| 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 | 70.9 | Confident | 84.5 | Confident | 200 Ų | 200 | 121.1 Ų | 121.1 | 99% | 0.985 | 59% | 0.592 | S | S | * | * | 0 | -36.2 | 0 | -59.3 | -163.6 | 78.6 | 0 | 0 | 113.2 | V4 L5 | M1-V4 PolarHBondContact O-N 3.29Å; M1-L5 PolarHBondContact O-N 3.26Å | |||
| 2 | W | 81.4 | Confident | 84.8 | Confident | 178 Ų | 178 | 122.8 Ų | 122.8 | 67% | 0.674 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -59.5 | -41.9 | 176.2 | -171.5 | -112.4 | 0 | 0 | 0 | 115.9 | V4 L5 W6 | W2-V4 VanDerWaalsContact C-N 3.26Å; W2-V4 PolarHBondContact O-N 3.34Å; W2-L5 HydrophobicContact CE3-CD1 4.34Å; W2-L5 PolarHBondContact O-N 3.18Å; W2-W6 AromaticContact CD1-CD1 3.76Å; W2-W6 AromaticContact CD1-NE1 3.87Å; W2-W6 AromaticContact CD2-NE1 3.86Å; W2-W6 AromaticContact CE2-CD1 3.68Å; W2-W6 AromaticContact CE2-NE1 3.07Å; W2-W6 HydrophobicContact CZ2-CZ2 4.28Å; W2-W6 AromaticContact CZ2-NE1 3.22Å; W2-W6 AromaticContact NE1-CD1 3.47Å; W2-W6 AromaticContact NE1-NE1 3.09Å; W2-W6 PolarHBondContact O-N 3.34Å |
| 3 | P | 85.3 | Confident | 85 | Confident | 97 Ų | 97 | 116.3 Ų | 116.3 | 63% | 0.63 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -65.1 | -30 | 178.6 | -22.9 | 35.4 | 0 | 0 | 0 | 113.5 | W6 M7 | P3-W6 PolarHBondContact O-N 3.04Å; P3-M7 WeakPolarHBondContact O-CB 3.42Å; P3-M7 PolarHBondContact O-N 2.89Å |
| 4 | V | 86.1 | Confident | 85.3 | Confident | 104 Ų | 104 | 113.4 Ų | 113.4 | 63% | 0.63 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -69.2 | -38.3 | 179.1 | -179.5 | 0 | 0 | 0 | 0 | 110.8 | M1 W2 M7 S8 | M1-V4 PolarHBondContact O-N 3.29Å; W2-V4 VanDerWaalsContact C-N 3.26Å; W2-V4 PolarHBondContact O-N 3.34Å; V4-M7 PolarHBondContact O-N 3.07Å; V4-S8 WeakPolarHBondContact O-CB 3.5Å; V4-S8 PolarHBondContact O-N 2.75Å; V4-S8 PolarHBondContact O-OG 3.12Å |
| 5 | L | 85.7 | Confident | 85.7 | Confident | 104 Ų | 104 | 117.5 Ų | 117.5 | 55% | 0.545 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66 | -41.4 | 174.9 | -69.1 | 171.1 | 0 | 0 | 0 | 112.1 | M1 W2 M7 S8 M9 | M1-L5 PolarHBondContact O-N 3.26Å; W2-L5 HydrophobicContact CE3-CD1 4.34Å; W2-L5 PolarHBondContact O-N 3.18Å; L5-M7 VanDerWaalsContact C-N 3.34Å; L5-S8 PolarHBondContact O-OG 3.33Å; L5-M9 VanDerWaalsContact O-CB 3.26Å; L5-M9 WeakPolarHBondContact O-CB 3.39Å; L5-M9 PolarHBondContact O-N 2.94Å |
| 6 | W | 86.9 | Confident | 86 | Confident | 108 Ų | 108 | 117.1 Ų | 117.1 | 41% | 0.409 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -67.4 | -36.1 | 176.2 | -82.5 | 102.6 | 0 | 0 | 0 | 113 | W2 P3 M9 R10 | W2-W6 AromaticContact CD1-CD1 3.76Å; W2-W6 AromaticContact CD1-NE1 3.87Å; W2-W6 AromaticContact CD2-NE1 3.86Å; W2-W6 AromaticContact CE2-CD1 3.68Å; W2-W6 AromaticContact CE2-NE1 3.07Å; W2-W6 HydrophobicContact CZ2-CZ2 4.28Å; W2-W6 AromaticContact CZ2-NE1 3.22Å; W2-W6 AromaticContact NE1-CD1 3.47Å; W2-W6 AromaticContact NE1-NE1 3.09Å; W2-W6 PolarHBondContact O-N 3.34Å; P3-W6 PolarHBondContact O-N 3.04Å; W6-M9 HydrophobicContact CD2-CE 4.38Å; W6-M9 HydrophobicContact CE3-CE 3.48Å; W6-M9 VanDerWaalsContact CE3-CE 3.48Å; W6-M9 HydrophobicContact CH2-CE 3.96Å; W6-M9 HydrophobicContact CZ3-CE 3.24Å; W6-R10 PolarHBondContact O-N 3.39Å |
| 7 | M | 87.1 | Confident | 86.4 | Confident | 137 Ų | 137 | 115.1 Ų | 115.1 | 68% | 0.675 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -69.1 | -48.7 | 176.2 | -170.1 | 169.4 | -178.9 | 0 | 0 | 110.7 | P3 V4 L5 M9 R10 T11 | P3-M7 WeakPolarHBondContact O-CB 3.42Å; P3-M7 PolarHBondContact O-N 2.89Å; V4-M7 PolarHBondContact O-N 3.07Å; L5-M7 VanDerWaalsContact C-N 3.34Å; M7-M9 PolarHBondContact O-N 3.24Å; M7-R10 PolarHBondContact O-N 3.45Å; M7-T11 PolarHBondContact O-N 3.41Å; M7-T11 PolarHBondContact O-OG1 2.98Å |
| 8 | S | 85.6 | Confident | 86.7 | Confident | 45 Ų | 45 | 116.8 Ų | 116.8 | 32% | 0.315 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -61.7 | -43.5 | 178.2 | 66.5 | 0 | 0 | 0 | 0 | 111.8 | V4 L5 R10 T11 Y12 | V4-S8 WeakPolarHBondContact O-CB 3.5Å; V4-S8 PolarHBondContact O-N 2.75Å; V4-S8 PolarHBondContact O-OG 3.12Å; L5-S8 PolarHBondContact O-OG 3.33Å; S8-R10 VanDerWaalsContact C-N 3.32Å; S8-R10 PolarHBondContact O-N 3.27Å; S8-T11 PolarHBondContact O-N 2.9Å; S8-Y12 WeakPolarHBondContact O-CB 3.5Å; S8-Y12 WeakPolarHBondContact O-CD2 3.34Å; S8-Y12 PolarHBondContact O-N 3.41Å |
| 9 | M | 86.8 | Confident | 87.2 | Confident | 105 Ų | 105 | 114 Ų | 114 | 52% | 0.517 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -60.4 | -41 | 178.1 | -170.2 | 173.2 | 71.6 | 0 | 0 | 111.9 | L5 W6 M7 A13 | L5-M9 VanDerWaalsContact O-CB 3.26Å; L5-M9 WeakPolarHBondContact O-CB 3.39Å; L5-M9 PolarHBondContact O-N 2.94Å; W6-M9 HydrophobicContact CD2-CE 4.38Å; W6-M9 HydrophobicContact CE3-CE 3.48Å; W6-M9 VanDerWaalsContact CE3-CE 3.48Å; W6-M9 HydrophobicContact CH2-CE 3.96Å; W6-M9 HydrophobicContact CZ3-CE 3.24Å; M7-M9 PolarHBondContact O-N 3.24Å; M9-A13 WeakPolarHBondContact O-CA 3.37Å; M9-A13 WeakPolarHBondContact O-CB 3.43Å; M9-A13 PolarHBondContact O-N 3.47Å |
| 10 | R | 86 | Confident | 87.6 | Confident | 180 Ų | 180 | 112.6 Ų | 112.6 | 68% | 0.679 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -68.7 | -40.7 | 175.3 | -81.2 | -174.7 | 164.2 | 103.3 | -2.2 | 112.9 | W6 M7 S8 P14 | W6-R10 PolarHBondContact O-N 3.39Å; M7-R10 PolarHBondContact O-N 3.45Å; S8-R10 VanDerWaalsContact C-N 3.32Å; S8-R10 PolarHBondContact O-N 3.27Å; R10-P14 WeakPolarHBondContact O-CD 3.36Å |
| 11 | T | 87.4 | Confident | 88 | Confident | 74 Ų | 74 | 110.2 Ų | 110.2 | 45% | 0.454 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -66.9 | -39.1 | 179.8 | -56.6 | 0 | 0 | 0 | 0 | 111.7 | M7 S8 Y15 | M7-T11 PolarHBondContact O-N 3.41Å; M7-T11 PolarHBondContact O-OG1 2.98Å; S8-T11 PolarHBondContact O-N 2.9Å; T11-Y15 WeakPolarHBondContact O-CE2 3.28Å |
| 12 | Y | 88.2 | Confident | 89.1 | Confident | 142 Ų | 142 | 107.3 Ų | 107.3 | 56% | 0.557 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -92.9 | -11.6 | -178.3 | -65.8 | -66.7 | 0 | 0 | 0 | 114.2 | S8 Y15 I16 | S8-Y12 WeakPolarHBondContact O-CB 3.5Å; S8-Y12 WeakPolarHBondContact O-CD2 3.34Å; S8-Y12 PolarHBondContact O-N 3.41Å; Y12-Y15 HydrophobicContact CD1-CD2 4.33Å; Y12-Y15 PolarHBondContact O-N 3.03Å; Y12-Y15 VanDerWaalsContact O-N 3.1Å; Y12-I16 PolarHBondContact O-N 3.05Å |
| 13 | A | 87.4 | Confident | 89.9 | Confident | 38 Ų | 38 | 103 Ų | 103 | 31% | 0.314 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -49.6 | -51.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | M9 Y15 I16 T17 | M9-A13 WeakPolarHBondContact O-CA 3.37Å; M9-A13 WeakPolarHBondContact O-CB 3.43Å; M9-A13 PolarHBondContact O-N 3.47Å; A13-Y15 PolarHBondContact O-N 3.19Å; A13-I16 PolarHBondContact O-N 3.35Å; A13-T17 WeakPolarHBondContact O-CB 3.44Å; A13-T17 WeakPolarHBondContact O-CG2 3.42Å; A13-T17 PolarHBondContact O-N 3.34Å; A13-T17 PolarHBondContact O-OG1 3.31Å |
| 14 | P | 89.2 | Confident | 90.4 | Very high | 76 Ų | 76 | 103 Ų | 103 | 49% | 0.494 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -60.6 | -34.1 | -177.2 | -23.4 | 34.8 | 0 | 0 | 0 | 113.3 | R10 I16 F18 | R10-P14 WeakPolarHBondContact O-CD 3.36Å; P14-I16 VanDerWaalsContact C-N 3.26Å; P14-I16 PolarHBondContact O-N 2.63Å; P14-F18 WeakPolarHBondContact O-CB 3.49Å; P14-F18 PolarHBondContact O-N 3.36Å; P14-F18 VanDerWaalsContact O-N 3.14Å |
| 15 | Y | 90.9 | Very high | 90.7 | Very high | 174 Ų | 174 | 100.1 Ų | 100.1 | 68% | 0.682 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -73.6 | -18.5 | -179.1 | -61.6 | -82.8 | 0 | 0 | 0 | 113.2 | T11 Y12 A13 P19 | T11-Y15 WeakPolarHBondContact O-CE2 3.28Å; Y12-Y15 HydrophobicContact CD1-CD2 4.33Å; Y12-Y15 PolarHBondContact O-N 3.03Å; Y12-Y15 VanDerWaalsContact O-N 3.1Å; A13-Y15 PolarHBondContact O-N 3.19Å; Y15-P19 WeakPolarHBondContact O-CD 3.35Å; Y15-P19 WeakPolarHBondContact O-CG 3.4Å |
| 16 | I | 90.8 | Very high | 91.1 | Very high | 111 Ų | 111 | 96.9 Ų | 96.9 | 57% | 0.569 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -101.9 | -45.1 | 178.5 | -62.6 | 166 | 0 | 0 | 0 | 109.9 | Y12 A13 P14 F18 P19 V20 | Y12-I16 PolarHBondContact O-N 3.05Å; A13-I16 PolarHBondContact O-N 3.35Å; P14-I16 VanDerWaalsContact C-N 3.26Å; P14-I16 PolarHBondContact O-N 2.63Å; I16-F18 PolarHBondContact O-N 3.12Å; I16-P19 WeakPolarHBondContact O-CD 3.42Å; I16-V20 HydrophobicContact CG2-CG2 4.48Å; I16-V20 WeakPolarHBondContact O-CB 3.43Å; I16-V20 WeakPolarHBondContact O-CG2 3.41Å; I16-V20 PolarHBondContact O-N 3.35Å |
| 17 | T | 92.8 | Very high | 91.5 | Very high | 83 Ų | 83 | 96 Ų | 96 | 51% | 0.509 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -68.1 | -37.5 | -176.7 | 58.4 | 0 | 0 | 0 | 0 | 111.9 | A13 A21 | A13-T17 WeakPolarHBondContact O-CB 3.44Å; A13-T17 WeakPolarHBondContact O-CG2 3.42Å; A13-T17 PolarHBondContact O-N 3.34Å; A13-T17 PolarHBondContact O-OG1 3.31Å; T17-A21 WeakPolarHBondContact O-CB 3.19Å; T17-A21 PolarHBondContact O-N 3.29Å |
| 18 | F | 92.5 | Very high | 91.6 | Very high | 146 Ų | 146 | 91 Ų | 91 | 64% | 0.64 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -66.5 | -51 | -179.3 | 177 | -96.1 | 0 | 0 | 0 | 112.7 | P14 I16 V20 A21 F22 | P14-F18 WeakPolarHBondContact O-CB 3.49Å; P14-F18 PolarHBondContact O-N 3.36Å; P14-F18 VanDerWaalsContact O-N 3.14Å; I16-F18 PolarHBondContact O-N 3.12Å; F18-V20 VanDerWaalsContact C-N 3.32Å; F18-V20 PolarHBondContact O-N 3.08Å; F18-A21 PolarHBondContact O-N 3.3Å; F18-F22 WeakPolarHBondContact O-CB 3.45Å; F18-F22 PolarHBondContact O-N 2.86Å |
| 19 | P | 94.9 | Very high | 91.6 | Very high | 64 Ų | 64 | 96.2 Ų | 96.2 | 42% | 0.416 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.4 | -39.9 | 175.1 | -26.2 | 36.4 | 0 | 0 | 0 | 113.1 | Y15 I16 F22 V23 | Y15-P19 WeakPolarHBondContact O-CD 3.35Å; Y15-P19 WeakPolarHBondContact O-CG 3.4Å; I16-P19 WeakPolarHBondContact O-CD 3.42Å; P19-F22 PolarHBondContact O-N 3.17Å; P19-V23 WeakPolarHBondContact O-CG2 3.46Å; P19-V23 PolarHBondContact O-N 3.47Å |
| 20 | V | 95.8 | Very high | 91.6 | Very high | 85 Ų | 85 | 97 Ų | 97 | 52% | 0.515 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.4 | -47.7 | 177.2 | 171.6 | 0 | 0 | 0 | 0 | 110.7 | I16 F18 F22 V23 V24 | I16-V20 HydrophobicContact CG2-CG2 4.48Å; I16-V20 WeakPolarHBondContact O-CB 3.43Å; I16-V20 WeakPolarHBondContact O-CG2 3.41Å; I16-V20 PolarHBondContact O-N 3.35Å; F18-V20 VanDerWaalsContact C-N 3.32Å; F18-V20 PolarHBondContact O-N 3.08Å; V20-F22 VanDerWaalsContact C-N 3.3Å; V20-F22 PolarHBondContact O-N 3.16Å; V20-V23 PolarHBondContact O-N 3.07Å; V20-V24 HydrophobicContact CG1-CG2 4.41Å; V20-V24 WeakPolarHBondContact O-CB 3.44Å; V20-V24 VanDerWaalsContact O-CG2 3.28Å; V20-V24 WeakPolarHBondContact O-CG2 3.44Å; V20-V24 PolarHBondContact O-N 3.03Å |
| 21 | A | 95.2 | Very high | 91.6 | Very high | 63 Ų | 63 | 93.3 Ų | 93.3 | 52% | 0.521 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.9 | -39 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | T17 F18 V24 G25 | T17-A21 WeakPolarHBondContact O-CB 3.19Å; T17-A21 PolarHBondContact O-N 3.29Å; F18-A21 PolarHBondContact O-N 3.3Å; A21-V24 PolarHBondContact O-N 2.83Å; A21-G25 PolarHBondContact O-N 3.4Å |
| 22 | F | 95.9 | Very high | 91.3 | Very high | 140 Ų | 140 | 94.3 Ų | 94.3 | 61% | 0.614 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.5 | -46.8 | 176 | -179.3 | -97.5 | 0 | 0 | 0 | 111.9 | F18 P19 V20 G25 A26 | F18-F22 WeakPolarHBondContact O-CB 3.45Å; F18-F22 PolarHBondContact O-N 2.86Å; P19-F22 PolarHBondContact O-N 3.17Å; V20-F22 VanDerWaalsContact C-N 3.3Å; V20-F22 PolarHBondContact O-N 3.16Å; F22-G25 PolarHBondContact O-N 3.3Å; F22-A26 WeakPolarHBondContact O-CB 3.48Å; F22-A26 PolarHBondContact O-N 3.07Å |
| 23 | V | 96.5 | Very high | 90.6 | Very high | 87 Ų | 87 | 96.1 Ų | 96.1 | 53% | 0.527 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.8 | -45.5 | 177.6 | 172.3 | 0 | 0 | 0 | 0 | 111 | P19 V20 G25 A26 V27 | P19-V23 WeakPolarHBondContact O-CG2 3.46Å; P19-V23 PolarHBondContact O-N 3.47Å; V20-V23 PolarHBondContact O-N 3.07Å; V23-G25 VanDerWaalsContact C-N 3.31Å; V23-G25 PolarHBondContact O-N 3.06Å; V23-A26 PolarHBondContact O-N 3.18Å; V23-V27 HydrophobicContact CG1-CG2 4.37Å; V23-V27 WeakPolarHBondContact O-CB 3.5Å; V23-V27 VanDerWaalsContact O-CG2 3.31Å; V23-V27 WeakPolarHBondContact O-CG2 3.49Å; V23-V27 PolarHBondContact O-N 3.37Å |
| 24 | V | 96.1 | Very high | 90.2 | Very high | 96 Ų | 96 | 102.5 Ų | 102.5 | 58% | 0.582 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -61.3 | -41.9 | 176.6 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | V20 A21 G28 | V20-V24 HydrophobicContact CG1-CG2 4.41Å; V20-V24 WeakPolarHBondContact O-CB 3.44Å; V20-V24 VanDerWaalsContact O-CG2 3.28Å; V20-V24 WeakPolarHBondContact O-CG2 3.44Å; V20-V24 PolarHBondContact O-N 3.03Å; A21-V24 PolarHBondContact O-N 2.83Å; V24-G28 WeakPolarHBondContact O-CA 3.19Å; V24-G28 PolarHBondContact O-N 2.97Å |
| 25 | G | 93.9 | Very high | 89.7 | Confident | 44 Ų | 44 | 105 Ų | 105 | 45% | 0.454 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.7 | -43.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | A21 F22 V23 G28 Y29 | A21-G25 PolarHBondContact O-N 3.4Å; F22-G25 PolarHBondContact O-N 3.3Å; V23-G25 VanDerWaalsContact C-N 3.31Å; V23-G25 PolarHBondContact O-N 3.06Å; G25-G28 PolarHBondContact O-N 2.97Å; G25-Y29 VanDerWaalsContact O-CB 3.3Å; G25-Y29 WeakPolarHBondContact O-CB 3.49Å; G25-Y29 PolarHBondContact O-N 3.49Å |
| 26 | A | 93.8 | Very high | 88.6 | Confident | 37 Ų | 37 | 102.8 Ų | 102.8 | 31% | 0.306 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64 | -47.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | F22 V23 G28 Y29 H30 | F22-A26 WeakPolarHBondContact O-CB 3.48Å; F22-A26 PolarHBondContact O-N 3.07Å; V23-A26 PolarHBondContact O-N 3.18Å; A26-G28 VanDerWaalsContact C-N 3.34Å; A26-Y29 PolarHBondContact O-N 3.04Å; A26-H30 PolarHBondContact O-CD2 2.86Å; A26-H30 PolarHBondContact O-N 3.3Å |
| 27 | V | 94.1 | Very high | 87.4 | Confident | 88 Ų | 88 | 99.4 Ų | 99.4 | 53% | 0.533 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.3 | -43.2 | 176.3 | 174.2 | 0 | 0 | 0 | 0 | 110.7 | V23 Y29 H30 L31 | V23-V27 HydrophobicContact CG1-CG2 4.37Å; V23-V27 WeakPolarHBondContact O-CB 3.5Å; V23-V27 VanDerWaalsContact O-CG2 3.31Å; V23-V27 WeakPolarHBondContact O-CG2 3.49Å; V23-V27 PolarHBondContact O-N 3.37Å; V27-Y29 PolarHBondContact O-N 2.93Å; V27-H30 PolarHBondContact O-N 3.24Å; V27-L31 VanDerWaalsContact O-CB 3.3Å; V27-L31 WeakPolarHBondContact O-CB 3.18Å; V27-L31 PolarHBondContact O-N 3.39Å |
| 28 | G | 90.1 | Very high | 85.7 | Confident | 32 Ų | 32 | 103.9 Ų | 103.9 | 33% | 0.33 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -59.5 | -44.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | V24 G25 A26 L31 E32 | V24-G28 WeakPolarHBondContact O-CA 3.19Å; V24-G28 PolarHBondContact O-N 2.97Å; G25-G28 PolarHBondContact O-N 2.97Å; A26-G28 VanDerWaalsContact C-N 3.34Å; G28-L31 PolarHBondContact O-N 3.05Å; G28-E32 WeakPolarHBondContact O-CB 3.36Å; G28-E32 PolarHBondContact O-N 3.41Å |
| 29 | Y | 85.8 | Confident | 84 | Confident | 155 Ų | 155 | 103.1 Ų | 103.1 | 61% | 0.608 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -61.9 | -43.4 | 176 | 177.9 | -101.2 | 0 | 0 | 0 | 112.2 | G25 A26 V27 W33 | G25-Y29 VanDerWaalsContact O-CB 3.3Å; G25-Y29 WeakPolarHBondContact O-CB 3.49Å; G25-Y29 PolarHBondContact O-N 3.49Å; A26-Y29 PolarHBondContact O-N 3.04Å; V27-Y29 PolarHBondContact O-N 2.93Å; Y29-W33 WeakPolarHBondContact O-CB 3.48Å; Y29-W33 PolarHBondContact O-N 3.26Å |
| 30 | H | 86.2 | Confident | 82.1 | Confident | 122 Ų | 122 | 103.6 Ų | 103.6 | 57% | 0.565 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -68 | -38.3 | 176.4 | -76.5 | -65.5 | 0 | 0 | 0 | 112.8 | A26 V27 W33 F34 | A26-H30 PolarHBondContact O-CD2 2.86Å; A26-H30 PolarHBondContact O-N 3.3Å; V27-H30 PolarHBondContact O-N 3.24Å; H30-W33 PolarHBondContact O-N 2.65Å; H30-F34 WeakPolarHBondContact O-CB 3.3Å; H30-F34 PolarHBondContact O-N 3.37Å |
| 31 | L | 86.5 | Confident | 80.1 | Confident | 102 Ų | 102 | 105 Ų | 105 | 53% | 0.534 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -71 | -39.5 | 177.2 | -170 | 123.1 | 0 | 0 | 0 | 111.5 | V27 G28 W33 F34 I35 | V27-L31 VanDerWaalsContact O-CB 3.3Å; V27-L31 WeakPolarHBondContact O-CB 3.18Å; V27-L31 PolarHBondContact O-N 3.39Å; G28-L31 PolarHBondContact O-N 3.05Å; L31-W33 VanDerWaalsContact C-N 3.32Å; L31-F34 PolarHBondContact O-N 2.88Å; L31-I35 HydrophobicContact CD2-CD1 3.49Å; L31-I35 VanDerWaalsContact CD2-CD1 3.49Å; L31-I35 HydrophobicContact CG-CD1 4.02Å; L31-I35 WeakPolarHBondContact O-CB 3.35Å; L31-I35 VanDerWaalsContact O-CG1 3.31Å; L31-I35 WeakPolarHBondContact O-CG1 3.02Å; L31-I35 PolarHBondContact O-N 2.98Å |
| 32 | E | 79.7 | Confident | 78.4 | Confident | 95 Ų | 95 | 108.1 Ų | 108.1 | 44% | 0.444 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -59.7 | -44.4 | 171 | -178.9 | 179.3 | 176.4 | 0 | 0 | 110.4 | G28 F34 I35 R36 | G28-E32 WeakPolarHBondContact O-CB 3.36Å; G28-E32 PolarHBondContact O-N 3.41Å; E32-F34 VanDerWaalsContact C-N 3.34Å; E32-F34 PolarHBondContact O-N 3.04Å; E32-I35 PolarHBondContact O-N 3.21Å; E32-R36 WeakPolarHBondContact O-CB 3.13Å; E32-R36 PolarHBondContact O-N 3.2Å; E32-R36 IonicContact OE1-CZ 2.65Å; E32-R36 IonicContact OE1-NE 2.75Å; E32-R36 IonicContact OE1-NH2 3.96Å; E32-R36 PolarHBondContact OE1-NH2 2.86Å |
| 33 | W | 74.1 | Confident | 76.4 | Confident | 181 Ų | 181 | 108.3 Ų | 108.3 | 69% | 0.686 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -61.9 | -41.5 | 175.1 | -171.5 | 78.2 | 0 | 0 | 0 | 112.2 | Y29 H30 L31 G37 | Y29-W33 WeakPolarHBondContact O-CB 3.48Å; Y29-W33 PolarHBondContact O-N 3.26Å; H30-W33 PolarHBondContact O-N 2.65Å; L31-W33 VanDerWaalsContact C-N 3.32Å; W33-G37 PolarHBondContact O-N 2.95Å |
| 34 | F | 78.7 | Confident | 74.5 | Confident | 172 Ų | 172 | 107.8 Ų | 107.8 | 75% | 0.754 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -66.6 | -40.6 | 177.5 | -173.6 | -99.6 | 0 | 0 | 0 | 113 | H30 L31 E32 | H30-F34 WeakPolarHBondContact O-CB 3.3Å; H30-F34 PolarHBondContact O-N 3.37Å; L31-F34 PolarHBondContact O-N 2.88Å; E32-F34 VanDerWaalsContact C-N 3.34Å; E32-F34 PolarHBondContact O-N 3.04Å |
| 35 | I | 79.5 | Confident | 72.7 | Confident | 127 Ų | 127 | 107.6 Ų | 107.6 | 65% | 0.651 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -75.7 | -37.7 | 179 | -67.1 | 170.9 | 0 | 0 | 0 | 111.3 | L31 E32 G37 | L31-I35 HydrophobicContact CD2-CD1 3.49Å; L31-I35 VanDerWaalsContact CD2-CD1 3.49Å; L31-I35 HydrophobicContact CG-CD1 4.02Å; L31-I35 WeakPolarHBondContact O-CB 3.35Å; L31-I35 VanDerWaalsContact O-CG1 3.31Å; L31-I35 WeakPolarHBondContact O-CG1 3.02Å; L31-I35 PolarHBondContact O-N 2.98Å; E32-I35 PolarHBondContact O-N 3.21Å; I35-G37 VanDerWaalsContact C-N 3.26Å; I35-G37 PolarHBondContact O-N 3.43Å |
| 36 | R | 68.4 | Low | 71.4 | Confident | 128 Ų | 128 | 112.9 Ų | 112.9 | 48% | 0.483 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -63.9 | -32.9 | -177.4 | -172.5 | 176.4 | -68.2 | -102.3 | 1.7 | 111.6 | E32 T39 T40 | E32-R36 WeakPolarHBondContact O-CB 3.13Å; E32-R36 PolarHBondContact O-N 3.2Å; E32-R36 IonicContact OE1-CZ 2.65Å; E32-R36 IonicContact OE1-NE 2.75Å; E32-R36 IonicContact OE1-NH2 3.96Å; E32-R36 PolarHBondContact OE1-NH2 2.86Å; R36-T39 PolarHBondContact O-OG1 2.71Å; R36-T40 WeakPolarHBondContact CD-OG1 3.2Å; R36-T40 WeakPolarHBondContact CG-OG1 3.45Å |
| 37 | G | 64.3 | Low | 70.5 | Confident | 40 Ų | 40 | 116.4 Ų | 116.4 | 41% | 0.412 | 61% | 0.605 | S | S | . | * | G | 310 helix | trans | 54.4 | 178.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | W33 I35 T39 | W33-G37 PolarHBondContact O-N 2.95Å; I35-G37 VanDerWaalsContact C-N 3.26Å; I35-G37 PolarHBondContact O-N 3.43Å; G37-T39 PolarHBondContact O-N 2.79Å |
| 38 | D | 58.9 | Low | 69.9 | Low | 178 Ų | 178 | 114.7 Ų | 114.7 | 95% | 0.952 | 60% | 0.597 | S | S | * | * | G | 310 helix | trans | -60.5 | 7.9 | -177.5 | -72.4 | -34.4 | 0 | 0 | 0 | 115.6 | ||
| 39 | T | 55.2 | Low | 69.6 | Low | 129 Ų | 129 | 118.8 Ų | 118.8 | 79% | 0.791 | 61% | 0.611 | S | S | * | * | G | 310 helix | trans | -84.9 | -13.6 | -172.8 | 59.5 | 0 | 0 | 0 | 0 | 114.9 | R36 G37 | R36-T39 PolarHBondContact O-OG1 2.71Å; G37-T39 PolarHBondContact O-N 2.79Å |
| 40 | T | 55.3 | Low | 69.7 | Low | 75 Ų | 75 | 115.3 Ų | 115.3 | 46% | 0.46 | 61% | 0.605 | S | S | . | * | S | Bend | trans | -119 | 113.9 | 169.2 | 16.2 | 0 | 0 | 0 | 0 | 108.4 | R36 K42 | R36-T40 WeakPolarHBondContact CD-OG1 3.2Å; R36-T40 WeakPolarHBondContact CG-OG1 3.45Å; T40-K42 PolarHBondContact O-N 2.75Å |
| 41 | L | 54.5 | Low | 69.6 | Low | 114 Ų | 114 | 114.1 Ų | 114.1 | 60% | 0.597 | 60% | 0.6 | S | S | * | * | trans | -32.7 | 125.8 | 162.1 | -73 | 157.3 | 0 | 0 | 0 | 108.2 | ||||
| 42 | K | 58.2 | Low | 69.6 | Low | 129 Ų | 129 | 113.4 Ų | 113.4 | 56% | 0.561 | 60% | 0.596 | S | S | * | * | trans | -48.8 | 136.6 | -178.4 | -64.3 | 178.3 | -167.7 | 127.3 | 0 | 107.8 | T40 G44 E45 | T40-K42 PolarHBondContact O-N 2.75Å; K42-G44 VanDerWaalsContact C-N 3.26Å; K42-G44 PolarHBondContact O-N 3.23Å; K42-E45 HydrophobicContact CB-CB 4.21Å; K42-E45 HydrophobicContact CB-CG 4.19Å; K42-E45 HydrophobicContact CD-CG 4.5Å; K42-E45 WeakPolarHBondContact CD-OE1 3.32Å; K42-E45 WeakPolarHBondContact CG-OE2 3.4Å; K42-E45 PolarHBondContact N-OE2 3.49Å; K42-E45 IonicContact NZ-OE1 3.72Å; K42-E45 PolarHBondContact NZ-OE1 2.82Å; K42-E45 IonicContact NZ-OE2 2.63Å; K42-E45 PolarHBondContact O-N 2.63Å | ||
| 43 | P | 54.7 | Low | 70 | Confident | 143 Ų | 143 | 115.8 Ų | 115.8 | 93% | 0.929 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | 94.6 | 174.7 | 23 | -28.9 | 0 | 0 | 0 | 107.9 | ||
| 44 | G | 56.1 | Low | 70.6 | Confident | 76 Ų | 76 | 112.3 Ų | 112.3 | 78% | 0.784 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 134.9 | -15.7 | -167.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | K42 | K42-G44 VanDerWaalsContact C-N 3.26Å; K42-G44 PolarHBondContact O-N 3.23Å |
| 45 | E | 59.2 | Low | 71.1 | Confident | 93 Ų | 93 | 106.6 Ų | 106.6 | 44% | 0.435 | 57% | 0.57 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -92 | -4.5 | 173.2 | -94.1 | 173 | -178.9 | 0 | 0 | 113.3 | K42 K47 | K42-E45 HydrophobicContact CB-CB 4.21Å; K42-E45 HydrophobicContact CB-CG 4.19Å; K42-E45 HydrophobicContact CD-CG 4.5Å; K42-E45 WeakPolarHBondContact CD-OE1 3.32Å; K42-E45 WeakPolarHBondContact CG-OE2 3.4Å; K42-E45 PolarHBondContact N-OE2 3.49Å; K42-E45 IonicContact NZ-OE1 3.72Å; K42-E45 PolarHBondContact NZ-OE1 2.82Å; K42-E45 IonicContact NZ-OE2 2.63Å; K42-E45 PolarHBondContact O-N 2.63Å; E45-K47 VanDerWaalsContact C-N 3.26Å; E45-K47 PolarHBondContact O-N 3.41Å |
| 46 | E | 66.5 | Low | 71.5 | Confident | 154 Ų | 154 | 107.5 Ų | 107.5 | 72% | 0.72 | 57% | 0.565 | S | S | * | * | S | Bend | trans | -68.2 | 91.9 | 166.5 | -66.6 | -171.6 | -179 | 0 | 0 | 108.1 | S48 | E46-S48 PolarHBondContact O-N 2.92Š|
| 47 | K | 74.8 | Confident | 72.3 | Confident | 111 Ų | 111 | 108.3 Ų | 108.3 | 48% | 0.483 | 57% | 0.572 | S | S | . | * | trans | -46 | 130.2 | 176.9 | -73.3 | -176 | 175.8 | -173.1 | 0 | 109.4 | E45 E51 L52 D55 | E45-K47 VanDerWaalsContact C-N 3.26Å; E45-K47 PolarHBondContact O-N 3.41Å; K47-E51 WeakPolarHBondContact CA-OE2 3.17Å; K47-E51 HydrophobicContact CB-CB 4.29Å; K47-L52 HydrophobicContact CB-CD2 3.85Å; K47-L52 HydrophobicContact CB-CG 3.85Å; K47-L52 HydrophobicContact CD-CD2 3.99Å; K47-D55 WeakPolarHBondContact CD-OD2 3.28Å; K47-D55 IonicContact NZ-OD2 3.53Å; K47-D55 PolarHBondContact NZ-OD2 2.96Å | ||
| 48 | S | 81.4 | Confident | 73.4 | Confident | 52 Ų | 52 | 112.2 Ų | 112.2 | 36% | 0.364 | 58% | 0.583 | S | S | . | * | trans | -61.4 | 155.7 | 178.4 | 83.2 | 0 | 0 | 0 | 0 | 109.8 | E46 V50 E51 L52 | E46-S48 PolarHBondContact O-N 2.92Å; S48-V50 PolarHBondContact O-N 3.36Å; S48-V50 PolarHBondContact OG-N 2.73Å; S48-E51 PolarHBondContact N-OE2 2.87Å; S48-E51 PolarHBondContact O-N 2.82Å; S48-E51 WeakPolarHBondContact OG-CG 3.38Å; S48-E51 PolarHBondContact OG-N 3.4Å; S48-L52 PolarHBondContact O-N 3.33Å | ||
| 49 | I | 83.1 | Confident | 74.8 | Confident | 119 Ų | 119 | 110.8 Ų | 110.8 | 61% | 0.61 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -56.7 | -28.9 | 177.5 | -59.7 | 175.1 | 0 | 0 | 0 | 111.1 | R53 | I49-R53 WeakPolarHBondContact O-CD 3.47Å; I49-R53 WeakPolarHBondContact O-CG 3.34Å; I49-R53 PolarHBondContact O-N 3.07Å |
| 50 | V | 88.4 | Confident | 76 | Confident | 82 Ų | 82 | 109.8 Ų | 109.8 | 50% | 0.497 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -70.4 | -48.9 | 176.4 | 179.1 | 0 | 0 | 0 | 0 | 110.6 | S48 L52 R53 E54 | S48-V50 PolarHBondContact O-N 3.36Å; S48-V50 PolarHBondContact OG-N 2.73Å; V50-L52 VanDerWaalsContact C-N 3.32Å; V50-L52 PolarHBondContact O-N 3.36Å; V50-R53 WeakPolarHBondContact O-CB 3.4Å; V50-R53 PolarHBondContact O-N 3.4Å; V50-E54 PolarHBondContact O-N 3.14Å |
| 51 | E | 84.4 | Confident | 77.1 | Confident | 97 Ų | 97 | 108.1 Ų | 108.1 | 45% | 0.453 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -59.5 | -42.4 | 177.5 | -69.3 | 166.7 | -176.1 | 0 | 0 | 111.4 | K47 S48 R53 E54 D55 | K47-E51 WeakPolarHBondContact CA-OE2 3.17Å; K47-E51 HydrophobicContact CB-CB 4.29Å; S48-E51 PolarHBondContact N-OE2 2.87Å; S48-E51 PolarHBondContact O-N 2.82Å; S48-E51 WeakPolarHBondContact OG-CG 3.38Å; S48-E51 PolarHBondContact OG-N 3.4Å; E51-R53 VanDerWaalsContact C-N 3.26Å; E51-R53 PolarHBondContact O-N 3.1Å; E51-E54 PolarHBondContact O-N 3.39Å; E51-D55 PolarHBondContact O-N 3.41Å |
| 52 | L | 86.4 | Confident | 78.2 | Confident | 86 Ų | 86 | 107 Ų | 107 | 45% | 0.45 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -61.4 | -33.2 | 175.1 | -71.9 | 174.3 | 0 | 0 | 0 | 113.3 | K47 S48 V50 R56 | K47-L52 HydrophobicContact CB-CD2 3.85Å; K47-L52 HydrophobicContact CB-CG 3.85Å; K47-L52 HydrophobicContact CD-CD2 3.99Å; S48-L52 PolarHBondContact O-N 3.33Å; V50-L52 VanDerWaalsContact C-N 3.32Å; V50-L52 PolarHBondContact O-N 3.36Å; L52-R56 PolarHBondContact O-N 2.86Å |
| 53 | R | 87.4 | Confident | 78.9 | Confident | 146 Ų | 146 | 104.6 Ų | 104.6 | 55% | 0.551 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -75.6 | -36.8 | 177 | -73.1 | 167.7 | -176.3 | -177.7 | 3.5 | 111.4 | I49 V50 E51 R56 K57 | I49-R53 WeakPolarHBondContact O-CD 3.47Å; I49-R53 WeakPolarHBondContact O-CG 3.34Å; I49-R53 PolarHBondContact O-N 3.07Å; V50-R53 WeakPolarHBondContact O-CB 3.4Å; V50-R53 PolarHBondContact O-N 3.4Å; E51-R53 VanDerWaalsContact C-N 3.26Å; E51-R53 PolarHBondContact O-N 3.1Å; R53-R56 PolarHBondContact O-N 3.22Å; R53-K57 WeakPolarHBondContact O-CG 3.48Å; R53-K57 PolarHBondContact O-N 3.3Å |
| 54 | E | 87.8 | Confident | 79.9 | Confident | 107 Ų | 107 | 106.4 Ų | 106.4 | 50% | 0.5 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -66.8 | -45.2 | 175.9 | -71.3 | 179.1 | 177.4 | 0 | 0 | 110.8 | V50 E51 R56 K57 L58 | V50-E54 PolarHBondContact O-N 3.14Å; E51-E54 PolarHBondContact O-N 3.39Å; E54-R56 VanDerWaalsContact C-N 3.31Å; E54-R56 PolarHBondContact O-N 3.22Å; E54-K57 WeakPolarHBondContact O-CB 3.18Å; E54-K57 PolarHBondContact O-N 3.35Å; E54-K57 VanDerWaalsContact O-N 3.08Å; E54-L58 WeakPolarHBondContact O-CG 3.18Å; E54-L58 PolarHBondContact O-N 2.85Å |
| 55 | D | 88.8 | Confident | 80.7 | Confident | 53 Ų | 53 | 106.9 Ų | 106.9 | 28% | 0.283 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -55.7 | -45.8 | 173.4 | -74.4 | -19.2 | 0 | 0 | 0 | 111.5 | K47 E51 K57 L58 E59 | K47-D55 WeakPolarHBondContact CD-OD2 3.28Å; K47-D55 IonicContact NZ-OD2 3.53Å; K47-D55 PolarHBondContact NZ-OD2 2.96Å; E51-D55 PolarHBondContact O-N 3.41Å; D55-K57 PolarHBondContact O-N 3.3Å; D55-L58 WeakPolarHBondContact O-CB 3.47Å; D55-L58 PolarHBondContact O-N 3.31Å; D55-L58 VanDerWaalsContact O-N 3.17Å; D55-E59 WeakPolarHBondContact O-CG 3.43Å; D55-E59 PolarHBondContact O-N 3.34Å |
| 56 | R | 87.3 | Confident | 81.1 | Confident | 145 Ų | 145 | 107.6 Ų | 107.6 | 55% | 0.547 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -61 | -42.4 | 175.9 | -168.9 | -170.6 | -55.3 | 158.5 | 3.5 | 112.4 | L52 R53 E54 L58 E59 E60 | L52-R56 PolarHBondContact O-N 2.86Å; R53-R56 PolarHBondContact O-N 3.22Å; E54-R56 VanDerWaalsContact C-N 3.31Å; E54-R56 PolarHBondContact O-N 3.22Å; R56-L58 VanDerWaalsContact C-N 3.3Å; R56-L58 PolarHBondContact O-N 3.08Å; R56-E59 PolarHBondContact O-N 3.04Å; R56-E60 WeakPolarHBondContact CG-OE1 3.3Å; R56-E60 WeakPolarHBondContact O-CB 3.48Å; R56-E60 VanDerWaalsContact O-CG 3.28Å; R56-E60 WeakPolarHBondContact O-CG 3.17Å; R56-E60 PolarHBondContact O-N 2.95Å |
| 57 | K | 86.3 | Confident | 81.3 | Confident | 146 Ų | 146 | 105.4 Ų | 105.4 | 64% | 0.635 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -64 | -37.8 | 176.3 | -74.1 | 175.9 | -178.4 | -179.8 | 0 | 111.7 | R53 E54 D55 G61 | R53-K57 WeakPolarHBondContact O-CG 3.48Å; R53-K57 PolarHBondContact O-N 3.3Å; E54-K57 WeakPolarHBondContact O-CB 3.18Å; E54-K57 PolarHBondContact O-N 3.35Å; E54-K57 VanDerWaalsContact O-N 3.08Å; D55-K57 PolarHBondContact O-N 3.3Å; K57-G61 PolarHBondContact O-N 2.94Å |
| 58 | L | 86.4 | Confident | 81 | Confident | 122 Ų | 122 | 107.6 Ų | 107.6 | 64% | 0.639 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -66.4 | -44.2 | 176.3 | -70.3 | 172.5 | 0 | 0 | 0 | 110.9 | E54 D55 R56 G61 A62 | E54-L58 WeakPolarHBondContact O-CG 3.18Å; E54-L58 PolarHBondContact O-N 2.85Å; D55-L58 WeakPolarHBondContact O-CB 3.47Å; D55-L58 PolarHBondContact O-N 3.31Å; D55-L58 VanDerWaalsContact O-N 3.17Å; R56-L58 VanDerWaalsContact C-N 3.3Å; R56-L58 PolarHBondContact O-N 3.08Å; L58-G61 CarbonylContact O-C 3.56Å; L58-G61 PolarHBondContact O-N 3.26Å; L58-G61 VanDerWaalsContact O-N 3.16Å; L58-A62 WeakPolarHBondContact O-CB 3.31Å; L58-A62 PolarHBondContact O-N 2.98Å |
| 59 | E | 87.6 | Confident | 80.4 | Confident | 148 Ų | 148 | 110.7 Ų | 110.7 | 69% | 0.692 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -60.8 | -44.5 | 174.2 | -73.3 | -179.5 | 173.8 | 0 | 0 | 112.1 | D55 R56 G61 A62 | D55-E59 WeakPolarHBondContact O-CG 3.43Å; D55-E59 PolarHBondContact O-N 3.34Å; R56-E59 PolarHBondContact O-N 3.04Å; E59-G61 PolarHBondContact O-N 3.43Å; E59-A62 PolarHBondContact O-N 2.87Å |
| 60 | E | 81.6 | Confident | 79.6 | Confident | 108 Ų | 108 | 110.5 Ų | 110.5 | 51% | 0.505 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -65.3 | -24.3 | 176.1 | -73 | 174.2 | -163.4 | 0 | 0 | 113.4 | R56 R64 | R56-E60 WeakPolarHBondContact CG-OE1 3.3Å; R56-E60 WeakPolarHBondContact O-CB 3.48Å; R56-E60 VanDerWaalsContact O-CG 3.28Å; R56-E60 WeakPolarHBondContact O-CG 3.17Å; R56-E60 PolarHBondContact O-N 2.95Å; E60-R64 PolarHBondContact O-NH1 3.44Å |
| 61 | G | 77.8 | Confident | 78.6 | Confident | 39 Ų | 39 | 110 Ų | 110 | 40% | 0.402 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -91 | -26 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | K57 L58 E59 G63 R64 | K57-G61 PolarHBondContact O-N 2.94Å; L58-G61 CarbonylContact O-C 3.56Å; L58-G61 PolarHBondContact O-N 3.26Å; L58-G61 VanDerWaalsContact O-N 3.16Å; E59-G61 PolarHBondContact O-N 3.43Å; G61-G63 PolarHBondContact O-N 3.22Å; G61-G63 VanDerWaalsContact O-N 3.07Å; G61-R64 PolarHBondContact O-N 3.36Å; G61-R64 VanDerWaalsContact O-N 3.07Å |
| 62 | A | 78.9 | Confident | 77.8 | Confident | 92 Ų | 92 | 112.1 Ų | 112.1 | 76% | 0.76 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.4 | -17.7 | -174.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | L58 E59 | L58-A62 WeakPolarHBondContact O-CB 3.31Å; L58-A62 PolarHBondContact O-N 2.98Å; E59-A62 PolarHBondContact O-N 2.87Å |
| 63 | G | 72.4 | Confident | 76.6 | Confident | 77 Ų | 77 | 116.2 Ų | 116.2 | 79% | 0.794 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.8 | 3.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | G61 | G61-G63 PolarHBondContact O-N 3.22Å; G61-G63 VanDerWaalsContact O-N 3.07Å |
| 64 | R | 74.4 | Confident | 75.5 | Confident | 182 Ų | 182 | 114.6 Ų | 114.6 | 69% | 0.687 | 61% | 0.613 | S | S | * | * | S | Bend | trans | -112.6 | 129.2 | -179.2 | -71.3 | -175.2 | 173.7 | 113.4 | -7.8 | 110.5 | E60 G61 S66 | E60-R64 PolarHBondContact O-NH1 3.44Å; G61-R64 PolarHBondContact O-N 3.36Å; G61-R64 VanDerWaalsContact O-N 3.07Å; R64-S66 PolarHBondContact O-N 2.95Å; R64-S66 VanDerWaalsContact O-N 3.12Å |
| 65 | D | 74.6 | Confident | 74.1 | Confident | 86 Ų | 86 | 115.1 Ų | 115.1 | 46% | 0.46 | 61% | 0.614 | S | S | . | * | trans | -70.8 | 105.6 | 170.8 | -173.8 | -3.9 | 0 | 0 | 0 | 109.2 | T67 Q68 | D65-T67 VanDerWaalsContact CG-OG1 3.3Å; D65-T67 PolarHBondContact O-N 2.83Å; D65-T67 WeakPolarHBondContact OD1-CB 3.31Å; D65-T67 PolarHBondContact OD1-N 3.49Å; D65-T67 PolarHBondContact OD1-OG1 3.41Å; D65-T67 PolarHBondContact OD2-OG1 2.93Å; D65-Q68 HydrophobicContact CB-CG 4.2Å; D65-Q68 PolarHBondContact O-N 3.22Å; D65-Q68 WeakPolarHBondContact OD2-CG 3.48Å; D65-Q68 PolarHBondContact OD2-NE2 2.88Å | ||
| 66 | S | 67.3 | Low | 72.8 | Confident | 107 Ų | 107 | 119.4 Ų | 119.4 | 75% | 0.748 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69 | -8.4 | -179.2 | 52.3 | 0 | 0 | 0 | 0 | 113.3 | R64 | R64-S66 PolarHBondContact O-N 2.95Å; R64-S66 VanDerWaalsContact O-N 3.12Å |
| 67 | T | 70.6 | Confident | 71.5 | Confident | 108 Ų | 108 | 120.8 Ų | 120.8 | 66% | 0.663 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.6 | -14.7 | 177.9 | 71.4 | 0 | 0 | 0 | 0 | 113.3 | D65 V69 | D65-T67 VanDerWaalsContact CG-OG1 3.3Å; D65-T67 PolarHBondContact O-N 2.83Å; D65-T67 WeakPolarHBondContact OD1-CB 3.31Å; D65-T67 PolarHBondContact OD1-N 3.49Å; D65-T67 PolarHBondContact OD1-OG1 3.41Å; D65-T67 PolarHBondContact OD2-OG1 2.93Å; T67-V69 VanDerWaalsContact C-N 3.25Å; T67-V69 PolarHBondContact O-N 2.84Å |
| 68 | Q | 67.8 | Low | 70.2 | Confident | 158 Ų | 158 | 123 Ų | 123 | 74% | 0.738 | 66% | 0.658 | S | S | * | * | trans | -84.9 | 65.8 | 174.7 | -66.8 | -173.4 | 16.6 | 0 | 0 | 111.3 | D65 | D65-Q68 HydrophobicContact CB-CG 4.2Å; D65-Q68 PolarHBondContact O-N 3.22Å; D65-Q68 WeakPolarHBondContact OD2-CG 3.48Å; D65-Q68 PolarHBondContact OD2-NE2 2.88Å | ||
| 69 | V | 68.4 | Low | 69.1 | Low | 117 Ų | 117 | 121.4 Ų | 121.4 | 71% | 0.709 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -97.9 | 133.3 | 169.3 | -69.2 | 0 | 0 | 0 | 0 | 109.4 | T67 S71 | T67-V69 VanDerWaalsContact C-N 3.25Å; T67-V69 PolarHBondContact O-N 2.84Å; V69-S71 PolarHBondContact O-N 3.29Å |
| 70 | L | 66.6 | Low | 67.8 | Low | 115 Ų | 115 | 119.7 Ų | 119.7 | 60% | 0.602 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 134.1 | 171.3 | -68.7 | 173.2 | 0 | 0 | 0 | 109.1 | L72 | L70-L72 PolarHBondContact O-N 2.82Š|
| 71 | S | 67.4 | Low | 67.1 | Low | 71 Ų | 71 | 124.8 Ų | 124.8 | 50% | 0.497 | 67% | 0.67 | S | S | . | * | P | Polyproline II helix | trans | -56.2 | 131.6 | -179.9 | 176.9 | 0 | 0 | 0 | 0 | 109.7 | V69 K73 E74 K75 | V69-S71 PolarHBondContact O-N 3.29Å; S71-K73 PolarHBondContact O-N 3.48Å; S71-K73 PolarHBondContact OG-N 2.9Å; S71-E74 WeakPolarHBondContact O-CB 3.48Å; S71-E74 PolarHBondContact O-N 3.32Å; S71-K75 PolarHBondContact O-N 3.44Å |
| 72 | L | 67.1 | Low | 66.7 | Low | 142 Ų | 142 | 125.5 Ų | 125.5 | 74% | 0.743 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -55.8 | -22.3 | 176.6 | -68.4 | 172.4 | 0 | 0 | 0 | 112.4 | L70 L76 | L70-L72 PolarHBondContact O-N 2.82Å; L72-L76 PolarHBondContact O-N 2.8Å |
| 73 | K | 62.6 | Low | 65.9 | Low | 171 Ų | 171 | 125.7 Ų | 125.7 | 74% | 0.743 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -67.5 | -36.9 | 175.2 | -149.7 | 177.7 | -173.6 | -121.6 | 0 | 112.5 | S71 L76 | S71-K73 PolarHBondContact O-N 3.48Å; S71-K73 PolarHBondContact OG-N 2.9Å; K73-L76 WeakPolarHBondContact O-CB 3.16Å; K73-L76 PolarHBondContact O-N 2.76Å |
| 74 | E | 63.3 | Low | 65.3 | Low | 113 Ų | 113 | 129.2 Ų | 129.2 | 53% | 0.528 | 67% | 0.674 | S | S | . | * | H | α-helix | trans | -75.4 | -34 | 178.3 | -164.8 | 175.9 | -172 | 0 | 0 | 111.3 | S71 L76 E77 | S71-E74 WeakPolarHBondContact O-CB 3.48Å; S71-E74 PolarHBondContact O-N 3.32Å; E74-L76 VanDerWaalsContact C-N 3.29Å; E74-L76 PolarHBondContact O-N 3.25Å; E74-E77 PolarHBondContact O-N 2.87Å |
| 75 | K | 59.8 | Low | 64.8 | Low | 117 Ų | 117 | 124.2 Ų | 124.2 | 51% | 0.509 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -68.5 | -23.9 | 172.5 | -84 | -173.8 | 177.7 | -75.7 | 0 | 114 | S71 E77 F78 T79 | S71-K75 PolarHBondContact O-N 3.44Å; K75-E77 VanDerWaalsContact C-N 3.27Å; K75-E77 PolarHBondContact O-N 2.86Å; K75-F78 PolarHBondContact O-N 3.3Å; K75-T79 PolarHBondContact O-N 2.94Å; K75-T79 VanDerWaalsContact O-N 3.12Å; K75-T79 PolarHBondContact O-OG1 3.47Å |
| 76 | L | 59.8 | Low | 64.3 | Low | 144 Ų | 144 | 131.1 Ų | 131.1 | 75% | 0.754 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -69.2 | -27.6 | 178.2 | -131.3 | 119.3 | 0 | 0 | 0 | 112 | L72 K73 E74 | L72-L76 PolarHBondContact O-N 2.8Å; K73-L76 WeakPolarHBondContact O-CB 3.16Å; K73-L76 PolarHBondContact O-N 2.76Å; E74-L76 VanDerWaalsContact C-N 3.29Å; E74-L76 PolarHBondContact O-N 3.25Å |
| 77 | E | 61.5 | Low | 64.1 | Low | 173 Ų | 173 | 133.5 Ų | 133.5 | 81% | 0.808 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -75.7 | -30.3 | 175.5 | -64.7 | -177.3 | 175.9 | 0 | 0 | 112.2 | E74 K75 | E74-E77 PolarHBondContact O-N 2.87Å; K75-E77 VanDerWaalsContact C-N 3.27Å; K75-E77 PolarHBondContact O-N 2.86Å |
| 78 | F | 57.9 | Low | 63.8 | Low | 193 Ų | 193 | 137.4 Ų | 137.4 | 85% | 0.846 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -95.9 | -11.4 | -174.5 | -149.6 | -92.8 | 0 | 0 | 0 | 114.3 | K75 | K75-F78 PolarHBondContact O-N 3.3Å |
| 79 | T | 63.2 | Low | 63.7 | Low | 88 Ų | 88 | 135.1 Ų | 135.1 | 54% | 0.54 | 69% | 0.686 | S | S | . | * | S | Bend | trans | -90.9 | 128.1 | 178.9 | -50.3 | 0 | 0 | 0 | 0 | 109.5 | K75 R81 | K75-T79 PolarHBondContact O-N 2.94Å; K75-T79 VanDerWaalsContact O-N 3.12Å; K75-T79 PolarHBondContact O-OG1 3.47Å; T79-R81 PolarHBondContact O-N 3.36Å |
| 80 | P | 61.3 | Low | 63.3 | Low | 112 Ų | 112 | 137.8 Ų | 137.8 | 73% | 0.727 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 129.1 | 174.9 | 23.4 | -31.9 | 0 | 0 | 0 | 109.2 | A82 | P80-A82 PolarHBondContact O-N 3.3Š|
| 81 | R | 66.5 | Low | 62.8 | Low | 216 Ų | 216 | 142 Ų | 142 | 82% | 0.815 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -46.8 | 120.1 | -179 | -73.1 | -174.4 | -179.7 | -171.4 | -2.4 | 109 | T79 | T79-R81 PolarHBondContact O-N 3.36Š|
| 82 | A | 69.1 | Low | 61.6 | Low | 54 Ų | 54 | 147.5 Ų | 147.5 | 45% | 0.446 | 74% | 0.743 | S | S | . | * | P | Polyproline II helix | trans | -61.8 | 145.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | P80 L84 D85 | P80-A82 PolarHBondContact O-N 3.3Å; A82-L84 PolarHBondContact O-N 3.02Å; A82-D85 PolarHBondContact O-N 2.89Å |
| 83 | A | 62.5 | Low | 61.4 | Low | 95 Ų | 95 | 147.8 Ų | 147.8 | 79% | 0.785 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -55.3 | -21.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | R86 | A83-R86 WeakPolarHBondContact O-CB 3.42Š|
| 84 | L | 60.2 | Low | 61.3 | Low | 152 Ų | 152 | 146.6 Ų | 146.6 | 80% | 0.796 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -68.7 | -29.2 | 175.3 | -164.5 | 69.3 | 0 | 0 | 0 | 113.6 | A82 R86 | A82-L84 PolarHBondContact O-N 3.02Å; L84-R86 PolarHBondContact O-N 3.21Å |
| 85 | D | 63.4 | Low | 61.2 | Low | 76 Ų | 76 | 148.4 Ų | 148.4 | 41% | 0.406 | 75% | 0.754 | S | S | . | * | G | 310 helix | trans | -75.4 | -12.2 | -179.7 | -70.9 | -41.6 | 0 | 0 | 0 | 112.8 | A82 N87 R88 | A82-D85 PolarHBondContact O-N 2.89Å; D85-N87 PolarHBondContact O-N 2.95Å; D85-R88 PolarHBondContact O-N 3.47Å |
| 86 | R | 63.8 | Low | 61.3 | Low | 231 Ų | 231 | 150.3 Ų | 150.3 | 87% | 0.872 | 77% | 0.769 | S | S | * | * | G | 310 helix | trans | -63.1 | -22.9 | 179.4 | -161.6 | 176.7 | -179.5 | 176.7 | 0.4 | 113.4 | A83 L84 | A83-R86 WeakPolarHBondContact O-CB 3.42Å; L84-R86 PolarHBondContact O-N 3.21Å |
| 87 | N | 63 | Low | 61.4 | Low | 158 Ų | 158 | 150.7 Ų | 150.7 | 85% | 0.845 | 77% | 0.77 | S | S | * | * | G | 310 helix | trans | -107.6 | 4.2 | -178.4 | -99.3 | -0.4 | 0 | 0 | 0 | 113.9 | D85 P89 | D85-N87 PolarHBondContact O-N 2.95Å; N87-P89 WeakPolarHBondContact O-CD 3.26Å |
| 88 | R | 64.8 | Low | 61.3 | Low | 189 Ų | 189 | 149.2 Ų | 149.2 | 71% | 0.713 | 77% | 0.767 | S | S | * | * | trans | -84.1 | 119.3 | -179.2 | -137.1 | 174.7 | -179.5 | 146.2 | -0.1 | 108.7 | D85 E90 | D85-R88 PolarHBondContact O-N 3.47Å; R88-E90 PolarHBondContact O-N 3.42Å | ||
| 89 | P | 65.1 | Low | 61.6 | Low | 110 Ų | 110 | 146.1 Ų | 146.1 | 71% | 0.714 | 76% | 0.762 | S | S | * | * | trans | -63.9 | 127 | 174.7 | 25.5 | -31.7 | 0 | 0 | 0 | 108.5 | N87 K91 | N87-P89 WeakPolarHBondContact O-CD 3.26Å; P89-K91 PolarHBondContact O-N 3.27Å | ||
| 90 | E | 59.7 | Low | 61.5 | Low | 173 Ų | 173 | 150.5 Ų | 150.5 | 81% | 0.808 | 78% | 0.779 | S | S | * | * | trans | -59.5 | 112.7 | 171.8 | -60.9 | -158.4 | 176.7 | 0 | 0 | 107.4 | R88 S92 | R88-E90 PolarHBondContact O-N 3.42Å; E90-S92 PolarHBondContact O-N 3.25Å | ||
| 91 | K | 57.7 | Low | 61.5 | Low | 204 Ų | 204 | 153.8 Ų | 153.8 | 89% | 0.887 | 78% | 0.783 | S | S | * | * | trans | -71.8 | 120.7 | 174.6 | -78 | -174.4 | 175.4 | -174.8 | 0 | 107.4 | P89 | P89-K91 PolarHBondContact O-N 3.27Š| ||
| 92 | S | 42.2 | Very low | 61 | Low | 187 Ų | 187 | 148.1 Ų | 148.1 | 100% | 1.308 | 78% | 0.78 | S | S | * | * | trans | -57 | 0 | 169.9 | -176.7 | 0 | 0 | 0 | 0 | 112.7 | E90 | E90-S92 PolarHBondContact O-N 3.25Š|
Retrieved 92 of 92 residues in 39.4 ms
(Link to these results)