| 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 | 47.9 | Very low | 57.1 | Low | 207 Ų | 207 | 103 Ų | 103 | 100% | 1.02 | 52% | 0.52 | S | S | * | . | 0 | 122.3 | 0 | -124.4 | 135 | 96.1 | 0 | 0 | 108 | |||||
| 2 | S | 52.8 | Low | 57.7 | Low | 80 Ų | 80 | 100.6 Ų | 100.6 | 56% | 0.559 | 51% | 0.505 | S | S | * | . | trans | -83.8 | 120.9 | 174.9 | -95.1 | 0 | 0 | 0 | 0 | 108.1 | K4 K5 | S2-K4 PolarHBondContact O-N 3.48Å; S2-K5 PolarHBondContact O-N 2.92Å | ||
| 3 | L | 55.1 | Low | 58.4 | Low | 157 Ų | 157 | 99.5 Ų | 99.5 | 82% | 0.822 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -45.5 | -32.1 | 179.9 | -128.2 | 98.8 | 0 | 0 | 0 | 113.6 | K5 L7 | L3-K5 PolarHBondContact O-N 3.33Å; L3-L7 PolarHBondContact O-N 3.44Å |
| 4 | K | 54.9 | Low | 59.1 | Low | 147 Ų | 147 | 96.6 Ų | 96.6 | 64% | 0.639 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -64.2 | -35.6 | 178.3 | -64.6 | -174.6 | 177.9 | -175.8 | 0 | 113.4 | S2 C8 P37 | S2-K4 PolarHBondContact O-N 3.48Å; K4-C8 PolarHBondContact O-N 3.41Å; K4-P37 HydrophobicContact CB-CB 4.31Å |
| 5 | K | 54.6 | Low | 59.9 | Low | 150 Ų | 150 | 95.6 Ų | 95.6 | 65% | 0.652 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -73.3 | -42.3 | 179.7 | -68 | -169.8 | 176.1 | -172.7 | 0 | 111 | S2 L3 L7 C8 I9 | S2-K5 PolarHBondContact O-N 2.92Å; L3-K5 PolarHBondContact O-N 3.33Å; K5-L7 VanDerWaalsContact C-N 3.3Å; K5-L7 PolarHBondContact O-N 3.26Å; K5-C8 PolarHBondContact O-N 2.85Å; K5-I9 WeakPolarHBondContact O-CG1 3.36Å; K5-I9 PolarHBondContact O-N 3.22Å; K5-I9 VanDerWaalsContact O-N 3.13Å |
| 6 | D | 56.2 | Low | 60.5 | Low | 63 Ų | 63 | 97.9 Ų | 97.9 | 34% | 0.337 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.4 | -37.7 | -178.9 | -59.9 | -28.4 | 0 | 0 | 0 | 111.3 | F10 | D6-F10 WeakPolarHBondContact O-CB 3.38Å; D6-F10 PolarHBondContact O-N 3.26Å |
| 7 | L | 58.1 | Low | 61.3 | Low | 61 Ų | 61 | 97.8 Ų | 97.8 | 32% | 0.319 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -69.8 | -36.6 | 176.9 | -158 | 65.2 | 0 | 0 | 0 | 112.8 | L3 K5 F10 V11 Y22 P37 | L3-L7 PolarHBondContact O-N 3.44Å; K5-L7 VanDerWaalsContact C-N 3.3Å; K5-L7 PolarHBondContact O-N 3.26Å; L7-F10 PolarHBondContact O-N 3.32Å; L7-V11 WeakPolarHBondContact O-CG2 3.39Å; L7-V11 PolarHBondContact O-N 2.82Å; L7-V11 VanDerWaalsContact O-N 3.09Å; L7-Y22 VanDerWaalsContact CD1-OH 3.28Å; L7-Y22 WeakPolarHBondContact CD1-OH 3.32Å; L7-Y22 VanDerWaalsContact CD2-OH 3.31Å; L7-Y22 WeakPolarHBondContact CD2-OH 3.16Å; L7-Y22 WeakPolarHBondContact CG-OH 3.42Å; L7-P37 HydrophobicContact CB-CG 3.75Å; L7-P37 HydrophobicContact CD2-CG 3.23Å; L7-P37 HydrophobicContact CG-CG 3.88Å |
| 8 | C | 59.5 | Low | 61.7 | Low | 33 Ų | 33 | 95.7 Ų | 95.7 | 22% | 0.223 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -63.9 | -43.3 | 176.9 | -168.9 | 0 | 0 | 0 | 0 | 111.4 | K4 K5 F10 V11 H12 | K4-C8 PolarHBondContact O-N 3.41Å; K5-C8 PolarHBondContact O-N 2.85Å; C8-F10 VanDerWaalsContact C-N 3.33Å; C8-V11 PolarHBondContact O-N 2.74Å; C8-H12 PolarHBondContact O-N 3.28Å |
| 9 | I | 60.1 | Low | 62.1 | Low | 114 Ų | 114 | 93.7 Ų | 93.7 | 59% | 0.585 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -64.3 | -41.3 | 177.2 | -64 | 166 | 0 | 0 | 0 | 110.3 | K5 V11 H12 S13 | K5-I9 WeakPolarHBondContact O-CG1 3.36Å; K5-I9 PolarHBondContact O-N 3.22Å; K5-I9 VanDerWaalsContact O-N 3.13Å; I9-V11 PolarHBondContact O-N 3.28Å; I9-H12 PolarHBondContact O-N 2.74Å; I9-S13 PolarHBondContact O-N 2.94Å; I9-S13 VanDerWaalsContact O-N 3.1Å |
| 10 | F | 63.6 | Low | 62.6 | Low | 102 Ų | 102 | 95 Ų | 95 | 45% | 0.447 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59.1 | -46.9 | 177.8 | -172.6 | -101.7 | 0 | 0 | 0 | 111.5 | D6 L7 C8 H12 S13 K14 | D6-F10 WeakPolarHBondContact O-CB 3.38Å; D6-F10 PolarHBondContact O-N 3.26Å; L7-F10 PolarHBondContact O-N 3.32Å; C8-F10 VanDerWaalsContact C-N 3.33Å; F10-H12 VanDerWaalsContact C-N 3.34Å; F10-H12 PolarHBondContact O-N 2.97Å; F10-S13 PolarHBondContact O-N 3.45Å; F10-S13 PolarHBondContact O-OG 3.31Å; F10-K14 WeakPolarHBondContact O-CG 3.34Å |
| 11 | V | 65.1 | Low | 63.1 | Low | 19 Ų | 19 | 96.8 Ų | 96.8 | 12% | 0.115 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -66.1 | -36.9 | 177.6 | 179.3 | 0 | 0 | 0 | 0 | 112 | L7 C8 I9 S13 K14 K19 Y22 F39 | L7-V11 WeakPolarHBondContact O-CG2 3.39Å; L7-V11 PolarHBondContact O-N 2.82Å; L7-V11 VanDerWaalsContact O-N 3.09Å; C8-V11 PolarHBondContact O-N 2.74Å; I9-V11 PolarHBondContact O-N 3.28Å; V11-S13 VanDerWaalsContact C-N 3.32Å; V11-S13 PolarHBondContact O-N 3.48Å; V11-K14 WeakPolarHBondContact O-CB 3.3Å; V11-K14 PolarHBondContact O-N 3.01Å; V11-K19 HydrophobicContact CG1-CG 4.49Å; V11-K19 WeakPolarHBondContact O-CE 3.39Å; V11-Y22 HydrophobicContact CB-CE1 4.48Å; V11-Y22 HydrophobicContact CG1-CD1 4.36Å; V11-Y22 HydrophobicContact CG2-CD1 3.59Å; V11-Y22 HydrophobicContact CG2-CE1 3.13Å; V11-Y22 HydrophobicContact CG2-CG 4.47Å; V11-F39 HydrophobicContact CG1-CE1 4.05Å; V11-F39 HydrophobicContact CG1-CZ 4.49Å |
| 12 | H | 64.6 | Low | 64.1 | Low | 74 Ų | 74 | 88.7 Ų | 88.7 | 34% | 0.343 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -63.4 | -40.5 | -179.6 | -162.2 | 83.9 | 0 | 0 | 0 | 111.8 | C8 I9 F10 K14 K19 E42 | C8-H12 PolarHBondContact O-N 3.28Å; I9-H12 PolarHBondContact O-N 2.74Å; F10-H12 VanDerWaalsContact C-N 3.34Å; F10-H12 PolarHBondContact O-N 2.97Å; H12-K14 PolarHBondContact O-N 3.37Å; H12-K14 VanDerWaalsContact O-N 3.11Å; H12-K19 PolarHBondContact O-NZ 3.22Å; H12-E42 IonicContact CD2-OE1 2.77Å; H12-E42 IonicContact CD2-OE2 3.87Å; H12-E42 PolarHBondContact CD2-OE2 3.32Å; H12-E42 VanDerWaalsContact CE1-CG 3.46Å; H12-E42 WeakPolarHBondContact CE1-CG 3.34Å; H12-E42 IonicContact CE1-OE2 3.01Å; H12-E42 PolarHBondContact CE1-OE2 3.17Å; H12-E42 IonicContact CG-OE1 3.82Å; H12-E42 IonicContact CG-OE2 3.77Å; H12-E42 IonicContact ND1-OE1 4Å; H12-E42 IonicContact ND1-OE2 3.68Å; H12-E42 IonicContact NE2-OE2 3.34Å; H12-E42 PolarHBondContact NE2-OE2 2.77Å |
| 13 | S | 67.4 | Low | 64.9 | Low | 87 Ų | 87 | 89.7 Ų | 89.7 | 61% | 0.608 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69 | -4.4 | -179.4 | 70.7 | 0 | 0 | 0 | 0 | 115.5 | I9 F10 V11 | I9-S13 PolarHBondContact O-N 2.94Å; I9-S13 VanDerWaalsContact O-N 3.1Å; F10-S13 PolarHBondContact O-N 3.45Å; F10-S13 PolarHBondContact O-OG 3.31Å; V11-S13 VanDerWaalsContact C-N 3.32Å; V11-S13 PolarHBondContact O-N 3.48Å |
| 14 | K | 67.9 | Low | 65.9 | Low | 58 Ų | 58 | 86.7 Ų | 86.7 | 25% | 0.252 | 43% | 0.43 | S | S | . | . | S | Bend | trans | -89.9 | 145.8 | -176.3 | -68.2 | -62.8 | -171 | 177.1 | 0 | 112.8 | F10 V11 H12 E18 K19 | F10-K14 WeakPolarHBondContact O-CG 3.34Å; V11-K14 WeakPolarHBondContact O-CB 3.3Å; V11-K14 PolarHBondContact O-N 3.01Å; H12-K14 PolarHBondContact O-N 3.37Å; H12-K14 VanDerWaalsContact O-N 3.11Å; K14-E18 HydrophobicContact CB-CB 3.8Å; K14-E18 HydrophobicContact CD-CB 3.9Å; K14-E18 VanDerWaalsContact CD-CD 3.45Å; K14-E18 HydrophobicContact CD-CG 4.26Å; K14-E18 VanDerWaalsContact CD-OE1 3.24Å; K14-E18 WeakPolarHBondContact CD-OE1 3.23Å; K14-E18 HydrophobicContact CG-CB 4.23Å; K14-E18 IonicContact NZ-OE1 2.84Å; K14-E18 PolarHBondContact NZ-OE1 3.15Å; K14-K19 HydrophobicContact CB-CG 4.03Å; K14-K19 WeakPolarHBondContact O-CE 3.47Å; K14-K19 PolarHBondContact O-NZ 2.84Å |
| 15 | T | 71 | Confident | 66.7 | Low | 82 Ų | 82 | 86 Ų | 86 | 50% | 0.503 | 43% | 0.425 | S | S | . | . | trans | -65.3 | 162.2 | 170.6 | 60 | 0 | 0 | 0 | 0 | 111.1 | V17 E18 K19 | T15-V17 VanDerWaalsContact C-N 3.27Å; T15-V17 PolarHBondContact O-N 3.4Å; T15-E18 PolarHBondContact N-OE2 3.1Å; T15-E18 PolarHBondContact O-N 2.91Å; T15-E18 VanDerWaalsContact O-N 3.1Å; T15-E18 VanDerWaalsContact OG1-CG 3.28Å; T15-E18 WeakPolarHBondContact OG1-CG 3.36Å; T15-E18 PolarHBondContact OG1-OE2 3.23Å; T15-K19 WeakPolarHBondContact O-CG 3.46Å; T15-K19 PolarHBondContact O-N 3.03Å | ||
| 16 | L | 69.3 | Low | 67.4 | Low | 133 Ų | 133 | 79.1 Ų | 79.1 | 70% | 0.696 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -55.9 | -42.1 | -178.7 | -173.2 | 68.6 | 0 | 0 | 0 | 112.2 | E18 K19 E20 | L16-E18 PolarHBondContact O-N 3.49Å; L16-K19 WeakPolarHBondContact O-CB 3.13Å; L16-K19 PolarHBondContact O-N 3.03Å; L16-E20 PolarHBondContact O-N 3.04Å |
| 17 | V | 73.8 | Confident | 68 | Low | 95 Ų | 95 | 81.8 Ų | 81.8 | 58% | 0.576 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -61.6 | -44.1 | 176.8 | 179.1 | 0 | 0 | 0 | 0 | 111.3 | T15 K19 E20 Q21 | T15-V17 VanDerWaalsContact C-N 3.27Å; T15-V17 PolarHBondContact O-N 3.4Å; V17-K19 VanDerWaalsContact C-N 3.32Å; V17-K19 PolarHBondContact O-N 3.34Å; V17-E20 PolarHBondContact O-N 3.41Å; V17-Q21 PolarHBondContact O-N 2.98Å; V17-Q21 VanDerWaalsContact O-N 3.15Å |
| 18 | E | 69.2 | Low | 68.5 | Low | 61 Ų | 61 | 86.6 Ų | 86.6 | 29% | 0.285 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -68.7 | -31.9 | 177.2 | -71 | 174.8 | 108.5 | 0 | 0 | 112.2 | K14 T15 L16 Y22 | K14-E18 HydrophobicContact CB-CB 3.8Å; K14-E18 HydrophobicContact CD-CB 3.9Å; K14-E18 VanDerWaalsContact CD-CD 3.45Å; K14-E18 HydrophobicContact CD-CG 4.26Å; K14-E18 VanDerWaalsContact CD-OE1 3.24Å; K14-E18 WeakPolarHBondContact CD-OE1 3.23Å; K14-E18 HydrophobicContact CG-CB 4.23Å; K14-E18 IonicContact NZ-OE1 2.84Å; K14-E18 PolarHBondContact NZ-OE1 3.15Å; T15-E18 PolarHBondContact N-OE2 3.1Å; T15-E18 PolarHBondContact O-N 2.91Å; T15-E18 VanDerWaalsContact O-N 3.1Å; T15-E18 VanDerWaalsContact OG1-CG 3.28Å; T15-E18 WeakPolarHBondContact OG1-CG 3.36Å; T15-E18 PolarHBondContact OG1-OE2 3.23Å; L16-E18 PolarHBondContact O-N 3.49Å; E18-Y22 VanDerWaalsContact O-CB 3.24Å; E18-Y22 WeakPolarHBondContact O-CB 3.31Å; E18-Y22 PolarHBondContact O-N 3.33Å |
| 19 | K | 69 | Low | 68.6 | Low | 57 Ų | 57 | 87 Ų | 87 | 25% | 0.248 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -65.8 | -38.1 | 173.7 | -75.5 | 172.1 | 174.6 | 160 | 0 | 111.7 | V11 H12 K14 T15 L16 V17 Y22 W23 | V11-K19 HydrophobicContact CG1-CG 4.49Å; V11-K19 WeakPolarHBondContact O-CE 3.39Å; H12-K19 PolarHBondContact O-NZ 3.22Å; K14-K19 HydrophobicContact CB-CG 4.03Å; K14-K19 WeakPolarHBondContact O-CE 3.47Å; K14-K19 PolarHBondContact O-NZ 2.84Å; T15-K19 WeakPolarHBondContact O-CG 3.46Å; T15-K19 PolarHBondContact O-N 3.03Å; L16-K19 WeakPolarHBondContact O-CB 3.13Å; L16-K19 PolarHBondContact O-N 3.03Å; V17-K19 VanDerWaalsContact C-N 3.32Å; V17-K19 PolarHBondContact O-N 3.34Å; K19-Y22 PolarHBondContact O-N 3.35Å; K19-W23 WeakPolarHBondContact O-CB 3.24Å; K19-W23 PolarHBondContact O-N 3.1Å |
| 20 | E | 71.7 | Confident | 68.6 | Low | 120 Ų | 120 | 90 Ų | 90 | 56% | 0.561 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -66.4 | -46.9 | 175.6 | -71.3 | -177.6 | 152.1 | 0 | 0 | 112.1 | L16 V17 Y22 W23 D24 | L16-E20 PolarHBondContact O-N 3.04Å; V17-E20 PolarHBondContact O-N 3.41Å; E20-Y22 VanDerWaalsContact C-N 3.3Å; E20-Y22 PolarHBondContact O-N 3Å; E20-W23 VanDerWaalsContact O-CB 3.31Å; E20-W23 WeakPolarHBondContact O-CB 3.31Å; E20-W23 PolarHBondContact O-N 2.9Å; E20-W23 VanDerWaalsContact O-N 3.1Å; E20-D24 PolarHBondContact O-N 3.48Å |
| 21 | Q | 72.4 | Confident | 68.3 | Low | 133 Ų | 133 | 92.6 Ų | 92.6 | 62% | 0.621 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -60.2 | -42.2 | 174.5 | -70.6 | -178.6 | -24.2 | 0 | 0 | 111.8 | V17 W23 D24 Y25 | V17-Q21 PolarHBondContact O-N 2.98Å; V17-Q21 VanDerWaalsContact O-N 3.15Å; Q21-W23 VanDerWaalsContact C-N 3.32Å; Q21-D24 PolarHBondContact O-N 3.48Å; Q21-Y25 PolarHBondContact O-N 3.28Å |
| 22 | Y | 70.4 | Confident | 67.9 | Low | 37 Ų | 37 | 96 Ų | 96 | 15% | 0.145 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -64.1 | -40.1 | 175.4 | -169.4 | -103.9 | 0 | 0 | 0 | 110.9 | L7 V11 E18 K19 E20 D24 Y25 L26 | L7-Y22 VanDerWaalsContact CD1-OH 3.28Å; L7-Y22 WeakPolarHBondContact CD1-OH 3.32Å; L7-Y22 VanDerWaalsContact CD2-OH 3.31Å; L7-Y22 WeakPolarHBondContact CD2-OH 3.16Å; L7-Y22 WeakPolarHBondContact CG-OH 3.42Å; V11-Y22 HydrophobicContact CB-CE1 4.48Å; V11-Y22 HydrophobicContact CG1-CD1 4.36Å; V11-Y22 HydrophobicContact CG2-CD1 3.59Å; V11-Y22 HydrophobicContact CG2-CE1 3.13Å; V11-Y22 HydrophobicContact CG2-CG 4.47Å; E18-Y22 VanDerWaalsContact O-CB 3.24Å; E18-Y22 WeakPolarHBondContact O-CB 3.31Å; E18-Y22 PolarHBondContact O-N 3.33Å; K19-Y22 PolarHBondContact O-N 3.35Å; E20-Y22 VanDerWaalsContact C-N 3.3Å; E20-Y22 PolarHBondContact O-N 3Å; Y22-D24 VanDerWaalsContact C-N 3.33Å; Y22-D24 PolarHBondContact O-N 3.32Å; Y22-Y25 HydrophobicContact CE2-CD1 4.36Å; Y22-Y25 CarbonylContact O-C 3.55Å; Y22-Y25 WeakPolarHBondContact O-CB 3.43Å; Y22-Y25 PolarHBondContact O-N 3.19Å; Y22-L26 HydrophobicContact CD1-CD1 3.73Å; Y22-L26 HydrophobicContact CD1-CD2 3.93Å; Y22-L26 HydrophobicContact CD1-CG 3.64Å; Y22-L26 HydrophobicContact CE1-CD1 3.49Å; Y22-L26 VanDerWaalsContact CE1-CD1 3.49Å; Y22-L26 HydrophobicContact CE1-CD2 3.27Å; Y22-L26 HydrophobicContact CE1-CG 3.45Å; Y22-L26 VanDerWaalsContact CE1-CG 3.45Å; Y22-L26 HydrophobicContact CE2-CD2 4.07Å; Y22-L26 HydrophobicContact CG-CG 4.39Å; Y22-L26 WeakPolarHBondContact O-CB 3.28Å; Y22-L26 VanDerWaalsContact O-CG 3.23Å; Y22-L26 WeakPolarHBondContact O-CG 3.33Å; Y22-L26 PolarHBondContact O-N 3.35Å; Y22-L26 WeakPolarHBondContact OH-CD2 3Å |
| 23 | W | 69 | Low | 67.3 | Low | 101 Ų | 101 | 95.8 Ų | 95.8 | 38% | 0.383 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -58.7 | -41.5 | 174.8 | -104 | 119.8 | 0 | 0 | 0 | 113.1 | K19 E20 Q21 L26 K27 F39 | K19-W23 WeakPolarHBondContact O-CB 3.24Å; K19-W23 PolarHBondContact O-N 3.1Å; E20-W23 VanDerWaalsContact O-CB 3.31Å; E20-W23 WeakPolarHBondContact O-CB 3.31Å; E20-W23 PolarHBondContact O-N 2.9Å; E20-W23 VanDerWaalsContact O-N 3.1Å; Q21-W23 VanDerWaalsContact C-N 3.32Å; W23-L26 HydrophobicContact CE3-CB 4.42Å; W23-L26 HydrophobicContact CE3-CD1 4.42Å; W23-L26 PolarHBondContact O-N 3.02Å; W23-K27 WeakPolarHBondContact O-CG 3.36Å; W23-K27 PolarHBondContact O-N 3.44Å; W23-F39 AromaticContact CD1-CZ 3.87Å; W23-F39 HydrophobicContact CD2-CE2 4.13Å; W23-F39 AromaticContact CD2-CZ 3.85Å; W23-F39 HydrophobicContact CD2-CZ 3.85Å; W23-F39 AromaticContact CE2-CE1 3.86Å; W23-F39 AromaticContact CE2-CE2 3.37Å; W23-F39 AromaticContact CE2-CZ 3.11Å; W23-F39 HydrophobicContact CE3-CE2 4.45Å; W23-F39 HydrophobicContact CG-CZ 4.3Å; W23-F39 HydrophobicContact CH2-CD2 4Å; W23-F39 AromaticContact CH2-CE2 3.42Å; W23-F39 HydrophobicContact CH2-CE2 3.42Å; W23-F39 VanDerWaalsContact CH2-CE2 3.42Å; W23-F39 HydrophobicContact CH2-CZ 4.1Å; W23-F39 AromaticContact CZ2-CD2 3.57Å; W23-F39 HydrophobicContact CZ2-CD2 3.57Å; W23-F39 HydrophobicContact CZ2-CE1 4.07Å; W23-F39 AromaticContact CZ2-CE2 2.99Å; W23-F39 HydrophobicContact CZ2-CE2 2.99Å; W23-F39 HydrophobicContact CZ2-CG 4.33Å; W23-F39 AromaticContact CZ2-CZ 3.3Å; W23-F39 HydrophobicContact CZ2-CZ 3.3Å; W23-F39 HydrophobicContact CZ3-CE2 4.14Å; W23-F39 AromaticContact NE1-CE1 3.45Å; W23-F39 AromaticContact NE1-CE2 3.87Å; W23-F39 AromaticContact NE1-CZ 3.12Å |
| 24 | D | 75.3 | Confident | 66.6 | Low | 93 Ų | 93 | 99.2 Ų | 99.2 | 50% | 0.497 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -69.9 | -38.3 | 177 | -73.6 | -20.5 | 0 | 0 | 0 | 111.8 | E20 Q21 Y22 L26 K27 Y28 | E20-D24 PolarHBondContact O-N 3.48Å; Q21-D24 PolarHBondContact O-N 3.48Å; Y22-D24 VanDerWaalsContact C-N 3.33Å; Y22-D24 PolarHBondContact O-N 3.32Å; D24-L26 VanDerWaalsContact C-N 3.33Å; D24-L26 PolarHBondContact O-N 3.22Å; D24-K27 PolarHBondContact O-N 3.09Å; D24-K27 IonicContact OD1-NZ 2.85Å; D24-K27 PolarHBondContact OD1-NZ 3.35Å; D24-Y28 PolarHBondContact O-N 3.39Å |
| 25 | Y | 71.9 | Confident | 66 | Low | 132 Ų | 132 | 101.5 Ų | 101.5 | 52% | 0.518 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -58.2 | -46 | 168.3 | -178.3 | -95.2 | 0 | 0 | 0 | 111.1 | Q21 Y22 K27 Y28 H29 | Q21-Y25 PolarHBondContact O-N 3.28Å; Y22-Y25 HydrophobicContact CE2-CD1 4.36Å; Y22-Y25 CarbonylContact O-C 3.55Å; Y22-Y25 WeakPolarHBondContact O-CB 3.43Å; Y22-Y25 PolarHBondContact O-N 3.19Å; Y25-K27 PolarHBondContact O-N 3.13Å; Y25-Y28 WeakPolarHBondContact O-CB 3.46Å; Y25-Y28 PolarHBondContact O-N 3.27Å; Y25-H29 AromaticContact CD1-CD2 3.64Å; Y25-H29 AromaticContact CD2-CD2 3.78Å; Y25-H29 AromaticContact CD2-NE2 3.8Å; Y25-H29 AromaticContact CE1-CD2 3.34Å; Y25-H29 WeakPolarHBondContact CE1-CD2 3.39Å; Y25-H29 AromaticContact CE1-NE2 3.68Å; Y25-H29 AromaticContact CE2-CD2 3.51Å; Y25-H29 AromaticContact CE2-NE2 3.13Å; Y25-H29 WeakPolarHBondContact CE2-NE2 3.47Å; Y25-H29 AromaticContact CG-CD2 3.85Å; Y25-H29 AromaticContact CZ-CD2 3.28Å; Y25-H29 AromaticContact CZ-NE2 3.05Å; Y25-H29 PolarHBondContact O-CD2 3.29Å; Y25-H29 PolarHBondContact O-N 2.87Å; Y25-H29 PolarHBondContact OH-NE2 3.05Å |
| 26 | L | 69.4 | Low | 65.3 | Low | 7 Ų | 7 | 99.7 Ų | 99.7 | 4% | 0.037 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -63.8 | -40 | 177.5 | -68.3 | -168.4 | 0 | 0 | 0 | 112.3 | Y22 W23 D24 Y28 H29 R30 L36 F39 | Y22-L26 HydrophobicContact CD1-CD1 3.73Å; Y22-L26 HydrophobicContact CD1-CD2 3.93Å; Y22-L26 HydrophobicContact CD1-CG 3.64Å; Y22-L26 HydrophobicContact CE1-CD1 3.49Å; Y22-L26 VanDerWaalsContact CE1-CD1 3.49Å; Y22-L26 HydrophobicContact CE1-CD2 3.27Å; Y22-L26 HydrophobicContact CE1-CG 3.45Å; Y22-L26 VanDerWaalsContact CE1-CG 3.45Å; Y22-L26 HydrophobicContact CE2-CD2 4.07Å; Y22-L26 HydrophobicContact CG-CG 4.39Å; Y22-L26 WeakPolarHBondContact O-CB 3.28Å; Y22-L26 VanDerWaalsContact O-CG 3.23Å; Y22-L26 WeakPolarHBondContact O-CG 3.33Å; Y22-L26 PolarHBondContact O-N 3.35Å; Y22-L26 WeakPolarHBondContact OH-CD2 3Å; W23-L26 HydrophobicContact CE3-CB 4.42Å; W23-L26 HydrophobicContact CE3-CD1 4.42Å; W23-L26 PolarHBondContact O-N 3.02Å; D24-L26 VanDerWaalsContact C-N 3.33Å; D24-L26 PolarHBondContact O-N 3.22Å; L26-Y28 VanDerWaalsContact C-N 3.33Å; L26-H29 CarbonylContact O-C 3.59Å; L26-H29 PolarHBondContact O-N 3.44Å; L26-R30 VanDerWaalsContact O-CB 3.3Å; L26-R30 WeakPolarHBondContact O-CB 3.14Å; L26-R30 PolarHBondContact O-N 3.39Å; L26-L36 HydrophobicContact CB-CD1 3.79Å; L26-L36 HydrophobicContact CB-CD2 3.65Å; L26-L36 HydrophobicContact CB-CG 4.37Å; L26-L36 HydrophobicContact CD1-CD1 4.21Å; L26-L36 HydrophobicContact CD1-CD2 3.77Å; L26-L36 HydrophobicContact CD1-CG 4.43Å; L26-L36 HydrophobicContact CD2-CD2 3.17Å; L26-L36 HydrophobicContact CG-CD1 4.46Å; L26-L36 HydrophobicContact CG-CD2 3.63Å; L26-F39 HydrophobicContact CD1-CE2 4.19Å; L26-F39 HydrophobicContact CD1-CZ 4.32Å |
| 27 | K | 68.5 | Low | 64.7 | Low | 118 Ų | 118 | 94.9 Ų | 94.9 | 51% | 0.513 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.4 | -43.2 | 174.4 | -74.3 | 173.2 | -162.1 | 154.5 | 0 | 110.9 | W23 D24 Y25 H29 R30 | W23-K27 WeakPolarHBondContact O-CG 3.36Å; W23-K27 PolarHBondContact O-N 3.44Å; D24-K27 PolarHBondContact O-N 3.09Å; D24-K27 IonicContact OD1-NZ 2.85Å; D24-K27 PolarHBondContact OD1-NZ 3.35Å; Y25-K27 PolarHBondContact O-N 3.13Å; K27-H29 VanDerWaalsContact C-N 3.33Å; K27-H29 PolarHBondContact O-N 3.23Å; K27-R30 PolarHBondContact O-N 3.37Å |
| 28 | Y | 68.6 | Low | 63.9 | Low | 162 Ų | 162 | 95 Ų | 95 | 64% | 0.635 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -59.3 | -44.8 | 175 | -176.8 | -97.3 | 0 | 0 | 0 | 111.4 | D24 Y25 L26 I32 | D24-Y28 PolarHBondContact O-N 3.39Å; Y25-Y28 WeakPolarHBondContact O-CB 3.46Å; Y25-Y28 PolarHBondContact O-N 3.27Å; L26-Y28 VanDerWaalsContact C-N 3.33Å; Y28-I32 HydrophobicContact CD1-CD1 4.37Å; Y28-I32 HydrophobicContact CE1-CD1 4.1Å |
| 29 | H | 62.3 | Low | 63.2 | Low | 43 Ų | 43 | 96.9 Ų | 96.9 | 20% | 0.199 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -79 | -18.8 | 179.1 | -76 | -76.6 | 0 | 0 | 0 | 114.9 | Y25 L26 K27 N31 I32 | Y25-H29 AromaticContact CD1-CD2 3.64Å; Y25-H29 AromaticContact CD2-CD2 3.78Å; Y25-H29 AromaticContact CD2-NE2 3.8Å; Y25-H29 AromaticContact CE1-CD2 3.34Å; Y25-H29 WeakPolarHBondContact CE1-CD2 3.39Å; Y25-H29 AromaticContact CE1-NE2 3.68Å; Y25-H29 AromaticContact CE2-CD2 3.51Å; Y25-H29 AromaticContact CE2-NE2 3.13Å; Y25-H29 WeakPolarHBondContact CE2-NE2 3.47Å; Y25-H29 AromaticContact CG-CD2 3.85Å; Y25-H29 AromaticContact CZ-CD2 3.28Å; Y25-H29 AromaticContact CZ-NE2 3.05Å; Y25-H29 PolarHBondContact O-CD2 3.29Å; Y25-H29 PolarHBondContact O-N 2.87Å; Y25-H29 PolarHBondContact OH-NE2 3.05Å; L26-H29 CarbonylContact O-C 3.59Å; L26-H29 PolarHBondContact O-N 3.44Å; K27-H29 VanDerWaalsContact C-N 3.33Å; K27-H29 PolarHBondContact O-N 3.23Å; H29-N31 VanDerWaalsContact C-N 3.26Å; H29-N31 PolarHBondContact O-N 3.49Å; H29-I32 CarbonylContact O-C 3.53Å; H29-I32 WeakPolarHBondContact O-CA 3.24Å; H29-I32 WeakPolarHBondContact O-CB 3.28Å; H29-I32 PolarHBondContact O-N 3.01Å |
| 30 | R | 59.3 | Low | 62.3 | Low | 177 Ų | 177 | 98.1 Ų | 98.1 | 67% | 0.668 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -64.5 | -33.5 | 173.4 | -172 | 178.1 | 178 | -177.8 | -0.6 | 111.2 | L26 K27 I32 G33 L36 | L26-R30 VanDerWaalsContact O-CB 3.3Å; L26-R30 WeakPolarHBondContact O-CB 3.14Å; L26-R30 PolarHBondContact O-N 3.39Å; K27-R30 PolarHBondContact O-N 3.37Å; R30-I32 PolarHBondContact O-N 3.27Å; R30-G33 PolarHBondContact O-N 3.44Å; R30-L36 HydrophobicContact CB-CD1 4.12Å; R30-L36 HydrophobicContact CG-CD1 4.4Å |
| 31 | N | 58 | Low | 61.3 | Low | 155 Ų | 155 | 96.6 Ų | 96.6 | 83% | 0.829 | 48% | 0.477 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.8 | -14.6 | 170.5 | -77.1 | -13.3 | 0 | 0 | 0 | 113 | H29 | H29-N31 VanDerWaalsContact C-N 3.26Å; H29-N31 PolarHBondContact O-N 3.49Å |
| 32 | I | 56.9 | Low | 60 | Low | 90 Ų | 90 | 95.2 Ų | 95.2 | 46% | 0.462 | 47% | 0.471 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.1 | 11.9 | -179.6 | -48.6 | 178.5 | 0 | 0 | 0 | 110.6 | Y28 H29 R30 Y34 | Y28-I32 HydrophobicContact CD1-CD1 4.37Å; Y28-I32 HydrophobicContact CE1-CD1 4.1Å; H29-I32 CarbonylContact O-C 3.53Å; H29-I32 WeakPolarHBondContact O-CA 3.24Å; H29-I32 WeakPolarHBondContact O-CB 3.28Å; H29-I32 PolarHBondContact O-N 3.01Å; R30-I32 PolarHBondContact O-N 3.27Å; I32-Y34 VanDerWaalsContact C-N 3.28Å; I32-Y34 HydrophobicContact CB-CD2 4.12Å; I32-Y34 HydrophobicContact CB-CE2 4.43Å; I32-Y34 HydrophobicContact CG2-CD2 4.02Å; I32-Y34 HydrophobicContact CG2-CE2 3.83Å; I32-Y34 PolarHBondContact O-N 2.83Å |
| 33 | G | 51.7 | Low | 58.7 | Low | 70 Ų | 70 | 99.8 Ų | 99.8 | 72% | 0.722 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.2 | 11.9 | 172.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | R30 S35 | R30-G33 PolarHBondContact O-N 3.44Å; G33-S35 PolarHBondContact O-N 2.93Å |
| 34 | Y | 53.6 | Low | 57.5 | Low | 160 Ų | 160 | 99.3 Ų | 99.3 | 63% | 0.627 | 51% | 0.507 | S | S | * | . | trans | -77.1 | 120 | 174.4 | -76.8 | -85.3 | 0 | 0 | 0 | 110.6 | I32 L36 | I32-Y34 VanDerWaalsContact C-N 3.28Å; I32-Y34 HydrophobicContact CB-CD2 4.12Å; I32-Y34 HydrophobicContact CB-CE2 4.43Å; I32-Y34 HydrophobicContact CG2-CD2 4.02Å; I32-Y34 HydrophobicContact CG2-CE2 3.83Å; I32-Y34 PolarHBondContact O-N 2.83Å; Y34-L36 PolarHBondContact O-N 3.17Å | ||
| 35 | S | 54.7 | Low | 56 | Low | 106 Ų | 106 | 99.7 Ų | 99.7 | 74% | 0.741 | 51% | 0.507 | S | S | * | . | trans | -65.3 | 101.6 | 167.9 | -176.6 | 0 | 0 | 0 | 0 | 108.5 | G33 | G33-S35 PolarHBondContact O-N 2.93Š| ||
| 36 | L | 56.7 | Low | 54.6 | Low | 44 Ų | 44 | 100.2 Ų | 100.2 | 23% | 0.23 | 52% | 0.518 | C | S | . | . | P | Polyproline II helix | trans | -63.8 | 122.4 | 176.1 | -67.7 | 167.9 | 0 | 0 | 0 | 109.2 | L26 R30 Y34 C38 | L26-L36 HydrophobicContact CB-CD1 3.79Å; L26-L36 HydrophobicContact CB-CD2 3.65Å; L26-L36 HydrophobicContact CB-CG 4.37Å; L26-L36 HydrophobicContact CD1-CD1 4.21Å; L26-L36 HydrophobicContact CD1-CD2 3.77Å; L26-L36 HydrophobicContact CD1-CG 4.43Å; L26-L36 HydrophobicContact CD2-CD2 3.17Å; L26-L36 HydrophobicContact CG-CD1 4.46Å; L26-L36 HydrophobicContact CG-CD2 3.63Å; R30-L36 HydrophobicContact CB-CD1 4.12Å; R30-L36 HydrophobicContact CG-CD1 4.4Å; Y34-L36 PolarHBondContact O-N 3.17Å; L36-C38 PolarHBondContact O-N 3.4Å |
| 37 | P | 57.2 | Low | 53.1 | Low | 32 Ų | 32 | 105.4 Ų | 105.4 | 21% | 0.208 | 55% | 0.551 | C | S | . | * | P | Polyproline II helix | trans | -65.1 | 132.2 | 175 | 24.3 | -27.9 | 0 | 0 | 0 | 109.4 | K4 L7 | K4-P37 HydrophobicContact CB-CB 4.31Å; L7-P37 HydrophobicContact CB-CG 3.75Å; L7-P37 HydrophobicContact CD2-CG 3.23Å; L7-P37 HydrophobicContact CG-CG 3.88Å |
| 38 | C | 56.4 | Low | 51.6 | Low | 97 Ų | 97 | 104.5 Ų | 104.5 | 66% | 0.655 | 56% | 0.559 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 138.9 | -167.3 | -49 | 0 | 0 | 0 | 0 | 112.5 | L36 I40 | L36-C38 PolarHBondContact O-N 3.4Å; C38-I40 PolarHBondContact O-N 2.77Å |
| 39 | F | 54 | Low | 50.2 | Low | 100 Ų | 100 | 105.5 Ų | 105.5 | 44% | 0.439 | 59% | 0.59 | S | S | . | * | trans | -60.4 | 102.3 | 159.2 | -74.1 | -96.2 | 0 | 0 | 0 | 107.3 | V11 W23 L26 | V11-F39 HydrophobicContact CG1-CE1 4.05Å; V11-F39 HydrophobicContact CG1-CZ 4.49Å; W23-F39 AromaticContact CD1-CZ 3.87Å; W23-F39 HydrophobicContact CD2-CE2 4.13Å; W23-F39 AromaticContact CD2-CZ 3.85Å; W23-F39 HydrophobicContact CD2-CZ 3.85Å; W23-F39 AromaticContact CE2-CE1 3.86Å; W23-F39 AromaticContact CE2-CE2 3.37Å; W23-F39 AromaticContact CE2-CZ 3.11Å; W23-F39 HydrophobicContact CE3-CE2 4.45Å; W23-F39 HydrophobicContact CG-CZ 4.3Å; W23-F39 HydrophobicContact CH2-CD2 4Å; W23-F39 AromaticContact CH2-CE2 3.42Å; W23-F39 HydrophobicContact CH2-CE2 3.42Å; W23-F39 VanDerWaalsContact CH2-CE2 3.42Å; W23-F39 HydrophobicContact CH2-CZ 4.1Å; W23-F39 AromaticContact CZ2-CD2 3.57Å; W23-F39 HydrophobicContact CZ2-CD2 3.57Å; W23-F39 HydrophobicContact CZ2-CE1 4.07Å; W23-F39 AromaticContact CZ2-CE2 2.99Å; W23-F39 HydrophobicContact CZ2-CE2 2.99Å; W23-F39 HydrophobicContact CZ2-CG 4.33Å; W23-F39 AromaticContact CZ2-CZ 3.3Å; W23-F39 HydrophobicContact CZ2-CZ 3.3Å; W23-F39 HydrophobicContact CZ3-CE2 4.14Å; W23-F39 AromaticContact NE1-CE1 3.45Å; W23-F39 AromaticContact NE1-CE2 3.87Å; W23-F39 AromaticContact NE1-CZ 3.12Å; L26-F39 HydrophobicContact CD1-CE2 4.19Å; L26-F39 HydrophobicContact CD1-CZ 4.32Å | ||
| 40 | I | 51.1 | Low | 49.6 | Very low | 84 Ų | 84 | 108.6 Ų | 108.6 | 43% | 0.431 | 61% | 0.609 | S | S | . | * | trans | -90.1 | 109.3 | 162.2 | -54.8 | 171.6 | 0 | 0 | 0 | 106.2 | C38 E42 I45 | C38-I40 PolarHBondContact O-N 2.77Å; I40-E42 PolarHBondContact O-N 2.78Å; I40-I45 HydrophobicContact CB-CD1 4.34Å; I40-I45 HydrophobicContact CD1-CD1 4.3Å; I40-I45 HydrophobicContact CG2-CD1 3.22Å; I40-I45 HydrophobicContact CG2-CG1 3.59Å | ||
| 41 | D | 50.3 | Low | 49.1 | Very low | 87 Ų | 87 | 105 Ų | 105 | 47% | 0.465 | 61% | 0.606 | S | S | . | * | trans | -59.8 | 113.9 | 167.5 | -177 | -83.6 | 0 | 0 | 0 | 108.5 | N43 T44 | D41-N43 PolarHBondContact O-N 3.43Å; D41-N43 WeakPolarHBondContact OD1-CA 3.48Å; D41-N43 WeakPolarHBondContact OD1-CB 3.35Å; D41-N43 PolarHBondContact OD1-N 2.91Å; D41-T44 WeakPolarHBondContact O-CB 3.48Å; D41-T44 PolarHBondContact O-N 3.47Å; D41-T44 PolarHBondContact OD1-N 3.11Å; D41-T44 PolarHBondContact OD1-OG1 2.84Å | ||
| 42 | E | 43.8 | Very low | 48.6 | Very low | 104 Ų | 104 | 102.2 Ų | 102.2 | 49% | 0.486 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -65.8 | -10.3 | 178.9 | -88.7 | -167.5 | 165.5 | 0 | 0 | 113.1 | H12 I40 T44 | H12-E42 IonicContact CD2-OE1 2.77Å; H12-E42 IonicContact CD2-OE2 3.87Å; H12-E42 PolarHBondContact CD2-OE2 3.32Å; H12-E42 VanDerWaalsContact CE1-CG 3.46Å; H12-E42 WeakPolarHBondContact CE1-CG 3.34Å; H12-E42 IonicContact CE1-OE2 3.01Å; H12-E42 PolarHBondContact CE1-OE2 3.17Å; H12-E42 IonicContact CG-OE1 3.82Å; H12-E42 IonicContact CG-OE2 3.77Å; H12-E42 IonicContact ND1-OE1 4Å; H12-E42 IonicContact ND1-OE2 3.68Å; H12-E42 IonicContact NE2-OE2 3.34Å; H12-E42 PolarHBondContact NE2-OE2 2.77Å; I40-E42 PolarHBondContact O-N 2.78Å; E42-T44 PolarHBondContact O-N 3.1Å |
| 43 | N | 44 | Very low | 48.1 | Very low | 134 Ų | 134 | 102.9 Ų | 102.9 | 72% | 0.717 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -77.5 | -9.4 | 168.5 | -57.7 | -55.2 | 0 | 0 | 0 | 112.5 | D41 | D41-N43 PolarHBondContact O-N 3.43Å; D41-N43 WeakPolarHBondContact OD1-CA 3.48Å; D41-N43 WeakPolarHBondContact OD1-CB 3.35Å; D41-N43 PolarHBondContact OD1-N 2.91Å |
| 44 | T | 44.1 | Very low | 47.9 | Very low | 91 Ų | 91 | 105 Ų | 105 | 56% | 0.558 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -96.6 | -19.3 | 178.3 | -52.2 | 0 | 0 | 0 | 0 | 112.9 | D41 E42 | D41-T44 WeakPolarHBondContact O-CB 3.48Å; D41-T44 PolarHBondContact O-N 3.47Å; D41-T44 PolarHBondContact OD1-N 3.11Å; D41-T44 PolarHBondContact OD1-OG1 2.84Å; E42-T44 PolarHBondContact O-N 3.1Å |
| 45 | I | 44.2 | Very low | 47.5 | Very low | 100 Ų | 100 | 101.3 Ų | 101.3 | 51% | 0.513 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -92.6 | -21.4 | -179.2 | -67.7 | -169.9 | 0 | 0 | 0 | 113.1 | I40 T47 | I40-I45 HydrophobicContact CB-CD1 4.34Å; I40-I45 HydrophobicContact CD1-CD1 4.3Å; I40-I45 HydrophobicContact CG2-CD1 3.22Å; I40-I45 HydrophobicContact CG2-CG1 3.59Å; I45-T47 VanDerWaalsContact C-N 3.3Å; I45-T47 PolarHBondContact O-N 3.34Å |
| 46 | L | 41 | Very low | 47 | Very low | 143 Ų | 143 | 101 Ų | 101 | 75% | 0.749 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | -0.7 | 177.8 | -75.4 | 165.8 | 0 | 0 | 0 | 114.9 | ||
| 47 | T | 37.9 | Very low | 46.2 | Very low | 117 Ų | 117 | 105.4 Ų | 105.4 | 72% | 0.718 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.7 | 14.9 | 173.7 | 51.2 | 0 | 0 | 0 | 0 | 113.9 | I45 | I45-T47 VanDerWaalsContact C-N 3.3Å; I45-T47 PolarHBondContact O-N 3.34Å |
| 48 | S | 37.1 | Very low | 45.3 | Very low | 99 Ų | 99 | 111.5 Ų | 111.5 | 69% | 0.692 | 64% | 0.641 | S | S | * | * | trans | -108.7 | 59.8 | 173.6 | -51.3 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 49 | S | 40.1 | Very low | 44.3 | Very low | 182 Ų | 182 | 112.8 Ų | 112.8 | 100% | 1.273 | 64% | 0.64 | S | S | * | * | trans | -100.4 | 0 | 165 | -53.9 | 0 | 0 | 0 | 0 | 109.7 |
Retrieved 49 of 49 residues in 55 ms
(Link to these results)