| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.4 | Very low | 42.5 | Very low | 252 Ų | 252 | 129.4 Ų | 129.4 | 100% | 1.241 | 68% | 0.676 | S | S | * | * | 0 | 95.5 | 0 | -83.4 | -175.1 | 146.1 | 0 | 0 | 110.6 | |||||
| 2 | S | 37.2 | Very low | 43 | Very low | 102 Ų | 102 | 124.8 Ų | 124.8 | 71% | 0.713 | 66% | 0.657 | S | S | * | * | trans | -131.3 | 18.6 | 176.5 | 70 | 0 | 0 | 0 | 0 | 114 | ||||
| 3 | R | 42.6 | Very low | 44 | Very low | 226 Ų | 226 | 123.7 Ų | 123.7 | 85% | 0.853 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | -4.8 | -169.9 | -78.4 | 171.6 | 81.7 | 153.5 | 0.7 | 115.9 | ||
| 4 | S | 37.8 | Very low | 44.6 | Very low | 90 Ų | 90 | 119.6 Ų | 119.6 | 63% | 0.629 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90 | -17.8 | -172.3 | 53.2 | 0 | 0 | 0 | 0 | 115.4 | ||
| 5 | R | 48 | Very low | 45.2 | Very low | 146 Ų | 146 | 116.8 Ų | 116.8 | 55% | 0.551 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.8 | -26.8 | -179.7 | -63 | -170.8 | -146.5 | -134.7 | 5.8 | 113.8 | ||
| 6 | L | 41.9 | Very low | 46.2 | Very low | 129 Ų | 129 | 114.6 Ų | 114.6 | 68% | 0.675 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -66.5 | -38.1 | 178.3 | -108 | 83.2 | 0 | 0 | 0 | 112.1 | S8 V9 T10 | L6-S8 PolarHBondContact O-N 3.35Å; L6-V9 PolarHBondContact O-N 3.22Å; L6-T10 WeakPolarHBondContact O-CG2 3Å; L6-T10 PolarHBondContact O-N 3.44Å; L6-T10 PolarHBondContact O-OG1 3.07Å; L6-T10 VanDerWaalsContact O-OG1 3.09Å |
| 7 | F | 40.5 | Very low | 46.9 | Very low | 163 Ų | 163 | 109.6 Ų | 109.6 | 72% | 0.715 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -67.3 | -31.5 | -174.8 | -109.8 | -86.6 | 0 | 0 | 0 | 114.2 | T10 S11 | F7-T10 WeakPolarHBondContact CA-OG1 3.35Å; F7-T10 PolarHBondContact O-OG1 3.17Å; F7-S11 VanDerWaalsContact O-CB 3.31Å; F7-S11 WeakPolarHBondContact O-CB 3.21Å; F7-S11 PolarHBondContact O-N 3.5Å |
| 8 | S | 47.6 | Very low | 47.7 | Very low | 79 Ų | 79 | 109.6 Ų | 109.6 | 55% | 0.552 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -76.9 | -33.3 | 177.9 | -174.7 | 0 | 0 | 0 | 0 | 112.1 | L6 V12 | L6-S8 PolarHBondContact O-N 3.35Å; S8-V12 WeakPolarHBondContact O-CG2 3.07Å; S8-V12 PolarHBondContact O-N 3.03Å |
| 9 | V | 46.8 | Very low | 48.1 | Very low | 87 Ų | 87 | 109.9 Ų | 109.9 | 53% | 0.527 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -75.2 | -42.5 | 180 | 176.4 | 0 | 0 | 0 | 0 | 109.7 | L6 S11 V12 I13 | L6-V9 PolarHBondContact O-N 3.22Å; V9-S11 VanDerWaalsContact C-N 3.33Å; V9-S11 PolarHBondContact O-N 3.32Å; V9-V12 PolarHBondContact O-N 3.03Å; V9-I13 HydrophobicContact CG1-CD1 3.54Å; V9-I13 HydrophobicContact CG1-CG1 4.33Å; V9-I13 WeakPolarHBondContact O-CB 3.18Å; V9-I13 WeakPolarHBondContact O-CD1 3.14Å; V9-I13 WeakPolarHBondContact O-CG1 3.07Å; V9-I13 PolarHBondContact O-N 3.48Å |
| 10 | T | 43.8 | Very low | 48.6 | Very low | 79 Ų | 79 | 106.7 Ų | 106.7 | 49% | 0.485 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -64.8 | -34.9 | 175 | 54.2 | 0 | 0 | 0 | 0 | 112.8 | L6 F7 S14 | L6-T10 WeakPolarHBondContact O-CG2 3Å; L6-T10 PolarHBondContact O-N 3.44Å; L6-T10 PolarHBondContact O-OG1 3.07Å; L6-T10 VanDerWaalsContact O-OG1 3.09Å; F7-T10 WeakPolarHBondContact CA-OG1 3.35Å; F7-T10 PolarHBondContact O-OG1 3.17Å; T10-S14 VanDerWaalsContact O-CB 3.27Å; T10-S14 WeakPolarHBondContact O-CB 3.49Å; T10-S14 PolarHBondContact O-N 3.47Å |
| 11 | S | 43.1 | Very low | 49 | Very low | 70 Ų | 70 | 107 Ų | 107 | 49% | 0.49 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -67 | -44.4 | 176.2 | 176.8 | 0 | 0 | 0 | 0 | 112.5 | F7 V9 S14 T15 | F7-S11 VanDerWaalsContact O-CB 3.31Å; F7-S11 WeakPolarHBondContact O-CB 3.21Å; F7-S11 PolarHBondContact O-N 3.5Å; V9-S11 VanDerWaalsContact C-N 3.33Å; V9-S11 PolarHBondContact O-N 3.32Å; S11-S14 WeakPolarHBondContact O-CB 3.25Å; S11-S14 PolarHBondContact O-N 3.21Å; S11-T15 PolarHBondContact O-N 3.37Å; S11-T15 PolarHBondContact O-OG1 3.4Å; S11-T15 VanDerWaalsContact O-OG1 3.05Å |
| 12 | V | 48.3 | Very low | 50 | Low | 75 Ų | 75 | 98.6 Ų | 98.6 | 46% | 0.455 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -71 | -36.1 | 178.2 | 176.6 | 0 | 0 | 0 | 0 | 111.4 | S8 V9 S14 T15 I16 | S8-V12 WeakPolarHBondContact O-CG2 3.07Å; S8-V12 PolarHBondContact O-N 3.03Å; V9-V12 PolarHBondContact O-N 3.03Å; V12-S14 VanDerWaalsContact C-N 3.31Å; V12-S14 PolarHBondContact O-N 3.48Å; V12-T15 PolarHBondContact O-N 3.5Å; V12-I16 HydrophobicContact CG1-CD1 3.63Å; V12-I16 HydrophobicContact CG1-CG1 4.29Å; V12-I16 WeakPolarHBondContact O-CB 3.33Å; V12-I16 VanDerWaalsContact O-CG1 3.26Å; V12-I16 WeakPolarHBondContact O-CG1 3.42Å; V12-I16 PolarHBondContact O-N 3.42Å |
| 13 | I | 56.2 | Low | 50.9 | Low | 110 Ų | 110 | 98.9 Ų | 98.9 | 56% | 0.564 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.5 | -38.4 | 172 | -67.7 | 165.8 | 0 | 0 | 0 | 110.8 | V9 G17 | V9-I13 HydrophobicContact CG1-CD1 3.54Å; V9-I13 HydrophobicContact CG1-CG1 4.33Å; V9-I13 WeakPolarHBondContact O-CB 3.18Å; V9-I13 WeakPolarHBondContact O-CD1 3.14Å; V9-I13 WeakPolarHBondContact O-CG1 3.07Å; V9-I13 PolarHBondContact O-N 3.48Å; I13-G17 WeakPolarHBondContact O-CA 3.23Å; I13-G17 PolarHBondContact O-N 3.32Å |
| 14 | S | 51.9 | Low | 51.5 | Low | 66 Ų | 66 | 93.1 Ų | 93.1 | 46% | 0.462 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.3 | -45.8 | 176.6 | 179.4 | 0 | 0 | 0 | 0 | 111.5 | T10 S11 V12 G17 I18 | T10-S14 VanDerWaalsContact O-CB 3.27Å; T10-S14 WeakPolarHBondContact O-CB 3.49Å; T10-S14 PolarHBondContact O-N 3.47Å; S11-S14 WeakPolarHBondContact O-CB 3.25Å; S11-S14 PolarHBondContact O-N 3.21Å; V12-S14 VanDerWaalsContact C-N 3.31Å; V12-S14 PolarHBondContact O-N 3.48Å; S14-G17 PolarHBondContact O-N 3.28Å; S14-I18 WeakPolarHBondContact O-CB 3.25Å; S14-I18 VanDerWaalsContact O-CD1 3.3Å; S14-I18 WeakPolarHBondContact O-CD1 3.3Å; S14-I18 WeakPolarHBondContact O-CG1 3.37Å; S14-I18 PolarHBondContact O-N 2.84Å |
| 15 | T | 54.6 | Low | 52.5 | Low | 78 Ų | 78 | 94.7 Ų | 94.7 | 48% | 0.479 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -67.3 | -41.1 | 179.2 | -50.4 | 0 | 0 | 0 | 0 | 112.6 | S11 V12 I18 L19 | S11-T15 PolarHBondContact O-N 3.37Å; S11-T15 PolarHBondContact O-OG1 3.4Å; S11-T15 VanDerWaalsContact O-OG1 3.05Å; V12-T15 PolarHBondContact O-N 3.5Å; T15-I18 PolarHBondContact O-N 3.35Å; T15-L19 HydrophobicContact CG2-CD1 4.36Å; T15-L19 PolarHBondContact O-N 2.84Å; T15-L19 VanDerWaalsContact O-N 3.16Å |
| 16 | I | 60.4 | Low | 52.8 | Low | 82 Ų | 82 | 93 Ų | 93 | 42% | 0.421 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -69.2 | -40.3 | 175.9 | -66 | 170.9 | 0 | 0 | 0 | 110.4 | V12 I18 L19 C20 | V12-I16 HydrophobicContact CG1-CD1 3.63Å; V12-I16 HydrophobicContact CG1-CG1 4.29Å; V12-I16 WeakPolarHBondContact O-CB 3.33Å; V12-I16 VanDerWaalsContact O-CG1 3.26Å; V12-I16 WeakPolarHBondContact O-CG1 3.42Å; V12-I16 PolarHBondContact O-N 3.42Å; I16-I18 VanDerWaalsContact C-N 3.35Å; I16-I18 PolarHBondContact O-N 2.85Å; I16-L19 PolarHBondContact O-N 3.48Å; I16-C20 WeakPolarHBondContact O-CB 3.34Å; I16-C20 PolarHBondContact O-N 3.4Å |
| 17 | G | 58 | Low | 53.4 | Low | 29 Ų | 29 | 92.2 Ų | 92.2 | 30% | 0.299 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -58.9 | -44.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | I13 S14 L19 C20 L21 | I13-G17 WeakPolarHBondContact O-CA 3.23Å; I13-G17 PolarHBondContact O-N 3.32Å; S14-G17 PolarHBondContact O-N 3.28Å; G17-L19 VanDerWaalsContact C-N 3.33Å; G17-L19 PolarHBondContact O-N 3.23Å; G17-C20 PolarHBondContact O-N 2.82Å; G17-L21 WeakPolarHBondContact O-CB 3.39Å; G17-L21 WeakPolarHBondContact O-CD1 3.42Å; G17-L21 WeakPolarHBondContact O-CG 3.13Å; G17-L21 PolarHBondContact O-N 3.21Å |
| 18 | I | 60.9 | Low | 54 | Low | 110 Ų | 110 | 90.7 Ų | 90.7 | 56% | 0.564 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.1 | -32.6 | 177.9 | -68.4 | 161.2 | 0 | 0 | 0 | 112.3 | S14 T15 I16 P22 | S14-I18 WeakPolarHBondContact O-CB 3.25Å; S14-I18 VanDerWaalsContact O-CD1 3.3Å; S14-I18 WeakPolarHBondContact O-CD1 3.3Å; S14-I18 WeakPolarHBondContact O-CG1 3.37Å; S14-I18 PolarHBondContact O-N 2.84Å; T15-I18 PolarHBondContact O-N 3.35Å; I16-I18 VanDerWaalsContact C-N 3.35Å; I16-I18 PolarHBondContact O-N 2.85Å; I18-P22 WeakPolarHBondContact O-CD 3.34Å; I18-P22 WeakPolarHBondContact O-CG 3.35Å |
| 19 | L | 56.5 | Low | 54.1 | Low | 115 Ų | 115 | 90.5 Ų | 90.5 | 60% | 0.602 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -81.1 | -29.6 | 176 | -77.3 | 161.5 | 0 | 0 | 0 | 113.2 | T15 I16 G17 P22 | T15-L19 HydrophobicContact CG2-CD1 4.36Å; T15-L19 PolarHBondContact O-N 2.84Å; T15-L19 VanDerWaalsContact O-N 3.16Å; I16-L19 PolarHBondContact O-N 3.48Å; G17-L19 VanDerWaalsContact C-N 3.33Å; G17-L19 PolarHBondContact O-N 3.23Å; L19-P22 WeakPolarHBondContact O-CD 3.19Å; L19-P22 VanDerWaalsContact O-CG 3.32Å; L19-P22 WeakPolarHBondContact O-CG 3.26Å |
| 20 | C | 57.4 | Low | 54.2 | Low | 45 Ų | 45 | 92.9 Ų | 92.9 | 30% | 0.304 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -83.3 | -34 | -176.9 | -151 | 0 | 0 | 0 | 0 | 112.3 | I16 G17 L23 F24 | I16-C20 WeakPolarHBondContact O-CB 3.34Å; I16-C20 PolarHBondContact O-N 3.4Å; G17-C20 PolarHBondContact O-N 2.82Å; C20-L23 PolarHBondContact O-N 2.84Å; C20-F24 HydrophobicContact CB-CD2 4.43Å; C20-F24 HydrophobicContact CB-CE2 4.5Å; C20-F24 VanDerWaalsContact O-CD2 3.27Å; C20-F24 WeakPolarHBondContact O-CD2 3.43Å; C20-F24 PolarHBondContact O-N 2.86Å; C20-F24 VanDerWaalsContact SG-CD2 3.57Å; C20-F24 WeakPolarHBondContact SG-CE2 3.32Å |
| 21 | L | 56.5 | Low | 54.4 | Low | 115 Ų | 115 | 95.9 Ų | 95.9 | 60% | 0.602 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -53.7 | -48.8 | 174.6 | -76.4 | 166.9 | 0 | 0 | 0 | 113.8 | G17 L23 F24 Q25 | G17-L21 WeakPolarHBondContact O-CB 3.39Å; G17-L21 WeakPolarHBondContact O-CD1 3.42Å; G17-L21 WeakPolarHBondContact O-CG 3.13Å; G17-L21 PolarHBondContact O-N 3.21Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L21-L23 PolarHBondContact O-N 3.48Å; L21-F24 PolarHBondContact O-N 3.3Å; L21-Q25 WeakPolarHBondContact O-CB 3.38Å; L21-Q25 WeakPolarHBondContact O-CG 3.38Å; L21-Q25 PolarHBondContact O-N 3.48Å |
| 22 | P | 59.8 | Low | 54.5 | Low | 74 Ų | 74 | 97.7 Ų | 97.7 | 48% | 0.481 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -69.2 | -29 | 177.6 | 26.7 | -34.7 | 0 | 0 | 0 | 112.7 | I18 L19 L26 | I18-P22 WeakPolarHBondContact O-CD 3.34Å; I18-P22 WeakPolarHBondContact O-CG 3.35Å; L19-P22 WeakPolarHBondContact O-CD 3.19Å; L19-P22 VanDerWaalsContact O-CG 3.32Å; L19-P22 WeakPolarHBondContact O-CG 3.26Å; P22-L26 VanDerWaalsContact O-CB 3.23Å; P22-L26 WeakPolarHBondContact O-CB 3.32Å; P22-L26 PolarHBondContact O-N 3.43Å |
| 23 | L | 56.3 | Low | 54.5 | Low | 108 Ų | 108 | 99.7 Ų | 99.7 | 57% | 0.565 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -70.6 | -41.5 | 175.9 | -69.7 | 172.1 | 0 | 0 | 0 | 111.9 | C20 L21 L26 V27 | C20-L23 PolarHBondContact O-N 2.84Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L21-L23 PolarHBondContact O-N 3.48Å; L23-L26 PolarHBondContact O-N 2.96Å; L23-V27 WeakPolarHBondContact O-CG2 3.49Å; L23-V27 PolarHBondContact O-N 2.91Å |
| 24 | F | 55.7 | Low | 54 | Low | 105 Ų | 105 | 101.8 Ų | 101.8 | 46% | 0.461 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -67.7 | -39.6 | 172.5 | -81.1 | -66.8 | 0 | 0 | 0 | 111.8 | C20 L21 L26 V27 L28 L59 | C20-F24 HydrophobicContact CB-CD2 4.43Å; C20-F24 HydrophobicContact CB-CE2 4.5Å; C20-F24 VanDerWaalsContact O-CD2 3.27Å; C20-F24 WeakPolarHBondContact O-CD2 3.43Å; C20-F24 PolarHBondContact O-N 2.86Å; C20-F24 VanDerWaalsContact SG-CD2 3.57Å; C20-F24 WeakPolarHBondContact SG-CE2 3.32Å; L21-F24 PolarHBondContact O-N 3.3Å; F24-L26 VanDerWaalsContact C-N 3.33Å; F24-V27 PolarHBondContact O-N 3.21Å; F24-L28 WeakPolarHBondContact O-CB 3.19Å; F24-L28 WeakPolarHBondContact O-CD1 3.43Å; F24-L28 PolarHBondContact O-N 3.48Å; F24-L59 HydrophobicContact CE1-CD1 4.21Å; F24-L59 HydrophobicContact CZ-CD1 4.26Å |
| 25 | Q | 57.3 | Low | 54.2 | Low | 124 Ų | 124 | 108 Ų | 108 | 58% | 0.579 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -61.3 | -42.2 | 172.6 | -72.4 | -75.9 | -22.3 | 0 | 0 | 110.8 | L21 L28 S29 | L21-Q25 WeakPolarHBondContact O-CB 3.38Å; L21-Q25 WeakPolarHBondContact O-CG 3.38Å; L21-Q25 PolarHBondContact O-N 3.48Å; Q25-L28 CarbonylContact O-C 3.52Å; Q25-L28 PolarHBondContact O-N 3.3Å; Q25-S29 WeakPolarHBondContact O-CA 3.39Å; Q25-S29 WeakPolarHBondContact O-CB 3.48Å; Q25-S29 PolarHBondContact O-N 2.85Å; Q25-S29 PolarHBondContact O-OG 3.4Å |
| 26 | L | 55.6 | Low | 54.2 | Low | 110 Ų | 110 | 111 Ų | 111 | 58% | 0.576 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -62.9 | -44.7 | 178.4 | -174.5 | 70.1 | 0 | 0 | 0 | 112.1 | P22 L23 F24 L28 S29 | P22-L26 VanDerWaalsContact O-CB 3.23Å; P22-L26 WeakPolarHBondContact O-CB 3.32Å; P22-L26 PolarHBondContact O-N 3.43Å; L23-L26 PolarHBondContact O-N 2.96Å; F24-L26 VanDerWaalsContact C-N 3.33Å; L26-L28 VanDerWaalsContact C-N 3.29Å; L26-L28 PolarHBondContact O-N 3.39Å; L26-S29 PolarHBondContact O-N 3.44Å |
| 27 | V | 55.2 | Low | 53.9 | Low | 112 Ų | 112 | 115.1 Ų | 115.1 | 68% | 0.679 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -67.8 | -28.2 | 177.1 | 171 | 0 | 0 | 0 | 0 | 112.4 | L23 F24 | L23-V27 WeakPolarHBondContact O-CG2 3.49Å; L23-V27 PolarHBondContact O-N 2.91Å; F24-V27 PolarHBondContact O-N 3.21Å |
| 28 | L | 52.7 | Low | 53.5 | Low | 132 Ų | 132 | 121.9 Ų | 121.9 | 69% | 0.691 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -88.7 | -18.5 | 174.7 | -94.8 | 73.2 | 0 | 0 | 0 | 113.8 | F24 Q25 L26 D30 | F24-L28 WeakPolarHBondContact O-CB 3.19Å; F24-L28 WeakPolarHBondContact O-CD1 3.43Å; F24-L28 PolarHBondContact O-N 3.48Å; Q25-L28 CarbonylContact O-C 3.52Å; Q25-L28 PolarHBondContact O-N 3.3Å; L26-L28 VanDerWaalsContact C-N 3.29Å; L26-L28 PolarHBondContact O-N 3.39Å; L28-D30 VanDerWaalsContact C-N 3.35Å |
| 29 | S | 48.8 | Very low | 53 | Low | 74 Ų | 74 | 123.4 Ų | 123.4 | 52% | 0.517 | 67% | 0.667 | S | S | . | * | H | α-helix | trans | -82 | -10.2 | -173 | -69.5 | 0 | 0 | 0 | 0 | 113.7 | Q25 L26 L31 | Q25-S29 WeakPolarHBondContact O-CA 3.39Å; Q25-S29 WeakPolarHBondContact O-CB 3.48Å; Q25-S29 PolarHBondContact O-N 2.85Å; Q25-S29 PolarHBondContact O-OG 3.4Å; L26-S29 PolarHBondContact O-N 3.44Å; S29-L31 PolarHBondContact O-N 2.86Å |
| 30 | D | 48.7 | Very low | 52.7 | Low | 138 Ų | 138 | 123.8 Ų | 123.8 | 74% | 0.738 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.7 | 18 | 176.4 | -81.4 | -25.1 | 0 | 0 | 0 | 114 | L28 P32 | L28-D30 VanDerWaalsContact C-N 3.35Å; D30-P32 WeakPolarHBondContact O-CD 3.49Å |
| 31 | L | 47.9 | Very low | 52.3 | Low | 142 Ų | 142 | 127.4 Ų | 127.4 | 74% | 0.743 | 69% | 0.69 | S | S | * | * | trans | -107.8 | 79.9 | 164.6 | -158.1 | 73.3 | 0 | 0 | 0 | 109 | S29 C33 | S29-L31 PolarHBondContact O-N 2.86Å; L31-C33 PolarHBondContact O-N 2.95Å | ||
| 32 | P | 46.5 | Very low | 52.1 | Low | 108 Ų | 108 | 132.5 Ų | 132.5 | 70% | 0.701 | 70% | 0.703 | S | S | * | * | trans | -62 | 108.6 | 166.9 | 27.7 | -30.8 | 0 | 0 | 0 | 106.6 | D30 E34 | D30-P32 WeakPolarHBondContact O-CD 3.49Å; P32-E34 PolarHBondContact O-N 3.12Å | ||
| 33 | C | 46.8 | Very low | 51.8 | Low | 116 Ų | 116 | 134.4 Ų | 134.4 | 78% | 0.784 | 71% | 0.709 | S | S | * | * | trans | -66.1 | 92.3 | 159.3 | -90.1 | 0 | 0 | 0 | 0 | 106.3 | L31 E35 | L31-C33 PolarHBondContact O-N 2.95Å; C33-E35 PolarHBondContact O-N 3.21Å | ||
| 34 | E | 46 | Very low | 51.7 | Low | 155 Ų | 155 | 136.8 Ų | 136.8 | 72% | 0.724 | 72% | 0.723 | S | S | * | * | trans | -63.5 | 107.1 | 159.2 | -170 | 114.9 | 87 | 0 | 0 | 106.4 | P32 D36 | P32-E34 PolarHBondContact O-N 3.12Å; E34-D36 PolarHBondContact O-N 2.84Å | ||
| 35 | E | 55.7 | Low | 51.7 | Low | 197 Ų | 197 | 140 Ų | 140 | 92% | 0.921 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | 12.4 | -174.4 | 57.7 | 173.1 | 163.6 | 0 | 0 | 114.1 | C33 | C33-E35 PolarHBondContact O-N 3.21Š|
| 36 | D | 54.8 | Low | 51.9 | Low | 141 Ų | 141 | 143.6 Ų | 143.6 | 75% | 0.754 | 76% | 0.755 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -148.7 | 43.4 | -174.8 | -163 | 37.4 | 0 | 0 | 0 | 116.1 | E34 | E34-D36 PolarHBondContact O-N 2.84Š|
| 37 | E | 55 | Low | 52.1 | Low | 168 Ų | 168 | 142.4 Ų | 142.4 | 79% | 0.785 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -129 | 99.7 | 159.1 | -72.5 | -164.6 | 160 | 0 | 0 | 111.1 | ||
| 38 | M | 49.6 | Very low | 52.4 | Low | 171 Ų | 171 | 143.1 Ų | 143.1 | 84% | 0.842 | 75% | 0.748 | S | S | * | * | trans | 5.5 | 130.4 | 162 | -65.7 | -175.5 | -170.2 | 0 | 0 | 117.1 | V40 | M38-V40 VanDerWaalsContact C-N 3.29Å; M38-V40 WeakPolarHBondContact O-CG2 3.31Å; M38-V40 PolarHBondContact O-N 3.33Å | ||
| 39 | C | 50.5 | Low | 53.1 | Low | 142 Ų | 142 | 138.9 Ų | 138.9 | 96% | 0.959 | 74% | 0.736 | S | S | * | * | trans | -33.3 | 82.5 | 156.8 | -158.8 | 0 | 0 | 0 | 0 | 113.6 | N41 | C39-N41 PolarHBondContact O-N 3.4Š| ||
| 40 | V | 49 | Very low | 54.5 | Low | 123 Ų | 123 | 145.4 Ų | 145.4 | 75% | 0.745 | 75% | 0.75 | S | S | * | * | trans | -85.1 | 103.8 | 170 | -176.6 | 0 | 0 | 0 | 0 | 106.7 | M38 Y42 | M38-V40 VanDerWaalsContact C-N 3.29Å; M38-V40 WeakPolarHBondContact O-CG2 3.31Å; M38-V40 PolarHBondContact O-N 3.33Å; V40-Y42 PolarHBondContact O-N 3.28Å | ||
| 41 | N | 50.5 | Low | 55.6 | Low | 121 Ų | 121 | 144.2 Ų | 144.2 | 65% | 0.647 | 74% | 0.736 | S | S | * | * | trans | -5.4 | 94.7 | 162.7 | -174.1 | 31.7 | 0 | 0 | 0 | 114.9 | C39 N43 | C39-N41 PolarHBondContact O-N 3.4Å; N41-N43 PolarHBondContact O-N 2.93Å; N41-N43 PolarHBondContact OD1-ND2 3.46Å | ||
| 42 | Y | 51.8 | Low | 57.2 | Low | 222 Ų | 222 | 141.8 Ų | 141.8 | 87% | 0.871 | 72% | 0.722 | S | S | * | * | trans | -78.4 | 28.1 | -174.7 | -135.7 | -89.3 | 0 | 0 | 0 | 113.6 | V40 | V40-Y42 PolarHBondContact O-N 3.28Š| ||
| 43 | N | 52.9 | Low | 59 | Low | 113 Ų | 113 | 145.2 Ų | 145.2 | 60% | 0.604 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -87.4 | -23.9 | -162.7 | -99.4 | -51 | 0 | 0 | 0 | 116.8 | N41 | N41-N43 PolarHBondContact O-N 2.93Å; N41-N43 PolarHBondContact OD1-ND2 3.46Å |
| 44 | D | 55.8 | Low | 60.7 | Low | 159 Ų | 159 | 143.3 Ų | 143.3 | 85% | 0.85 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -146.1 | 32.2 | -170.4 | -71.7 | -60.9 | 0 | 0 | 0 | 115.3 | ||
| 45 | Q | 55.5 | Low | 62.4 | Low | 172 Ų | 172 | 141 Ų | 141 | 80% | 0.804 | 70% | 0.695 | S | S | * | * | trans | -119.9 | 88.7 | 169.9 | -90 | 179.3 | 9.4 | 0 | 0 | 110.8 | P47 | Q45-P47 HydrophobicContact CB-CG 4.36Å; Q45-P47 WeakPolarHBondContact O-CD 3.27Å | ||
| 46 | H | 60 | Low | 63.8 | Low | 199 Ų | 199 | 135.7 Ų | 135.7 | 92% | 0.921 | 67% | 0.673 | S | S | * | * | trans | -88.9 | 69.8 | 154.4 | -90.4 | -51.9 | 0 | 0 | 0 | 111.8 | ||||
| 47 | P | 61.5 | Low | 65.4 | Low | 86 Ų | 86 | 134.7 Ų | 134.7 | 56% | 0.558 | 67% | 0.666 | S | S | * | * | trans | -101.4 | 42.7 | 169.6 | 39.8 | -32.6 | 0 | 0 | 0 | 110.2 | Q45 | Q45-P47 HydrophobicContact CB-CG 4.36Å; Q45-P47 WeakPolarHBondContact O-CD 3.27Å | ||
| 48 | K | 61.5 | Low | 66.9 | Low | 126 Ų | 126 | 131 Ų | 131 | 55% | 0.548 | 66% | 0.655 | S | S | . | * | trans | -146.4 | 14.2 | -159.3 | -78.5 | -161.8 | -177.7 | 165.9 | 0 | 118 | Y51 I52 | K48-Y51 VanDerWaalsContact CA-CE1 3.43Å; K48-Y51 HydrophobicContact CB-CD1 4.26Å; K48-Y51 HydrophobicContact CB-CE1 3.47Å; K48-Y51 VanDerWaalsContact CB-CE1 3.47Å; K48-Y51 HydrophobicContact CD-CE1 4.07Å; K48-Y51 HydrophobicContact CG-CD1 4.32Å; K48-Y51 HydrophobicContact CG-CE1 3.54Å; K48-Y51 WeakPolarHBondContact O-CD1 3.36Å; K48-Y51 WeakPolarHBondContact O-CE1 3.33Å; K48-I52 WeakPolarHBondContact O-CD1 3.42Å; K48-I52 WeakPolarHBondContact O-CG1 3.49Å | ||
| 49 | G | 66.2 | Low | 68.5 | Low | 43 Ų | 43 | 126.4 Ų | 126.4 | 44% | 0.443 | 63% | 0.634 | S | S | . | * | S | Bend | trans | -85.3 | -48.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | Y51 I52 W53 | G49-Y51 PolarHBondContact O-N 3.45Å; G49-I52 PolarHBondContact O-N 2.85Å; G49-W53 PolarHBondContact O-N 2.88Å |
| 50 | W | 77.4 | Confident | 70.2 | Confident | 211 Ų | 211 | 122.9 Ų | 122.9 | 80% | 0.799 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -68.3 | -38.5 | -167.5 | -167.1 | 48.9 | 0 | 0 | 0 | 113.5 | I52 W53 I54 | W50-I52 VanDerWaalsContact C-N 3.3Å; W50-I52 PolarHBondContact O-N 3.49Å; W50-W53 PolarHBondContact O-N 3.29Å; W50-I54 WeakPolarHBondContact O-CG1 3.46Å; W50-I54 PolarHBondContact O-N 2.95Å |
| 51 | Y | 73.7 | Confident | 72.1 | Confident | 114 Ų | 114 | 119.6 Ų | 119.6 | 45% | 0.447 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -66 | -32.6 | 178.4 | 83.6 | -90.8 | 0 | 0 | 0 | 112.4 | K48 G49 W53 I54 L55 | K48-Y51 VanDerWaalsContact CA-CE1 3.43Å; K48-Y51 HydrophobicContact CB-CD1 4.26Å; K48-Y51 HydrophobicContact CB-CE1 3.47Å; K48-Y51 VanDerWaalsContact CB-CE1 3.47Å; K48-Y51 HydrophobicContact CD-CE1 4.07Å; K48-Y51 HydrophobicContact CG-CD1 4.32Å; K48-Y51 HydrophobicContact CG-CE1 3.54Å; K48-Y51 WeakPolarHBondContact O-CD1 3.36Å; K48-Y51 WeakPolarHBondContact O-CE1 3.33Å; G49-Y51 PolarHBondContact O-N 3.45Å; Y51-W53 VanDerWaalsContact C-N 3.34Å; Y51-I54 PolarHBondContact O-N 2.91Å; Y51-L55 HydrophobicContact CD2-CD1 3.64Å; Y51-L55 HydrophobicContact CD2-CG 4.48Å; Y51-L55 HydrophobicContact CE2-CD1 3.97Å; Y51-L55 WeakPolarHBondContact O-CB 3.23Å; Y51-L55 WeakPolarHBondContact O-CG 3.11Å; Y51-L55 PolarHBondContact O-N 3.4Å |
| 52 | I | 79.8 | Confident | 73.8 | Confident | 90 Ų | 90 | 116.7 Ų | 116.7 | 46% | 0.462 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -64.4 | -44.6 | 177.2 | -60.9 | 176.7 | 0 | 0 | 0 | 109.4 | K48 G49 W50 I54 L55 L56 | K48-I52 WeakPolarHBondContact O-CD1 3.42Å; K48-I52 WeakPolarHBondContact O-CG1 3.49Å; G49-I52 PolarHBondContact O-N 2.85Å; W50-I52 VanDerWaalsContact C-N 3.3Å; W50-I52 PolarHBondContact O-N 3.49Å; I52-I54 PolarHBondContact O-N 3.05Å; I52-L55 PolarHBondContact O-N 3.43Å; I52-L56 VanDerWaalsContact O-CB 3.3Å; I52-L56 WeakPolarHBondContact O-CB 3.37Å; I52-L56 PolarHBondContact O-N 2.83Å |
| 53 | W | 84.5 | Confident | 75.5 | Confident | 180 Ų | 180 | 111.6 Ų | 111.6 | 68% | 0.682 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -62.4 | -41.3 | 175.3 | -74.4 | 105.9 | 0 | 0 | 0 | 112.4 | G49 W50 Y51 L56 L57 | G49-W53 PolarHBondContact O-N 2.88Å; W50-W53 PolarHBondContact O-N 3.29Å; Y51-W53 VanDerWaalsContact C-N 3.34Å; W53-L56 HydrophobicContact CE3-CD2 4.31Å; W53-L56 HydrophobicContact CZ3-CD2 4.35Å; W53-L56 PolarHBondContact O-N 2.86Å; W53-L57 WeakPolarHBondContact O-CB 3.36Å; W53-L57 PolarHBondContact O-N 3.46Å |
| 54 | I | 82.4 | Confident | 77.3 | Confident | 76 Ų | 76 | 111.6 Ų | 111.6 | 39% | 0.39 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -65.6 | -45.7 | 176.7 | -65.3 | -64.5 | 0 | 0 | 0 | 111.3 | W50 Y51 I52 L56 L57 V58 | W50-I54 WeakPolarHBondContact O-CG1 3.46Å; W50-I54 PolarHBondContact O-N 2.95Å; Y51-I54 PolarHBondContact O-N 2.91Å; I52-I54 PolarHBondContact O-N 3.05Å; I54-L56 VanDerWaalsContact C-N 3.34Å; I54-L56 PolarHBondContact O-N 3.26Å; I54-L57 WeakPolarHBondContact O-CB 3.33Å; I54-L57 PolarHBondContact O-N 3.16Å; I54-V58 WeakPolarHBondContact O-CG2 3.31Å; I54-V58 PolarHBondContact O-N 3.42Å |
| 55 | L | 82.4 | Confident | 78.7 | Confident | 106 Ų | 106 | 107.7 Ų | 107.7 | 56% | 0.555 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -60.5 | -43.7 | 176.1 | -77.1 | 172.5 | 0 | 0 | 0 | 111.6 | Y51 I52 L57 V58 L59 | Y51-L55 HydrophobicContact CD2-CD1 3.64Å; Y51-L55 HydrophobicContact CD2-CG 4.48Å; Y51-L55 HydrophobicContact CE2-CD1 3.97Å; Y51-L55 WeakPolarHBondContact O-CB 3.23Å; Y51-L55 WeakPolarHBondContact O-CG 3.11Å; Y51-L55 PolarHBondContact O-N 3.4Å; I52-L55 PolarHBondContact O-N 3.43Å; L55-L57 VanDerWaalsContact C-N 3.33Å; L55-L57 PolarHBondContact O-N 3.4Å; L55-V58 PolarHBondContact O-N 3Å; L55-L59 WeakPolarHBondContact O-CB 3.36Å; L55-L59 PolarHBondContact O-N 3.28Å |
| 56 | L | 84.4 | Confident | 80.1 | Confident | 87 Ų | 87 | 101 Ų | 101 | 46% | 0.455 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.8 | -43.4 | 175.8 | -177.1 | 65.7 | 0 | 0 | 0 | 111.2 | I52 W53 I54 L59 V60 | I52-L56 VanDerWaalsContact O-CB 3.3Å; I52-L56 WeakPolarHBondContact O-CB 3.37Å; I52-L56 PolarHBondContact O-N 2.83Å; W53-L56 HydrophobicContact CE3-CD2 4.31Å; W53-L56 HydrophobicContact CZ3-CD2 4.35Å; W53-L56 PolarHBondContact O-N 2.86Å; I54-L56 VanDerWaalsContact C-N 3.34Å; I54-L56 PolarHBondContact O-N 3.26Å; L56-L59 PolarHBondContact O-N 2.91Å; L56-V60 VanDerWaalsContact O-CG2 3.31Å; L56-V60 WeakPolarHBondContact O-CG2 3.38Å; L56-V60 PolarHBondContact O-N 3.2Å |
| 57 | L | 88.8 | Confident | 81.2 | Confident | 119 Ų | 119 | 93.8 Ų | 93.8 | 62% | 0.623 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -62.2 | -44.9 | 177.7 | -172.5 | 71.9 | 0 | 0 | 0 | 111.7 | W53 I54 L55 L59 V60 A61 | W53-L57 WeakPolarHBondContact O-CB 3.36Å; W53-L57 PolarHBondContact O-N 3.46Å; I54-L57 WeakPolarHBondContact O-CB 3.33Å; I54-L57 PolarHBondContact O-N 3.16Å; L55-L57 VanDerWaalsContact C-N 3.33Å; L55-L57 PolarHBondContact O-N 3.4Å; L57-L59 VanDerWaalsContact C-N 3.33Å; L57-L59 PolarHBondContact O-N 3.41Å; L57-V60 PolarHBondContact O-N 3.48Å; L57-A61 WeakPolarHBondContact O-CB 2.92Å; L57-A61 PolarHBondContact O-N 2.94Å |
| 58 | V | 86.9 | Confident | 82.5 | Confident | 92 Ų | 92 | 93.8 Ų | 93.8 | 56% | 0.558 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.5 | -42.8 | 177 | 171.7 | 0 | 0 | 0 | 0 | 110.8 | I54 L55 A61 A62 | I54-V58 WeakPolarHBondContact O-CG2 3.31Å; I54-V58 PolarHBondContact O-N 3.42Å; L55-V58 PolarHBondContact O-N 3Å; V58-A61 PolarHBondContact O-N 3.49Å; V58-A62 WeakPolarHBondContact O-CB 3.32Å; V58-A62 PolarHBondContact O-N 3.05Å |
| 59 | L | 84 | Confident | 83.7 | Confident | 74 Ų | 74 | 91.2 Ų | 91.2 | 39% | 0.387 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.7 | -47.6 | 177.2 | -178.6 | 66.6 | 0 | 0 | 0 | 111.6 | F24 L55 L56 L57 A61 A62 L63 | F24-L59 HydrophobicContact CE1-CD1 4.21Å; F24-L59 HydrophobicContact CZ-CD1 4.26Å; L55-L59 WeakPolarHBondContact O-CB 3.36Å; L55-L59 PolarHBondContact O-N 3.28Å; L56-L59 PolarHBondContact O-N 2.91Å; L57-L59 VanDerWaalsContact C-N 3.33Å; L57-L59 PolarHBondContact O-N 3.41Å; L59-A61 VanDerWaalsContact C-N 3.33Å; L59-A61 PolarHBondContact O-N 3.22Å; L59-A62 PolarHBondContact O-N 3.09Å; L59-L63 HydrophobicContact CG-CD1 4.34Å; L59-L63 WeakPolarHBondContact O-CG 3.23Å; L59-L63 PolarHBondContact O-N 3.43Å |
| 60 | V | 85 | Confident | 84.4 | Confident | 67 Ų | 67 | 93.6 Ų | 93.6 | 41% | 0.406 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.5 | -43.8 | 178 | 172.4 | 0 | 0 | 0 | 0 | 110.7 | L56 L57 A62 L63 L64 | L56-V60 VanDerWaalsContact O-CG2 3.31Å; L56-V60 WeakPolarHBondContact O-CG2 3.38Å; L56-V60 PolarHBondContact O-N 3.2Å; L57-V60 PolarHBondContact O-N 3.48Å; V60-A62 PolarHBondContact O-N 2.93Å; V60-L63 PolarHBondContact O-N 3.34Å; V60-L64 HydrophobicContact CG1-CD1 3.89Å; V60-L64 HydrophobicContact CG1-CG 4.35Å; V60-L64 WeakPolarHBondContact O-CB 3.3Å; V60-L64 VanDerWaalsContact O-CG 3.32Å; V60-L64 WeakPolarHBondContact O-CG 3.15Å; V60-L64 PolarHBondContact O-N 3.22Å |
| 61 | A | 90.2 | Very high | 84.6 | Confident | 54 Ų | 54 | 86.9 Ų | 86.9 | 45% | 0.446 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.1 | -42.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | L57 V58 L59 L64 C65 | L57-A61 WeakPolarHBondContact O-CB 2.92Å; L57-A61 PolarHBondContact O-N 2.94Å; V58-A61 PolarHBondContact O-N 3.49Å; L59-A61 VanDerWaalsContact C-N 3.33Å; L59-A61 PolarHBondContact O-N 3.22Å; A61-L64 PolarHBondContact O-N 3.15Å; A61-C65 VanDerWaalsContact O-CB 3.25Å; A61-C65 WeakPolarHBondContact O-CB 3.44Å; A61-C65 PolarHBondContact O-N 2.95Å |
| 62 | A | 85.3 | Confident | 85 | Confident | 61 Ų | 61 | 86.2 Ų | 86.2 | 50% | 0.504 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.3 | -42 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | V58 L59 V60 C65 G66 | V58-A62 WeakPolarHBondContact O-CB 3.32Å; V58-A62 PolarHBondContact O-N 3.05Å; L59-A62 PolarHBondContact O-N 3.09Å; V60-A62 PolarHBondContact O-N 2.93Å; A62-C65 PolarHBondContact O-N 3.46Å; A62-G66 PolarHBondContact O-N 3.48Å |
| 63 | L | 86.7 | Confident | 84.9 | Confident | 115 Ų | 115 | 86.5 Ų | 86.5 | 60% | 0.602 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -64.7 | -45.6 | 176.8 | -71.4 | 173.2 | 0 | 0 | 0 | 112 | L59 V60 G66 A67 | L59-L63 HydrophobicContact CG-CD1 4.34Å; L59-L63 WeakPolarHBondContact O-CG 3.23Å; L59-L63 PolarHBondContact O-N 3.43Å; V60-L63 PolarHBondContact O-N 3.34Å; L63-G66 PolarHBondContact O-N 3.37Å; L63-A67 WeakPolarHBondContact O-CB 3.45Å; L63-A67 PolarHBondContact O-N 3.46Å |
| 64 | L | 91.4 | Very high | 84.5 | Confident | 112 Ų | 112 | 81.8 Ų | 81.8 | 59% | 0.586 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -62.4 | -45.7 | 177.1 | -71.2 | 172.5 | 0 | 0 | 0 | 111.1 | V60 A61 A67 V68 | V60-L64 HydrophobicContact CG1-CD1 3.89Å; V60-L64 HydrophobicContact CG1-CG 4.35Å; V60-L64 WeakPolarHBondContact O-CB 3.3Å; V60-L64 VanDerWaalsContact O-CG 3.32Å; V60-L64 WeakPolarHBondContact O-CG 3.15Å; V60-L64 PolarHBondContact O-N 3.22Å; A61-L64 PolarHBondContact O-N 3.15Å; L64-A67 PolarHBondContact O-N 3.31Å; L64-V68 WeakPolarHBondContact O-CG2 3.41Å; L64-V68 PolarHBondContact O-N 3.36Å |
| 65 | C | 86.1 | Confident | 84.2 | Confident | 78 Ų | 78 | 87.6 Ų | 87.6 | 53% | 0.527 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.2 | -47.5 | 176.8 | -174.5 | 0 | 0 | 0 | 0 | 111.3 | A61 A62 A67 V68 V69 | A61-C65 VanDerWaalsContact O-CB 3.25Å; A61-C65 WeakPolarHBondContact O-CB 3.44Å; A61-C65 PolarHBondContact O-N 2.95Å; A62-C65 PolarHBondContact O-N 3.46Å; C65-A67 VanDerWaalsContact C-N 3.32Å; C65-A67 PolarHBondContact O-N 2.98Å; C65-V68 PolarHBondContact O-N 3.32Å; C65-V69 WeakPolarHBondContact O-CG2 3.43Å; C65-V69 PolarHBondContact O-N 2.95Å |
| 66 | G | 83.8 | Confident | 83.6 | Confident | 30 Ų | 30 | 88.8 Ų | 88.8 | 31% | 0.309 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -57.1 | -44.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A62 L63 V69 L70 | A62-G66 PolarHBondContact O-N 3.48Å; L63-G66 PolarHBondContact O-N 3.37Å; G66-V69 PolarHBondContact O-N 2.92Å; G66-L70 VanDerWaalsContact O-CB 3.3Å; G66-L70 WeakPolarHBondContact O-CB 3.16Å; G66-L70 WeakPolarHBondContact O-CG 3.36Å; G66-L70 PolarHBondContact O-N 2.97Å |
| 67 | A | 83.8 | Confident | 82.7 | Confident | 49 Ų | 49 | 93.7 Ų | 93.7 | 41% | 0.405 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.3 | -44 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L63 L64 C65 L70 C71 | L63-A67 WeakPolarHBondContact O-CB 3.45Å; L63-A67 PolarHBondContact O-N 3.46Å; L64-A67 PolarHBondContact O-N 3.31Å; C65-A67 VanDerWaalsContact C-N 3.32Å; C65-A67 PolarHBondContact O-N 2.98Å; A67-L70 PolarHBondContact O-N 2.82Å; A67-C71 VanDerWaalsContact O-CB 3.32Å; A67-C71 WeakPolarHBondContact O-CB 3.41Å; A67-C71 PolarHBondContact O-N 3.05Å; A67-C71 PolarHBondContact O-SG 2.92Å |
| 68 | V | 88.8 | Confident | 81.3 | Confident | 85 Ų | 85 | 94.4 Ų | 94.4 | 52% | 0.515 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.4 | -45.8 | 177.2 | 172.5 | 0 | 0 | 0 | 0 | 111.1 | L64 C65 C71 L72 | L64-V68 WeakPolarHBondContact O-CG2 3.41Å; L64-V68 PolarHBondContact O-N 3.36Å; C65-V68 PolarHBondContact O-N 3.32Å; V68-C71 WeakPolarHBondContact O-CB 3.27Å; V68-C71 PolarHBondContact O-N 3.46Å; V68-L72 HydrophobicContact CG1-CD1 4.02Å; V68-L72 HydrophobicContact CG1-CG 4.46Å; V68-L72 WeakPolarHBondContact O-CG 3.3Å; V68-L72 PolarHBondContact O-N 3.46Å |
| 69 | V | 86 | Confident | 79.9 | Confident | 72 Ų | 72 | 94.1 Ų | 94.1 | 44% | 0.436 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.1 | -43.8 | 178.2 | 173.5 | 0 | 0 | 0 | 0 | 111 | C65 G66 C71 L72 Q73 | C65-V69 WeakPolarHBondContact O-CG2 3.43Å; C65-V69 PolarHBondContact O-N 2.95Å; G66-V69 PolarHBondContact O-N 2.92Å; V69-C71 VanDerWaalsContact C-N 3.33Å; V69-C71 PolarHBondContact O-N 3.38Å; V69-L72 PolarHBondContact O-N 3.18Å; V69-Q73 HydrophobicContact CG1-CG 4.3Å; V69-Q73 WeakPolarHBondContact O-CB 3.11Å; V69-Q73 VanDerWaalsContact O-CG 3.23Å; V69-Q73 WeakPolarHBondContact O-CG 3.43Å; V69-Q73 PolarHBondContact O-N 2.99Å |
| 70 | L | 81.9 | Confident | 78.5 | Confident | 94 Ų | 94 | 101.3 Ų | 101.3 | 49% | 0.492 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.5 | -41.4 | 176 | -73.3 | 173.3 | 0 | 0 | 0 | 111.6 | G66 A67 Q73 C74 | G66-L70 VanDerWaalsContact O-CB 3.3Å; G66-L70 WeakPolarHBondContact O-CB 3.16Å; G66-L70 WeakPolarHBondContact O-CG 3.36Å; G66-L70 PolarHBondContact O-N 2.97Å; A67-L70 PolarHBondContact O-N 2.82Å; L70-Q73 PolarHBondContact O-N 3.33Å; L70-C74 WeakPolarHBondContact O-CB 3.42Å; L70-C74 PolarHBondContact O-N 3.47Å; L70-C74 PolarHBondContact O-SG 2.9Å |
| 71 | C | 80.1 | Confident | 77 | Confident | 69 Ų | 69 | 103 Ų | 103 | 47% | 0.466 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -57.9 | -56.3 | 171.3 | -75.8 | 0 | 0 | 0 | 0 | 110 | A67 V68 V69 Q73 C74 W75 | A67-C71 VanDerWaalsContact O-CB 3.32Å; A67-C71 WeakPolarHBondContact O-CB 3.41Å; A67-C71 PolarHBondContact O-N 3.05Å; A67-C71 PolarHBondContact O-SG 2.92Å; V68-C71 WeakPolarHBondContact O-CB 3.27Å; V68-C71 PolarHBondContact O-N 3.46Å; V69-C71 VanDerWaalsContact C-N 3.33Å; V69-C71 PolarHBondContact O-N 3.38Å; C71-Q73 VanDerWaalsContact C-N 3.28Å; C71-Q73 PolarHBondContact O-N 2.93Å; C71-C74 CarbonylContact O-C 3.56Å; C71-C74 WeakPolarHBondContact O-CA 3.41Å; C71-C74 WeakPolarHBondContact O-CB 3.47Å; C71-C74 PolarHBondContact O-N 2.93Å; C71-W75 PolarHBondContact O-N 3.47Å |
| 72 | L | 81.9 | Confident | 75.2 | Confident | 100 Ų | 100 | 105.8 Ų | 105.8 | 52% | 0.524 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -54.8 | -43.3 | 178.9 | -69.9 | 169.7 | 0 | 0 | 0 | 112.5 | V68 V69 C74 W75 L76 | V68-L72 HydrophobicContact CG1-CD1 4.02Å; V68-L72 HydrophobicContact CG1-CG 4.46Å; V68-L72 WeakPolarHBondContact O-CG 3.3Å; V68-L72 PolarHBondContact O-N 3.46Å; V69-L72 PolarHBondContact O-N 3.18Å; L72-C74 PolarHBondContact O-N 3.46Å; L72-W75 PolarHBondContact O-N 3.41Å; L72-L76 WeakPolarHBondContact O-CB 3.13Å; L72-L76 VanDerWaalsContact O-CG 3.25Å; L72-L76 WeakPolarHBondContact O-CG 3.35Å; L72-L76 PolarHBondContact O-N 3.03Å |
| 73 | Q | 78.7 | Confident | 73.6 | Confident | 97 Ų | 97 | 108.1 Ų | 108.1 | 45% | 0.453 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -62 | -42.7 | 174.8 | -70.3 | -71.1 | 1.6 | 0 | 0 | 112 | V69 L70 C71 W75 L76 R77 | V69-Q73 HydrophobicContact CG1-CG 4.3Å; V69-Q73 WeakPolarHBondContact O-CB 3.11Å; V69-Q73 VanDerWaalsContact O-CG 3.23Å; V69-Q73 WeakPolarHBondContact O-CG 3.43Å; V69-Q73 PolarHBondContact O-N 2.99Å; L70-Q73 PolarHBondContact O-N 3.33Å; C71-Q73 VanDerWaalsContact C-N 3.28Å; C71-Q73 PolarHBondContact O-N 2.93Å; Q73-W75 VanDerWaalsContact C-N 3.35Å; Q73-L76 PolarHBondContact O-N 3.3Å; Q73-R77 WeakPolarHBondContact O-CB 3.45Å; Q73-R77 WeakPolarHBondContact O-CG 3.03Å; Q73-R77 PolarHBondContact O-N 2.84Å |
| 74 | C | 75.6 | Confident | 72 | Confident | 80 Ų | 80 | 110.8 Ų | 110.8 | 54% | 0.541 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -60.8 | -45.4 | 173.9 | -70.7 | 0 | 0 | 0 | 0 | 111 | L70 C71 L72 L76 R77 R78 | L70-C74 WeakPolarHBondContact O-CB 3.42Å; L70-C74 PolarHBondContact O-N 3.47Å; L70-C74 PolarHBondContact O-SG 2.9Å; C71-C74 CarbonylContact O-C 3.56Å; C71-C74 WeakPolarHBondContact O-CA 3.41Å; C71-C74 WeakPolarHBondContact O-CB 3.47Å; C71-C74 PolarHBondContact O-N 2.93Å; L72-C74 PolarHBondContact O-N 3.46Å; C74-L76 VanDerWaalsContact C-N 3.34Å; C74-L76 PolarHBondContact O-N 3.49Å; C74-R77 PolarHBondContact O-N 3.27Å; C74-R78 WeakPolarHBondContact O-CB 3.45Å; C74-R78 PolarHBondContact O-N 3.4Å |
| 75 | W | 76.1 | Confident | 70.1 | Confident | 199 Ų | 199 | 115.1 Ų | 115.1 | 75% | 0.754 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -69.8 | -29.3 | -178.6 | -73.2 | 58.6 | 0 | 0 | 0 | 112.8 | C71 L72 Q73 P79 | C71-W75 PolarHBondContact O-N 3.47Å; L72-W75 PolarHBondContact O-N 3.41Å; Q73-W75 VanDerWaalsContact C-N 3.35Å; W75-P79 WeakPolarHBondContact O-CD 3.18Å; W75-P79 WeakPolarHBondContact O-CG 3.12Å |
| 76 | L | 70.6 | Confident | 68.7 | Low | 131 Ų | 131 | 123.3 Ų | 123.3 | 69% | 0.686 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -85.4 | -26.2 | 175.4 | -69.1 | 171.7 | 0 | 0 | 0 | 113.1 | L72 Q73 C74 P79 | L72-L76 WeakPolarHBondContact O-CB 3.13Å; L72-L76 VanDerWaalsContact O-CG 3.25Å; L72-L76 WeakPolarHBondContact O-CG 3.35Å; L72-L76 PolarHBondContact O-N 3.03Å; Q73-L76 PolarHBondContact O-N 3.3Å; C74-L76 VanDerWaalsContact C-N 3.34Å; C74-L76 PolarHBondContact O-N 3.49Å; L76-P79 WeakPolarHBondContact O-CD 3.36Å |
| 77 | R | 65.2 | Low | 67.4 | Low | 190 Ų | 190 | 128.1 Ų | 128.1 | 72% | 0.717 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -85.3 | -32.8 | 176.5 | -70.1 | -93.6 | -179.8 | 159.2 | -3.1 | 112.6 | Q73 C74 R80 | Q73-R77 WeakPolarHBondContact O-CB 3.45Å; Q73-R77 WeakPolarHBondContact O-CG 3.03Å; Q73-R77 PolarHBondContact O-N 2.84Å; C74-R77 PolarHBondContact O-N 3.27Å; R77-R80 PolarHBondContact O-N 3.38Å |
| 78 | R | 59.7 | Low | 66.2 | Low | 133 Ų | 133 | 133.9 Ų | 133.9 | 50% | 0.502 | 65% | 0.645 | S | S | . | * | G | 310 helix | trans | -57.2 | -39.6 | 176.4 | -167.8 | 84.9 | -175.8 | -137.5 | -3.9 | 115.6 | C74 R80 I81 | C74-R78 WeakPolarHBondContact O-CB 3.45Å; C74-R78 PolarHBondContact O-N 3.4Å; R78-R80 PolarHBondContact O-N 3.29Å; R78-I81 PolarHBondContact O-N 3.45Å |
| 79 | P | 56.6 | Low | 65.1 | Low | 87 Ų | 87 | 133.7 Ų | 133.7 | 57% | 0.565 | 65% | 0.652 | S | S | * | * | G | 310 helix | trans | -61.4 | -22.6 | -175.4 | -18.5 | 31.7 | 0 | 0 | 0 | 112.3 | W75 L76 | W75-P79 WeakPolarHBondContact O-CD 3.18Å; W75-P79 WeakPolarHBondContact O-CG 3.12Å; L76-P79 WeakPolarHBondContact O-CD 3.36Å |
| 80 | R | 54.6 | Low | 63.8 | Low | 225 Ų | 225 | 136.1 Ų | 136.1 | 85% | 0.849 | 67% | 0.667 | S | S | * | * | G | 310 helix | trans | -78.1 | -17.4 | 180 | -127.9 | -179.9 | -176.4 | -168.2 | 0.9 | 114.1 | R77 R78 | R77-R80 PolarHBondContact O-N 3.38Å; R78-R80 PolarHBondContact O-N 3.29Å |
| 81 | I | 53.8 | Low | 62.7 | Low | 101 Ų | 101 | 140.2 Ų | 140.2 | 52% | 0.518 | 68% | 0.681 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -93.8 | -28.4 | -176.1 | -78 | 162.6 | 0 | 0 | 0 | 112.3 | R78 S83 H84 | R78-I81 PolarHBondContact O-N 3.45Å; I81-S83 PolarHBondContact O-N 2.61Å; I81-H84 PolarHBondContact O-N 3.3Å |
| 82 | D | 52.2 | Low | 62 | Low | 113 Ų | 113 | 141.7 Ų | 141.7 | 60% | 0.604 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.2 | -4.5 | -177.2 | -68.7 | -39.7 | 0 | 0 | 0 | 113.5 | ||
| 83 | S | 52.9 | Low | 60.6 | Low | 111 Ų | 111 | 143.2 Ų | 143.2 | 78% | 0.776 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.1 | -13.7 | 173.2 | 177.2 | 0 | 0 | 0 | 0 | 114.6 | I81 | I81-S83 PolarHBondContact O-N 2.61Š|
| 84 | H | 53.3 | Low | 59.5 | Low | 171 Ų | 171 | 142 Ų | 142 | 79% | 0.792 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -115 | 13.4 | -166.9 | -159 | -77.8 | 0 | 0 | 0 | 114.8 | I81 | I81-H84 PolarHBondContact O-N 3.3Š|
| 85 | R | 50.6 | Low | 58.4 | Low | 202 Ų | 202 | 144.4 Ų | 144.4 | 76% | 0.762 | 73% | 0.732 | S | S | * | * | trans | -131.5 | 31.7 | -171.3 | -110.1 | -176.5 | -176.3 | -110.1 | -0.2 | 116.6 | T87 | R85-T87 VanDerWaalsContact C-N 3.28Å; R85-T87 PolarHBondContact O-N 2.75Å | ||
| 86 | R | 57.5 | Low | 57.3 | Low | 251 Ų | 251 | 143.3 Ų | 143.3 | 95% | 0.947 | 74% | 0.74 | S | S | * | * | trans | -84.6 | 73.5 | 159 | -69.3 | -166.9 | -162.4 | -174.9 | 6.2 | 110.2 | M88 | R86-M88 PolarHBondContact O-N 3.25Š| ||
| 87 | T | 56.2 | Low | 56.2 | Low | 131 Ų | 131 | 142.8 Ų | 142.8 | 80% | 0.804 | 74% | 0.738 | S | S | * | * | trans | -89.4 | 95.7 | 159.8 | -11.9 | 0 | 0 | 0 | 0 | 106.6 | R85 A89 | R85-T87 VanDerWaalsContact C-N 3.28Å; R85-T87 PolarHBondContact O-N 2.75Å; T87-A89 PolarHBondContact O-N 3.42Å | ||
| 88 | M | 58.4 | Low | 55.6 | Low | 170 Ų | 170 | 137.7 Ų | 137.7 | 84% | 0.837 | 73% | 0.731 | S | S | * | * | trans | -75.4 | 109.7 | 176 | -165.2 | 176.5 | -176.7 | 0 | 0 | 107.6 | R86 V90 | R86-M88 PolarHBondContact O-N 3.25Å; M88-V90 HydrophobicContact CG-CG2 4.47Å; M88-V90 PolarHBondContact O-N 3.02Å | ||
| 89 | A | 65.6 | Low | 54.8 | Low | 80 Ų | 80 | 139.1 Ų | 139.1 | 66% | 0.661 | 75% | 0.747 | S | S | * | * | trans | -86.3 | 106.6 | 170.3 | 0 | 0 | 0 | 0 | 0 | 107.9 | T87 F91 | T87-A89 PolarHBondContact O-N 3.42Å; A89-F91 HydrophobicContact CB-CD2 4.5Å; A89-F91 HydrophobicContact CB-CE2 4.28Å | ||
| 90 | V | 58.1 | Low | 54 | Low | 124 Ų | 124 | 145.9 Ų | 145.9 | 75% | 0.752 | 76% | 0.763 | S | S | * | * | trans | -84.4 | 110.6 | 169 | -178.7 | 0 | 0 | 0 | 0 | 107 | M88 | M88-V90 HydrophobicContact CG-CG2 4.47Å; M88-V90 PolarHBondContact O-N 3.02Å | ||
| 91 | F | 59 | Low | 53.4 | Low | 180 Ų | 180 | 138.2 Ų | 138.2 | 79% | 0.789 | 75% | 0.754 | S | S | * | * | trans | -84.1 | 115.3 | 168.1 | -83.1 | -92.5 | 0 | 0 | 0 | 108 | A89 V93 | A89-F91 HydrophobicContact CB-CD2 4.5Å; A89-F91 HydrophobicContact CB-CE2 4.28Å; F91-V93 PolarHBondContact O-N 2.9Å | ||
| 92 | A | 65.6 | Low | 52.7 | Low | 99 Ų | 99 | 138.8 Ų | 138.8 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | trans | -76.4 | 110.5 | 164.2 | 0 | 0 | 0 | 0 | 0 | 107.9 | G94 | A92-G94 PolarHBondContact O-N 2.94Š| ||
| 93 | V | 51.4 | Low | 52.2 | Low | 132 Ų | 132 | 141.6 Ų | 141.6 | 80% | 0.8 | 77% | 0.772 | S | S | * | * | trans | -79.3 | 101.6 | 170.8 | 175.7 | 0 | 0 | 0 | 0 | 106.7 | F91 D95 | F91-V93 PolarHBondContact O-N 2.9Å; V93-D95 PolarHBondContact O-N 3.22Å | ||
| 94 | G | 56.2 | Low | 51.6 | Low | 72 Ų | 72 | 141 Ų | 141 | 74% | 0.742 | 77% | 0.773 | S | S | * | * | trans | -83.1 | 98.5 | 167.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | A92 L96 | A92-G94 PolarHBondContact O-N 2.94Å; G94-L96 PolarHBondContact O-N 2.93Å | ||
| 95 | D | 53.7 | Low | 50.9 | Low | 131 Ų | 131 | 137.3 Ų | 137.3 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | trans | -78.1 | 109.1 | 168.1 | -172.6 | 26.4 | 0 | 0 | 0 | 108 | V93 | V93-D95 PolarHBondContact O-N 3.22Š| ||
| 96 | L | 51.8 | Low | 50.3 | Low | 175 Ų | 175 | 134 Ų | 134 | 92% | 0.916 | 77% | 0.774 | S | S | * | * | trans | -108.3 | 86.3 | 162.7 | -110.7 | 115 | 0 | 0 | 0 | 106.3 | G94 | G94-L96 PolarHBondContact O-N 2.93Š| ||
| 97 | D | 48.7 | Very low | 49.7 | Very low | 121 Ų | 121 | 127.6 Ų | 127.6 | 65% | 0.647 | 77% | 0.768 | S | S | * | * | trans | -69.1 | 145.5 | 169.9 | -151.2 | -7.6 | 0 | 0 | 0 | 110.1 | ||||
| 98 | S | 52.7 | Low | 49.2 | Very low | 82 Ų | 82 | 126.8 Ų | 126.8 | 57% | 0.573 | 77% | 0.765 | S | S | * | * | trans | -46.4 | 153.4 | 174.3 | 59.4 | 0 | 0 | 0 | 0 | 114 | ||||
| 99 | I | 41.2 | Very low | 48.6 | Very low | 164 Ų | 164 | 124.5 Ų | 124.5 | 84% | 0.841 | 76% | 0.763 | S | S | * | * | -176.2 | 131.4 | 115.2 | -85.7 | 150.5 | 0 | 0 | 0 | 110.8 | |||||
| 100 | Y | 41.7 | Very low | 47.4 | Very low | 229 Ų | 229 | 127.4 Ų | 127.4 | 90% | 0.898 | 77% | 0.772 | S | S | * | * | trans | -53.1 | 137.3 | 170.5 | -165.4 | -97 | 0 | 0 | 0 | 113.4 | ||||
| 101 | G | 41.4 | Very low | 46.5 | Very low | 63 Ų | 63 | 124.4 Ų | 124.4 | 65% | 0.649 | 77% | 0.767 | S | S | * | * | trans | 168 | 75.3 | 169.4 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 102 | T | 39.7 | Very low | 45.6 | Very low | 114 Ų | 114 | 124.3 Ų | 124.3 | 70% | 0.699 | 77% | 0.773 | S | S | * | * | trans | 63.5 | 144.2 | 141.1 | -41.4 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 103 | E | 40.8 | Very low | 44.5 | Very low | 172 Ų | 172 | 127.2 Ų | 127.2 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | trans | 79 | 99.6 | 151.2 | 48.5 | -154.4 | 115.3 | 0 | 0 | 122.2 | ||||
| 104 | A | 40.5 | Very low | 43.9 | Very low | 97 Ų | 97 | 126.9 Ų | 126.9 | 80% | 0.802 | 76% | 0.762 | S | S | * | * | 75.5 | 105.8 | 125.3 | 0 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 105 | A | 38.1 | Very low | 42.8 | Very low | 94 Ų | 94 | 131.5 Ų | 131.5 | 78% | 0.777 | 76% | 0.764 | S | S | * | * | 67.3 | 132.4 | 127.7 | 0 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 106 | V | 39.1 | Very low | 41.9 | Very low | 133 Ų | 133 | 129.5 Ų | 129.5 | 81% | 0.806 | 76% | 0.757 | S | S | * | * | trans | 86 | 91.4 | 161.3 | -169.2 | 0 | 0 | 0 | 0 | 116 | ||||
| 107 | S | 43.1 | Very low | 41.1 | Very low | 117 Ų | 117 | 129.6 Ų | 129.6 | 82% | 0.818 | 75% | 0.753 | S | S | * | * | trans | -60.2 | 134.5 | 152.9 | -40.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 108 | P | 47.1 | Very low | 40.3 | Very low | 113 Ų | 113 | 129.6 Ų | 129.6 | 73% | 0.734 | 76% | 0.757 | S | S | * | * | -136 | 157.8 | 93.8 | 27.6 | -9.9 | 0 | 0 | 0 | 113.5 | |||||
| 109 | P | 44.6 | Very low | 39.4 | Very low | 123 Ų | 123 | 129.4 Ų | 129.4 | 80% | 0.799 | 76% | 0.761 | S | S | * | * | trans | -81.1 | 126.1 | -166.2 | 30.8 | -32.1 | 0 | 0 | 0 | 114.3 | ||||
| 110 | V | 40.8 | Very low | 39.1 | Very low | 140 Ų | 140 | 128.8 Ų | 128.8 | 85% | 0.848 | 76% | 0.759 | S | S | * | * | trans | 70.9 | 88.5 | 142.3 | -173.2 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 111 | G | 40 | Very low | 38.9 | Very low | 62 Ų | 62 | 126 Ų | 126 | 64% | 0.639 | 76% | 0.759 | S | S | * | * | trans | -81.9 | 168.7 | 134.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 112 | I | 39.4 | Very low | 38.9 | Very low | 178 Ų | 178 | 133.7 Ų | 133.7 | 91% | 0.913 | 77% | 0.77 | S | S | * | * | -160.1 | 139 | 51.3 | -23.6 | 178.7 | 0 | 0 | 0 | 109.8 | |||||
| 113 | H | 42.7 | Very low | 39.3 | Very low | 159 Ų | 159 | 133.4 Ų | 133.4 | 74% | 0.736 | 77% | 0.77 | S | S | * | * | trans | -84.7 | 156.9 | 169.9 | -173.8 | -83.6 | 0 | 0 | 0 | 110 | ||||
| 114 | L | 39.2 | Very low | 39.6 | Very low | 125 Ų | 125 | 129.5 Ų | 129.5 | 65% | 0.654 | 77% | 0.767 | S | S | * | * | trans | 77.9 | 108.7 | 162.2 | -96.5 | 152.3 | 0 | 0 | 0 | 119.9 | T116 | L114-T116 WeakPolarHBondContact CD2-OG1 3.32Š| ||
| 115 | Q | 33.3 | Very low | 39.9 | Very low | 169 Ų | 169 | 130.6 Ų | 130.6 | 79% | 0.79 | 77% | 0.766 | S | S | * | * | -136.9 | 109 | 119.4 | -149.7 | -154.3 | 62.9 | 0 | 0 | 111.2 | |||||
| 116 | T | 33.6 | Very low | 40.4 | Very low | 90 Ų | 90 | 129.8 Ų | 129.8 | 55% | 0.552 | 76% | 0.759 | S | S | * | * | trans | -55.2 | 121.8 | 162.4 | -57.2 | 0 | 0 | 0 | 0 | 110.1 | L114 T118 | L114-T116 WeakPolarHBondContact CD2-OG1 3.32Å; T116-T118 WeakPolarHBondContact CG2-OG1 2.92Å | ||
| 117 | Q | 35.3 | Very low | 40.9 | Very low | 177 Ų | 177 | 129.7 Ų | 129.7 | 83% | 0.827 | 76% | 0.761 | S | S | * | * | trans | -101.3 | 99.7 | 157.1 | -77.4 | -170.8 | 27.3 | 0 | 0 | 108.6 | ||||
| 118 | T | 32.3 | Very low | 41.2 | Very low | 121 Ų | 121 | 129.9 Ų | 129.9 | 74% | 0.742 | 76% | 0.761 | S | S | * | * | trans | -66.6 | 146.4 | 168.5 | -51.8 | 0 | 0 | 0 | 0 | 109.9 | T116 | T116-T118 WeakPolarHBondContact CG2-OG1 2.92Š| ||
| 119 | A | 33.6 | Very low | 41.1 | Very low | 78 Ų | 78 | 135 Ų | 135 | 65% | 0.645 | 77% | 0.772 | S | S | * | * | trans | -57.4 | 152.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 120 | D | 35.1 | Very low | 41 | Very low | 151 Ų | 151 | 132 Ų | 132 | 81% | 0.807 | 77% | 0.765 | S | S | * | * | trans | 144.6 | 108.5 | 149 | -76.7 | -26.7 | 0 | 0 | 0 | 107.3 | ||||
| 121 | L | 36.7 | Very low | 41.5 | Very low | 171 Ų | 171 | 132.2 Ų | 132.2 | 90% | 0.895 | 77% | 0.766 | S | S | * | * | -159.4 | 135.9 | 57.1 | -75 | 144.6 | 0 | 0 | 0 | 110.6 | |||||
| 122 | Y | 41.5 | Very low | 42.2 | Very low | 224 Ų | 224 | 137.5 Ų | 137.5 | 88% | 0.878 | 78% | 0.779 | S | S | * | * | trans | -58.8 | 175.2 | 167.7 | -100.2 | -101.2 | 0 | 0 | 0 | 113.4 | ||||
| 123 | P | 48.1 | Very low | 42.9 | Very low | 108 Ų | 108 | 132 Ų | 132 | 70% | 0.701 | 77% | 0.766 | S | S | * | * | cis | -130 | 162.5 | -3.2 | 36.5 | -18.8 | 0 | 0 | 0 | 115.3 | ||||
| 124 | A | 46.8 | Very low | 43.6 | Very low | 89 Ų | 89 | 130.2 Ų | 130.2 | 74% | 0.736 | 77% | 0.771 | S | S | * | * | trans | -66.3 | 157.8 | 161.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 125 | P | 48.1 | Very low | 44.5 | Very low | 120 Ų | 120 | 129.5 Ų | 129.5 | 78% | 0.779 | 77% | 0.774 | S | S | * | * | -150 | 151.2 | 97.5 | 36 | -17.7 | 0 | 0 | 0 | 116.7 | |||||
| 126 | A | 47.6 | Very low | 45.8 | Very low | 78 Ų | 78 | 127 Ų | 127 | 65% | 0.645 | 77% | 0.772 | S | S | * | * | trans | 41.9 | 138.1 | 145.6 | 0 | 0 | 0 | 0 | 0 | 122.6 | C128 | A126-C128 PolarHBondContact O-N 3.18Š| ||
| 127 | P | 50.6 | Low | 47.3 | Very low | 130 Ų | 130 | 127.7 Ų | 127.7 | 84% | 0.844 | 78% | 0.778 | S | S | * | * | trans | -80 | 108.2 | 173.4 | 32.7 | -29.7 | 0 | 0 | 0 | 110.8 | ||||
| 128 | C | 48.2 | Very low | 48.6 | Very low | 122 Ų | 122 | 128.8 Ų | 128.8 | 82% | 0.824 | 78% | 0.776 | S | S | * | * | trans | -90.5 | 106.3 | 174.5 | -67.4 | 0 | 0 | 0 | 0 | 110.8 | A126 | A126-C128 PolarHBondContact O-N 3.18Š| ||
| 129 | F | 45.3 | Very low | 50 | Low | 219 Ų | 219 | 131.3 Ų | 131.3 | 96% | 0.961 | 78% | 0.78 | S | S | * | * | trans | -57.8 | 129.6 | 150 | -91.9 | -100.8 | 0 | 0 | 0 | 108.8 | ||||
| 130 | G | 43.1 | Very low | 51.2 | Low | 62 Ų | 62 | 135.3 Ų | 135.3 | 64% | 0.639 | 79% | 0.785 | S | S | * | * | trans | -179.6 | 95.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L132 | G130-L132 PolarHBondContact O-N 2.68Å; G130-L132 VanDerWaalsContact O-N 3.07Å | ||
| 131 | T | 51.9 | Low | 52.3 | Low | 143 Ų | 143 | 136.1 Ų | 136.1 | 88% | 0.877 | 79% | 0.788 | S | S | * | * | trans | -44.2 | 101.7 | 172.2 | -50 | 0 | 0 | 0 | 0 | 112.7 | G133 | T131-G133 PolarHBondContact O-N 3.19Š| ||
| 132 | L | 53.6 | Low | 53.4 | Low | 174 Ų | 174 | 134.8 Ų | 134.8 | 91% | 0.911 | 78% | 0.781 | S | S | * | * | trans | -91.7 | 89.3 | 156.7 | -105.1 | 89.8 | 0 | 0 | 0 | 108.1 | G130 | G130-L132 PolarHBondContact O-N 2.68Å; G130-L132 VanDerWaalsContact O-N 3.07Å | ||
| 133 | G | 53.3 | Low | 53.8 | Low | 62 Ų | 62 | 132.9 Ų | 132.9 | 64% | 0.639 | 78% | 0.777 | S | S | * | * | trans | -64.7 | 145.8 | 164.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | T131 | T131-G133 PolarHBondContact O-N 3.19Š| ||
| 134 | S | 57.9 | Low | 53.9 | Low | 122 Ų | 122 | 134 Ų | 134 | 85% | 0.853 | 78% | 0.782 | S | S | * | * | trans | -60.4 | 164.2 | -178 | -131.6 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 135 | P | 59.2 | Low | 53.9 | Low | 110 Ų | 110 | 138.9 Ų | 138.9 | 71% | 0.714 | 81% | 0.811 | S | S | * | * | trans | -87 | -174.2 | -154.2 | 43.7 | -42.4 | 0 | 0 | 0 | 113.8 | ||||
| 136 | P | 60.9 | Low | 54.2 | Low | 115 Ų | 115 | 139.8 Ų | 139.8 | 75% | 0.747 | 81% | 0.812 | S | S | * | * | trans | -78.4 | 167.5 | -145.3 | 34.1 | -37.4 | 0 | 0 | 0 | 116.4 | ||||
| 137 | P | 64.9 | Low | 54.5 | Low | 105 Ų | 105 | 143.1 Ų | 143.1 | 68% | 0.682 | 82% | 0.821 | S | S | * | * | trans | -78.3 | 149.8 | -171.4 | 33.1 | -34.9 | 0 | 0 | 0 | 113 | E139 | P137-E139 PolarHBondContact O-N 3.03Š| ||
| 138 | Y | 61.1 | Low | 54.7 | Low | 200 Ų | 200 | 143.8 Ų | 143.8 | 78% | 0.784 | 82% | 0.82 | S | S | * | * | trans | -80 | 109.6 | 173.5 | 36.2 | -89 | 0 | 0 | 0 | 109.5 | E140 | Y138-E140 PolarHBondContact O-N 3.35Š| ||
| 139 | E | 62.3 | Low | 55.1 | Low | 175 Ų | 175 | 145.1 Ų | 145.1 | 82% | 0.818 | 82% | 0.82 | S | S | * | * | trans | -78.3 | 112 | 168.9 | -57 | -153.7 | -153.7 | 0 | 0 | 108.9 | P137 I141 | P137-E139 PolarHBondContact O-N 3.03Å; E139-I141 PolarHBondContact O-N 3Å | ||
| 140 | E | 58.3 | Low | 55.7 | Low | 161 Ų | 161 | 140.4 Ų | 140.4 | 75% | 0.752 | 81% | 0.811 | S | S | * | * | trans | -72.1 | 104.4 | 173.4 | -57.3 | -171 | -164.7 | 0 | 0 | 108.9 | Y138 L142 | Y138-E140 PolarHBondContact O-N 3.35Å; E140-L142 PolarHBondContact O-N 3.03Å | ||
| 141 | I | 58.6 | Low | 56.6 | Low | 169 Ų | 169 | 145.7 Ų | 145.7 | 87% | 0.867 | 82% | 0.822 | S | S | * | * | trans | -68.3 | 113 | 177.2 | -57.4 | 167.5 | 0 | 0 | 0 | 108.4 | E139 | E139-I141 PolarHBondContact O-N 3Š| ||
| 142 | L | 61.1 | Low | 56.9 | Low | 143 Ų | 143 | 145.9 Ų | 145.9 | 75% | 0.749 | 82% | 0.818 | S | S | * | * | trans | -63.8 | 129.7 | 174.5 | -121.3 | 83 | 0 | 0 | 0 | 112.1 | E140 | E140-L142 PolarHBondContact O-N 3.03Š| ||
| 143 | K | 48.5 | Very low | 57.2 | Low | 183 Ų | 183 | 143.7 Ų | 143.7 | 80% | 0.796 | 81% | 0.811 | S | S | * | * | trans | 52.8 | 124.6 | 141.5 | -77.3 | 176.2 | 173.5 | 176.4 | 0 | 120.6 | ||||
| 144 | T | 51.6 | Low | 57.5 | Low | 133 Ų | 133 | 150.5 Ų | 150.5 | 82% | 0.816 | 83% | 0.826 | S | S | * | * | -145.1 | 122.8 | 126.5 | 55.6 | 0 | 0 | 0 | 0 | 112 | |||||
| 145 | S | 45.5 | Very low | 57.4 | Low | 190 Ų | 190 | 153.1 Ų | 153.1 | 100% | 1.329 | 82% | 0.823 | S | S | * | * | trans | 52.5 | 0 | 149.2 | 54.2 | 0 | 0 | 0 | 0 | 120.9 |
Retrieved 145 of 145 residues in 356.1 ms
(Link to these results)