| 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 | 56.9 | Low | 69.5 | Low | 200 Ų | 200 | 141.5 Ų | 141.5 | 99% | 0.985 | 64% | 0.642 | S | S | * | * | 0 | -11.4 | 0 | -148.8 | 162.4 | 176.3 | 0 | 0 | 113.5 | |||||
| 2 | K | 59.3 | Low | 70.2 | Confident | 154 Ų | 154 | 141.6 Ų | 141.6 | 67% | 0.67 | 65% | 0.645 | S | S | * | * | trans | -81.8 | -42.2 | 175.3 | -155.3 | -179.6 | 177 | -165.6 | 0 | 113.4 | Y4 L5 | K2-Y4 VanDerWaalsContact C-N 3.34Å; K2-Y4 PolarHBondContact O-N 3.29Å; K2-L5 PolarHBondContact O-N 3.25Å | ||
| 3 | Y | 63.8 | Low | 71.2 | Confident | 184 Ų | 184 | 136.4 Ų | 136.4 | 72% | 0.722 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -59.2 | -38.5 | 179.8 | -68.9 | -75.6 | 0 | 0 | 0 | 114.3 | L5 E6 E7 | Y3-L5 VanDerWaalsContact C-N 3.27Å; Y3-L5 PolarHBondContact O-N 3.34Å; Y3-E6 PolarHBondContact O-N 3.36Å; Y3-E7 PolarHBondContact O-N 2.85Å |
| 4 | Y | 65.7 | Low | 72.2 | Confident | 164 Ų | 164 | 134.4 Ų | 134.4 | 64% | 0.643 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -64.2 | -29.9 | -179.4 | -62.6 | -69.4 | 0 | 0 | 0 | 113.6 | K2 E8 | K2-Y4 VanDerWaalsContact C-N 3.34Å; K2-Y4 PolarHBondContact O-N 3.29Å; Y4-E8 WeakPolarHBondContact O-CG 3.43Å; Y4-E8 PolarHBondContact O-N 3.31Å |
| 5 | L | 69.6 | Low | 73 | Confident | 99 Ų | 99 | 132.7 Ų | 132.7 | 52% | 0.518 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -74.3 | -35.6 | 179.5 | -69.7 | 170.8 | 0 | 0 | 0 | 111.9 | K2 Y3 E8 E9 | K2-L5 PolarHBondContact O-N 3.25Å; Y3-L5 VanDerWaalsContact C-N 3.27Å; Y3-L5 PolarHBondContact O-N 3.34Å; L5-E8 PolarHBondContact O-N 3.06Å; L5-E9 WeakPolarHBondContact O-CG 3.41Å; L5-E9 PolarHBondContact O-N 3.46Å |
| 6 | E | 72.8 | Confident | 73.9 | Confident | 95 Ų | 95 | 132.1 Ų | 132.1 | 44% | 0.444 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -67.8 | -38.3 | 179.3 | -68.4 | 171 | -171.2 | 0 | 0 | 110.8 | Y3 E10 | Y3-E6 PolarHBondContact O-N 3.36Å; E6-E10 WeakPolarHBondContact O-CG 3.49Å; E6-E10 PolarHBondContact O-N 3.3Å; E6-E10 VanDerWaalsContact O-N 3.11Å |
| 7 | E | 73.2 | Confident | 74.7 | Confident | 121 Ų | 121 | 131 Ų | 131 | 57% | 0.565 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -66.1 | -41.7 | 175 | -69.3 | 177.1 | 177.5 | 0 | 0 | 112.3 | Y3 E10 E11 | Y3-E7 PolarHBondContact O-N 2.85Å; E7-E10 PolarHBondContact O-N 3.08Å; E7-E11 WeakPolarHBondContact O-CG 3.41Å; E7-E11 PolarHBondContact O-N 3.07Å; E7-E11 VanDerWaalsContact O-N 3.08Å |
| 8 | E | 74.5 | Confident | 75.4 | Confident | 120 Ų | 120 | 129.9 Ų | 129.9 | 56% | 0.561 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -64.3 | -41.6 | 176.8 | -73.8 | 177.1 | -179.7 | 0 | 0 | 112.1 | Y4 L5 E11 E12 | Y4-E8 WeakPolarHBondContact O-CG 3.43Å; Y4-E8 PolarHBondContact O-N 3.31Å; L5-E8 PolarHBondContact O-N 3.06Å; E8-E11 PolarHBondContact O-N 3.1Å; E8-E12 WeakPolarHBondContact O-CG 3.48Å; E8-E12 PolarHBondContact O-N 3.11Å; E8-E12 VanDerWaalsContact O-N 3.1Å |
| 9 | E | 75.5 | Confident | 76 | Confident | 136 Ų | 136 | 129.3 Ų | 129.3 | 64% | 0.636 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -65.3 | -38.8 | 177 | -74.3 | -180 | -173.2 | 0 | 0 | 112.4 | L5 D13 | L5-E9 WeakPolarHBondContact O-CG 3.41Å; L5-E9 PolarHBondContact O-N 3.46Å; E9-D13 PolarHBondContact O-N 3.45Å; E9-D13 VanDerWaalsContact O-N 3.13Å |
| 10 | E | 76.1 | Confident | 76.6 | Confident | 141 Ų | 141 | 126 Ų | 126 | 66% | 0.659 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -67.8 | -40.5 | 176.8 | -75.3 | -176.1 | -177 | 0 | 0 | 112.3 | E6 E7 E14 | E6-E10 WeakPolarHBondContact O-CG 3.49Å; E6-E10 PolarHBondContact O-N 3.3Å; E6-E10 VanDerWaalsContact O-N 3.11Å; E7-E10 PolarHBondContact O-N 3.08Å; E10-E14 PolarHBondContact O-N 3.42Å |
| 11 | E | 76.9 | Confident | 77.1 | Confident | 142 Ų | 142 | 123.7 Ų | 123.7 | 66% | 0.664 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -64.4 | -40.9 | 175.7 | -74.1 | -170.9 | -179.9 | 0 | 0 | 112.1 | E7 E8 E14 E15 | E7-E11 WeakPolarHBondContact O-CG 3.41Å; E7-E11 PolarHBondContact O-N 3.07Å; E7-E11 VanDerWaalsContact O-N 3.08Å; E8-E11 PolarHBondContact O-N 3.1Å; E11-E14 PolarHBondContact O-N 3.38Å; E11-E15 PolarHBondContact O-N 2.95Å |
| 12 | E | 78.6 | Confident | 78.6 | Confident | 143 Ų | 143 | 120.9 Ų | 120.9 | 67% | 0.668 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.1 | -44.3 | 176.6 | -75.7 | -169.9 | 178 | 0 | 0 | 112.5 | E8 E14 E15 E16 | E8-E12 WeakPolarHBondContact O-CG 3.48Å; E8-E12 PolarHBondContact O-N 3.11Å; E8-E12 VanDerWaalsContact O-N 3.1Å; E12-E14 PolarHBondContact O-N 2.93Å; E12-E15 PolarHBondContact O-N 3.26Å; E12-E16 PolarHBondContact O-N 3.5Å |
| 13 | D | 83 | Confident | 79.9 | Confident | 74 Ų | 74 | 117.5 Ų | 117.5 | 40% | 0.396 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -64.2 | -39.6 | 177.4 | 179.2 | 46.8 | 0 | 0 | 0 | 111.7 | E9 E16 K17 | E9-D13 PolarHBondContact O-N 3.45Å; E9-D13 VanDerWaalsContact O-N 3.13Å; D13-E16 PolarHBondContact O-N 3.45Å; D13-K17 WeakPolarHBondContact O-CB 3.3Å; D13-K17 VanDerWaalsContact O-CG 3.29Å; D13-K17 WeakPolarHBondContact O-CG 3.29Å; D13-K17 PolarHBondContact O-N 2.6Å; D13-K17 WeakPolarHBondContact OD1-CE 3.43Å; D13-K17 IonicContact OD1-NZ 3.72Å; D13-K17 WeakPolarHBondContact OD2-CE 3.21Å; D13-K17 IonicContact OD2-NZ 2.6Å; D13-K17 PolarHBondContact OD2-NZ 2.9Å |
| 14 | E | 84.6 | Confident | 81.1 | Confident | 109 Ų | 109 | 115 Ų | 115 | 51% | 0.509 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.3 | -42.4 | 173.1 | -84.8 | -154 | -170.5 | 0 | 0 | 113.1 | E10 E11 E12 K18 | E10-E14 PolarHBondContact O-N 3.42Å; E11-E14 PolarHBondContact O-N 3.38Å; E12-E14 PolarHBondContact O-N 2.93Å; E14-K18 WeakPolarHBondContact O-CD 3.4Å; E14-K18 VanDerWaalsContact O-CG 3.29Å; E14-K18 WeakPolarHBondContact O-CG 3.42Å; E14-K18 PolarHBondContact O-N 3.26Å; E14-K18 IonicContact OE2-NZ 2.85Å; E14-K18 PolarHBondContact OE2-NZ 3.5Å |
| 15 | E | 85.1 | Confident | 82.1 | Confident | 108 Ų | 108 | 111.8 Ų | 111.8 | 51% | 0.505 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.4 | -42.3 | 175.9 | -79.7 | -155.1 | 174.1 | 0 | 0 | 112.2 | E11 E12 K18 K19 | E11-E15 PolarHBondContact O-N 2.95Å; E12-E15 PolarHBondContact O-N 3.26Å; E15-K18 PolarHBondContact O-N 3.02Å; E15-K19 VanDerWaalsContact O-CG 3.29Å; E15-K19 WeakPolarHBondContact O-CG 3.46Å; E15-K19 PolarHBondContact O-N 3.04Å; E15-K19 IonicContact OE2-NZ 2.9Å; E15-K19 PolarHBondContact OE2-NZ 3.34Å |
| 16 | E | 86.8 | Confident | 82.9 | Confident | 124 Ų | 124 | 112.5 Ų | 112.5 | 58% | 0.579 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63.1 | -46 | 177.6 | -171.7 | 171.3 | -174.5 | 0 | 0 | 110.8 | E12 D13 K18 K19 T20 | E12-E16 PolarHBondContact O-N 3.5Å; D13-E16 PolarHBondContact O-N 3.45Å; E16-K18 VanDerWaalsContact C-N 3.29Å; E16-K18 PolarHBondContact O-N 3.15Å; E16-K19 CarbonylContact O-C 3.57Å; E16-K19 WeakPolarHBondContact O-CA 3.26Å; E16-K19 WeakPolarHBondContact O-CB 3.45Å; E16-K19 PolarHBondContact O-N 3.25Å; E16-T20 HydrophobicContact CG-CG2 4.4Å; E16-T20 WeakPolarHBondContact O-CG2 3.29Å; E16-T20 PolarHBondContact O-N 3.48Å; E16-T20 PolarHBondContact O-OG1 3Å |
| 17 | K | 86.6 | Confident | 83.6 | Confident | 113 Ų | 113 | 111.8 Ų | 111.8 | 49% | 0.491 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -55.9 | -41.4 | 172.9 | -75.1 | 168.2 | 178.8 | 164.1 | 0 | 112.4 | D13 K19 T20 V21 | D13-K17 WeakPolarHBondContact O-CB 3.3Å; D13-K17 VanDerWaalsContact O-CG 3.29Å; D13-K17 WeakPolarHBondContact O-CG 3.29Å; D13-K17 PolarHBondContact O-N 2.6Å; D13-K17 WeakPolarHBondContact OD1-CE 3.43Å; D13-K17 IonicContact OD1-NZ 3.72Å; D13-K17 WeakPolarHBondContact OD2-CE 3.21Å; D13-K17 IonicContact OD2-NZ 2.6Å; D13-K17 PolarHBondContact OD2-NZ 2.9Å; K17-K19 VanDerWaalsContact C-N 3.34Å; K17-K19 PolarHBondContact O-N 2.95Å; K17-T20 WeakPolarHBondContact CA-OG1 3.29Å; K17-T20 PolarHBondContact O-OG1 3.13Å; K17-V21 VanDerWaalsContact O-CG2 3.3Å; K17-V21 WeakPolarHBondContact O-CG2 3.42Å; K17-V21 PolarHBondContact O-N 2.9Å; K17-V21 VanDerWaalsContact O-N 3.15Å |
| 18 | K | 87.8 | Confident | 84.2 | Confident | 112 Ų | 112 | 108.6 Ų | 108.6 | 49% | 0.487 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.3 | -36.2 | 175.6 | -71.6 | 162.6 | -169.1 | 152.9 | 0 | 111.5 | E14 E15 E16 K22 | E14-K18 WeakPolarHBondContact O-CD 3.4Å; E14-K18 VanDerWaalsContact O-CG 3.29Å; E14-K18 WeakPolarHBondContact O-CG 3.42Å; E14-K18 PolarHBondContact O-N 3.26Å; E14-K18 IonicContact OE2-NZ 2.85Å; E14-K18 PolarHBondContact OE2-NZ 3.5Å; E15-K18 PolarHBondContact O-N 3.02Å; E16-K18 VanDerWaalsContact C-N 3.29Å; E16-K18 PolarHBondContact O-N 3.15Å; K18-K22 VanDerWaalsContact O-CG 3.26Å; K18-K22 WeakPolarHBondContact O-CG 3.45Å; K18-K22 PolarHBondContact O-N 3.41Å |
| 19 | K | 87.9 | Confident | 84.7 | Confident | 117 Ų | 117 | 105.1 Ų | 105.1 | 51% | 0.509 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -70.4 | -40.9 | 177.2 | -71.1 | 163.2 | -170.4 | 155.7 | 0 | 111.9 | E15 E16 K17 K22 T23 | E15-K19 VanDerWaalsContact O-CG 3.29Å; E15-K19 WeakPolarHBondContact O-CG 3.46Å; E15-K19 PolarHBondContact O-N 3.04Å; E15-K19 IonicContact OE2-NZ 2.9Å; E15-K19 PolarHBondContact OE2-NZ 3.34Å; E16-K19 CarbonylContact O-C 3.57Å; E16-K19 WeakPolarHBondContact O-CA 3.26Å; E16-K19 WeakPolarHBondContact O-CB 3.45Å; E16-K19 PolarHBondContact O-N 3.25Å; K17-K19 VanDerWaalsContact C-N 3.34Å; K17-K19 PolarHBondContact O-N 2.95Å; K19-K22 PolarHBondContact O-N 3.5Å; K19-T23 WeakPolarHBondContact O-CB 3.24Å; K19-T23 PolarHBondContact O-N 3.38Å; K19-T23 PolarHBondContact O-OG1 3.32Å |
| 20 | T | 87.2 | Confident | 85.1 | Confident | 64 Ų | 64 | 103.2 Ų | 103.2 | 39% | 0.393 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.2 | -48.3 | 177.8 | 54.7 | 0 | 0 | 0 | 0 | 111.5 | E16 K17 K22 T23 E24 | E16-T20 HydrophobicContact CG-CG2 4.4Å; E16-T20 WeakPolarHBondContact O-CG2 3.29Å; E16-T20 PolarHBondContact O-N 3.48Å; E16-T20 PolarHBondContact O-OG1 3Å; K17-T20 WeakPolarHBondContact CA-OG1 3.29Å; K17-T20 PolarHBondContact O-OG1 3.13Å; T20-K22 VanDerWaalsContact C-N 3.33Å; T20-K22 PolarHBondContact O-N 3.04Å; T20-T23 WeakPolarHBondContact O-CA 3.47Å; T20-T23 WeakPolarHBondContact O-CB 3.32Å; T20-T23 PolarHBondContact O-N 3.41Å; T20-E24 PolarHBondContact O-N 3.01Å |
| 21 | V | 87.7 | Confident | 85.7 | Confident | 77 Ų | 77 | 104 Ų | 104 | 47% | 0.467 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -58.1 | -44.1 | 176.7 | 173.4 | 0 | 0 | 0 | 0 | 111.6 | K17 T23 E24 I25 | K17-V21 VanDerWaalsContact O-CG2 3.3Å; K17-V21 WeakPolarHBondContact O-CG2 3.42Å; K17-V21 PolarHBondContact O-N 2.9Å; K17-V21 VanDerWaalsContact O-N 3.15Å; V21-T23 VanDerWaalsContact C-N 3.31Å; V21-T23 PolarHBondContact O-N 2.84Å; V21-E24 PolarHBondContact O-N 3.32Å; V21-I25 HydrophobicContact CG1-CD1 3.79Å; V21-I25 WeakPolarHBondContact O-CD1 3.49Å; V21-I25 VanDerWaalsContact O-CG1 3.24Å; V21-I25 WeakPolarHBondContact O-CG1 3.5Å; V21-I25 PolarHBondContact O-N 2.83Å |
| 22 | K | 87.5 | Confident | 86.2 | Confident | 142 Ų | 142 | 103.7 Ų | 103.7 | 62% | 0.617 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.7 | -40.9 | 175.4 | -75.3 | 174.4 | -177.2 | 176.9 | 0 | 111.9 | K18 K19 T20 I25 L26 | K18-K22 VanDerWaalsContact O-CG 3.26Å; K18-K22 WeakPolarHBondContact O-CG 3.45Å; K18-K22 PolarHBondContact O-N 3.41Å; K19-K22 PolarHBondContact O-N 3.5Å; T20-K22 VanDerWaalsContact C-N 3.33Å; T20-K22 PolarHBondContact O-N 3.04Å; K22-I25 PolarHBondContact O-N 3.02Å; K22-L26 VanDerWaalsContact O-CG 3.32Å; K22-L26 WeakPolarHBondContact O-CG 3.28Å; K22-L26 PolarHBondContact O-N 3.07Å |
| 23 | T | 86.6 | Confident | 86.9 | Confident | 83 Ų | 83 | 105.1 Ų | 105.1 | 51% | 0.509 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.7 | -42.4 | 179.2 | -57.6 | 0 | 0 | 0 | 0 | 111.8 | K19 T20 V21 I25 L26 T27 | K19-T23 WeakPolarHBondContact O-CB 3.24Å; K19-T23 PolarHBondContact O-N 3.38Å; K19-T23 PolarHBondContact O-OG1 3.32Å; T20-T23 WeakPolarHBondContact O-CA 3.47Å; T20-T23 WeakPolarHBondContact O-CB 3.32Å; T20-T23 PolarHBondContact O-N 3.41Å; V21-T23 VanDerWaalsContact C-N 3.31Å; V21-T23 PolarHBondContact O-N 2.84Å; T23-I25 PolarHBondContact O-N 3.03Å; T23-L26 PolarHBondContact O-N 3.45Å; T23-T27 HydrophobicContact CG2-CG2 4.34Å; T23-T27 WeakPolarHBondContact O-CB 3.33Å; T23-T27 VanDerWaalsContact O-CG2 3.28Å; T23-T27 WeakPolarHBondContact O-CG2 3.46Å; T23-T27 PolarHBondContact O-N 2.92Å; T23-T27 PolarHBondContact O-OG1 2.95Å |
| 24 | E | 88.7 | Confident | 87.2 | Confident | 131 Ų | 131 | 108.4 Ų | 108.4 | 61% | 0.612 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -64 | -39.7 | 175.6 | -69.3 | -178.2 | 175.1 | 0 | 0 | 112.5 | T20 V21 T27 S28 | T20-E24 PolarHBondContact O-N 3.01Å; V21-E24 PolarHBondContact O-N 3.32Å; E24-T27 WeakPolarHBondContact CA-OG1 3.42Å; E24-T27 PolarHBondContact O-OG1 3.35Å; E24-S28 VanDerWaalsContact O-CB 3.28Å; E24-S28 WeakPolarHBondContact O-CB 3.49Å; E24-S28 PolarHBondContact O-N 2.94Å; E24-S28 PolarHBondContact O-OG 3.27Å |
| 25 | I | 86.3 | Confident | 87.4 | Confident | 97 Ų | 97 | 106.6 Ų | 106.6 | 50% | 0.497 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65 | -42.8 | 176 | -66.9 | 165.7 | 0 | 0 | 0 | 111 | V21 K22 T23 S28 S29 | V21-I25 HydrophobicContact CG1-CD1 3.79Å; V21-I25 WeakPolarHBondContact O-CD1 3.49Å; V21-I25 VanDerWaalsContact O-CG1 3.24Å; V21-I25 WeakPolarHBondContact O-CG1 3.5Å; V21-I25 PolarHBondContact O-N 2.83Å; K22-I25 PolarHBondContact O-N 3.02Å; T23-I25 PolarHBondContact O-N 3.03Å; I25-S28 PolarHBondContact O-OG 2.96Å; I25-S29 VanDerWaalsContact O-CB 3.32Å; I25-S29 WeakPolarHBondContact O-CB 3.45Å; I25-S29 PolarHBondContact O-N 2.78Å; I25-S29 VanDerWaalsContact O-N 3.08Å; I25-S29 PolarHBondContact O-OG 3.08Å |
| 26 | L | 86.6 | Confident | 87.8 | Confident | 114 Ų | 114 | 106.6 Ų | 106.6 | 60% | 0.597 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -67.2 | -45.8 | 177.8 | -71.7 | 172.8 | 0 | 0 | 0 | 111.7 | K22 T23 S29 L30 | K22-L26 VanDerWaalsContact O-CG 3.32Å; K22-L26 WeakPolarHBondContact O-CG 3.28Å; K22-L26 PolarHBondContact O-N 3.07Å; T23-L26 PolarHBondContact O-N 3.45Å; L26-S29 WeakPolarHBondContact O-CB 3.33Å; L26-S29 PolarHBondContact O-N 3.19Å; L26-L30 WeakPolarHBondContact O-CG 3.37Å; L26-L30 PolarHBondContact O-N 2.89Å |
| 27 | T | 88.6 | Confident | 88.2 | Confident | 80 Ų | 80 | 105.7 Ų | 105.7 | 49% | 0.491 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.3 | -44.2 | 179.9 | 51.7 | 0 | 0 | 0 | 0 | 111.9 | T23 E24 S29 L30 Y31 | T23-T27 HydrophobicContact CG2-CG2 4.34Å; T23-T27 WeakPolarHBondContact O-CB 3.33Å; T23-T27 VanDerWaalsContact O-CG2 3.28Å; T23-T27 WeakPolarHBondContact O-CG2 3.46Å; T23-T27 PolarHBondContact O-N 2.92Å; T23-T27 PolarHBondContact O-OG1 2.95Å; E24-T27 WeakPolarHBondContact CA-OG1 3.42Å; E24-T27 PolarHBondContact O-OG1 3.35Å; T27-S29 VanDerWaalsContact C-N 3.32Å; T27-S29 PolarHBondContact O-N 3.42Å; T27-L30 PolarHBondContact O-N 2.91Å; T27-Y31 PolarHBondContact O-N 3.24Å |
| 28 | S | 85.8 | Confident | 88.5 | Confident | 53 Ų | 53 | 105.4 Ų | 105.4 | 37% | 0.371 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.7 | -39.4 | 175.1 | 63.9 | 0 | 0 | 0 | 0 | 112.2 | E24 I25 Y31 K32 | E24-S28 VanDerWaalsContact O-CB 3.28Å; E24-S28 WeakPolarHBondContact O-CB 3.49Å; E24-S28 PolarHBondContact O-N 2.94Å; E24-S28 PolarHBondContact O-OG 3.27Å; I25-S28 PolarHBondContact O-OG 2.96Å; S28-Y31 PolarHBondContact O-N 2.95Å; S28-K32 WeakPolarHBondContact O-CG 3.32Å; S28-K32 PolarHBondContact O-N 3.01Å; S28-K32 VanDerWaalsContact O-N 3.07Å |
| 29 | S | 84.3 | Confident | 88.9 | Confident | 48 Ų | 48 | 103.9 Ų | 103.9 | 34% | 0.336 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64 | -42.8 | 175.7 | -64 | 0 | 0 | 0 | 0 | 112.4 | I25 L26 T27 R33 | I25-S29 VanDerWaalsContact O-CB 3.32Å; I25-S29 WeakPolarHBondContact O-CB 3.45Å; I25-S29 PolarHBondContact O-N 2.78Å; I25-S29 VanDerWaalsContact O-N 3.08Å; I25-S29 PolarHBondContact O-OG 3.08Å; L26-S29 WeakPolarHBondContact O-CB 3.33Å; L26-S29 PolarHBondContact O-N 3.19Å; T27-S29 VanDerWaalsContact C-N 3.32Å; T27-S29 PolarHBondContact O-N 3.42Å; S29-R33 WeakPolarHBondContact O-CG 3.28Å; S29-R33 PolarHBondContact O-N 3.29Å |
| 30 | L | 84.1 | Confident | 89.2 | Confident | 95 Ų | 95 | 105.2 Ų | 105.2 | 50% | 0.497 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.9 | -40.4 | 177.1 | -69.3 | 173.6 | 0 | 0 | 0 | 112.1 | L26 T27 R33 K34 | L26-L30 WeakPolarHBondContact O-CG 3.37Å; L26-L30 PolarHBondContact O-N 2.89Å; T27-L30 PolarHBondContact O-N 2.91Å; L30-R33 PolarHBondContact O-N 3.27Å; L30-K34 WeakPolarHBondContact O-CG 3.3Å; L30-K34 PolarHBondContact O-N 2.87Å |
| 31 | Y | 88.4 | Confident | 89.6 | Confident | 157 Ų | 157 | 107.1 Ų | 107.1 | 62% | 0.616 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61 | -46.8 | 176.2 | -179 | -98.1 | 0 | 0 | 0 | 111.5 | T27 S28 R33 K34 L35 | T27-Y31 PolarHBondContact O-N 3.24Å; S28-Y31 PolarHBondContact O-N 2.95Å; Y31-R33 VanDerWaalsContact C-N 3.34Å; Y31-R33 PolarHBondContact O-N 3Å; Y31-K34 PolarHBondContact O-N 2.94Å; Y31-L35 HydrophobicContact CE1-CD2 3.97Å; Y31-L35 VanDerWaalsContact O-CB 3.3Å; Y31-L35 WeakPolarHBondContact O-CB 3.3Å; Y31-L35 PolarHBondContact O-N 3.46Å |
| 32 | K | 88.1 | Confident | 90 | Very high | 136 Ų | 136 | 107.7 Ų | 107.7 | 59% | 0.591 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -57.3 | -45 | 176.2 | -73.2 | 174.4 | -177.7 | 177 | 0 | 112 | S28 L35 L36 | S28-K32 WeakPolarHBondContact O-CG 3.32Å; S28-K32 PolarHBondContact O-N 3.01Å; S28-K32 VanDerWaalsContact O-N 3.07Å; K32-L35 PolarHBondContact O-N 3.1Å; K32-L36 VanDerWaalsContact O-CG 3.3Å; K32-L36 WeakPolarHBondContact O-CG 3.43Å; K32-L36 PolarHBondContact O-N 3.49Å; K32-L36 VanDerWaalsContact O-N 3.1Å |
| 33 | R | 92 | Very high | 90.4 | Very high | 174 Ų | 174 | 105.2 Ų | 105.2 | 66% | 0.657 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.6 | -47.1 | 177.5 | -70.7 | -179.2 | -170.8 | 178.3 | 3.7 | 112 | S29 L30 Y31 L36 I37 | S29-R33 WeakPolarHBondContact O-CG 3.28Å; S29-R33 PolarHBondContact O-N 3.29Å; L30-R33 PolarHBondContact O-N 3.27Å; Y31-R33 VanDerWaalsContact C-N 3.34Å; Y31-R33 PolarHBondContact O-N 3Å; R33-L36 PolarHBondContact O-N 3.38Å; R33-I37 WeakPolarHBondContact O-CG1 3.34Å; R33-I37 PolarHBondContact O-N 3.34Å |
| 34 | K | 90.2 | Very high | 90.7 | Very high | 143 Ų | 143 | 106.5 Ų | 106.5 | 62% | 0.622 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.8 | -43.9 | 178.4 | -73.1 | -179 | 179.1 | -178.7 | 0 | 111.9 | L30 Y31 L36 I37 L38 | L30-K34 WeakPolarHBondContact O-CG 3.3Å; L30-K34 PolarHBondContact O-N 2.87Å; Y31-K34 PolarHBondContact O-N 2.94Å; K34-L36 PolarHBondContact O-N 3.46Å; K34-I37 PolarHBondContact O-N 3.24Å; K34-L38 WeakPolarHBondContact O-CG 3.47Å; K34-L38 PolarHBondContact O-N 3.38Å |
| 35 | L | 89.9 | Confident | 91.1 | Very high | 70 Ų | 70 | 107.7 Ų | 107.7 | 37% | 0.366 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.4 | -45.3 | 179.3 | -177.8 | 62.5 | 0 | 0 | 0 | 111.8 | Y31 K32 I37 L38 I39 | Y31-L35 HydrophobicContact CE1-CD2 3.97Å; Y31-L35 VanDerWaalsContact O-CB 3.3Å; Y31-L35 WeakPolarHBondContact O-CB 3.3Å; Y31-L35 PolarHBondContact O-N 3.46Å; K32-L35 PolarHBondContact O-N 3.1Å; L35-I37 VanDerWaalsContact C-N 3.31Å; L35-I37 PolarHBondContact O-N 3.07Å; L35-L38 PolarHBondContact O-N 3.23Å; L35-I39 HydrophobicContact CD1-CD1 4.31Å; L35-I39 HydrophobicContact CG-CD1 4Å; L35-I39 WeakPolarHBondContact O-CG1 3.31Å; L35-I39 PolarHBondContact O-N 3.17Å |
| 36 | L | 92.1 | Very high | 91.5 | Very high | 109 Ų | 109 | 107.3 Ų | 107.3 | 57% | 0.571 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62.1 | -36.8 | 177.4 | -71.2 | 172.5 | 0 | 0 | 0 | 112.8 | K32 R33 K34 K40 | K32-L36 VanDerWaalsContact O-CG 3.3Å; K32-L36 WeakPolarHBondContact O-CG 3.43Å; K32-L36 PolarHBondContact O-N 3.49Å; K32-L36 VanDerWaalsContact O-N 3.1Å; R33-L36 PolarHBondContact O-N 3.38Å; K34-L36 PolarHBondContact O-N 3.46Å; L36-K40 WeakPolarHBondContact O-CG 3.27Å; L36-K40 PolarHBondContact O-N 2.99Å; L36-K40 VanDerWaalsContact O-N 3.17Å |
| 37 | I | 94.6 | Very high | 91.6 | Very high | 105 Ų | 105 | 106.8 Ų | 106.8 | 54% | 0.538 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.6 | -46.7 | 175.9 | -66.3 | 164.1 | 0 | 0 | 0 | 110.3 | R33 K34 L35 I39 K40 L41 | R33-I37 WeakPolarHBondContact O-CG1 3.34Å; R33-I37 PolarHBondContact O-N 3.34Å; K34-I37 PolarHBondContact O-N 3.24Å; L35-I37 VanDerWaalsContact C-N 3.31Å; L35-I37 PolarHBondContact O-N 3.07Å; I37-I39 VanDerWaalsContact C-N 3.34Å; I37-I39 PolarHBondContact O-N 3.44Å; I37-K40 PolarHBondContact O-N 2.93Å; I37-L41 HydrophobicContact CG2-CD1 4.48Å; I37-L41 PolarHBondContact O-N 3.44Å; I37-L41 VanDerWaalsContact O-N 3.15Å |
| 38 | L | 93.5 | Very high | 91.8 | Very high | 107 Ų | 107 | 108.8 Ų | 108.8 | 56% | 0.56 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.4 | -43.9 | 178.4 | -69.1 | 172.7 | 0 | 0 | 0 | 111.8 | K34 L35 K40 L41 V42 | K34-L38 WeakPolarHBondContact O-CG 3.47Å; K34-L38 PolarHBondContact O-N 3.38Å; L35-L38 PolarHBondContact O-N 3.23Å; L38-K40 VanDerWaalsContact C-N 3.31Å; L38-K40 PolarHBondContact O-N 3.49Å; L38-L41 PolarHBondContact O-N 3.11Å; L38-V42 WeakPolarHBondContact O-CG2 3.46Å; L38-V42 PolarHBondContact O-N 3Å; L38-V42 VanDerWaalsContact O-N 3.11Å |
| 39 | I | 96.6 | Very high | 91.9 | Very high | 80 Ų | 80 | 108.7 Ų | 108.7 | 41% | 0.41 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59 | -43.3 | 177.5 | -69.1 | 166.3 | 0 | 0 | 0 | 111 | L35 I37 L41 V42 I43 | L35-I39 HydrophobicContact CD1-CD1 4.31Å; L35-I39 HydrophobicContact CG-CD1 4Å; L35-I39 WeakPolarHBondContact O-CG1 3.31Å; L35-I39 PolarHBondContact O-N 3.17Å; I37-I39 VanDerWaalsContact C-N 3.34Å; I37-I39 PolarHBondContact O-N 3.44Å; I39-L41 VanDerWaalsContact C-N 3.35Å; I39-L41 PolarHBondContact O-N 3.3Å; I39-V42 PolarHBondContact O-N 3.19Å; I39-I43 HydrophobicContact CG2-CD1 3.7Å; I39-I43 HydrophobicContact CG2-CG1 4.38Å; I39-I43 VanDerWaalsContact O-CG1 3.31Å; I39-I43 WeakPolarHBondContact O-CG1 3.49Å; I39-I43 PolarHBondContact O-N 3.15Å |
| 40 | K | 94.4 | Very high | 92.1 | Very high | 144 Ų | 144 | 111.5 Ų | 111.5 | 63% | 0.626 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61.4 | -41.6 | 177.3 | -73.2 | -178.8 | -179.9 | -174.1 | 0 | 112.5 | L36 I37 L38 V42 I43 L44 | L36-K40 WeakPolarHBondContact O-CG 3.27Å; L36-K40 PolarHBondContact O-N 2.99Å; L36-K40 VanDerWaalsContact O-N 3.17Å; I37-K40 PolarHBondContact O-N 2.93Å; L38-K40 VanDerWaalsContact C-N 3.31Å; L38-K40 PolarHBondContact O-N 3.49Å; K40-V42 VanDerWaalsContact C-N 3.34Å; K40-V42 PolarHBondContact O-N 3.38Å; K40-I43 PolarHBondContact O-N 3.43Å; K40-L44 WeakPolarHBondContact O-CB 3.33Å; K40-L44 VanDerWaalsContact O-CG 3.27Å; K40-L44 WeakPolarHBondContact O-CG 3.26Å; K40-L44 PolarHBondContact O-N 3.23Å |
| 41 | L | 95.5 | Very high | 92.2 | Very high | 105 Ų | 105 | 113 Ų | 113 | 55% | 0.55 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.6 | -41.8 | 178 | -68.5 | 173.3 | 0 | 0 | 0 | 111.7 | I37 L38 I39 L44 Y45 | I37-L41 HydrophobicContact CG2-CD1 4.48Å; I37-L41 PolarHBondContact O-N 3.44Å; I37-L41 VanDerWaalsContact O-N 3.15Å; L38-L41 PolarHBondContact O-N 3.11Å; I39-L41 VanDerWaalsContact C-N 3.35Å; I39-L41 PolarHBondContact O-N 3.3Å; L41-L44 PolarHBondContact O-N 3.25Å; L41-Y45 WeakPolarHBondContact O-CB 3.41Å; L41-Y45 PolarHBondContact O-N 3.43Å |
| 42 | V | 96.3 | Very high | 92 | Very high | 88 Ų | 88 | 109.3 Ų | 109.3 | 53% | 0.533 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.2 | -45.2 | 177.4 | 174.5 | 0 | 0 | 0 | 0 | 111.2 | L38 I39 K40 L44 Y45 I46 | L38-V42 WeakPolarHBondContact O-CG2 3.46Å; L38-V42 PolarHBondContact O-N 3Å; L38-V42 VanDerWaalsContact O-N 3.11Å; I39-V42 PolarHBondContact O-N 3.19Å; K40-V42 VanDerWaalsContact C-N 3.34Å; K40-V42 PolarHBondContact O-N 3.38Å; V42-L44 VanDerWaalsContact C-N 3.34Å; V42-L44 PolarHBondContact O-N 2.94Å; V42-Y45 PolarHBondContact O-N 2.98Å; V42-I46 HydrophobicContact CG1-CD1 3.94Å; V42-I46 WeakPolarHBondContact O-CG1 3.35Å; V42-I46 PolarHBondContact O-N 3.31Å |
| 43 | I | 96.3 | Very high | 91.5 | Very high | 90 Ų | 90 | 107.3 Ų | 107.3 | 46% | 0.462 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.4 | -46.1 | 177 | -66.8 | 167.7 | 0 | 0 | 0 | 110.5 | I39 K40 Y45 I46 L47 | I39-I43 HydrophobicContact CG2-CD1 3.7Å; I39-I43 HydrophobicContact CG2-CG1 4.38Å; I39-I43 VanDerWaalsContact O-CG1 3.31Å; I39-I43 WeakPolarHBondContact O-CG1 3.49Å; I39-I43 PolarHBondContact O-N 3.15Å; K40-I43 PolarHBondContact O-N 3.43Å; I43-Y45 VanDerWaalsContact C-N 3.32Å; I43-Y45 PolarHBondContact O-N 2.97Å; I43-I46 PolarHBondContact O-N 3.4Å; I43-L47 HydrophobicContact CG2-CD1 3.97Å; I43-L47 HydrophobicContact CG2-CG 4.41Å; I43-L47 VanDerWaalsContact O-CG 3.31Å; I43-L47 WeakPolarHBondContact O-CG 3.36Å; I43-L47 PolarHBondContact O-N 2.85Å |
| 44 | L | 93.2 | Very high | 90.8 | Very high | 111 Ų | 111 | 101.9 Ų | 101.9 | 58% | 0.581 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -60.3 | -41.5 | 177.1 | -75.1 | 170.5 | 0 | 0 | 0 | 112.1 | K40 L41 V42 L47 F48 | K40-L44 WeakPolarHBondContact O-CB 3.33Å; K40-L44 VanDerWaalsContact O-CG 3.27Å; K40-L44 WeakPolarHBondContact O-CG 3.26Å; K40-L44 PolarHBondContact O-N 3.23Å; L41-L44 PolarHBondContact O-N 3.25Å; V42-L44 VanDerWaalsContact C-N 3.34Å; V42-L44 PolarHBondContact O-N 2.94Å; L44-L47 PolarHBondContact O-N 3.44Å; L44-F48 VanDerWaalsContact O-CB 3.26Å; L44-F48 WeakPolarHBondContact O-CB 3.31Å; L44-F48 PolarHBondContact O-N 3.47Å |
| 45 | Y | 95.9 | Very high | 90 | Very high | 156 Ų | 156 | 97.9 Ų | 97.9 | 61% | 0.612 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.7 | -44.8 | 176.9 | 177.6 | -103.5 | 0 | 0 | 0 | 112.2 | L41 V42 I43 L47 F48 V49 | L41-Y45 WeakPolarHBondContact O-CB 3.41Å; L41-Y45 PolarHBondContact O-N 3.43Å; V42-Y45 PolarHBondContact O-N 2.98Å; I43-Y45 VanDerWaalsContact C-N 3.32Å; I43-Y45 PolarHBondContact O-N 2.97Å; Y45-L47 PolarHBondContact O-N 3.49Å; Y45-F48 WeakPolarHBondContact O-CB 3.19Å; Y45-F48 PolarHBondContact O-N 3.25Å; Y45-V49 HydrophobicContact CD1-CG2 4.3Å; Y45-V49 HydrophobicContact CD2-CG2 4.4Å; Y45-V49 HydrophobicContact CE1-CG2 3.85Å; Y45-V49 HydrophobicContact CE2-CG2 3.96Å; Y45-V49 WeakPolarHBondContact O-CG2 3.45Å; Y45-V49 PolarHBondContact O-N 3.32Å |
| 46 | I | 94.4 | Very high | 89 | Confident | 89 Ų | 89 | 99.7 Ų | 99.7 | 46% | 0.456 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.4 | -46.5 | 177 | -66.8 | 166.6 | 0 | 0 | 0 | 110.6 | V42 I43 F48 V49 I50 | V42-I46 HydrophobicContact CG1-CD1 3.94Å; V42-I46 WeakPolarHBondContact O-CG1 3.35Å; V42-I46 PolarHBondContact O-N 3.31Å; I43-I46 PolarHBondContact O-N 3.4Å; I46-F48 VanDerWaalsContact C-N 3.29Å; I46-F48 PolarHBondContact O-N 2.96Å; I46-V49 PolarHBondContact O-N 3.41Å; I46-I50 HydrophobicContact CG2-CD1 3.87Å; I46-I50 WeakPolarHBondContact O-CG1 3.42Å; I46-I50 PolarHBondContact O-N 2.89Å |
| 47 | L | 89.9 | Confident | 87.7 | Confident | 103 Ų | 103 | 100 Ų | 100 | 54% | 0.539 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.9 | -42 | 176.1 | -70.8 | 173.6 | 0 | 0 | 0 | 111.4 | I43 L44 Y45 I50 F51 | I43-L47 HydrophobicContact CG2-CD1 3.97Å; I43-L47 HydrophobicContact CG2-CG 4.41Å; I43-L47 VanDerWaalsContact O-CG 3.31Å; I43-L47 WeakPolarHBondContact O-CG 3.36Å; I43-L47 PolarHBondContact O-N 2.85Å; L44-L47 PolarHBondContact O-N 3.44Å; Y45-L47 PolarHBondContact O-N 3.49Å; L47-I50 PolarHBondContact O-N 2.87Å; L47-F51 WeakPolarHBondContact O-CB 3.35Å; L47-F51 PolarHBondContact O-N 3.22Å |
| 48 | F | 91.5 | Very high | 86.5 | Confident | 122 Ų | 122 | 101.4 Ų | 101.4 | 54% | 0.535 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.4 | -45.5 | 176 | -179.8 | -97.3 | 0 | 0 | 0 | 111.6 | L44 Y45 I46 F51 D52 | L44-F48 VanDerWaalsContact O-CB 3.26Å; L44-F48 WeakPolarHBondContact O-CB 3.31Å; L44-F48 PolarHBondContact O-N 3.47Å; Y45-F48 WeakPolarHBondContact O-CB 3.19Å; Y45-F48 PolarHBondContact O-N 3.25Å; I46-F48 VanDerWaalsContact C-N 3.29Å; I46-F48 PolarHBondContact O-N 2.96Å; F48-F51 PolarHBondContact O-N 3.02Å; F48-D52 VanDerWaalsContact O-CB 3.27Å; F48-D52 WeakPolarHBondContact O-CB 3.27Å; F48-D52 PolarHBondContact O-N 3.42Å |
| 49 | V | 88.9 | Confident | 85.4 | Confident | 50 Ų | 50 | 100.5 Ų | 100.5 | 30% | 0.303 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.8 | -42.6 | 177.8 | 170.7 | 0 | 0 | 0 | 0 | 111.4 | Y45 I46 F51 D52 N53 | Y45-V49 HydrophobicContact CD1-CG2 4.3Å; Y45-V49 HydrophobicContact CD2-CG2 4.4Å; Y45-V49 HydrophobicContact CE1-CG2 3.85Å; Y45-V49 HydrophobicContact CE2-CG2 3.96Å; Y45-V49 WeakPolarHBondContact O-CG2 3.45Å; Y45-V49 PolarHBondContact O-N 3.32Å; I46-V49 PolarHBondContact O-N 3.41Å; V49-F51 VanDerWaalsContact C-N 3.34Å; V49-D52 PolarHBondContact O-N 3.41Å; V49-N53 PolarHBondContact O-N 3.42Å; V49-N53 PolarHBondContact O-ND2 2.78Å |
| 50 | I | 88.1 | Confident | 84 | Confident | 107 Ų | 107 | 98.6 Ų | 98.6 | 55% | 0.549 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64 | -44.1 | 177 | -67.1 | 168.3 | 0 | 0 | 0 | 110.4 | I46 L47 N53 S54 | I46-I50 HydrophobicContact CG2-CD1 3.87Å; I46-I50 WeakPolarHBondContact O-CG1 3.42Å; I46-I50 PolarHBondContact O-N 2.89Å; L47-I50 PolarHBondContact O-N 2.87Å; I50-N53 PolarHBondContact O-N 2.79Å; I50-S54 PolarHBondContact O-N 3.07Å |
| 51 | F | 86 | Confident | 82.6 | Confident | 127 Ų | 127 | 96.7 Ų | 96.7 | 56% | 0.557 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -63.8 | -44.1 | 178.5 | -175.8 | -110 | 0 | 0 | 0 | 111.9 | L47 F48 V49 S54 I55 | L47-F51 WeakPolarHBondContact O-CB 3.35Å; L47-F51 PolarHBondContact O-N 3.22Å; F48-F51 PolarHBondContact O-N 3.02Å; V49-F51 VanDerWaalsContact C-N 3.34Å; F51-S54 PolarHBondContact O-N 3.37Å; F51-I55 HydrophobicContact CD1-CD1 3.68Å; F51-I55 HydrophobicContact CD1-CG1 4.42Å; F51-I55 HydrophobicContact CD2-CD1 4.36Å; F51-I55 HydrophobicContact CE1-CD1 3.12Å; F51-I55 HydrophobicContact CE1-CG1 4.21Å; F51-I55 HydrophobicContact CE2-CD1 3.87Å; F51-I55 HydrophobicContact CE2-CG1 4.31Å; F51-I55 HydrophobicContact CG-CD1 4.29Å; F51-I55 HydrophobicContact CZ-CD1 3.25Å; F51-I55 HydrophobicContact CZ-CG1 4.17Å; F51-I55 WeakPolarHBondContact O-CB 3.11Å; F51-I55 WeakPolarHBondContact O-CG1 3.29Å; F51-I55 PolarHBondContact O-N 2.72Å |
| 52 | D | 83.8 | Confident | 81.3 | Confident | 79 Ų | 79 | 93.7 Ų | 93.7 | 42% | 0.422 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.3 | -43.5 | 177.1 | -170 | 61.5 | 0 | 0 | 0 | 111.2 | F48 V49 S54 I55 H56 | F48-D52 VanDerWaalsContact O-CB 3.27Å; F48-D52 WeakPolarHBondContact O-CB 3.27Å; F48-D52 PolarHBondContact O-N 3.42Å; V49-D52 PolarHBondContact O-N 3.41Å; D52-S54 VanDerWaalsContact C-N 3.34Å; D52-S54 PolarHBondContact O-N 2.83Å; D52-I55 PolarHBondContact O-N 3.48Å; D52-H56 WeakPolarHBondContact O-CA 3.46Å; D52-H56 WeakPolarHBondContact O-CB 3.44Å; D52-H56 PolarHBondContact O-N 3.24Å |
| 53 | N | 78.8 | Confident | 79.7 | Confident | 95 Ų | 95 | 95.1 Ų | 95.1 | 51% | 0.508 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.5 | -40.5 | 174.9 | -75.5 | -57.8 | 0 | 0 | 0 | 112.6 | V49 I50 M57 | V49-N53 PolarHBondContact O-N 3.42Å; V49-N53 PolarHBondContact O-ND2 2.78Å; I50-N53 PolarHBondContact O-N 2.79Å; N53-M57 WeakPolarHBondContact O-CB 3.44Å; N53-M57 VanDerWaalsContact O-CG 3.29Å; N53-M57 WeakPolarHBondContact O-CG 3.43Å; N53-M57 PolarHBondContact O-N 2.85Å |
| 54 | S | 77.7 | Confident | 78.1 | Confident | 59 Ų | 59 | 96.7 Ų | 96.7 | 41% | 0.413 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -66 | -46.8 | 177.2 | 179.6 | 0 | 0 | 0 | 0 | 111.3 | I50 F51 D52 M57 H58 | I50-S54 PolarHBondContact O-N 3.07Å; F51-S54 PolarHBondContact O-N 3.37Å; D52-S54 VanDerWaalsContact C-N 3.34Å; D52-S54 PolarHBondContact O-N 2.83Å; S54-M57 WeakPolarHBondContact O-CB 3.45Å; S54-M57 PolarHBondContact O-N 2.99Å; S54-H58 PolarHBondContact O-CD2 3.01Å; S54-H58 PolarHBondContact O-N 3.09Å; S54-H58 VanDerWaalsContact O-N 3.09Å |
| 55 | I | 72.8 | Confident | 76.7 | Confident | 60 Ų | 60 | 96.1 Ų | 96.1 | 31% | 0.308 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.3 | -45.3 | 176.3 | -75.5 | -173.9 | 0 | 0 | 0 | 111 | F51 D52 M57 H58 I59 | F51-I55 HydrophobicContact CD1-CD1 3.68Å; F51-I55 HydrophobicContact CD1-CG1 4.42Å; F51-I55 HydrophobicContact CD2-CD1 4.36Å; F51-I55 HydrophobicContact CE1-CD1 3.12Å; F51-I55 HydrophobicContact CE1-CG1 4.21Å; F51-I55 HydrophobicContact CE2-CD1 3.87Å; F51-I55 HydrophobicContact CE2-CG1 4.31Å; F51-I55 HydrophobicContact CG-CD1 4.29Å; F51-I55 HydrophobicContact CZ-CD1 3.25Å; F51-I55 HydrophobicContact CZ-CG1 4.17Å; F51-I55 WeakPolarHBondContact O-CB 3.11Å; F51-I55 WeakPolarHBondContact O-CG1 3.29Å; F51-I55 PolarHBondContact O-N 2.72Å; D52-I55 PolarHBondContact O-N 3.48Å; I55-M57 PolarHBondContact O-N 3Å; I55-H58 CarbonylContact O-C 3.51Å; I55-H58 WeakPolarHBondContact O-CA 3.35Å; I55-H58 WeakPolarHBondContact O-CB 3.19Å; I55-H58 PolarHBondContact O-N 3.33Å; I55-I59 HydrophobicContact CG2-CD1 3.45Å; I55-I59 VanDerWaalsContact CG2-CD1 3.45Å; I55-I59 HydrophobicContact CG2-CG1 3.96Å; I55-I59 WeakPolarHBondContact O-CG1 3.49Å; I55-I59 PolarHBondContact O-N 3.19Å |
| 56 | H | 67.8 | Low | 75.1 | Confident | 107 Ų | 107 | 99 Ų | 99 | 50% | 0.495 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.5 | -37.1 | -179.8 | -166.5 | 66.2 | 0 | 0 | 0 | 110.6 | D52 I59 C60 | D52-H56 WeakPolarHBondContact O-CA 3.46Å; D52-H56 WeakPolarHBondContact O-CB 3.44Å; D52-H56 PolarHBondContact O-N 3.24Å; H56-I59 PolarHBondContact O-N 2.78Å; H56-C60 WeakPolarHBondContact O-CB 3.47Å; H56-C60 PolarHBondContact O-N 2.75Å; H56-C60 PolarHBondContact O-SG 3.4Å |
| 57 | M | 66.6 | Low | 73 | Confident | 117 Ų | 117 | 106.4 Ų | 106.4 | 58% | 0.576 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -61.4 | -44.8 | 169.9 | -78.5 | -95.9 | 68.6 | 0 | 0 | 112.5 | N53 S54 I55 C60 L61 | N53-M57 WeakPolarHBondContact O-CB 3.44Å; N53-M57 VanDerWaalsContact O-CG 3.29Å; N53-M57 WeakPolarHBondContact O-CG 3.43Å; N53-M57 PolarHBondContact O-N 2.85Å; S54-M57 WeakPolarHBondContact O-CB 3.45Å; S54-M57 PolarHBondContact O-N 2.99Å; I55-M57 PolarHBondContact O-N 3Å; M57-C60 PolarHBondContact O-N 2.83Å; M57-L61 WeakPolarHBondContact O-CB 3.47Å; M57-L61 WeakPolarHBondContact O-CG 3.22Å; M57-L61 PolarHBondContact O-N 3.16Å |
| 58 | H | 68.2 | Low | 72.2 | Confident | 133 Ų | 133 | 106.6 Ų | 106.6 | 62% | 0.616 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -65.3 | -39.2 | 175.8 | -75.5 | -67.7 | 0 | 0 | 0 | 112.9 | S54 I55 G62 | S54-H58 PolarHBondContact O-CD2 3.01Å; S54-H58 PolarHBondContact O-N 3.09Å; S54-H58 VanDerWaalsContact O-N 3.09Å; I55-H58 CarbonylContact O-C 3.51Å; I55-H58 WeakPolarHBondContact O-CA 3.35Å; I55-H58 WeakPolarHBondContact O-CB 3.19Å; I55-H58 PolarHBondContact O-N 3.33Å; H58-G62 PolarHBondContact O-N 3.38Å |
| 59 | I | 70.1 | Confident | 71.2 | Confident | 89 Ų | 89 | 105.7 Ų | 105.7 | 46% | 0.456 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -67.9 | -44.6 | 176 | -66.9 | 174.4 | 0 | 0 | 0 | 110.1 | I55 H56 L61 G62 I63 | I55-I59 HydrophobicContact CG2-CD1 3.45Å; I55-I59 VanDerWaalsContact CG2-CD1 3.45Å; I55-I59 HydrophobicContact CG2-CG1 3.96Å; I55-I59 WeakPolarHBondContact O-CG1 3.49Å; I55-I59 PolarHBondContact O-N 3.19Å; H56-I59 PolarHBondContact O-N 2.78Å; I59-L61 VanDerWaalsContact C-N 3.34Å; I59-L61 PolarHBondContact O-N 2.96Å; I59-G62 PolarHBondContact O-N 3.46Å; I59-G62 VanDerWaalsContact O-N 3.16Å; I59-I63 HydrophobicContact CG2-CD1 3.91Å; I59-I63 HydrophobicContact CG2-CG1 4.45Å; I59-I63 WeakPolarHBondContact O-CG1 3.37Å; I59-I63 PolarHBondContact O-N 2.87Å |
| 60 | C | 67.9 | Low | 70.2 | Confident | 40 Ų | 40 | 108.8 Ų | 108.8 | 27% | 0.27 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -59.5 | -44 | 176.1 | -77.8 | 0 | 0 | 0 | 0 | 111.5 | H56 M57 I63 I64 | H56-C60 WeakPolarHBondContact O-CB 3.47Å; H56-C60 PolarHBondContact O-N 2.75Å; H56-C60 PolarHBondContact O-SG 3.4Å; M57-C60 PolarHBondContact O-N 2.83Å; C60-I63 PolarHBondContact O-N 3.31Å; C60-I64 WeakPolarHBondContact O-CD1 3.3Å; C60-I64 WeakPolarHBondContact O-CG1 3.47Å; C60-I64 PolarHBondContact O-N 3.48Å |
| 61 | L | 64.1 | Low | 69.1 | Low | 104 Ų | 104 | 108.9 Ų | 108.9 | 55% | 0.545 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -67.2 | -38.5 | 173.7 | -76.6 | 168.6 | 0 | 0 | 0 | 112.4 | M57 I59 I63 I64 S65 | M57-L61 WeakPolarHBondContact O-CB 3.47Å; M57-L61 WeakPolarHBondContact O-CG 3.22Å; M57-L61 PolarHBondContact O-N 3.16Å; I59-L61 VanDerWaalsContact C-N 3.34Å; I59-L61 PolarHBondContact O-N 2.96Å; L61-I63 VanDerWaalsContact C-N 3.34Å; L61-I63 PolarHBondContact O-N 3.45Å; L61-I64 PolarHBondContact O-N 2.98Å; L61-S65 VanDerWaalsContact O-CB 3.3Å; L61-S65 WeakPolarHBondContact O-CB 3.45Å; L61-S65 PolarHBondContact O-N 3.47Å |
| 62 | G | 69.4 | Low | 68.1 | Low | 42 Ų | 42 | 107.8 Ų | 107.8 | 43% | 0.433 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -60.1 | -42.5 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | H58 I59 S65 Y66 | H58-G62 PolarHBondContact O-N 3.38Å; I59-G62 PolarHBondContact O-N 3.46Å; I59-G62 VanDerWaalsContact O-N 3.16Å; G62-S65 PolarHBondContact O-N 3.48Å; G62-Y66 VanDerWaalsContact O-CB 3.28Å; G62-Y66 WeakPolarHBondContact O-CB 3.28Å; G62-Y66 PolarHBondContact O-N 2.95Å |
| 63 | I | 63.2 | Low | 67 | Low | 118 Ų | 118 | 109.7 Ų | 109.7 | 61% | 0.605 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -69.9 | -40.5 | 175.8 | -64.1 | 168.3 | 0 | 0 | 0 | 111.2 | I59 C60 L61 S65 Y66 | I59-I63 HydrophobicContact CG2-CD1 3.91Å; I59-I63 HydrophobicContact CG2-CG1 4.45Å; I59-I63 WeakPolarHBondContact O-CG1 3.37Å; I59-I63 PolarHBondContact O-N 2.87Å; C60-I63 PolarHBondContact O-N 3.31Å; L61-I63 VanDerWaalsContact C-N 3.34Å; L61-I63 PolarHBondContact O-N 3.45Å; I63-S65 VanDerWaalsContact C-N 3.33Å; I63-S65 PolarHBondContact O-N 3.49Å; I63-Y66 PolarHBondContact O-N 3.37Å |
| 64 | I | 60.9 | Low | 66.2 | Low | 122 Ų | 122 | 110.8 Ų | 110.8 | 63% | 0.626 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -63.1 | -40.1 | 175.5 | -68.8 | 164 | 0 | 0 | 0 | 110.9 | C60 L61 | C60-I64 WeakPolarHBondContact O-CD1 3.3Å; C60-I64 WeakPolarHBondContact O-CG1 3.47Å; C60-I64 PolarHBondContact O-N 3.48Å; L61-I64 PolarHBondContact O-N 2.98Å |
| 65 | S | 64.9 | Low | 65.3 | Low | 99 Ų | 99 | 114.8 Ų | 114.8 | 69% | 0.692 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -81.2 | -13.1 | 179.5 | -171.1 | 0 | 0 | 0 | 0 | 114.3 | L61 G62 I63 K67 | L61-S65 VanDerWaalsContact O-CB 3.3Å; L61-S65 WeakPolarHBondContact O-CB 3.45Å; L61-S65 PolarHBondContact O-N 3.47Å; G62-S65 PolarHBondContact O-N 3.48Å; I63-S65 VanDerWaalsContact C-N 3.33Å; I63-S65 PolarHBondContact O-N 3.49Å; S65-K67 VanDerWaalsContact C-N 3.26Å |
| 66 | Y | 62.1 | Low | 64.7 | Low | 216 Ų | 216 | 119.3 Ų | 119.3 | 85% | 0.847 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.2 | -12.3 | 175.5 | -175.9 | -102 | 0 | 0 | 0 | 112.4 | G62 I63 | G62-Y66 VanDerWaalsContact O-CB 3.28Å; G62-Y66 WeakPolarHBondContact O-CB 3.28Å; G62-Y66 PolarHBondContact O-N 2.95Å; I63-Y66 PolarHBondContact O-N 3.37Å |
| 67 | K | 50.8 | Low | 64.4 | Low | 245 Ų | 245 | 120.5 Ų | 120.5 | 100% | 1.065 | 61% | 0.612 | S | S | * | * | trans | -93.8 | 0 | 176 | -144.4 | -177.9 | -170.3 | -179.5 | 0 | 111 | S65 | S65-K67 VanDerWaalsContact C-N 3.26Š|
Retrieved 67 of 67 residues in 96.7 ms
(Link to these results)