A0A087WZ36_HUMAN Loading...

Zinc finger protein 658

AlphaFold DB , UniProt , Accession A0A087WZ36, Species HUMAN (Homo sapiens, Human), Gene ZNF658, Length 97 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
1M39.8Very low66.6Low235 Ų235116.6 Ų116.6100%1.15865%0.652SS**  0113.50-72.8169.7174.100106.7M3M1-M3 PolarHBondContact O-N 2.79Å
2N52.8Low68.1Low164 Ų164116.2 Ų116.288%0.87765%0.647SS**  trans-75.1106177.6-162.314.4000107.2S4N2-S4 VanDerWaalsContact C-N 3.32Å; N2-S4 PolarHBondContact O-N 2.83Å
3M51.6Low69.4Low156 Ų156111.2 Ų111.277%0.76862%0.622SS**  trans-73.389.2176.6-71.2169.761.800107.7M1 Q5M1-M3 PolarHBondContact O-N 2.79Å; M3-Q5 PolarHBondContact O-N 3.29Å
4S61.7Low70.6Confident113 Ų113105.2 Ų105.279%0.7959%0.589SS**  trans-62.192.6160.548.60000107.3N2 A6N2-S4 VanDerWaalsContact C-N 3.32Å; N2-S4 PolarHBondContact O-N 2.83Å; S4-A6 PolarHBondContact O-N 3.3Å
5Q65.1Low71.7Confident157 Ų157103.1 Ų103.173%0.73458%0.579SS**  trans-61.8105.2169.2-82.1-177.9-61.700106.8M3 S7M3-Q5 PolarHBondContact O-N 3.29Å; Q5-S7 PolarHBondContact O-N 3.2Å
6A67Low72.6Confident83 Ų83105.8 Ų105.869%0.68659%0.586SS**PPolyproline II helixtrans-58.3122.116800000107.7S4S4-A6 PolarHBondContact O-N 3.3Å
7S71.4Confident73.4Confident101 Ų101103.3 Ų103.371%0.70657%0.568SS**PPolyproline II helixtrans-80.4119.6174.255.60000108.6Q5Q5-S7 PolarHBondContact O-N 3.2Å
8V78.1Confident74.1Confident56 Ų56101.4 Ų101.434%0.33956%0.56SS.*PPolyproline II helixtrans-83.2130.7170.5-1800000108.1D12 V13 L44V8-D12 HydrophobicContact CG1-CB 4.19Å; V8-V13 HydrophobicContact CG1-CG1 4Å; V8-L44 HydrophobicContact CG1-CD2 4.01Å
9S79.8Confident74.6Confident45 Ų45100.8 Ų100.832%0.31555%0.548SS..PPolyproline II helixtrans-103.4168.5174.8780000111.2Q11 D12S9-Q11 PolarHBondContact O-N 2.89Å; S9-Q11 PolarHBondContact OG-N 3.26Å; S9-D12 WeakPolarHBondContact CA-OD2 3.48Å; S9-D12 VanDerWaalsContact CB-OD2 3.31Å; S9-D12 WeakPolarHBondContact CB-OD2 3.45Å; S9-D12 PolarHBondContact N-OD2 3.15Å; S9-D12 PolarHBondContact O-N 3.02Å; S9-D12 PolarHBondContact OG-OD2 2.98Å
10F81.9Confident75.3Confident28 Ų28101.5 Ų101.512%0.12355%0.548CS..G310 helixtrans-60.8-35.9174.6-175.9-113.2000112.1D12 V13 T14 L44 P54 V56 I57F10-D12 PolarHBondContact O-N 3.12Å; F10-V13 HydrophobicContact CD2-CG2 4.49Å; F10-V13 WeakPolarHBondContact O-CG2 3.47Å; F10-V13 PolarHBondContact O-N 2.79Å; F10-T14 HydrophobicContact CD1-CG2 3.48Å; F10-T14 VanDerWaalsContact CD1-CG2 3.48Å; F10-T14 HydrophobicContact CD2-CG2 3.85Å; F10-T14 HydrophobicContact CE1-CG2 3.17Å; F10-T14 HydrophobicContact CE2-CG2 3.58Å; F10-T14 HydrophobicContact CG-CG2 3.81Å; F10-T14 HydrophobicContact CZ-CG2 3.22Å; F10-T14 WeakPolarHBondContact O-CG2 3.19Å; F10-T14 PolarHBondContact O-N 3.07Å; F10-T14 PolarHBondContact O-OG1 2.9Å; F10-L44 HydrophobicContact CB-CD1 3.97Å; F10-L44 HydrophobicContact CD2-CD1 3.81Å; F10-L44 HydrophobicContact CG-CD1 4.39Å; F10-P54 HydrophobicContact CB-CG 4.26Å; F10-P54 HydrophobicContact CD1-CB 3.88Å; F10-P54 HydrophobicContact CD1-CG 3.45Å; F10-P54 VanDerWaalsContact CD1-CG 3.45Å; F10-P54 HydrophobicContact CD2-CG 4.32Å; F10-P54 HydrophobicContact CE1-CB 3.89Å; F10-P54 HydrophobicContact CE1-CG 3.78Å; F10-P54 HydrophobicContact CG-CG 3.75Å; F10-P54 HydrophobicContact CZ-CG 4.36Å; F10-V56 HydrophobicContact CE1-CG1 3.64Å; F10-V56 HydrophobicContact CZ-CG1 4.23Å; F10-I57 HydrophobicContact CE1-CD1 4.4Å; F10-I57 HydrophobicContact CE1-CG1 4.12Å; F10-I57 HydrophobicContact CE2-CD1 3.83Å; F10-I57 HydrophobicContact CE2-CG1 4.01Å; F10-I57 HydrophobicContact CZ-CD1 3.44Å; F10-I57 VanDerWaalsContact CZ-CD1 3.44Å; F10-I57 HydrophobicContact CZ-CG1 3.57Å
11Q83.1Confident76Confident145 Ų145101.5 Ų101.568%0.67854%0.544SS*.G310 helixtrans-63.1-29.8178.8-73.4178.1-26.200113S9 V13 T14S9-Q11 PolarHBondContact O-N 2.89Å; S9-Q11 PolarHBondContact OG-N 3.26Å; Q11-V13 PolarHBondContact O-N 3.12Å; Q11-T14 WeakPolarHBondContact CA-OG1 3.39Å; Q11-T14 PolarHBondContact O-OG1 3.37Å
12D84.9Confident78.3Confident111 Ų11190.7 Ų90.759%0.59449%0.491SS*.G310 helixtrans-72.1-15.8-179.1-58.2-58.3000113.1V8 S9 F10V8-D12 HydrophobicContact CG1-CB 4.19Å; S9-D12 WeakPolarHBondContact CA-OD2 3.48Å; S9-D12 VanDerWaalsContact CB-OD2 3.31Å; S9-D12 WeakPolarHBondContact CB-OD2 3.45Å; S9-D12 PolarHBondContact N-OD2 3.15Å; S9-D12 PolarHBondContact O-N 3.02Å; S9-D12 PolarHBondContact OG-OD2 2.98Å; F10-D12 PolarHBondContact O-N 3.12Å
13V85.6Confident80.1Confident52 Ų5288.7 Ų88.732%0.31548%0.476SS..G310 helixtrans-122.35.7-176.7-58.20000112.9V8 F10 Q11 N40 L44V8-V13 HydrophobicContact CG1-CG1 4Å; F10-V13 HydrophobicContact CD2-CG2 4.49Å; F10-V13 WeakPolarHBondContact O-CG2 3.47Å; F10-V13 PolarHBondContact O-N 2.79Å; Q11-V13 PolarHBondContact O-N 3.12Å; V13-N40 HydrophobicContact CG2-CB 4.24Å; V13-N40 PolarHBondContact O-ND2 2.73Å; V13-L44 HydrophobicContact CG2-CD1 3.69Å; V13-L44 HydrophobicContact CG2-CD2 4.34Å; V13-L44 HydrophobicContact CG2-CG 4.15Å
14T86.4Confident82.1Confident27 Ų2788.9 Ų88.917%0.16647%0.474CS..  trans-96.3146.1178.750.10000111.9F10 Q11 M37F10-T14 HydrophobicContact CD1-CG2 3.48Å; F10-T14 VanDerWaalsContact CD1-CG2 3.48Å; F10-T14 HydrophobicContact CD2-CG2 3.85Å; F10-T14 HydrophobicContact CE1-CG2 3.17Å; F10-T14 HydrophobicContact CE2-CG2 3.58Å; F10-T14 HydrophobicContact CG-CG2 3.81Å; F10-T14 HydrophobicContact CZ-CG2 3.22Å; F10-T14 WeakPolarHBondContact O-CG2 3.19Å; F10-T14 PolarHBondContact O-N 3.07Å; F10-T14 PolarHBondContact O-OG1 2.9Å; Q11-T14 WeakPolarHBondContact CA-OG1 3.39Å; Q11-T14 PolarHBondContact O-OG1 3.37Å; T14-M37 HydrophobicContact CG2-SD 3.79Å
15V86.7Confident83.5Confident73 Ų7384.6 Ų84.644%0.44244%0.442SS..  trans-89.5128.1162.1-178.50000106.8F17 Y33 M37V15-F17 HydrophobicContact CG1-CD2 4.22Å; V15-F17 HydrophobicContact CG1-CE1 4.44Å; V15-F17 HydrophobicContact CG1-CE2 3.74Å; V15-F17 HydrophobicContact CG1-CZ 3.86Å; V15-Y33 VanDerWaalsContact O-CE2 3.28Å; V15-Y33 WeakPolarHBondContact O-CE2 3.37Å; V15-M37 HydrophobicContact CB-CE 3.94Å; V15-M37 HydrophobicContact CG2-CE 4.08Å; V15-M37 VanDerWaalsContact N-CE 3.34Å
16E85.3Confident84.9Confident147 Ų14778.2 Ų78.269%0.68742%0.419SS*.  trans-105.7125.2172.9-68.7-170.3148.900108.5
17F86.3Confident86.2Confident63 Ų6379.4 Ų79.428%0.27642%0.42SS..  trans-103.8140.8167.8-69.4-74000108.3V15 E21 W22 L25 Y33 W67V15-F17 HydrophobicContact CG1-CD2 4.22Å; V15-F17 HydrophobicContact CG1-CE1 4.44Å; V15-F17 HydrophobicContact CG1-CE2 3.74Å; V15-F17 HydrophobicContact CG1-CZ 3.86Å; F17-E21 HydrophobicContact CB-CB 4.32Å; F17-E21 HydrophobicContact CD1-CB 4.04Å; F17-W22 HydrophobicContact CB-CB 4.47Å; F17-W22 HydrophobicContact CB-CE3 4.39Å; F17-W22 HydrophobicContact CD2-CE3 4.07Å; F17-W22 HydrophobicContact CD2-CZ3 4.27Å; F17-W22 HydrophobicContact CG-CE3 4.46Å; F17-L25 HydrophobicContact CD1-CD1 4.23Å; F17-L25 HydrophobicContact CD2-CD1 3.92Å; F17-L25 HydrophobicContact CE1-CD1 4.15Å; F17-L25 HydrophobicContact CE1-CD2 4.19Å; F17-L25 HydrophobicContact CE2-CD1 3.83Å; F17-L25 HydrophobicContact CG-CD1 4.12Å; F17-L25 HydrophobicContact CZ-CD1 3.95Å; F17-L25 HydrophobicContact CZ-CD2 4.35Å; F17-Y33 AromaticContact CD2-CD2 3.75Å; F17-Y33 HydrophobicContact CD2-CD2 3.75Å; F17-Y33 AromaticContact CD2-CE2 3.8Å; F17-Y33 HydrophobicContact CD2-CE2 3.8Å; F17-Y33 AromaticContact CE2-CD2 3.57Å; F17-Y33 HydrophobicContact CE2-CD2 3.57Å; F17-Y33 HydrophobicContact CE2-CE2 4.03Å; F17-Y33 HydrophobicContact CE2-CG 4.41Å; F17-W67 HydrophobicContact CB-CH2 4.34Å; F17-W67 VanDerWaalsContact O-CZ3 3.32Å; F17-W67 WeakPolarHBondContact O-CZ3 3.34Å
18T86.6Confident87.3Confident69 Ų6980.2 Ų80.242%0.42342%0.42SS..  trans-66162.8161.859.50000110.1E20 E21 W22T18-E20 PolarHBondContact O-N 3.05Å; T18-E21 WeakPolarHBondContact CB-OE2 3.47Å; T18-E21 WeakPolarHBondContact CG2-OE2 3.4Å; T18-E21 PolarHBondContact N-OE2 3.28Å; T18-E21 PolarHBondContact O-N 3.48Å; T18-E21 WeakPolarHBondContact OG1-CB 3.47Å; T18-E21 WeakPolarHBondContact OG1-CG 3.33Å; T18-E21 PolarHBondContact OG1-N 3.18Å; T18-E21 VanDerWaalsContact OG1-N 3.14Å; T18-E21 PolarHBondContact OG1-OE2 3.07Å; T18-W22 WeakPolarHBondContact O-CB 3.47Å; T18-W22 PolarHBondContact O-N 3.29Å
19R84.2Confident88.1Confident91 Ų9182.4 Ų82.434%0.34343%0.427SS..Hα-helixtrans-60.4-39.7177.1-174.1-176.3-172.3164.96110.8W22 Q23 W67 E72R19-W22 PolarHBondContact O-N 3.04Å; R19-Q23 WeakPolarHBondContact O-CG 3.45Å; R19-Q23 PolarHBondContact O-N 2.9Å; R19-W67 HydrophobicContact CG-CG 4.49Å; R19-E72 IonicContact CZ-OE2 3.82Å; R19-E72 VanDerWaalsContact NH1-CD 3.33Å; R19-E72 IonicContact NH1-OE1 3.68Å; R19-E72 PolarHBondContact NH1-OE1 3.1Å; R19-E72 VanDerWaalsContact NH1-OE1 3.15Å; R19-E72 IonicContact NH1-OE2 2.8Å; R19-E72 PolarHBondContact NH1-OE2 2.87Å
20E87.7Confident88.8Confident114 Ų11483.8 Ų83.853%0.53343%0.425SS..Hα-helixtrans-64.1-50.5178.1-64.267.1-146.700109.9T18 W22 Q23 H24T18-E20 PolarHBondContact O-N 3.05Å; E20-W22 VanDerWaalsContact C-N 3.31Å; E20-W22 PolarHBondContact O-N 3.46Å; E20-Q23 WeakPolarHBondContact O-CB 3.45Å; E20-Q23 PolarHBondContact O-N 2.84Å; E20-H24 PolarHBondContact O-N 3.04Å; E20-H24 PolarHBondContact O-ND1 3.36Å
21E89.3Confident89.4Confident101 Ų10186.1 Ų86.147%0.47244%0.442SS..Hα-helixtrans-59.8-42176.7-72.7162.7147.600111.9F17 T18 Q23 H24 L25F17-E21 HydrophobicContact CB-CB 4.32Å; F17-E21 HydrophobicContact CD1-CB 4.04Å; T18-E21 WeakPolarHBondContact CB-OE2 3.47Å; T18-E21 WeakPolarHBondContact CG2-OE2 3.4Å; T18-E21 PolarHBondContact N-OE2 3.28Å; T18-E21 PolarHBondContact O-N 3.48Å; T18-E21 WeakPolarHBondContact OG1-CB 3.47Å; T18-E21 WeakPolarHBondContact OG1-CG 3.33Å; T18-E21 PolarHBondContact OG1-N 3.18Å; T18-E21 VanDerWaalsContact OG1-N 3.14Å; T18-E21 PolarHBondContact OG1-OE2 3.07Å; E21-Q23 VanDerWaalsContact C-N 3.3Å; E21-Q23 PolarHBondContact O-N 3.26Å; E21-H24 WeakPolarHBondContact O-CB 3.48Å; E21-H24 PolarHBondContact O-N 3.37Å; E21-L25 PolarHBondContact O-N 3.37Å
22W89.8Confident89.9Confident9 Ų984.3 Ų84.33%0.03444%0.436CS..Hα-helixtrans-60.9-38.7177-176.6-101.6000113.5F17 T18 R19 E20 H24 L25 R30 Y33 P66 W67F17-W22 HydrophobicContact CB-CB 4.47Å; F17-W22 HydrophobicContact CB-CE3 4.39Å; F17-W22 HydrophobicContact CD2-CE3 4.07Å; F17-W22 HydrophobicContact CD2-CZ3 4.27Å; F17-W22 HydrophobicContact CG-CE3 4.46Å; T18-W22 WeakPolarHBondContact O-CB 3.47Å; T18-W22 PolarHBondContact O-N 3.29Å; R19-W22 PolarHBondContact O-N 3.04Å; E20-W22 VanDerWaalsContact C-N 3.31Å; E20-W22 PolarHBondContact O-N 3.46Å; W22-H24 PolarHBondContact O-N 3.36Å; W22-L25 HydrophobicContact CD2-CD1 4.07Å; W22-L25 HydrophobicContact CE3-CD1 3.44Å; W22-L25 VanDerWaalsContact CE3-CD1 3.44Å; W22-L25 HydrophobicContact CZ3-CD1 3.91Å; W22-L25 WeakPolarHBondContact O-CB 3.47Å; W22-L25 PolarHBondContact O-N 3.32Å; W22-L25 VanDerWaalsContact O-N 3.07Å; W22-R30 HydrophobicContact CD2-CG 4.26Å; W22-R30 HydrophobicContact CH2-CB 4.02Å; W22-R30 HydrophobicContact CH2-CG 3.95Å; W22-R30 HydrophobicContact CZ2-CB 3.89Å; W22-R30 HydrophobicContact CZ2-CG 3.59Å; W22-R30 HydrophobicContact CZ3-CG 4.45Å; W22-R30 PolarHBondContact O-NE 3.44Å; W22-R30 PolarHBondContact O-NH2 2.98Å; W22-Y33 AromaticContact CH2-CD1 3.41Å; W22-Y33 HydrophobicContact CH2-CD1 3.41Å; W22-Y33 VanDerWaalsContact CH2-CD1 3.41Å; W22-Y33 HydrophobicContact CH2-CE1 4.01Å; W22-Y33 AromaticContact CH2-CG 3.9Å; W22-Y33 HydrophobicContact CH2-CG 3.9Å; W22-Y33 AromaticContact CZ3-CD1 3.36Å; W22-Y33 HydrophobicContact CZ3-CD1 3.36Å; W22-Y33 HydrophobicContact CZ3-CD2 4.11Å; W22-Y33 AromaticContact CZ3-CE1 3.81Å; W22-Y33 HydrophobicContact CZ3-CE1 3.81Å; W22-Y33 HydrophobicContact CZ3-CE2 4.46Å; W22-Y33 AromaticContact CZ3-CG 3.5Å; W22-Y33 HydrophobicContact CZ3-CG 3.5Å; W22-P66 HydrophobicContact CH2-CG 3.96Å; W22-P66 HydrophobicContact CZ2-CG 4.1Å; W22-P66 HydrophobicContact CZ3-CG 4.24Å; W22-W67 HydrophobicContact CB-CH2 3.55Å; W22-W67 HydrophobicContact CB-CZ2 3.3Å; W22-W67 HydrophobicContact CB-CZ3 4.41Å; W22-W67 AromaticContact CD1-CE2 3.51Å; W22-W67 AromaticContact CD1-CZ2 3.23Å; W22-W67 AromaticContact CD1-NE1 3.4Å; W22-W67 AromaticContact CD2-CH2 3.48Å; W22-W67 HydrophobicContact CD2-CH2 3.48Å; W22-W67 VanDerWaalsContact CD2-CH2 3.48Å; W22-W67 AromaticContact CD2-CZ2 3.01Å; W22-W67 HydrophobicContact CD2-CZ2 3.01Å; W22-W67 AromaticContact CE2-CZ2 3.4Å; W22-W67 VanDerWaalsContact CE2-CZ2 3.4Å; W22-W67 AromaticContact CE3-CH2 3.41Å; W22-W67 HydrophobicContact CE3-CH2 3.41Å; W22-W67 VanDerWaalsContact CE3-CH2 3.41Å; W22-W67 AromaticContact CE3-CZ2 3.48Å; W22-W67 HydrophobicContact CE3-CZ2 3.48Å; W22-W67 VanDerWaalsContact CE3-CZ2 3.48Å; W22-W67 AromaticContact CG-CE2 3.54Å; W22-W67 AromaticContact CG-CH2 3.53Å; W22-W67 HydrophobicContact CG-CH2 3.53Å; W22-W67 AromaticContact CG-CZ2 2.88Å; W22-W67 HydrophobicContact CG-CZ2 2.88Å; W22-W67 AromaticContact CG-NE1 3.93Å; W22-W67 HydrophobicContact CZ2-CZ2 4.17Å; W22-W67 HydrophobicContact CZ3-CH2 4.13Å; W22-W67 HydrophobicContact CZ3-CZ2 4.23Å; W22-W67 AromaticContact NE1-CE2 3.95Å; W22-W67 AromaticContact NE1-CZ2 3.52Å; W22-W67 AromaticContact NE1-NE1 3.8Å
23Q89.4Confident90.4Very high122 Ų12280 Ų8057%0.5741%0.412SS*.Hα-helixtrans-61.8-28.3176.4-76.8176.6-5.200112.2R19 E20 E21R19-Q23 WeakPolarHBondContact O-CG 3.45Å; R19-Q23 PolarHBondContact O-N 2.9Å; E20-Q23 WeakPolarHBondContact O-CB 3.45Å; E20-Q23 PolarHBondContact O-N 2.84Å; E21-Q23 VanDerWaalsContact C-N 3.3Å; E21-Q23 PolarHBondContact O-N 3.26Å
24H93.1Very high90.8Very high159 Ų15981.8 Ų81.874%0.73641%0.413SS*.Hα-helixtrans-83.3-13.9176.4-65.483.5000113.4E20 E21 W22E20-H24 PolarHBondContact O-N 3.04Å; E20-H24 PolarHBondContact O-ND1 3.36Å; E21-H24 WeakPolarHBondContact O-CB 3.48Å; E21-H24 PolarHBondContact O-N 3.37Å; W22-H24 PolarHBondContact O-N 3.36Å
25L91.6Very high91.2Very high23 Ų2384.7 Ų84.712%0.1243%0.427CS..  trans-70.7133.7176.5-63.5-178.2000111.9F17 E21 W22 E29 R30F17-L25 HydrophobicContact CD1-CD1 4.23Å; F17-L25 HydrophobicContact CD2-CD1 3.92Å; F17-L25 HydrophobicContact CE1-CD1 4.15Å; F17-L25 HydrophobicContact CE1-CD2 4.19Å; F17-L25 HydrophobicContact CE2-CD1 3.83Å; F17-L25 HydrophobicContact CG-CD1 4.12Å; F17-L25 HydrophobicContact CZ-CD1 3.95Å; F17-L25 HydrophobicContact CZ-CD2 4.35Å; E21-L25 PolarHBondContact O-N 3.37Å; W22-L25 HydrophobicContact CD2-CD1 4.07Å; W22-L25 HydrophobicContact CE3-CD1 3.44Å; W22-L25 VanDerWaalsContact CE3-CD1 3.44Å; W22-L25 HydrophobicContact CZ3-CD1 3.91Å; W22-L25 WeakPolarHBondContact O-CB 3.47Å; W22-L25 PolarHBondContact O-N 3.32Å; W22-L25 VanDerWaalsContact O-N 3.07Å; L25-E29 WeakPolarHBondContact CA-OE2 3.44Å; L25-E29 HydrophobicContact CB-CB 4.1Å; L25-E29 HydrophobicContact CD2-CB 4.04Å; L25-E29 HydrophobicContact CG-CB 4.47Å; L25-R30 HydrophobicContact CB-CG 3.86Å; L25-R30 PolarHBondContact O-NE 3.14Å
26G95.1Very high91.5Very high24 Ų2483.5 Ų83.525%0.24742%0.42CS..  trans-72.5166.7171.800000112.9V28 E29 R30G26-V28 PolarHBondContact O-N 3.22Å; G26-E29 PolarHBondContact N-OE2 3.14Å; G26-E29 PolarHBondContact O-N 2.7Å; G26-E29 VanDerWaalsContact O-N 3.12Å; G26-R30 WeakPolarHBondContact O-CG 3.44Å; G26-R30 PolarHBondContact O-N 3.32Å
27P93.6Very high91.8Very high108 Ų10876.6 Ų76.670%0.70139%0.388SS*.Hα-helixtrans-56.1-36.7180-26.234.5000113.9T31P27-T31 WeakPolarHBondContact O-CB 3.37Å; P27-T31 PolarHBondContact O-N 3.34Å; P27-T31 PolarHBondContact O-OG1 2.71Å
28V95.9Very high92.1Very high118 Ų11875.6 Ų75.672%0.71539%0.385SS*.Hα-helixtrans-66.7-44.4178.7176.60000110.8G26 T31 L32G26-V28 PolarHBondContact O-N 3.22Å; V28-T31 PolarHBondContact O-N 3.11Å; V28-L32 WeakPolarHBondContact O-CB 3.45Å; V28-L32 PolarHBondContact O-N 2.93Å
29E94.4Very high92.5Very high101 Ų10177.4 Ų77.447%0.47239%0.389SS..Hα-helixtrans-67.4-39.4179.8-64.3171.2119.800111.5L25 G26 T31 L32 Y33L25-E29 WeakPolarHBondContact CA-OE2 3.44Å; L25-E29 HydrophobicContact CB-CB 4.1Å; L25-E29 HydrophobicContact CD2-CB 4.04Å; L25-E29 HydrophobicContact CG-CB 4.47Å; G26-E29 PolarHBondContact N-OE2 3.14Å; G26-E29 PolarHBondContact O-N 2.7Å; G26-E29 VanDerWaalsContact O-N 3.12Å; E29-T31 VanDerWaalsContact C-N 3.32Å; E29-T31 PolarHBondContact O-N 3.05Å; E29-L32 PolarHBondContact O-N 3.3Å; E29-Y33 WeakPolarHBondContact O-CB 3.34Å; E29-Y33 PolarHBondContact O-N 3.37Å
30R93.3Very high92.9Very high75 Ų7575 Ų7528%0.28338%0.383SS..Hα-helixtrans-64.5-37.3174.5-67.3-176.6178.5171.54.9112.5W22 L25 G26 R34 E65W22-R30 HydrophobicContact CD2-CG 4.26Å; W22-R30 HydrophobicContact CH2-CB 4.02Å; W22-R30 HydrophobicContact CH2-CG 3.95Å; W22-R30 HydrophobicContact CZ2-CB 3.89Å; W22-R30 HydrophobicContact CZ2-CG 3.59Å; W22-R30 HydrophobicContact CZ3-CG 4.45Å; W22-R30 PolarHBondContact O-NE 3.44Å; W22-R30 PolarHBondContact O-NH2 2.98Å; L25-R30 HydrophobicContact CB-CG 3.86Å; L25-R30 PolarHBondContact O-NE 3.14Å; G26-R30 WeakPolarHBondContact O-CG 3.44Å; G26-R30 PolarHBondContact O-N 3.32Å; R30-R34 PolarHBondContact O-N 3.01Å; R30-R34 VanDerWaalsContact O-N 3.1Å; R30-E65 IonicContact NH1-OE1 2.71Å
31T94.4Very high93Very high77 Ų7770.9 Ų70.947%0.47236%0.363SS..Hα-helixtrans-66.1-47.4174.5-56.30000110.3P27 V28 E29 Y33 R34 D35P27-T31 WeakPolarHBondContact O-CB 3.37Å; P27-T31 PolarHBondContact O-N 3.34Å; P27-T31 PolarHBondContact O-OG1 2.71Å; V28-T31 PolarHBondContact O-N 3.11Å; E29-T31 VanDerWaalsContact C-N 3.32Å; E29-T31 PolarHBondContact O-N 3.05Å; T31-Y33 VanDerWaalsContact C-N 3.31Å; T31-Y33 PolarHBondContact O-N 3.26Å; T31-R34 WeakPolarHBondContact O-CB 3.42Å; T31-R34 PolarHBondContact O-N 3.23Å; T31-R34 VanDerWaalsContact O-N 3.12Å; T31-D35 PolarHBondContact O-N 2.88Å
32L95.6Very high93.1Very high107 Ų10769.1 Ų69.156%0.5636%0.361SS*.Hα-helixtrans-59.3-42.8176.9-178.163.5000111.8V28 E29 R34 D35 V36V28-L32 WeakPolarHBondContact O-CB 3.45Å; V28-L32 PolarHBondContact O-N 2.93Å; E29-L32 PolarHBondContact O-N 3.3Å; L32-R34 VanDerWaalsContact C-N 3.34Å; L32-R34 PolarHBondContact O-N 3.08Å; L32-D35 PolarHBondContact O-N 2.92Å; L32-V36 HydrophobicContact CD1-CG2 3.96Å; L32-V36 HydrophobicContact CG-CG2 4.26Å; L32-V36 WeakPolarHBondContact O-CB 3.46Å; L32-V36 VanDerWaalsContact O-CG2 3.26Å; L32-V36 WeakPolarHBondContact O-CG2 3.31Å; L32-V36 PolarHBondContact O-N 3.33Å
33Y94.1Very high93.2Very high21 Ų2173.3 Ų73.38%0.08238%0.381CS..Hα-helixtrans-56.4-48.9174.3175-95.7000111.7V15 F17 W22 E29 T31 D35 V36 M37 L60 P66V15-Y33 VanDerWaalsContact O-CE2 3.28Å; V15-Y33 WeakPolarHBondContact O-CE2 3.37Å; F17-Y33 AromaticContact CD2-CD2 3.75Å; F17-Y33 HydrophobicContact CD2-CD2 3.75Å; F17-Y33 AromaticContact CD2-CE2 3.8Å; F17-Y33 HydrophobicContact CD2-CE2 3.8Å; F17-Y33 AromaticContact CE2-CD2 3.57Å; F17-Y33 HydrophobicContact CE2-CD2 3.57Å; F17-Y33 HydrophobicContact CE2-CE2 4.03Å; F17-Y33 HydrophobicContact CE2-CG 4.41Å; W22-Y33 AromaticContact CH2-CD1 3.41Å; W22-Y33 HydrophobicContact CH2-CD1 3.41Å; W22-Y33 VanDerWaalsContact CH2-CD1 3.41Å; W22-Y33 HydrophobicContact CH2-CE1 4.01Å; W22-Y33 AromaticContact CH2-CG 3.9Å; W22-Y33 HydrophobicContact CH2-CG 3.9Å; W22-Y33 AromaticContact CZ3-CD1 3.36Å; W22-Y33 HydrophobicContact CZ3-CD1 3.36Å; W22-Y33 HydrophobicContact CZ3-CD2 4.11Å; W22-Y33 AromaticContact CZ3-CE1 3.81Å; W22-Y33 HydrophobicContact CZ3-CE1 3.81Å; W22-Y33 HydrophobicContact CZ3-CE2 4.46Å; W22-Y33 AromaticContact CZ3-CG 3.5Å; W22-Y33 HydrophobicContact CZ3-CG 3.5Å; E29-Y33 WeakPolarHBondContact O-CB 3.34Å; E29-Y33 PolarHBondContact O-N 3.37Å; T31-Y33 VanDerWaalsContact C-N 3.31Å; T31-Y33 PolarHBondContact O-N 3.26Å; Y33-D35 VanDerWaalsContact C-N 3.35Å; Y33-D35 PolarHBondContact O-N 3.41Å; Y33-V36 PolarHBondContact O-N 2.91Å; Y33-M37 HydrophobicContact CD1-CG 4.09Å; Y33-M37 HydrophobicContact CD2-CE 4.32Å; Y33-M37 HydrophobicContact CD2-CG 3.98Å; Y33-M37 HydrophobicContact CE1-CG 3.74Å; Y33-M37 HydrophobicContact CE2-CE 4.15Å; Y33-M37 HydrophobicContact CE2-CG 3.63Å; Y33-M37 HydrophobicContact CE2-SD 4.04Å; Y33-M37 HydrophobicContact CG-CG 4.23Å; Y33-M37 WeakPolarHBondContact O-CB 3.43Å; Y33-M37 VanDerWaalsContact O-CG 3.24Å; Y33-M37 WeakPolarHBondContact O-CG 3.33Å; Y33-M37 PolarHBondContact O-N 3.39Å; Y33-L60 HydrophobicContact CD1-CD1 4.42Å; Y33-L60 HydrophobicContact CD1-CD2 4.28Å; Y33-L60 HydrophobicContact CE1-CD1 3.94Å; Y33-L60 HydrophobicContact CE1-CD2 4.16Å; Y33-P66 HydrophobicContact CE1-CG 3.77Å
34R93.4Very high93.1Very high88 Ų8868.1 Ų68.133%0.33236%0.357SS..Hα-helixtrans-57-50.4178.6177.1-177-179.4166.34.5110.8R30 T31 L32 M37 L38 L60 E61R30-R34 PolarHBondContact O-N 3.01Å; R30-R34 VanDerWaalsContact O-N 3.1Å; T31-R34 WeakPolarHBondContact O-CB 3.42Å; T31-R34 PolarHBondContact O-N 3.23Å; T31-R34 VanDerWaalsContact O-N 3.12Å; L32-R34 VanDerWaalsContact C-N 3.34Å; L32-R34 PolarHBondContact O-N 3.08Å; R34-M37 PolarHBondContact O-N 3.45Å; R34-L38 HydrophobicContact CG-CD1 3.86Å; R34-L38 WeakPolarHBondContact O-CB 3.26Å; R34-L38 VanDerWaalsContact O-CG 3.26Å; R34-L38 WeakPolarHBondContact O-CG 3.45Å; R34-L38 PolarHBondContact O-N 2.8Å; R34-L60 HydrophobicContact CB-CD2 4.21Å; R34-L60 HydrophobicContact CG-CB 4.31Å; R34-L60 HydrophobicContact CG-CD2 4.22Å; R34-L60 PolarHBondContact NE-O 2.93Å; R34-L60 PolarHBondContact NH2-O 3.25Å; R34-E61 PolarHBondContact NH2-O 3.37Å; R34-E61 VanDerWaalsContact NH2-O 3.14Å
35D95.1Very high92.8Very high88 Ų8864 Ų6447%0.47134%0.34SS..Hα-helixtrans-62.5-48.7-176.7-66.8-18000111T31 L32 Y33 M37 L38 E39T31-D35 PolarHBondContact O-N 2.88Å; L32-D35 PolarHBondContact O-N 2.92Å; Y33-D35 VanDerWaalsContact C-N 3.35Å; Y33-D35 PolarHBondContact O-N 3.41Å; D35-M37 PolarHBondContact O-N 2.92Å; D35-L38 PolarHBondContact O-N 3.36Å; D35-E39 VanDerWaalsContact O-CB 3.31Å; D35-E39 WeakPolarHBondContact O-CB 3.26Å; D35-E39 PolarHBondContact O-N 3.46Å
36V93.7Very high92.6Very high48 Ų4867.3 Ų67.329%0.29137%0.365SS..Hα-helixtrans-62.9-43179.2174.20000111.5L32 Y33 E39 N40L32-V36 HydrophobicContact CD1-CG2 3.96Å; L32-V36 HydrophobicContact CG-CG2 4.26Å; L32-V36 WeakPolarHBondContact O-CB 3.46Å; L32-V36 VanDerWaalsContact O-CG2 3.26Å; L32-V36 WeakPolarHBondContact O-CG2 3.31Å; L32-V36 PolarHBondContact O-N 3.33Å; Y33-V36 PolarHBondContact O-N 2.91Å; V36-E39 PolarHBondContact O-N 3.45Å; V36-N40 WeakPolarHBondContact O-CB 3.36Å; V36-N40 PolarHBondContact O-N 2.84Å; V36-N40 PolarHBondContact O-OD1 3.29Å
37M92.1Very high92.2Very high2 Ų270.7 Ų70.71%0.0138%0.381CS..Hα-helixtrans-66.7-39.8-180-71.6-53.2108.500112.3T14 V15 Y33 R34 D35 Y41 I57 L60T14-M37 HydrophobicContact CG2-SD 3.79Å; V15-M37 HydrophobicContact CB-CE 3.94Å; V15-M37 HydrophobicContact CG2-CE 4.08Å; V15-M37 VanDerWaalsContact N-CE 3.34Å; Y33-M37 HydrophobicContact CD1-CG 4.09Å; Y33-M37 HydrophobicContact CD2-CE 4.32Å; Y33-M37 HydrophobicContact CD2-CG 3.98Å; Y33-M37 HydrophobicContact CE1-CG 3.74Å; Y33-M37 HydrophobicContact CE2-CE 4.15Å; Y33-M37 HydrophobicContact CE2-CG 3.63Å; Y33-M37 HydrophobicContact CE2-SD 4.04Å; Y33-M37 HydrophobicContact CG-CG 4.23Å; Y33-M37 WeakPolarHBondContact O-CB 3.43Å; Y33-M37 VanDerWaalsContact O-CG 3.24Å; Y33-M37 WeakPolarHBondContact O-CG 3.33Å; Y33-M37 PolarHBondContact O-N 3.39Å; R34-M37 PolarHBondContact O-N 3.45Å; D35-M37 PolarHBondContact O-N 2.92Å; M37-Y41 PolarHBondContact O-N 3.46Å; M37-I57 HydrophobicContact CB-CD1 4.34Å; M37-I57 WeakPolarHBondContact O-CD1 3.22Å; M37-L60 HydrophobicContact CB-CD1 3.58Å; M37-L60 HydrophobicContact CG-CD1 4.11Å
38L92.8Very high91.6Very high42 Ų4268.2 Ų68.222%0.2238%0.375CS..Hα-helixtrans-67.7-41.3176.7-70.1175.2000111.6R34 D35 Y41 S42 I57 L60 E61R34-L38 HydrophobicContact CG-CD1 3.86Å; R34-L38 WeakPolarHBondContact O-CB 3.26Å; R34-L38 VanDerWaalsContact O-CG 3.26Å; R34-L38 WeakPolarHBondContact O-CG 3.45Å; R34-L38 PolarHBondContact O-N 2.8Å; D35-L38 PolarHBondContact O-N 3.36Å; L38-Y41 PolarHBondContact O-N 3.03Å; L38-S42 WeakPolarHBondContact O-CB 3.32Å; L38-S42 PolarHBondContact O-N 3.43Å; L38-I57 HydrophobicContact CD2-CD1 4.33Å; L38-I57 HydrophobicContact CD2-CG2 4.21Å; L38-L60 HydrophobicContact CD2-CB 4.12Å; L38-L60 HydrophobicContact CG-CB 4.35Å; L38-E61 HydrophobicContact CD2-CG 3.62Å
39E94.5Very high90.7Very high107 Ų10767.4 Ų67.450%0.536%0.36SS..Hα-helixtrans-62.5-46.7175.2-177.3174.6-172.400111.3D35 V36 Y41 S42 H43D35-E39 VanDerWaalsContact O-CB 3.31Å; D35-E39 WeakPolarHBondContact O-CB 3.26Å; D35-E39 PolarHBondContact O-N 3.46Å; V36-E39 PolarHBondContact O-N 3.45Å; E39-Y41 VanDerWaalsContact C-N 3.33Å; E39-Y41 PolarHBondContact O-N 2.91Å; E39-S42 WeakPolarHBondContact O-CB 3.26Å; E39-S42 PolarHBondContact O-N 3.48Å; E39-S42 VanDerWaalsContact O-N 3.16Å; E39-H43 WeakPolarHBondContact CG-CE1 3.24Å; E39-H43 VanDerWaalsContact O-CG 3.31Å; E39-H43 PolarHBondContact O-N 2.91Å; E39-H43 PolarHBondContact O-ND1 3.31Å; E39-H43 IonicContact OE1-CE1 3.29Å; E39-H43 PolarHBondContact OE1-CE1 2.93Å; E39-H43 VanDerWaalsContact OE1-CE1 3.29Å; E39-H43 IonicContact OE1-NE2 3.9Å
40N92Very high89.7Confident40 Ų4063.6 Ų63.621%0.21434%0.344CS..Hα-helixtrans-59.8-42.9177-72.9-7.5000111.9V13 V36 H43 L44V13-N40 HydrophobicContact CG2-CB 4.24Å; V13-N40 PolarHBondContact O-ND2 2.73Å; V36-N40 WeakPolarHBondContact O-CB 3.36Å; V36-N40 PolarHBondContact O-N 2.84Å; V36-N40 PolarHBondContact O-OD1 3.29Å; N40-H43 PolarHBondContact O-N 3.08Å; N40-L44 WeakPolarHBondContact O-CG 3.28Å; N40-L44 PolarHBondContact O-N 3.45Å
41Y90.4Very high88.5Confident28 Ų2867.7 Ų67.711%0.1137%0.37CS..Hα-helixtrans-61.5-47.8174.5175.6-108.5000111.8M37 L38 E39 H43 L44 I45 C50 K53 P54 I57M37-Y41 PolarHBondContact O-N 3.46Å; L38-Y41 PolarHBondContact O-N 3.03Å; E39-Y41 VanDerWaalsContact C-N 3.33Å; E39-Y41 PolarHBondContact O-N 2.91Å; Y41-H43 VanDerWaalsContact C-N 3.29Å; Y41-H43 PolarHBondContact O-N 3.1Å; Y41-L44 PolarHBondContact O-N 3.37Å; Y41-L44 VanDerWaalsContact O-N 3.17Å; Y41-I45 HydrophobicContact CD1-CG1 4.31Å; Y41-I45 HydrophobicContact CD2-CG1 4.38Å; Y41-I45 HydrophobicContact CE1-CD1 4.34Å; Y41-I45 HydrophobicContact CE1-CG1 3.9Å; Y41-I45 HydrophobicContact CE2-CD1 3.73Å; Y41-I45 HydrophobicContact CE2-CG1 3.96Å; Y41-I45 WeakPolarHBondContact O-CG1 3.44Å; Y41-I45 PolarHBondContact O-N 2.7Å; Y41-C50 HydrophobicContact CE2-CB 4.38Å; Y41-K53 HydrophobicContact CE1-CG 4.39Å; Y41-K53 HydrophobicContact CE2-CG 4.46Å; Y41-K53 WeakPolarHBondContact OH-CA 3.45Å; Y41-K53 WeakPolarHBondContact OH-CB 3.48Å; Y41-K53 WeakPolarHBondContact OH-CE 3.48Å; Y41-P54 HydrophobicContact CD2-CG 4.38Å; Y41-P54 VanDerWaalsContact CE2-CD 3.46Å; Y41-I57 HydrophobicContact CD1-CG1 4.48Å; Y41-I57 HydrophobicContact CD1-CG2 3.6Å; Y41-I57 HydrophobicContact CD2-CG1 4.06Å; Y41-I57 HydrophobicContact CD2-CG2 4.4Å; Y41-I57 HydrophobicContact CE1-CG2 3.88Å; Y41-I57 HydrophobicContact CG-CB 4.46Å; Y41-I57 HydrophobicContact CG-CD1 4.14Å; Y41-I57 HydrophobicContact CG-CG1 3.88Å; Y41-I57 HydrophobicContact CG-CG2 3.88Å
42S91.3Very high87.8Confident64 Ų6468.8 Ų68.845%0.44838%0.376SS..Hα-helixtrans-56.5-43.1177.1-175.20000112.2L38 E39 I45 S46L38-S42 WeakPolarHBondContact O-CB 3.32Å; L38-S42 PolarHBondContact O-N 3.43Å; E39-S42 WeakPolarHBondContact O-CB 3.26Å; E39-S42 PolarHBondContact O-N 3.48Å; E39-S42 VanDerWaalsContact O-N 3.16Å; S42-I45 PolarHBondContact O-N 2.68Å; S42-S46 WeakPolarHBondContact O-CB 3.41Å; S42-S46 PolarHBondContact O-N 3.19Å; S42-S46 PolarHBondContact O-OG 3.41Å
43H91.5Very high87.2Confident98 Ų9867.6 Ų67.645%0.45437%0.367SS..Hα-helixtrans-61.4-48.4175.6-68.3158000111.7E39 N40 Y41 I45 S46 V47E39-H43 WeakPolarHBondContact CG-CE1 3.24Å; E39-H43 VanDerWaalsContact O-CG 3.31Å; E39-H43 PolarHBondContact O-N 2.91Å; E39-H43 PolarHBondContact O-ND1 3.31Å; E39-H43 IonicContact OE1-CE1 3.29Å; E39-H43 PolarHBondContact OE1-CE1 2.93Å; E39-H43 VanDerWaalsContact OE1-CE1 3.29Å; E39-H43 IonicContact OE1-NE2 3.9Å; N40-H43 PolarHBondContact O-N 3.08Å; Y41-H43 VanDerWaalsContact C-N 3.29Å; Y41-H43 PolarHBondContact O-N 3.1Å; H43-I45 VanDerWaalsContact C-N 3.31Å; H43-I45 PolarHBondContact O-N 3.41Å; H43-S46 WeakPolarHBondContact O-CA 3.15Å; H43-S46 WeakPolarHBondContact O-CB 3.36Å; H43-S46 PolarHBondContact O-N 2.9Å; H43-V47 VanDerWaalsContact O-CG2 3.3Å; H43-V47 WeakPolarHBondContact O-CG2 3.48Å; H43-V47 PolarHBondContact O-N 3.35Å
44L87.6Confident86.8Confident12 Ų1267.9 Ų67.96%0.06337%0.371CS..Hα-helixtrans-61.4-36.7177.9-69.1179.4000113.4V8 F10 V13 N40 Y41 S46 G48 Y49 C50V8-L44 HydrophobicContact CG1-CD2 4.01Å; F10-L44 HydrophobicContact CB-CD1 3.97Å; F10-L44 HydrophobicContact CD2-CD1 3.81Å; F10-L44 HydrophobicContact CG-CD1 4.39Å; V13-L44 HydrophobicContact CG2-CD1 3.69Å; V13-L44 HydrophobicContact CG2-CD2 4.34Å; V13-L44 HydrophobicContact CG2-CG 4.15Å; N40-L44 WeakPolarHBondContact O-CG 3.28Å; N40-L44 PolarHBondContact O-N 3.45Å; Y41-L44 PolarHBondContact O-N 3.37Å; Y41-L44 VanDerWaalsContact O-N 3.17Å; L44-S46 VanDerWaalsContact C-N 3.35Å; L44-G48 PolarHBondContact O-N 3.05Å; L44-G48 VanDerWaalsContact O-N 3.15Å; L44-Y49 PolarHBondContact O-N 3.23Å; L44-C50 HydrophobicContact CB-CB 3.83Å; L44-C50 HydrophobicContact CD1-CB 4.42Å; L44-C50 PolarHBondContact O-N 3.5Å
45I86.9Confident86.5Confident72 Ų7267.9 Ų67.937%0.36937%0.373SS..Hα-helixtrans-61.5-47.4171.5-63.6-55.6000110Y41 S42 H43 V47 G48 C50Y41-I45 HydrophobicContact CD1-CG1 4.31Å; Y41-I45 HydrophobicContact CD2-CG1 4.38Å; Y41-I45 HydrophobicContact CE1-CD1 4.34Å; Y41-I45 HydrophobicContact CE1-CG1 3.9Å; Y41-I45 HydrophobicContact CE2-CD1 3.73Å; Y41-I45 HydrophobicContact CE2-CG1 3.96Å; Y41-I45 WeakPolarHBondContact O-CG1 3.44Å; Y41-I45 PolarHBondContact O-N 2.7Å; S42-I45 PolarHBondContact O-N 2.68Å; H43-I45 VanDerWaalsContact C-N 3.31Å; H43-I45 PolarHBondContact O-N 3.41Å; I45-V47 VanDerWaalsContact C-N 3.26Å; I45-V47 PolarHBondContact O-N 2.92Å; I45-G48 PolarHBondContact O-N 2.89Å; I45-C50 HydrophobicContact CD1-CB 3.89Å; I45-C50 WeakPolarHBondContact CD1-O 3.42Å
46S87.9Confident86.1Confident94 Ų9465.2 Ų65.266%0.65736%0.361SS*.Hα-helixtrans-61.7-33.3-176.6-58.80000113S42 H43 L44S42-S46 WeakPolarHBondContact O-CB 3.41Å; S42-S46 PolarHBondContact O-N 3.19Å; S42-S46 PolarHBondContact O-OG 3.41Å; H43-S46 WeakPolarHBondContact O-CA 3.15Å; H43-S46 WeakPolarHBondContact O-CB 3.36Å; H43-S46 PolarHBondContact O-N 2.9Å; L44-S46 VanDerWaalsContact C-N 3.35Å
47V85.6Confident85.9Confident94 Ų9463 Ų6357%0.5735%0.347SS*.THydrogen-bonded Turntrans-933.6175.4-63.50000113.9H43 I45 Y49H43-V47 VanDerWaalsContact O-CG2 3.3Å; H43-V47 WeakPolarHBondContact O-CG2 3.48Å; H43-V47 PolarHBondContact O-N 3.35Å; I45-V47 VanDerWaalsContact C-N 3.26Å; I45-V47 PolarHBondContact O-N 2.92Å; V47-Y49 HydrophobicContact CB-CD2 3.97Å; V47-Y49 HydrophobicContact CB-CE2 4.1Å; V47-Y49 HydrophobicContact CG2-CD2 3.3Å; V47-Y49 HydrophobicContact CG2-CE2 3.87Å; V47-Y49 HydrophobicContact CG2-CG 4.29Å
48G81.9Confident85.7Confident56 Ų5664.7 Ų64.758%0.57736%0.359SS*.THydrogen-bonded Turntrans77.918173.600000115.7L44 I45L44-G48 PolarHBondContact O-N 3.05Å; L44-G48 VanDerWaalsContact O-N 3.15Å; I45-G48 PolarHBondContact O-N 2.89Å
49Y77.1Confident85.6Confident102 Ų10263.6 Ų63.640%0.435%0.353SS..  trans-95.8-12-176.7-72.9-58.5000114.9L44 V47L44-Y49 PolarHBondContact O-N 3.23Å; V47-Y49 HydrophobicContact CB-CD2 3.97Å; V47-Y49 HydrophobicContact CB-CE2 4.1Å; V47-Y49 HydrophobicContact CG2-CD2 3.3Å; V47-Y49 HydrophobicContact CG2-CE2 3.87Å; V47-Y49 HydrophobicContact CG2-CG 4.29Å
50C72.1Confident85.4Confident20 Ų2058.8 Ų58.814%0.13533%0.33CS..  trans-123.1118.4177-164.10000110.3Y41 L44 I45 T52Y41-C50 HydrophobicContact CE2-CB 4.38Å; L44-C50 HydrophobicContact CB-CB 3.83Å; L44-C50 HydrophobicContact CD1-CB 4.42Å; L44-C50 PolarHBondContact O-N 3.5Å; I45-C50 HydrophobicContact CD1-CB 3.89Å; I45-C50 WeakPolarHBondContact CD1-O 3.42Å; C50-T52 PolarHBondContact SG-O 2.88Å
51I68.9Low85.4Confident161 Ų16161.1 Ų61.183%0.82634%0.34SS*.  trans-103.8-33.4179.2-58.1174.6000110.4
52T79.6Confident85.5Confident100 Ų10066.8 Ų66.861%0.61337%0.365SS*.SBendtrans-104126-178.8-53.90000109.8C50 P54C50-T52 PolarHBondContact SG-O 2.88Å; T52-P54 VanDerWaalsContact O-CD 3.3Å; T52-P54 WeakPolarHBondContact O-CD 3.47Å
53K83.4Confident85.3Confident83 Ų8365.9 Ų65.936%0.36137%0.365SS..  trans-66.5121.9176.3-175.8170-85.7-171.40110.8Y41 I57 S58 E61Y41-K53 HydrophobicContact CE1-CG 4.39Å; Y41-K53 HydrophobicContact CE2-CG 4.46Å; Y41-K53 WeakPolarHBondContact OH-CA 3.45Å; Y41-K53 WeakPolarHBondContact OH-CB 3.48Å; Y41-K53 WeakPolarHBondContact OH-CE 3.48Å; K53-I57 HydrophobicContact CD-CG2 4.08Å; K53-I57 HydrophobicContact CG-CB 4.2Å; K53-I57 HydrophobicContact CG-CG2 3.87Å; K53-S58 WeakPolarHBondContact CD-OG 3.39Å; K53-E61 WeakPolarHBondContact CE-OE1 3.3Å; K53-E61 IonicContact NZ-OE1 2.68Å; K53-E61 PolarHBondContact NZ-OE1 3.02Å; K53-E61 IonicContact NZ-OE2 2.7Å; K53-E61 PolarHBondContact NZ-OE2 2.97Å
54P85.7Confident85.2Confident27 Ų2765.5 Ų65.518%0.17536%0.364CS..  trans-61.9148.9174.3-2232.9000112.1F10 Y41 T52 V56 I57 S58F10-P54 HydrophobicContact CB-CG 4.26Å; F10-P54 HydrophobicContact CD1-CB 3.88Å; F10-P54 HydrophobicContact CD1-CG 3.45Å; F10-P54 VanDerWaalsContact CD1-CG 3.45Å; F10-P54 HydrophobicContact CD2-CG 4.32Å; F10-P54 HydrophobicContact CE1-CB 3.89Å; F10-P54 HydrophobicContact CE1-CG 3.78Å; F10-P54 HydrophobicContact CG-CG 3.75Å; F10-P54 HydrophobicContact CZ-CG 4.36Å; Y41-P54 HydrophobicContact CD2-CG 4.38Å; Y41-P54 VanDerWaalsContact CE2-CD 3.46Å; T52-P54 VanDerWaalsContact O-CD 3.3Å; T52-P54 WeakPolarHBondContact O-CD 3.47Å; P54-V56 VanDerWaalsContact C-N 3.31Å; P54-V56 HydrophobicContact CB-CG1 4.04Å; P54-V56 PolarHBondContact O-N 3.46Å; P54-I57 HydrophobicContact CB-CB 4.35Å; P54-I57 HydrophobicContact CB-CG1 4.01Å; P54-I57 HydrophobicContact CG-CG1 3.96Å; P54-I57 WeakPolarHBondContact O-CB 3.31Å; P54-I57 PolarHBondContact O-N 3.16Å; P54-S58 PolarHBondContact O-N 2.88Å; P54-S58 VanDerWaalsContact O-N 3.1Å; P54-S58 PolarHBondContact O-OG 3.41Å
55K86.3Confident85Confident87 Ų8769.4 Ų69.438%0.37838%0.382SS..Hα-helixtrans-59.1-43.5176.4-74-175.1-179.9177.40112I57 S58 K59 D71K55-I57 VanDerWaalsContact C-N 3.28Å; K55-I57 PolarHBondContact O-N 3.38Å; K55-S58 WeakPolarHBondContact O-CB 3.38Å; K55-S58 PolarHBondContact O-N 3.43Å; K55-S58 VanDerWaalsContact O-N 3.08Å; K55-K59 PolarHBondContact O-N 3.06Å; K55-D71 IonicContact NZ-OD1 2.89Å; K55-D71 PolarHBondContact NZ-OD1 3.03Å
56V86.1Confident84.8Confident33 Ų3366.5 Ų66.520%0.237%0.368CS..Hα-helixtrans-57.5-42.7178.262.30000111.3F10 P54 S58 K59 L60 P66F10-V56 HydrophobicContact CE1-CG1 3.64Å; F10-V56 HydrophobicContact CZ-CG1 4.23Å; P54-V56 VanDerWaalsContact C-N 3.31Å; P54-V56 HydrophobicContact CB-CG1 4.04Å; P54-V56 PolarHBondContact O-N 3.46Å; V56-S58 PolarHBondContact O-N 2.97Å; V56-K59 PolarHBondContact O-N 3.29Å; V56-L60 HydrophobicContact CG2-CD1 4Å; V56-L60 HydrophobicContact CG2-CG 4.26Å; V56-L60 WeakPolarHBondContact O-CB 3.29Å; V56-L60 VanDerWaalsContact O-CG 3.26Å; V56-L60 WeakPolarHBondContact O-CG 3.36Å; V56-L60 PolarHBondContact O-N 3.35Å; V56-P66 HydrophobicContact CG2-CB 3.95Å
57I89.9Confident84.1Confident0 Ų065 Ų650%035%0.348CS..Hα-helixtrans-60.9-45.5174.6-65.8-58.1000111.3F10 M37 L38 Y41 K53 P54 K55 K59 L60 E61F10-I57 HydrophobicContact CE1-CD1 4.4Å; F10-I57 HydrophobicContact CE1-CG1 4.12Å; F10-I57 HydrophobicContact CE2-CD1 3.83Å; F10-I57 HydrophobicContact CE2-CG1 4.01Å; F10-I57 HydrophobicContact CZ-CD1 3.44Å; F10-I57 VanDerWaalsContact CZ-CD1 3.44Å; F10-I57 HydrophobicContact CZ-CG1 3.57Å; M37-I57 HydrophobicContact CB-CD1 4.34Å; M37-I57 WeakPolarHBondContact O-CD1 3.22Å; L38-I57 HydrophobicContact CD2-CD1 4.33Å; L38-I57 HydrophobicContact CD2-CG2 4.21Å; Y41-I57 HydrophobicContact CD1-CG1 4.48Å; Y41-I57 HydrophobicContact CD1-CG2 3.6Å; Y41-I57 HydrophobicContact CD2-CG1 4.06Å; Y41-I57 HydrophobicContact CD2-CG2 4.4Å; Y41-I57 HydrophobicContact CE1-CG2 3.88Å; Y41-I57 HydrophobicContact CG-CB 4.46Å; Y41-I57 HydrophobicContact CG-CD1 4.14Å; Y41-I57 HydrophobicContact CG-CG1 3.88Å; Y41-I57 HydrophobicContact CG-CG2 3.88Å; K53-I57 HydrophobicContact CD-CG2 4.08Å; K53-I57 HydrophobicContact CG-CB 4.2Å; K53-I57 HydrophobicContact CG-CG2 3.87Å; P54-I57 HydrophobicContact CB-CB 4.35Å; P54-I57 HydrophobicContact CB-CG1 4.01Å; P54-I57 HydrophobicContact CG-CG1 3.96Å; P54-I57 WeakPolarHBondContact O-CB 3.31Å; P54-I57 PolarHBondContact O-N 3.16Å; K55-I57 VanDerWaalsContact C-N 3.28Å; K55-I57 PolarHBondContact O-N 3.38Å; I57-K59 PolarHBondContact O-N 3.45Å; I57-L60 PolarHBondContact O-N 3.39Å; I57-E61 HydrophobicContact CG2-CG 4.42Å; I57-E61 WeakPolarHBondContact O-CG 3.49Å; I57-E61 PolarHBondContact O-N 2.95Å
58S88.6Confident83Confident39 Ų3962.1 Ų62.127%0.27333%0.331SS..Hα-helixtrans-60.9-32.7179.4-550000113K53 P54 K55 V56 K62K53-S58 WeakPolarHBondContact CD-OG 3.39Å; P54-S58 PolarHBondContact O-N 2.88Å; P54-S58 VanDerWaalsContact O-N 3.1Å; P54-S58 PolarHBondContact O-OG 3.41Å; K55-S58 WeakPolarHBondContact O-CB 3.38Å; K55-S58 PolarHBondContact O-N 3.43Å; K55-S58 VanDerWaalsContact O-N 3.08Å; V56-S58 PolarHBondContact O-N 2.97Å; S58-K62 WeakPolarHBondContact O-CG 3.46Å
59K89.8Confident81.6Confident19 Ų1964.3 Ų64.38%0.08333%0.33CS..Hα-helixtrans-76.1-46.3175.2-67.9-176.1-168.9175.20111.8K55 V56 I57 E61 K62 G63 E64 E65 P66 S68 D71K55-K59 PolarHBondContact O-N 3.06Å; V56-K59 PolarHBondContact O-N 3.29Å; I57-K59 PolarHBondContact O-N 3.45Å; K59-E61 VanDerWaalsContact C-N 3.29Å; K59-E61 PolarHBondContact O-N 2.78Å; K59-K62 CarbonylContact O-C 3.56Å; K59-K62 WeakPolarHBondContact O-CA 3.39Å; K59-K62 WeakPolarHBondContact O-CB 2.93Å; K59-K62 PolarHBondContact O-N 3.21Å; K59-G63 PolarHBondContact O-N 3.26Å; K59-G63 VanDerWaalsContact O-N 3.11Å; K59-E64 HydrophobicContact CB-CB 4.05Å; K59-E64 PolarHBondContact O-N 3.02Å; K59-E65 WeakPolarHBondContact CD-O 3.33Å; K59-P66 WeakPolarHBondContact CD-O 3.41Å; K59-P66 PolarHBondContact NZ-O 2.89Å; K59-S68 WeakPolarHBondContact CE-OG 3.06Å; K59-S68 VanDerWaalsContact NZ-N 3.19Å; K59-S68 PolarHBondContact NZ-OG 3.29Å; K59-D71 WeakPolarHBondContact CE-OD2 3.49Å; K59-D71 IonicContact NZ-OD2 3.15Å; K59-D71 PolarHBondContact NZ-OD2 2.82Å
60L91.6Very high80.5Confident5 Ų565.5 Ų65.53%0.02634%0.339CS..Hα-helixtrans-60.7-36.7179-70.8177.6000112.2Y33 R34 M37 L38 V56 I57 K62 G63 P66Y33-L60 HydrophobicContact CD1-CD1 4.42Å; Y33-L60 HydrophobicContact CD1-CD2 4.28Å; Y33-L60 HydrophobicContact CE1-CD1 3.94Å; Y33-L60 HydrophobicContact CE1-CD2 4.16Å; R34-L60 HydrophobicContact CB-CD2 4.21Å; R34-L60 HydrophobicContact CG-CB 4.31Å; R34-L60 HydrophobicContact CG-CD2 4.22Å; R34-L60 PolarHBondContact NE-O 2.93Å; R34-L60 PolarHBondContact NH2-O 3.25Å; M37-L60 HydrophobicContact CB-CD1 3.58Å; M37-L60 HydrophobicContact CG-CD1 4.11Å; L38-L60 HydrophobicContact CD2-CB 4.12Å; L38-L60 HydrophobicContact CG-CB 4.35Å; V56-L60 HydrophobicContact CG2-CD1 4Å; V56-L60 HydrophobicContact CG2-CG 4.26Å; V56-L60 WeakPolarHBondContact O-CB 3.29Å; V56-L60 VanDerWaalsContact O-CG 3.26Å; V56-L60 WeakPolarHBondContact O-CG 3.36Å; V56-L60 PolarHBondContact O-N 3.35Å; I57-L60 PolarHBondContact O-N 3.39Å; L60-K62 VanDerWaalsContact C-N 3.27Å; L60-K62 PolarHBondContact O-N 3.18Å; L60-G63 PolarHBondContact O-N 3.28Å; L60-P66 HydrophobicContact CD2-CG 4.28Å
61E91.8Very high79.7Confident89 Ų8965.7 Ų65.742%0.41634%0.338SS..Hα-helixtrans-59.6-38.3173.3-74.7176153.900112.2R34 L38 K53 I57 K59 G63R34-E61 PolarHBondContact NH2-O 3.37Å; R34-E61 VanDerWaalsContact NH2-O 3.14Å; L38-E61 HydrophobicContact CD2-CG 3.62Å; K53-E61 WeakPolarHBondContact CE-OE1 3.3Å; K53-E61 IonicContact NZ-OE1 2.68Å; K53-E61 PolarHBondContact NZ-OE1 3.02Å; K53-E61 IonicContact NZ-OE2 2.7Å; K53-E61 PolarHBondContact NZ-OE2 2.97Å; I57-E61 HydrophobicContact CG2-CG 4.42Å; I57-E61 WeakPolarHBondContact O-CG 3.49Å; I57-E61 PolarHBondContact O-N 2.95Å; K59-E61 VanDerWaalsContact C-N 3.29Å; K59-E61 PolarHBondContact O-N 2.78Å; E61-G63 VanDerWaalsContact C-N 3.26Å; E61-G63 PolarHBondContact O-N 3.17Å
62K91.3Very high78.9Confident148 Ų14861.7 Ų61.764%0.64332%0.316SS*.Hα-helixtrans-78.8-8.3176.8-61.5175.4-173.1177.90113.6S58 K59 L60 E64S58-K62 WeakPolarHBondContact O-CG 3.46Å; K59-K62 CarbonylContact O-C 3.56Å; K59-K62 WeakPolarHBondContact O-CA 3.39Å; K59-K62 WeakPolarHBondContact O-CB 2.93Å; K59-K62 PolarHBondContact O-N 3.21Å; L60-K62 VanDerWaalsContact C-N 3.27Å; L60-K62 PolarHBondContact O-N 3.18Å; K62-E64 VanDerWaalsContact C-N 3.3Å; K62-E64 HydrophobicContact CB-CG 4Å; K62-E64 WeakPolarHBondContact CD-OE1 3.4Å
63G88.1Confident77.2Confident44 Ų4464.1 Ų64.145%0.45432%0.319SS..THydrogen-bonded Turntrans73.921.1-172.800000114.1K59 L60 E61K59-G63 PolarHBondContact O-N 3.26Å; K59-G63 VanDerWaalsContact O-N 3.11Å; L60-G63 PolarHBondContact O-N 3.28Å; E61-G63 VanDerWaalsContact C-N 3.26Å; E61-G63 PolarHBondContact O-N 3.17Å
64E88.8Confident75.2Confident91 Ų9164.4 Ų64.443%0.42532%0.323SS..  trans-83.8160.2173.3-65.4169.7-162.800110.8K59 K62K59-E64 HydrophobicContact CB-CB 4.05Å; K59-E64 PolarHBondContact O-N 3.02Å; K62-E64 VanDerWaalsContact C-N 3.3Å; K62-E64 HydrophobicContact CB-CG 4Å; K62-E64 WeakPolarHBondContact CD-OE1 3.4Å
65E84.7Confident73.5Confident93 Ų9367.8 Ų67.844%0.43534%0.34SS..  trans-71.4150.3175.1-64.8-154.7162.200112.4R30 K59 W67R30-E65 IonicContact NH1-OE1 2.71Å; K59-E65 WeakPolarHBondContact CD-O 3.33Å; E65-W67 PolarHBondContact O-N 3.19Å; E65-W67 PolarHBondContact OE2-NE1 3.37Å
66P81.6Confident71.7Confident12 Ų1270.7 Ų70.78%0.07836%0.355CS..SBendtrans-57.3-45.2-179.6-24.333.6000113.8W22 Y33 V56 K59 L60W22-P66 HydrophobicContact CH2-CG 3.96Å; W22-P66 HydrophobicContact CZ2-CG 4.1Å; W22-P66 HydrophobicContact CZ3-CG 4.24Å; Y33-P66 HydrophobicContact CE1-CG 3.77Å; V56-P66 HydrophobicContact CG2-CB 3.95Å; K59-P66 WeakPolarHBondContact CD-O 3.41Å; K59-P66 PolarHBondContact NZ-O 2.89Å; L60-P66 HydrophobicContact CD2-CG 4.28Å
67W72.8Confident69.6Low63 Ų6378.2 Ų78.224%0.23938%0.38CS..  trans-93.199.9173.529.871.9000109.2F17 R19 W22 E65F17-W67 HydrophobicContact CB-CH2 4.34Å; F17-W67 VanDerWaalsContact O-CZ3 3.32Å; F17-W67 WeakPolarHBondContact O-CZ3 3.34Å; R19-W67 HydrophobicContact CG-CG 4.49Å; W22-W67 HydrophobicContact CB-CH2 3.55Å; W22-W67 HydrophobicContact CB-CZ2 3.3Å; W22-W67 HydrophobicContact CB-CZ3 4.41Å; W22-W67 AromaticContact CD1-CE2 3.51Å; W22-W67 AromaticContact CD1-CZ2 3.23Å; W22-W67 AromaticContact CD1-NE1 3.4Å; W22-W67 AromaticContact CD2-CH2 3.48Å; W22-W67 HydrophobicContact CD2-CH2 3.48Å; W22-W67 VanDerWaalsContact CD2-CH2 3.48Å; W22-W67 AromaticContact CD2-CZ2 3.01Å; W22-W67 HydrophobicContact CD2-CZ2 3.01Å; W22-W67 AromaticContact CE2-CZ2 3.4Å; W22-W67 VanDerWaalsContact CE2-CZ2 3.4Å; W22-W67 AromaticContact CE3-CH2 3.41Å; W22-W67 HydrophobicContact CE3-CH2 3.41Å; W22-W67 VanDerWaalsContact CE3-CH2 3.41Å; W22-W67 AromaticContact CE3-CZ2 3.48Å; W22-W67 HydrophobicContact CE3-CZ2 3.48Å; W22-W67 VanDerWaalsContact CE3-CZ2 3.48Å; W22-W67 AromaticContact CG-CE2 3.54Å; W22-W67 AromaticContact CG-CH2 3.53Å; W22-W67 HydrophobicContact CG-CH2 3.53Å; W22-W67 AromaticContact CG-CZ2 2.88Å; W22-W67 HydrophobicContact CG-CZ2 2.88Å; W22-W67 AromaticContact CG-NE1 3.93Å; W22-W67 HydrophobicContact CZ2-CZ2 4.17Å; W22-W67 HydrophobicContact CZ3-CH2 4.13Å; W22-W67 HydrophobicContact CZ3-CZ2 4.23Å; W22-W67 AromaticContact NE1-CE2 3.95Å; W22-W67 AromaticContact NE1-CZ2 3.52Å; W22-W67 AromaticContact NE1-NE1 3.8Å; E65-W67 PolarHBondContact O-N 3.19Å; E65-W67 PolarHBondContact OE2-NE1 3.37Å
68S63.6Low67.3Low32 Ų3285.7 Ų85.722%0.22441%0.409CS..  trans-86.5149.516169.90000108K59 E70 D71K59-S68 WeakPolarHBondContact CE-OG 3.06Å; K59-S68 VanDerWaalsContact NZ-N 3.19Å; K59-S68 PolarHBondContact NZ-OG 3.29Å; S68-E70 WeakPolarHBondContact CB-OE2 3.4Å; S68-E70 PolarHBondContact O-N 3.18Å; S68-E70 VanDerWaalsContact O-N 3.08Å; S68-E70 PolarHBondContact OG-OE2 2.99Å; S68-D71 PolarHBondContact O-N 3.29Å
69L52.2Low65.1Low103 Ų10388.2 Ų88.254%0.53942%0.424SS..Hα-helixtrans-53.6-32.7-179-77.6166.3000112D71 E72 F73L69-D71 VanDerWaalsContact C-N 3.32Å; L69-D71 PolarHBondContact O-N 3.45Å; L69-E72 PolarHBondContact O-N 3.35Å; L69-F73 WeakPolarHBondContact O-CD2 3.49Å; L69-F73 PolarHBondContact O-N 2.75Å
70E53.5Low63.2Low127 Ų12790.2 Ų90.259%0.59345%0.451SS*.Hα-helixtrans-64.6-30.6176.9-62.573.8-157.400113.6S68 L74S68-E70 WeakPolarHBondContact CB-OE2 3.4Å; S68-E70 PolarHBondContact O-N 3.18Å; S68-E70 VanDerWaalsContact O-N 3.08Å; S68-E70 PolarHBondContact OG-OE2 2.99Å; E70-L74 WeakPolarHBondContact O-CG 3.36Å; E70-L74 PolarHBondContact O-N 3.38Å
71D56.3Low61Low23 Ų2399.8 Ų99.812%0.12349%0.488CS..Hα-helixtrans-75.4-28.6178.1-114.8-23.3000112K55 K59 S68 L69 L74 N75K55-D71 IonicContact NZ-OD1 2.89Å; K55-D71 PolarHBondContact NZ-OD1 3.03Å; K59-D71 WeakPolarHBondContact CE-OD2 3.49Å; K59-D71 IonicContact NZ-OD2 3.15Å; K59-D71 PolarHBondContact NZ-OD2 2.82Å; S68-D71 PolarHBondContact O-N 3.29Å; L69-D71 VanDerWaalsContact C-N 3.32Å; L69-D71 PolarHBondContact O-N 3.45Å; D71-L74 PolarHBondContact O-N 3.15Å; D71-N75 VanDerWaalsContact O-CB 3.31Å; D71-N75 WeakPolarHBondContact O-CB 3.14Å; D71-N75 PolarHBondContact O-N 3.03Å; D71-N75 PolarHBondContact O-ND2 3.41Å
72E51.2Low59Low77 Ų77104.3 Ų104.336%0.3651%0.506SS..Hα-helixtrans-66-42.8174.9-168.1167.7-154.100110.6R19 L69 L74 Q76R19-E72 IonicContact CZ-OE2 3.82Å; R19-E72 VanDerWaalsContact NH1-CD 3.33Å; R19-E72 IonicContact NH1-OE1 3.68Å; R19-E72 PolarHBondContact NH1-OE1 3.1Å; R19-E72 VanDerWaalsContact NH1-OE1 3.15Å; R19-E72 IonicContact NH1-OE2 2.8Å; R19-E72 PolarHBondContact NH1-OE2 2.87Å; L69-E72 PolarHBondContact O-N 3.35Å; E72-L74 PolarHBondContact O-N 3.37Å; E72-Q76 WeakPolarHBondContact O-CB 3Å; E72-Q76 VanDerWaalsContact O-CG 3.22Å; E72-Q76 WeakPolarHBondContact O-CG 3.3Å; E72-Q76 PolarHBondContact O-N 3.23Å
73F45.3Very low56.5Low152 Ų152104.6 Ų104.667%0.66751%0.508SS*.Hα-helixtrans-64.4-38.3173.9-80.8-77.9000113.4L69 R77L69-F73 WeakPolarHBondContact O-CD2 3.49Å; L69-F73 PolarHBondContact O-N 2.75Å; F73-R77 WeakPolarHBondContact O-CB 3.37Å; F73-R77 PolarHBondContact O-N 2.65Å
74L41.4Very low54.6Low88 Ų88107.9 Ų107.946%0.46152%0.519SS..Hα-helixtrans-76.3-38-179.3-69.2177.4000112.4E70 D71 E72 R77 Y78E70-L74 WeakPolarHBondContact O-CG 3.36Å; E70-L74 PolarHBondContact O-N 3.38Å; D71-L74 PolarHBondContact O-N 3.15Å; E72-L74 PolarHBondContact O-N 3.37Å; L74-R77 PolarHBondContact O-N 3.3Å; L74-Y78 PolarHBondContact O-N 3.28Å
75N49.8Very low52.6Low98 Ų98108.3 Ų108.352%0.52452%0.524SS..Hα-helixtrans-70-33.1175.5-76.5-49.8000112.5D71 R77 Y78D71-N75 VanDerWaalsContact O-CB 3.31Å; D71-N75 WeakPolarHBondContact O-CB 3.14Å; D71-N75 PolarHBondContact O-N 3.03Å; D71-N75 PolarHBondContact O-ND2 3.41Å; N75-R77 VanDerWaalsContact C-N 3.34Å; N75-Y78 CarbonylContact O-C 3.59Å
76Q47.9Very low50.7Low148 Ų148111.3 Ų111.369%0.69254%0.538SS*.Hα-helixtrans-67.8-32.5172.8-76.1178.126.700112.8E72E72-Q76 WeakPolarHBondContact O-CB 3Å; E72-Q76 VanDerWaalsContact O-CG 3.22Å; E72-Q76 WeakPolarHBondContact O-CG 3.3Å; E72-Q76 PolarHBondContact O-N 3.23Å
77R41.1Very low49.2Very low191 Ų191114.4 Ų114.472%0.72155%0.553SS**Hα-helixtrans-90.4-25.2-178.3-162.2173.4-179.1170.31.4113.4F73 L74 N75F73-R77 WeakPolarHBondContact O-CB 3.37Å; F73-R77 PolarHBondContact O-N 2.65Å; L74-R77 PolarHBondContact O-N 3.3Å; N75-R77 VanDerWaalsContact C-N 3.34Å
78Y42Very low47.8Very low157 Ų157118.9 Ų118.962%0.61657%0.574SS**SBendtrans-142.893.8-179.8-65.3-77.9000110.4L74 N75 G80L74-Y78 PolarHBondContact O-N 3.28Å; N75-Y78 CarbonylContact O-C 3.59Å; Y78-G80 PolarHBondContact O-N 3.14Å
79P43.3Very low46.6Very low92 Ų92119.4 Ų119.460%0.59758%0.584SS**  trans-69.5105.4173.828.3-30.3000108.3Y81P79-Y81 WeakPolarHBondContact O-CD2 3.31Å; P79-Y81 WeakPolarHBondContact O-CE2 3.42Å; P79-Y81 PolarHBondContact O-N 3.46Å
80G48.7Very low46.5Very low61 Ų61119.8 Ų119.863%0.62959%0.586SS**SBendtrans49.160.8154.200000119Y78Y78-G80 PolarHBondContact O-N 3.14Å
81Y45.4Very low46.2Very low206 Ų206122.9 Ų122.981%0.80859%0.592SS**  trans-136.782.7163.5-57.8-75.5000112.2P79 K83P79-Y81 WeakPolarHBondContact O-CD2 3.31Å; P79-Y81 WeakPolarHBondContact O-CE2 3.42Å; P79-Y81 PolarHBondContact O-N 3.46Å; Y81-K83 VanDerWaalsContact C-N 3.26Å; Y81-K83 PolarHBondContact O-N 2.93Å
82F50.6Low45.7Very low184 Ų184128.8 Ų128.881%0.80762%0.619SS**  trans-81.284153.2-64.4-71.6000107.8V84F82-V84 PolarHBondContact O-N 3.25Å
83K37.8Very low45.6Very low154 Ų154134 Ų13467%0.6764%0.641SS**  trans-62.2120.4174-152179.5-170.2-142.60108.4Y81 D85 H86Y81-K83 VanDerWaalsContact C-N 3.26Å; Y81-K83 PolarHBondContact O-N 2.93Å; K83-D85 HydrophobicContact CD-CB 4.37Å; K83-D85 WeakPolarHBondContact CD-OD2 3.15Å; K83-D85 WeakPolarHBondContact CE-OD2 2.95Å; K83-D85 HydrophobicContact CG-CB 4.26Å; K83-D85 IonicContact NZ-OD2 2.7Å; K83-D85 PolarHBondContact NZ-OD2 3.41Å; K83-D85 PolarHBondContact O-N 3.33Å; K83-H86 PolarHBondContact O-N 2.7Å
84V48Very low45.8Very low114 Ų114135 Ų13569%0.69165%0.647SS**THydrogen-bonded Turntrans-57.6-10.6179.6-179.10000112.8F82 H86 I87F82-V84 PolarHBondContact O-N 3.25Å; V84-H86 PolarHBondContact O-N 3.2Å; V84-H86 VanDerWaalsContact O-N 3.14Å; V84-I87 HydrophobicContact CG1-CD1 4.41Å; V84-I87 PolarHBondContact O-N 2.99Å
85D48.3Very low46.2Very low99 Ų99139 Ų13953%0.52966%0.663SS.*THydrogen-bonded Turntrans-62.3-18.8179-64.4-13.1000114.5K83 I87 K88K83-D85 HydrophobicContact CD-CB 4.37Å; K83-D85 WeakPolarHBondContact CD-OD2 3.15Å; K83-D85 WeakPolarHBondContact CE-OD2 2.95Å; K83-D85 HydrophobicContact CG-CB 4.26Å; K83-D85 IonicContact NZ-OD2 2.7Å; K83-D85 PolarHBondContact NZ-OD2 3.41Å; K83-D85 PolarHBondContact O-N 3.33Å; D85-I87 PolarHBondContact O-N 2.84Å; D85-K88 PolarHBondContact O-N 2.99Å
86H44.5Very low45.8Very low156 Ų156143.8 Ų143.872%0.72268%0.68SS**Hα-helixtrans-72.6-15179.6-140.861000113.7K83 V84 K88K83-H86 PolarHBondContact O-N 2.7Å; V84-H86 PolarHBondContact O-N 3.2Å; V84-H86 VanDerWaalsContact O-N 3.14Å; H86-K88 VanDerWaalsContact C-N 3.35Å
87I50.3Low46.1Very low78 Ų78146 Ų14640%0.471%0.707SS.*Hα-helixtrans-79.2-21179.9-53.3179.4000111.4V84 D85V84-I87 HydrophobicContact CG1-CD1 4.41Å; V84-I87 PolarHBondContact O-N 2.99Å; D85-I87 PolarHBondContact O-N 2.84Å
88K43.3Very low46.3Very low156 Ų156143.8 Ų143.868%0.67871%0.706SS**Hα-helixtrans-72.9-32.9177.1-160.7176.4179.9-173.80112.1D85 H86D85-K88 PolarHBondContact O-N 2.99Å; H86-K88 VanDerWaalsContact C-N 3.35Å
89G38.7Very low46.5Very low43 Ų43143.1 Ų143.144%0.44371%0.711SS.*Hα-helixtrans-77.9-19.5-177.200000115.8
90I49.5Very low46.7Very low112 Ų112145.9 Ų145.957%0.57472%0.717SS**Hα-helixtrans-82.7-31.7-179.4-61175.1000111.1
91R46.4Very low46.6Very low191 Ų191150.9 Ų150.972%0.72172%0.722SS**Hα-helixtrans-71.9-32.1179.4-84.5-174.6-101.4-149.7-3.1113.6K93R91-K93 VanDerWaalsContact C-N 3.29Å; R91-K93 PolarHBondContact O-N 3.18Å
92E45.9Very low46.7Very low147 Ų147147.4 Ų147.469%0.68772%0.717SS**THydrogen-bonded Turntrans-75.2-10.9-179.3-74.1179.7-179.600114.5
93K50Low46.4Very low188 Ų188145 Ų14582%0.81771%0.711SS**THydrogen-bonded Turntrans-93.4-1.7177.9-69.6-162.4178.2-169.80114.9R91R91-K93 VanDerWaalsContact C-N 3.29Å; R91-K93 PolarHBondContact O-N 3.18Å
94Q48.8Very low47Very low172 Ų172144.4 Ų144.480%0.80471%0.714SS**SBendtrans-109.33.7-178.6-69.6-72-10.900113.4
95E51Low47Very low171 Ų171146.7 Ų146.780%0.79972%0.716SS**  trans-127.880.9178.2-153.7169.5-174.900110.7
96K40.7Very low46.9Very low199 Ų199150.7 Ų150.787%0.86573%0.731SS**  trans-147119.7154.6-144.2178.5-174.8-176.20109.8
97P53.2Low47.1Very low195 Ų195150.2 Ų150.2100%1.26673%0.732SS**  trans-67.10161.51.212.4000111.5

Retrieved 97 of 97 residues in 829.7 ms (Link to these results)

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