| 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 | 37.2 | Very low | 45.8 | Very low | 252 Ų | 252 | 137.1 Ų | 137.1 | 100% | 1.241 | 86% | 0.862 | S | S | * | * | 0 | 139.9 | 0 | -74.3 | 179.9 | 177.8 | 0 | 0 | 108 | |||||
| 2 | A | 36.1 | Very low | 46.3 | Very low | 105 Ų | 105 | 135.8 Ų | 135.8 | 87% | 0.868 | 85% | 0.851 | S | S | * | * | trans | -91.5 | 160.2 | -145.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 3 | S | 40.7 | Very low | 46.3 | Very low | 118 Ų | 118 | 134.7 Ų | 134.7 | 83% | 0.825 | 85% | 0.847 | S | S | * | * | trans | -31.2 | 129.4 | 171.6 | -152.3 | 0 | 0 | 0 | 0 | 116.2 | G5 | S3-G5 PolarHBondContact O-N 2.88Š| ||
| 4 | L | 49.7 | Very low | 46.6 | Very low | 179 Ų | 179 | 134.2 Ų | 134.2 | 94% | 0.937 | 84% | 0.842 | S | S | * | * | trans | -81.9 | 96.9 | 167.5 | -164.3 | 66.7 | 0 | 0 | 0 | 108.4 | ||||
| 5 | G | 44.7 | Very low | 47.2 | Very low | 64 Ų | 64 | 136.7 Ų | 136.7 | 66% | 0.66 | 84% | 0.84 | S | S | * | * | trans | -66.1 | 130.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | S3 G7 | S3-G5 PolarHBondContact O-N 2.88Å; G5-G7 PolarHBondContact O-N 3.25Å | ||
| 6 | S | 51.6 | Low | 47.5 | Very low | 131 Ų | 131 | 134.8 Ų | 134.8 | 92% | 0.916 | 83% | 0.833 | S | S | * | * | trans | -50.5 | 115.8 | 165.6 | -179.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 7 | G | 46.1 | Very low | 47.8 | Very low | 70 Ų | 70 | 133.9 Ų | 133.9 | 72% | 0.722 | 83% | 0.827 | S | S | * | * | trans | -128.1 | 96.4 | 167.1 | 0 | 0 | 0 | 0 | 0 | 107.5 | G5 | G5-G7 PolarHBondContact O-N 3.25Š| ||
| 8 | N | 53.8 | Low | 48.6 | Very low | 142 Ų | 142 | 130.2 Ų | 130.2 | 76% | 0.759 | 81% | 0.813 | S | S | * | * | 78.2 | 93.8 | 86.8 | -163.7 | 31.9 | 0 | 0 | 0 | 112.7 | S10 | N8-S10 PolarHBondContact O-N 3.09Š| |||
| 9 | W | 43.6 | Very low | 49.2 | Very low | 251 Ų | 251 | 129.5 Ų | 129.5 | 95% | 0.951 | 81% | 0.81 | S | S | * | * | trans | -9.9 | 104.2 | 159.7 | -55.1 | 78.9 | 0 | 0 | 0 | 115.6 | ||||
| 10 | S | 49.3 | Very low | 49.4 | Very low | 126 Ų | 126 | 131.4 Ų | 131.4 | 88% | 0.881 | 81% | 0.811 | S | S | * | * | trans | -71.8 | 121.3 | 161.3 | 44.3 | 0 | 0 | 0 | 0 | 110.3 | N8 | N8-S10 PolarHBondContact O-N 3.09Š| ||
| 11 | G | 50.9 | Low | 49.9 | Very low | 70 Ų | 70 | 130.2 Ų | 130.2 | 72% | 0.722 | 81% | 0.805 | S | S | * | * | trans | 156.5 | 81.3 | 166 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 12 | V | 52.3 | Low | 50.9 | Low | 121 Ų | 121 | 128.5 Ų | 128.5 | 73% | 0.733 | 79% | 0.785 | S | S | * | * | trans | 20.8 | 116.7 | 152 | -169 | 0 | 0 | 0 | 0 | 117.4 | T14 | V12-T14 PolarHBondContact O-N 3.13Å; V12-T14 VanDerWaalsContact O-N 3.14Å | ||
| 13 | P | 46.3 | Very low | 52.3 | Low | 122 Ų | 122 | 129 Ų | 129 | 79% | 0.792 | 78% | 0.777 | S | S | * | * | trans | -71.8 | 108.4 | 154.2 | 29.3 | -26.9 | 0 | 0 | 0 | 107.8 | Q15 | P13-Q15 VanDerWaalsContact C-N 3.34Å; P13-Q15 PolarHBondContact O-N 2.85Å | ||
| 14 | T | 50.1 | Low | 53.6 | Low | 128 Ų | 128 | 128 Ų | 128 | 79% | 0.785 | 77% | 0.766 | S | S | * | * | trans | -53.6 | 101.8 | 164.2 | -58.8 | 0 | 0 | 0 | 0 | 107.4 | V12 S16 | V12-T14 PolarHBondContact O-N 3.13Å; V12-T14 VanDerWaalsContact O-N 3.14Å; T14-S16 PolarHBondContact O-N 2.8Å | ||
| 15 | Q | 55.4 | Low | 54.4 | Low | 172 Ų | 172 | 126.2 Ų | 126.2 | 80% | 0.804 | 76% | 0.756 | S | S | * | * | trans | -67 | 80.6 | 172.7 | 52.2 | -177.8 | 87.6 | 0 | 0 | 108.7 | P13 T17 | P13-Q15 VanDerWaalsContact C-N 3.34Å; P13-Q15 PolarHBondContact O-N 2.85Å; Q15-T17 PolarHBondContact O-N 2.85Å | ||
| 16 | S | 52.2 | Low | 55.3 | Low | 105 Ų | 105 | 130.1 Ų | 130.1 | 73% | 0.734 | 76% | 0.761 | S | S | * | * | trans | -64.9 | 95.2 | 159.9 | -173.1 | 0 | 0 | 0 | 0 | 106.1 | T14 A18 | T14-S16 PolarHBondContact O-N 2.8Å; S16-A18 PolarHBondContact O-N 3.18Å | ||
| 17 | T | 53.1 | Low | 55.9 | Low | 120 Ų | 120 | 131.4 Ų | 131.4 | 74% | 0.736 | 75% | 0.752 | S | S | * | * | trans | -65.9 | 81.8 | 165.8 | -63.9 | 0 | 0 | 0 | 0 | 106.7 | Q15 | Q15-T17 PolarHBondContact O-N 2.85Š| ||
| 18 | A | 62.1 | Low | 56.7 | Low | 68 Ų | 68 | 133.3 Ų | 133.3 | 56% | 0.562 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 134.8 | 162.5 | 0 | 0 | 0 | 0 | 0 | 107.2 | S16 M20 | S16-A18 PolarHBondContact O-N 3.18Å; A18-M20 PolarHBondContact O-N 3.18Å; A18-M20 VanDerWaalsContact O-N 3.12Å |
| 19 | P | 59.4 | Low | 56.9 | Low | 117 Ų | 117 | 135.1 Ų | 135.1 | 76% | 0.76 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 123.4 | 173.7 | -20.3 | 29.8 | 0 | 0 | 0 | 108.4 | P21 | P19-P21 VanDerWaalsContact O-CD 3.25Å; P19-P21 WeakPolarHBondContact O-CD 3.26Å; P19-P21 VanDerWaalsContact O-N 3.08Å |
| 20 | M | 54.5 | Low | 57.2 | Low | 167 Ų | 167 | 127.4 Ų | 127.4 | 82% | 0.823 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 119.3 | 170.6 | -89.1 | -178.6 | 72.7 | 0 | 0 | 107.6 | A18 W22 | A18-M20 PolarHBondContact O-N 3.18Å; A18-M20 VanDerWaalsContact O-N 3.12Å; M20-W22 PolarHBondContact O-N 3.16Å |
| 21 | P | 58.5 | Low | 57.2 | Low | 106 Ų | 106 | 129.9 Ų | 129.9 | 69% | 0.688 | 73% | 0.726 | S | S | * | * | trans | -67 | 108.9 | 168.5 | 27.9 | -30.7 | 0 | 0 | 0 | 106.2 | P19 V23 | P19-P21 VanDerWaalsContact O-CD 3.25Å; P19-P21 WeakPolarHBondContact O-CD 3.26Å; P19-P21 VanDerWaalsContact O-N 3.08Å; P21-V23 VanDerWaalsContact C-N 3.28Å; P21-V23 PolarHBondContact O-N 2.88Å | ||
| 22 | W | 59.5 | Low | 57.3 | Low | 217 Ų | 217 | 132.8 Ų | 132.8 | 82% | 0.822 | 73% | 0.73 | S | S | * | * | trans | -67.5 | 92.5 | 171.3 | 47.7 | -78.6 | 0 | 0 | 0 | 106.9 | M20 T24 | M20-W22 PolarHBondContact O-N 3.16Å; W22-T24 PolarHBondContact O-N 3.42Å; W22-T24 VanDerWaalsContact O-N 3.11Å | ||
| 23 | V | 65.5 | Low | 57.5 | Low | 115 Ų | 115 | 131.5 Ų | 131.5 | 70% | 0.697 | 72% | 0.722 | S | S | * | * | trans | -75.8 | 101.4 | 171 | -176.9 | 0 | 0 | 0 | 0 | 106.1 | P21 I25 | P21-V23 VanDerWaalsContact C-N 3.28Å; P21-V23 PolarHBondContact O-N 2.88Å; V23-I25 VanDerWaalsContact C-N 3.32Å; V23-I25 HydrophobicContact CG1-CG1 4.15Å; V23-I25 PolarHBondContact O-N 3.35Å | ||
| 24 | T | 66.8 | Low | 58 | Low | 98 Ų | 98 | 129 Ų | 129 | 60% | 0.601 | 71% | 0.706 | S | S | * | * | trans | -69.6 | 96.6 | 169.4 | -55.3 | 0 | 0 | 0 | 0 | 107 | W22 L26 | W22-T24 PolarHBondContact O-N 3.42Å; W22-T24 VanDerWaalsContact O-N 3.11Å; T24-L26 PolarHBondContact O-N 2.86Å; T24-L26 VanDerWaalsContact O-N 3.15Å | ||
| 25 | I | 66.3 | Low | 58.4 | Low | 140 Ų | 140 | 128.8 Ų | 128.8 | 72% | 0.718 | 71% | 0.709 | S | S | * | * | trans | -72.3 | 106.4 | 172.1 | -57.1 | 179.9 | 0 | 0 | 0 | 106.4 | V23 Q27 | V23-I25 VanDerWaalsContact C-N 3.32Å; V23-I25 HydrophobicContact CG1-CG1 4.15Å; V23-I25 PolarHBondContact O-N 3.35Å; I25-Q27 VanDerWaalsContact C-N 3.34Å; I25-Q27 PolarHBondContact O-N 2.87Å | ||
| 26 | L | 64.7 | Low | 58.5 | Low | 147 Ų | 147 | 124.6 Ų | 124.6 | 77% | 0.77 | 70% | 0.699 | S | S | * | * | trans | -64.1 | 100.5 | 165.6 | -72.1 | 168.7 | 0 | 0 | 0 | 107 | T24 P28 | T24-L26 PolarHBondContact O-N 2.86Å; T24-L26 VanDerWaalsContact O-N 3.15Å; L26-P28 VanDerWaalsContact O-CD 3.28Å; L26-P28 WeakPolarHBondContact O-CD 3.48Å; L26-P28 VanDerWaalsContact O-N 3.15Å | ||
| 27 | Q | 64.3 | Low | 58.8 | Low | 157 Ų | 157 | 126.7 Ų | 126.7 | 73% | 0.734 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 118.3 | 174.1 | -176.2 | -174.4 | -16.5 | 0 | 0 | 107.6 | I25 F29 | I25-Q27 VanDerWaalsContact C-N 3.34Å; I25-Q27 PolarHBondContact O-N 2.87Å; Q27-F29 PolarHBondContact O-N 3.37Å |
| 28 | P | 63.3 | Low | 59 | Low | 111 Ų | 111 | 126.2 Ų | 126.2 | 72% | 0.721 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -60 | 129.7 | 173.7 | 23.3 | -30.1 | 0 | 0 | 0 | 108.1 | L26 | L26-P28 VanDerWaalsContact O-CD 3.28Å; L26-P28 WeakPolarHBondContact O-CD 3.48Å; L26-P28 VanDerWaalsContact O-N 3.15Å |
| 29 | F | 56.7 | Low | 59 | Low | 179 Ų | 179 | 128.1 Ų | 128.1 | 79% | 0.785 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -47 | 127.8 | -177.6 | -175.3 | -99.6 | 0 | 0 | 0 | 111 | Q27 W31 | Q27-F29 PolarHBondContact O-N 3.37Å; F29-W31 PolarHBondContact O-N 2.84Å |
| 30 | P | 49.2 | Very low | 59 | Low | 90 Ų | 90 | 131.3 Ų | 131.3 | 58% | 0.584 | 70% | 0.698 | S | S | * | * | trans | -69.4 | 104.9 | 178.3 | 28.3 | -30.9 | 0 | 0 | 0 | 108.2 | T32 | P30-T32 PolarHBondContact O-N 3.43Š| ||
| 31 | W | 50.3 | Low | 59.5 | Low | 178 Ų | 178 | 130.5 Ų | 130.5 | 67% | 0.674 | 70% | 0.697 | S | S | * | * | trans | -74.5 | 106.2 | 176.4 | 55.9 | -69.9 | 0 | 0 | 0 | 108.5 | F29 V33 | F29-W31 PolarHBondContact O-N 2.84Å; W31-V33 HydrophobicContact CE3-CG2 3.78Å; W31-V33 HydrophobicContact CH2-CG2 4.04Å; W31-V33 HydrophobicContact CZ3-CG2 3.47Å; W31-V33 VanDerWaalsContact CZ3-CG2 3.47Å; W31-V33 PolarHBondContact O-N 3.21Å | ||
| 32 | T | 52.1 | Low | 60.1 | Low | 130 Ų | 130 | 133.3 Ų | 133.3 | 80% | 0.798 | 69% | 0.694 | S | S | * | * | trans | -63.8 | 111.8 | 164.5 | -68.7 | 0 | 0 | 0 | 0 | 107.7 | P30 P34 | P30-T32 PolarHBondContact O-N 3.43Å; T32-P34 WeakPolarHBondContact O-CD 3.33Å | ||
| 33 | V | 56.5 | Low | 61 | Low | 95 Ų | 95 | 126.7 Ų | 126.7 | 58% | 0.576 | 68% | 0.677 | S | S | * | * | trans | -58.7 | 118.2 | 170 | 176.9 | 0 | 0 | 0 | 0 | 107.8 | W31 S35 | W31-V33 HydrophobicContact CE3-CG2 3.78Å; W31-V33 HydrophobicContact CH2-CG2 4.04Å; W31-V33 HydrophobicContact CZ3-CG2 3.47Å; W31-V33 VanDerWaalsContact CZ3-CG2 3.47Å; W31-V33 PolarHBondContact O-N 3.21Å; V33-S35 PolarHBondContact O-N 3.43Å | ||
| 34 | P | 57.3 | Low | 61.6 | Low | 69 Ų | 69 | 129.1 Ų | 129.1 | 45% | 0.448 | 68% | 0.678 | S | S | . | * | trans | -64.5 | 124.1 | 170.9 | -5.7 | 18.9 | 0 | 0 | 0 | 107.7 | T32 S36 | T32-P34 WeakPolarHBondContact O-CD 3.33Å; P34-S36 PolarHBondContact O-N 2.97Å; P34-S36 VanDerWaalsContact O-N 3.16Å | ||
| 35 | S | 57.9 | Low | 62.3 | Low | 123 Ų | 123 | 129.4 Ų | 129.4 | 86% | 0.86 | 67% | 0.673 | S | S | * | * | trans | -70.7 | 107.1 | 169.3 | -178 | 0 | 0 | 0 | 0 | 108.1 | V33 | V33-S35 PolarHBondContact O-N 3.43Š| ||
| 36 | S | 57.6 | Low | 63.1 | Low | 84 Ų | 84 | 124.8 Ų | 124.8 | 59% | 0.587 | 65% | 0.65 | S | S | * | * | trans | -103.6 | 96.2 | 179.3 | 24.1 | 0 | 0 | 0 | 0 | 110.3 | P34 P38 | P34-S36 PolarHBondContact O-N 2.97Å; P34-S36 VanDerWaalsContact O-N 3.16Å; S36-P38 WeakPolarHBondContact O-CD 3.49Å | ||
| 37 | Q | 58.7 | Low | 64.1 | Low | 149 Ų | 149 | 122.7 Ų | 122.7 | 70% | 0.696 | 64% | 0.638 | S | S | * | * | trans | -74 | 118.6 | 158.2 | -171.9 | 168.2 | -55.9 | 0 | 0 | 107.3 | Q39 | Q37-Q39 PolarHBondContact O-N 3.48Š| ||
| 38 | P | 57.8 | Low | 65.1 | Low | 111 Ų | 111 | 120 Ų | 120 | 72% | 0.721 | 63% | 0.629 | S | S | * | * | trans | -70.8 | 97 | -170.8 | 26.5 | -33.2 | 0 | 0 | 0 | 110.3 | S36 | S36-P38 WeakPolarHBondContact O-CD 3.49Š| ||
| 39 | Q | 62.8 | Low | 66.2 | Low | 108 Ų | 108 | 120.1 Ų | 120.1 | 51% | 0.505 | 62% | 0.62 | S | S | . | * | trans | -86 | 113.1 | 166.5 | -64.3 | -70.9 | -19.2 | 0 | 0 | 106.2 | Q37 N41 R42 | Q37-Q39 PolarHBondContact O-N 3.48Å; Q39-N41 PolarHBondContact O-N 2.91Å; Q39-R42 HydrophobicContact CB-CB 4.37Å; Q39-R42 HydrophobicContact CB-CG 4.5Å; Q39-R42 PolarHBondContact O-N 2.95Å | ||
| 40 | H | 59.2 | Low | 67.5 | Low | 183 Ų | 183 | 116.5 Ų | 116.5 | 85% | 0.847 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50 | -21.5 | -178.4 | -177.3 | -95.9 | 0 | 0 | 0 | 113.9 | ||
| 41 | N | 63.9 | Low | 69.2 | Low | 150 Ų | 150 | 117.9 Ų | 117.9 | 80% | 0.802 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | 2.2 | 177.6 | -151.5 | 12.7 | 0 | 0 | 0 | 115 | Q39 | Q39-N41 PolarHBondContact O-N 2.91Š|
| 42 | R | 71 | Confident | 71 | Confident | 166 Ų | 166 | 114.7 Ų | 114.7 | 63% | 0.626 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.3 | -1.3 | 179.4 | -72 | -169.6 | 169.8 | -173.5 | -3.6 | 114.4 | Q39 K44 E45 D46 | Q39-R42 HydrophobicContact CB-CB 4.37Å; Q39-R42 HydrophobicContact CB-CG 4.5Å; Q39-R42 PolarHBondContact O-N 2.95Å; R42-K44 PolarHBondContact O-N 3.23Å; R42-K44 VanDerWaalsContact O-N 3.13Å; R42-E45 VanDerWaalsContact CA-OE2 3.26Å; R42-E45 WeakPolarHBondContact CA-OE2 3.48Å; R42-E45 PolarHBondContact O-N 2.99Å; R42-E45 VanDerWaalsContact O-N 3.09Å; R42-D46 WeakPolarHBondContact O-CB 3.39Å; R42-D46 VanDerWaalsContact O-CG 3.28Å; R42-D46 PolarHBondContact O-N 2.88Å |
| 43 | V | 79.2 | Confident | 72.7 | Confident | 77 Ų | 77 | 111.9 Ų | 111.9 | 47% | 0.467 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -57.7 | -32.5 | -177.7 | 179.5 | 0 | 0 | 0 | 0 | 111.8 | L47 | V43-L47 WeakPolarHBondContact O-CB 3.19Å; V43-L47 PolarHBondContact O-N 3.3Å |
| 44 | K | 78.8 | Confident | 74.2 | Confident | 167 Ų | 167 | 113.5 Ų | 113.5 | 73% | 0.726 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -69.5 | -46.5 | 177.4 | -179.4 | -175.1 | 168.5 | -173.3 | 0 | 111.5 | R42 L47 L48 | R42-K44 PolarHBondContact O-N 3.23Å; R42-K44 VanDerWaalsContact O-N 3.13Å; K44-L47 PolarHBondContact O-N 3.45Å; K44-L48 WeakPolarHBondContact O-CB 3.33Å; K44-L48 PolarHBondContact O-N 3.31Å |
| 45 | E | 81.7 | Confident | 75.6 | Confident | 104 Ų | 104 | 114.1 Ų | 114.1 | 49% | 0.486 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -64.4 | -44.3 | 176 | -67.7 | 75.1 | -160.4 | 0 | 0 | 110.7 | R42 L47 L48 E49 | R42-E45 VanDerWaalsContact CA-OE2 3.26Å; R42-E45 WeakPolarHBondContact CA-OE2 3.48Å; R42-E45 PolarHBondContact O-N 2.99Å; R42-E45 VanDerWaalsContact O-N 3.09Å; E45-L47 VanDerWaalsContact C-N 3.34Å; E45-L47 PolarHBondContact O-N 2.89Å; E45-L48 PolarHBondContact O-N 3.29Å; E45-E49 WeakPolarHBondContact O-CB 3.18Å; E45-E49 PolarHBondContact O-N 3.46Å |
| 46 | D | 82.8 | Confident | 76.9 | Confident | 43 Ų | 43 | 110.8 Ų | 110.8 | 23% | 0.23 | 56% | 0.562 | C | S | . | * | H | α-helix | trans | -62.3 | -41 | 177.4 | -67 | -3.2 | 0 | 0 | 0 | 111.2 | R42 E49 L50 | R42-D46 WeakPolarHBondContact O-CB 3.39Å; R42-D46 VanDerWaalsContact O-CG 3.28Å; R42-D46 PolarHBondContact O-N 2.88Å; D46-E49 PolarHBondContact O-N 3.34Å; D46-L50 WeakPolarHBondContact O-CB 3.36Å; D46-L50 WeakPolarHBondContact O-CD1 3.47Å; D46-L50 WeakPolarHBondContact O-CG 3.37Å; D46-L50 PolarHBondContact O-N 2.92Å |
| 47 | L | 84.5 | Confident | 78.5 | Confident | 102 Ų | 102 | 111.7 Ų | 111.7 | 53% | 0.534 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -66.7 | -40.8 | 175.8 | -177.2 | 64.4 | 0 | 0 | 0 | 111.7 | V43 K44 E45 E49 L50 M51 | V43-L47 WeakPolarHBondContact O-CB 3.19Å; V43-L47 PolarHBondContact O-N 3.3Å; K44-L47 PolarHBondContact O-N 3.45Å; E45-L47 VanDerWaalsContact C-N 3.34Å; E45-L47 PolarHBondContact O-N 2.89Å; L47-E49 VanDerWaalsContact C-N 3.34Å; L47-L50 PolarHBondContact O-N 3.35Å; L47-M51 WeakPolarHBondContact O-CB 3.43Å; L47-M51 VanDerWaalsContact O-CG 3.3Å; L47-M51 WeakPolarHBondContact O-CG 3.22Å; L47-M51 PolarHBondContact O-N 2.96Å |
| 48 | L | 85.9 | Confident | 80 | Confident | 101 Ų | 101 | 110 Ų | 110 | 53% | 0.529 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -64.2 | -41.2 | 176.2 | -176.2 | 68.9 | 0 | 0 | 0 | 111.1 | K44 E45 M51 M52 | K44-L48 WeakPolarHBondContact O-CB 3.33Å; K44-L48 PolarHBondContact O-N 3.31Å; E45-L48 PolarHBondContact O-N 3.29Å; L48-M51 PolarHBondContact O-N 3.39Å; L48-M52 HydrophobicContact CG-CE 4.35Å; L48-M52 WeakPolarHBondContact O-CB 3.44Å; L48-M52 WeakPolarHBondContact O-CG 3.49Å; L48-M52 PolarHBondContact O-N 2.97Å |
| 49 | E | 85.6 | Confident | 81.5 | Confident | 113 Ų | 113 | 109.6 Ų | 109.6 | 53% | 0.528 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.8 | -42.9 | 176.6 | -165.3 | 171.7 | -162.7 | 0 | 0 | 111.2 | E45 D46 L47 M52 L53 | E45-E49 WeakPolarHBondContact O-CB 3.18Å; E45-E49 PolarHBondContact O-N 3.46Å; D46-E49 PolarHBondContact O-N 3.34Å; L47-E49 VanDerWaalsContact C-N 3.34Å; E49-M52 PolarHBondContact O-N 3.44Å; E49-L53 WeakPolarHBondContact O-CB 3.28Å; E49-L53 PolarHBondContact O-N 2.84Å |
| 50 | L | 85.6 | Confident | 82.8 | Confident | 104 Ų | 104 | 111.1 Ų | 111.1 | 55% | 0.545 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.4 | -40.3 | 173 | -74.1 | 167.2 | 0 | 0 | 0 | 112.5 | D46 L47 L53 Q54 | D46-L50 WeakPolarHBondContact O-CB 3.36Å; D46-L50 WeakPolarHBondContact O-CD1 3.47Å; D46-L50 WeakPolarHBondContact O-CG 3.37Å; D46-L50 PolarHBondContact O-N 2.92Å; L47-L50 PolarHBondContact O-N 3.35Å; L50-L53 PolarHBondContact O-N 2.9Å; L50-Q54 PolarHBondContact O-N 2.96Å |
| 51 | M | 84.1 | Confident | 84.3 | Confident | 118 Ų | 118 | 108.5 Ų | 108.5 | 58% | 0.581 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -65.5 | -43.3 | 175.1 | -77.9 | -175.3 | 74.4 | 0 | 0 | 111.6 | L47 L48 L53 Q54 N55 | L47-M51 WeakPolarHBondContact O-CB 3.43Å; L47-M51 VanDerWaalsContact O-CG 3.3Å; L47-M51 WeakPolarHBondContact O-CG 3.22Å; L47-M51 PolarHBondContact O-N 2.96Å; L48-M51 PolarHBondContact O-N 3.39Å; M51-L53 VanDerWaalsContact C-N 3.29Å; M51-L53 PolarHBondContact O-N 3.11Å; M51-Q54 PolarHBondContact O-N 3Å; M51-N55 WeakPolarHBondContact O-CB 3.47Å; M51-N55 PolarHBondContact O-N 3.15Å |
| 52 | M | 87.1 | Confident | 85.6 | Confident | 112 Ų | 112 | 106.8 Ų | 106.8 | 55% | 0.552 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.9 | -37.9 | 174.4 | -77.6 | -165.2 | -67.1 | 0 | 0 | 111.6 | L48 E49 N55 A56 | L48-M52 HydrophobicContact CG-CE 4.35Å; L48-M52 WeakPolarHBondContact O-CB 3.44Å; L48-M52 WeakPolarHBondContact O-CG 3.49Å; L48-M52 PolarHBondContact O-N 2.97Å; E49-M52 PolarHBondContact O-N 3.44Å; M52-N55 WeakPolarHBondContact O-CB 3.32Å; M52-N55 PolarHBondContact O-N 3.12Å; M52-A56 WeakPolarHBondContact O-CB 3.3Å; M52-A56 PolarHBondContact O-N 2.94Å |
| 53 | L | 88.8 | Confident | 86.5 | Confident | 70 Ų | 70 | 103.4 Ų | 103.4 | 37% | 0.366 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.5 | -46.1 | 177.7 | -173.7 | 63.7 | 0 | 0 | 0 | 111.7 | E49 L50 M51 N55 A56 Q57 | E49-L53 WeakPolarHBondContact O-CB 3.28Å; E49-L53 PolarHBondContact O-N 2.84Å; L50-L53 PolarHBondContact O-N 2.9Å; M51-L53 VanDerWaalsContact C-N 3.29Å; M51-L53 PolarHBondContact O-N 3.11Å; L53-N55 VanDerWaalsContact C-N 3.26Å; L53-N55 PolarHBondContact O-N 2.86Å; L53-A56 PolarHBondContact O-N 2.96Å; L53-Q57 WeakPolarHBondContact O-CB 3.29Å; L53-Q57 VanDerWaalsContact O-CG 3.29Å; L53-Q57 WeakPolarHBondContact O-CG 3.48Å; L53-Q57 PolarHBondContact O-N 3.04Å |
| 54 | Q | 89 | Confident | 86.9 | Confident | 130 Ų | 130 | 101.7 Ų | 101.7 | 61% | 0.607 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59.1 | -41.6 | 173.9 | -176.3 | -163.7 | 83.8 | 0 | 0 | 111 | L50 M51 Q57 M58 | L50-Q54 PolarHBondContact O-N 2.96Å; M51-Q54 PolarHBondContact O-N 3Å; Q54-Q57 PolarHBondContact O-N 2.9Å; Q54-M58 PolarHBondContact O-N 3.21Å |
| 55 | N | 85.4 | Confident | 87.3 | Confident | 82 Ų | 82 | 98.6 Ų | 98.6 | 44% | 0.439 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.8 | -45.2 | 179.5 | -163.7 | 3.9 | 0 | 0 | 0 | 111.4 | M51 M52 L53 Q57 M58 H59 | M51-N55 WeakPolarHBondContact O-CB 3.47Å; M51-N55 PolarHBondContact O-N 3.15Å; M52-N55 WeakPolarHBondContact O-CB 3.32Å; M52-N55 PolarHBondContact O-N 3.12Å; L53-N55 VanDerWaalsContact C-N 3.26Å; L53-N55 PolarHBondContact O-N 2.86Å; N55-Q57 PolarHBondContact O-N 3.34Å; N55-M58 PolarHBondContact O-N 3.49Å; N55-H59 PolarHBondContact O-N 3.39Å; N55-H59 PolarHBondContact O-ND1 2.87Å; N55-H59 PolarHBondContact OD1-CE1 2.85Å; N55-H59 PolarHBondContact OD1-ND1 3.35Å |
| 56 | A | 86.6 | Confident | 87.6 | Confident | 52 Ų | 52 | 98.5 Ų | 98.5 | 43% | 0.43 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.1 | -42.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | M52 L53 M58 H59 Q60 | M52-A56 WeakPolarHBondContact O-CB 3.3Å; M52-A56 PolarHBondContact O-N 2.94Å; L53-A56 PolarHBondContact O-N 2.96Å; A56-M58 VanDerWaalsContact C-N 3.35Å; A56-M58 PolarHBondContact O-N 3.43Å; A56-H59 PolarHBondContact O-N 3.42Å; A56-Q60 WeakPolarHBondContact O-CB 3.4Å; A56-Q60 VanDerWaalsContact O-CG 3.22Å; A56-Q60 WeakPolarHBondContact O-CG 3.29Å; A56-Q60 PolarHBondContact O-N 3.41Å |
| 57 | Q | 90.2 | Very high | 87.8 | Confident | 103 Ų | 103 | 100.1 Ų | 100.1 | 48% | 0.481 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.9 | -42.5 | 177.7 | -75.4 | 176.5 | -2.6 | 0 | 0 | 112.2 | L53 Q54 N55 Q60 L61 | L53-Q57 WeakPolarHBondContact O-CB 3.29Å; L53-Q57 VanDerWaalsContact O-CG 3.29Å; L53-Q57 WeakPolarHBondContact O-CG 3.48Å; L53-Q57 PolarHBondContact O-N 3.04Å; Q54-Q57 PolarHBondContact O-N 2.9Å; N55-Q57 PolarHBondContact O-N 3.34Å; Q57-Q60 PolarHBondContact O-N 2.87Å; Q57-L61 PolarHBondContact O-N 3Å |
| 58 | M | 91.1 | Very high | 87.7 | Confident | 113 Ų | 113 | 97.5 Ų | 97.5 | 56% | 0.557 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.5 | -44.4 | 176.4 | -172.7 | -171 | -64.4 | 0 | 0 | 111.7 | Q54 N55 A56 Q60 L61 L62 | Q54-M58 PolarHBondContact O-N 3.21Å; N55-M58 PolarHBondContact O-N 3.49Å; A56-M58 VanDerWaalsContact C-N 3.35Å; A56-M58 PolarHBondContact O-N 3.43Å; M58-Q60 VanDerWaalsContact C-N 3.31Å; M58-Q60 PolarHBondContact O-N 3Å; M58-L61 PolarHBondContact O-N 2.92Å; M58-L62 PolarHBondContact O-N 2.77Å |
| 59 | H | 88.5 | Confident | 87.5 | Confident | 103 Ų | 103 | 96.8 Ų | 96.8 | 48% | 0.477 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.5 | -41 | 177.1 | -78.7 | 83.5 | 0 | 0 | 0 | 111.7 | N55 A56 L62 L63 | N55-H59 PolarHBondContact O-N 3.39Å; N55-H59 PolarHBondContact O-ND1 2.87Å; N55-H59 PolarHBondContact OD1-CE1 2.85Å; N55-H59 PolarHBondContact OD1-ND1 3.35Å; A56-H59 PolarHBondContact O-N 3.42Å; H59-L62 PolarHBondContact O-N 3.5Å; H59-L63 WeakPolarHBondContact O-CB 3.26Å; H59-L63 VanDerWaalsContact O-CG 3.26Å; H59-L63 WeakPolarHBondContact O-CG 3.35Å; H59-L63 PolarHBondContact O-N 2.87Å |
| 60 | Q | 89.9 | Confident | 87.1 | Confident | 141 Ų | 141 | 95.2 Ų | 95.2 | 66% | 0.659 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.6 | -41.5 | 175.2 | -71.9 | -68.9 | -50.1 | 0 | 0 | 111.8 | A56 Q57 M58 G64 | A56-Q60 WeakPolarHBondContact O-CB 3.4Å; A56-Q60 VanDerWaalsContact O-CG 3.22Å; A56-Q60 WeakPolarHBondContact O-CG 3.29Å; A56-Q60 PolarHBondContact O-N 3.41Å; Q57-Q60 PolarHBondContact O-N 2.87Å; M58-Q60 VanDerWaalsContact C-N 3.31Å; M58-Q60 PolarHBondContact O-N 3Å; Q60-G64 WeakPolarHBondContact O-CA 3.23Å; Q60-G64 PolarHBondContact O-N 3.25Å |
| 61 | L | 91.6 | Very high | 87 | Confident | 128 Ų | 128 | 97 Ų | 97 | 67% | 0.67 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64.6 | -46.7 | 176 | -178.9 | 65.7 | 0 | 0 | 0 | 111.7 | Q57 M58 G64 Q65 | Q57-L61 PolarHBondContact O-N 3Å; M58-L61 PolarHBondContact O-N 2.92Å; L61-G64 PolarHBondContact O-N 3.38Å; L61-Q65 WeakPolarHBondContact O-CB 3.49Å; L61-Q65 PolarHBondContact O-N 2.93Å |
| 62 | L | 90 | Very high | 86.4 | Confident | 113 Ų | 113 | 96.8 Ų | 96.8 | 59% | 0.592 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.8 | -48 | -177.6 | -155.6 | 89.2 | 0 | 0 | 0 | 111.2 | M58 H59 G64 Q65 L66 | M58-L62 PolarHBondContact O-N 2.77Å; H59-L62 PolarHBondContact O-N 3.5Å; L62-G64 VanDerWaalsContact C-N 3.35Å; L62-Q65 PolarHBondContact O-N 2.78Å; L62-L66 WeakPolarHBondContact O-CG 3.47Å; L62-L66 PolarHBondContact O-N 2.79Å |
| 63 | L | 89.9 | Confident | 85.2 | Confident | 96 Ų | 96 | 96.5 Ų | 96.5 | 50% | 0.503 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -67.1 | -38.2 | 177.4 | -67.1 | 173 | 0 | 0 | 0 | 111.5 | H59 Q65 L66 V67 | H59-L63 WeakPolarHBondContact O-CB 3.26Å; H59-L63 VanDerWaalsContact O-CG 3.26Å; H59-L63 WeakPolarHBondContact O-CG 3.35Å; H59-L63 PolarHBondContact O-N 2.87Å; L63-Q65 VanDerWaalsContact C-N 3.33Å; L63-Q65 PolarHBondContact O-N 3.14Å; L63-L66 HydrophobicContact CD2-CD1 4.37Å; L63-L66 PolarHBondContact O-N 3.33Å; L63-V67 WeakPolarHBondContact O-CB 3.25Å; L63-V67 VanDerWaalsContact O-CG2 3.29Å; L63-V67 WeakPolarHBondContact O-CG2 3.37Å; L63-V67 PolarHBondContact O-N 3.29Å |
| 64 | G | 87.9 | Confident | 83.9 | Confident | 40 Ų | 40 | 95.5 Ų | 95.5 | 41% | 0.412 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.2 | -43 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q60 L61 L62 V67 A68 | Q60-G64 WeakPolarHBondContact O-CA 3.23Å; Q60-G64 PolarHBondContact O-N 3.25Å; L61-G64 PolarHBondContact O-N 3.38Å; L62-G64 VanDerWaalsContact C-N 3.35Å; G64-V67 PolarHBondContact O-N 3.01Å; G64-A68 VanDerWaalsContact O-CB 3.31Å; G64-A68 WeakPolarHBondContact O-CB 3.31Å; G64-A68 PolarHBondContact O-N 3.45Å |
| 65 | Q | 87.8 | Confident | 82.4 | Confident | 103 Ų | 103 | 95.3 Ų | 95.3 | 48% | 0.481 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -65.8 | -44.6 | 176 | -170.9 | 62.8 | 49.5 | 0 | 0 | 111.6 | L61 L62 L63 V67 A68 D69 | L61-Q65 WeakPolarHBondContact O-CB 3.49Å; L61-Q65 PolarHBondContact O-N 2.93Å; L62-Q65 PolarHBondContact O-N 2.78Å; L63-Q65 VanDerWaalsContact C-N 3.33Å; L63-Q65 PolarHBondContact O-N 3.14Å; Q65-V67 VanDerWaalsContact C-N 3.31Å; Q65-V67 PolarHBondContact O-N 3.35Å; Q65-A68 PolarHBondContact O-N 3.38Å; Q65-A68 VanDerWaalsContact O-N 3.16Å; Q65-D69 PolarHBondContact NE2-OD1 3.28Å; Q65-D69 WeakPolarHBondContact O-CB 3.45Å; Q65-D69 PolarHBondContact O-N 2.92Å |
| 66 | L | 86.8 | Confident | 81 | Confident | 101 Ų | 101 | 100.4 Ų | 100.4 | 53% | 0.529 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -60.1 | -40.9 | 176.8 | -71 | 169.4 | 0 | 0 | 0 | 112.3 | L62 L63 A70 | L62-L66 WeakPolarHBondContact O-CG 3.47Å; L62-L66 PolarHBondContact O-N 2.79Å; L63-L66 HydrophobicContact CD2-CD1 4.37Å; L63-L66 PolarHBondContact O-N 3.33Å; L66-A70 WeakPolarHBondContact O-CB 3.4Å; L66-A70 PolarHBondContact O-N 3.02Å |
| 67 | V | 87.4 | Confident | 79.3 | Confident | 78 Ų | 78 | 108.5 Ų | 108.5 | 47% | 0.473 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -67.9 | -42.3 | 175.2 | 171.6 | 0 | 0 | 0 | 0 | 110.6 | L63 G64 Q65 D69 A70 L71 | L63-V67 WeakPolarHBondContact O-CB 3.25Å; L63-V67 VanDerWaalsContact O-CG2 3.29Å; L63-V67 WeakPolarHBondContact O-CG2 3.37Å; L63-V67 PolarHBondContact O-N 3.29Å; G64-V67 PolarHBondContact O-N 3.01Å; Q65-V67 VanDerWaalsContact C-N 3.31Å; Q65-V67 PolarHBondContact O-N 3.35Å; V67-D69 PolarHBondContact O-N 2.87Å; V67-A70 PolarHBondContact O-N 3.49Å; V67-L71 HydrophobicContact CG1-CD1 3.67Å; V67-L71 HydrophobicContact CG1-CG 4.19Å; V67-L71 WeakPolarHBondContact O-CB 3.48Å; V67-L71 VanDerWaalsContact O-CG 3.23Å; V67-L71 WeakPolarHBondContact O-CG 3.44Å; V67-L71 PolarHBondContact O-N 2.81Å |
| 68 | A | 82.6 | Confident | 77.4 | Confident | 46 Ų | 46 | 108.5 Ų | 108.5 | 38% | 0.38 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -61.7 | -42.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | G64 Q65 A70 L71 N72 | G64-A68 VanDerWaalsContact O-CB 3.31Å; G64-A68 WeakPolarHBondContact O-CB 3.31Å; G64-A68 PolarHBondContact O-N 3.45Å; Q65-A68 PolarHBondContact O-N 3.38Å; Q65-A68 VanDerWaalsContact O-N 3.16Å; A68-A70 VanDerWaalsContact C-N 3.35Å; A68-L71 PolarHBondContact O-N 3.16Å; A68-N72 WeakPolarHBondContact O-CB 3.32Å; A68-N72 PolarHBondContact O-N 2.79Å |
| 69 | D | 80.7 | Confident | 75.9 | Confident | 86 Ų | 86 | 107.8 Ų | 107.8 | 46% | 0.46 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -66.3 | -35.2 | 176.6 | -66.6 | -17.9 | 0 | 0 | 0 | 111.8 | Q65 V67 N72 | Q65-D69 PolarHBondContact NE2-OD1 3.28Å; Q65-D69 WeakPolarHBondContact O-CB 3.45Å; Q65-D69 PolarHBondContact O-N 2.92Å; V67-D69 PolarHBondContact O-N 2.87Å; D69-N72 CarbonylContact O-C 3.3Å; D69-N72 VanDerWaalsContact O-C 3.3Å |
| 70 | A | 79 | Confident | 74.2 | Confident | 81 Ų | 81 | 108.1 Ų | 108.1 | 67% | 0.669 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -72.6 | -36.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | L66 V67 A68 | L66-A70 WeakPolarHBondContact O-CB 3.4Å; L66-A70 PolarHBondContact O-N 3.02Å; V67-A70 PolarHBondContact O-N 3.49Å; A68-A70 VanDerWaalsContact C-N 3.35Å |
| 71 | L | 82.1 | Confident | 72.6 | Confident | 142 Ų | 142 | 107.2 Ų | 107.2 | 74% | 0.743 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -82.4 | -22.4 | 179.6 | -66.9 | 176.6 | 0 | 0 | 0 | 112.8 | V67 A68 | V67-L71 HydrophobicContact CG1-CD1 3.67Å; V67-L71 HydrophobicContact CG1-CG 4.19Å; V67-L71 WeakPolarHBondContact O-CB 3.48Å; V67-L71 VanDerWaalsContact O-CG 3.23Å; V67-L71 WeakPolarHBondContact O-CG 3.44Å; V67-L71 PolarHBondContact O-N 2.81Å; A68-L71 PolarHBondContact O-N 3.16Å |
| 72 | N | 71.7 | Confident | 70.5 | Confident | 113 Ų | 113 | 110 Ų | 110 | 60% | 0.604 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -135.5 | 86.4 | 176.6 | -162 | -20.6 | 0 | 0 | 0 | 108.1 | A68 D69 G74 | A68-N72 WeakPolarHBondContact O-CB 3.32Å; A68-N72 PolarHBondContact O-N 2.79Å; D69-N72 CarbonylContact O-C 3.3Å; D69-N72 VanDerWaalsContact O-C 3.3Å; N72-G74 VanDerWaalsContact C-N 3.26Å; N72-G74 PolarHBondContact O-N 2.81Å |
| 73 | P | 62.2 | Low | 68.5 | Low | 106 Ų | 106 | 116.1 Ų | 116.1 | 69% | 0.688 | 65% | 0.649 | S | S | * | * | trans | -61.5 | 100 | 168.3 | 26.3 | -31.4 | 0 | 0 | 0 | 106.3 | ||||
| 74 | G | 61 | Low | 66.5 | Low | 48 Ų | 48 | 117.5 Ų | 117.5 | 50% | 0.495 | 67% | 0.665 | S | S | . | * | trans | -53.1 | 151.8 | 179 | 0 | 0 | 0 | 0 | 0 | 109.9 | N72 E76 | N72-G74 VanDerWaalsContact C-N 3.26Å; N72-G74 PolarHBondContact O-N 2.81Å; G74-E76 PolarHBondContact O-N 3.01Å | ||
| 75 | P | 58.9 | Low | 64.3 | Low | 127 Ų | 127 | 119 Ų | 119 | 83% | 0.825 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -50 | 123 | 177 | 21 | -31 | 0 | 0 | 0 | 108.2 | W77 | P75-W77 PolarHBondContact O-N 3.03Š|
| 76 | E | 54.9 | Low | 62.3 | Low | 189 Ų | 189 | 120.4 Ų | 120.4 | 88% | 0.883 | 69% | 0.691 | S | S | * | * | trans | -43.6 | 116.7 | -175.3 | -166.1 | 142 | 136.5 | 0 | 0 | 108.7 | G74 | G74-E76 PolarHBondContact O-N 3.01Š| ||
| 77 | W | 51.4 | Low | 60.4 | Low | 222 Ų | 222 | 121 Ų | 121 | 84% | 0.841 | 70% | 0.7 | S | S | * | * | trans | -48.8 | 129 | 179.9 | -172.9 | -90.8 | 0 | 0 | 0 | 107.5 | P75 S79 | P75-W77 PolarHBondContact O-N 3.03Å; W77-S79 PolarHBondContact O-N 2.87Å | ||
| 78 | P | 49.7 | Very low | 58.6 | Low | 102 Ų | 102 | 122.6 Ų | 122.6 | 66% | 0.662 | 71% | 0.712 | S | S | * | * | trans | -56 | 115.8 | -177 | 20.3 | -29.1 | 0 | 0 | 0 | 107.2 | ||||
| 79 | S | 59.9 | Low | 56.9 | Low | 98 Ų | 98 | 126.3 Ų | 126.3 | 69% | 0.685 | 73% | 0.73 | S | S | * | * | trans | -44 | 135.9 | 174 | 46.2 | 0 | 0 | 0 | 0 | 108.3 | W77 P81 | W77-S79 PolarHBondContact O-N 2.87Å; S79-P81 VanDerWaalsContact O-N 3.14Å | ||
| 80 | P | 52 | Low | 55.3 | Low | 110 Ų | 110 | 127.8 Ų | 127.8 | 71% | 0.714 | 74% | 0.744 | S | S | * | * | trans | -47.1 | 129.2 | 173.7 | -22.8 | 30.6 | 0 | 0 | 0 | 107.8 | E82 | P80-E82 PolarHBondContact O-N 3.04Š| ||
| 81 | P | 56.6 | Low | 53.7 | Low | 123 Ų | 123 | 132.8 Ų | 132.8 | 80% | 0.799 | 75% | 0.754 | S | S | * | * | trans | -53 | 125.9 | 179.6 | 21.7 | -31.4 | 0 | 0 | 0 | 106.6 | S79 R83 | S79-P81 VanDerWaalsContact O-N 3.14Å; P81-R83 PolarHBondContact O-N 2.96Å | ||
| 82 | E | 48.5 | Very low | 52 | Low | 187 Ų | 187 | 131.4 Ų | 131.4 | 87% | 0.874 | 76% | 0.755 | S | S | * | * | trans | -39.1 | 115.6 | 173.6 | -91.1 | 167.9 | 109.4 | 0 | 0 | 107 | P80 C84 | P80-E82 PolarHBondContact O-N 3.04Å; E82-C84 PolarHBondContact O-N 2.85Å | ||
| 83 | R | 48.2 | Very low | 50.9 | Low | 241 Ų | 241 | 133 Ų | 133 | 91% | 0.909 | 76% | 0.763 | S | S | * | * | trans | -50.1 | 114.1 | 171.1 | -78 | -173.5 | -163.8 | -139.7 | 2.6 | 104.6 | P81 A85 | P81-R83 PolarHBondContact O-N 2.96Å; R83-A85 PolarHBondContact O-N 3.39Å | ||
| 84 | C | 47.4 | Very low | 50.4 | Low | 125 Ų | 125 | 131.2 Ų | 131.2 | 85% | 0.845 | 76% | 0.764 | S | S | * | * | trans | -44.5 | 114.2 | 171.2 | -72.6 | 0 | 0 | 0 | 0 | 106.5 | E82 | E82-C84 PolarHBondContact O-N 2.85Š| ||
| 85 | A | 42.5 | Very low | 49.8 | Very low | 70 Ų | 70 | 136 Ų | 136 | 58% | 0.579 | 78% | 0.778 | S | S | * | * | trans | -49.8 | 140.7 | 172.3 | 0 | 0 | 0 | 0 | 0 | 107.2 | R83 T87 | R83-A85 PolarHBondContact O-N 3.39Å; A85-T87 PolarHBondContact O-N 2.92Å; A85-T87 PolarHBondContact O-OG1 2.84Å | ||
| 86 | P | 45.8 | Very low | 49.1 | Very low | 133 Ų | 133 | 134.7 Ų | 134.7 | 86% | 0.864 | 77% | 0.771 | S | S | * | * | trans | -67.9 | 83.4 | 175.2 | 28.7 | -31.1 | 0 | 0 | 0 | 107.5 | ||||
| 87 | T | 45.5 | Very low | 48.6 | Very low | 114 Ų | 114 | 136.3 Ų | 136.3 | 70% | 0.699 | 77% | 0.769 | S | S | * | * | trans | -68.6 | 130.2 | 165.3 | -53.3 | 0 | 0 | 0 | 0 | 105.3 | A85 T89 | A85-T87 PolarHBondContact O-N 2.92Å; A85-T87 PolarHBondContact O-OG1 2.84Å; T87-T89 PolarHBondContact O-N 2.98Å | ||
| 88 | P | 50 | Low | 48.5 | Very low | 112 Ų | 112 | 130.3 Ų | 130.3 | 73% | 0.727 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -62.5 | 114 | -172.4 | 24 | -31.7 | 0 | 0 | 0 | 109.6 | ||
| 89 | T | 47 | Very low | 48.3 | Very low | 123 Ų | 123 | 134.9 Ų | 134.9 | 76% | 0.755 | 76% | 0.764 | S | S | * | * | trans | 43.5 | 100.1 | 161.4 | 40 | 0 | 0 | 0 | 0 | 116.9 | T87 Q91 | T87-T89 PolarHBondContact O-N 2.98Å; T89-Q91 PolarHBondContact O-N 2.88Å | ||
| 90 | P | 46.4 | Very low | 47.7 | Very low | 118 Ų | 118 | 135.8 Ų | 135.8 | 77% | 0.766 | 77% | 0.769 | S | S | * | * | trans | -75 | 119.3 | 149.5 | 29.9 | -26.9 | 0 | 0 | 0 | 108.2 | C92 | P90-C92 PolarHBondContact O-N 2.91Å; P90-C92 VanDerWaalsContact O-N 3.13Å | ||
| 91 | Q | 46.7 | Very low | 47.3 | Very low | 186 Ų | 186 | 135.6 Ų | 135.6 | 87% | 0.869 | 77% | 0.766 | S | S | * | * | trans | -62.1 | 113.2 | 167.1 | -73.9 | -149.5 | 34 | 0 | 0 | 108.8 | T89 N93 | T89-Q91 PolarHBondContact O-N 2.88Å; Q91-N93 PolarHBondContact O-N 2.66Å | ||
| 92 | C | 46.4 | Very low | 46.9 | Very low | 113 Ų | 113 | 134.7 Ų | 134.7 | 76% | 0.764 | 76% | 0.763 | S | S | * | * | trans | -68.1 | 97.8 | 169.6 | -93.3 | 0 | 0 | 0 | 0 | 109 | P90 | P90-C92 PolarHBondContact O-N 2.91Å; P90-C92 VanDerWaalsContact O-N 3.13Å | ||
| 93 | N | 47.5 | Very low | 47.2 | Very low | 146 Ų | 146 | 131 Ų | 131 | 78% | 0.781 | 76% | 0.757 | S | S | * | * | trans | -89.8 | 116.6 | 163.9 | -165.2 | 26.3 | 0 | 0 | 0 | 108.9 | Q91 D95 | Q91-N93 PolarHBondContact O-N 2.66Å; N93-D95 VanDerWaalsContact C-N 3.27Å; N93-D95 PolarHBondContact O-N 3.48Å | ||
| 94 | G | 52.1 | Low | 47.2 | Very low | 69 Ų | 69 | 127.7 Ų | 127.7 | 71% | 0.711 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 56.2 | -48.4 | 150.5 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||
| 95 | D | 48.3 | Very low | 47.3 | Very low | 147 Ų | 147 | 133.8 Ų | 133.8 | 79% | 0.786 | 76% | 0.755 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.3 | 7.8 | -155.5 | -63.8 | -53.3 | 0 | 0 | 0 | 114.5 | N93 W97 | N93-D95 VanDerWaalsContact C-N 3.27Å; N93-D95 PolarHBondContact O-N 3.48Å; D95-W97 PolarHBondContact O-N 2.82Å; D95-W97 VanDerWaalsContact O-N 3.16Å |
| 96 | C | 43.3 | Very low | 47.5 | Very low | 100 Ų | 100 | 137.3 Ų | 137.3 | 68% | 0.676 | 76% | 0.764 | S | S | * | * | trans | -82.1 | 98.1 | 173.7 | -148.5 | 0 | 0 | 0 | 0 | 109.7 | C98 | C96-C98 PolarHBondContact O-N 3Š| ||
| 97 | W | 45.3 | Very low | 47.7 | Very low | 224 Ų | 224 | 142.9 Ų | 142.9 | 85% | 0.848 | 79% | 0.785 | S | S | * | * | trans | -62.4 | 86.7 | 165.5 | -87.4 | 63 | 0 | 0 | 0 | 109.3 | D95 R99 | D95-W97 PolarHBondContact O-N 2.82Å; D95-W97 VanDerWaalsContact O-N 3.16Å; W97-R99 PolarHBondContact O-N 2.8Å | ||
| 98 | C | 48.4 | Very low | 47.8 | Very low | 95 Ų | 95 | 144.3 Ų | 144.3 | 64% | 0.642 | 79% | 0.789 | S | S | * | * | trans | -66.1 | 85.2 | 163 | -76.8 | 0 | 0 | 0 | 0 | 108 | C96 C100 | C96-C98 PolarHBondContact O-N 3Å; C98-C100 PolarHBondContact O-N 3.16Å | ||
| 99 | R | 45.5 | Very low | 47.7 | Very low | 198 Ų | 198 | 146 Ų | 146 | 75% | 0.747 | 79% | 0.792 | S | S | * | * | trans | -75.5 | 72.1 | 169.9 | -159.1 | -170 | -106.9 | -153.9 | -2.5 | 108.5 | W97 T101 | W97-R99 PolarHBondContact O-N 2.8Å; R99-T101 HydrophobicContact CG-CG2 3.78Å; R99-T101 PolarHBondContact O-N 3.46Å | ||
| 100 | C | 47.4 | Very low | 47.8 | Very low | 118 Ų | 118 | 147.3 Ų | 147.3 | 80% | 0.797 | 79% | 0.794 | S | S | * | * | trans | -71.9 | 83.2 | 160 | -71.8 | 0 | 0 | 0 | 0 | 107.1 | C98 S102 | C98-C100 PolarHBondContact O-N 3.16Å; C100-S102 VanDerWaalsContact C-N 3.32Å; C100-S102 PolarHBondContact O-N 3.01Å | ||
| 101 | T | 43.6 | Very low | 47.9 | Very low | 106 Ų | 106 | 149 Ų | 149 | 65% | 0.65 | 80% | 0.796 | S | S | * | * | trans | -65.5 | 101 | 166.3 | 55.3 | 0 | 0 | 0 | 0 | 107.3 | R99 S103 | R99-T101 HydrophobicContact CG-CG2 3.78Å; R99-T101 PolarHBondContact O-N 3.46Å; T101-S103 PolarHBondContact O-N 3.13Å | ||
| 102 | S | 48.9 | Very low | 47.9 | Very low | 104 Ų | 104 | 146.7 Ų | 146.7 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | -55.5 | 102.2 | 169.2 | -178.5 | 0 | 0 | 0 | 0 | 108.8 | C100 F104 | C100-S102 VanDerWaalsContact C-N 3.32Å; C100-S102 PolarHBondContact O-N 3.01Å; S102-F104 PolarHBondContact O-N 2.71Å | ||
| 103 | S | 54.5 | Low | 48 | Very low | 109 Ų | 109 | 148.9 Ų | 148.9 | 76% | 0.762 | 79% | 0.793 | S | S | * | * | trans | -94.2 | 47.4 | 170.8 | -156.3 | 0 | 0 | 0 | 0 | 110.3 | T101 | T101-S103 PolarHBondContact O-N 3.13Š| ||
| 104 | F | 49.4 | Very low | 48.1 | Very low | 172 Ų | 172 | 149.1 Ų | 149.1 | 75% | 0.754 | 79% | 0.794 | S | S | * | * | trans | -140.4 | 82.1 | 163.8 | -82.2 | -80 | 0 | 0 | 0 | 109.2 | S102 L106 | S102-F104 PolarHBondContact O-N 2.71Å; F104-L106 HydrophobicContact CD1-CD1 4.31Å; F104-L106 HydrophobicContact CE1-CD1 4.45Å | ||
| 105 | R | 48.7 | Very low | 47.8 | Very low | 252 Ų | 252 | 155.3 Ų | 155.3 | 95% | 0.951 | 80% | 0.8 | S | S | * | * | trans | -106 | 93.5 | 144.6 | -92.7 | -166.7 | -170.3 | -111.4 | 3.7 | 106.9 | ||||
| 106 | L | 45.9 | Very low | 47.7 | Very low | 145 Ų | 145 | 156 Ų | 156 | 76% | 0.759 | 80% | 0.802 | S | S | * | * | trans | -101.4 | 135.7 | 156.3 | -92.7 | 160.7 | 0 | 0 | 0 | 106.6 | F104 | F104-L106 HydrophobicContact CD1-CD1 4.31Å; F104-L106 HydrophobicContact CE1-CD1 4.45Å | ||
| 107 | L | 51.5 | Low | 48.1 | Very low | 249 Ų | 249 | 161.1 Ų | 161.1 | 100% | 1.304 | 81% | 0.813 | S | S | * | * | trans | 107.2 | 0 | -176.5 | -60.8 | 161.8 | 0 | 0 | 0 | 113.5 |
Retrieved 107 of 107 residues in 318.2 ms
(Link to these results)