| 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 | 43.3 | Very low | 54.3 | Low | 248 Ų | 248 | 154.3 Ų | 154.3 | 100% | 1.222 | 82% | 0.815 | S | S | * | * | 0 | 101.3 | 0 | -81.1 | 168.5 | 143.8 | 0 | 0 | 106 | |||||
| 2 | I | 55.3 | Low | 54.1 | Low | 167 Ų | 167 | 154.1 Ų | 154.1 | 86% | 0.856 | 82% | 0.815 | S | S | * | * | cis | -136.9 | 151.9 | 25.5 | -76.3 | 157.9 | 0 | 0 | 0 | 107.1 | ||||
| 3 | P | 52.5 | Low | 54.3 | Low | 112 Ų | 112 | 151.2 Ų | 151.2 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | trans | -91.9 | 144.9 | -147.8 | -2.1 | 21.6 | 0 | 0 | 0 | 115.7 | A5 | P3-A5 PolarHBondContact O-N 3.36Š| ||
| 4 | W | 55.5 | Low | 54 | Low | 268 Ų | 268 | 153.5 Ų | 153.5 | 100% | 1.015 | 81% | 0.806 | S | S | * | * | trans | -63.8 | 104 | 156.9 | -73.1 | -32.5 | 0 | 0 | 0 | 110.5 | ||||
| 5 | A | 58.6 | Low | 54.1 | Low | 81 Ų | 81 | 149.7 Ų | 149.7 | 67% | 0.669 | 79% | 0.794 | S | S | * | * | trans | -169.3 | 154.7 | 157.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | P3 | P3-A5 PolarHBondContact O-N 3.36Š| ||
| 6 | S | 60 | Low | 54.1 | Low | 120 Ų | 120 | 149.3 Ų | 149.3 | 84% | 0.839 | 79% | 0.792 | S | S | * | * | trans | 73.7 | 121.1 | -174.2 | 76.8 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 7 | F | 49.4 | Very low | 54 | Low | 181 Ų | 181 | 149.9 Ų | 149.9 | 79% | 0.794 | 79% | 0.794 | S | S | * | * | cis | -165.4 | 86.7 | 43.1 | -178.6 | -106.9 | 0 | 0 | 0 | 107.9 | S9 | F7-S9 PolarHBondContact O-N 3.17Š| ||
| 8 | L | 53.7 | Low | 54.3 | Low | 172 Ų | 172 | 150.7 Ų | 150.7 | 90% | 0.901 | 79% | 0.79 | S | S | * | * | trans | -78.9 | 78.9 | 163 | -83.7 | 165.2 | 0 | 0 | 0 | 107.7 | K10 | L8-K10 VanDerWaalsContact C-N 3.3Å; L8-K10 PolarHBondContact O-N 3.18Å | ||
| 9 | S | 58 | Low | 54.5 | Low | 72 Ų | 72 | 147.8 Ų | 147.8 | 50% | 0.503 | 78% | 0.781 | S | S | . | * | trans | -65.5 | 95.6 | 161.5 | 159 | 0 | 0 | 0 | 0 | 107.8 | F7 S11 | F7-S9 PolarHBondContact O-N 3.17Å; S9-S11 VanDerWaalsContact C-N 3.25Å; S9-S11 PolarHBondContact O-N 3.35Å | ||
| 10 | K | 54.8 | Low | 55 | Low | 187 Ų | 187 | 149.1 Ų | 149.1 | 81% | 0.813 | 78% | 0.776 | S | S | * | * | trans | -65.2 | 89.8 | 162.7 | -69.3 | 178.2 | 178.6 | 179.2 | 0 | 107.5 | L8 N12 | L8-K10 VanDerWaalsContact C-N 3.3Å; L8-K10 PolarHBondContact O-N 3.18Å; K10-N12 VanDerWaalsContact C-N 3.33Å; K10-N12 PolarHBondContact O-N 3.06Å | ||
| 11 | S | 55.8 | Low | 55.5 | Low | 89 Ų | 89 | 150.2 Ų | 150.2 | 62% | 0.622 | 77% | 0.77 | S | S | * | * | trans | -65.9 | 101.9 | 159.8 | 44.9 | 0 | 0 | 0 | 0 | 106.9 | S9 V13 | S9-S11 VanDerWaalsContact C-N 3.25Å; S9-S11 PolarHBondContact O-N 3.35Å; S11-V13 PolarHBondContact O-N 3.04Å | ||
| 12 | N | 52 | Low | 57.2 | Low | 152 Ų | 152 | 143.6 Ų | 143.6 | 81% | 0.813 | 75% | 0.747 | S | S | * | * | trans | -64 | 78.9 | 162.2 | -90 | -19.5 | 0 | 0 | 0 | 107.7 | K10 F14 | K10-N12 VanDerWaalsContact C-N 3.33Å; K10-N12 PolarHBondContact O-N 3.06Å; N12-F14 PolarHBondContact O-N 3.35Å; N12-F14 VanDerWaalsContact O-N 3.12Å | ||
| 13 | V | 56.4 | Low | 58.8 | Low | 117 Ų | 117 | 138.8 Ų | 138.8 | 71% | 0.709 | 72% | 0.723 | S | S | * | * | trans | -76.1 | 97.8 | 165.8 | -155.4 | 0 | 0 | 0 | 0 | 105.1 | S11 P15 | S11-V13 PolarHBondContact O-N 3.04Å; V13-P15 VanDerWaalsContact O-CD 3.26Å; V13-P15 WeakPolarHBondContact O-CD 3.18Å | ||
| 14 | F | 51.3 | Low | 60.5 | Low | 183 Ų | 183 | 138.3 Ų | 138.3 | 80% | 0.803 | 73% | 0.728 | S | S | * | * | trans | -42.3 | 113.7 | 166.9 | -101.5 | -96.5 | 0 | 0 | 0 | 108.4 | N12 L16 | N12-F14 PolarHBondContact O-N 3.35Å; N12-F14 VanDerWaalsContact O-N 3.12Å; F14-L16 PolarHBondContact O-N 3.44Å | ||
| 15 | P | 54.9 | Low | 62.1 | Low | 97 Ų | 97 | 131.2 Ų | 131.2 | 63% | 0.63 | 71% | 0.71 | S | S | * | * | trans | -70.9 | 109.3 | 167.1 | 28.4 | -26.9 | 0 | 0 | 0 | 104.8 | V13 L17 | V13-P15 VanDerWaalsContact O-CD 3.26Å; V13-P15 WeakPolarHBondContact O-CD 3.18Å; P15-L17 PolarHBondContact O-N 3.23Å | ||
| 16 | L | 53.4 | Low | 63.6 | Low | 143 Ų | 143 | 133.9 Ų | 133.9 | 75% | 0.749 | 70% | 0.703 | S | S | * | * | trans | -53.9 | 97.7 | 160.3 | -71 | 169.8 | 0 | 0 | 0 | 106.1 | F14 F18 | F14-L16 PolarHBondContact O-N 3.44Å; L16-F18 HydrophobicContact CB-CD2 4.08Å; L16-F18 HydrophobicContact CB-CE2 4.21Å; L16-F18 PolarHBondContact O-N 3.36Å | ||
| 17 | L | 52.4 | Low | 65 | Low | 160 Ų | 160 | 131.7 Ų | 131.7 | 84% | 0.838 | 69% | 0.692 | S | S | * | * | trans | -68.4 | 61.4 | 174.6 | -88.5 | 142.2 | 0 | 0 | 0 | 108.8 | P15 | P15-L17 PolarHBondContact O-N 3.23Š| ||
| 18 | F | 59.3 | Low | 67 | Low | 163 Ų | 163 | 125.9 Ų | 125.9 | 72% | 0.715 | 68% | 0.678 | S | S | * | * | trans | -60.7 | 128.1 | 148.4 | -74.8 | -79.2 | 0 | 0 | 0 | 105.3 | L16 Y20 | L16-F18 HydrophobicContact CB-CD2 4.08Å; L16-F18 HydrophobicContact CB-CE2 4.21Å; L16-F18 PolarHBondContact O-N 3.36Å; F18-Y20 VanDerWaalsContact C-N 3.28Å; F18-Y20 PolarHBondContact O-N 3.17Å | ||
| 19 | P | 59.5 | Low | 68.7 | Low | 96 Ų | 96 | 125.9 Ų | 125.9 | 62% | 0.623 | 68% | 0.678 | S | S | * | * | trans | -59.3 | 102.7 | 172.4 | 25.4 | -32.2 | 0 | 0 | 0 | 106.1 | R21 | P19-R21 HydrophobicContact CB-CG 4.16Å; P19-R21 PolarHBondContact O-N 3.28Å | ||
| 20 | Y | 63.1 | Low | 70.4 | Confident | 173 Ų | 173 | 126.1 Ų | 126.1 | 68% | 0.678 | 68% | 0.679 | S | S | * | * | trans | -69.8 | 75.7 | 171.5 | -174.6 | -96.6 | 0 | 0 | 0 | 105.4 | F18 C22 R26 | F18-Y20 VanDerWaalsContact C-N 3.28Å; F18-Y20 PolarHBondContact O-N 3.17Å; Y20-C22 WeakPolarHBondContact CD1-SG 3.21Å; Y20-C22 HydrophobicContact CE1-CB 4.4Å; Y20-C22 WeakPolarHBondContact CE1-SG 3.42Å; Y20-C22 PolarHBondContact O-N 2.88Å; Y20-R26 VanDerWaalsContact CG-NH2 3.3Å | ||
| 21 | R | 66.7 | Low | 72.2 | Confident | 173 Ų | 173 | 126.9 Ų | 126.9 | 65% | 0.653 | 68% | 0.677 | S | S | * | * | trans | -68.4 | 102.2 | 172.7 | -66.3 | -168.1 | 176.8 | -139.8 | 1 | 105.5 | P19 N23 R26 | P19-R21 HydrophobicContact CB-CG 4.16Å; P19-R21 PolarHBondContact O-N 3.28Å; R21-N23 PolarHBondContact O-N 3.49Å; R21-R26 PolarHBondContact O-NE 3.09Å; R21-R26 PolarHBondContact O-NH2 2.98Å | ||
| 22 | C | 78.6 | Confident | 74 | Confident | 110 Ų | 110 | 124.8 Ų | 124.8 | 74% | 0.743 | 66% | 0.66 | S | S | * | * | trans | -70.5 | 51.9 | 169.9 | -51.2 | 0 | 0 | 0 | 0 | 109.9 | Y20 | Y20-C22 WeakPolarHBondContact CD1-SG 3.21Å; Y20-C22 HydrophobicContact CE1-CB 4.4Å; Y20-C22 WeakPolarHBondContact CE1-SG 3.42Å; Y20-C22 PolarHBondContact O-N 2.88Å | ||
| 23 | N | 88.6 | Confident | 76.1 | Confident | 66 Ų | 66 | 126.9 Ų | 126.9 | 35% | 0.353 | 66% | 0.662 | S | S | . | * | trans | -105.9 | 147.5 | 179 | 67.7 | 3.4 | 0 | 0 | 0 | 110.2 | R21 N25 R26 | R21-N23 PolarHBondContact O-N 3.49Å; N23-N25 PolarHBondContact O-N 2.87Å; N23-N25 VanDerWaalsContact O-N 3.1Å; N23-R26 PolarHBondContact O-N 2.81Å; N23-R26 PolarHBondContact OD1-N 2.82Å; N23-R26 VanDerWaalsContact OD1-N 3.09Å | ||
| 24 | A | 88.5 | Confident | 78 | Confident | 101 Ų | 101 | 130.5 Ų | 130.5 | 84% | 0.835 | 66% | 0.663 | S | S | * | * | G | 310 helix | trans | -60.9 | -19.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 25 | N | 90 | Very high | 80.1 | Confident | 119 Ų | 119 | 134 Ų | 134 | 64% | 0.636 | 67% | 0.67 | S | S | * | * | G | 310 helix | trans | -82.3 | -10.4 | -175 | -62.6 | -19.2 | 0 | 0 | 0 | 114.1 | N23 A27 A28 | N23-N25 PolarHBondContact O-N 2.87Å; N23-N25 VanDerWaalsContact O-N 3.1Å; N25-A27 PolarHBondContact O-N 3.1Å; N25-A27 VanDerWaalsContact O-N 3.1Å; N25-A28 PolarHBondContact O-N 2.87Å |
| 26 | R | 89.7 | Confident | 82.1 | Confident | 137 Ų | 137 | 137.1 Ų | 137.1 | 52% | 0.517 | 68% | 0.681 | S | S | . | * | G | 310 helix | trans | -51.8 | -38.9 | -175.7 | -176.4 | -175.3 | -72.4 | -163.5 | 5.1 | 113.2 | Y20 R21 N23 | Y20-R26 VanDerWaalsContact CG-NH2 3.3Å; R21-R26 PolarHBondContact O-NE 3.09Å; R21-R26 PolarHBondContact O-NH2 2.98Å; N23-R26 PolarHBondContact O-N 2.81Å; N23-R26 PolarHBondContact OD1-N 2.82Å; N23-R26 VanDerWaalsContact OD1-N 3.09Å |
| 27 | A | 89.4 | Confident | 84.2 | Confident | 74 Ų | 74 | 136.7 Ų | 136.7 | 61% | 0.612 | 67% | 0.671 | S | S | * | * | G | 310 helix | trans | -120.4 | 15.2 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | N25 L29 C30 | N25-A27 PolarHBondContact O-N 3.1Å; N25-A27 VanDerWaalsContact O-N 3.1Å; A27-L29 VanDerWaalsContact C-N 3.32Å; A27-L29 PolarHBondContact O-N 3.26Å; A27-C30 PolarHBondContact O-SG 3.45Å |
| 28 | A | 90.1 | Very high | 86.2 | Confident | 60 Ų | 60 | 131.9 Ų | 131.9 | 50% | 0.496 | 66% | 0.66 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -67.1 | -33.2 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | N25 C30 | N25-A28 PolarHBondContact O-N 2.87Å; A28-C30 PolarHBondContact O-N 2.98Å |
| 29 | L | 90.6 | Very high | 88 | Confident | 172 Ų | 172 | 133.3 Ų | 133.3 | 90% | 0.901 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -89.7 | 99.7 | 179.1 | -58.4 | -178.8 | 0 | 0 | 0 | 110.3 | A27 | A27-L29 VanDerWaalsContact C-N 3.32Å; A27-L29 PolarHBondContact O-N 3.26Å |
| 30 | C | 92.8 | Very high | 89.7 | Confident | 76 Ų | 76 | 131.4 Ų | 131.4 | 51% | 0.514 | 65% | 0.647 | S | S | . | * | trans | -139.4 | 163.1 | -179.6 | -78.1 | 0 | 0 | 0 | 0 | 111.7 | A27 A28 R56 | A27-C30 PolarHBondContact O-SG 3.45Å; A28-C30 PolarHBondContact O-N 2.98Å; C30-R56 PolarHBondContact O-NH2 2.92Å | ||
| 31 | R | 92.8 | Very high | 91.3 | Very high | 204 Ų | 204 | 126.2 Ų | 126.2 | 77% | 0.77 | 63% | 0.626 | S | S | * | * | trans | -125.2 | 162.7 | 170.5 | 74 | 178.7 | -174.7 | -156.1 | 0.2 | 111.3 | K33 | R31-K33 PolarHBondContact O-N 2.97Š| ||
| 32 | T | 94.6 | Very high | 92.7 | Very high | 44 Ų | 44 | 121.5 Ų | 121.5 | 27% | 0.27 | 62% | 0.619 | S | S | . | * | trans | -66.2 | 117.1 | 171.9 | -52.7 | 0 | 0 | 0 | 0 | 109.8 | R34 Y37 | T32-R34 HydrophobicContact CG2-CB 4.24Å; T32-R34 HydrophobicContact CG2-CG 4.29Å; T32-R34 PolarHBondContact O-N 3.34Å; T32-R34 VanDerWaalsContact O-N 3.1Å; T32-Y37 HydrophobicContact CG2-CD1 4.25Å; T32-Y37 HydrophobicContact CG2-CD2 4.09Å; T32-Y37 HydrophobicContact CG2-CG 3.83Å | ||
| 33 | K | 95.4 | Very high | 93.6 | Very high | 197 Ų | 197 | 116.3 Ų | 116.3 | 86% | 0.857 | 58% | 0.583 | S | S | * | * | trans | -85.3 | 42.9 | -177 | -62.1 | -177.6 | -178.9 | 179.1 | 0 | 112.7 | R31 | R31-K33 PolarHBondContact O-N 2.97Š| ||
| 34 | R | 96 | Very high | 94 | Very high | 193 Ų | 193 | 115.8 Ų | 115.8 | 73% | 0.728 | 59% | 0.585 | S | S | * | * | trans | -119.8 | 146 | 176.3 | -64.6 | -173.9 | 179 | 176.6 | 0.1 | 109.5 | T32 Y37 | T32-R34 HydrophobicContact CG2-CB 4.24Å; T32-R34 HydrophobicContact CG2-CG 4.29Å; T32-R34 PolarHBondContact O-N 3.34Å; T32-R34 VanDerWaalsContact O-N 3.1Å; R34-Y37 VanDerWaalsContact O-CD1 3.32Å; R34-Y37 WeakPolarHBondContact O-CD1 3.4Å | ||
| 35 | R | 96.5 | Very high | 94.4 | Very high | 255 Ų | 255 | 112.4 Ų | 112.4 | 96% | 0.962 | 55% | 0.552 | S | S | * | * | S | Bend | trans | -65.9 | -45.3 | 177.3 | -77.6 | -174.7 | 170.6 | 179.9 | -2.6 | 111.8 | ||
| 36 | L | 96.7 | Very high | 94.8 | Very high | 163 Ų | 163 | 108.4 Ų | 108.4 | 85% | 0.853 | 53% | 0.531 | S | S | * | . | S | Bend | trans | -116.3 | 125.8 | 174.7 | -60.3 | 176.4 | 0 | 0 | 0 | 108.6 | ||
| 37 | Y | 96.5 | Very high | 95.1 | Very high | 135 Ų | 135 | 106.1 Ų | 106.1 | 53% | 0.529 | 52% | 0.523 | S | S | . | . | trans | -150.8 | 145.8 | 175.7 | 60.8 | -80.9 | 0 | 0 | 0 | 110.1 | T32 R34 | T32-Y37 HydrophobicContact CG2-CD1 4.25Å; T32-Y37 HydrophobicContact CG2-CD2 4.09Å; T32-Y37 HydrophobicContact CG2-CG 3.83Å; R34-Y37 VanDerWaalsContact O-CD1 3.32Å; R34-Y37 WeakPolarHBondContact O-CD1 3.4Å | ||
| 38 | G | 96 | Very high | 95.3 | Very high | 59 Ų | 59 | 105.8 Ų | 105.8 | 61% | 0.608 | 52% | 0.515 | S | S | * | . | trans | -66.5 | 151.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | T40 | G38-T40 PolarHBondContact O-N 3.32Š| ||
| 39 | R | 95.6 | Very high | 95.3 | Very high | 192 Ų | 192 | 109.4 Ų | 109.4 | 73% | 0.725 | 53% | 0.525 | S | S | * | . | trans | -60.2 | 134.4 | 173.6 | -174.9 | 169.1 | -179.7 | 172.5 | 0.6 | 109.3 | Y41 | R39-Y41 WeakPolarHBondContact CD-OH 3.29Å; R39-Y41 HydrophobicContact CG-CE1 4.3Å; R39-Y41 HydrophobicContact CG-CE2 4.26Å; R39-Y41 PolarHBondContact NE-OH 3.5Å | ||
| 40 | T | 96.3 | Very high | 95.4 | Very high | 56 Ų | 56 | 104 Ų | 104 | 34% | 0.344 | 51% | 0.512 | S | S | . | . | trans | -125.1 | 150.6 | 174.4 | 53.7 | 0 | 0 | 0 | 0 | 109.7 | G38 F57 | G38-T40 PolarHBondContact O-N 3.32Å; T40-F57 CarbonylContact C-O 3.57Å; T40-F57 WeakPolarHBondContact CA-O 3.38Å; T40-F57 WeakPolarHBondContact CB-O 3.43Å | ||
| 41 | Y | 96.6 | Very high | 95.5 | Very high | 64 Ų | 64 | 101.9 Ų | 101.9 | 25% | 0.251 | 50% | 0.503 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.6 | 143.1 | -178 | -58.1 | -84.7 | 0 | 0 | 0 | 109.6 | R39 V43 R56 F57 H58 P60 | R39-Y41 WeakPolarHBondContact CD-OH 3.29Å; R39-Y41 HydrophobicContact CG-CE1 4.3Å; R39-Y41 HydrophobicContact CG-CE2 4.26Å; R39-Y41 PolarHBondContact NE-OH 3.5Å; Y41-V43 PolarHBondContact O-N 2.91Å; Y41-R56 CarbonylContact O-C 3.48Å; Y41-R56 WeakPolarHBondContact O-CA 3.35Å; Y41-F57 PolarHBondContact N-O 3.47Å; Y41-F57 PolarHBondContact O-N 3.49Å; Y41-H58 WeakPolarHBondContact CD2-O 3.43Å; Y41-H58 WeakPolarHBondContact CE2-O 3.48Å; Y41-P60 HydrophobicContact CD1-CB 3.97Å; Y41-P60 HydrophobicContact CD2-CB 3.92Å; Y41-P60 HydrophobicContact CE1-CB 4.06Å; Y41-P60 HydrophobicContact CE2-CB 4.02Å; Y41-P60 HydrophobicContact CE2-CG 4.32Å; Y41-P60 HydrophobicContact CG-CB 3.89Å |
| 42 | P | 95.7 | Very high | 95.7 | Very high | 75 Ų | 75 | 96.3 Ų | 96.3 | 49% | 0.487 | 50% | 0.495 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.5 | 121.6 | 172.6 | 28.8 | -31.3 | 0 | 0 | 0 | 109.6 | I55 | P42-I55 CarbonylContact C-O 3.53Å; P42-I55 WeakPolarHBondContact CA-O 3.49Å |
| 43 | V | 97.2 | Very high | 95.7 | Very high | 1 Ų | 1 | 98.2 Ų | 98.2 | 1% | 0.006 | 50% | 0.503 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.6 | 141.5 | -178.7 | -174.6 | 0 | 0 | 0 | 0 | 109.8 | Y41 I55 F57 R61 L64 | Y41-V43 PolarHBondContact O-N 2.91Å; V43-I55 HydrophobicContact CB-CG1 4.46Å; V43-I55 PolarHBondContact N-O 2.92Å; V43-I55 PolarHBondContact O-N 3.19Å; V43-F57 HydrophobicContact CB-CB 4.12Å; V43-F57 HydrophobicContact CG2-CB 3.48Å; V43-F57 VanDerWaalsContact CG2-CB 3.48Å; V43-F57 HydrophobicContact CG2-CG 4.41Å; V43-R61 HydrophobicContact CG1-CB 4.36Å; V43-R61 VanDerWaalsContact CG2-O 3.24Å; V43-R61 WeakPolarHBondContact CG2-O 3.01Å; V43-L64 HydrophobicContact CG1-CB 4.41Å; V43-L64 HydrophobicContact CG1-CD1 3.94Å; V43-L64 HydrophobicContact CG1-CG 3.78Å |
| 44 | S | 97.2 | Very high | 95.7 | Very high | 54 Ų | 54 | 98.3 Ų | 98.3 | 38% | 0.378 | 50% | 0.498 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.9 | 110.4 | 173.7 | -64.2 | 0 | 0 | 0 | 0 | 110.3 | I62 M63 L64 | S44-I62 PolarHBondContact N-O 3.15Å; S44-M63 CarbonylContact O-C 3.58Å; S44-M63 WeakPolarHBondContact O-CA 3.41Å; S44-M63 WeakPolarHBondContact O-CB 3.36Å; S44-L64 PolarHBondContact O-N 2.94Å |
| 45 | L | 97.4 | Very high | 95.7 | Very high | 30 Ų | 30 | 91.7 Ų | 91.7 | 16% | 0.157 | 48% | 0.476 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.2 | 121.7 | 171.8 | -174.1 | 76.7 | 0 | 0 | 0 | 108.9 | Y47 S52 I53 I55 L64 I66 | L45-Y47 HydrophobicContact CD2-CE2 4.45Å; L45-S52 CarbonylContact O-C 3.59Å; L45-S52 VanDerWaalsContact O-CA 3.25Å; L45-S52 WeakPolarHBondContact O-CA 3.36Å; L45-I53 WeakPolarHBondContact CB-O 3.38Å; L45-I53 PolarHBondContact N-O 3.31Å; L45-I53 PolarHBondContact O-N 3.38Å; L45-I55 HydrophobicContact CB-CD1 3.96Å; L45-I55 HydrophobicContact CB-CG1 4.15Å; L45-I55 HydrophobicContact CB-CG2 4.42Å; L45-I55 HydrophobicContact CD1-CD1 4.12Å; L45-I55 HydrophobicContact CD2-CD1 4.41Å; L45-I55 HydrophobicContact CG-CD1 4.41Å; L45-L64 CarbonylContact C-O 3.56Å; L45-L64 WeakPolarHBondContact CA-O 3.25Å; L45-L64 HydrophobicContact CD1-CB 3.96Å; L45-I66 HydrophobicContact CD1-CD1 3.91Å; L45-I66 HydrophobicContact CD1-CG1 3.91Å; L45-I66 HydrophobicContact CD2-CD1 3.9Å; L45-I66 HydrophobicContact CG-CD1 3.83Å; L45-I66 HydrophobicContact CG-CG1 4.3Å |
| 46 | I | 97.3 | Very high | 95.6 | Very high | 36 Ų | 36 | 86.2 Ų | 86.2 | 19% | 0.185 | 46% | 0.455 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.3 | 124.3 | -178.9 | -65.4 | 162.1 | 0 | 0 | 0 | 109 | G51 M63 L64 I66 | I46-G51 WeakPolarHBondContact CA-O 3.42Å; I46-M63 HydrophobicContact CD1-CB 4.02Å; I46-M63 HydrophobicContact CD1-CE 3.21Å; I46-M63 HydrophobicContact CD1-CG 4.24Å; I46-M63 HydrophobicContact CD1-SD 3.4Å; I46-M63 WeakPolarHBondContact CD1-SD 3.23Å; I46-L64 PolarHBondContact N-O 3.36Å; I46-I66 PolarHBondContact O-N 3.08Å |
| 47 | Y | 95.9 | Very high | 95.6 | Very high | 88 Ų | 88 | 80.9 Ų | 80.9 | 35% | 0.345 | 43% | 0.425 | S | S | . | . | trans | -80.7 | 157.4 | 175.2 | -71.4 | -79.1 | 0 | 0 | 0 | 111.3 | L45 N49 G50 G51 I53 I66 | L45-Y47 HydrophobicContact CD2-CE2 4.45Å; Y47-N49 WeakPolarHBondContact CB-OD1 3.36Å; Y47-N49 PolarHBondContact O-N 3.11Å; Y47-N49 VanDerWaalsContact O-N 3.17Å; Y47-G50 PolarHBondContact O-N 3.1Å; Y47-G51 PolarHBondContact N-O 3.12Å; Y47-I53 HydrophobicContact CE2-CB 4.3Å; Y47-I53 HydrophobicContact CE2-CD1 3.53Å; Y47-I53 HydrophobicContact CE2-CG1 3.77Å; Y47-I66 HydrophobicContact CD1-CD1 3.63Å; Y47-I66 HydrophobicContact CE1-CD1 3.72Å; Y47-I66 HydrophobicContact CG-CD1 4.34Å | ||
| 48 | P | 93.6 | Very high | 95.6 | Very high | 68 Ų | 68 | 79.7 Ų | 79.7 | 44% | 0.442 | 42% | 0.424 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.8 | -20.5 | 177.9 | 26.3 | -35.7 | 0 | 0 | 0 | 113.4 | G50 L68 | P48-G50 VanDerWaalsContact C-N 3.26Å; P48-G50 PolarHBondContact O-N 3.27Å; P48-L68 HydrophobicContact CB-CB 3.94Å; P48-L68 HydrophobicContact CB-CD1 3.91Å; P48-L68 HydrophobicContact CG-CD1 4.32Å |
| 49 | N | 90.4 | Very high | 95.6 | Very high | 135 Ų | 135 | 81 Ų | 81 | 72% | 0.722 | 42% | 0.415 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81 | 0.6 | 174 | 68 | -3 | 0 | 0 | 0 | 113.8 | Y47 G51 | Y47-N49 WeakPolarHBondContact CB-OD1 3.36Å; Y47-N49 PolarHBondContact O-N 3.11Å; Y47-N49 VanDerWaalsContact O-N 3.17Å; N49-G51 VanDerWaalsContact C-N 3.35Å; N49-G51 PolarHBondContact OD1-N 2.9Å |
| 50 | G | 92.2 | Very high | 95.6 | Very high | 60 Ų | 60 | 76.5 Ų | 76.5 | 62% | 0.619 | 41% | 0.41 | S | S | * | . | S | Bend | trans | 87.6 | -6.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | Y47 P48 | Y47-G50 PolarHBondContact O-N 3.1Å; P48-G50 VanDerWaalsContact C-N 3.26Å; P48-G50 PolarHBondContact O-N 3.27Å |
| 51 | G | 95.4 | Very high | 95.6 | Very high | 31 Ų | 31 | 80.1 Ų | 80.1 | 32% | 0.32 | 42% | 0.418 | S | S | . | . | trans | -65.5 | 152.7 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | I46 Y47 N49 | I46-G51 WeakPolarHBondContact CA-O 3.42Å; Y47-G51 PolarHBondContact N-O 3.12Å; N49-G51 VanDerWaalsContact C-N 3.35Å; N49-G51 PolarHBondContact OD1-N 2.9Å | ||
| 52 | S | 96.8 | Very high | 95.5 | Very high | 86 Ų | 86 | 84.5 Ų | 84.5 | 60% | 0.601 | 44% | 0.444 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -132.3 | 142.8 | 176.7 | 66.2 | 0 | 0 | 0 | 0 | 112.6 | L45 | L45-S52 CarbonylContact O-C 3.59Å; L45-S52 VanDerWaalsContact O-CA 3.25Å; L45-S52 WeakPolarHBondContact O-CA 3.36Å |
| 53 | I | 95.9 | Very high | 95.5 | Very high | 85 Ų | 85 | 85.8 Ų | 85.8 | 44% | 0.436 | 45% | 0.445 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.7 | 139.8 | 175.1 | -64.8 | -179.9 | 0 | 0 | 0 | 109.3 | L45 Y47 I55 | L45-I53 WeakPolarHBondContact CB-O 3.38Å; L45-I53 PolarHBondContact N-O 3.31Å; L45-I53 PolarHBondContact O-N 3.38Å; Y47-I53 HydrophobicContact CE2-CB 4.3Å; Y47-I53 HydrophobicContact CE2-CD1 3.53Å; Y47-I53 HydrophobicContact CE2-CG1 3.77Å; I53-I55 HydrophobicContact CG2-CG2 4.11Å |
| 54 | R | 95.1 | Very high | 95.4 | Very high | 199 Ų | 199 | 87 Ų | 87 | 75% | 0.751 | 45% | 0.451 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -87 | 116.7 | 176.3 | -167.1 | 175 | -174.2 | -175.3 | 1.8 | 110.3 | ||
| 55 | I | 95.3 | Very high | 95.4 | Very high | 53 Ų | 53 | 91.7 Ų | 91.7 | 27% | 0.272 | 47% | 0.467 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.8 | 167.9 | 179 | 62.8 | 169 | 0 | 0 | 0 | 111.1 | P42 V43 L45 I53 L64 | P42-I55 CarbonylContact C-O 3.53Å; P42-I55 WeakPolarHBondContact CA-O 3.49Å; V43-I55 HydrophobicContact CB-CG1 4.46Å; V43-I55 PolarHBondContact N-O 2.92Å; V43-I55 PolarHBondContact O-N 3.19Å; L45-I55 HydrophobicContact CB-CD1 3.96Å; L45-I55 HydrophobicContact CB-CG1 4.15Å; L45-I55 HydrophobicContact CB-CG2 4.42Å; L45-I55 HydrophobicContact CD1-CD1 4.12Å; L45-I55 HydrophobicContact CD2-CD1 4.41Å; L45-I55 HydrophobicContact CG-CD1 4.41Å; I53-I55 HydrophobicContact CG2-CG2 4.11Å; I55-L64 HydrophobicContact CD1-CD1 4.35Å |
| 56 | R | 95.2 | Very high | 95.3 | Very high | 140 Ų | 140 | 92.9 Ų | 92.9 | 53% | 0.528 | 47% | 0.473 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.6 | 125.4 | 169.7 | -70.1 | -175.8 | -176.8 | 81.4 | 2.9 | 108.7 | C30 Y41 | C30-R56 PolarHBondContact O-NH2 2.92Å; Y41-R56 CarbonylContact O-C 3.48Å; Y41-R56 WeakPolarHBondContact O-CA 3.35Å |
| 57 | F | 96.5 | Very high | 95.1 | Very high | 51 Ų | 51 | 96.4 Ų | 96.4 | 22% | 0.224 | 50% | 0.498 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.1 | 158.8 | -178.2 | -161.1 | -117.9 | 0 | 0 | 0 | 111.1 | T40 Y41 V43 E59 L64 | T40-F57 CarbonylContact C-O 3.57Å; T40-F57 WeakPolarHBondContact CA-O 3.38Å; T40-F57 WeakPolarHBondContact CB-O 3.43Å; Y41-F57 PolarHBondContact N-O 3.47Å; Y41-F57 PolarHBondContact O-N 3.49Å; V43-F57 HydrophobicContact CB-CB 4.12Å; V43-F57 HydrophobicContact CG2-CB 3.48Å; V43-F57 VanDerWaalsContact CG2-CB 3.48Å; V43-F57 HydrophobicContact CG2-CG 4.41Å; F57-E59 HydrophobicContact CD1-CB 3.92Å; F57-E59 HydrophobicContact CE1-CB 3.9Å; F57-L64 HydrophobicContact CD1-CD1 4.06Å; F57-L64 HydrophobicContact CD2-CD1 3.85Å; F57-L64 HydrophobicContact CE1-CD1 4.1Å; F57-L64 HydrophobicContact CE1-CD2 4.44Å; F57-L64 HydrophobicContact CE2-CD1 3.89Å; F57-L64 HydrophobicContact CG-CD1 3.93Å; F57-L64 HydrophobicContact CZ-CD1 4Å |
| 58 | H | 96.1 | Very high | 94.9 | Very high | 110 Ų | 110 | 95.6 Ų | 95.6 | 51% | 0.509 | 50% | 0.499 | S | S | . | . | S | Bend | trans | -76.4 | -36.8 | -177.3 | 62.3 | -74.2 | 0 | 0 | 0 | 112.7 | Y41 | Y41-H58 WeakPolarHBondContact CD2-O 3.43Å; Y41-H58 WeakPolarHBondContact CE2-O 3.48Å |
| 59 | E | 95.6 | Very high | 94.9 | Very high | 87 Ų | 87 | 96 Ų | 96 | 41% | 0.407 | 50% | 0.497 | S | S | . | . | S | Bend | trans | -90.2 | 145.8 | 176.7 | -78.8 | 156.8 | -149 | 0 | 0 | 112.3 | F57 R61 | F57-E59 HydrophobicContact CD1-CB 3.92Å; F57-E59 HydrophobicContact CE1-CB 3.9Å; E59-R61 VanDerWaalsContact C-N 3.3Å; E59-R61 HydrophobicContact CB-CG 4.07Å; E59-R61 PolarHBondContact O-N 3.25Å |
| 60 | P | 96 | Very high | 94.9 | Very high | 98 Ų | 98 | 91.2 Ų | 91.2 | 64% | 0.636 | 47% | 0.472 | S | S | * | . | trans | -78.3 | 76.7 | 176.9 | 33.2 | -35.1 | 0 | 0 | 0 | 111.2 | Y41 | Y41-P60 HydrophobicContact CD1-CB 3.97Å; Y41-P60 HydrophobicContact CD2-CB 3.92Å; Y41-P60 HydrophobicContact CE1-CB 4.06Å; Y41-P60 HydrophobicContact CE2-CB 4.02Å; Y41-P60 HydrophobicContact CE2-CG 4.32Å; Y41-P60 HydrophobicContact CG-CB 3.89Å | ||
| 61 | R | 95.4 | Very high | 94.8 | Very high | 131 Ų | 131 | 94 Ų | 94 | 49% | 0.494 | 47% | 0.472 | S | S | . | . | trans | -104.3 | 148.6 | 174.8 | -55.6 | -177.7 | 92.7 | 175.9 | 7.4 | 110.2 | V43 E59 | V43-R61 HydrophobicContact CG1-CB 4.36Å; V43-R61 VanDerWaalsContact CG2-O 3.24Å; V43-R61 WeakPolarHBondContact CG2-O 3.01Å; E59-R61 VanDerWaalsContact C-N 3.3Å; E59-R61 HydrophobicContact CB-CG 4.07Å; E59-R61 PolarHBondContact O-N 3.25Å | ||
| 62 | I | 94.8 | Very high | 94.5 | Very high | 157 Ų | 157 | 99 Ų | 99 | 81% | 0.805 | 49% | 0.492 | S | S | * | . | S | Bend | trans | -76.6 | -46.4 | 176.8 | -60.5 | 174 | 0 | 0 | 0 | 110.1 | S44 | S44-I62 PolarHBondContact N-O 3.15Š|
| 63 | M | 95.6 | Very high | 94.1 | Very high | 102 Ų | 102 | 95.9 Ų | 95.9 | 50% | 0.502 | 47% | 0.47 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.2 | 157.5 | 177.3 | 77.8 | 168.8 | 41.9 | 0 | 0 | 112.9 | S44 I46 | S44-M63 CarbonylContact O-C 3.58Å; S44-M63 WeakPolarHBondContact O-CA 3.41Å; S44-M63 WeakPolarHBondContact O-CB 3.36Å; I46-M63 HydrophobicContact CD1-CB 4.02Å; I46-M63 HydrophobicContact CD1-CE 3.21Å; I46-M63 HydrophobicContact CD1-CG 4.24Å; I46-M63 HydrophobicContact CD1-SD 3.4Å; I46-M63 WeakPolarHBondContact CD1-SD 3.23Å |
| 64 | L | 96.3 | Very high | 94 | Very high | 27 Ų | 27 | 94.3 Ų | 94.3 | 14% | 0.141 | 47% | 0.466 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.1 | 118.9 | 170.3 | -72.1 | 170.4 | 0 | 0 | 0 | 108.3 | V43 S44 L45 I46 I55 F57 | V43-L64 HydrophobicContact CG1-CB 4.41Å; V43-L64 HydrophobicContact CG1-CD1 3.94Å; V43-L64 HydrophobicContact CG1-CG 3.78Å; S44-L64 PolarHBondContact O-N 2.94Å; L45-L64 CarbonylContact C-O 3.56Å; L45-L64 WeakPolarHBondContact CA-O 3.25Å; L45-L64 HydrophobicContact CD1-CB 3.96Å; I46-L64 PolarHBondContact N-O 3.36Å; I55-L64 HydrophobicContact CD1-CD1 4.35Å; F57-L64 HydrophobicContact CD1-CD1 4.06Å; F57-L64 HydrophobicContact CD2-CD1 3.85Å; F57-L64 HydrophobicContact CE1-CD1 4.1Å; F57-L64 HydrophobicContact CE1-CD2 4.44Å; F57-L64 HydrophobicContact CE2-CD1 3.89Å; F57-L64 HydrophobicContact CG-CD1 3.93Å; F57-L64 HydrophobicContact CZ-CD1 4Å |
| 65 | Q | 96.1 | Very high | 94 | Very high | 152 Ų | 152 | 89.9 Ų | 89.9 | 71% | 0.71 | 46% | 0.464 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -96.8 | 123.6 | 177.6 | -171.7 | 174.3 | 14 | 0 | 0 | 110.1 | ||
| 66 | I | 95.3 | Very high | 93.9 | Very high | 55 Ų | 55 | 93.6 Ų | 93.6 | 28% | 0.282 | 48% | 0.48 | S | S | . | . | P | Polyproline II helix | trans | -77.8 | 128.1 | 172.5 | -64.6 | 166.4 | 0 | 0 | 0 | 108.2 | L45 I46 Y47 | L45-I66 HydrophobicContact CD1-CD1 3.91Å; L45-I66 HydrophobicContact CD1-CG1 3.91Å; L45-I66 HydrophobicContact CD2-CD1 3.9Å; L45-I66 HydrophobicContact CG-CD1 3.83Å; L45-I66 HydrophobicContact CG-CG1 4.3Å; I46-I66 PolarHBondContact O-N 3.08Å; Y47-I66 HydrophobicContact CD1-CD1 3.63Å; Y47-I66 HydrophobicContact CE1-CD1 3.72Å; Y47-I66 HydrophobicContact CG-CD1 4.34Å |
| 67 | P | 94.5 | Very high | 93.8 | Very high | 110 Ų | 110 | 91 Ų | 91 | 71% | 0.714 | 47% | 0.474 | S | S | * | . | P | Polyproline II helix | trans | -67.3 | 147.6 | 174.1 | 29.5 | -34.6 | 0 | 0 | 0 | 110.5 | D69 | P67-D69 PolarHBondContact O-N 3.38Š|
| 68 | L | 91.4 | Very high | 93.7 | Very high | 71 Ų | 71 | 93.8 Ų | 93.8 | 37% | 0.372 | 48% | 0.483 | S | S | . | . | P | Polyproline II helix | trans | -71.5 | 127.6 | 169.8 | 177 | 68.2 | 0 | 0 | 0 | 109.6 | P48 R81 | P48-L68 HydrophobicContact CB-CB 3.94Å; P48-L68 HydrophobicContact CB-CD1 3.91Å; P48-L68 HydrophobicContact CG-CD1 4.32Å; L68-R81 VanDerWaalsContact CD2-CZ 3.5Å; L68-R81 VanDerWaalsContact CD2-NE 3.29Å |
| 69 | D | 92.4 | Very high | 93.6 | Very high | 75 Ų | 75 | 94.5 Ų | 94.5 | 40% | 0.401 | 49% | 0.486 | S | S | . | . | P | Polyproline II helix | trans | -74.3 | 135 | 168.7 | -164.9 | -7.6 | 0 | 0 | 0 | 110.3 | P67 N71 C73 | P67-D69 PolarHBondContact O-N 3.38Å; D69-N71 VanDerWaalsContact C-N 3.34Å; D69-N71 PolarHBondContact OD1-N 3.23Å; D69-N71 VanDerWaalsContact OD1-N 3.12Å; D69-N71 PolarHBondContact OD1-ND2 3.29Å; D69-C73 PolarHBondContact O-SG 3.21Å; D69-C73 VanDerWaalsContact O-SG 3.32Å |
| 70 | L | 90.1 | Very high | 93.6 | Very high | 36 Ų | 36 | 96.7 Ų | 96.7 | 19% | 0.188 | 50% | 0.495 | C | S | . | . | S | Bend | trans | -80.1 | -18.7 | 179.3 | -66.2 | 177.6 | 0 | 0 | 0 | 112.5 | ||
| 71 | N | 90.4 | Very high | 93.5 | Very high | 117 Ų | 117 | 95.5 Ų | 95.5 | 63% | 0.626 | 48% | 0.477 | S | S | * | . | S | Bend | trans | -76.3 | -29.9 | 179.3 | -59.8 | -45.8 | 0 | 0 | 0 | 112.2 | D69 C73 | D69-N71 VanDerWaalsContact C-N 3.34Å; D69-N71 PolarHBondContact OD1-N 3.23Å; D69-N71 VanDerWaalsContact OD1-N 3.12Å; D69-N71 PolarHBondContact OD1-ND2 3.29Å; N71-C73 VanDerWaalsContact C-N 3.28Å; N71-C73 PolarHBondContact O-N 3.36Å |
| 72 | D | 89.8 | Confident | 93.3 | Very high | 137 Ų | 137 | 93.2 Ų | 93.2 | 73% | 0.733 | 48% | 0.475 | S | S | * | . | S | Bend | trans | -78 | -12.8 | 178.1 | -65.2 | -20.6 | 0 | 0 | 0 | 113.2 | ||
| 73 | C | 88.3 | Confident | 93.2 | Very high | 20 Ų | 20 | 91.4 Ų | 91.4 | 14% | 0.135 | 47% | 0.466 | C | S | . | . | S | Bend | trans | -81 | 149.9 | -178.5 | -65 | 0 | 0 | 0 | 0 | 111.7 | D69 N71 R78 R81 | D69-C73 PolarHBondContact O-SG 3.21Å; D69-C73 VanDerWaalsContact O-SG 3.32Å; N71-C73 VanDerWaalsContact C-N 3.28Å; N71-C73 PolarHBondContact O-N 3.36Å; C73-R78 HydrophobicContact CB-CB 4.32Å; C73-R81 PolarHBondContact SG-NH1 2.88Å |
| 74 | S | 94.1 | Very high | 93.1 | Very high | 52 Ų | 52 | 96.5 Ų | 96.5 | 36% | 0.364 | 48% | 0.48 | S | S | . | . | trans | -59.8 | 149.7 | 165.5 | 70.4 | 0 | 0 | 0 | 0 | 110.6 | E76 E77 R78 | S74-E76 PolarHBondContact O-N 3.3Å; S74-E77 PolarHBondContact O-N 3.2Å; S74-E77 WeakPolarHBondContact OG-CB 3.49Å; S74-E77 VanDerWaalsContact OG-CG 3.23Å; S74-E77 WeakPolarHBondContact OG-CG 3.49Å; S74-E77 PolarHBondContact OG-N 3.32Å; S74-R78 WeakPolarHBondContact O-CB 3.49Å; S74-R78 PolarHBondContact O-N 3.12Å | ||
| 75 | P | 93.8 | Very high | 92.9 | Very high | 107 Ų | 107 | 103.2 Ų | 103.2 | 70% | 0.695 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.4 | -37.3 | -176.5 | 22.4 | -33.3 | 0 | 0 | 0 | 112.2 | R78 Q79 | P75-R78 PolarHBondContact O-N 3.04Å; P75-Q79 PolarHBondContact O-N 3.08Å |
| 76 | E | 94.7 | Very high | 92.6 | Very high | 130 Ų | 130 | 98.3 Ų | 98.3 | 61% | 0.607 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -64.7 | -46.4 | 176.7 | -62.1 | -175.4 | -175.7 | 0 | 0 | 112.5 | S74 R78 Q79 K80 | S74-E76 PolarHBondContact O-N 3.3Å; E76-R78 VanDerWaalsContact C-N 3.32Å; E76-R78 PolarHBondContact O-N 2.77Å; E76-Q79 PolarHBondContact O-N 3.25Å; E76-K80 WeakPolarHBondContact O-CG 3.4Å; E76-K80 PolarHBondContact O-N 2.89Å |
| 77 | E | 93.4 | Very high | 92.3 | Very high | 87 Ų | 87 | 101.6 Ų | 101.6 | 41% | 0.407 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.9 | -39.2 | 178.1 | -76.1 | -175.1 | -157.1 | 0 | 0 | 111.7 | S74 Q79 K80 R81 | S74-E77 PolarHBondContact O-N 3.2Å; S74-E77 WeakPolarHBondContact OG-CB 3.49Å; S74-E77 VanDerWaalsContact OG-CG 3.23Å; S74-E77 WeakPolarHBondContact OG-CG 3.49Å; S74-E77 PolarHBondContact OG-N 3.32Å; E77-Q79 VanDerWaalsContact C-N 3.33Å; E77-Q79 PolarHBondContact O-N 3.5Å; E77-K80 PolarHBondContact O-N 3.25Å; E77-R81 WeakPolarHBondContact O-CB 3.46Å; E77-R81 WeakPolarHBondContact O-CG 3.21Å; E77-R81 PolarHBondContact O-N 3.01Å; E77-R81 IonicContact OE2-CZ 3.46Å; E77-R81 IonicContact OE2-NH1 2.77Å; E77-R81 PolarHBondContact OE2-NH1 2.81Å; E77-R81 IonicContact OE2-NH2 3.2Å; E77-R81 PolarHBondContact OE2-NH2 2.98Å |
| 78 | R | 94.4 | Very high | 91.8 | Very high | 108 Ų | 108 | 108 Ų | 108 | 41% | 0.408 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -57.4 | -48.3 | 174.1 | 177.9 | 179.4 | 173 | 164.6 | -0.8 | 110.4 | C73 S74 P75 E76 R81 L82 | C73-R78 HydrophobicContact CB-CB 4.32Å; S74-R78 WeakPolarHBondContact O-CB 3.49Å; S74-R78 PolarHBondContact O-N 3.12Å; P75-R78 PolarHBondContact O-N 3.04Å; E76-R78 VanDerWaalsContact C-N 3.32Å; E76-R78 PolarHBondContact O-N 2.77Å; R78-R81 PolarHBondContact O-N 2.9Å; R78-L82 HydrophobicContact CG-CD1 4.17Å; R78-L82 WeakPolarHBondContact O-CG 3.35Å; R78-L82 PolarHBondContact O-N 3.48Å |
| 79 | Q | 94.1 | Very high | 91.3 | Very high | 125 Ų | 125 | 109.1 Ų | 109.1 | 58% | 0.584 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -61.2 | -47 | 177.4 | -172.4 | 178.2 | 4.6 | 0 | 0 | 111.8 | P75 E76 E77 R81 L82 L83 | P75-Q79 PolarHBondContact O-N 3.08Å; E76-Q79 PolarHBondContact O-N 3.25Å; E77-Q79 VanDerWaalsContact C-N 3.33Å; E77-Q79 PolarHBondContact O-N 3.5Å; Q79-R81 VanDerWaalsContact C-N 3.28Å; Q79-R81 PolarHBondContact O-N 3.17Å; Q79-L82 PolarHBondContact O-N 2.89Å; Q79-L82 VanDerWaalsContact O-N 3.15Å; Q79-L83 HydrophobicContact CG-CD1 4.28Å; Q79-L83 WeakPolarHBondContact O-CG 3.45Å; Q79-L83 PolarHBondContact O-N 2.88Å |
| 80 | K | 94.1 | Very high | 90.6 | Very high | 134 Ų | 134 | 114.7 Ų | 114.7 | 58% | 0.583 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -56.4 | -41.5 | 175.7 | -71.8 | 172.6 | -174.4 | 170.4 | 0 | 112 | E76 E77 R84 | E76-K80 WeakPolarHBondContact O-CG 3.4Å; E76-K80 PolarHBondContact O-N 2.89Å; E77-K80 PolarHBondContact O-N 3.25Å; K80-R84 WeakPolarHBondContact O-CG 3.21Å; K80-R84 PolarHBondContact O-N 2.85Å; K80-R84 VanDerWaalsContact O-N 3.08Å |
| 81 | R | 93.5 | Very high | 89.9 | Confident | 73 Ų | 73 | 120.1 Ų | 120.1 | 28% | 0.275 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -68 | -39.9 | 177.1 | -73.5 | -178.3 | 179.8 | 100.7 | 8.6 | 112.4 | L68 C73 E77 R78 Q79 R84 R85 | L68-R81 VanDerWaalsContact CD2-CZ 3.5Å; L68-R81 VanDerWaalsContact CD2-NE 3.29Å; C73-R81 PolarHBondContact SG-NH1 2.88Å; E77-R81 WeakPolarHBondContact O-CB 3.46Å; E77-R81 WeakPolarHBondContact O-CG 3.21Å; E77-R81 PolarHBondContact O-N 3.01Å; E77-R81 IonicContact OE2-CZ 3.46Å; E77-R81 IonicContact OE2-NH1 2.77Å; E77-R81 PolarHBondContact OE2-NH1 2.81Å; E77-R81 IonicContact OE2-NH2 3.2Å; E77-R81 PolarHBondContact OE2-NH2 2.98Å; R78-R81 PolarHBondContact O-N 2.9Å; Q79-R81 VanDerWaalsContact C-N 3.28Å; Q79-R81 PolarHBondContact O-N 3.17Å; R81-R84 PolarHBondContact O-N 3.39Å; R81-R85 WeakPolarHBondContact O-CG 3.41Å; R81-R85 PolarHBondContact O-N 2.8Å |
| 82 | L | 92.8 | Very high | 89.1 | Confident | 83 Ų | 83 | 119.8 Ų | 119.8 | 44% | 0.435 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65 | -43.8 | 176.1 | -70.1 | 172 | 0 | 0 | 0 | 111.6 | R78 Q79 R84 R85 A86 | R78-L82 HydrophobicContact CG-CD1 4.17Å; R78-L82 WeakPolarHBondContact O-CG 3.35Å; R78-L82 PolarHBondContact O-N 3.48Å; Q79-L82 PolarHBondContact O-N 2.89Å; Q79-L82 VanDerWaalsContact O-N 3.15Å; L82-R84 VanDerWaalsContact C-N 3.3Å; L82-R84 PolarHBondContact O-N 2.79Å; L82-R85 WeakPolarHBondContact O-CB 3.34Å; L82-R85 PolarHBondContact O-N 2.92Å; L82-A86 PolarHBondContact O-N 3.05Å; L82-A86 VanDerWaalsContact O-N 3.08Å |
| 83 | L | 92.8 | Very high | 88.2 | Confident | 118 Ų | 118 | 120.2 Ų | 120.2 | 62% | 0.618 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -60.5 | -38.3 | 174.7 | -69.7 | 173.1 | 0 | 0 | 0 | 112.2 | Q79 R85 A86 | Q79-L83 HydrophobicContact CG-CD1 4.28Å; Q79-L83 WeakPolarHBondContact O-CG 3.45Å; Q79-L83 PolarHBondContact O-N 2.88Å; L83-R85 VanDerWaalsContact C-N 3.25Å; L83-R85 PolarHBondContact O-N 3.25Å; L83-A86 WeakPolarHBondContact O-CB 3.24Å; L83-A86 PolarHBondContact O-N 2.88Å |
| 84 | R | 92.1 | Very high | 87.3 | Confident | 210 Ų | 210 | 126 Ų | 126 | 79% | 0.792 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -64.3 | -27.7 | 174.2 | -79 | 178.2 | 58.3 | -170.8 | -2.6 | 113.9 | K80 R81 L82 | K80-R84 WeakPolarHBondContact O-CG 3.21Å; K80-R84 PolarHBondContact O-N 2.85Å; K80-R84 VanDerWaalsContact O-N 3.08Å; R81-R84 PolarHBondContact O-N 3.39Å; L82-R84 VanDerWaalsContact C-N 3.3Å; L82-R84 PolarHBondContact O-N 2.79Å |
| 85 | R | 92.3 | Very high | 86.1 | Confident | 167 Ų | 167 | 131.3 Ų | 131.3 | 63% | 0.63 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -83.8 | -24.2 | 177.8 | -69.1 | 175.5 | -176.2 | -173.9 | 1.1 | 112.3 | R81 L82 L83 | R81-R85 WeakPolarHBondContact O-CG 3.41Å; R81-R85 PolarHBondContact O-N 2.8Å; L82-R85 WeakPolarHBondContact O-CB 3.34Å; L82-R85 PolarHBondContact O-N 2.92Å; L83-R85 VanDerWaalsContact C-N 3.25Å; L83-R85 PolarHBondContact O-N 3.25Å |
| 86 | A | 90.2 | Very high | 84.8 | Confident | 49 Ų | 49 | 134.1 Ų | 134.1 | 41% | 0.405 | 64% | 0.642 | S | S | . | * | S | Bend | trans | -58.1 | 140.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | L82 L83 R88 | L82-A86 PolarHBondContact O-N 3.05Å; L82-A86 VanDerWaalsContact O-N 3.08Å; L83-A86 WeakPolarHBondContact O-CB 3.24Å; L83-A86 PolarHBondContact O-N 2.88Å; A86-R88 PolarHBondContact O-N 2.98Å |
| 87 | P | 89.3 | Confident | 83.5 | Confident | 125 Ų | 125 | 133.8 Ų | 133.8 | 81% | 0.812 | 64% | 0.643 | S | S | * | * | trans | -60 | 130.5 | 180 | 25.6 | -33.7 | 0 | 0 | 0 | 109.5 | S89 | P87-S89 PolarHBondContact O-N 2.93Å; P87-S89 VanDerWaalsContact O-N 3.1Å | ||
| 88 | R | 83.9 | Confident | 82.3 | Confident | 243 Ų | 243 | 137.6 Ų | 137.6 | 92% | 0.917 | 66% | 0.661 | S | S | * | * | trans | -72.3 | 104.8 | 170.8 | -65.4 | -177.2 | 179.4 | -176.8 | -2.1 | 107.5 | A86 K90 | A86-R88 PolarHBondContact O-N 2.98Å; R88-K90 PolarHBondContact O-N 2.84Å | ||
| 89 | S | 79.9 | Confident | 81.2 | Confident | 96 Ų | 96 | 139.2 Ų | 139.2 | 67% | 0.671 | 68% | 0.677 | S | S | * | * | trans | -62.6 | 122.9 | 167.6 | 52.2 | 0 | 0 | 0 | 0 | 108 | P87 L91 | P87-S89 PolarHBondContact O-N 2.93Å; P87-S89 VanDerWaalsContact O-N 3.1Å; S89-L91 PolarHBondContact O-N 2.98Å; S89-L91 VanDerWaalsContact O-N 3.12Å | ||
| 90 | K | 79.2 | Confident | 80.4 | Confident | 192 Ų | 192 | 138.7 Ų | 138.7 | 84% | 0.835 | 68% | 0.683 | S | S | * | * | trans | -62.4 | 115.6 | 164.9 | -67.9 | -179.4 | -179.9 | 179.1 | 0 | 105.9 | R88 T92 | R88-K90 PolarHBondContact O-N 2.84Å; K90-T92 PolarHBondContact O-N 3.19Å | ||
| 91 | L | 74.1 | Confident | 79.7 | Confident | 149 Ų | 149 | 138.6 Ų | 138.6 | 78% | 0.78 | 68% | 0.683 | S | S | * | * | trans | -68.4 | 93.3 | 167.8 | -66.2 | 175.6 | 0 | 0 | 0 | 106.3 | S89 L93 | S89-L91 PolarHBondContact O-N 2.98Å; S89-L91 VanDerWaalsContact O-N 3.12Å; L91-L93 VanDerWaalsContact C-N 3.3Å; L91-L93 PolarHBondContact O-N 3.32Å; L91-L93 VanDerWaalsContact O-N 3.11Å | ||
| 92 | T | 73.9 | Confident | 79.3 | Confident | 111 Ų | 111 | 140.2 Ų | 140.2 | 68% | 0.681 | 70% | 0.697 | S | S | * | * | trans | -70.4 | 99.7 | 158.3 | 48.2 | 0 | 0 | 0 | 0 | 104.9 | K90 L94 | K90-T92 PolarHBondContact O-N 3.19Å; T92-L94 PolarHBondContact O-N 2.88Å | ||
| 93 | L | 70.8 | Confident | 78.7 | Confident | 146 Ų | 146 | 143 Ų | 143 | 76% | 0.764 | 71% | 0.708 | S | S | * | * | trans | -61.2 | 93.9 | 162.8 | -65 | 175.8 | 0 | 0 | 0 | 105.2 | L91 E95 | L91-L93 VanDerWaalsContact C-N 3.3Å; L91-L93 PolarHBondContact O-N 3.32Å; L91-L93 VanDerWaalsContact O-N 3.11Å; L93-E95 PolarHBondContact O-N 3.1Å | ||
| 94 | L | 69.8 | Low | 78.3 | Confident | 141 Ų | 141 | 145.3 Ų | 145.3 | 74% | 0.738 | 72% | 0.715 | S | S | * | * | trans | -68.8 | 93.5 | 158.5 | -67.7 | 173.4 | 0 | 0 | 0 | 103.2 | T92 Q96 | T92-L94 PolarHBondContact O-N 2.88Å; L94-Q96 PolarHBondContact O-N 3.29Å | ||
| 95 | E | 69.6 | Low | 77.9 | Confident | 163 Ų | 163 | 138.1 Ų | 138.1 | 76% | 0.762 | 70% | 0.701 | S | S | * | * | trans | -56.8 | 97.2 | 161.8 | -70.1 | 179.2 | 177.5 | 0 | 0 | 105.1 | L93 I97 | L93-E95 PolarHBondContact O-N 3.1Å; E95-I97 PolarHBondContact O-N 3.41Å | ||
| 96 | Q | 65.6 | Low | 77.5 | Confident | 167 Ų | 167 | 135.8 Ų | 135.8 | 78% | 0.78 | 69% | 0.693 | S | S | * | * | trans | -69.3 | 87.9 | 167 | -72.7 | -177.6 | -3.8 | 0 | 0 | 105 | L94 E98 | L94-Q96 PolarHBondContact O-N 3.29Å; Q96-E98 VanDerWaalsContact C-N 3.35Å; Q96-E98 PolarHBondContact O-N 2.8Å; Q96-E98 VanDerWaalsContact O-N 3.1Å | ||
| 97 | I | 68.8 | Low | 77.3 | Confident | 122 Ų | 122 | 137.2 Ų | 137.2 | 63% | 0.626 | 69% | 0.694 | S | S | * | * | trans | -65.6 | 106.4 | 160.4 | -55.9 | 173.3 | 0 | 0 | 0 | 103.9 | E95 D99 | E95-I97 PolarHBondContact O-N 3.41Å; I97-D99 WeakPolarHBondContact CG2-OD1 3.36Å; I97-D99 PolarHBondContact O-N 3.42Å | ||
| 98 | E | 67.8 | Low | 77.2 | Confident | 168 Ų | 168 | 138 Ų | 138 | 79% | 0.785 | 69% | 0.685 | S | S | * | * | trans | -69.5 | 81.8 | 169.8 | -69.9 | -176.9 | 172.3 | 0 | 0 | 108 | Q96 T100 | Q96-E98 VanDerWaalsContact C-N 3.35Å; Q96-E98 PolarHBondContact O-N 2.8Å; Q96-E98 VanDerWaalsContact O-N 3.1Å; E98-T100 PolarHBondContact O-N 3Å | ||
| 99 | D | 69.9 | Low | 77.3 | Confident | 141 Ų | 141 | 132 Ų | 132 | 75% | 0.754 | 67% | 0.671 | S | S | * | * | trans | -75.4 | 55.7 | 171 | -89.7 | -12.7 | 0 | 0 | 0 | 110.3 | I97 F101 | I97-D99 WeakPolarHBondContact CG2-OD1 3.36Å; I97-D99 PolarHBondContact O-N 3.42Å; D99-F101 PolarHBondContact O-N 3.12Å; D99-F101 VanDerWaalsContact O-N 3.09Å | ||
| 100 | T | 77.9 | Confident | 77.5 | Confident | 114 Ų | 114 | 134.1 Ų | 134.1 | 70% | 0.699 | 67% | 0.673 | S | S | * | * | trans | -83.9 | 70.4 | 165.3 | -48.5 | 0 | 0 | 0 | 0 | 107.6 | E98 D102 | E98-T100 PolarHBondContact O-N 3Å; T100-D102 PolarHBondContact O-N 2.81Å | ||
| 101 | F | 79.9 | Confident | 77.7 | Confident | 132 Ų | 132 | 133.5 Ų | 133.5 | 58% | 0.579 | 67% | 0.671 | S | S | * | * | trans | -86.2 | 106.1 | 175.9 | 176.4 | -100.5 | 0 | 0 | 0 | 110.1 | D99 Q103 Y106 | D99-F101 PolarHBondContact O-N 3.12Å; D99-F101 VanDerWaalsContact O-N 3.09Å; F101-Q103 HydrophobicContact CD1-CB 4.5Å; F101-Q103 HydrophobicContact CE1-CB 3.84Å; F101-Q103 HydrophobicContact CE1-CG 4.22Å; F101-Y106 HydrophobicContact CD2-CD2 4.13Å; F101-Y106 AromaticContact CD2-CE2 3.83Å; F101-Y106 HydrophobicContact CD2-CE2 3.83Å; F101-Y106 AromaticContact CE2-CD2 3.39Å; F101-Y106 HydrophobicContact CE2-CD2 3.39Å; F101-Y106 AromaticContact CE2-CE2 3.51Å; F101-Y106 HydrophobicContact CE2-CE2 3.51Å; F101-Y106 HydrophobicContact CE2-CG 4.22Å; F101-Y106 AromaticContact CZ-CD2 3.89Å; F101-Y106 HydrophobicContact CZ-CD2 3.89Å; F101-Y106 HydrophobicContact CZ-CE2 4.42Å | ||
| 102 | D | 83.9 | Confident | 77.8 | Confident | 108 Ų | 108 | 136.2 Ų | 136.2 | 58% | 0.578 | 68% | 0.676 | S | S | * | * | trans | -89 | 104.7 | 171.6 | -71.6 | -25.5 | 0 | 0 | 0 | 110.3 | T100 E104 A105 Y106 | T100-D102 PolarHBondContact O-N 2.81Å; D102-E104 PolarHBondContact O-N 3.02Å; D102-A105 HydrophobicContact CB-CB 4.26Å; D102-A105 WeakPolarHBondContact O-CB 3.2Å; D102-A105 PolarHBondContact O-N 2.71Å; D102-A105 VanDerWaalsContact O-N 3.17Å; D102-Y106 VanDerWaalsContact O-CD2 3.29Å; D102-Y106 WeakPolarHBondContact O-CD2 3.14Å | ||
| 103 | Q | 80.6 | Confident | 77.4 | Confident | 141 Ų | 141 | 144.5 Ų | 144.5 | 66% | 0.659 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -59.1 | -34.1 | -178.9 | -171.2 | 174.1 | 1.8 | 0 | 0 | 112.6 | F101 A105 Y106 | F101-Q103 HydrophobicContact CD1-CB 4.5Å; F101-Q103 HydrophobicContact CE1-CB 3.84Å; F101-Q103 HydrophobicContact CE1-CG 4.22Å; Q103-A105 VanDerWaalsContact C-N 3.28Å; Q103-A105 PolarHBondContact O-N 3.09Å; Q103-Y106 PolarHBondContact O-N 3.19Å |
| 104 | E | 84.1 | Confident | 77.7 | Confident | 166 Ų | 166 | 144.4 Ų | 144.4 | 78% | 0.776 | 70% | 0.7 | S | S | * | * | G | 310 helix | trans | -63.2 | -34.2 | -179.8 | -63.2 | -168.9 | 166.9 | 0 | 0 | 112.8 | D102 Y106 N107 | D102-E104 PolarHBondContact O-N 3.02Å; E104-Y106 PolarHBondContact O-N 2.76Å; E104-N107 PolarHBondContact O-N 2.71Å |
| 105 | A | 84.7 | Confident | 78.2 | Confident | 60 Ų | 60 | 144.6 Ų | 144.6 | 50% | 0.496 | 70% | 0.698 | S | S | . | * | G | 310 helix | trans | -62.9 | -23.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | D102 Q103 F108 | D102-A105 HydrophobicContact CB-CB 4.26Å; D102-A105 WeakPolarHBondContact O-CB 3.2Å; D102-A105 PolarHBondContact O-N 2.71Å; D102-A105 VanDerWaalsContact O-N 3.17Å; Q103-A105 VanDerWaalsContact C-N 3.28Å; Q103-A105 PolarHBondContact O-N 3.09Å; A105-F108 WeakPolarHBondContact O-CD1 3.33Å; A105-F108 WeakPolarHBondContact O-CE1 3.26Å |
| 106 | Y | 84.6 | Confident | 78.6 | Confident | 117 Ų | 117 | 143.6 Ų | 143.6 | 46% | 0.459 | 69% | 0.694 | S | S | . | * | G | 310 helix | trans | -105.1 | 0.6 | -175.1 | -63.9 | -79 | 0 | 0 | 0 | 114.5 | F101 D102 Q103 E104 F108 L109 | F101-Y106 HydrophobicContact CD2-CD2 4.13Å; F101-Y106 AromaticContact CD2-CE2 3.83Å; F101-Y106 HydrophobicContact CD2-CE2 3.83Å; F101-Y106 AromaticContact CE2-CD2 3.39Å; F101-Y106 HydrophobicContact CE2-CD2 3.39Å; F101-Y106 AromaticContact CE2-CE2 3.51Å; F101-Y106 HydrophobicContact CE2-CE2 3.51Å; F101-Y106 HydrophobicContact CE2-CG 4.22Å; F101-Y106 AromaticContact CZ-CD2 3.89Å; F101-Y106 HydrophobicContact CZ-CD2 3.89Å; F101-Y106 HydrophobicContact CZ-CE2 4.42Å; D102-Y106 VanDerWaalsContact O-CD2 3.29Å; D102-Y106 WeakPolarHBondContact O-CD2 3.14Å; Q103-Y106 PolarHBondContact O-N 3.19Å; E104-Y106 PolarHBondContact O-N 2.76Å; Y106-F108 PolarHBondContact O-N 3.1Å; Y106-L109 HydrophobicContact CD1-CD1 3.89Å; Y106-L109 WeakPolarHBondContact O-CB 3.32Å; Y106-L109 PolarHBondContact O-N 3.26Å |
| 107 | N | 84.1 | Confident | 79.4 | Confident | 79 Ų | 79 | 142.2 Ų | 142.2 | 42% | 0.422 | 69% | 0.689 | S | S | . | * | G | 310 helix | trans | -58.9 | -23.6 | -179 | -81.3 | -24.7 | 0 | 0 | 0 | 113.9 | E104 L109 L110 | E104-N107 PolarHBondContact O-N 2.71Å; N107-L109 PolarHBondContact O-N 3.1Å; N107-L110 PolarHBondContact O-N 3.35Å |
| 108 | F | 87.3 | Confident | 80.1 | Confident | 142 Ų | 142 | 143.4 Ų | 143.4 | 62% | 0.623 | 69% | 0.693 | S | S | * | * | G | 310 helix | trans | -66 | -25.6 | 177.4 | 73.5 | -87.1 | 0 | 0 | 0 | 113.1 | A105 Y106 L110 | A105-F108 WeakPolarHBondContact O-CD1 3.33Å; A105-F108 WeakPolarHBondContact O-CE1 3.26Å; Y106-F108 PolarHBondContact O-N 3.1Å; F108-L110 VanDerWaalsContact C-N 3.27Å; F108-L110 PolarHBondContact O-N 3.41Å |
| 109 | L | 87.3 | Confident | 80.9 | Confident | 118 Ų | 118 | 141.8 Ų | 141.8 | 62% | 0.618 | 69% | 0.687 | S | S | * | * | G | 310 helix | trans | -72.6 | -21.2 | 178.7 | -64 | 173.2 | 0 | 0 | 0 | 112.8 | Y106 N107 | Y106-L109 HydrophobicContact CD1-CD1 3.89Å; Y106-L109 WeakPolarHBondContact O-CB 3.32Å; Y106-L109 PolarHBondContact O-N 3.26Å; N107-L109 PolarHBondContact O-N 3.1Å |
| 110 | L | 84.2 | Confident | 81.7 | Confident | 139 Ų | 139 | 141.9 Ų | 141.9 | 73% | 0.728 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -88.7 | -11.7 | -176.2 | -69.8 | 164.2 | 0 | 0 | 0 | 113.4 | N107 F108 K112 | N107-L110 PolarHBondContact O-N 3.35Å; F108-L110 VanDerWaalsContact C-N 3.27Å; F108-L110 PolarHBondContact O-N 3.41Å; L110-K112 PolarHBondContact O-N 2.76Å |
| 111 | K | 82.9 | Confident | 82 | Confident | 179 Ų | 179 | 144 Ų | 144 | 78% | 0.778 | 68% | 0.681 | S | S | * | * | trans | -83 | 107.8 | 178.8 | -67.6 | -175 | -179.8 | 179.9 | 0 | 110.1 | ||||
| 112 | K | 77.2 | Confident | 82.1 | Confident | 207 Ų | 207 | 145 Ų | 145 | 90% | 0.9 | 69% | 0.689 | S | S | * | * | trans | -69.7 | 135.7 | 167.7 | -76.3 | -170.7 | 176.8 | -178 | 0 | 109.8 | L110 | L110-K112 PolarHBondContact O-N 2.76Š| ||
| 113 | K | 64.7 | Low | 82 | Confident | 284 Ų | 284 | 148.4 Ų | 148.4 | 100% | 1.235 | 70% | 0.699 | S | S | * | * | trans | -56.9 | 0 | 169.2 | -90.4 | -175.7 | 174.9 | 179.9 | 0 | 111.7 |
Retrieved 113 of 113 residues in 101.2 ms
(Link to these results)