| 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 | 52.6 | Low | 63.6 | Low | 183 Ų | 183 | 128.6 Ų | 128.6 | 90% | 0.901 | 59% | 0.588 | S | S | * | * | 0 | -0.7 | 0 | -83.8 | -178.3 | 171 | 0 | 0 | 114.6 | |||||
| 2 | Y | 56.1 | Low | 64.2 | Low | 165 Ų | 165 | 126.3 Ų | 126.3 | 65% | 0.647 | 58% | 0.584 | S | S | * | * | trans | -74.2 | -35.3 | -173.3 | -60.8 | -72.9 | 0 | 0 | 0 | 115.8 | R4 H5 Y6 F76 | Y2-R4 PolarHBondContact O-N 3.44Å; Y2-R4 VanDerWaalsContact O-N 3.13Å; Y2-H5 PolarHBondContact O-N 3.37Å; Y2-Y6 PolarHBondContact O-N 3.48Å; Y2-F76 HydrophobicContact CD1-CD2 4.49Å; Y2-F76 AromaticContact CD1-CE2 3.24Å; Y2-F76 HydrophobicContact CD1-CE2 3.24Å; Y2-F76 AromaticContact CD1-CZ 3.48Å; Y2-F76 HydrophobicContact CD1-CZ 3.48Å; Y2-F76 VanDerWaalsContact CD1-CZ 3.48Å; Y2-F76 HydrophobicContact CD2-CE2 4.34Å; Y2-F76 AromaticContact CD2-CZ 3.7Å; Y2-F76 HydrophobicContact CD2-CZ 3.7Å; Y2-F76 AromaticContact CE1-CE2 3.63Å; Y2-F76 HydrophobicContact CE1-CE2 3.63Å; Y2-F76 AromaticContact CE1-CZ 3.84Å; Y2-F76 HydrophobicContact CE1-CZ 3.84Å; Y2-F76 HydrophobicContact CE2-CZ 4.08Å; Y2-F76 AromaticContact CG-CE2 3.61Å; Y2-F76 HydrophobicContact CG-CE2 3.61Å; Y2-F76 AromaticContact CG-CZ 3.36Å; Y2-F76 HydrophobicContact CG-CZ 3.36Å | ||
| 3 | Y | 56.5 | Low | 64.8 | Low | 210 Ų | 210 | 121.3 Ų | 121.3 | 82% | 0.824 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -55.4 | -33.2 | 177.8 | -76.7 | -80.8 | 0 | 0 | 0 | 113.6 | H5 Y6 L7 | Y3-H5 VanDerWaalsContact C-N 3.29Å; Y3-H5 PolarHBondContact O-N 2.87Å; Y3-Y6 PolarHBondContact O-N 3.11Å; Y3-L7 PolarHBondContact O-N 2.99Å; Y3-L7 VanDerWaalsContact O-N 3.08Å |
| 4 | R | 59.3 | Low | 65.3 | Low | 169 Ų | 169 | 119.4 Ų | 119.4 | 64% | 0.638 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -65.5 | -33.1 | 179.8 | -162.3 | 177.1 | 77.7 | -148.1 | 3.5 | 112.3 | Y2 L8 | Y2-R4 PolarHBondContact O-N 3.44Å; Y2-R4 VanDerWaalsContact O-N 3.13Å; R4-L8 PolarHBondContact O-N 2.92Å |
| 5 | H | 60.7 | Low | 65.8 | Low | 119 Ų | 119 | 116.7 Ų | 116.7 | 55% | 0.551 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -78.6 | -36 | -179.5 | -65.4 | 32.8 | 0 | 0 | 0 | 110.8 | Y2 Y3 L8 A9 | Y2-H5 PolarHBondContact O-N 3.37Å; Y3-H5 VanDerWaalsContact C-N 3.29Å; Y3-H5 PolarHBondContact O-N 2.87Å; H5-L8 PolarHBondContact O-N 3.05Å; H5-A9 PolarHBondContact O-N 3.39Å |
| 6 | Y | 60.5 | Low | 66.2 | Low | 159 Ų | 159 | 114.4 Ų | 114.4 | 62% | 0.624 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -64.5 | -46.4 | 176.5 | -170.8 | -106.5 | 0 | 0 | 0 | 112.1 | Y2 Y3 L8 A9 I10 | Y2-Y6 PolarHBondContact O-N 3.48Å; Y3-Y6 PolarHBondContact O-N 3.11Å; Y6-L8 VanDerWaalsContact C-N 3.28Å; Y6-L8 PolarHBondContact O-N 3.2Å; Y6-A9 PolarHBondContact O-N 2.88Å; Y6-I10 HydrophobicContact CD1-CD1 3.58Å; Y6-I10 HydrophobicContact CD1-CG1 4.49Å; Y6-I10 HydrophobicContact CE1-CD1 3.14Å; Y6-I10 HydrophobicContact CE1-CG1 4.22Å; Y6-I10 HydrophobicContact CE2-CD1 4.42Å; Y6-I10 HydrophobicContact CG-CD1 4.39Å; Y6-I10 WeakPolarHBondContact O-CG1 3.5Å; Y6-I10 PolarHBondContact O-N 2.93Å |
| 7 | L | 69.3 | Low | 66.2 | Low | 112 Ų | 112 | 110.9 Ų | 110.9 | 59% | 0.586 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -58.4 | -43.3 | 175.7 | -163.6 | 92.7 | 0 | 0 | 0 | 111 | Y3 I10 I11 | Y3-L7 PolarHBondContact O-N 2.99Å; Y3-L7 VanDerWaalsContact O-N 3.08Å; L7-I10 PolarHBondContact O-N 2.85Å; L7-I11 HydrophobicContact CD2-CD1 3.84Å; L7-I11 HydrophobicContact CG-CD1 3.91Å; L7-I11 WeakPolarHBondContact O-CD1 3.2Å; L7-I11 WeakPolarHBondContact O-CG1 3.45Å; L7-I11 PolarHBondContact O-N 3.44Å |
| 8 | L | 70.5 | Confident | 65.9 | Low | 102 Ų | 102 | 108.4 Ų | 108.4 | 53% | 0.534 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.4 | -39.9 | 179.7 | -167.6 | 69.7 | 0 | 0 | 0 | 112.2 | R4 H5 Y6 I11 N12 | R4-L8 PolarHBondContact O-N 2.92Å; H5-L8 PolarHBondContact O-N 3.05Å; Y6-L8 VanDerWaalsContact C-N 3.28Å; Y6-L8 PolarHBondContact O-N 3.2Å; L8-I11 PolarHBondContact O-N 2.93Å; L8-N12 WeakPolarHBondContact O-CB 3.44Å; L8-N12 PolarHBondContact O-N 2.85Å |
| 9 | A | 68.7 | Low | 65.7 | Low | 51 Ų | 51 | 108.2 Ų | 108.2 | 42% | 0.421 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.1 | -44.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | H5 Y6 N12 V13 | H5-A9 PolarHBondContact O-N 3.39Å; Y6-A9 PolarHBondContact O-N 2.88Å; A9-N12 PolarHBondContact O-N 2.6Å; A9-V13 WeakPolarHBondContact O-CG2 3.24Å; A9-V13 PolarHBondContact O-N 3.33Å |
| 10 | I | 72.4 | Confident | 65.5 | Low | 68 Ų | 68 | 104.7 Ų | 104.7 | 35% | 0.349 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.5 | -46.6 | 176.5 | -70.1 | 171.6 | 0 | 0 | 0 | 110.9 | Y6 L7 N12 V13 I14 | Y6-I10 HydrophobicContact CD1-CD1 3.58Å; Y6-I10 HydrophobicContact CD1-CG1 4.49Å; Y6-I10 HydrophobicContact CE1-CD1 3.14Å; Y6-I10 HydrophobicContact CE1-CG1 4.22Å; Y6-I10 HydrophobicContact CE2-CD1 4.42Å; Y6-I10 HydrophobicContact CG-CD1 4.39Å; Y6-I10 WeakPolarHBondContact O-CG1 3.5Å; Y6-I10 PolarHBondContact O-N 2.93Å; L7-I10 PolarHBondContact O-N 2.85Å; I10-N12 VanDerWaalsContact C-N 3.29Å; I10-N12 PolarHBondContact O-N 3.22Å; I10-V13 PolarHBondContact O-N 3.22Å; I10-I14 HydrophobicContact CG2-CD1 3.62Å; I10-I14 HydrophobicContact CG2-CG1 4.27Å; I10-I14 VanDerWaalsContact O-CG1 3.32Å; I10-I14 WeakPolarHBondContact O-CG1 3.41Å; I10-I14 PolarHBondContact O-N 2.93Å |
| 11 | I | 72.9 | Confident | 65 | Low | 77 Ų | 77 | 105.8 Ų | 105.8 | 40% | 0.395 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -58.6 | -44.5 | 178.1 | -68.9 | 163.4 | 0 | 0 | 0 | 110.1 | L7 L8 V13 I14 V15 | L7-I11 HydrophobicContact CD2-CD1 3.84Å; L7-I11 HydrophobicContact CG-CD1 3.91Å; L7-I11 WeakPolarHBondContact O-CD1 3.2Å; L7-I11 WeakPolarHBondContact O-CG1 3.45Å; L7-I11 PolarHBondContact O-N 3.44Å; L8-I11 PolarHBondContact O-N 2.93Å; I11-V13 VanDerWaalsContact C-N 3.34Å; I11-V13 PolarHBondContact O-N 3.44Å; I11-I14 PolarHBondContact O-N 2.89Å; I11-V15 HydrophobicContact CG2-CG2 4.26Å; I11-V15 VanDerWaalsContact O-CG2 3.3Å; I11-V15 WeakPolarHBondContact O-CG2 3.24Å; I11-V15 PolarHBondContact O-N 3.35Å |
| 12 | N | 70.7 | Confident | 65.2 | Low | 101 Ų | 101 | 104.8 Ų | 104.8 | 54% | 0.54 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62 | -40.6 | 177.7 | -78.6 | -15.9 | 0 | 0 | 0 | 112.5 | L8 A9 I10 L16 | L8-N12 WeakPolarHBondContact O-CB 3.44Å; L8-N12 PolarHBondContact O-N 2.85Å; A9-N12 PolarHBondContact O-N 2.6Å; I10-N12 VanDerWaalsContact C-N 3.29Å; I10-N12 PolarHBondContact O-N 3.22Å; N12-L16 VanDerWaalsContact O-CB 3.31Å; N12-L16 WeakPolarHBondContact O-CB 3.43Å; N12-L16 PolarHBondContact O-N 3.48Å |
| 13 | V | 71.9 | Confident | 65.3 | Low | 61 Ų | 61 | 102.7 Ų | 102.7 | 37% | 0.37 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.4 | -41 | 176.5 | 172.4 | 0 | 0 | 0 | 0 | 111.4 | A9 I10 I11 L16 S17 V65 | A9-V13 WeakPolarHBondContact O-CG2 3.24Å; A9-V13 PolarHBondContact O-N 3.33Å; I10-V13 PolarHBondContact O-N 3.22Å; I11-V13 VanDerWaalsContact C-N 3.34Å; I11-V13 PolarHBondContact O-N 3.44Å; V13-L16 PolarHBondContact O-N 2.96Å; V13-S17 WeakPolarHBondContact O-CB 3.34Å; V13-S17 PolarHBondContact O-N 3.39Å; V13-V65 HydrophobicContact CG1-CG1 4.21Å; V13-V65 HydrophobicContact CG2-CG1 3.56Å |
| 14 | I | 72.3 | Confident | 65.1 | Low | 95 Ų | 95 | 96.5 Ų | 96.5 | 49% | 0.487 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -64.1 | -48.6 | 177.4 | -67.2 | 168.6 | 0 | 0 | 0 | 110.5 | I10 I11 L16 S17 T18 | I10-I14 HydrophobicContact CG2-CD1 3.62Å; I10-I14 HydrophobicContact CG2-CG1 4.27Å; I10-I14 VanDerWaalsContact O-CG1 3.32Å; I10-I14 WeakPolarHBondContact O-CG1 3.41Å; I10-I14 PolarHBondContact O-N 2.93Å; I11-I14 PolarHBondContact O-N 2.89Å; I14-L16 VanDerWaalsContact C-N 3.28Å; I14-L16 PolarHBondContact O-N 2.71Å; I14-S17 PolarHBondContact O-N 2.67Å; I14-S17 VanDerWaalsContact O-N 3.14Å; I14-T18 HydrophobicContact CG2-CG2 4.47Å; I14-T18 WeakPolarHBondContact O-CG2 3.39Å; I14-T18 PolarHBondContact O-N 3.36Å; I14-T18 PolarHBondContact O-OG1 2.74Å |
| 15 | V | 72.2 | Confident | 64.6 | Low | 78 Ų | 78 | 90 Ų | 90 | 47% | 0.473 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61 | -38.9 | 178.4 | 172.4 | 0 | 0 | 0 | 0 | 111.3 | I11 T18 M19 | I11-V15 HydrophobicContact CG2-CG2 4.26Å; I11-V15 VanDerWaalsContact O-CG2 3.3Å; I11-V15 WeakPolarHBondContact O-CG2 3.24Å; I11-V15 PolarHBondContact O-N 3.35Å; V15-T18 WeakPolarHBondContact CA-OG1 3.34Å; V15-T18 PolarHBondContact O-N 3.49Å; V15-T18 PolarHBondContact O-OG1 3.29Å; V15-M19 WeakPolarHBondContact O-CG 2.99Å; V15-M19 PolarHBondContact O-N 3.35Å |
| 16 | L | 73.4 | Confident | 64 | Low | 81 Ų | 81 | 85.3 Ų | 85.3 | 42% | 0.424 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -66.7 | -41.5 | 175.7 | -172.1 | 62.7 | 0 | 0 | 0 | 111.5 | N12 V13 I14 M19 I20 I61 | N12-L16 VanDerWaalsContact O-CB 3.31Å; N12-L16 WeakPolarHBondContact O-CB 3.43Å; N12-L16 PolarHBondContact O-N 3.48Å; V13-L16 PolarHBondContact O-N 2.96Å; I14-L16 VanDerWaalsContact C-N 3.28Å; I14-L16 PolarHBondContact O-N 2.71Å; L16-M19 PolarHBondContact O-N 3.49Å; L16-I20 HydrophobicContact CG-CD1 4.24Å; L16-I20 VanDerWaalsContact O-CG1 3.28Å; L16-I20 WeakPolarHBondContact O-CG1 3.48Å; L16-I20 PolarHBondContact O-N 3.38Å; L16-I61 HydrophobicContact CD2-CG2 3.95Å |
| 17 | S | 65 | Low | 63.6 | Low | 54 Ų | 54 | 82.4 Ų | 82.4 | 38% | 0.378 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64.1 | -39.8 | 177 | -169 | 0 | 0 | 0 | 0 | 112.2 | V13 I14 I20 Q21 | V13-S17 WeakPolarHBondContact O-CB 3.34Å; V13-S17 PolarHBondContact O-N 3.39Å; I14-S17 PolarHBondContact O-N 2.67Å; I14-S17 VanDerWaalsContact O-N 3.14Å; S17-I20 PolarHBondContact O-N 3.23Å; S17-Q21 WeakPolarHBondContact O-CG 3.08Å; S17-Q21 PolarHBondContact O-N 3.01Å |
| 18 | T | 61.2 | Low | 62.6 | Low | 66 Ų | 66 | 83.7 Ų | 83.7 | 41% | 0.405 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -69.8 | -37 | 176.7 | 57.8 | 0 | 0 | 0 | 0 | 112.2 | I14 V15 I20 Q21 Y22 | I14-T18 HydrophobicContact CG2-CG2 4.47Å; I14-T18 WeakPolarHBondContact O-CG2 3.39Å; I14-T18 PolarHBondContact O-N 3.36Å; I14-T18 PolarHBondContact O-OG1 2.74Å; V15-T18 WeakPolarHBondContact CA-OG1 3.34Å; V15-T18 PolarHBondContact O-N 3.49Å; V15-T18 PolarHBondContact O-OG1 3.29Å; T18-I20 VanDerWaalsContact C-N 3.34Å; T18-Q21 PolarHBondContact O-N 2.91Å; T18-Y22 WeakPolarHBondContact O-CB 3.28Å; T18-Y22 PolarHBondContact O-N 2.94Å |
| 19 | M | 61.9 | Low | 61.7 | Low | 104 Ų | 104 | 87.9 Ų | 87.9 | 51% | 0.512 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.3 | -41.5 | 172.1 | -73.5 | -67.9 | 103.9 | 0 | 0 | 111.6 | V15 L16 Y22 V23 | V15-M19 WeakPolarHBondContact O-CG 2.99Å; V15-M19 PolarHBondContact O-N 3.35Å; L16-M19 PolarHBondContact O-N 3.49Å; M19-Y22 PolarHBondContact O-N 3.36Å; M19-V23 VanDerWaalsContact O-CG2 3.28Å; M19-V23 WeakPolarHBondContact O-CG2 3.18Å; M19-V23 PolarHBondContact O-N 2.93Å |
| 20 | I | 61.5 | Low | 60.5 | Low | 39 Ų | 39 | 88.3 Ų | 88.3 | 20% | 0.2 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -62.5 | -46.5 | 175.1 | -69.6 | 164.6 | 0 | 0 | 0 | 110.8 | L16 S17 T18 Y22 V23 I24 I58 I61 | L16-I20 HydrophobicContact CG-CD1 4.24Å; L16-I20 VanDerWaalsContact O-CG1 3.28Å; L16-I20 WeakPolarHBondContact O-CG1 3.48Å; L16-I20 PolarHBondContact O-N 3.38Å; S17-I20 PolarHBondContact O-N 3.23Å; T18-I20 VanDerWaalsContact C-N 3.34Å; I20-Y22 VanDerWaalsContact C-N 3.27Å; I20-Y22 PolarHBondContact O-N 2.8Å; I20-V23 PolarHBondContact O-N 3.16Å; I20-I24 HydrophobicContact CG2-CD1 3.77Å; I20-I24 WeakPolarHBondContact O-CG1 3.38Å; I20-I24 PolarHBondContact O-N 3.09Å; I20-I58 HydrophobicContact CG2-CD1 3.83Å; I20-I58 HydrophobicContact CG2-CG1 3.76Å; I20-I61 HydrophobicContact CD1-CD1 4.47Å |
| 21 | Q | 55.6 | Low | 59.3 | Low | 127 Ų | 127 | 90.7 Ų | 90.7 | 59% | 0.593 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.2 | -31.7 | 175.9 | -72.2 | 179.3 | 32.3 | 0 | 0 | 112.3 | S17 T18 G25 | S17-Q21 WeakPolarHBondContact O-CG 3.08Å; S17-Q21 PolarHBondContact O-N 3.01Å; T18-Q21 PolarHBondContact O-N 2.91Å; Q21-G25 WeakPolarHBondContact O-CA 3.27Å; Q21-G25 PolarHBondContact O-N 3.35Å |
| 22 | Y | 56.4 | Low | 57.9 | Low | 162 Ų | 162 | 93.1 Ų | 93.1 | 64% | 0.635 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -74.6 | -35.2 | 174.5 | -169.3 | -93.7 | 0 | 0 | 0 | 111.8 | T18 M19 I20 I24 G26 | T18-Y22 WeakPolarHBondContact O-CB 3.28Å; T18-Y22 PolarHBondContact O-N 2.94Å; M19-Y22 PolarHBondContact O-N 3.36Å; I20-Y22 VanDerWaalsContact C-N 3.27Å; I20-Y22 PolarHBondContact O-N 2.8Å; Y22-I24 VanDerWaalsContact C-N 3.32Å; Y22-I24 PolarHBondContact O-N 2.94Å; Y22-G26 WeakPolarHBondContact O-CA 3.38Å; Y22-G26 PolarHBondContact O-N 2.81Å |
| 23 | V | 58 | Low | 56.9 | Low | 121 Ų | 121 | 95 Ų | 95 | 73% | 0.733 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -67.7 | -35.3 | 173.9 | 170.9 | 0 | 0 | 0 | 0 | 111.1 | M19 I20 | M19-V23 VanDerWaalsContact O-CG2 3.28Å; M19-V23 WeakPolarHBondContact O-CG2 3.18Å; M19-V23 PolarHBondContact O-N 2.93Å; I20-V23 PolarHBondContact O-N 3.16Å |
| 24 | I | 54 | Low | 55.8 | Low | 81 Ų | 81 | 96.6 Ų | 96.6 | 42% | 0.415 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -88.9 | -39.9 | -178.8 | -63.7 | 168 | 0 | 0 | 0 | 112.4 | I20 Y22 I58 | I20-I24 HydrophobicContact CG2-CD1 3.77Å; I20-I24 WeakPolarHBondContact O-CG1 3.38Å; I20-I24 PolarHBondContact O-N 3.09Å; Y22-I24 VanDerWaalsContact C-N 3.32Å; Y22-I24 PolarHBondContact O-N 2.94Å; I24-I58 HydrophobicContact CD1-CD1 3.47Å; I24-I58 VanDerWaalsContact CD1-CD1 3.47Å |
| 25 | G | 48.9 | Very low | 54.5 | Low | 32 Ų | 32 | 97 Ų | 97 | 33% | 0.33 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -106.4 | -7.8 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | Q21 S27 I28 | Q21-G25 WeakPolarHBondContact O-CA 3.27Å; Q21-G25 PolarHBondContact O-N 3.35Å; G25-S27 PolarHBondContact O-N 3.34Å; G25-I28 WeakPolarHBondContact O-CD1 3.5Å; G25-I28 WeakPolarHBondContact O-CG1 3.23Å; G25-I28 PolarHBondContact O-N 3.24Å |
| 26 | G | 47 | Very low | 53 | Low | 20 Ų | 20 | 99.5 Ų | 99.5 | 21% | 0.206 | 57% | 0.569 | C | S | . | * | G | 310 helix | trans | -78.6 | -1.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | Y22 I28 | Y22-G26 WeakPolarHBondContact O-CA 3.38Å; Y22-G26 PolarHBondContact O-N 2.81Å; G26-I28 PolarHBondContact O-N 3.02Å |
| 27 | S | 51.5 | Low | 51.5 | Low | 99 Ų | 99 | 103.6 Ų | 103.6 | 69% | 0.692 | 58% | 0.584 | S | S | * | * | G | 310 helix | trans | -87 | 18.1 | 165.7 | -168.6 | 0 | 0 | 0 | 0 | 113.1 | G25 | G25-S27 PolarHBondContact O-N 3.34Š|
| 28 | I | 49 | Very low | 50.7 | Low | 139 Ų | 139 | 108.3 Ų | 108.3 | 71% | 0.713 | 61% | 0.605 | S | S | * | * | G | 310 helix | trans | -92.8 | -20.5 | 169.7 | -46.5 | 164.1 | 0 | 0 | 0 | 111 | G25 G26 | G25-I28 WeakPolarHBondContact O-CD1 3.5Å; G25-I28 WeakPolarHBondContact O-CG1 3.23Å; G25-I28 PolarHBondContact O-N 3.24Å; G26-I28 PolarHBondContact O-N 3.02Å |
| 29 | F | 51.2 | Low | 49.6 | Very low | 189 Ų | 189 | 114 Ų | 114 | 83% | 0.829 | 63% | 0.629 | S | S | * | * | S | Bend | trans | -99.9 | 8.6 | 172 | -69.1 | -74.4 | 0 | 0 | 0 | 113.3 | ||
| 30 | G | 44.1 | Very low | 48.6 | Very low | 60 Ų | 60 | 115 Ų | 115 | 62% | 0.619 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -96.9 | 3.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 31 | D | 46 | Very low | 48 | Very low | 118 Ų | 118 | 118.7 Ų | 118.7 | 63% | 0.631 | 67% | 0.666 | S | S | * | * | trans | -133.8 | 74.7 | 173.2 | -146.2 | 2.5 | 0 | 0 | 0 | 109 | T33 | D31-T33 VanDerWaalsContact C-N 3.32Å; D31-T33 PolarHBondContact O-N 2.83Å | ||
| 32 | D | 44.9 | Very low | 47.6 | Very low | 129 Ų | 129 | 119.3 Ų | 119.3 | 69% | 0.69 | 68% | 0.678 | S | S | * | * | trans | -44.6 | 103.1 | 154.8 | -81.8 | -44.4 | 0 | 0 | 0 | 108.4 | S34 | D32-S34 WeakPolarHBondContact O-CA 3.41Å; D32-S34 VanDerWaalsContact O-CB 3.24Å; D32-S34 WeakPolarHBondContact O-CB 3.39Å; D32-S34 PolarHBondContact O-N 3.49Å; D32-S34 PolarHBondContact O-OG 3Å | ||
| 33 | T | 48.5 | Very low | 47.1 | Very low | 141 Ų | 141 | 117.6 Ų | 117.6 | 87% | 0.865 | 69% | 0.685 | S | S | * | * | S | Bend | trans | 22.8 | 42.1 | 132.5 | -23.5 | 0 | 0 | 0 | 0 | 117.3 | D31 | D31-T33 VanDerWaalsContact C-N 3.32Å; D31-T33 PolarHBondContact O-N 2.83Å |
| 34 | S | 48.9 | Very low | 46.7 | Very low | 94 Ų | 94 | 121 Ų | 121 | 66% | 0.657 | 69% | 0.69 | S | S | * | * | trans | -137.9 | -0.4 | -173.2 | 72.8 | 0 | 0 | 0 | 0 | 114 | D32 | D32-S34 WeakPolarHBondContact O-CA 3.41Å; D32-S34 VanDerWaalsContact O-CB 3.24Å; D32-S34 WeakPolarHBondContact O-CB 3.39Å; D32-S34 PolarHBondContact O-N 3.49Å; D32-S34 PolarHBondContact O-OG 3Å | ||
| 35 | T | 44.3 | Very low | 46.4 | Very low | 104 Ų | 104 | 121.1 Ų | 121.1 | 64% | 0.638 | 70% | 0.703 | S | S | * | * | trans | -108.4 | 46.5 | 169.9 | -11.6 | 0 | 0 | 0 | 0 | 112.6 | K37 | T35-K37 PolarHBondContact O-N 3.21Š| ||
| 36 | T | 42.4 | Very low | 46.1 | Very low | 129 Ų | 129 | 123.8 Ų | 123.8 | 79% | 0.791 | 72% | 0.717 | S | S | * | * | trans | -61.9 | 77.6 | 142.4 | -60.3 | 0 | 0 | 0 | 0 | 108 | ||||
| 37 | K | 40.8 | Very low | 46.2 | Very low | 168 Ų | 168 | 125.6 Ų | 125.6 | 73% | 0.73 | 73% | 0.726 | S | S | * | * | S | Bend | trans | 168.9 | 114.3 | 149.3 | -96 | 162.9 | -178.7 | -179.4 | 0 | 111.2 | T35 | T35-K37 PolarHBondContact O-N 3.21Š|
| 38 | N | 48.5 | Very low | 46.2 | Very low | 153 Ų | 153 | 123.2 Ų | 123.2 | 82% | 0.818 | 71% | 0.712 | S | S | * | * | trans | 58.2 | 79.5 | 143.4 | -62.7 | 31 | 0 | 0 | 0 | 118.5 | ||||
| 39 | M | 38.4 | Very low | 46.4 | Very low | 186 Ų | 186 | 121.6 Ų | 121.6 | 92% | 0.916 | 71% | 0.705 | S | S | * | * | trans | -156.6 | 97.5 | 135.4 | -146.6 | 162 | -175.7 | 0 | 0 | 111.4 | T41 | M39-T41 PolarHBondContact O-N 3.45Š| ||
| 40 | T | 40.3 | Very low | 46.3 | Very low | 125 Ų | 125 | 115.7 Ų | 115.7 | 77% | 0.767 | 69% | 0.688 | S | S | * | * | trans | -68.1 | 119.8 | 171.6 | -21 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 41 | T | 50.2 | Low | 46.8 | Very low | 116 Ų | 116 | 117.8 Ų | 117.8 | 71% | 0.712 | 68% | 0.684 | S | S | * | * | S | Bend | trans | 55.6 | 102.7 | 147.6 | 49 | 0 | 0 | 0 | 0 | 119.5 | M39 | M39-T41 PolarHBondContact O-N 3.45Š|
| 42 | T | 45.2 | Very low | 47.2 | Very low | 139 Ų | 139 | 118.4 Ų | 118.4 | 85% | 0.853 | 68% | 0.683 | S | S | * | * | trans | -163.6 | 5.4 | 138 | 23.6 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 43 | T | 47.1 | Very low | 48.1 | Very low | 126 Ų | 126 | 116.9 Ų | 116.9 | 77% | 0.773 | 68% | 0.678 | S | S | * | * | trans | -109.2 | 20.8 | -178.8 | 14.1 | 0 | 0 | 0 | 0 | 116.4 | A45 | T43-A45 VanDerWaalsContact C-N 3.28Å; T43-A45 PolarHBondContact O-N 3.2Å | ||
| 44 | K | 49.1 | Very low | 48.9 | Very low | 192 Ų | 192 | 112.3 Ų | 112.3 | 84% | 0.835 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -77 | -9.2 | 169.4 | -79.2 | -170.2 | 178.2 | -179 | 0 | 114.3 | S47 | K44-S47 PolarHBondContact O-OG 2.85Š|
| 45 | A | 47 | Very low | 49.6 | Very low | 84 Ų | 84 | 116.6 Ų | 116.6 | 69% | 0.694 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -80.4 | -22.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | T43 | T43-A45 VanDerWaalsContact C-N 3.28Å; T43-A45 PolarHBondContact O-N 3.2Å |
| 46 | S | 44.3 | Very low | 50.9 | Low | 89 Ų | 89 | 117.4 Ų | 117.4 | 62% | 0.622 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -95.2 | -12.3 | -176.8 | -167.9 | 0 | 0 | 0 | 0 | 114.4 | ||
| 47 | S | 48.4 | Very low | 52.2 | Low | 57 Ų | 57 | 113.4 Ų | 113.4 | 40% | 0.399 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -83.8 | -23.1 | -177.8 | 56.4 | 0 | 0 | 0 | 0 | 113.7 | K44 S50 L51 | K44-S47 PolarHBondContact O-OG 2.85Å; S47-S50 PolarHBondContact O-OG 3.45Å; S47-L51 WeakPolarHBondContact O-CB 3.44Å; S47-L51 PolarHBondContact O-N 2.9Å; S47-L51 VanDerWaalsContact O-N 3.11Å |
| 48 | A | 51.4 | Low | 53.6 | Low | 49 Ų | 49 | 107.1 Ų | 107.1 | 41% | 0.405 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -66.1 | -46.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | S50 L51 E52 | A48-S50 VanDerWaalsContact C-N 3.34Å; A48-S50 PolarHBondContact O-N 3.35Å; A48-L51 WeakPolarHBondContact O-CB 3.21Å; A48-L51 PolarHBondContact O-N 3.41Å; A48-E52 PolarHBondContact O-N 3.38Å |
| 49 | N | 52.4 | Low | 54.7 | Low | 105 Ų | 105 | 102 Ų | 102 | 56% | 0.561 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -63.7 | -37.6 | 179.4 | -63.7 | 57.2 | 0 | 0 | 0 | 112.2 | V53 | N49-V53 VanDerWaalsContact O-CG2 3.24Å; N49-V53 WeakPolarHBondContact O-CG2 3.39Å; N49-V53 PolarHBondContact O-N 2.89Å |
| 50 | S | 50.6 | Low | 56.3 | Low | 66 Ų | 66 | 96.2 Ų | 96.2 | 46% | 0.462 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -70.2 | -34.5 | 176.7 | 59.7 | 0 | 0 | 0 | 0 | 112.4 | S47 A48 S54 | S47-S50 PolarHBondContact O-OG 3.45Å; A48-S50 VanDerWaalsContact C-N 3.34Å; A48-S50 PolarHBondContact O-N 3.35Å; S50-S54 WeakPolarHBondContact O-CB 3.28Å; S50-S54 PolarHBondContact O-N 2.95Å; S50-S54 PolarHBondContact O-OG 2.92Å |
| 51 | L | 55 | Low | 58 | Low | 103 Ų | 103 | 93.2 Ų | 93.2 | 54% | 0.539 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -66.6 | -43.3 | 172.7 | -95 | 150.9 | 0 | 0 | 0 | 112.3 | S47 A48 S54 W55 | S47-L51 WeakPolarHBondContact O-CB 3.44Å; S47-L51 PolarHBondContact O-N 2.9Å; S47-L51 VanDerWaalsContact O-N 3.11Å; A48-L51 WeakPolarHBondContact O-CB 3.21Å; A48-L51 PolarHBondContact O-N 3.41Å; L51-S54 WeakPolarHBondContact O-CB 3.44Å; L51-S54 PolarHBondContact O-N 2.9Å; L51-W55 PolarHBondContact O-N 3.14Å |
| 52 | E | 54.4 | Low | 59.1 | Low | 131 Ų | 131 | 90.3 Ų | 90.3 | 61% | 0.612 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -63.7 | -43.6 | 176.4 | -73.1 | -176 | 177.2 | 0 | 0 | 112 | A48 S54 W55 L56 | A48-E52 PolarHBondContact O-N 3.38Å; E52-S54 VanDerWaalsContact C-N 3.28Å; E52-S54 PolarHBondContact O-N 3.49Å; E52-W55 PolarHBondContact O-N 3.38Å; E52-L56 WeakPolarHBondContact O-CG 3.31Å; E52-L56 PolarHBondContact O-N 3.26Å |
| 53 | V | 62.7 | Low | 60.6 | Low | 98 Ų | 98 | 90.1 Ų | 90.1 | 59% | 0.594 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.1 | -39.8 | 173.8 | 173.4 | 0 | 0 | 0 | 0 | 110.6 | N49 L56 A57 | N49-V53 VanDerWaalsContact O-CG2 3.24Å; N49-V53 WeakPolarHBondContact O-CG2 3.39Å; N49-V53 PolarHBondContact O-N 2.89Å; V53-L56 PolarHBondContact O-N 2.91Å; V53-A57 VanDerWaalsContact O-CB 3.28Å; V53-A57 WeakPolarHBondContact O-CB 3.28Å; V53-A57 PolarHBondContact O-N 3.38Å |
| 54 | S | 65.7 | Low | 61.9 | Low | 44 Ų | 44 | 88.9 Ų | 88.9 | 31% | 0.308 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.1 | -44.4 | 175.5 | -61.3 | 0 | 0 | 0 | 0 | 111 | S50 L51 E52 A57 I58 | S50-S54 WeakPolarHBondContact O-CB 3.28Å; S50-S54 PolarHBondContact O-N 2.95Å; S50-S54 PolarHBondContact O-OG 2.92Å; L51-S54 WeakPolarHBondContact O-CB 3.44Å; L51-S54 PolarHBondContact O-N 2.9Å; E52-S54 VanDerWaalsContact C-N 3.28Å; E52-S54 PolarHBondContact O-N 3.49Å; S54-A57 PolarHBondContact O-N 3.03Å; S54-I58 WeakPolarHBondContact O-CB 3.44Å; S54-I58 VanDerWaalsContact O-CD1 3.27Å; S54-I58 WeakPolarHBondContact O-CD1 3.42Å; S54-I58 WeakPolarHBondContact O-CG1 3.37Å; S54-I58 PolarHBondContact O-N 2.8Å |
| 55 | W | 63.9 | Low | 63.2 | Low | 184 Ų | 184 | 81 Ų | 81 | 70% | 0.697 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -64.9 | -43.2 | 178.3 | -171.6 | -106.4 | 0 | 0 | 0 | 112.7 | L51 E52 I58 S59 | L51-W55 PolarHBondContact O-N 3.14Å; E52-W55 PolarHBondContact O-N 3.38Å; W55-I58 HydrophobicContact CE3-CD1 4.44Å; W55-I58 PolarHBondContact O-N 3.41Å; W55-S59 WeakPolarHBondContact O-CB 3.32Å; W55-S59 PolarHBondContact O-N 2.97Å |
| 56 | L | 72 | Confident | 64.6 | Low | 121 Ų | 121 | 81.6 Ų | 81.6 | 63% | 0.634 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -62.6 | -43 | 175.2 | -71.8 | 171.9 | 0 | 0 | 0 | 111.7 | E52 V53 S59 S60 | E52-L56 WeakPolarHBondContact O-CG 3.31Å; E52-L56 PolarHBondContact O-N 3.26Å; V53-L56 PolarHBondContact O-N 2.91Å; L56-S59 PolarHBondContact O-N 3.25Å; L56-S60 WeakPolarHBondContact O-CB 3.36Å; L56-S60 PolarHBondContact O-N 3.28Å |
| 57 | A | 69.3 | Low | 66.1 | Low | 46 Ų | 46 | 79.3 Ų | 79.3 | 38% | 0.38 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -61.8 | -43.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | V53 S54 S60 I61 | V53-A57 VanDerWaalsContact O-CB 3.28Å; V53-A57 WeakPolarHBondContact O-CB 3.28Å; V53-A57 PolarHBondContact O-N 3.38Å; S54-A57 PolarHBondContact O-N 3.03Å; A57-S60 WeakPolarHBondContact O-CB 3.45Å; A57-S60 PolarHBondContact O-N 2.85Å; A57-I61 WeakPolarHBondContact O-CD1 3.38Å; A57-I61 VanDerWaalsContact O-CG1 3.23Å; A57-I61 WeakPolarHBondContact O-CG1 3.5Å; A57-I61 PolarHBondContact O-N 3.3Å |
| 58 | I | 70.4 | Confident | 67.4 | Low | 36 Ų | 36 | 81.3 Ų | 81.3 | 19% | 0.185 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -62.7 | -49.5 | 176 | -65.7 | 160.4 | 0 | 0 | 0 | 110.6 | I20 I24 S54 W55 S60 I61 S62 | I20-I58 HydrophobicContact CG2-CD1 3.83Å; I20-I58 HydrophobicContact CG2-CG1 3.76Å; I24-I58 HydrophobicContact CD1-CD1 3.47Å; I24-I58 VanDerWaalsContact CD1-CD1 3.47Å; S54-I58 WeakPolarHBondContact O-CB 3.44Å; S54-I58 VanDerWaalsContact O-CD1 3.27Å; S54-I58 WeakPolarHBondContact O-CD1 3.42Å; S54-I58 WeakPolarHBondContact O-CG1 3.37Å; S54-I58 PolarHBondContact O-N 2.8Å; W55-I58 HydrophobicContact CE3-CD1 4.44Å; W55-I58 PolarHBondContact O-N 3.41Å; I58-S60 PolarHBondContact O-N 2.92Å; I58-I61 PolarHBondContact O-N 3.5Å; I58-I61 VanDerWaalsContact O-N 3.16Å; I58-S62 WeakPolarHBondContact O-CB 3.32Å; I58-S62 PolarHBondContact O-N 3.45Å; I58-S62 PolarHBondContact O-OG 2.92Å; I58-S62 VanDerWaalsContact O-OG 3.09Å |
| 59 | S | 71.2 | Confident | 68.5 | Low | 46 Ų | 46 | 83 Ų | 83 | 32% | 0.322 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -57.5 | -40.6 | 178.8 | -175.1 | 0 | 0 | 0 | 0 | 111.1 | W55 L56 S62 M63 | W55-S59 WeakPolarHBondContact O-CB 3.32Å; W55-S59 PolarHBondContact O-N 2.97Å; L56-S59 PolarHBondContact O-N 3.25Å; S59-S62 PolarHBondContact O-N 2.83Å; S59-M63 WeakPolarHBondContact O-CG 3.34Å; S59-M63 PolarHBondContact O-N 3.34Å |
| 60 | S | 72.5 | Confident | 69.5 | Low | 64 Ų | 64 | 82.4 Ų | 82.4 | 45% | 0.448 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -63.8 | -48.9 | 175.8 | -175.2 | 0 | 0 | 0 | 0 | 112 | L56 A57 I58 S62 M63 I64 | L56-S60 WeakPolarHBondContact O-CB 3.36Å; L56-S60 PolarHBondContact O-N 3.28Å; A57-S60 WeakPolarHBondContact O-CB 3.45Å; A57-S60 PolarHBondContact O-N 2.85Å; I58-S60 PolarHBondContact O-N 2.92Å; S60-S62 VanDerWaalsContact C-N 3.33Å; S60-S62 PolarHBondContact O-N 3.17Å; S60-M63 PolarHBondContact O-N 3.39Å; S60-I64 WeakPolarHBondContact O-CG1 3.31Å; S60-I64 PolarHBondContact O-N 2.89Å |
| 61 | I | 75.2 | Confident | 70.5 | Confident | 62 Ų | 62 | 81 Ų | 81 | 32% | 0.318 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -60.2 | -43.6 | 176.9 | -66.9 | 160.8 | 0 | 0 | 0 | 110.7 | L16 I20 A57 I58 M63 I64 V65 | L16-I61 HydrophobicContact CD2-CG2 3.95Å; I20-I61 HydrophobicContact CD1-CD1 4.47Å; A57-I61 WeakPolarHBondContact O-CD1 3.38Å; A57-I61 VanDerWaalsContact O-CG1 3.23Å; A57-I61 WeakPolarHBondContact O-CG1 3.5Å; A57-I61 PolarHBondContact O-N 3.3Å; I58-I61 PolarHBondContact O-N 3.5Å; I58-I61 VanDerWaalsContact O-N 3.16Å; I61-M63 PolarHBondContact O-N 3.34Å; I61-I64 PolarHBondContact O-N 2.95Å; I61-V65 HydrophobicContact CG2-CG2 4.31Å; I61-V65 VanDerWaalsContact O-CG2 3.31Å; I61-V65 WeakPolarHBondContact O-CG2 3.34Å; I61-V65 PolarHBondContact O-N 3.01Å |
| 62 | S | 74.4 | Confident | 70.8 | Confident | 55 Ų | 55 | 82 Ų | 82 | 39% | 0.385 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -60.3 | -43.2 | 176.8 | -64.5 | 0 | 0 | 0 | 0 | 111.9 | I58 S59 S60 I64 V65 I66 | I58-S62 WeakPolarHBondContact O-CB 3.32Å; I58-S62 PolarHBondContact O-N 3.45Å; I58-S62 PolarHBondContact O-OG 2.92Å; I58-S62 VanDerWaalsContact O-OG 3.09Å; S59-S62 PolarHBondContact O-N 2.83Å; S60-S62 VanDerWaalsContact C-N 3.33Å; S60-S62 PolarHBondContact O-N 3.17Å; S62-I64 PolarHBondContact O-N 2.83Å; S62-V65 PolarHBondContact O-N 3.43Å; S62-I66 WeakPolarHBondContact O-CB 3.32Å; S62-I66 WeakPolarHBondContact O-CD1 3.3Å; S62-I66 WeakPolarHBondContact O-CG1 3.27Å; S62-I66 PolarHBondContact O-N 3.44Å |
| 63 | M | 74.8 | Confident | 71.4 | Confident | 134 Ų | 134 | 81.3 Ų | 81.3 | 66% | 0.66 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -63.1 | -40.6 | 175.2 | -72.9 | -168.5 | -165 | 0 | 0 | 112.2 | S59 S60 I61 I66 G67 | S59-M63 WeakPolarHBondContact O-CG 3.34Å; S59-M63 PolarHBondContact O-N 3.34Å; S60-M63 PolarHBondContact O-N 3.39Å; I61-M63 PolarHBondContact O-N 3.34Å; M63-I66 PolarHBondContact O-N 3.01Å; M63-G67 PolarHBondContact O-N 3.34Å |
| 64 | I | 76.4 | Confident | 71.4 | Confident | 100 Ų | 100 | 84.7 Ų | 84.7 | 51% | 0.513 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -62.6 | -46.4 | 176 | -66 | 163.9 | 0 | 0 | 0 | 110.4 | S60 I61 S62 G67 L68 | S60-I64 WeakPolarHBondContact O-CG1 3.31Å; S60-I64 PolarHBondContact O-N 2.89Å; I61-I64 PolarHBondContact O-N 2.95Å; S62-I64 PolarHBondContact O-N 2.83Å; I64-G67 PolarHBondContact O-N 2.87Å; I64-L68 HydrophobicContact CG2-CD1 4.05Å; I64-L68 HydrophobicContact CG2-CG 4.44Å; I64-L68 WeakPolarHBondContact O-CG 3.48Å; I64-L68 PolarHBondContact O-N 3.36Å |
| 65 | V | 75.2 | Confident | 71.1 | Confident | 28 Ų | 28 | 92.2 Ų | 92.2 | 17% | 0.17 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -61.6 | -46.6 | 178.6 | 170.9 | 0 | 0 | 0 | 0 | 110.8 | V13 I61 S62 G67 L68 I69 | V13-V65 HydrophobicContact CG1-CG1 4.21Å; V13-V65 HydrophobicContact CG2-CG1 3.56Å; I61-V65 HydrophobicContact CG2-CG2 4.31Å; I61-V65 VanDerWaalsContact O-CG2 3.31Å; I61-V65 WeakPolarHBondContact O-CG2 3.34Å; I61-V65 PolarHBondContact O-N 3.01Å; S62-V65 PolarHBondContact O-N 3.43Å; V65-G67 VanDerWaalsContact C-N 3.32Å; V65-G67 PolarHBondContact O-N 3.42Å; V65-L68 PolarHBondContact O-N 3.24Å; V65-I69 HydrophobicContact CG1-CD1 3.77Å; V65-I69 HydrophobicContact CG1-CG1 4.49Å; V65-I69 VanDerWaalsContact O-CG1 3.25Å; V65-I69 WeakPolarHBondContact O-CG1 3.28Å; V65-I69 PolarHBondContact O-N 3.46Å |
| 66 | I | 76.1 | Confident | 70.7 | Confident | 96 Ų | 96 | 89.3 Ų | 89.3 | 49% | 0.492 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -61.8 | -42 | 176.4 | -67.8 | 163.8 | 0 | 0 | 0 | 110.6 | S62 M63 I69 N70 | S62-I66 WeakPolarHBondContact O-CB 3.32Å; S62-I66 WeakPolarHBondContact O-CD1 3.3Å; S62-I66 WeakPolarHBondContact O-CG1 3.27Å; S62-I66 PolarHBondContact O-N 3.44Å; M63-I66 PolarHBondContact O-N 3.01Å; I66-I69 PolarHBondContact O-N 2.81Å; I66-N70 WeakPolarHBondContact CG2-ND2 3.25Å; I66-N70 WeakPolarHBondContact O-CB 3.44Å; I66-N70 VanDerWaalsContact O-CG 3.27Å; I66-N70 PolarHBondContact O-N 3.33Å; I66-N70 PolarHBondContact O-ND2 3.36Å |
| 67 | G | 75.4 | Confident | 70 | Confident | 41 Ų | 41 | 90.3 Ų | 90.3 | 42% | 0.423 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.1 | -41.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | M63 I64 V65 N70 G71 | M63-G67 PolarHBondContact O-N 3.34Å; I64-G67 PolarHBondContact O-N 2.87Å; V65-G67 VanDerWaalsContact C-N 3.32Å; V65-G67 PolarHBondContact O-N 3.42Å; G67-N70 PolarHBondContact O-N 3.18Å; G67-G71 PolarHBondContact O-N 3.37Å |
| 68 | L | 75.8 | Confident | 69.1 | Low | 99 Ų | 99 | 98 Ų | 98 | 52% | 0.518 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.8 | -45.3 | 174.7 | -73.4 | 170.6 | 0 | 0 | 0 | 111.3 | I64 V65 G71 H72 | I64-L68 HydrophobicContact CG2-CD1 4.05Å; I64-L68 HydrophobicContact CG2-CG 4.44Å; I64-L68 WeakPolarHBondContact O-CG 3.48Å; I64-L68 PolarHBondContact O-N 3.36Å; V65-L68 PolarHBondContact O-N 3.24Å; L68-G71 PolarHBondContact O-N 3.34Å; L68-H72 VanDerWaalsContact O-CB 3.28Å; L68-H72 WeakPolarHBondContact O-CB 3.2Å; L68-H72 VanDerWaalsContact O-CG 3.27Å; L68-H72 PolarHBondContact O-N 3.08Å; L68-H72 PolarHBondContact O-ND1 2.98Å |
| 69 | I | 74.2 | Confident | 69 | Low | 84 Ų | 84 | 101.1 Ų | 101.1 | 43% | 0.431 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.1 | -49.4 | 176.3 | -67.6 | 164.7 | 0 | 0 | 0 | 110.1 | V65 I66 H72 L73 | V65-I69 HydrophobicContact CG1-CD1 3.77Å; V65-I69 HydrophobicContact CG1-CG1 4.49Å; V65-I69 VanDerWaalsContact O-CG1 3.25Å; V65-I69 WeakPolarHBondContact O-CG1 3.28Å; V65-I69 PolarHBondContact O-N 3.46Å; I66-I69 PolarHBondContact O-N 2.81Å; I69-H72 PolarHBondContact O-N 3.42Å; I69-L73 VanDerWaalsContact O-CB 3.27Å; I69-L73 WeakPolarHBondContact O-CB 3.21Å; I69-L73 PolarHBondContact O-N 3.35Å |
| 70 | N | 73.5 | Confident | 68.9 | Low | 92 Ų | 92 | 104 Ų | 104 | 49% | 0.492 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.5 | -41.1 | 179.7 | -73.7 | -25.8 | 0 | 0 | 0 | 112.2 | I66 G67 H72 L73 R74 | I66-N70 WeakPolarHBondContact CG2-ND2 3.25Å; I66-N70 WeakPolarHBondContact O-CB 3.44Å; I66-N70 VanDerWaalsContact O-CG 3.27Å; I66-N70 PolarHBondContact O-N 3.33Å; I66-N70 PolarHBondContact O-ND2 3.36Å; G67-N70 PolarHBondContact O-N 3.18Å; N70-H72 VanDerWaalsContact C-N 3.34Å; N70-L73 PolarHBondContact O-N 3.37Å; N70-R74 WeakPolarHBondContact O-CB 3.44Å; N70-R74 PolarHBondContact O-N 3.16Å |
| 71 | G | 72.5 | Confident | 68.7 | Low | 38 Ų | 38 | 106.2 Ų | 106.2 | 39% | 0.392 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.3 | -39.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | G67 L68 R75 | G67-G71 PolarHBondContact O-N 3.37Å; L68-G71 PolarHBondContact O-N 3.34Å; G71-R75 WeakPolarHBondContact O-CB 3.45Å; G71-R75 PolarHBondContact O-N 3.28Å |
| 72 | H | 61.9 | Low | 68.3 | Low | 124 Ų | 124 | 108.8 Ų | 108.8 | 57% | 0.574 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -73.4 | -39.8 | 176.7 | -74.6 | 27.7 | 0 | 0 | 0 | 112.1 | L68 I69 N70 R75 F76 | L68-H72 VanDerWaalsContact O-CB 3.28Å; L68-H72 WeakPolarHBondContact O-CB 3.2Å; L68-H72 VanDerWaalsContact O-CG 3.27Å; L68-H72 PolarHBondContact O-N 3.08Å; L68-H72 PolarHBondContact O-ND1 2.98Å; I69-H72 PolarHBondContact O-N 3.42Å; N70-H72 VanDerWaalsContact C-N 3.34Å; H72-R75 PolarHBondContact O-N 3.02Å; H72-F76 PolarHBondContact O-N 3.14Å; H72-F76 VanDerWaalsContact O-N 3.14Å |
| 73 | L | 65.5 | Low | 67.9 | Low | 115 Ų | 115 | 112.2 Ų | 112.2 | 60% | 0.602 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -64.1 | -41.3 | 174.1 | -170.8 | 65.7 | 0 | 0 | 0 | 111.1 | I69 N70 F76 I77 | I69-L73 VanDerWaalsContact O-CB 3.27Å; I69-L73 WeakPolarHBondContact O-CB 3.21Å; I69-L73 PolarHBondContact O-N 3.35Å; N70-L73 PolarHBondContact O-N 3.37Å; L73-F76 WeakPolarHBondContact O-CA 3.27Å; L73-F76 VanDerWaalsContact O-CB 3.27Å; L73-F76 WeakPolarHBondContact O-CB 3.47Å; L73-F76 PolarHBondContact O-N 3Å; L73-I77 PolarHBondContact O-N 3.13Å; L73-I77 VanDerWaalsContact O-N 3.16Å |
| 74 | R | 64.3 | Low | 67.5 | Low | 170 Ų | 170 | 110.7 Ų | 110.7 | 64% | 0.642 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -63.8 | -39.1 | 174 | -178.4 | 174.7 | 173.1 | -91 | -2.6 | 112.2 | N70 F76 I77 F78 | N70-R74 WeakPolarHBondContact O-CB 3.44Å; N70-R74 PolarHBondContact O-N 3.16Å; R74-F76 PolarHBondContact O-N 3.3Å; R74-I77 PolarHBondContact O-N 3.38Å; R74-F78 HydrophobicContact CG-CD2 4.22Å; R74-F78 HydrophobicContact CG-CE2 4.36Å; R74-F78 PolarHBondContact O-N 3.04Å |
| 75 | R | 59.3 | Low | 66.8 | Low | 202 Ų | 202 | 111.5 Ų | 111.5 | 76% | 0.762 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -67.5 | -13.9 | 172.5 | -178.6 | 172.7 | 166.4 | -161.7 | -3.2 | 113 | G71 H72 F78 | G71-R75 WeakPolarHBondContact O-CB 3.45Å; G71-R75 PolarHBondContact O-N 3.28Å; H72-R75 PolarHBondContact O-N 3.02Å; R75-F78 VanDerWaalsContact O-OXT 3.05Å |
| 76 | F | 54.4 | Low | 66.2 | Low | 123 Ų | 123 | 117.9 Ų | 117.9 | 54% | 0.539 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -92.1 | -25.4 | 177.5 | -142.9 | -83.5 | 0 | 0 | 0 | 112.9 | Y2 H72 L73 R74 | Y2-F76 HydrophobicContact CD1-CD2 4.49Å; Y2-F76 AromaticContact CD1-CE2 3.24Å; Y2-F76 HydrophobicContact CD1-CE2 3.24Å; Y2-F76 AromaticContact CD1-CZ 3.48Å; Y2-F76 HydrophobicContact CD1-CZ 3.48Å; Y2-F76 VanDerWaalsContact CD1-CZ 3.48Å; Y2-F76 HydrophobicContact CD2-CE2 4.34Å; Y2-F76 AromaticContact CD2-CZ 3.7Å; Y2-F76 HydrophobicContact CD2-CZ 3.7Å; Y2-F76 AromaticContact CE1-CE2 3.63Å; Y2-F76 HydrophobicContact CE1-CE2 3.63Å; Y2-F76 AromaticContact CE1-CZ 3.84Å; Y2-F76 HydrophobicContact CE1-CZ 3.84Å; Y2-F76 HydrophobicContact CE2-CZ 4.08Å; Y2-F76 AromaticContact CG-CE2 3.61Å; Y2-F76 HydrophobicContact CG-CE2 3.61Å; Y2-F76 AromaticContact CG-CZ 3.36Å; Y2-F76 HydrophobicContact CG-CZ 3.36Å; H72-F76 PolarHBondContact O-N 3.14Å; H72-F76 VanDerWaalsContact O-N 3.14Å; L73-F76 WeakPolarHBondContact O-CA 3.27Å; L73-F76 VanDerWaalsContact O-CB 3.27Å; L73-F76 WeakPolarHBondContact O-CB 3.47Å; L73-F76 PolarHBondContact O-N 3Å; R74-F76 PolarHBondContact O-N 3.3Å |
| 77 | I | 57.5 | Low | 65.4 | Low | 141 Ų | 141 | 119.8 Ų | 119.8 | 72% | 0.723 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -88.6 | -17.7 | -178.8 | -140.4 | 157.3 | 0 | 0 | 0 | 113.2 | L73 R74 | L73-I77 PolarHBondContact O-N 3.13Å; L73-I77 VanDerWaalsContact O-N 3.16Å; R74-I77 PolarHBondContact O-N 3.38Å |
| 78 | F | 50.3 | Low | 64.5 | Low | 208 Ų | 208 | 126.9 Ų | 126.9 | 91% | 0.912 | 60% | 0.599 | S | S | * | * | trans | -108.1 | 0 | 169 | -72.5 | -82.3 | 0 | 0 | 0 | 109.7 | R74 R75 | R74-F78 HydrophobicContact CG-CD2 4.22Å; R74-F78 HydrophobicContact CG-CE2 4.36Å; R74-F78 PolarHBondContact O-N 3.04Å; R75-F78 VanDerWaalsContact O-OXT 3.05Å |
Retrieved 78 of 78 residues in 235.2 ms
(Link to these results)