| 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 | 49.9 | Very low | 55 | Low | 247 Ų | 247 | 132.4 Ų | 132.4 | 100% | 1.217 | 83% | 0.829 | S | S | * | * | 0 | 122.3 | 0 | -68.1 | -138.2 | 105.9 | 0 | 0 | 108.4 | |||||
| 2 | A | 45.5 | Very low | 54.9 | Low | 98 Ų | 98 | 137 Ų | 137 | 81% | 0.81 | 83% | 0.833 | S | S | * | * | trans | -174.2 | 108.2 | 146.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 3 | T | 54 | Low | 54.8 | Low | 137 Ų | 137 | 139.8 Ų | 139.8 | 84% | 0.84 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -49.6 | 133.5 | 176.3 | -58.4 | 0 | 0 | 0 | 0 | 113.8 | ||
| 4 | F | 63.9 | Low | 54.9 | Low | 192 Ų | 192 | 137.7 Ų | 137.7 | 84% | 0.842 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 135 | 166.2 | -66.8 | -80.9 | 0 | 0 | 0 | 110.1 | ||
| 5 | P | 68.3 | Low | 54.8 | Low | 113 Ų | 113 | 135.8 Ų | 135.8 | 73% | 0.734 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 152.1 | 177.8 | 28.5 | -33.5 | 0 | 0 | 0 | 111.9 | ||
| 6 | P | 58.3 | Low | 54.7 | Low | 120 Ų | 120 | 130.4 Ų | 130.4 | 78% | 0.779 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 150.3 | -173.2 | 27.8 | -35.7 | 0 | 0 | 0 | 113.1 | T8 | P6-T8 PolarHBondContact O-N 3.26Å; P6-T8 VanDerWaalsContact O-N 3.14Å |
| 7 | A | 57.6 | Low | 55.1 | Low | 104 Ų | 104 | 130.4 Ų | 130.4 | 86% | 0.86 | 80% | 0.799 | S | S | * | * | trans | -56.7 | 112.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | S9 | A7-S9 PolarHBondContact O-N 3.47Å; A7-S9 VanDerWaalsContact O-N 3.12Å | ||
| 8 | T | 47.6 | Very low | 54.8 | Low | 141 Ų | 141 | 131.3 Ų | 131.3 | 87% | 0.865 | 79% | 0.793 | S | S | * | * | trans | -74.6 | 100.2 | 166.2 | 30 | 0 | 0 | 0 | 0 | 109.1 | P6 A10 | P6-T8 PolarHBondContact O-N 3.26Å; P6-T8 VanDerWaalsContact O-N 3.14Å; T8-A10 PolarHBondContact O-N 2.87Å | ||
| 9 | S | 56.8 | Low | 54.9 | Low | 106 Ų | 106 | 132.7 Ų | 132.7 | 74% | 0.741 | 80% | 0.796 | S | S | * | * | trans | -37.7 | 119.5 | 157.9 | -179.2 | 0 | 0 | 0 | 0 | 110 | A7 | A7-S9 PolarHBondContact O-N 3.47Å; A7-S9 VanDerWaalsContact O-N 3.12Å | ||
| 10 | A | 53.5 | Low | 54.8 | Low | 79 Ų | 79 | 134 Ų | 134 | 65% | 0.653 | 79% | 0.793 | S | S | * | * | trans | -55.6 | 134.5 | 162.1 | 0 | 0 | 0 | 0 | 0 | 107.7 | T8 Q12 | T8-A10 PolarHBondContact O-N 2.87Å; A10-Q12 PolarHBondContact O-N 2.93Å; A10-Q12 VanDerWaalsContact O-N 3.11Å | ||
| 11 | P | 49.3 | Very low | 55.1 | Low | 119 Ų | 119 | 134.1 Ų | 134.1 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | trans | -60.6 | 120 | 171.5 | 24.5 | -30.7 | 0 | 0 | 0 | 107.4 | Q13 | P11-Q13 PolarHBondContact O-N 2.86Š| ||
| 12 | Q | 54.4 | Low | 55.8 | Low | 188 Ų | 188 | 127.1 Ų | 127.1 | 88% | 0.879 | 76% | 0.763 | S | S | * | * | trans | -55.9 | 110.7 | 167.3 | -69.4 | -173.2 | -40.4 | 0 | 0 | 106.4 | A10 | A10-Q12 PolarHBondContact O-N 2.93Å; A10-Q12 VanDerWaalsContact O-N 3.11Å | ||
| 13 | Q | 53.5 | Low | 56.6 | Low | 173 Ų | 173 | 127.7 Ų | 127.7 | 81% | 0.808 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -57 | 134.3 | 164.3 | -61.4 | -147.2 | -66.8 | 0 | 0 | 106.2 | P11 | P11-Q13 PolarHBondContact O-N 2.86Š|
| 14 | P | 56.6 | Low | 57.3 | Low | 111 Ų | 111 | 125.4 Ų | 125.4 | 72% | 0.721 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 131.6 | 171.4 | 24.6 | -31.4 | 0 | 0 | 0 | 106.4 | G16 | P14-G16 PolarHBondContact O-N 3.41Š|
| 15 | P | 53.2 | Low | 57.9 | Low | 109 Ų | 109 | 120.2 Ų | 120.2 | 71% | 0.708 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -51.5 | 119.9 | 164.2 | 22.9 | -29.7 | 0 | 0 | 0 | 104.9 | ||
| 16 | G | 52.9 | Low | 58.1 | Low | 50 Ų | 50 | 122.1 Ų | 122.1 | 52% | 0.515 | 72% | 0.723 | S | S | . | * | P | Polyproline II helix | trans | -50.5 | 151.3 | 169 | 0 | 0 | 0 | 0 | 0 | 107.5 | P14 E18 | P14-G16 PolarHBondContact O-N 3.41Å; G16-E18 VanDerWaalsContact C-N 3.32Å; G16-E18 PolarHBondContact O-N 2.9Å |
| 17 | P | 61.9 | Low | 58.9 | Low | 130 Ų | 130 | 120 Ų | 120 | 84% | 0.844 | 71% | 0.711 | S | S | * | * | trans | -50.1 | 109.4 | 176.8 | 24.2 | -32.6 | 0 | 0 | 0 | 105.9 | D19 | P17-D19 PolarHBondContact O-N 3.37Š| ||
| 18 | E | 49.3 | Very low | 60 | Low | 146 Ų | 146 | 119 Ų | 119 | 68% | 0.682 | 69% | 0.692 | S | S | * | * | trans | -53.1 | 134.9 | 178.1 | -60.7 | -168.3 | 133.8 | 0 | 0 | 104.2 | G16 E20 | G16-E18 VanDerWaalsContact C-N 3.32Å; G16-E18 PolarHBondContact O-N 2.9Å; E18-E20 PolarHBondContact O-N 3.48Å | ||
| 19 | D | 57.4 | Low | 61.7 | Low | 159 Ų | 159 | 116.5 Ų | 116.5 | 85% | 0.85 | 67% | 0.672 | S | S | * | * | trans | -58.1 | 85.4 | 171.1 | -63.1 | -71.4 | 0 | 0 | 0 | 106.2 | P17 D21 | P17-D19 PolarHBondContact O-N 3.37Å; D19-D21 PolarHBondContact O-N 3.3Å | ||
| 20 | E | 52.9 | Low | 62.4 | Low | 157 Ų | 157 | 119.1 Ų | 119.1 | 73% | 0.734 | 67% | 0.667 | S | S | * | * | trans | -65.1 | 82.3 | 162.4 | -63.4 | -74.4 | 123.7 | 0 | 0 | 102.7 | E18 P22 | E18-E20 PolarHBondContact O-N 3.48Å; E20-P22 WeakPolarHBondContact O-CD 3.45Å | ||
| 21 | D | 59.6 | Low | 63.6 | Low | 137 Ų | 137 | 119.1 Ų | 119.1 | 73% | 0.733 | 66% | 0.662 | S | S | * | * | trans | -42.7 | 114.5 | 156.3 | -96.7 | -31.2 | 0 | 0 | 0 | 103.5 | D19 S23 | D19-D21 PolarHBondContact O-N 3.3Å; D21-S23 VanDerWaalsContact C-N 3.29Å; D21-S23 PolarHBondContact O-N 3.36Å | ||
| 22 | P | 65.2 | Low | 64.9 | Low | 100 Ų | 100 | 116.6 Ų | 116.6 | 65% | 0.649 | 64% | 0.642 | S | S | * | * | trans | -56.4 | 106.2 | -175.8 | 21.7 | -31.5 | 0 | 0 | 0 | 104.7 | E20 L24 | E20-P22 WeakPolarHBondContact O-CD 3.45Å; P22-L24 PolarHBondContact O-N 3.48Å | ||
| 23 | S | 61.7 | Low | 65.8 | Low | 110 Ų | 110 | 109.9 Ų | 109.9 | 77% | 0.769 | 62% | 0.619 | S | S | * | * | trans | -66.2 | 95.2 | -174.5 | 63 | 0 | 0 | 0 | 0 | 104.1 | D21 D25 | D21-S23 VanDerWaalsContact C-N 3.29Å; D21-S23 PolarHBondContact O-N 3.36Å; S23-D25 PolarHBondContact O-N 3.49Å | ||
| 24 | L | 69.6 | Low | 66.4 | Low | 90 Ų | 90 | 106.6 Ų | 106.6 | 47% | 0.471 | 60% | 0.603 | S | S | . | * | trans | -60.4 | 110.9 | -179.3 | -65.3 | -179.7 | 0 | 0 | 0 | 104.2 | P22 D28 L32 | P22-L24 PolarHBondContact O-N 3.48Å; L24-D28 HydrophobicContact CB-CB 4.1Å; L24-D28 HydrophobicContact CD2-CB 4.13Å; L24-L32 HydrophobicContact CD1-CD2 4.34Å | ||
| 25 | D | 76.6 | Confident | 66.9 | Low | 82 Ų | 82 | 104.5 Ų | 104.5 | 44% | 0.439 | 59% | 0.591 | S | S | . | * | trans | -65.5 | 164.6 | 179 | 73.9 | 29.9 | 0 | 0 | 0 | 108.7 | S23 S27 D28 L29 | S23-D25 PolarHBondContact O-N 3.49Å; D25-S27 PolarHBondContact O-N 3.47Å; D25-S27 WeakPolarHBondContact OD1-CA 3.23Å; D25-S27 WeakPolarHBondContact OD1-CB 3.49Å; D25-S27 PolarHBondContact OD1-N 3.24Å; D25-S27 PolarHBondContact OD1-OG 3.07Å; D25-D28 PolarHBondContact O-N 3.49Å; D25-D28 PolarHBondContact OD1-N 2.96Å; D25-L29 PolarHBondContact O-N 3.43Å | ||
| 26 | E | 72.9 | Confident | 67.2 | Low | 153 Ų | 153 | 106.3 Ų | 106.3 | 72% | 0.715 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -53 | -27 | -179.2 | -71.3 | -68.8 | 110.9 | 0 | 0 | 112.3 | Y30 | E26-Y30 WeakPolarHBondContact O-CB 3.35Å; E26-Y30 PolarHBondContact O-N 3.29Å |
| 27 | S | 73.4 | Confident | 67.5 | Low | 76 Ų | 76 | 109.9 Ų | 109.9 | 53% | 0.531 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -76.7 | -39.7 | 178.4 | -38.6 | 0 | 0 | 0 | 0 | 112.3 | D25 S31 | D25-S27 PolarHBondContact O-N 3.47Å; D25-S27 WeakPolarHBondContact OD1-CA 3.23Å; D25-S27 WeakPolarHBondContact OD1-CB 3.49Å; D25-S27 PolarHBondContact OD1-N 3.24Å; D25-S27 PolarHBondContact OD1-OG 3.07Å; S27-S31 WeakPolarHBondContact O-CB 3.35Å; S27-S31 PolarHBondContact O-N 3.04Å; S27-S31 PolarHBondContact O-OG 2.96Å |
| 28 | D | 82.1 | Confident | 67.2 | Low | 83 Ų | 83 | 106 Ų | 106 | 44% | 0.444 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -68.5 | -40.5 | 174.1 | -73.1 | -23 | 0 | 0 | 0 | 110.8 | L24 D25 S31 L32 | L24-D28 HydrophobicContact CB-CB 4.1Å; L24-D28 HydrophobicContact CD2-CB 4.13Å; D25-D28 PolarHBondContact O-N 3.49Å; D25-D28 PolarHBondContact OD1-N 2.96Å; D28-S31 PolarHBondContact O-N 2.94Å; D28-L32 VanDerWaalsContact O-CB 3.28Å; D28-L32 WeakPolarHBondContact O-CB 3.34Å; D28-L32 PolarHBondContact O-N 3.44Å |
| 29 | L | 81.8 | Confident | 67.4 | Low | 88 Ų | 88 | 109.2 Ų | 109.2 | 46% | 0.461 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -64.6 | -41.4 | 175.1 | -170.9 | 61.2 | 0 | 0 | 0 | 111.5 | D25 A33 | D25-L29 PolarHBondContact O-N 3.43Å; L29-A33 PolarHBondContact O-N 3.04Å; L29-A33 VanDerWaalsContact O-N 3.07Å |
| 30 | Y | 73.3 | Confident | 66.9 | Low | 162 Ų | 162 | 108.5 Ų | 108.5 | 64% | 0.635 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -63.5 | -48.9 | 173.1 | -137.4 | -112.2 | 0 | 0 | 0 | 110.5 | E26 L32 A33 H34 | E26-Y30 WeakPolarHBondContact O-CB 3.35Å; E26-Y30 PolarHBondContact O-N 3.29Å; Y30-L32 VanDerWaalsContact C-N 3.28Å; Y30-L32 PolarHBondContact O-N 2.74Å; Y30-A33 PolarHBondContact O-N 3.09Å; Y30-H34 AromaticContact CD1-CE1 3.03Å; Y30-H34 WeakPolarHBondContact CD1-CE1 3.45Å; Y30-H34 AromaticContact CD1-ND1 3.54Å; Y30-H34 AromaticContact CD1-NE2 3.91Å; Y30-H34 AromaticContact CE1-CE1 3.01Å; Y30-H34 WeakPolarHBondContact CE1-CE1 3.31Å; Y30-H34 AromaticContact CE1-ND1 3.98Å; Y30-H34 AromaticContact CE1-NE2 3.6Å; Y30-H34 AromaticContact CG-CE1 3.76Å; Y30-H34 AromaticContact CZ-CE1 3.71Å; Y30-H34 PolarHBondContact O-N 3Å; Y30-H34 PolarHBondContact O-ND1 3.29Å |
| 31 | S | 78.1 | Confident | 66.9 | Low | 78 Ų | 78 | 107.6 Ų | 107.6 | 55% | 0.545 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -59 | -40.8 | -179.5 | -67 | 0 | 0 | 0 | 0 | 112.3 | S27 D28 H34 S35 | S27-S31 WeakPolarHBondContact O-CB 3.35Å; S27-S31 PolarHBondContact O-N 3.04Å; S27-S31 PolarHBondContact O-OG 2.96Å; D28-S31 PolarHBondContact O-N 2.94Å; S31-H34 PolarHBondContact O-N 3.5Å; S31-S35 PolarHBondContact O-N 3.26Å; S31-S35 VanDerWaalsContact O-N 3.08Å |
| 32 | L | 77.1 | Confident | 66.6 | Low | 66 Ų | 66 | 106.9 Ų | 106.9 | 35% | 0.346 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.8 | -46.3 | 177 | -175.1 | 63 | 0 | 0 | 0 | 111.2 | L24 D28 Y30 H34 S35 Y36 | L24-L32 HydrophobicContact CD1-CD2 4.34Å; D28-L32 VanDerWaalsContact O-CB 3.28Å; D28-L32 WeakPolarHBondContact O-CB 3.34Å; D28-L32 PolarHBondContact O-N 3.44Å; Y30-L32 VanDerWaalsContact C-N 3.28Å; Y30-L32 PolarHBondContact O-N 2.74Å; L32-H34 VanDerWaalsContact C-N 3.3Å; L32-H34 PolarHBondContact O-N 2.97Å; L32-S35 WeakPolarHBondContact O-CB 3.43Å; L32-S35 PolarHBondContact O-N 2.99Å; L32-S35 VanDerWaalsContact O-N 3.1Å; L32-S35 PolarHBondContact O-OG 3.25Å; L32-Y36 HydrophobicContact CD1-CD2 4.03Å; L32-Y36 HydrophobicContact CD1-CE2 3.34Å; L32-Y36 HydrophobicContact CD2-CE2 3.98Å; L32-Y36 HydrophobicContact CG-CD2 3.88Å; L32-Y36 HydrophobicContact CG-CE2 3.4Å; L32-Y36 VanDerWaalsContact CG-CE2 3.4Å; L32-Y36 WeakPolarHBondContact O-CD2 3.43Å; L32-Y36 PolarHBondContact O-N 3.32Å; L32-Y36 VanDerWaalsContact O-N 3.1Å |
| 33 | A | 72.6 | Confident | 65.9 | Low | 47 Ų | 47 | 107.4 Ų | 107.4 | 39% | 0.388 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -59.7 | -38.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L29 Y30 S35 Y36 L37 | L29-A33 PolarHBondContact O-N 3.04Å; L29-A33 VanDerWaalsContact O-N 3.07Å; Y30-A33 PolarHBondContact O-N 3.09Å; A33-S35 VanDerWaalsContact C-N 3.3Å; A33-S35 PolarHBondContact O-N 3.23Å; A33-Y36 PolarHBondContact O-N 2.98Å; A33-L37 WeakPolarHBondContact O-CG 3.26Å; A33-L37 PolarHBondContact O-N 2.82Å |
| 34 | H | 65.7 | Low | 65.4 | Low | 105 Ų | 105 | 108.7 Ų | 108.7 | 49% | 0.486 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -66.9 | -32.4 | 177.1 | -72.8 | 67.4 | 0 | 0 | 0 | 112.1 | Y30 S31 L32 G38 | Y30-H34 AromaticContact CD1-CE1 3.03Å; Y30-H34 WeakPolarHBondContact CD1-CE1 3.45Å; Y30-H34 AromaticContact CD1-ND1 3.54Å; Y30-H34 AromaticContact CD1-NE2 3.91Å; Y30-H34 AromaticContact CE1-CE1 3.01Å; Y30-H34 WeakPolarHBondContact CE1-CE1 3.31Å; Y30-H34 AromaticContact CE1-ND1 3.98Å; Y30-H34 AromaticContact CE1-NE2 3.6Å; Y30-H34 AromaticContact CG-CE1 3.76Å; Y30-H34 AromaticContact CZ-CE1 3.71Å; Y30-H34 PolarHBondContact O-N 3Å; Y30-H34 PolarHBondContact O-ND1 3.29Å; S31-H34 PolarHBondContact O-N 3.5Å; L32-H34 VanDerWaalsContact C-N 3.3Å; L32-H34 PolarHBondContact O-N 2.97Å; H34-G38 PolarHBondContact O-N 3.25Å |
| 35 | S | 67.2 | Low | 64.5 | Low | 67 Ų | 67 | 110.2 Ų | 110.2 | 47% | 0.469 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -71.1 | -36.8 | 175.2 | 79.8 | 0 | 0 | 0 | 0 | 112.8 | S31 L32 A33 G38 R39 | S31-S35 PolarHBondContact O-N 3.26Å; S31-S35 VanDerWaalsContact O-N 3.08Å; L32-S35 WeakPolarHBondContact O-CB 3.43Å; L32-S35 PolarHBondContact O-N 2.99Å; L32-S35 VanDerWaalsContact O-N 3.1Å; L32-S35 PolarHBondContact O-OG 3.25Å; A33-S35 VanDerWaalsContact C-N 3.3Å; A33-S35 PolarHBondContact O-N 3.23Å; S35-G38 PolarHBondContact O-N 2.88Å; S35-R39 PolarHBondContact O-N 2.85Å |
| 36 | Y | 59.7 | Low | 63.4 | Low | 146 Ų | 146 | 111.7 Ų | 111.7 | 57% | 0.573 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -72.7 | -39.8 | 177.7 | -75 | -65.6 | 0 | 0 | 0 | 112.8 | L32 A33 G38 R39 | L32-Y36 HydrophobicContact CD1-CD2 4.03Å; L32-Y36 HydrophobicContact CD1-CE2 3.34Å; L32-Y36 HydrophobicContact CD2-CE2 3.98Å; L32-Y36 HydrophobicContact CG-CD2 3.88Å; L32-Y36 HydrophobicContact CG-CE2 3.4Å; L32-Y36 VanDerWaalsContact CG-CE2 3.4Å; L32-Y36 WeakPolarHBondContact O-CD2 3.43Å; L32-Y36 PolarHBondContact O-N 3.32Å; L32-Y36 VanDerWaalsContact O-N 3.1Å; A33-Y36 PolarHBondContact O-N 2.98Å; Y36-G38 PolarHBondContact O-N 3.26Å; Y36-R39 PolarHBondContact O-N 3.2Å |
| 37 | L | 60 | Low | 62.4 | Low | 126 Ų | 126 | 109.3 Ų | 109.3 | 66% | 0.66 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -63.5 | -27.5 | 173.2 | -68.3 | 174.6 | 0 | 0 | 0 | 112.2 | A33 R39 | A33-L37 WeakPolarHBondContact O-CG 3.26Å; A33-L37 PolarHBondContact O-N 2.82Å; L37-R39 VanDerWaalsContact C-N 3.34Å |
| 38 | G | 55.8 | Low | 61.4 | Low | 48 Ų | 48 | 111.6 Ų | 111.6 | 50% | 0.495 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -73.7 | -19.2 | 171.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | H34 S35 Y36 | H34-G38 PolarHBondContact O-N 3.25Å; S35-G38 PolarHBondContact O-N 2.88Å; Y36-G38 PolarHBondContact O-N 3.26Å |
| 39 | R | 51.8 | Low | 59.9 | Low | 213 Ų | 213 | 115.5 Ų | 115.5 | 80% | 0.804 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.5 | 3.5 | -174.4 | -157.1 | 168.4 | -158.8 | -90 | -0.8 | 114.6 | S35 Y36 L37 | S35-R39 PolarHBondContact O-N 2.85Å; Y36-R39 PolarHBondContact O-N 3.2Å; L37-R39 VanDerWaalsContact C-N 3.34Å |
| 40 | L | 47.4 | Very low | 58.6 | Low | 144 Ų | 144 | 117.4 Ų | 117.4 | 75% | 0.754 | 65% | 0.653 | S | S | * | * | trans | -96.4 | 6.6 | 169.4 | -75.3 | 171.3 | 0 | 0 | 0 | 113.4 | V42 | L40-V42 PolarHBondContact O-N 3.18Š| ||
| 41 | I | 53.6 | Low | 57.5 | Low | 138 Ų | 138 | 115.5 Ų | 115.5 | 71% | 0.708 | 66% | 0.66 | S | S | * | * | trans | -81.6 | 71 | 171.3 | -50.6 | 177.5 | 0 | 0 | 0 | 108.4 | P43 | I41-P43 WeakPolarHBondContact O-CD 3.44Š| ||
| 42 | V | 53 | Low | 56.1 | Low | 122 Ų | 122 | 115.9 Ų | 115.9 | 74% | 0.739 | 67% | 0.668 | S | S | * | * | trans | -75.6 | 117.6 | 157.7 | -167.1 | 0 | 0 | 0 | 0 | 105.5 | L40 L44 | L40-V42 PolarHBondContact O-N 3.18Å; V42-L44 PolarHBondContact O-N 2.72Å | ||
| 43 | P | 49.9 | Very low | 55 | Low | 111 Ų | 111 | 120 Ų | 120 | 72% | 0.721 | 69% | 0.689 | S | S | * | * | trans | -71.9 | 106.5 | 176.7 | 28.3 | -30 | 0 | 0 | 0 | 108.1 | I41 | I41-P43 WeakPolarHBondContact O-CD 3.44Š| ||
| 44 | L | 51.1 | Low | 54.2 | Low | 138 Ų | 138 | 124.2 Ų | 124.2 | 72% | 0.723 | 71% | 0.71 | S | S | * | * | trans | -48.6 | 129.6 | 158 | -175.3 | 70.9 | 0 | 0 | 0 | 107.8 | V42 T46 | V42-L44 PolarHBondContact O-N 2.72Å; L44-T46 VanDerWaalsContact C-N 3.3Å; L44-T46 PolarHBondContact O-N 2.99Å | ||
| 45 | P | 50.4 | Low | 53.5 | Low | 122 Ų | 122 | 124 Ų | 124 | 79% | 0.792 | 72% | 0.716 | S | S | * | * | trans | -70.3 | 91.1 | 178.9 | 28 | -32.9 | 0 | 0 | 0 | 109.1 | ||||
| 46 | T | 54.8 | Low | 52.9 | Low | 113 Ų | 113 | 123.9 Ų | 123.9 | 69% | 0.693 | 73% | 0.725 | S | S | * | * | trans | -78.8 | 124.8 | 172.9 | 52.3 | 0 | 0 | 0 | 0 | 109.4 | L44 | L44-T46 VanDerWaalsContact C-N 3.3Å; L44-T46 PolarHBondContact O-N 2.99Å | ||
| 47 | S | 51.7 | Low | 52.9 | Low | 102 Ų | 102 | 119.3 Ų | 119.3 | 71% | 0.713 | 72% | 0.723 | S | S | * | * | trans | -32.6 | 150.4 | 178.4 | -48.2 | 0 | 0 | 0 | 0 | 116.9 | L49 | S47-L49 PolarHBondContact O-N 3.48Š| ||
| 48 | P | 51.9 | Low | 52.9 | Low | 125 Ų | 125 | 116.4 Ų | 116.4 | 81% | 0.812 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -85.3 | 76 | -167 | 35.9 | -35.9 | 0 | 0 | 0 | 112.2 | ||
| 49 | L | 50.7 | Low | 53.1 | Low | 165 Ų | 165 | 116.3 Ų | 116.3 | 86% | 0.864 | 72% | 0.723 | S | S | * | * | trans | -147.1 | 39.2 | 172.1 | -70.2 | -179.2 | 0 | 0 | 0 | 115 | S47 | S47-L49 PolarHBondContact O-N 3.48Š| ||
| 50 | T | 54.5 | Low | 53.8 | Low | 128 Ų | 128 | 115.7 Ų | 115.7 | 79% | 0.785 | 72% | 0.72 | S | S | * | * | trans | -122.9 | 120.7 | 172.6 | 22.7 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 51 | P | 50.3 | Low | 54.7 | Low | 121 Ų | 121 | 119.3 Ų | 119.3 | 79% | 0.786 | 73% | 0.73 | S | S | * | * | trans | -76.7 | 132.4 | -179.9 | 30.8 | -31.3 | 0 | 0 | 0 | 111 | ||||
| 52 | A | 49.1 | Very low | 55.3 | Low | 86 Ų | 86 | 116.3 Ų | 116.3 | 71% | 0.711 | 73% | 0.733 | S | S | * | * | trans | 53.1 | 95.7 | 142.4 | 0 | 0 | 0 | 0 | 0 | 118.3 | V54 | A52-V54 PolarHBondContact O-N 3.4Å; A52-V54 VanDerWaalsContact O-N 3.17Å | ||
| 53 | L | 54.7 | Low | 55.7 | Low | 153 Ų | 153 | 116.8 Ų | 116.8 | 80% | 0.801 | 72% | 0.722 | S | S | * | * | 3.5 | 97.2 | 128.3 | -170.3 | 73 | 0 | 0 | 0 | 115.7 | T55 | L53-T55 WeakPolarHBondContact CD1-OG1 3.37Š| |||
| 54 | V | 55.6 | Low | 56.7 | Low | 136 Ų | 136 | 115 Ų | 115 | 82% | 0.824 | 71% | 0.709 | S | S | * | * | trans | -111.7 | 83.8 | 151.4 | 162.6 | 0 | 0 | 0 | 0 | 107.9 | A52 G56 | A52-V54 PolarHBondContact O-N 3.4Å; A52-V54 VanDerWaalsContact O-N 3.17Å; V54-G56 PolarHBondContact O-N 2.76Å; V54-G56 VanDerWaalsContact O-N 3.16Å | ||
| 55 | T | 50.4 | Low | 57.3 | Low | 99 Ų | 99 | 114.6 Ų | 114.6 | 61% | 0.607 | 70% | 0.701 | S | S | * | * | trans | -83.4 | 63.5 | 155.8 | 6.5 | 0 | 0 | 0 | 0 | 108.8 | L53 G57 K65 | L53-T55 WeakPolarHBondContact CD1-OG1 3.37Å; T55-G57 PolarHBondContact O-N 3.08Å; T55-G57 VanDerWaalsContact O-N 3.15Å; T55-K65 PolarHBondContact O-NZ 3.11Å | ||
| 56 | G | 55.3 | Low | 58 | Low | 65 Ų | 65 | 119.2 Ų | 119.2 | 67% | 0.67 | 70% | 0.703 | S | S | * | * | trans | -83.1 | 42.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | V54 G58 | V54-G56 PolarHBondContact O-N 2.76Å; V54-G56 VanDerWaalsContact O-N 3.16Å; G56-G58 PolarHBondContact O-N 3.14Å | ||
| 57 | G | 58.3 | Low | 58.4 | Low | 51 Ų | 51 | 117.8 Ų | 117.8 | 53% | 0.526 | 69% | 0.688 | S | S | . | * | trans | -73.5 | 119.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | T55 K65 | T55-G57 PolarHBondContact O-N 3.08Å; T55-G57 VanDerWaalsContact O-N 3.15Å; G57-K65 VanDerWaalsContact O-CE 3.27Å; G57-K65 WeakPolarHBondContact O-CE 3.43Å | ||
| 58 | G | 61.3 | Low | 59 | Low | 65 Ų | 65 | 114.4 Ų | 114.4 | 67% | 0.67 | 67% | 0.666 | S | S | * | * | S | Bend | trans | 82 | 47 | 145.6 | 0 | 0 | 0 | 0 | 0 | 117.9 | G56 | G56-G58 PolarHBondContact O-N 3.14Š|
| 59 | G | 58.9 | Low | 59.6 | Low | 46 Ų | 46 | 111.3 Ų | 111.3 | 47% | 0.474 | 65% | 0.651 | S | S | . | * | trans | -142.7 | 124.6 | 168.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | K61 | G59-K61 PolarHBondContact O-N 3.12Š| ||
| 60 | R | 66.4 | Low | 60.3 | Low | 199 Ų | 199 | 105.5 Ų | 105.5 | 75% | 0.751 | 63% | 0.627 | S | S | * | * | trans | -55.7 | 139.7 | 164.1 | -62 | -178.5 | -168 | -136.4 | -0.4 | 107.3 | G62 R63 | R60-G62 PolarHBondContact O-N 3.4Å; R60-R63 PolarHBondContact O-N 2.8Å | ||
| 61 | K | 66.1 | Low | 60.9 | Low | 221 Ų | 221 | 104.9 Ų | 104.9 | 96% | 0.961 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -44.7 | 112.3 | -178.7 | -170 | 171.6 | -179 | 178 | 0 | 110.1 | G59 | G59-K61 PolarHBondContact O-N 3.12Š|
| 62 | G | 66.5 | Low | 61.7 | Low | 75 Ų | 75 | 101.9 Ų | 101.9 | 77% | 0.773 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 102.9 | -8.5 | -178.8 | 0 | 0 | 0 | 0 | 0 | 117.1 | R60 | R60-G62 PolarHBondContact O-N 3.4Š|
| 63 | R | 61.2 | Low | 62.6 | Low | 131 Ų | 131 | 103.9 Ų | 103.9 | 49% | 0.494 | 60% | 0.597 | S | S | . | * | trans | -95.3 | 122.3 | 171.1 | -71.4 | -171 | -170.3 | 162.7 | 3.2 | 110.8 | R60 E67 | R60-R63 PolarHBondContact O-N 2.8Å; R63-E67 HydrophobicContact CB-CB 4.49Å | ||
| 64 | T | 70.6 | Confident | 63.2 | Low | 74 Ų | 74 | 105.1 Ų | 105.1 | 45% | 0.454 | 59% | 0.592 | S | S | . | * | trans | -62.4 | 147.6 | 170.4 | 61.7 | 0 | 0 | 0 | 0 | 109.8 | R66 E67 A68 | T64-R66 PolarHBondContact O-N 2.96Å; T64-E67 WeakPolarHBondContact O-CB 3.39Å; T64-E67 PolarHBondContact O-N 3.19Å; T64-E67 WeakPolarHBondContact OG1-CG 3.36Å; T64-E67 PolarHBondContact OG1-N 3Å; T64-E67 PolarHBondContact OG1-OE1 2.85Å; T64-A68 PolarHBondContact O-N 2.79Å | ||
| 65 | K | 65.3 | Low | 63.7 | Low | 130 Ų | 130 | 105 Ų | 105 | 57% | 0.565 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -53.2 | -28.8 | 174.8 | -68.6 | 177.8 | 179.5 | 175.9 | 0 | 111.6 | T55 G57 A68 A69 | T55-K65 PolarHBondContact O-NZ 3.11Å; G57-K65 VanDerWaalsContact O-CE 3.27Å; G57-K65 WeakPolarHBondContact O-CE 3.43Å; K65-A68 PolarHBondContact O-N 2.95Å; K65-A69 WeakPolarHBondContact O-CB 3.29Å; K65-A69 PolarHBondContact O-N 3.25Å |
| 66 | R | 65.3 | Low | 64.2 | Low | 219 Ų | 219 | 102.8 Ų | 102.8 | 83% | 0.826 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -64.6 | -46.7 | 173.1 | -172.5 | 177.6 | -177.9 | 176.7 | 0.9 | 112.9 | T64 A68 A69 A70 | T64-R66 PolarHBondContact O-N 2.96Å; R66-A68 VanDerWaalsContact C-N 3.32Å; R66-A69 PolarHBondContact O-N 3.4Å; R66-A70 WeakPolarHBondContact O-CB 3.29Å; R66-A70 PolarHBondContact O-N 3.02Å |
| 67 | E | 62.2 | Low | 64.5 | Low | 83 Ų | 83 | 104.7 Ų | 104.7 | 39% | 0.388 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -65.4 | -36.3 | 174.7 | -75.9 | 160.5 | -127.3 | 0 | 0 | 112.2 | R63 T64 A70 N71 | R63-E67 HydrophobicContact CB-CB 4.49Å; T64-E67 WeakPolarHBondContact O-CB 3.39Å; T64-E67 PolarHBondContact O-N 3.19Å; T64-E67 WeakPolarHBondContact OG1-CG 3.36Å; T64-E67 PolarHBondContact OG1-N 3Å; T64-E67 PolarHBondContact OG1-OE1 2.85Å; E67-A70 PolarHBondContact O-N 3.47Å; E67-N71 WeakPolarHBondContact O-CB 3.31Å; E67-N71 PolarHBondContact O-N 2.86Å; E67-N71 PolarHBondContact O-ND2 3.14Å |
| 68 | A | 63.8 | Low | 65.4 | Low | 30 Ų | 30 | 104 Ų | 104 | 25% | 0.248 | 58% | 0.575 | C | S | . | * | H | α-helix | trans | -64.8 | -46.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | T64 K65 R66 A70 N71 T72 | T64-A68 PolarHBondContact O-N 2.79Å; K65-A68 PolarHBondContact O-N 2.95Å; R66-A68 VanDerWaalsContact C-N 3.32Å; A68-A70 PolarHBondContact O-N 3.48Å; A68-N71 CarbonylContact O-C 3.26Å; A68-N71 VanDerWaalsContact O-C 3.26Å; A68-N71 PolarHBondContact O-N 2.75Å; A68-T72 WeakPolarHBondContact O-CG2 3.39Å; A68-T72 PolarHBondContact O-N 3.26Å; A68-T72 VanDerWaalsContact O-N 3.14Å |
| 69 | A | 65.2 | Low | 66.4 | Low | 60 Ų | 60 | 101.3 Ų | 101.3 | 50% | 0.496 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -59.7 | -43.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | K65 R66 N71 T72 | K65-A69 WeakPolarHBondContact O-CB 3.29Å; K65-A69 PolarHBondContact O-N 3.25Å; R66-A69 PolarHBondContact O-N 3.4Å; A69-N71 VanDerWaalsContact C-N 3.29Å; A69-N71 PolarHBondContact O-N 3.3Å; A69-T72 PolarHBondContact O-N 2.71Å; A69-T72 PolarHBondContact O-OG1 2.63Å |
| 70 | A | 66.3 | Low | 67.7 | Low | 44 Ų | 44 | 104.2 Ų | 104.2 | 36% | 0.364 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -66.8 | -28.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | R66 E67 A68 R82 | R66-A70 WeakPolarHBondContact O-CB 3.29Å; R66-A70 PolarHBondContact O-N 3.02Å; E67-A70 PolarHBondContact O-N 3.47Å; A68-A70 PolarHBondContact O-N 3.48Å; A70-R82 PolarHBondContact O-NH1 2.86Å; A70-R82 PolarHBondContact O-NH2 2.98Å |
| 71 | N | 66.3 | Low | 68.7 | Low | 114 Ų | 114 | 100.7 Ų | 100.7 | 61% | 0.61 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.5 | 31 | 176.2 | -69 | -75.8 | 0 | 0 | 0 | 112.5 | E67 A68 A69 | E67-N71 WeakPolarHBondContact O-CB 3.31Å; E67-N71 PolarHBondContact O-N 2.86Å; E67-N71 PolarHBondContact O-ND2 3.14Å; A68-N71 CarbonylContact O-C 3.26Å; A68-N71 VanDerWaalsContact O-C 3.26Å; A68-N71 PolarHBondContact O-N 2.75Å; A69-N71 VanDerWaalsContact C-N 3.29Å; A69-N71 PolarHBondContact O-N 3.3Å |
| 72 | T | 67.9 | Low | 69.8 | Low | 59 Ų | 59 | 96.1 Ų | 96.1 | 36% | 0.362 | 52% | 0.517 | S | S | . | . | trans | -77.3 | 133.5 | 171.8 | 47.3 | 0 | 0 | 0 | 0 | 110.2 | A68 A69 R74 | A68-T72 WeakPolarHBondContact O-CG2 3.39Å; A68-T72 PolarHBondContact O-N 3.26Å; A68-T72 VanDerWaalsContact O-N 3.14Å; A69-T72 PolarHBondContact O-N 2.71Å; A69-T72 PolarHBondContact O-OG1 2.63Å; T72-R74 PolarHBondContact O-N 2.89Å | ||
| 73 | N | 66.1 | Low | 70.8 | Confident | 127 Ų | 127 | 96.5 Ų | 96.5 | 68% | 0.679 | 50% | 0.498 | S | S | * | . | trans | -72.2 | 48.8 | 166.9 | -73.1 | -60.8 | 0 | 0 | 0 | 110.6 | K83 | N73-K83 VanDerWaalsContact OD1-CD 3.29Å; N73-K83 WeakPolarHBondContact OD1-CD 3.37Å; N73-K83 WeakPolarHBondContact OD1-CE 3.35Å; N73-K83 PolarHBondContact OD1-NZ 2.68Å | ||
| 74 | R | 67.6 | Low | 72.2 | Confident | 180 Ų | 180 | 94.8 Ų | 94.8 | 68% | 0.679 | 50% | 0.498 | S | S | * | . | trans | -81.1 | 139.3 | 177.4 | -135.8 | 143.1 | -170.8 | 177.7 | 0.3 | 108.4 | T72 S76 | T72-R74 PolarHBondContact O-N 2.89Å; R74-S76 PolarHBondContact O-N 2.86Å | ||
| 75 | P | 67.2 | Low | 73.1 | Confident | 133 Ų | 133 | 95 Ų | 95 | 86% | 0.864 | 50% | 0.499 | S | S | * | . | S | Bend | trans | -74.8 | 56.1 | 173.1 | 34 | -35.7 | 0 | 0 | 0 | 109.6 | ||
| 76 | S | 60.9 | Low | 74.4 | Confident | 53 Ų | 53 | 92 Ų | 92 | 37% | 0.371 | 49% | 0.491 | S | S | . | . | trans | -103.7 | 142 | 166.6 | 66.7 | 0 | 0 | 0 | 0 | 108 | R74 G78 G79 H80 | R74-S76 PolarHBondContact O-N 2.86Å; S76-G78 VanDerWaalsContact C-N 3.34Å; S76-G78 PolarHBondContact O-N 3.3Å; S76-G79 PolarHBondContact O-N 3.04Å; S76-H80 PolarHBondContact O-N 3.45Å; S76-H80 VanDerWaalsContact O-N 3.08Å | ||
| 77 | P | 62.3 | Low | 75.8 | Confident | 105 Ų | 105 | 87.3 Ų | 87.3 | 68% | 0.682 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -54.3 | -47.3 | -169.9 | 17 | -30.4 | 0 | 0 | 0 | 112.6 | G79 H80 E81 | P77-G79 VanDerWaalsContact C-N 3.33Å; P77-G79 PolarHBondContact O-N 3Å; P77-H80 PolarHBondContact O-N 2.81Å; P77-E81 PolarHBondContact O-N 3.28Å |
| 78 | G | 76.4 | Confident | 77.3 | Confident | 35 Ų | 35 | 88.3 Ų | 88.3 | 36% | 0.361 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -71 | -20.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | S76 R82 | S76-G78 VanDerWaalsContact C-N 3.34Å; S76-G78 PolarHBondContact O-N 3.3Å; G78-R82 WeakPolarHBondContact O-CG 3.12Å; G78-R82 PolarHBondContact O-NE 3.44Å |
| 79 | G | 82.7 | Confident | 78.8 | Confident | 10 Ų | 10 | 91.1 Ų | 91.1 | 10% | 0.103 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -77 | -38.7 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | S76 P77 K83 | S76-G79 PolarHBondContact O-N 3.04Å; P77-G79 VanDerWaalsContact C-N 3.33Å; P77-G79 PolarHBondContact O-N 3Å; G79-K83 PolarHBondContact O-N 3.46Å |
| 80 | H | 84.9 | Confident | 80.2 | Confident | 107 Ų | 107 | 92.1 Ų | 92.1 | 50% | 0.495 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.8 | -48 | -179.9 | -171.7 | 78.3 | 0 | 0 | 0 | 112 | S76 P77 K83 L84 | S76-H80 PolarHBondContact O-N 3.45Å; S76-H80 VanDerWaalsContact O-N 3.08Å; P77-H80 PolarHBondContact O-N 2.81Å; H80-K83 WeakPolarHBondContact O-CB 3.46Å; H80-K83 PolarHBondContact O-N 2.75Å; H80-L84 PolarHBondContact O-N 2.68Å |
| 81 | E | 88.2 | Confident | 81.5 | Confident | 124 Ų | 124 | 93.7 Ų | 93.7 | 58% | 0.579 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.9 | -47.9 | 178.8 | -67.6 | 168.8 | -179.3 | 0 | 0 | 112.2 | P77 K83 L84 V85 | P77-E81 PolarHBondContact O-N 3.28Å; E81-K83 PolarHBondContact O-N 2.95Å; E81-L84 PolarHBondContact O-N 2.85Å; E81-L84 VanDerWaalsContact O-N 3.07Å; E81-V85 WeakPolarHBondContact O-CG2 3.04Å; E81-V85 PolarHBondContact O-N 3.05Å |
| 82 | R | 88.4 | Confident | 82.8 | Confident | 125 Ų | 125 | 92.9 Ų | 92.9 | 47% | 0.472 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -57.2 | -37.6 | 176.4 | -74.4 | -177.2 | -68.7 | 147.6 | 3.6 | 112 | A70 G78 T86 | A70-R82 PolarHBondContact O-NH1 2.86Å; A70-R82 PolarHBondContact O-NH2 2.98Å; G78-R82 WeakPolarHBondContact O-CG 3.12Å; G78-R82 PolarHBondContact O-NE 3.44Å; R82-T86 VanDerWaalsContact O-CB 3.29Å; R82-T86 WeakPolarHBondContact O-CB 3.49Å; R82-T86 PolarHBondContact O-N 2.9Å; R82-T86 PolarHBondContact O-OG1 3.07Å |
| 83 | K | 88.3 | Confident | 84 | Confident | 83 Ų | 83 | 98 Ų | 98 | 36% | 0.361 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.8 | -43.2 | 175.9 | -177.9 | -178.9 | -178.5 | 173.7 | 0 | 112 | N73 G79 H80 E81 T86 K87 | N73-K83 VanDerWaalsContact OD1-CD 3.29Å; N73-K83 WeakPolarHBondContact OD1-CD 3.37Å; N73-K83 WeakPolarHBondContact OD1-CE 3.35Å; N73-K83 PolarHBondContact OD1-NZ 2.68Å; G79-K83 PolarHBondContact O-N 3.46Å; H80-K83 WeakPolarHBondContact O-CB 3.46Å; H80-K83 PolarHBondContact O-N 2.75Å; E81-K83 PolarHBondContact O-N 2.95Å; K83-T86 PolarHBondContact O-N 2.95Å; K83-K87 WeakPolarHBondContact O-CB 3.34Å; K83-K87 WeakPolarHBondContact O-CG 3.46Å; K83-K87 PolarHBondContact O-N 2.89Å |
| 84 | L | 89.6 | Confident | 85.3 | Confident | 95 Ų | 95 | 100 Ų | 100 | 50% | 0.497 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.9 | -49.1 | 177 | -68.9 | 178.5 | 0 | 0 | 0 | 111.1 | H80 E81 T86 K87 L88 | H80-L84 PolarHBondContact O-N 2.68Å; E81-L84 PolarHBondContact O-N 2.85Å; E81-L84 VanDerWaalsContact O-N 3.07Å; L84-T86 VanDerWaalsContact C-N 3.34Å; L84-T86 PolarHBondContact O-N 2.98Å; L84-K87 PolarHBondContact O-N 3.33Å; L84-L88 PolarHBondContact O-N 2.67Å |
| 85 | V | 90.8 | Very high | 86.4 | Confident | 80 Ų | 80 | 98.2 Ų | 98.2 | 49% | 0.485 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.9 | -45.9 | 177.9 | 174.4 | 0 | 0 | 0 | 0 | 111.2 | E81 K87 L88 Q89 | E81-V85 WeakPolarHBondContact O-CG2 3.04Å; E81-V85 PolarHBondContact O-N 3.05Å; V85-K87 PolarHBondContact O-N 2.89Å; V85-L88 PolarHBondContact O-N 2.97Å; V85-Q89 WeakPolarHBondContact O-CG 3.22Å; V85-Q89 PolarHBondContact O-N 2.9Å |
| 86 | T | 92.2 | Very high | 87.4 | Confident | 65 Ų | 65 | 100.8 Ų | 100.8 | 40% | 0.399 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.4 | -41.3 | 179.8 | -58.5 | 0 | 0 | 0 | 0 | 112.1 | R82 K83 L84 L88 Q89 N90 | R82-T86 VanDerWaalsContact O-CB 3.29Å; R82-T86 WeakPolarHBondContact O-CB 3.49Å; R82-T86 PolarHBondContact O-N 2.9Å; R82-T86 PolarHBondContact O-OG1 3.07Å; K83-T86 PolarHBondContact O-N 2.95Å; L84-T86 VanDerWaalsContact C-N 3.34Å; L84-T86 PolarHBondContact O-N 2.98Å; T86-L88 VanDerWaalsContact C-N 3.34Å; T86-L88 PolarHBondContact O-N 3.18Å; T86-Q89 PolarHBondContact O-N 3.31Å; T86-N90 WeakPolarHBondContact O-CB 3.33Å; T86-N90 VanDerWaalsContact O-CG 3.23Å; T86-N90 PolarHBondContact O-N 3.36Å; T86-N90 PolarHBondContact O-ND2 3.43Å |
| 87 | K | 93.8 | Very high | 88.5 | Confident | 121 Ų | 121 | 100.5 Ų | 100.5 | 53% | 0.526 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.8 | -40.8 | 176.1 | -81.1 | -175.6 | 173.3 | -169.9 | 0 | 112 | K83 L84 V85 S91 | K83-K87 WeakPolarHBondContact O-CB 3.34Å; K83-K87 WeakPolarHBondContact O-CG 3.46Å; K83-K87 PolarHBondContact O-N 2.89Å; L84-K87 PolarHBondContact O-N 3.33Å; V85-K87 PolarHBondContact O-N 2.89Å; K87-S91 WeakPolarHBondContact O-CB 3.35Å; K87-S91 PolarHBondContact O-N 2.93Å; K87-S91 PolarHBondContact O-OG 2.67Å |
| 88 | L | 94.7 | Very high | 89.1 | Confident | 105 Ų | 105 | 99.5 Ų | 99.5 | 55% | 0.55 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.8 | -54.6 | 176.6 | 178.3 | 62.5 | 0 | 0 | 0 | 110.5 | L84 V85 T86 N90 S91 E92 | L84-L88 PolarHBondContact O-N 2.67Å; V85-L88 PolarHBondContact O-N 2.97Å; T86-L88 VanDerWaalsContact C-N 3.34Å; T86-L88 PolarHBondContact O-N 3.18Å; L88-N90 VanDerWaalsContact C-N 3.31Å; L88-N90 PolarHBondContact O-N 2.98Å; L88-S91 WeakPolarHBondContact O-CB 3.33Å; L88-S91 PolarHBondContact O-N 3.15Å; L88-S91 VanDerWaalsContact O-N 3.09Å; L88-E92 HydrophobicContact CD1-CG 4.47Å; L88-E92 WeakPolarHBondContact O-CG 3.28Å; L88-E92 PolarHBondContact O-N 3.36Å |
| 89 | Q | 94.7 | Very high | 88.6 | Confident | 89 Ų | 89 | 107.7 Ų | 107.7 | 42% | 0.416 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -57.5 | -41.8 | 179.5 | -70.2 | 179.3 | -9.6 | 0 | 0 | 112.7 | V85 T86 E92 R93 | V85-Q89 WeakPolarHBondContact O-CG 3.22Å; V85-Q89 PolarHBondContact O-N 2.9Å; T86-Q89 PolarHBondContact O-N 3.31Å; Q89-E92 PolarHBondContact O-N 3.08Å; Q89-R93 WeakPolarHBondContact O-CB 3.03Å; Q89-R93 VanDerWaalsContact O-CG 3.26Å; Q89-R93 WeakPolarHBondContact O-CG 3.01Å; Q89-R93 PolarHBondContact O-N 3.1Å |
| 90 | N | 94.4 | Very high | 87.4 | Confident | 81 Ų | 81 | 120.6 Ų | 120.6 | 43% | 0.433 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -66.4 | -40.1 | 177.3 | -73.3 | -24.2 | 0 | 0 | 0 | 112.3 | T86 L88 R93 K94 | T86-N90 WeakPolarHBondContact O-CB 3.33Å; T86-N90 VanDerWaalsContact O-CG 3.23Å; T86-N90 PolarHBondContact O-N 3.36Å; T86-N90 PolarHBondContact O-ND2 3.43Å; L88-N90 VanDerWaalsContact C-N 3.31Å; L88-N90 PolarHBondContact O-N 2.98Å; N90-R93 PolarHBondContact O-N 3.43Å; N90-K94 VanDerWaalsContact O-CB 3.31Å; N90-K94 WeakPolarHBondContact O-CB 3.49Å; N90-K94 PolarHBondContact O-N 3.1Å |
| 91 | S | 93.8 | Very high | 87.5 | Confident | 76 Ų | 76 | 121.3 Ų | 121.3 | 53% | 0.531 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.6 | -42.6 | 176.3 | -58.8 | 0 | 0 | 0 | 0 | 111.2 | K87 L88 K94 K95 | K87-S91 WeakPolarHBondContact O-CB 3.35Å; K87-S91 PolarHBondContact O-N 2.93Å; K87-S91 PolarHBondContact O-OG 2.67Å; L88-S91 WeakPolarHBondContact O-CB 3.33Å; L88-S91 PolarHBondContact O-N 3.15Å; L88-S91 VanDerWaalsContact O-N 3.09Å; S91-K94 PolarHBondContact O-N 3.16Å; S91-K95 WeakPolarHBondContact O-CB 3.36Å; S91-K95 PolarHBondContact O-N 3.27Å |
| 92 | E | 94.1 | Very high | 87.5 | Confident | 98 Ų | 98 | 121.2 Ų | 121.2 | 46% | 0.458 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -64.4 | -45.5 | 175.5 | -70.9 | -174.9 | 165.9 | 0 | 0 | 112.5 | L88 Q89 K94 K95 R96 | L88-E92 HydrophobicContact CD1-CG 4.47Å; L88-E92 WeakPolarHBondContact O-CG 3.28Å; L88-E92 PolarHBondContact O-N 3.36Å; Q89-E92 PolarHBondContact O-N 3.08Å; E92-K94 VanDerWaalsContact C-N 3.33Å; E92-K94 PolarHBondContact O-N 3.37Å; E92-K95 PolarHBondContact O-N 3.04Å; E92-R96 WeakPolarHBondContact O-CG 3.27Å; E92-R96 PolarHBondContact O-N 3.31Å |
| 93 | R | 93.3 | Very high | 87.4 | Confident | 166 Ų | 166 | 120.9 Ų | 120.9 | 63% | 0.626 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -60.3 | -43.6 | 175.5 | -73.8 | 172.1 | -178.7 | 177.2 | 0.5 | 111.3 | Q89 N90 R96 G97 | Q89-R93 WeakPolarHBondContact O-CB 3.03Å; Q89-R93 VanDerWaalsContact O-CG 3.26Å; Q89-R93 WeakPolarHBondContact O-CG 3.01Å; Q89-R93 PolarHBondContact O-N 3.1Å; N90-R93 PolarHBondContact O-N 3.43Å; R93-R96 PolarHBondContact O-N 3.17Å; R93-G97 PolarHBondContact O-N 3.01Å |
| 94 | K | 92.4 | Very high | 87.4 | Confident | 168 Ų | 168 | 123.2 Ų | 123.2 | 73% | 0.73 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -63.9 | -42.3 | 176 | -171.9 | 175.5 | -179.7 | -179.8 | 0 | 111.6 | N90 S91 E92 R96 G97 A98 | N90-K94 VanDerWaalsContact O-CB 3.31Å; N90-K94 WeakPolarHBondContact O-CB 3.49Å; N90-K94 PolarHBondContact O-N 3.1Å; S91-K94 PolarHBondContact O-N 3.16Å; E92-K94 VanDerWaalsContact C-N 3.33Å; E92-K94 PolarHBondContact O-N 3.37Å; K94-R96 VanDerWaalsContact C-N 3.34Å; K94-R96 PolarHBondContact O-N 2.98Å; K94-G97 PolarHBondContact O-N 3.35Å; K94-A98 VanDerWaalsContact O-CB 3.31Å; K94-A98 WeakPolarHBondContact O-CB 3.14Å; K94-A98 PolarHBondContact O-N 2.8Å |
| 95 | K | 92.3 | Very high | 87.3 | Confident | 143 Ų | 143 | 124.9 Ų | 124.9 | 62% | 0.622 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -63.3 | -37.6 | 175.3 | -174.7 | 176.7 | -178.7 | 178.1 | 0 | 112.3 | S91 E92 R99 | S91-K95 WeakPolarHBondContact O-CB 3.36Å; S91-K95 PolarHBondContact O-N 3.27Å; E92-K95 PolarHBondContact O-N 3.04Å; K95-R99 WeakPolarHBondContact O-CD 3.45Å; K95-R99 VanDerWaalsContact O-CG 3.23Å; K95-R99 WeakPolarHBondContact O-CG 3.12Å; K95-R99 PolarHBondContact O-N 3.31Å |
| 96 | R | 88.1 | Confident | 87 | Confident | 187 Ų | 187 | 127.9 Ų | 127.9 | 71% | 0.706 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -71.2 | -41.4 | 175 | -71.3 | 176 | -176.1 | -127.3 | 3.9 | 112.1 | E92 R93 K94 R99 | E92-R96 WeakPolarHBondContact O-CG 3.27Å; E92-R96 PolarHBondContact O-N 3.31Å; R93-R96 PolarHBondContact O-N 3.17Å; K94-R96 VanDerWaalsContact C-N 3.34Å; K94-R96 PolarHBondContact O-N 2.98Å; R96-R99 PolarHBondContact O-N 2.93Å |
| 97 | G | 84 | Confident | 86.7 | Confident | 48 Ų | 48 | 132.4 Ų | 132.4 | 50% | 0.495 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -68.5 | -33.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | R93 K94 R99 | R93-G97 PolarHBondContact O-N 3.01Å; K94-G97 PolarHBondContact O-N 3.35Å; G97-R99 VanDerWaalsContact C-N 3.29Å; G97-R99 PolarHBondContact O-N 3Å |
| 98 | A | 73.2 | Confident | 86.1 | Confident | 83 Ų | 83 | 133.3 Ų | 133.3 | 69% | 0.686 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.4 | -9.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | K94 | K94-A98 VanDerWaalsContact O-CB 3.31Å; K94-A98 WeakPolarHBondContact O-CB 3.14Å; K94-A98 PolarHBondContact O-N 2.8Å |
| 99 | R | 67.6 | Low | 85.4 | Confident | 207 Ų | 207 | 135.7 Ų | 135.7 | 78% | 0.781 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.1 | -1.4 | 175.7 | -72.6 | 176 | 107.9 | -174.5 | 5.3 | 112.8 | K95 R96 G97 | K95-R99 WeakPolarHBondContact O-CD 3.45Å; K95-R99 VanDerWaalsContact O-CG 3.23Å; K95-R99 WeakPolarHBondContact O-CG 3.12Å; K95-R99 PolarHBondContact O-N 3.31Å; R96-R99 PolarHBondContact O-N 2.93Å; G97-R99 VanDerWaalsContact C-N 3.29Å; G97-R99 PolarHBondContact O-N 3Å |
| 100 | R | 56.9 | Low | 84.6 | Confident | 282 Ų | 282 | 139.9 Ų | 139.9 | 100% | 1.064 | 65% | 0.648 | S | S | * | * | trans | -100.3 | 0 | 170.4 | -77 | -175.8 | 164.2 | -164.8 | -5.2 | 108.5 |
Retrieved 100 of 100 residues in 16.4 ms
(Link to these results)