91 WeakPolarHBondContact O-CB 3.39Å; D88-N91 PolarHBondContact O-N 3.5Å; P89-N91 PolarHBondContact O-N 3.37Å; N91-T94 PolarHBondContact O-N 2.91Å; N91-S95 VanDerWaalsContact O-CB 3.22Å; N91-S95 WeakPolarHBondContact O-CB 3.07Å; N91-S95 PolarHBondContact O-N 3.45Å; N91-S95 PolarHBondContact O-OG 3.43Å
92S87.6Confident88Confident13 Ų1368 Ų689%0.09135%0.345CS..Hα-helixtrans-60-46.1173.7-59.70000111.8P89 T94 S95 G96 L123 E127P89-S92 PolarHBondContact O-N 3.37Å; S92-T94 PolarHBondContact O-N 2.91Å; S92-S95 VanDerWaalsContact CA-OG 3.31Å; S92-S95 WeakPolarHBondContact CA-OG 3.39Å; S92-S95 PolarHBondContact O-N 3.5Å; S92-S95 PolarHBondContact O-OG 2.92Å; S92-G96 PolarHBondContact O-N 3.34Å; S92-L123 WeakPolarHBondContact O-CD1 3.1Å; S92-E127 WeakPolarHBondContact CB-OE1 3.47Å; S92-E127 PolarHBondContact OG-OE1 3.14Å
93I91.6Very high88.4Confident37 Ų3761.7 Ų61.719%0.1933%0.326CS..Hα-helixtrans-64.1-46-179.8-63.6169.2000111.1P89 G96 A97 A124P89-I93 WeakPolarHBondContact O-CG1 3.45Å; P89-I93 PolarHBondContact O-N 3.17Å; P89-I93 VanDerWaalsContact O-N 3.13Å; I93-G96 PolarHBondContact O-N 2.91Å; I93-A97 PolarHBondContact O-N 3.09Å; I93-A124 HydrophobicContact CD1-CB 3.89Å; I93-A124 HydrophobicContact CG1-CB 4Å; I93-A124 HydrophobicContact CG2-CB 4.47Å
94T92.1Very high88.9Confident48 Ų4855.2 Ų55.229%0.29429%0.294SS..Hα-helixtrans-68.6-40.8-178.5-54.40000111.1L80 W90 N91 S92 G96 A97 L98L80-T94 HydrophobicContact CD1-CG2 4.24Å; W90-T94 WeakPolarHBondContact O-CB 3.27Å; W90-T94 PolarHBondContact O-N 3.45Å; W90-T94 PolarHBondContact O-OG1 2.87Å; N91-T94 PolarHBondContact O-N 2.91Å; S92-T94 PolarHBondContact O-N 2.91Å; T94-G96 VanDerWaalsContact C-N 3.35Å; T94-A97 PolarHBondContact O-N 2.97Å; T94-L98 HydrophobicContact CG2-CD1 3.95Å; T94-L98 HydrophobicContact CG2-CG 4.33Å; T94-L98 WeakPolarHBondContact O-CB 3.41Å; T94-L98 VanDerWaalsContact O-CG 3.29Å; T94-L98 WeakPolarHBondContact O-CG 3.29Å; T94-L98 PolarHBondContact O-N 3.18Å
95S92.5Very high89.3Confident0 Ų050.9 Ų50.90%029%0.288CS..Hα-helixtrans-65.5-37175.754.60000111.8F73 N91 S92 L98 T99F73-S95 WeakPolarHBondContact CE2-OG 3.41Å; N91-S95 VanDerWaalsContact O-CB 3.22Å; N91-S95 WeakPolarHBondContact O-CB 3.07Å; N91-S95 PolarHBondContact O-N 3.45Å; N91-S95 PolarHBondContact O-OG 3.43Å; S92-S95 VanDerWaalsContact CA-OG 3.31Å; S92-S95 WeakPolarHBondContact CA-OG 3.39Å; S92-S95 PolarHBondContact O-N 3.5Å; S92-S95 PolarHBondContact O-OG 2.92Å; S95-L98 PolarHBondContact O-N 3.18Å; S95-T99 VanDerWaalsContact O-CB 3.23Å; S95-T99 WeakPolarHBondContact O-CB 3.25Å; S95-T99 PolarHBondContact O-N 3.43Å; S95-T99 PolarHBondContact O-OG1 3.14Å
96G92.8Very high90.1Very high0 Ų059 Ų590%030%0.298CS..Hα-helixtrans-62.1-45.7171.200000113.4S92 I93 T94 T99 G100 L123S92-G96 PolarHBondContact O-N 3.34Å; I93-G96 PolarHBondContact O-N 2.91Å; T94-G96 VanDerWaalsContact C-N 3.35Å; G96-T99 PolarHBondContact O-N 3.35Å; G96-G100 PolarHBondContact O-N 3.34Å; G96-L123 VanDerWaalsContact CA-CD1 3.48Å
97A94.8Very high90.8Very high27 Ų2756.3 Ų56.322%0.22330%0.297CS..Hα-helixtrans-63.6-45176.900000111.9I93 T94 G100 A101 A116I93-A97 PolarHBondContact O-N 3.09Å; T94-A97 PolarHBondContact O-N 2.97Å; A97-G100 PolarHBondContact O-N 3.34Å; A97-A101 WeakPolarHBondContact O-CB 3.4Å; A97-A101 PolarHBondContact O-N 3.39Å; A97-A116 WeakPolarHBondContact CA-O 3.33Å; A97-A116 WeakPolarHBondContact O-CA 3.42Å; A97-A116 WeakPolarHBondContact O-CB 3.38Å
98L94.3Very high91.7Very high76 Ų7651.4 Ų51.440%0.39828%0.28SS..Hα-helixtrans-64.9-42.6177.3-73.5172.2000111.9I76 T94 S95 G100 A101 V102I76-L98 HydrophobicContact CD1-CB 3.94Å; I76-L98 HydrophobicContact CG2-CB 4.17Å; I76-L98 HydrophobicContact CG2-CD1 3.72Å; T94-L98 HydrophobicContact CG2-CD1 3.95Å; T94-L98 HydrophobicContact CG2-CG 4.33Å; T94-L98 WeakPolarHBondContact O-CB 3.41Å; T94-L98 VanDerWaalsContact O-CG 3.29Å; T94-L98 WeakPolarHBondContact O-CG 3.29Å; T94-L98 PolarHBondContact O-N 3.18Å; S95-L98 PolarHBondContact O-N 3.18Å; L98-G100 VanDerWaalsContact C-N 3.34Å; L98-G100 PolarHBondContact O-N 3.18Å; L98-A101 PolarHBondContact O-N 3.05Å; L98-V102 WeakPolarHBondContact O-CB 3.36Å; L98-V102 VanDerWaalsContact O-CG2 3.24Å; L98-V102 WeakPolarHBondContact O-CG2 3.25Å; L98-V102 PolarHBondContact O-N 2.88Å
99T94.8Very high92.3Very high0 Ų052.8 Ų52.80%029%0.294CS..Hα-helixtrans-57.9-47.9175.4-60.30000110.6W69 L72 F73 S95 G96 V102 L103W69-T99 HydrophobicContact CG-CG2 4.21Å; L72-T99 HydrophobicContact CB-CG2 4.09Å; L72-T99 HydrophobicContact CD2-CG2 3.95Å; L72-T99 HydrophobicContact CG-CG2 4.02Å; F73-T99 VanDerWaalsContact CA-OG1 3.25Å; F73-T99 WeakPolarHBondContact CA-OG1 3.35Å; F73-T99 HydrophobicContact CB-CG2 4.36Å; F73-T99 PolarHBondContact N-OG1 2.83Å; S95-T99 VanDerWaalsContact O-CB 3.23Å; S95-T99 WeakPolarHBondContact O-CB 3.25Å; S95-T99 PolarHBondContact O-N 3.43Å; S95-T99 PolarHBondContact O-OG1 3.14Å; G96-T99 PolarHBondContact O-N 3.35Å; T99-V102 PolarHBondContact O-N 3.42Å; T99-L103 HydrophobicContact CG2-CD1 4.01Å; T99-L103 VanDerWaalsContact O-CG 3.27Å; T99-L103 WeakPolarHBondContact O-CG 3.29Å; T99-L103 PolarHBondContact O-N 2.89Å
100G93.5Very high92.9Very high8 Ų857.6 Ų57.68%0.08232%0.315CS..Hα-helixtrans-57.1-51.5175.300000112.1G96 A97 L98 V102 L103 A104 S115G96-G100 PolarHBondContact O-N 3.34Å; A97-G100 PolarHBondContact O-N 3.34Å; L98-G100 VanDerWaalsContact C-N 3.34Å; L98-G100 PolarHBondContact O-N 3.18Å; G100-V102 PolarHBondContact O-N 3.06Å; G100-L103 PolarHBondContact O-N 3.38Å; G100-A104 PolarHBondContact O-N 3.27Å; G100-A104 VanDerWaalsContact O-N 3.14Å; G100-S115 VanDerWaalsContact C-OG 3.28Å; G100-S115 WeakPolarHBondContact O-CB 3.39Å; G100-S115 PolarHBondContact O-OG 2.92Å
101A95.2Very high93.3Very high17 Ų1751.3 Ų51.314%0.1430%0.3CS..Hα-helixtrans-56.6-47.2179.600000112.4A97 L98 A104 A105 A116A97-A101 WeakPolarHBondContact O-CB 3.4Å; A97-A101 PolarHBondContact O-N 3.39Å; L98-A101 PolarHBondContact O-N 3.05Å; A101-A104 CarbonylContact O-C 3.57Å; A101-A104 PolarHBondContact O-N 2.89Å; A101-A105 PolarHBondContact O-N 2.97Å; A101-A116 HydrophobicContact CB-CB 3.98Å
102V95.5Very high93.6Very high78 Ų7854.3 Ų54.347%0.47331%0.314SS..Hα-helixtrans-65.9-42.6-177.3169.30000111L72 L98 T99 G100 A104 A105L72-V102 HydrophobicContact CD1-CG1 4.4Å; L72-V102 HydrophobicContact CD2-CB 3.89Å; L72-V102 HydrophobicContact CD2-CG1 3.62Å; L98-V102 WeakPolarHBondContact O-CB 3.36Å; L98-V102 VanDerWaalsContact O-CG2 3.24Å; L98-V102 WeakPolarHBondContact O-CG2 3.25Å; L98-V102 PolarHBondContact O-N 2.88Å; T99-V102 PolarHBondContact O-N 3.42Å; G100-V102 PolarHBondContact O-N 3.06Å; V102-A104 VanDerWaalsContact C-N 3.26Å; V102-A104 PolarHBondContact O-N 3.41Å; V102-A105 VanDerWaalsContact O-CB 3.22Å; V102-A105 WeakPolarHBondContact O-CB 3.38Å; V102-A105 PolarHBondContact O-N 2.88Å
103L93.8Very high94Very high71 Ų7157.9 Ų57.937%0.37234%0.335SS..Hα-helixtrans-66.8-29.3179.1-66.8175.1000113V68 W69 L72 T99 G100V68-L103 HydrophobicContact CG1-CD2 3.73Å; W69-L103 HydrophobicContact CB-CD1 4.21Å; W69-L103 HydrophobicContact CG-CD1 4.28Å; L72-L103 HydrophobicContact CD2-CD2 3.87Å; L72-L103 HydrophobicContact CD2-CG 3.9Å; T99-L103 HydrophobicContact CG2-CD1 4.01Å; T99-L103 VanDerWaalsContact O-CG 3.27Å; T99-L103 WeakPolarHBondContact O-CG 3.29Å; T99-L103 PolarHBondContact O-N 2.89Å; G100-L103 PolarHBondContact O-N 3.38Å
104A94.3Very high94.2Very high12 Ų1257.8 Ų57.810%0.09934%0.343CS..THydrogen-bonded Turntrans-93.43.6176.500000113.9G100 A101 V102 R106 S107 A111 S115G100-A104 PolarHBondContact O-N 3.27Å; G100-A104 VanDerWaalsContact O-N 3.14Å; A101-A104 CarbonylContact O-C 3.57Å; A101-A104 PolarHBondContact O-N 2.89Å; V102-A104 VanDerWaalsContact C-N 3.26Å; V102-A104 PolarHBondContact O-N 3.41Å; A104-R106 PolarHBondContact O-N 3.12Å; A104-S107 WeakPolarHBondContact O-CA 3.5Å; A104-S107 WeakPolarHBondContact O-CB 3.44Å; A104-S107 PolarHBondContact O-N 3.45Å; A104-A111 HydrophobicContact CB-CB 4.35Å; A104-A111 WeakPolarHBondContact CB-O 3.49Å; A104-S115 WeakPolarHBondContact CB-OG 3.49Å
105A93.5Very high94.3Very high49 Ų4957 Ų5741%0.40534%0.34SS..G310 helixtrans-54.3-40.9-175.300000113.1A101 V102 S107 G108 M112A101-A105 PolarHBondContact O-N 2.97Å; V102-A105 VanDerWaalsContact O-CB 3.22Å; V102-A105 WeakPolarHBondContact O-CB 3.38Å; V102-A105 PolarHBondContact O-N 2.88Å; A105-S107 PolarHBondContact O-N 3.25Å; A105-G108 PolarHBondContact O-N 3.01Å; A105-M112 HydrophobicContact CB-CE 4.21Å; A105-M112 HydrophobicContact CB-CG 4.5Å; A105-M112 HydrophobicContact CB-SD 4.26Å
106R93.6Very high94.4Very high239 Ų23958 Ų5890%0.90235%0.348SS*.G310 helixtrans-70.5-16.4178.368.6179.7-177.8179.1-0.1114.6A104 G108A104-R106 PolarHBondContact O-N 3.12Å; R106-G108 VanDerWaalsContact C-N 3.32Å
107S92.9Very high94.6Very high81 Ų8163.3 Ų63.357%0.56637%0.374SS*.G310 helixtrans-91.12.2-176.7-55.40000112.5A104 A105A104-S107 WeakPolarHBondContact O-CA 3.5Å; A104-S107 WeakPolarHBondContact O-CB 3.44Å; A104-S107 PolarHBondContact O-N 3.45Å; A105-S107 PolarHBondContact O-N 3.25Å
108G94.7Very high94.5Very high25 Ų2568.1 Ų68.126%0.25839%0.394SS..  trans94.6164.8178.600000114A105 R106 L110 A111 M112A105-G108 PolarHBondContact O-N 3.01Å; R106-G108 VanDerWaalsContact C-N 3.32Å; G108-L110 VanDerWaalsContact C-N 3.32Å; G108-L110 PolarHBondContact O-N 3.03Å; G108-A111 PolarHBondContact O-N 2.95Å; G108-A111 VanDerWaalsContact O-N 3.12Å; G108-M112 WeakPolarHBondContact O-CG 3.44Å; G108-M112 PolarHBondContact O-N 3.38Å
109P93.9Very high94.4Very high104 Ų10465 Ų6568%0.67538%0.379SS*.Hα-helixtrans-62.8-34.3-16922.9-33.5000113.5M112 V113P109-M112 WeakPolarHBondContact O-CB 3.07Å; P109-M112 PolarHBondContact O-N 3.29Å; P109-V113 WeakPolarHBondContact O-CG2 3.21Å; P109-V113 PolarHBondContact O-N 2.88Å
110L95.1Very high94.3Very high154 Ų15465.4 Ų65.481%0.80638%0.384SS*.Hα-helixtrans-65.2-41.6177.4-173.166.9000111.8G108 M112 V113 G114G108-L110 VanDerWaalsContact C-N 3.32Å; G108-L110 PolarHBondContact O-N 3.03Å; L110-M112 VanDerWaalsContact C-N 3.34Å; L110-V113 PolarHBondContact O-N 3.39Å; L110-G114 PolarHBondContact O-N 3Å
111A94.5Very high94.3Very high37 Ų3770 Ų7031%0.30641%0.406SS..Hα-helixtrans-68.5-34.9176.500000111.7A104 G108 S115A104-A111 HydrophobicContact CB-CB 4.35Å; A104-A111 WeakPolarHBondContact CB-O 3.49Å; G108-A111 PolarHBondContact O-N 2.95Å; G108-A111 VanDerWaalsContact O-N 3.12Å; A111-S115 VanDerWaalsContact O-CB 3.32Å; A111-S115 WeakPolarHBondContact O-CB 3.35Å; A111-S115 PolarHBondContact O-N 2.79Å; A111-S115 PolarHBondContact O-OG 3.32Å
112M95.4Very high94.2Very high64 Ų6473 Ų7332%0.31542%0.419SS..Hα-helixtrans-59.7-50.2172.6-66.2176.370.900111.7A105 G108 P109 L110 S115 A116A105-M112 HydrophobicContact CB-CE 4.21Å; A105-M112 HydrophobicContact CB-CG 4.5Å; A105-M112 HydrophobicContact CB-SD 4.26Å; G108-M112 WeakPolarHBondContact O-CG 3.44Å; G108-M112 PolarHBondContact O-N 3.38Å; P109-M112 WeakPolarHBondContact O-CB 3.07Å; P109-M112 PolarHBondContact O-N 3.29Å; L110-M112 VanDerWaalsContact C-N 3.34Å; M112-S115 PolarHBondContact O-N 3.48Å; M112-S115 PolarHBondContact O-OG 2.91Å; M112-A116 WeakPolarHBondContact O-CB 3.48Å; M112-A116 PolarHBondContact O-N 2.83Å
113V95.8Very high94.1Very high88 Ų8869.9 Ų69.953%0.53340%0.399SS..Hα-helixtrans-64.8-43.7179.81760000110.8P109 L110 S115 A116 M117P109-V113 WeakPolarHBondContact O-CG2 3.21Å; P109-V113 PolarHBondContact O-N 2.88Å; L110-V113 PolarHBondContact O-N 3.39Å; V113-S115 PolarHBondContact O-N 3.42Å; V113-A116 PolarHBondContact O-N 3.43Å; V113-M117 HydrophobicContact CG1-CE 4.18Å; V113-M117 WeakPolarHBondContact O-CG 3.45Å; V113-M117 PolarHBondContact O-N 3.3Å
114G95.1Very high94Very high35 Ų3568.3 Ų68.336%0.36140%0.397SS..Hα-helixtrans-60.2-46177.800000113.3L110 M118L110-G114 PolarHBondContact O-N 3Å; G114-M118 PolarHBondContact O-N 3.16Å; G114-M118 VanDerWaalsContact O-N 3.09Å
115S94.9Very high94Very high31 Ų3173 Ų7322%0.21742%0.42CS..Hα-helixtrans-70-36.5177.756.90000113G100 A104 A111 M112 V113 M118 G119G100-S115 VanDerWaalsContact C-OG 3.28Å; G100-S115 WeakPolarHBondContact O-CB 3.39Å; G100-S115 PolarHBondContact O-OG 2.92Å; A104-S115 WeakPolarHBondContact CB-OG 3.49Å; A111-S115 VanDerWaalsContact O-CB 3.32Å; A111-S115 WeakPolarHBondContact O-CB 3.35Å; A111-S115 PolarHBondContact O-N 2.79Å; A111-S115 PolarHBondContact O-OG 3.32Å; M112-S115 PolarHBondContact O-N 3.48Å; M112-S115 PolarHBondContact O-OG 2.91Å; V113-S115 PolarHBondContact O-N 3.42Å; S115-M118 PolarHBondContact O-N 2.95Å; S115-G119 PolarHBondContact O-N 2.86Å
116A94.6Very high93.8Very high21 Ų2175.2 Ų75.217%0.17442%0.424CS..Hα-helixtrans-62.2-45.5174.400000111.6A97 A101 M112 V113 G119 G120A97-A116 WeakPolarHBondContact CA-O 3.33Å; A97-A116 WeakPolarHBondContact O-CA 3.42Å; A97-A116 WeakPolarHBondContact O-CB 3.38Å; A101-A116 HydrophobicContact CB-CB 3.98Å; M112-A116 WeakPolarHBondContact O-CB 3.48Å; M112-A116 PolarHBondContact O-N 2.83Å; V113-A116 PolarHBondContact O-N 3.43Å; A116-G119 PolarHBondContact O-N 3.06Å; A116-G120 PolarHBondContact O-N 3.12Å
117M95.9Very high93.6Very high112 Ų11266.8 Ų66.855%0.55240%0.395SS*.Hα-helixtrans-60.6-47.6175.5-73.7-170.7-60.600111.2V113 G119 G120 I121V113-M117 HydrophobicContact CG1-CE 4.18Å; V113-M117 WeakPolarHBondContact O-CG 3.45Å; V113-M117 PolarHBondContact O-N 3.3Å; M117-G119 PolarHBondContact O-N 2.88Å; M117-G120 PolarHBondContact O-N 3.06Å; M117-I121 WeakPolarHBondContact O-CB 3.32Å; M117-I121 WeakPolarHBondContact O-CD1 3.34Å; M117-I121 WeakPolarHBondContact O-CG1 3.46Å; M117-I121 PolarHBondContact O-N 3.01Å
118M93.9Very high93.4Very high129 Ų12964.7 Ų64.764%0.63539%0.386SS*.Hα-helixtrans-60.8-45.1179.1-172.465.4-175.600111.9G114 S115 L122G114-M118 PolarHBondContact O-N 3.16Å; G114-M118 VanDerWaalsContact O-N 3.09Å; S115-M118 PolarHBondContact O-N 2.95Å; M118-L122 VanDerWaalsContact O-CB 3.31Å; M118-L122 WeakPolarHBondContact O-CB 3.26Å; M118-L122 PolarHBondContact O-N 2.9Å
119G91.4Very high93.2Very high9 Ų967.2 Ų67.29%0.09340%0.396CS..Hα-helixtrans-64-44.2177.900000112.9S115 A116 M117 L123S115-G119 PolarHBondContact O-N 2.86Å; A116-G119 PolarHBondContact O-N 3.06Å; M117-G119 PolarHBondContact O-N 2.88Å; G119-L123 PolarHBondContact O-N 3.31Å; G119-L123 VanDerWaalsContact O-N 3.16Å
120G92.8Very high92.9Very high10 Ų1063.7 Ų63.710%0.10338%0.379CS..Hα-helixtrans-65-44.5177.300000112.8A116 M117 A124A116-G120 PolarHBondContact O-N 3.12Å; M117-G120 PolarHBondContact O-N 3.06Å; G120-A124 VanDerWaalsContact O-CB 3.25Å; G120-A124 WeakPolarHBondContact O-CB 3.31Å; G120-A124 PolarHBondContact O-N 2.92Å
121I94.6Very high92.6Very high105 Ų10560.1 Ų60.154%0.53836%0.36SS..Hα-helixtrans-63.3-45.6177.3-68.9165.6000110.6M117 L123 A124 L125M117-I121 WeakPolarHBondContact O-CB 3.32Å; M117-I121 WeakPolarHBondContact O-CD1 3.34Å; M117-I121 WeakPolarHBondContact O-CG1 3.46Å; M117-I121 PolarHBondContact O-N 3.01Å; I121-L123 PolarHBondContact O-N 2.77Å; I121-A124 PolarHBondContact O-N 3.03Å; I121-L125 HydrophobicContact CG2-CD1 4.21Å; I121-L125 WeakPolarHBondContact O-CG 3.39Å; I121-L125 PolarHBondContact O-N 3.26Å
122L92.9Very high92.2Very high80 Ų8064 Ų6442%0.41938%0.375SS..Hα-helixtrans-59.2-47.4-179.1-177.165.6000111.3M118 L125 I126M118-L122 VanDerWaalsContact O-CB 3.31Å; M118-L122 WeakPolarHBondContact O-CB 3.26Å; M118-L122 PolarHBondContact O-N 2.9Å; L122-L125 PolarHBondContact O-N 3.45Å; L122-I126 HydrophobicContact CG-CD1 4.38Å; L122-I126 WeakPolarHBondContact O-CG1 3.34Å; L122-I126 PolarHBondContact O-N 2.91Å
123L92.5Very high91.8Very high11 Ų1165.9 Ų65.96%0.05839%0.386CS..Hα-helixtrans-74.7-30180-64.9-164.4000113.3W69 F73 S92 G96 G119 I121 L125 I126 E127W69-L123 HydrophobicContact CH2-CD2 4.41Å; F73-L123 HydrophobicContact CD2-CD1 3.67Å; F73-L123 HydrophobicContact CE2-CD1 3.08Å; F73-L123 HydrophobicContact CZ-CD1 3.79Å; S92-L123 WeakPolarHBondContact O-CD1 3.1Å; G96-L123 VanDerWaalsContact CA-CD1 3.48Å; G119-L123 PolarHBondContact O-N 3.31Å; G119-L123 VanDerWaalsContact O-N 3.16Å; I121-L123 PolarHBondContact O-N 2.77Å; L123-L125 PolarHBondContact O-N 2.89Å; L123-I126 HydrophobicContact CD2-CD1 3.8Å; L123-I126 PolarHBondContact O-N 3.47Å; L123-E127 WeakPolarHBondContact O-CB 3.42Å; L123-E127 WeakPolarHBondContact O-CG 3.25Å; L123-E127 PolarHBondContact O-N 3.31Å
124A92.5Very high91.4Very high39 Ų3966 Ų6632%0.32239%0.387SS..Hα-helixtrans-60.3-38.1170.200000111.6I93 G120 I121 G128I93-A124 HydrophobicContact CD1-CB 3.89Å; I93-A124 HydrophobicContact CG1-CB 4Å; I93-A124 HydrophobicContact CG2-CB 4.47Å; G120-A124 VanDerWaalsContact O-CB 3.25Å; G120-A124 WeakPolarHBondContact O-CB 3.31Å; G120-A124 PolarHBondContact O-N 2.92Å; I121-A124 PolarHBondContact O-N 3.03Å; A124-G128 WeakPolarHBondContact O-CA 3.26Å; A124-G128 PolarHBondContact O-N 3.49Å
125L92.5Very high90.8Very high110 Ų11072.9 Ų72.958%0.57640%0.402SS*.Hα-helixtrans-69-43.5174.3-68.2173.1000112I121 L122 L123 G128 V129I121-L125 HydrophobicContact CG2-CD1 4.21Å; I121-L125 WeakPolarHBondContact O-CG 3.39Å; I121-L125 PolarHBondContact O-N 3.26Å; L122-L125 PolarHBondContact O-N 3.45Å; L123-L125 PolarHBondContact O-N 2.89Å; L125-G128 PolarHBondContact O-N 3.32Å; L125-V129 WeakPolarHBondContact O-CB 3.25Å; L125-V129 VanDerWaalsContact O-CG2 3.29Å; L125-V129 WeakPolarHBondContact O-CG2 3.31Å; L125-V129 PolarHBondContact O-N 3.45Å
126I91.3Very high90.3Very high96 Ų9678.5 Ų78.549%0.49242%0.419SS..Hα-helixtrans-62.5-49.6179.4-67.3178.1000110.9L122 L123 G128 V129 G130L122-I126 HydrophobicContact CG-CD1 4.38Å; L122-I126 WeakPolarHBondContact O-CG1 3.34Å; L122-I126 PolarHBondContact O-N 2.91Å; L123-I126 HydrophobicContact CD2-CD1 3.8Å; L123-I126 PolarHBondContact O-N 3.47Å; I126-G128 VanDerWaalsContact C-N 3.35Å; I126-G128 PolarHBondContact O-N 3.02Å; I126-V129 PolarHBondContact O-N 3.09Å; I126-G130 PolarHBondContact O-N 3.41Å
127E88.9Confident89.8Confident61 Ų6180.6 Ų80.629%0.28543%0.43SS..Hα-helixtrans-64.9-39.7177-67.4-65.5166.900111.5P89 S92 L123 V129 G130 I131P89-E127 HydrophobicContact CB-CB 4.44Å; S92-E127 WeakPolarHBondContact CB-OE1 3.47Å; S92-E127 PolarHBondContact OG-OE1 3.14Å; L123-E127 WeakPolarHBondContact O-CB 3.42Å; L123-E127 WeakPolarHBondContact O-CG 3.25Å; L123-E127 PolarHBondContact O-N 3.31Å; E127-V129 PolarHBondContact O-N 2.94Å; E127-G130 PolarHBondContact O-N 2.92Å; E127-I131 WeakPolarHBondContact O-CG1 3.38Å; E127-I131 PolarHBondContact O-N 2.92Å
128G88.1Confident88.8Confident38 Ų3877.9 Ų77.939%0.39243%0.426SS..Hα-helixtrans-60.5-42.8176.300000112.9A124 L125 I126 L132A124-G128 WeakPolarHBondContact O-CA 3.26Å; A124-G128 PolarHBondContact O-N 3.49Å; L125-G128 PolarHBondContact O-N 3.32Å; I126-G128 VanDerWaalsContact C-N 3.35Å; I126-G128 PolarHBondContact O-N 3.02Å; G128-L132 PolarHBondContact O-N 2.89Å; G128-L132 VanDerWaalsContact O-N 3.09Å
129V91.1Very high87.7Confident77 Ų7777.4 Ų77.447%0.46742%0.422SS..Hα-helixtrans-68-40173.8173.10000110.8L125 I126 E127 I131 L132 L133L125-V129 WeakPolarHBondContact O-CB 3.25Å; L125-V129 VanDerWaalsContact O-CG2 3.29Å; L125-V129 WeakPolarHBondContact O-CG2 3.31Å; L125-V129 PolarHBondContact O-N 3.45Å; I126-V129 PolarHBondContact O-N 3.09Å; E127-V129 PolarHBondContact O-N 2.94Å; V129-I131 PolarHBondContact O-N 3.37Å; V129-L132 PolarHBondContact O-N 3.39Å; V129-L133 HydrophobicContact CG1-CD1 3.85Å; V129-L133 HydrophobicContact CG1-CG 4.13Å; V129-L133 WeakPolarHBondContact O-CB 3.2Å; V129-L133 WeakPolarHBondContact O-CG 3.47Å; V129-L133 PolarHBondContact O-N 3Å
130G87Confident86.5Confident31 Ų3182.9 Ų82.932%0.3245%0.445SS..Hα-helixtrans-58-45.3175.600000112.6I126 E127 T134I126-G130 PolarHBondContact O-N 3.41Å; E127-G130 PolarHBondContact O-N 2.92Å; G130-T134 WeakPolarHBondContact O-CB 3.41Å; G130-T134 PolarHBondContact O-N 2.96Å; G130-T134 PolarHBondContact O-OG1 3.41Å
131I88Confident85Confident78 Ų7890.3 Ų90.340%0.448%0.475SS..Hα-helixtrans-62.9-43.6175-66.5166.6000110.6P89 E127 V129 T134 R135P89-I131 HydrophobicContact CG-CD1 4.14Å; E127-I131 WeakPolarHBondContact O-CG1 3.38Å; E127-I131 PolarHBondContact O-N 2.92Å; V129-I131 PolarHBondContact O-N 3.37Å; I131-T134 PolarHBondContact O-N 2.88Å; I131-R135 WeakPolarHBondContact O-CG 3.37Å; I131-R135 PolarHBondContact O-N 2.89Å
132L87.6Confident83.3Confident119 Ų11995.7 Ų95.762%0.62349%0.488SS*.Hα-helixtrans-62.8-47.5179.7-178.663.1000112.1G128 V129 T134 R135 Y136G128-L132 PolarHBondContact O-N 2.89Å; G128-L132 VanDerWaalsContact O-N 3.09Å; V129-L132 PolarHBondContact O-N 3.39Å; L132-T134 VanDerWaalsContact C-N 3.34Å; L132-T134 PolarHBondContact O-N 2.82Å; L132-R135 PolarHBondContact O-N 3.43Å; L132-Y136 WeakPolarHBondContact O-CB 3.35Å; L132-Y136 PolarHBondContact O-N 3.48Å
133L87.3Confident81.5Confident103 Ų10398 Ų9854%0.53950%0.501SS..Hα-helixtrans-63.3-41.3177.9-70.6174.8000111.6V129 R135 Y136 T137V129-L133 HydrophobicContact CG1-CD1 3.85Å; V129-L133 HydrophobicContact CG1-CG 4.13Å; V129-L133 WeakPolarHBondContact O-CB 3.2Å; V129-L133 WeakPolarHBondContact O-CG 3.47Å; V129-L133 PolarHBondContact O-N 3Å; L133-R135 VanDerWaalsContact C-N 3.32Å; L133-R135 PolarHBondContact O-N 3.48Å; L133-Y136 PolarHBondContact O-N 3.09Å; L133-T137 WeakPolarHBondContact O-CB 3.29Å; L133-T137 WeakPolarHBondContact O-CG2 3.47Å; L133-T137 PolarHBondContact O-N 2.98Å; L133-T137 PolarHBondContact O-OG1 2.99Å
134T86Confident79.6Confident91 Ų91100.7 Ų100.756%0.55853%0.525SS*.Hα-helixtrans-62.4-41.4175.9-55.90000111G130 I131 L132 T137 A138G130-T134 WeakPolarHBondContact O-CB 3.41Å; G130-T134 PolarHBondContact O-N 2.96Å; G130-T134 PolarHBondContact O-OG1 3.41Å; I131-T134 PolarHBondContact O-N 2.88Å; L132-T134 VanDerWaalsContact C-N 3.34Å; L132-T134 PolarHBondContact O-N 2.82Å; T134-T137 WeakPolarHBondContact CA-OG1 3.33Å; T134-T137 PolarHBondContact O-OG1 3.12Å; T134-A138 WeakPolarHBondContact O-CB 3.47Å; T134-A138 PolarHBondContact O-N 3.27Å
135R84.1Confident77.8Confident179 Ų179103.7 Ų103.768%0.67554%0.541SS*.Hα-helixtrans-67.2-42.2176-74.9-168.5178.9-150.81.7112.7I131 L132 L133 A138 Q139I131-R135 WeakPolarHBondContact O-CG 3.37Å; I131-R135 PolarHBondContact O-N 2.89Å; L132-R135 PolarHBondContact O-N 3.43Å; L133-R135 VanDerWaalsContact C-N 3.32Å; L133-R135 PolarHBondContact O-N 3.48Å; R135-A138 PolarHBondContact O-N 3.47Å; R135-Q139 VanDerWaalsContact O-CG 3.32Å; R135-Q139 WeakPolarHBondContact O-CG 3.23Å; R135-Q139 PolarHBondContact O-N 3.47Å
136Y83.6Confident76.1Confident150 Ų150103.9 Ų103.959%0.58855%0.549SS*.Hα-helixtrans-64.6-45.8179-176.5-99.1000112L132 L133 Q139 Q140L132-Y136 WeakPolarHBondContact O-CB 3.35Å; L132-Y136 PolarHBondContact O-N 3.48Å; L133-Y136 PolarHBondContact O-N 3.09Å; Y136-Q139 WeakPolarHBondContact O-CB 3.35Å; Y136-Q139 PolarHBondContact O-N 3.06Å; Y136-Q140 PolarHBondContact O-N 3.45Å
137T83.2Confident74.3Confident65 Ų65108.5 Ų108.540%0.39957%0.566SS.*Hα-helixtrans-65.3-4017652.50000111.9L133 T134 Q139 Q140 F141L133-T137 WeakPolarHBondContact O-CB 3.29Å; L133-T137 WeakPolarHBondContact O-CG2 3.47Å; L133-T137 PolarHBondContact O-N 2.98Å; L133-T137 PolarHBondContact O-OG1 2.99Å; T134-T137 WeakPolarHBondContact CA-OG1 3.33Å; T134-T137 PolarHBondContact O-OG1 3.12Å; T137-Q139 VanDerWaalsContact C-N 3.3Å; T137-Q139 PolarHBondContact O-N 3.25Å; T137-Q140 VanDerWaalsContact O-CB 3.27Å; T137-Q140 WeakPolarHBondContact O-CB 3.28Å; T137-Q140 PolarHBondContact O-N 2.99Å; T137-Q140 VanDerWaalsContact O-N 3.07Å; T137-F141 VanDerWaalsContact O-CD2 3.23Å; T137-F141 WeakPolarHBondContact O-CD2 3.22Å; T137-F141 PolarHBondContact O-N 2.89Å
138A76.1Confident72.5Confident55 Ų55113.3 Ų113.346%0.45559%0.592SS.*Hα-helixtrans-62.5-35.3174.400000112.6T134 R135 Q140 F141 R142T134-A138 WeakPolarHBondContact O-CB 3.47Å; T134-A138 PolarHBondContact O-N 3.27Å; R135-A138 PolarHBondContact O-N 3.47Å; A138-Q140 VanDerWaalsContact C-N 3.29Å; A138-Q140 PolarHBondContact O-N 3.01Å; A138-F141 PolarHBondContact O-N 2.85Å; A138-R142 WeakPolarHBondContact O-CB 3.38Å; A138-R142 PolarHBondContact O-N 3.41Å; A138-R142 VanDerWaalsContact O-N 3.1Å
139Q70.4Confident70.8Confident119 Ų119120.2 Ų120.256%0.55662%0.615SS**Hα-helixtrans-65.5-33173.1-74.5175.5-4500112.2R135 Y136 T137 F141 R142 N143R135-Q139 VanDerWaalsContact O-CG 3.32Å; R135-Q139 WeakPolarHBondContact O-CG 3.23Å; R135-Q139 PolarHBondContact O-N 3.47Å; Y136-Q139 WeakPolarHBondContact O-CB 3.35Å; Y136-Q139 PolarHBondContact O-N 3.06Å; T137-Q139 VanDerWaalsContact C-N 3.3Å; T137-Q139 PolarHBondContact O-N 3.25Å; Q139-F141 VanDerWaalsContact C-N 3.35Å; Q139-F141 PolarHBondContact O-N 2.76Å; Q139-R142 PolarHBondContact O-N 3.31Å; Q139-N143 PolarHBondContact O-N 2.91Å; Q139-N143 PolarHBondContact O-ND2 2.88Å; Q139-N143 VanDerWaalsContact O-ND2 3.11Å
140Q66.1Low68.7Low124 Ų124121.3 Ų121.358%0.57962%0.618SS**Hα-helixtrans-65.1-37.5177.6-158.3173.8-89.700112.2Y136 T137 A138Y136-Q140 PolarHBondContact O-N 3.45Å; T137-Q140 VanDerWaalsContact O-CB 3.27Å; T137-Q140 WeakPolarHBondContact O-CB 3.28Å; T137-Q140 PolarHBondContact O-N 2.99Å; T137-Q140 VanDerWaalsContact O-N 3.07Å; A138-Q140 VanDerWaalsContact C-N 3.29Å; A138-Q140 PolarHBondContact O-N 3.01Å
141F60.5Low66.9Low165 Ų165124.9 Ų124.972%0.72464%0.635SS**Hα-helixtrans-82-20.9176.1-65.5-68000114T137 A138 Q139 N143T137-F141 VanDerWaalsContact O-CD2 3.23Å; T137-F141 WeakPolarHBondContact O-CD2 3.22Å; T137-F141 PolarHBondContact O-N 2.89Å; A138-F141 PolarHBondContact O-N 2.85Å; Q139-F141 VanDerWaalsContact C-N 3.35Å; Q139-F141 PolarHBondContact O-N 2.76Å; F141-N143 PolarHBondContact O-N 2.94Å
142R60.5Low65.3Low219 Ų219125.3 Ų125.383%0.82665%0.645SS**Hα-helixtrans-76.8-11.7177.2-155.9168-175.1153.80.7113.4A138 Q139A138-R142 WeakPolarHBondContact O-CB 3.38Å; A138-R142 PolarHBondContact O-N 3.41Å; A138-R142 VanDerWaalsContact O-N 3.1Å; Q139-R142 PolarHBondContact O-N 3.31Å
143N54.2Low63.4Low128 Ų128128 Ų12868%0.68465%0.654SS**THydrogen-bonded Turntrans-106.111.2-177-68.4-30.8000114.5Q139 F141 P145Q139-N143 PolarHBondContact O-N 2.91Å; Q139-N143 PolarHBondContact O-ND2 2.88Å; Q139-N143 VanDerWaalsContact O-ND2 3.11Å; F141-N143 PolarHBondContact O-N 2.94Å; N143-P145 WeakPolarHBondContact O-CD 3.25Å
144A53Low61.4Low67 Ų67129.9 Ų129.955%0.55466%0.664SS**SBendtrans-67.3112.9158.600000106.1
145P53.7Low59.5Low102 Ų102130.7 Ų130.766%0.66267%0.672SS**  trans-54.8135.2173.823.6-31.1000106.7N143 F147N143-P145 WeakPolarHBondContact O-CD 3.25Å; P145-F147 PolarHBondContact O-N 3.48Å
146P56.8Low57.4Low115 Ų115127.9 Ų127.975%0.74768%0.676SS**  trans-50123.2167.721.6-29.7000105.5L148P146-L148 PolarHBondContact O-N 2.77Å
147F54.2Low55.6Low192 Ų192130.9 Ų130.984%0.84269%0.693SS**  trans-44.9116.1168.2-53.6-87000104.7P145 E149P145-F147 PolarHBondContact O-N 3.48Å; F147-E149 PolarHBondContact O-N 2.92Å
148L51.7Low53.4Low162 Ų162135.1 Ų135.185%0.84871%0.713SS**  trans-56.198.6179.1-158.290.3000104.4P146 D150P146-L148 PolarHBondContact O-N 2.77Å; L148-D150 PolarHBondContact O-N 3.44Å
149E51.4Low51.9Low184 Ų184135.9 Ų135.986%0.8673%0.726SS**  trans-61.896.3169.4-108163.3114.400103.9F147 P151F147-E149 PolarHBondContact O-N 2.92Å; E149-P151 WeakPolarHBondContact O-CD 3.31Å; E149-P151 VanDerWaalsContact O-N 3.09Å
150D47.6Very low50.1Low99 Ų99137 Ų13753%0.52974%0.741SS.*  trans-55.5114.4176-170.6-21.6000106.3L148 S152 Q153L148-D150 PolarHBondContact O-N 3.44Å; D150-S152 PolarHBondContact O-N 3.11Å; D150-S152 WeakPolarHBondContact OD1-CB 3.42Å; D150-S152 PolarHBondContact OD1-N 3.25Å; D150-S152 PolarHBondContact OD1-OG 3.33Å; D150-S152 PolarHBondContact OD2-OG 3.48Å; D150-Q153 PolarHBondContact O-N 2.97Å
151P49.8Very low48.8Very low107 Ų107136.9 Ų136.970%0.69575%0.751SS**G310 helixtrans-59-5.1-175.6-23.633.3000114.2E149E149-P151 WeakPolarHBondContact O-CD 3.31Å; E149-P151 VanDerWaalsContact O-N 3.09Å
152S53.1Low47.8Very low87 Ų87133.4 Ų133.461%0.60875%0.753SS**G310 helixtrans-79.4-7.8178.8580000115.2D150D150-S152 PolarHBondContact O-N 3.11Å; D150-S152 WeakPolarHBondContact OD1-CB 3.42Å; D150-S152 PolarHBondContact OD1-N 3.25Å; D150-S152 PolarHBondContact OD1-OG 3.33Å; D150-S152 PolarHBondContact OD2-OG 3.48Å
153Q47.6Very low46.7Very low174 Ų174128.8 Ų128.881%0.81375%0.751SS**G310 helixtrans-96.68.3179.4-66.9-158.3-28.300115.6D150 P155D150-Q153 PolarHBondContact O-N 2.97Å; Q153-P155 WeakPolarHBondContact O-CD 3.45Å
154L46.6Very low45.8Very low143 Ų143126.2 Ų126.275%0.74975%0.754SS**PPolyproline II helixtrans-77.1122.8174-75160.1000110.6
155P46Very low44.8Very low109 Ų109133.9 Ų133.971%0.70877%0.771SS**PPolyproline II helixtrans-63.9149.8170.625.6-30.9000110.4Q153 K157Q153-P155 WeakPolarHBondContact O-CD 3.45Å; P155-K157 PolarHBondContact O-N 3.31Å
156P39.5Very low44Very low120 Ų120133.9 Ų133.978%0.77977%0.771SS**PPolyproline II helixtrans-58.3136.6-173.5-20.330.7000112.2D158P156-D158 PolarHBondContact O-N 2.95Å
157K45.4Very low43.2Very low213 Ų213133.7 Ų133.793%0.92677%0.772SS**  trans-68.493.5170.2-87.5-177.1170.1171.40109.7P155P155-K157 PolarHBondContact O-N 3.31Å
158D37.9Very low42.3Very low154 Ų154135 Ų13582%0.82477%0.773SS**  trans-103.9129.9155.1-82.5-39.5000109.6P156P156-D158 PolarHBondContact O-N 2.95Å
159G44.4Very low41.6Very low70 Ų70134.2 Ų134.272%0.72277%0.765SS**  trans-72.5149.2-159.500000115.8
160T32.8Very low40.9Very low142 Ų142134.4 Ų134.487%0.87177%0.766SS**  trans178.4154.914423.80000109.2
161P37.1Very low40.2Very low122 Ų122138.6 Ų138.679%0.79278%0.775SS**PPolyproline II helixtrans-77.9144.5-14728.7-33.7000115.1
162A40.7Very low39.7Very low93 Ų93145.7 Ų145.777%0.76980%0.799SS**PPolyproline II helixtrans-67.3134.3175.900000112.2
163P36.8Very low39Very low122 Ų122148.6 Ų148.679%0.79281%0.808SS**PPolyproline II helixtrans-70.2128.2165.1-10.125.8000109.5
164G35.1Very low38.6Very low73 Ų73147.3 Ų147.375%0.75381%0.808SS**PPolyproline II helixtrans-61.4143.5-173.800000114.7
165Y32.8Very low38.1Very low229 Ų229147.5 Ų147.590%0.89881%0.811SS**PPolyproline II helixtrans-81.4126.8162.6-85.5-92.9000109.5S167Y165-S167 PolarHBondContact O-N 3.36Å
166P37.6Very low37.7Very low102 Ų102149.8 Ų149.866%0.66282%0.817SS**PPolyproline II helixtrans-74.9118.7167.1-7.523.4000109.9Y168P166-Y168 HydrophobicContact CB-CE2 4.32Å; P166-Y168 PolarHBondContact O-N 2.98Å
167S38.3Very low37.6Very low110 Ų110151.6 Ų151.677%0.76982%0.82SS**PPolyproline II helixtrans-59.2119.1162.847.60000110.1Y165Y165-S167 PolarHBondContact O-N 3.36Å
168Y36.8Very low37Very low220 Ų220147.5 Ų147.586%0.86381%0.813SS**  trans-94.9113169.7-92.8-84.5000111.4P166P166-Y168 HydrophobicContact CB-CE2 4.32Å; P166-Y168 PolarHBondContact O-N 2.98Å
169Q36.7Very low37Very low146 Ų146147.1 Ų147.168%0.68281%0.812SS**  trans-56.1131.6172.8-92.5158.4-60.700113.2Y171Q169-Y171 HydrophobicContact CB-CD2 4.17Å; Q169-Y171 HydrophobicContact CB-CE2 4.27Å
170Q35.7Very low36.4Very low188 Ų188153 Ų15388%0.87982%0.819SS**  trans-36.4122.7143.1-177.4172.1-1600112.9
171Y34Very low36.7Very low186 Ų186153.9 Ų153.973%0.72981%0.814SS**  trans-145150.4159.5-94.9-80.5000111.7Q169Q169-Y171 HydrophobicContact CB-CD2 4.17Å; Q169-Y171 HydrophobicContact CB-CE2 4.27Å
172H39.3Very low36.7Very low256 Ų256156.8 Ų156.8100%1.18582%0.816SS**  trans-54.50-168.2-70.7-95.7000117.2

Retrieved 172 of 172 residues in 68.3 ms (Link to these results)