| 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 | 41.5 | Very low | 72.7 | Confident | 257 Ų | 257 | 108.5 Ų | 108.5 | 100% | 1.266 | 55% | 0.547 | S | S | * | . | 0 | 63.8 | 0 | -78.9 | -178.4 | 165.1 | 0 | 0 | 110.1 | |||||
| 2 | G | 54.4 | Low | 74 | Confident | 53 Ų | 53 | 104.5 Ų | 104.5 | 55% | 0.546 | 54% | 0.543 | S | S | . | . | trans | -166.1 | -21.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 3 | E | 57 | Low | 74.8 | Confident | 161 Ų | 161 | 104.5 Ų | 104.5 | 75% | 0.752 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -73.7 | -31.5 | -175 | -62.4 | 178.6 | 165.9 | 0 | 0 | 113.4 | K5 Y6 | E3-K5 VanDerWaalsContact C-N 3.27Å; E3-K5 PolarHBondContact O-N 2.94Å; E3-Y6 PolarHBondContact O-N 3.43Å |
| 4 | E | 63.7 | Low | 75.6 | Confident | 189 Ų | 189 | 102.8 Ų | 102.8 | 88% | 0.883 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.7 | -26.7 | 179.9 | -68.3 | -178.6 | 165.1 | 0 | 0 | 113.5 | P8 | E4-P8 WeakPolarHBondContact O-CD 3.47Å |
| 5 | K | 75.5 | Confident | 76.2 | Confident | 141 Ų | 141 | 104.8 Ų | 104.8 | 61% | 0.613 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -90.1 | -20.7 | 179.4 | -157.9 | -175.7 | -179.8 | -125.9 | 0 | 112.6 | E3 P8 E9 | E3-K5 VanDerWaalsContact C-N 3.27Å; E3-K5 PolarHBondContact O-N 2.94Å; K5-P8 WeakPolarHBondContact O-CD 3.27Å; K5-P8 WeakPolarHBondContact O-CG 3.26Å; K5-E9 VanDerWaalsContact CD-OE1 3.26Å; K5-E9 WeakPolarHBondContact CD-OE1 3.12Å; K5-E9 WeakPolarHBondContact CE-OE1 3.28Å; K5-E9 HydrophobicContact CG-CG 4.4Å; K5-E9 WeakPolarHBondContact CG-OE1 3.34Å; K5-E9 IonicContact NZ-OE1 2.65Å; K5-E9 PolarHBondContact NZ-OE1 3.44Å; K5-E9 WeakPolarHBondContact O-CB 3.44Å; K5-E9 WeakPolarHBondContact O-CG 3.39Å; K5-E9 PolarHBondContact O-N 3.48Å |
| 6 | Y | 81.6 | Confident | 77.1 | Confident | 88 Ų | 88 | 104.3 Ų | 104.3 | 35% | 0.345 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -70.8 | -44.7 | -171.7 | -175.4 | -117.7 | 0 | 0 | 0 | 112.9 | E3 E9 L10 F35 | E3-Y6 PolarHBondContact O-N 3.43Å; Y6-E9 PolarHBondContact O-N 3.3Å; Y6-L10 HydrophobicContact CD1-CD1 3.94Å; Y6-L10 HydrophobicContact CE1-CD1 3.5Å; Y6-L10 VanDerWaalsContact CE1-CD1 3.5Å; Y6-L10 HydrophobicContact CE1-CG 4.27Å; Y6-L10 HydrophobicContact CE2-CD1 4.35Å; Y6-L10 HydrophobicContact CE2-CD2 4.32Å; Y6-L10 HydrophobicContact CE2-CG 4.27Å; Y6-L10 WeakPolarHBondContact O-CG 3.47Å; Y6-L10 PolarHBondContact O-N 3.48Å; Y6-F35 AromaticContact CD1-CE1 3.82Å; Y6-F35 HydrophobicContact CD1-CE1 3.82Å; Y6-F35 AromaticContact CD1-CE2 3.82Å; Y6-F35 HydrophobicContact CD1-CE2 3.82Å; Y6-F35 AromaticContact CD1-CZ 3.4Å; Y6-F35 HydrophobicContact CD1-CZ 3.4Å; Y6-F35 HydrophobicContact CE1-CD2 4.27Å; Y6-F35 HydrophobicContact CE1-CE1 4.27Å; Y6-F35 AromaticContact CE1-CE2 3.42Å; Y6-F35 HydrophobicContact CE1-CE2 3.42Å; Y6-F35 VanDerWaalsContact CE1-CE2 3.42Å; Y6-F35 AromaticContact CE1-CZ 3.41Å; Y6-F35 HydrophobicContact CE1-CZ 3.41Å; Y6-F35 VanDerWaalsContact CE1-CZ 3.41Å |
| 7 | L | 83.8 | Confident | 77.8 | Confident | 50 Ų | 50 | 100.8 Ų | 100.8 | 26% | 0.262 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62 | -49.2 | 178.5 | -172.9 | 66.6 | 0 | 0 | 0 | 113.6 | E9 L10 M11 I32 F35 | L7-E9 VanDerWaalsContact C-N 3.26Å; L7-E9 PolarHBondContact O-N 3.28Å; L7-L10 PolarHBondContact O-N 2.89Å; L7-M11 WeakPolarHBondContact O-CG 3.31Å; L7-M11 PolarHBondContact O-N 3.27Å; L7-M11 VanDerWaalsContact O-N 3.09Å; L7-I32 HydrophobicContact CD1-CG1 4.48Å; L7-I32 HydrophobicContact CD1-CG2 4.14Å; L7-F35 HydrophobicContact CD1-CB 4.1Å |
| 8 | P | 86.3 | Confident | 78.4 | Confident | 72 Ų | 72 | 100.2 Ų | 100.2 | 47% | 0.468 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.1 | -29.4 | 177.1 | 21.5 | -30.3 | 0 | 0 | 0 | 113 | E4 K5 A12 | E4-P8 WeakPolarHBondContact O-CD 3.47Å; K5-P8 WeakPolarHBondContact O-CD 3.27Å; K5-P8 WeakPolarHBondContact O-CG 3.26Å; P8-A12 WeakPolarHBondContact O-CB 3.31Å; P8-A12 PolarHBondContact O-N 3.48Å |
| 9 | E | 86.6 | Confident | 78.7 | Confident | 86 Ų | 86 | 100.7 Ų | 100.7 | 40% | 0.402 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.6 | -44.8 | 172.9 | -75 | 173.7 | 174.7 | 0 | 0 | 112.1 | K5 Y6 L7 M11 A12 E13 | K5-E9 VanDerWaalsContact CD-OE1 3.26Å; K5-E9 WeakPolarHBondContact CD-OE1 3.12Å; K5-E9 WeakPolarHBondContact CE-OE1 3.28Å; K5-E9 HydrophobicContact CG-CG 4.4Å; K5-E9 WeakPolarHBondContact CG-OE1 3.34Å; K5-E9 IonicContact NZ-OE1 2.65Å; K5-E9 PolarHBondContact NZ-OE1 3.44Å; K5-E9 WeakPolarHBondContact O-CB 3.44Å; K5-E9 WeakPolarHBondContact O-CG 3.39Å; K5-E9 PolarHBondContact O-N 3.48Å; Y6-E9 PolarHBondContact O-N 3.3Å; L7-E9 VanDerWaalsContact C-N 3.26Å; L7-E9 PolarHBondContact O-N 3.28Å; E9-M11 VanDerWaalsContact C-N 3.33Å; E9-M11 PolarHBondContact O-N 3.21Å; E9-A12 PolarHBondContact O-N 2.88Å; E9-E13 WeakPolarHBondContact O-CB 3.43Å; E9-E13 PolarHBondContact O-N 2.84Å |
| 10 | L | 85.3 | Confident | 79.3 | Confident | 10 Ų | 10 | 99.8 Ų | 99.8 | 5% | 0.052 | 54% | 0.537 | C | S | . | . | H | α-helix | trans | -62.4 | -38.3 | 176.3 | -71.6 | 175.5 | 0 | 0 | 0 | 112.7 | Y6 L7 K14 L28 E31 I32 | Y6-L10 HydrophobicContact CD1-CD1 3.94Å; Y6-L10 HydrophobicContact CE1-CD1 3.5Å; Y6-L10 VanDerWaalsContact CE1-CD1 3.5Å; Y6-L10 HydrophobicContact CE1-CG 4.27Å; Y6-L10 HydrophobicContact CE2-CD1 4.35Å; Y6-L10 HydrophobicContact CE2-CD2 4.32Å; Y6-L10 HydrophobicContact CE2-CG 4.27Å; Y6-L10 WeakPolarHBondContact O-CG 3.47Å; Y6-L10 PolarHBondContact O-N 3.48Å; L7-L10 PolarHBondContact O-N 2.89Å; L10-K14 WeakPolarHBondContact O-CB 3.28Å; L10-K14 PolarHBondContact O-N 2.96Å; L10-L28 HydrophobicContact CD2-CD2 3.73Å; L10-E31 HydrophobicContact CD1-CG 4.16Å; L10-I32 HydrophobicContact CB-CD1 4.2Å; L10-I32 HydrophobicContact CB-CG1 3.88Å; L10-I32 HydrophobicContact CD1-CG1 4.34Å |
| 11 | M | 84 | Confident | 79.7 | Confident | 87 Ų | 87 | 100.8 Ų | 100.8 | 43% | 0.429 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.5 | -44.6 | 176.3 | -67.9 | -179 | 76.5 | 0 | 0 | 111.2 | L7 E9 E13 K14 D15 I32 | L7-M11 WeakPolarHBondContact O-CG 3.31Å; L7-M11 PolarHBondContact O-N 3.27Å; L7-M11 VanDerWaalsContact O-N 3.09Å; E9-M11 VanDerWaalsContact C-N 3.33Å; E9-M11 PolarHBondContact O-N 3.21Å; M11-E13 PolarHBondContact O-N 3.43Å; M11-K14 PolarHBondContact O-N 3.4Å; M11-D15 PolarHBondContact O-N 3.33Å; M11-I32 HydrophobicContact CG-CD1 4.11Å |
| 12 | A | 87.9 | Confident | 81.9 | Confident | 60 Ų | 60 | 93.1 Ų | 93.1 | 50% | 0.496 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.5 | -38.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | P8 E9 D15 S16 | P8-A12 WeakPolarHBondContact O-CB 3.31Å; P8-A12 PolarHBondContact O-N 3.48Å; E9-A12 PolarHBondContact O-N 2.88Å; A12-D15 PolarHBondContact O-N 2.92Å; A12-S16 WeakPolarHBondContact O-CB 3.08Å; A12-S16 PolarHBondContact O-N 2.91Å; A12-S16 VanDerWaalsContact O-N 3.09Å; A12-S16 PolarHBondContact O-OG 3.44Å |
| 13 | E | 85.3 | Confident | 83.6 | Confident | 104 Ų | 104 | 97.2 Ų | 97.2 | 49% | 0.486 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.4 | -46.2 | 174.8 | -170.6 | 176.8 | 169.7 | 0 | 0 | 110.9 | E9 M11 D15 S16 L17 L28 | E9-E13 WeakPolarHBondContact O-CB 3.43Å; E9-E13 PolarHBondContact O-N 2.84Å; M11-E13 PolarHBondContact O-N 3.43Å; E13-D15 VanDerWaalsContact C-N 3.3Å; E13-D15 PolarHBondContact O-N 2.87Å; E13-S16 PolarHBondContact O-N 3.3Å; E13-S16 PolarHBondContact O-OG 2.93Å; E13-S16 VanDerWaalsContact O-OG 3.13Å; E13-L17 WeakPolarHBondContact O-CB 3.44Å; E13-L17 PolarHBondContact O-N 3.11Å; E13-L28 HydrophobicContact CB-CD1 4.46Å; E13-L28 HydrophobicContact CG-CD1 4.05Å |
| 14 | K | 85.3 | Confident | 85 | Confident | 81 Ų | 81 | 91.4 Ų | 91.4 | 35% | 0.352 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -58.1 | -41.4 | 176.8 | -178.1 | -172.5 | 171.7 | -170.2 | 0 | 112.5 | L10 M11 L28 I32 | L10-K14 WeakPolarHBondContact O-CB 3.28Å; L10-K14 PolarHBondContact O-N 2.96Å; M11-K14 PolarHBondContact O-N 3.4Å; K14-L28 HydrophobicContact CB-CB 4.44Å; K14-L28 HydrophobicContact CB-CD1 4.31Å; K14-I32 HydrophobicContact CB-CD1 4.47Å; K14-I32 HydrophobicContact CD-CD1 4.03Å |
| 15 | D | 85.1 | Confident | 86.1 | Confident | 133 Ų | 133 | 84.3 Ų | 84.3 | 71% | 0.711 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -76.2 | -25.8 | -177.2 | -69.9 | -19.1 | 0 | 0 | 0 | 113.1 | M11 A12 E13 | M11-D15 PolarHBondContact O-N 3.33Å; A12-D15 PolarHBondContact O-N 2.92Å; E13-D15 VanDerWaalsContact C-N 3.3Å; E13-D15 PolarHBondContact O-N 2.87Å |
| 16 | S | 90 | Very high | 86.7 | Confident | 97 Ų | 97 | 83.8 Ų | 83.8 | 68% | 0.678 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -90.5 | -14.4 | 176.1 | 58.1 | 0 | 0 | 0 | 0 | 113.6 | A12 E13 | A12-S16 WeakPolarHBondContact O-CB 3.08Å; A12-S16 PolarHBondContact O-N 2.91Å; A12-S16 VanDerWaalsContact O-N 3.09Å; A12-S16 PolarHBondContact O-OG 3.44Å; E13-S16 PolarHBondContact O-N 3.3Å; E13-S16 PolarHBondContact O-OG 2.93Å; E13-S16 VanDerWaalsContact O-OG 3.13Å |
| 17 | L | 89.5 | Confident | 87.1 | Confident | 45 Ų | 45 | 84.2 Ų | 84.2 | 24% | 0.236 | 46% | 0.462 | C | S | . | . | S | Bend | trans | -69.3 | 132.7 | -179.4 | -163.5 | 75.2 | 0 | 0 | 0 | 111.2 | E13 F21 A24 L28 | E13-L17 WeakPolarHBondContact O-CB 3.44Å; E13-L17 PolarHBondContact O-N 3.11Å; L17-F21 HydrophobicContact CD1-CB 4.47Å; L17-F21 HydrophobicContact CD1-CD2 4.36Å; L17-F21 HydrophobicContact CD2-CB 3.97Å; L17-F21 HydrophobicContact CG-CB 4.13Å; L17-F21 HydrophobicContact CG-CD2 4.45Å; L17-A24 HydrophobicContact CD2-CB 3.92Å; L17-L28 HydrophobicContact CD2-CD1 4.15Å |
| 18 | D | 88.9 | Confident | 87.2 | Confident | 90 Ų | 90 | 82.8 Ų | 82.8 | 48% | 0.481 | 45% | 0.454 | S | S | . | . | trans | -64.1 | 132.8 | 176 | 179.2 | 61.4 | 0 | 0 | 0 | 111.1 | S20 F21 | D18-S20 PolarHBondContact O-N 3.42Å; D18-S20 WeakPolarHBondContact OD2-CB 3.25Å; D18-S20 PolarHBondContact OD2-N 3.29Å; D18-S20 PolarHBondContact OD2-OG 3.24Å; D18-F21 HydrophobicContact CB-CD2 3.99Å; D18-F21 HydrophobicContact CB-CE2 4.19Å; D18-F21 PolarHBondContact O-N 3.21Å | ||
| 19 | P | 83.7 | Confident | 87.2 | Confident | 110 Ų | 110 | 81 Ų | 81 | 71% | 0.714 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.6 | -14.1 | -178.3 | -28 | 36 | 0 | 0 | 0 | 115.7 | F21 | P19-F21 PolarHBondContact O-N 3.29Š|
| 20 | S | 90.3 | Very high | 87.2 | Confident | 82 Ų | 82 | 80.2 Ų | 80.2 | 57% | 0.573 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.8 | -24.6 | 173.3 | 72.5 | 0 | 0 | 0 | 0 | 112.9 | D18 V22 | D18-S20 PolarHBondContact O-N 3.42Å; D18-S20 WeakPolarHBondContact OD2-CB 3.25Å; D18-S20 PolarHBondContact OD2-N 3.29Å; D18-S20 PolarHBondContact OD2-OG 3.24Å; S20-V22 PolarHBondContact O-N 3.41Å |
| 21 | F | 88.5 | Confident | 87.2 | Confident | 120 Ų | 120 | 82.5 Ų | 82.5 | 53% | 0.526 | 45% | 0.452 | S | S | . | . | trans | -83.2 | 59.6 | 177.3 | -63.8 | -74.6 | 0 | 0 | 0 | 111.9 | L17 D18 P19 H23 A24 S25 | L17-F21 HydrophobicContact CD1-CB 4.47Å; L17-F21 HydrophobicContact CD1-CD2 4.36Å; L17-F21 HydrophobicContact CD2-CB 3.97Å; L17-F21 HydrophobicContact CG-CB 4.13Å; L17-F21 HydrophobicContact CG-CD2 4.45Å; D18-F21 HydrophobicContact CB-CD2 3.99Å; D18-F21 HydrophobicContact CB-CE2 4.19Å; D18-F21 PolarHBondContact O-N 3.21Å; P19-F21 PolarHBondContact O-N 3.29Å; F21-H23 VanDerWaalsContact C-N 3.26Å; F21-H23 PolarHBondContact O-N 3.35Å; F21-A24 HydrophobicContact CB-CB 4.16Å; F21-A24 PolarHBondContact O-N 2.89Å; F21-S25 WeakPolarHBondContact O-CB 3.28Å; F21-S25 PolarHBondContact O-N 3.03Å | ||
| 22 | V | 87.8 | Confident | 87.3 | Confident | 96 Ų | 96 | 79 Ų | 79 | 58% | 0.582 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -53.1 | -42.3 | -177.2 | 179.7 | 0 | 0 | 0 | 0 | 112.2 | S20 R26 | S20-V22 PolarHBondContact O-N 3.41Å; V22-R26 WeakPolarHBondContact O-CB 3.49Å; V22-R26 PolarHBondContact O-N 3.05Å; V22-R26 VanDerWaalsContact O-N 3.1Å |
| 23 | H | 89 | Confident | 87.1 | Confident | 139 Ų | 139 | 82.7 Ų | 82.7 | 64% | 0.644 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -72.5 | -40.4 | -178.1 | -62.5 | -41.1 | 0 | 0 | 0 | 113 | F21 R26 L27 | F21-H23 VanDerWaalsContact C-N 3.26Å; F21-H23 PolarHBondContact O-N 3.35Å; H23-R26 PolarHBondContact O-N 3.09Å; H23-L27 WeakPolarHBondContact O-CG 3.49Å; H23-L27 PolarHBondContact O-N 3.49Å; H23-L27 VanDerWaalsContact O-N 3.08Å |
| 24 | A | 86.8 | Confident | 87 | Confident | 39 Ų | 39 | 83 Ų | 83 | 32% | 0.322 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -70.3 | -41 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | L17 F21 R26 L27 L28 | L17-A24 HydrophobicContact CD2-CB 3.92Å; F21-A24 HydrophobicContact CB-CB 4.16Å; F21-A24 PolarHBondContact O-N 2.89Å; A24-R26 VanDerWaalsContact C-N 3.3Å; A24-R26 PolarHBondContact O-N 2.63Å; A24-L27 PolarHBondContact O-N 3.31Å; A24-L28 WeakPolarHBondContact O-CG 3.29Å; A24-L28 PolarHBondContact O-N 2.66Å |
| 25 | S | 87.5 | Confident | 86.5 | Confident | 40 Ų | 40 | 82.7 Ų | 82.7 | 28% | 0.28 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -58.3 | -41.5 | 173.2 | -170.4 | 0 | 0 | 0 | 0 | 112 | F21 A29 | F21-S25 WeakPolarHBondContact O-CB 3.28Å; F21-S25 PolarHBondContact O-N 3.03Å; S25-A29 WeakPolarHBondContact O-CB 3.35Å; S25-A29 PolarHBondContact O-N 3.34Å |
| 26 | R | 88.6 | Confident | 85.9 | Confident | 130 Ų | 130 | 82.3 Ų | 82.3 | 49% | 0.491 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -62.4 | -46.2 | 175.1 | -175.2 | -179.6 | 66.5 | 90.7 | 0.7 | 112.3 | V22 H23 A24 A29 E30 | V22-R26 WeakPolarHBondContact O-CB 3.49Å; V22-R26 PolarHBondContact O-N 3.05Å; V22-R26 VanDerWaalsContact O-N 3.1Å; H23-R26 PolarHBondContact O-N 3.09Å; A24-R26 VanDerWaalsContact C-N 3.3Å; A24-R26 PolarHBondContact O-N 2.63Å; R26-A29 PolarHBondContact O-N 2.77Å; R26-E30 IonicContact CZ-OE1 2.62Å; R26-E30 IonicContact NH1-OE1 2.84Å; R26-E30 PolarHBondContact NH1-OE1 3.38Å; R26-E30 IonicContact NH1-OE2 3.62Å; R26-E30 WeakPolarHBondContact O-CG 3.42Å; R26-E30 PolarHBondContact O-N 3.39Å |
| 27 | L | 88.7 | Confident | 84.5 | Confident | 97 Ų | 97 | 79.7 Ų | 79.7 | 51% | 0.508 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.2 | -40.6 | -179.5 | -69.9 | 171 | 0 | 0 | 0 | 111.9 | H23 A24 E30 E31 | H23-L27 WeakPolarHBondContact O-CG 3.49Å; H23-L27 PolarHBondContact O-N 3.49Å; H23-L27 VanDerWaalsContact O-N 3.08Å; A24-L27 PolarHBondContact O-N 3.31Å; L27-E30 PolarHBondContact O-N 3.42Å; L27-E31 PolarHBondContact O-N 3.19Å |
| 28 | L | 86.8 | Confident | 82.7 | Confident | 21 Ų | 21 | 81.2 Ų | 81.2 | 11% | 0.11 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -62.4 | -42.7 | 174.3 | -72.8 | 172.4 | 0 | 0 | 0 | 111.6 | L10 E13 K14 L17 A24 E31 I32 | L10-L28 HydrophobicContact CD2-CD2 3.73Å; E13-L28 HydrophobicContact CB-CD1 4.46Å; E13-L28 HydrophobicContact CG-CD1 4.05Å; K14-L28 HydrophobicContact CB-CB 4.44Å; K14-L28 HydrophobicContact CB-CD1 4.31Å; L17-L28 HydrophobicContact CD2-CD1 4.15Å; A24-L28 WeakPolarHBondContact O-CG 3.29Å; A24-L28 PolarHBondContact O-N 2.66Å; L28-E31 PolarHBondContact O-N 3.1Å; L28-I32 WeakPolarHBondContact O-CD1 3.44Å; L28-I32 VanDerWaalsContact O-CG1 3.24Å; L28-I32 WeakPolarHBondContact O-CG1 3.44Å; L28-I32 PolarHBondContact O-N 3.37Å |
| 29 | A | 85.9 | Confident | 80.9 | Confident | 35 Ų | 35 | 84.5 Ų | 84.5 | 29% | 0.289 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.5 | -44 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | S25 R26 E31 I32 E33 | S25-A29 WeakPolarHBondContact O-CB 3.35Å; S25-A29 PolarHBondContact O-N 3.34Å; R26-A29 PolarHBondContact O-N 2.77Å; A29-E31 VanDerWaalsContact C-N 3.32Å; A29-E31 PolarHBondContact O-N 2.62Å; A29-I32 PolarHBondContact O-N 3.5Å; A29-E33 WeakPolarHBondContact O-CB 3.42Å; A29-E33 PolarHBondContact O-N 3.14Å |
| 30 | E | 86.3 | Confident | 79.2 | Confident | 68 Ų | 68 | 80.7 Ų | 80.7 | 32% | 0.318 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -62.3 | -38.1 | 175.8 | -76.1 | 173.5 | -167.3 | 0 | 0 | 112.2 | R26 L27 E33 K34 | R26-E30 IonicContact CZ-OE1 2.62Å; R26-E30 IonicContact NH1-OE1 2.84Å; R26-E30 PolarHBondContact NH1-OE1 3.38Å; R26-E30 IonicContact NH1-OE2 3.62Å; R26-E30 WeakPolarHBondContact O-CG 3.42Å; R26-E30 PolarHBondContact O-N 3.39Å; L27-E30 PolarHBondContact O-N 3.42Å; E30-E33 PolarHBondContact O-N 3.37Å; E30-K34 WeakPolarHBondContact O-CG 3.34Å; E30-K34 PolarHBondContact O-N 3.38Å |
| 31 | E | 85.6 | Confident | 77.1 | Confident | 58 Ų | 58 | 85.7 Ų | 85.7 | 27% | 0.271 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -70.1 | -43 | 178.5 | -161.5 | 61.6 | -163.6 | 0 | 0 | 111.6 | L10 L27 L28 A29 E33 K34 F35 | L10-E31 HydrophobicContact CD1-CG 4.16Å; L27-E31 PolarHBondContact O-N 3.19Å; L28-E31 PolarHBondContact O-N 3.1Å; A29-E31 VanDerWaalsContact C-N 3.32Å; A29-E31 PolarHBondContact O-N 2.62Å; E31-E33 VanDerWaalsContact C-N 3.31Å; E31-E33 PolarHBondContact O-N 3.31Å; E31-K34 PolarHBondContact O-N 2.75Å; E31-K34 IonicContact OE2-NZ 3.63Å; E31-K34 PolarHBondContact OE2-NZ 3.07Å; E31-F35 HydrophobicContact CG-CE2 4.45Å; E31-F35 WeakPolarHBondContact O-CD2 3.44Å; E31-F35 PolarHBondContact O-N 2.87Å; E31-F35 VanDerWaalsContact O-N 3.14Å |
| 32 | I | 85.3 | Confident | 75.2 | Confident | 13 Ų | 13 | 88.4 Ų | 88.4 | 7% | 0.067 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -59.2 | -42.9 | 173.5 | -67.6 | 163.9 | 0 | 0 | 0 | 110.8 | L7 L10 M11 K14 L28 A29 F35 Q36 | L7-I32 HydrophobicContact CD1-CG1 4.48Å; L7-I32 HydrophobicContact CD1-CG2 4.14Å; L10-I32 HydrophobicContact CB-CD1 4.2Å; L10-I32 HydrophobicContact CB-CG1 3.88Å; L10-I32 HydrophobicContact CD1-CG1 4.34Å; M11-I32 HydrophobicContact CG-CD1 4.11Å; K14-I32 HydrophobicContact CB-CD1 4.47Å; K14-I32 HydrophobicContact CD-CD1 4.03Å; L28-I32 WeakPolarHBondContact O-CD1 3.44Å; L28-I32 VanDerWaalsContact O-CG1 3.24Å; L28-I32 WeakPolarHBondContact O-CG1 3.44Å; L28-I32 PolarHBondContact O-N 3.37Å; A29-I32 PolarHBondContact O-N 3.5Å; I32-F35 PolarHBondContact O-N 3.12Å; I32-Q36 WeakPolarHBondContact O-CG 3.43Å; I32-Q36 PolarHBondContact O-N 2.96Å |
| 33 | E | 84.3 | Confident | 73.3 | Confident | 139 Ų | 139 | 88.4 Ų | 88.4 | 65% | 0.65 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -65.1 | -38.6 | 178.5 | -171.5 | 178.6 | -178.5 | 0 | 0 | 112.1 | A29 E30 E31 F35 Q36 G37 | A29-E33 WeakPolarHBondContact O-CB 3.42Å; A29-E33 PolarHBondContact O-N 3.14Å; E30-E33 PolarHBondContact O-N 3.37Å; E31-E33 VanDerWaalsContact C-N 3.31Å; E31-E33 PolarHBondContact O-N 3.31Å; E33-F35 VanDerWaalsContact C-N 3.33Å; E33-F35 PolarHBondContact O-N 2.96Å; E33-Q36 PolarHBondContact O-N 3.41Å; E33-G37 WeakPolarHBondContact O-CA 3.42Å; E33-G37 PolarHBondContact O-N 3.45Å |
| 34 | K | 83.2 | Confident | 71.4 | Confident | 110 Ų | 110 | 88.4 Ų | 88.4 | 48% | 0.478 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63.6 | -37.4 | 174 | -73.1 | 173.9 | -149.5 | 155.2 | 0 | 112.6 | E30 E31 S38 | E30-K34 WeakPolarHBondContact O-CG 3.34Å; E30-K34 PolarHBondContact O-N 3.38Å; E31-K34 PolarHBondContact O-N 2.75Å; E31-K34 IonicContact OE2-NZ 3.63Å; E31-K34 PolarHBondContact OE2-NZ 3.07Å; K34-S38 WeakPolarHBondContact O-CA 3.07Å; K34-S38 WeakPolarHBondContact O-CB 3.46Å; K34-S38 PolarHBondContact O-N 3.06Å |
| 35 | F | 75.6 | Confident | 69.6 | Low | 74 Ų | 74 | 94.4 Ų | 94.4 | 33% | 0.325 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -66.9 | -45.7 | 176.8 | -91.9 | -97.3 | 0 | 0 | 0 | 111 | Y6 L7 E31 I32 E33 S38 | Y6-F35 AromaticContact CD1-CE1 3.82Å; Y6-F35 HydrophobicContact CD1-CE1 3.82Å; Y6-F35 AromaticContact CD1-CE2 3.82Å; Y6-F35 HydrophobicContact CD1-CE2 3.82Å; Y6-F35 AromaticContact CD1-CZ 3.4Å; Y6-F35 HydrophobicContact CD1-CZ 3.4Å; Y6-F35 HydrophobicContact CE1-CD2 4.27Å; Y6-F35 HydrophobicContact CE1-CE1 4.27Å; Y6-F35 AromaticContact CE1-CE2 3.42Å; Y6-F35 HydrophobicContact CE1-CE2 3.42Å; Y6-F35 VanDerWaalsContact CE1-CE2 3.42Å; Y6-F35 AromaticContact CE1-CZ 3.41Å; Y6-F35 HydrophobicContact CE1-CZ 3.41Å; Y6-F35 VanDerWaalsContact CE1-CZ 3.41Å; L7-F35 HydrophobicContact CD1-CB 4.1Å; E31-F35 HydrophobicContact CG-CE2 4.45Å; E31-F35 WeakPolarHBondContact O-CD2 3.44Å; E31-F35 PolarHBondContact O-N 2.87Å; E31-F35 VanDerWaalsContact O-N 3.14Å; I32-F35 PolarHBondContact O-N 3.12Å; E33-F35 VanDerWaalsContact C-N 3.33Å; E33-F35 PolarHBondContact O-N 2.96Å; F35-S38 PolarHBondContact O-OG 2.5Å |
| 36 | Q | 70.9 | Confident | 67.9 | Low | 125 Ų | 125 | 100 Ų | 100 | 58% | 0.584 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -71.8 | -29.2 | 178.7 | -66.1 | 177.5 | 9.5 | 0 | 0 | 113.2 | I32 E33 | I32-Q36 WeakPolarHBondContact O-CG 3.43Å; I32-Q36 PolarHBondContact O-N 2.96Å; E33-Q36 PolarHBondContact O-N 3.41Å |
| 37 | G | 61.6 | Low | 66.3 | Low | 43 Ų | 43 | 100.7 Ų | 100.7 | 44% | 0.443 | 51% | 0.507 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99 | 8.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | E33 D39 G40 | E33-G37 WeakPolarHBondContact O-CA 3.42Å; E33-G37 PolarHBondContact O-N 3.45Å; G37-D39 PolarHBondContact O-N 3.23Å; G37-D39 VanDerWaalsContact O-N 3.12Å; G37-G40 PolarHBondContact O-N 2.95Å |
| 38 | S | 51.7 | Low | 65.1 | Low | 77 Ų | 77 | 103.6 Ų | 103.6 | 54% | 0.538 | 52% | 0.516 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.7 | -4.8 | -177.3 | 59.4 | 0 | 0 | 0 | 0 | 114.8 | K34 F35 | K34-S38 WeakPolarHBondContact O-CA 3.07Å; K34-S38 WeakPolarHBondContact O-CB 3.46Å; K34-S38 PolarHBondContact O-N 3.06Å; F35-S38 PolarHBondContact O-OG 2.5Å |
| 39 | D | 50.6 | Low | 64.3 | Low | 158 Ų | 158 | 111.7 Ų | 111.7 | 85% | 0.845 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.6 | -15.9 | 162 | -85.6 | -54.9 | 0 | 0 | 0 | 113.3 | G37 | G37-D39 PolarHBondContact O-N 3.23Å; G37-D39 VanDerWaalsContact O-N 3.12Å |
| 40 | G | 47.8 | Very low | 63.5 | Low | 31 Ų | 31 | 114.8 Ų | 114.8 | 32% | 0.32 | 56% | 0.557 | S | S | . | * | G | 310 helix | trans | -91.7 | -7.7 | -171.7 | 0 | 0 | 0 | 0 | 0 | 116.7 | G37 K42 E43 | G37-G40 PolarHBondContact O-N 2.95Å; G40-K42 PolarHBondContact O-N 2.95Å; G40-E43 PolarHBondContact O-N 2.93Å |
| 41 | K | 47.5 | Very low | 62.9 | Low | 186 Ų | 186 | 115.5 Ų | 115.5 | 81% | 0.809 | 56% | 0.563 | S | S | * | * | G | 310 helix | trans | -68.1 | -5.5 | -177.3 | -83.4 | -173.3 | 179.8 | 174.7 | 0 | 114.9 | ||
| 42 | K | 47.5 | Very low | 62.4 | Low | 178 Ų | 178 | 118.1 Ų | 118.1 | 77% | 0.774 | 58% | 0.583 | S | S | * | * | G | 310 helix | trans | -91.5 | -12.2 | 172.1 | -70 | -177.4 | -179.1 | 174.3 | 0 | 113.8 | G40 | G40-K42 PolarHBondContact O-N 2.95Š|
| 43 | E | 48.1 | Very low | 62 | Low | 96 Ų | 96 | 125 Ų | 125 | 45% | 0.449 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -78.8 | -20.8 | -171.1 | -67 | -166.3 | 166.4 | 0 | 0 | 114.8 | G40 E45 E46 K47 | G40-E43 PolarHBondContact O-N 2.93Å; E43-E45 VanDerWaalsContact C-N 3.3Å; E43-E45 PolarHBondContact O-N 3.18Å; E43-E46 PolarHBondContact O-N 2.99Å; E43-K47 WeakPolarHBondContact O-CG 3.44Å; E43-K47 PolarHBondContact O-N 3.08Å; E43-K47 VanDerWaalsContact O-N 3.14Å; E43-K47 WeakPolarHBondContact OE2-CE 3.45Å; E43-K47 IonicContact OE2-NZ 2.66Å; E43-K47 PolarHBondContact OE2-NZ 3.42Å |
| 44 | D | 49.8 | Very low | 61.4 | Low | 138 Ų | 138 | 120.6 Ų | 120.6 | 74% | 0.738 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -70.4 | -25.8 | -178.1 | -81.7 | -22.7 | 0 | 0 | 0 | 112.8 | ||
| 45 | E | 49 | Very low | 60.8 | Low | 166 Ų | 166 | 122.4 Ų | 122.4 | 78% | 0.776 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -78.1 | -37.6 | 173.6 | -91.5 | -171.9 | 153.1 | 0 | 0 | 112.5 | E43 K48 | E43-E45 VanDerWaalsContact C-N 3.3Å; E43-E45 PolarHBondContact O-N 3.18Å; E45-K48 PolarHBondContact O-N 3.01Å |
| 46 | E | 51.7 | Low | 60.9 | Low | 158 Ų | 158 | 125.8 Ų | 125.8 | 74% | 0.738 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -74.7 | -30.3 | -178.2 | -74.3 | -173.5 | 163.6 | 0 | 0 | 113.2 | E43 K48 | E43-E46 PolarHBondContact O-N 2.99Å; E46-K48 PolarHBondContact O-N 2.95Å |
| 47 | K | 55.8 | Low | 60.9 | Low | 144 Ų | 144 | 128 Ų | 128 | 63% | 0.626 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | -7.5 | 177.6 | -70.2 | 172.4 | -171.8 | 159.4 | 0 | 114.1 | E43 Y49 | E43-K47 WeakPolarHBondContact O-CG 3.44Å; E43-K47 PolarHBondContact O-N 3.08Å; E43-K47 VanDerWaalsContact O-N 3.14Å; E43-K47 WeakPolarHBondContact OE2-CE 3.45Å; E43-K47 IonicContact OE2-NZ 2.66Å; E43-K47 PolarHBondContact OE2-NZ 3.42Å; K47-Y49 VanDerWaalsContact C-N 3.34Å |
| 48 | K | 63.3 | Low | 61.7 | Low | 158 Ų | 158 | 130.6 Ų | 130.6 | 69% | 0.687 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | -25 | -177.3 | -166.5 | 176.6 | -179.7 | -176.5 | 0 | 113.1 | E45 E46 | E45-K48 PolarHBondContact O-N 3.01Å; E46-K48 PolarHBondContact O-N 2.95Å |
| 49 | Y | 69.4 | Low | 62.8 | Low | 190 Ų | 190 | 136.9 Ų | 136.9 | 75% | 0.745 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -110 | 124.9 | -178 | -60.9 | -77 | 0 | 0 | 0 | 111 | K47 | K47-Y49 VanDerWaalsContact C-N 3.34Š|
| 50 | L | 69.6 | Low | 64 | Low | 100 Ų | 100 | 136.9 Ų | 136.9 | 52% | 0.524 | 67% | 0.668 | S | S | . | * | trans | -88.7 | 126.6 | 175.2 | -177.9 | 68.3 | 0 | 0 | 0 | 110 | V52 I58 | L50-V52 PolarHBondContact O-N 3.2Å; L50-I58 HydrophobicContact CD1-CD1 3.38Å; L50-I58 HydrophobicContact CD1-CG1 3.66Å; L50-I58 HydrophobicContact CD2-CD1 3.46Å; L50-I58 VanDerWaalsContact CD2-CD1 3.46Å; L50-I58 HydrophobicContact CG-CD1 4.02Å | ||
| 51 | D | 73 | Confident | 65.3 | Low | 83 Ų | 83 | 141 Ų | 141 | 44% | 0.444 | 69% | 0.692 | S | S | . | * | trans | -79 | 104.2 | 164.3 | 176.3 | 11.8 | 0 | 0 | 0 | 109.7 | I53 S54 | D51-I53 PolarHBondContact O-N 3.33Å; D51-I53 PolarHBondContact OD1-N 3.46Å; D51-I53 VanDerWaalsContact OD1-N 3.09Å; D51-S54 WeakPolarHBondContact CB-OG 3.4Å; D51-S54 PolarHBondContact O-OG 2.97Å; D51-S54 VanDerWaalsContact OD2-CB 3.29Å; D51-S54 WeakPolarHBondContact OD2-CB 3.24Å; D51-S54 PolarHBondContact OD2-OG 2.84Å | ||
| 52 | V | 74.8 | Confident | 66.7 | Low | 113 Ų | 113 | 140.6 Ų | 140.6 | 69% | 0.685 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.3 | -19.3 | -175.1 | -173.7 | 0 | 0 | 0 | 0 | 112.2 | L50 | L50-V52 PolarHBondContact O-N 3.2Š|
| 53 | I | 77.6 | Confident | 68.3 | Low | 158 Ų | 158 | 144 Ų | 144 | 81% | 0.81 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | -32.6 | -175.9 | -58.9 | 171.4 | 0 | 0 | 0 | 111 | D51 | D51-I53 PolarHBondContact O-N 3.33Å; D51-I53 PolarHBondContact OD1-N 3.46Å; D51-I53 VanDerWaalsContact OD1-N 3.09Å |
| 54 | S | 71.5 | Confident | 69.9 | Low | 46 Ų | 46 | 144.6 Ų | 144.6 | 32% | 0.322 | 71% | 0.711 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.7 | -0.1 | -173 | 55.4 | 0 | 0 | 0 | 0 | 115.5 | D51 K56 | D51-S54 WeakPolarHBondContact CB-OG 3.4Å; D51-S54 PolarHBondContact O-OG 2.97Å; D51-S54 VanDerWaalsContact OD2-CB 3.29Å; D51-S54 WeakPolarHBondContact OD2-CB 3.24Å; D51-S54 PolarHBondContact OD2-OG 2.84Å; S54-K56 PolarHBondContact O-N 3.34Å; S54-K56 WeakPolarHBondContact OG-CE 3.32Å |
| 55 | N | 69.2 | Low | 71.3 | Confident | 148 Ų | 148 | 145.2 Ų | 145.2 | 79% | 0.791 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 44.1 | 42.3 | 174.1 | -91.7 | -32.9 | 0 | 0 | 0 | 114.2 | ||
| 56 | K | 78.6 | Confident | 72.9 | Confident | 145 Ų | 145 | 140.7 Ų | 140.7 | 63% | 0.63 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -75 | 143.3 | 178.1 | -64.7 | 176.8 | -175.5 | 173.3 | 0 | 110.6 | S54 I58 | S54-K56 PolarHBondContact O-N 3.34Å; S54-K56 WeakPolarHBondContact OG-CE 3.32Å; K56-I58 PolarHBondContact O-N 3.47Å |
| 57 | N | 71.4 | Confident | 74 | Confident | 171 Ų | 171 | 136.2 Ų | 136.2 | 91% | 0.914 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 128.1 | 175.4 | -60.9 | 80 | 0 | 0 | 0 | 111.1 | ||
| 58 | I | 78 | Confident | 75.1 | Confident | 98 Ų | 98 | 132.6 Ų | 132.6 | 50% | 0.503 | 67% | 0.668 | S | S | . | * | P | Polyproline II helix | trans | -102.9 | 135.8 | 179.5 | -49.9 | 169 | 0 | 0 | 0 | 108.7 | L50 K56 L60 | L50-I58 HydrophobicContact CD1-CD1 3.38Å; L50-I58 HydrophobicContact CD1-CG1 3.66Å; L50-I58 HydrophobicContact CD2-CD1 3.46Å; L50-I58 VanDerWaalsContact CD2-CD1 3.46Å; L50-I58 HydrophobicContact CG-CD1 4.02Å; K56-I58 PolarHBondContact O-N 3.47Å; I58-L60 HydrophobicContact CG2-CD2 3.88Å; I58-L60 HydrophobicContact CG2-CG 3.97Å |
| 59 | K | 74.9 | Confident | 75.6 | Confident | 210 Ų | 210 | 134.7 Ų | 134.7 | 91% | 0.913 | 68% | 0.677 | S | S | * | * | trans | -94.4 | 111.8 | 168.5 | -66.1 | -176.4 | -179.7 | -179.7 | 0 | 108.6 | ||||
| 60 | L | 75.4 | Confident | 75.9 | Confident | 158 Ų | 158 | 132.5 Ų | 132.5 | 83% | 0.827 | 67% | 0.674 | S | S | * | * | trans | -108.5 | 131.5 | 173.5 | -64.4 | 175.6 | 0 | 0 | 0 | 109 | I58 | I58-L60 HydrophobicContact CG2-CD2 3.88Å; I58-L60 HydrophobicContact CG2-CG 3.97Å | ||
| 61 | S | 74.7 | Confident | 76 | Confident | 118 Ų | 118 | 134.9 Ų | 134.9 | 83% | 0.825 | 68% | 0.677 | S | S | * | * | trans | -132.3 | 118.2 | 174.5 | 64.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 62 | E | 78.1 | Confident | 76 | Confident | 177 Ų | 177 | 135.1 Ų | 135.1 | 83% | 0.827 | 68% | 0.683 | S | S | * | * | trans | -107 | 133.2 | 175.8 | -172.9 | 171.8 | -178.3 | 0 | 0 | 110.2 | V64 | E62-V64 HydrophobicContact CG-CG2 4.34Š| ||
| 63 | R | 79.8 | Confident | 75.7 | Confident | 249 Ų | 249 | 139.1 Ų | 139.1 | 94% | 0.94 | 69% | 0.691 | S | S | * | * | trans | -96.8 | 109.1 | 174.8 | -66.1 | -168.5 | -177.2 | -173.6 | 2.4 | 109.3 | ||||
| 64 | V | 81.3 | Confident | 75 | Confident | 109 Ų | 109 | 135.6 Ų | 135.6 | 66% | 0.661 | 68% | 0.677 | S | S | * | * | P | Polyproline II helix | trans | -95.5 | 134.1 | 177.6 | -178.1 | 0 | 0 | 0 | 0 | 110.2 | E62 | E62-V64 HydrophobicContact CG-CG2 4.34Š|
| 65 | L | 80.5 | Confident | 74.4 | Confident | 150 Ų | 150 | 135.8 Ų | 135.8 | 79% | 0.785 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 125.3 | 179 | -174.2 | 134.2 | 0 | 0 | 0 | 111.1 | ||
| 66 | I | 82.1 | Confident | 74 | Confident | 71 Ų | 71 | 136.1 Ų | 136.1 | 36% | 0.364 | 67% | 0.67 | S | S | . | * | P | Polyproline II helix | trans | -89.2 | 124.8 | 174 | -57.4 | 177 | 0 | 0 | 0 | 108.4 | V68 L75 | I66-V68 HydrophobicContact CB-CG1 4.31Å; I66-V68 HydrophobicContact CG2-CG1 4.16Å; I66-V68 WeakPolarHBondContact O-CG1 3.21Å; I66-V68 PolarHBondContact O-N 3.41Å; I66-L75 HydrophobicContact CG2-CD2 4.35Å; I66-L75 HydrophobicContact CG2-CG 4.49Å |
| 67 | P | 75.8 | Confident | 73.2 | Confident | 64 Ų | 64 | 131.6 Ų | 131.6 | 42% | 0.416 | 66% | 0.66 | S | S | . | * | trans | -75.8 | 69.1 | -177.3 | 31.3 | -35.7 | 0 | 0 | 0 | 112 | K69 Q70 Y71 | P67-K69 PolarHBondContact O-N 3.04Å; P67-Q70 PolarHBondContact O-N 3.49Å; P67-Y71 PolarHBondContact O-N 2.99Å | ||
| 68 | V | 77.9 | Confident | 72.7 | Confident | 68 Ų | 68 | 126 Ų | 126 | 41% | 0.412 | 63% | 0.634 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -60.1 | -29.6 | -176.3 | -61.3 | 0 | 0 | 0 | 0 | 114 | I66 L75 | I66-V68 HydrophobicContact CB-CG1 4.31Å; I66-V68 HydrophobicContact CG2-CG1 4.16Å; I66-V68 WeakPolarHBondContact O-CG1 3.21Å; I66-V68 PolarHBondContact O-N 3.41Å; V68-L75 HydrophobicContact CB-CD1 3.51Å; V68-L75 HydrophobicContact CB-CD2 4.41Å; V68-L75 HydrophobicContact CB-CG 4.32Å; V68-L75 HydrophobicContact CG1-CD1 3.57Å; V68-L75 HydrophobicContact CG1-CD2 3.51Å; V68-L75 HydrophobicContact CG1-CG 3.84Å |
| 69 | K | 73.6 | Confident | 72 | Confident | 203 Ų | 203 | 124.8 Ų | 124.8 | 88% | 0.883 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | -28 | -176.2 | -63 | -175.4 | 178.6 | 179.3 | 0 | 113.1 | P67 | P67-K69 PolarHBondContact O-N 3.04Š|
| 70 | Q | 75.4 | Confident | 71.3 | Confident | 143 Ų | 143 | 121 Ų | 121 | 67% | 0.668 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.4 | -31.8 | -177.9 | -78.8 | 167 | -28.1 | 0 | 0 | 112.3 | P67 | P67-Q70 PolarHBondContact O-N 3.49Š|
| 71 | Y | 73 | Confident | 70.9 | Confident | 150 Ų | 150 | 121.5 Ų | 121.5 | 59% | 0.588 | 61% | 0.613 | S | S | * | * | trans | -136.5 | 74.2 | -175.2 | -60.4 | -72.7 | 0 | 0 | 0 | 112.8 | P67 K73 V74 | P67-Y71 PolarHBondContact O-N 2.99Å; Y71-K73 VanDerWaalsContact C-N 3.26Å; Y71-K73 PolarHBondContact O-N 3.14Å; Y71-V74 PolarHBondContact O-N 3.27Å | ||
| 72 | P | 71.6 | Confident | 70.6 | Confident | 88 Ų | 88 | 122.9 Ų | 122.9 | 57% | 0.571 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.5 | -27.1 | -176.5 | 23.8 | -33.4 | 0 | 0 | 0 | 113.8 | ||
| 73 | K | 68.8 | Low | 70.1 | Confident | 197 Ų | 197 | 121.5 Ų | 121.5 | 86% | 0.857 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | -22.2 | -179 | -62.4 | -179.4 | -178.4 | 177.3 | 0 | 113.8 | Y71 | Y71-K73 VanDerWaalsContact C-N 3.26Å; Y71-K73 PolarHBondContact O-N 3.14Å |
| 74 | V | 62.8 | Low | 69.4 | Low | 84 Ų | 84 | 113.3 Ų | 113.3 | 51% | 0.509 | 57% | 0.574 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -90.9 | -14.4 | -173.9 | -165.4 | 0 | 0 | 0 | 0 | 111.5 | Y71 H76 A77 C78 | Y71-V74 PolarHBondContact O-N 3.27Å; V74-H76 PolarHBondContact O-N 2.98Å; V74-A77 PolarHBondContact O-N 3.05Å; V74-C78 WeakPolarHBondContact O-CB 3.33Å; V74-C78 PolarHBondContact O-N 3.28Å |
| 75 | L | 60.2 | Low | 68.7 | Low | 50 Ų | 50 | 112.6 Ų | 112.6 | 26% | 0.262 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -59.4 | -43.3 | 177.9 | -106.2 | 144.4 | 0 | 0 | 0 | 114.5 | I66 V68 A77 C78 S79 | I66-L75 HydrophobicContact CG2-CD2 4.35Å; I66-L75 HydrophobicContact CG2-CG 4.49Å; V68-L75 HydrophobicContact CB-CD1 3.51Å; V68-L75 HydrophobicContact CB-CD2 4.41Å; V68-L75 HydrophobicContact CB-CG 4.32Å; V68-L75 HydrophobicContact CG1-CD1 3.57Å; V68-L75 HydrophobicContact CG1-CD2 3.51Å; V68-L75 HydrophobicContact CG1-CG 3.84Å; L75-A77 VanDerWaalsContact C-N 3.32Å; L75-A77 PolarHBondContact O-N 2.9Å; L75-C78 PolarHBondContact O-N 3.09Å; L75-S79 VanDerWaalsContact O-CB 3.25Å; L75-S79 WeakPolarHBondContact O-CB 3.42Å; L75-S79 PolarHBondContact O-N 3.25Å |
| 76 | H | 60.3 | Low | 67.8 | Low | 155 Ų | 155 | 108.5 Ų | 108.5 | 72% | 0.718 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -63.8 | -41.1 | 178.8 | -81.4 | -115.8 | 0 | 0 | 0 | 110.7 | V74 M80 | V74-H76 PolarHBondContact O-N 2.98Å; H76-M80 WeakPolarHBondContact O-CB 3.38Å; H76-M80 VanDerWaalsContact O-CG 3.27Å; H76-M80 WeakPolarHBondContact O-CG 3.4Å; H76-M80 PolarHBondContact O-N 3.02Å |
| 77 | A | 61.5 | Low | 66.7 | Low | 51 Ų | 51 | 109.1 Ų | 109.1 | 42% | 0.421 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -68.6 | -48.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | V74 L75 S79 M80 Y81 | V74-A77 PolarHBondContact O-N 3.05Å; L75-A77 VanDerWaalsContact C-N 3.32Å; L75-A77 PolarHBondContact O-N 2.9Å; A77-S79 PolarHBondContact O-N 2.95Å; A77-M80 PolarHBondContact O-N 3.13Å; A77-Y81 WeakPolarHBondContact O-CD2 3.42Å; A77-Y81 PolarHBondContact O-N 2.84Å |
| 78 | C | 61.1 | Low | 66 | Low | 54 Ų | 54 | 112 Ų | 112 | 37% | 0.365 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -66.4 | -40.1 | -176.4 | -163.1 | 0 | 0 | 0 | 0 | 112.5 | V74 L75 Y81 F82 | V74-C78 WeakPolarHBondContact O-CB 3.33Å; V74-C78 PolarHBondContact O-N 3.28Å; L75-C78 PolarHBondContact O-N 3.09Å; C78-Y81 PolarHBondContact O-N 2.89Å; C78-F82 WeakPolarHBondContact O-CB 3.4Å; C78-F82 PolarHBondContact O-N 3.01Å |
| 79 | S | 62.9 | Low | 64.9 | Low | 72 Ų | 72 | 116.6 Ų | 116.6 | 50% | 0.503 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65.1 | -39.4 | 174.8 | -176.2 | 0 | 0 | 0 | 0 | 112.1 | L75 A77 F83 | L75-S79 VanDerWaalsContact O-CB 3.25Å; L75-S79 WeakPolarHBondContact O-CB 3.42Å; L75-S79 PolarHBondContact O-N 3.25Å; A77-S79 PolarHBondContact O-N 2.95Å; S79-F83 VanDerWaalsContact O-CB 3.28Å; S79-F83 WeakPolarHBondContact O-CB 3.44Å; S79-F83 PolarHBondContact O-N 3.33Å |
| 80 | M | 61.4 | Low | 63.9 | Low | 130 Ų | 130 | 114.8 Ų | 114.8 | 64% | 0.64 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -67.7 | -42.7 | 175.6 | -74.2 | -164.9 | 78.1 | 0 | 0 | 111.7 | H76 A77 F83 V84 | H76-M80 WeakPolarHBondContact O-CB 3.38Å; H76-M80 VanDerWaalsContact O-CG 3.27Å; H76-M80 WeakPolarHBondContact O-CG 3.4Å; H76-M80 PolarHBondContact O-N 3.02Å; A77-M80 PolarHBondContact O-N 3.13Å; M80-F83 PolarHBondContact O-N 3Å; M80-V84 VanDerWaalsContact O-CB 3.28Å; M80-V84 WeakPolarHBondContact O-CB 3.49Å; M80-V84 WeakPolarHBondContact O-CG2 3.42Å; M80-V84 PolarHBondContact O-N 3.49Å |
| 81 | Y | 65.5 | Low | 62.2 | Low | 169 Ų | 169 | 119.9 Ų | 119.9 | 66% | 0.663 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -62.6 | -43.6 | 177.2 | -95.2 | -90.2 | 0 | 0 | 0 | 112.2 | A77 C78 V84 L85 | A77-Y81 WeakPolarHBondContact O-CD2 3.42Å; A77-Y81 PolarHBondContact O-N 2.84Å; C78-Y81 PolarHBondContact O-N 2.89Å; Y81-V84 PolarHBondContact O-N 3.29Å; Y81-L85 VanDerWaalsContact O-CB 3.31Å; Y81-L85 WeakPolarHBondContact O-CB 3.47Å; Y81-L85 WeakPolarHBondContact O-CD1 3.06Å; Y81-L85 VanDerWaalsContact O-CG 3.26Å; Y81-L85 WeakPolarHBondContact O-CG 3.34Å; Y81-L85 PolarHBondContact O-N 3.09Å |
| 82 | F | 69.3 | Low | 61.7 | Low | 147 Ų | 147 | 118.4 Ų | 118.4 | 65% | 0.645 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -68.1 | -39.6 | 179.1 | -141.7 | -89.4 | 0 | 0 | 0 | 112.1 | C78 S86 | C78-F82 WeakPolarHBondContact O-CB 3.4Å; C78-F82 PolarHBondContact O-N 3.01Å; F82-S86 VanDerWaalsContact O-CB 3.31Å; F82-S86 WeakPolarHBondContact O-CB 3.26Å; F82-S86 PolarHBondContact O-N 3.37Å |
| 83 | F | 66.9 | Low | 61.2 | Low | 148 Ų | 148 | 120 Ų | 120 | 65% | 0.649 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -65.8 | -44.5 | 174.7 | -173.9 | -98.6 | 0 | 0 | 0 | 111.6 | S79 M80 S86 V87 | S79-F83 VanDerWaalsContact O-CB 3.28Å; S79-F83 WeakPolarHBondContact O-CB 3.44Å; S79-F83 PolarHBondContact O-N 3.33Å; M80-F83 PolarHBondContact O-N 3Å; F83-S86 PolarHBondContact O-N 3.32Å; F83-V87 HydrophobicContact CD1-CG2 4.22Å; F83-V87 HydrophobicContact CE1-CG2 3.89Å; F83-V87 HydrophobicContact CE2-CG2 4.5Å; F83-V87 HydrophobicContact CZ-CG2 4.05Å; F83-V87 VanDerWaalsContact O-CG2 3.28Å; F83-V87 WeakPolarHBondContact O-CG2 3.38Å; F83-V87 PolarHBondContact O-N 3.28Å |
| 84 | V | 65.8 | Low | 60.7 | Low | 77 Ų | 77 | 115.7 Ų | 115.7 | 47% | 0.467 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -63.4 | -44.5 | 177.6 | 170.5 | 0 | 0 | 0 | 0 | 111.1 | M80 Y81 V87 L88 | M80-V84 VanDerWaalsContact O-CB 3.28Å; M80-V84 WeakPolarHBondContact O-CB 3.49Å; M80-V84 WeakPolarHBondContact O-CG2 3.42Å; M80-V84 PolarHBondContact O-N 3.49Å; Y81-V84 PolarHBondContact O-N 3.29Å; V84-V87 PolarHBondContact O-N 3.42Å; V84-L88 WeakPolarHBondContact O-CB 3.34Å; V84-L88 PolarHBondContact O-N 3.06Å |
| 85 | L | 67.4 | Low | 60.6 | Low | 93 Ų | 93 | 117.6 Ų | 117.6 | 49% | 0.487 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -61 | -46.8 | 174.8 | -76.7 | 164.2 | 0 | 0 | 0 | 111.2 | Y81 V87 L88 E89 | Y81-L85 VanDerWaalsContact O-CB 3.31Å; Y81-L85 WeakPolarHBondContact O-CB 3.47Å; Y81-L85 WeakPolarHBondContact O-CD1 3.06Å; Y81-L85 VanDerWaalsContact O-CG 3.26Å; Y81-L85 WeakPolarHBondContact O-CG 3.34Å; Y81-L85 PolarHBondContact O-N 3.09Å; L85-V87 VanDerWaalsContact C-N 3.26Å; L85-V87 PolarHBondContact O-N 3.29Å; L85-L88 PolarHBondContact O-N 3.29Å; L85-L88 VanDerWaalsContact O-N 3.11Å; L85-E89 WeakPolarHBondContact O-CB 3.2Å; L85-E89 PolarHBondContact O-N 2.65Å |
| 86 | S | 61.2 | Low | 60.7 | Low | 64 Ų | 64 | 121.8 Ų | 121.8 | 45% | 0.448 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -63.6 | -30.6 | 178.4 | -170.4 | 0 | 0 | 0 | 0 | 113.1 | F82 F83 Q90 | F82-S86 VanDerWaalsContact O-CB 3.31Å; F82-S86 WeakPolarHBondContact O-CB 3.26Å; F82-S86 PolarHBondContact O-N 3.37Å; F83-S86 PolarHBondContact O-N 3.32Å; S86-Q90 WeakPolarHBondContact O-CG 3.38Å |
| 87 | V | 59.2 | Low | 60.7 | Low | 84 Ų | 84 | 119.6 Ų | 119.6 | 51% | 0.509 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -77.1 | -34.4 | 174.3 | 171.6 | 0 | 0 | 0 | 0 | 111.4 | F83 V84 L85 | F83-V87 HydrophobicContact CD1-CG2 4.22Å; F83-V87 HydrophobicContact CE1-CG2 3.89Å; F83-V87 HydrophobicContact CE2-CG2 4.5Å; F83-V87 HydrophobicContact CZ-CG2 4.05Å; F83-V87 VanDerWaalsContact O-CG2 3.28Å; F83-V87 WeakPolarHBondContact O-CG2 3.38Å; F83-V87 PolarHBondContact O-N 3.28Å; V84-V87 PolarHBondContact O-N 3.42Å; L85-V87 VanDerWaalsContact C-N 3.26Å; L85-V87 PolarHBondContact O-N 3.29Å |
| 88 | L | 59.4 | Low | 60.6 | Low | 126 Ų | 126 | 124.5 Ų | 124.5 | 66% | 0.66 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -71.6 | -34.3 | 178.5 | -138.5 | 84 | 0 | 0 | 0 | 112.5 | V84 L85 Q90 | V84-L88 WeakPolarHBondContact O-CB 3.34Å; V84-L88 PolarHBondContact O-N 3.06Å; L85-L88 PolarHBondContact O-N 3.29Å; L85-L88 VanDerWaalsContact O-N 3.11Å; L88-Q90 VanDerWaalsContact C-N 3.25Å; L88-Q90 PolarHBondContact O-N 3.31Å |
| 89 | E | 55.8 | Low | 60.6 | Low | 164 Ų | 164 | 129.9 Ų | 129.9 | 77% | 0.766 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.6 | -8.9 | -178.9 | -146.5 | 156.9 | 135.3 | 0 | 0 | 113.1 | L85 | L85-E89 WeakPolarHBondContact O-CB 3.2Å; L85-E89 PolarHBondContact O-N 2.65Å |
| 90 | Q | 51.6 | Low | 60.4 | Low | 165 Ų | 165 | 134.8 Ų | 134.8 | 77% | 0.771 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.6 | 16.2 | 177.3 | -65.7 | -76.2 | -16 | 0 | 0 | 113 | S86 L88 | S86-Q90 WeakPolarHBondContact O-CG 3.38Å; L88-Q90 VanDerWaalsContact C-N 3.25Å; L88-Q90 PolarHBondContact O-N 3.31Å |
| 91 | K | 41.3 | Very low | 60.3 | Low | 250 Ų | 250 | 135.2 Ų | 135.2 | 100% | 1.087 | 65% | 0.65 | S | S | * | * | trans | -125.7 | 0 | 178.2 | -170.2 | 177.2 | -175.6 | 178.6 | 0 | 111.7 |
Retrieved 91 of 91 residues in 204.7 ms
(Link to these results)