| 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 | 48.3 | Very low | 58.2 | Low | 236 Ų | 236 | 138.9 Ų | 138.9 | 100% | 1.163 | 86% | 0.862 | S | S | * | * | 0 | 114.4 | 0 | -76.8 | 170.3 | 169 | 0 | 0 | 107 | |||||
| 2 | E | 54.5 | Low | 58.3 | Low | 175 Ų | 175 | 135.3 Ų | 135.3 | 82% | 0.818 | 86% | 0.857 | S | S | * | * | trans | -67.5 | 149.4 | -155.9 | -54.8 | 103.7 | 100.8 | 0 | 0 | 114.6 | ||||
| 3 | S | 58.5 | Low | 58.1 | Low | 112 Ų | 112 | 132 Ų | 132 | 78% | 0.783 | 85% | 0.849 | S | S | * | * | trans | -158.9 | 99 | 148.4 | -82.2 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 4 | R | 61.7 | Low | 58.2 | Low | 243 Ų | 243 | 133.9 Ų | 133.9 | 92% | 0.917 | 85% | 0.849 | S | S | * | * | trans | 70.3 | 86.7 | 133.2 | -60 | 176.8 | 145.1 | -155.5 | -9.1 | 119.1 | ||||
| 5 | S | 63.6 | Low | 58 | Low | 125 Ų | 125 | 133.3 Ų | 133.3 | 87% | 0.874 | 85% | 0.851 | S | S | * | * | trans | -86 | 112.5 | 150 | -58.6 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 6 | G | 52.6 | Low | 57.6 | Low | 82 Ų | 82 | 129.3 Ų | 129.3 | 85% | 0.845 | 83% | 0.833 | S | S | * | * | trans | -96.1 | 110.6 | 166.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 7 | S | 60.8 | Low | 57 | Low | 118 Ų | 118 | 129.2 Ų | 129.2 | 83% | 0.825 | 83% | 0.831 | S | S | * | * | trans | -111.2 | 126.7 | 172.8 | -71.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 8 | G | 54.4 | Low | 56.7 | Low | 75 Ų | 75 | 131.2 Ų | 131.2 | 77% | 0.773 | 83% | 0.827 | S | S | * | * | trans | -62.6 | 142.2 | -172.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | T10 | G8-T10 PolarHBondContact O-N 3.43Š| ||
| 9 | A | 58.5 | Low | 56.7 | Low | 104 Ų | 104 | 132.3 Ų | 132.3 | 86% | 0.86 | 83% | 0.825 | S | S | * | * | trans | -78 | 110 | 168.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 10 | T | 65.1 | Low | 56.7 | Low | 132 Ų | 132 | 128.8 Ų | 128.8 | 81% | 0.81 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 124.4 | 161.5 | 47 | 0 | 0 | 0 | 0 | 108.9 | G8 A12 | G8-T10 PolarHBondContact O-N 3.43Å; T10-A12 PolarHBondContact O-N 3.48Å |
| 11 | P | 61.6 | Low | 57.1 | Low | 126 Ų | 126 | 130.2 Ų | 130.2 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 132.9 | 173.3 | 25.9 | -30.2 | 0 | 0 | 0 | 110.4 | ||
| 12 | A | 60.1 | Low | 58.2 | Low | 96 Ų | 96 | 122.4 Ų | 122.4 | 79% | 0.793 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 131.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | T10 N14 | T10-A12 PolarHBondContact O-N 3.48Å; A12-N14 PolarHBondContact O-N 3.02Å |
| 13 | A | 56.1 | Low | 59.5 | Low | 92 Ų | 92 | 116.8 Ų | 116.8 | 76% | 0.76 | 74% | 0.743 | S | S | * | * | trans | -64.5 | 116 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | S15 | A13-S15 PolarHBondContact O-N 3.28Š| ||
| 14 | N | 58.9 | Low | 60.9 | Low | 158 Ų | 158 | 112.9 Ų | 112.9 | 85% | 0.845 | 72% | 0.716 | S | S | * | * | trans | -60.1 | 99.9 | 168.9 | -97 | -3.1 | 0 | 0 | 0 | 110.7 | A12 A16 | A12-N14 PolarHBondContact O-N 3.02Å; N14-A16 PolarHBondContact O-N 3.12Å; N14-A16 VanDerWaalsContact O-N 3.12Å | ||
| 15 | S | 55 | Low | 62.3 | Low | 126 Ų | 126 | 104.9 Ų | 104.9 | 88% | 0.881 | 69% | 0.686 | S | S | * | * | trans | -84 | 63 | 163.6 | -61.6 | 0 | 0 | 0 | 0 | 109.6 | A13 | A13-S15 PolarHBondContact O-N 3.28Š| ||
| 16 | A | 51.8 | Low | 63.7 | Low | 68 Ų | 68 | 101.2 Ų | 101.2 | 56% | 0.562 | 66% | 0.656 | S | S | * | * | trans | -85.4 | 125.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | N14 | N14-A16 PolarHBondContact O-N 3.12Å; N14-A16 VanDerWaalsContact O-N 3.12Å | ||
| 17 | T | 48.1 | Very low | 65.7 | Low | 129 Ų | 129 | 97.3 Ų | 97.3 | 79% | 0.791 | 62% | 0.616 | S | S | * | * | trans | 80.8 | 61.4 | 153.7 | 69.9 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 18 | H | 51.8 | Low | 67.1 | Low | 165 Ų | 165 | 93.3 Ų | 93.3 | 76% | 0.764 | 59% | 0.593 | S | S | * | * | trans | -94.9 | 88.9 | 137.1 | -163.2 | -99.9 | 0 | 0 | 0 | 107.7 | S20 | H18-S20 VanDerWaalsContact ND1-CB 3.31Å; H18-S20 WeakPolarHBondContact ND1-CB 3.31Å; H18-S20 PolarHBondContact O-N 3.31Å | ||
| 19 | L | 56.3 | Low | 68.9 | Low | 151 Ų | 151 | 95.5 Ų | 95.5 | 79% | 0.791 | 58% | 0.583 | S | S | * | * | trans | -70.5 | 58.8 | 170.9 | -154.6 | 79.1 | 0 | 0 | 0 | 108.7 | K21 | L19-K21 VanDerWaalsContact C-N 3.26Å; L19-K21 PolarHBondContact O-N 3.11Å | ||
| 20 | S | 56.4 | Low | 70.6 | Confident | 62 Ų | 62 | 93 Ų | 93 | 43% | 0.434 | 56% | 0.559 | S | S | . | * | trans | -62 | 96.8 | 168.2 | 39.8 | 0 | 0 | 0 | 0 | 106.3 | H18 T22 | H18-S20 VanDerWaalsContact ND1-CB 3.31Å; H18-S20 WeakPolarHBondContact ND1-CB 3.31Å; H18-S20 PolarHBondContact O-N 3.31Å; S20-T22 PolarHBondContact O-N 3.06Å | ||
| 21 | K | 64.8 | Low | 71.8 | Confident | 159 Ų | 159 | 96 Ų | 96 | 69% | 0.691 | 56% | 0.555 | S | S | * | * | trans | -49.6 | 109.7 | 167.8 | -66.4 | 174.9 | -178.1 | 175.7 | 0 | 106.4 | L19 V23 | L19-K21 VanDerWaalsContact C-N 3.26Å; L19-K21 PolarHBondContact O-N 3.11Å; K21-V23 PolarHBondContact O-N 2.76Å; K21-V23 VanDerWaalsContact O-N 3.14Å | ||
| 22 | T | 71.5 | Confident | 73.2 | Confident | 73 Ų | 73 | 90.6 Ų | 90.6 | 45% | 0.448 | 52% | 0.522 | S | S | . | . | trans | -58.7 | 119.4 | 172.9 | 43.1 | 0 | 0 | 0 | 0 | 106.5 | S20 S24 | S20-T22 PolarHBondContact O-N 3.06Å; T22-S24 PolarHBondContact O-N 3.47Å | ||
| 23 | V | 80.9 | Confident | 74.6 | Confident | 56 Ų | 56 | 91.6 Ų | 91.6 | 34% | 0.339 | 51% | 0.51 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.3 | 112.7 | 179.3 | 180 | 0 | 0 | 0 | 0 | 106.3 | K21 Y25 K54 | K21-V23 PolarHBondContact O-N 2.76Å; K21-V23 VanDerWaalsContact O-N 3.14Å; V23-Y25 HydrophobicContact CB-CE2 3.85Å; V23-Y25 HydrophobicContact CG1-CD2 4.35Å; V23-Y25 HydrophobicContact CG1-CE1 4.35Å; V23-Y25 HydrophobicContact CG1-CE2 3.82Å; V23-Y25 WeakPolarHBondContact O-CD2 3.45Å; V23-Y25 VanDerWaalsContact O-CE2 3.3Å; V23-Y25 WeakPolarHBondContact O-CE2 3.36Å; V23-Y25 PolarHBondContact O-N 2.92Å; V23-K54 HydrophobicContact CG1-CG 4.08Å |
| 24 | S | 88.5 | Confident | 76.2 | Confident | 30 Ų | 30 | 87.5 Ų | 87.5 | 21% | 0.21 | 48% | 0.475 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.8 | 121.5 | 173 | 57.4 | 0 | 0 | 0 | 0 | 109.5 | T22 K55 | T22-S24 PolarHBondContact O-N 3.47Å; S24-K55 VanDerWaalsContact O-CB 3.29Å; S24-K55 WeakPolarHBondContact O-CB 3.29Å; S24-K55 PolarHBondContact O-N 2.78Å; S24-K55 WeakPolarHBondContact OG-CD 3.4Å |
| 25 | Y | 92.2 | Very high | 77.6 | Confident | 75 Ų | 75 | 86.3 Ų | 86.3 | 29% | 0.294 | 47% | 0.465 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.3 | 153.6 | 172.5 | -64.5 | -92 | 0 | 0 | 0 | 110.5 | V23 E33 N34 I36 L52 Y53 K54 | V23-Y25 HydrophobicContact CB-CE2 3.85Å; V23-Y25 HydrophobicContact CG1-CD2 4.35Å; V23-Y25 HydrophobicContact CG1-CE1 4.35Å; V23-Y25 HydrophobicContact CG1-CE2 3.82Å; V23-Y25 WeakPolarHBondContact O-CD2 3.45Å; V23-Y25 VanDerWaalsContact O-CE2 3.3Å; V23-Y25 WeakPolarHBondContact O-CE2 3.36Å; V23-Y25 PolarHBondContact O-N 2.92Å; Y25-E33 CarbonylContact O-C 3.52Å; Y25-E33 WeakPolarHBondContact O-CA 3.1Å; Y25-N34 PolarHBondContact N-O 2.77Å; Y25-N34 PolarHBondContact O-N 2.82Å; Y25-I36 HydrophobicContact CD2-CB 4.04Å; Y25-I36 HydrophobicContact CD2-CG1 4.35Å; Y25-I36 HydrophobicContact CE2-CB 4.19Å; Y25-L52 HydrophobicContact CD1-CB 4.43Å; Y25-L52 HydrophobicContact CG-CB 4.47Å; Y25-Y53 CarbonylContact C-O 3.45Å; Y25-Y53 VanDerWaalsContact CA-O 3.25Å; Y25-Y53 WeakPolarHBondContact CA-O 3.31Å; Y25-K54 HydrophobicContact CD1-CB 4.46Å; Y25-K54 HydrophobicContact CE1-CB 4.4Å |
| 26 | I | 93 | Very high | 79.1 | Confident | 48 Ų | 48 | 81.4 Ų | 81.4 | 25% | 0.246 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.6 | 129.4 | -179.4 | -60.4 | 173.9 | 0 | 0 | 0 | 108.2 | R31 A32 L52 Y53 K55 | I26-R31 HydrophobicContact CG2-CB 4.29Å; I26-A32 WeakPolarHBondContact CA-O 3.3Å; I26-L52 CarbonylContact O-C 3.55Å; I26-L52 WeakPolarHBondContact O-CA 3.26Å; I26-Y53 PolarHBondContact N-O 2.75Å; I26-Y53 PolarHBondContact O-N 3.3Å; I26-K55 HydrophobicContact CD1-CB 4.14Å; I26-K55 HydrophobicContact CD1-CD 4.46Å; I26-K55 HydrophobicContact CD1-CG 4.02Å; I26-K55 HydrophobicContact CG1-CB 4.37Å |
| 27 | C | 94.1 | Very high | 80.6 | Confident | 1 Ų | 1 | 86.6 Ų | 86.6 | 1% | 0.007 | 43% | 0.433 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.9 | 140.5 | 175.3 | -174.6 | 0 | 0 | 0 | 0 | 112.3 | E29 C30 R31 A32 C44 C47 L52 | C27-E29 VanDerWaalsContact C-N 3.29Å; C27-E29 PolarHBondContact O-N 3.03Å; C27-C30 WeakPolarHBondContact CB-SG 3.39Å; C27-C30 VanDerWaalsContact SG-SG 3.62Å; C27-R31 VanDerWaalsContact O-CA 3.26Å; C27-R31 WeakPolarHBondContact O-CA 3.43Å; C27-R31 PolarHBondContact O-N 3.13Å; C27-A32 PolarHBondContact N-O 3.18Å; C27-C44 HydrophobicContact CB-CB 4.21Å; C27-C44 VanDerWaalsContact CB-SG 3.58Å; C27-C44 VanDerWaalsContact SG-SG 3.67Å; C27-C47 PolarHBondContact SG-SG 2.74Å; C27-L52 HydrophobicContact CB-CD2 4.06Å |
| 28 | G | 90.8 | Very high | 82.2 | Confident | 33 Ų | 33 | 85.7 Ų | 85.7 | 34% | 0.34 | 43% | 0.429 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.5 | -28.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | V51 | G28-V51 PolarHBondContact N-O 2.83Š|
| 29 | E | 92.4 | Very high | 83.8 | Confident | 121 Ų | 121 | 90.2 Ų | 90.2 | 57% | 0.565 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.2 | -63.4 | -174.4 | -63.1 | -169.8 | -169.4 | 0 | 0 | 112.7 | C27 R31 H49 | C27-E29 VanDerWaalsContact C-N 3.29Å; C27-E29 PolarHBondContact O-N 3.03Å; E29-R31 VanDerWaalsContact C-N 3.29Å; E29-R31 PolarHBondContact O-N 3.49Å; E29-H49 VanDerWaalsContact CD-NE2 3.29Å; E29-H49 IonicContact OE1-CD2 3.06Å; E29-H49 PolarHBondContact OE1-CD2 3.08Å; E29-H49 IonicContact OE1-CE1 3.71Å; E29-H49 IonicContact OE1-CG 3.71Å; E29-H49 IonicContact OE1-NE2 3.14Å; E29-H49 PolarHBondContact OE1-NE2 3.28Å; E29-H49 VanDerWaalsContact OE1-NE2 3.14Å; E29-H49 IonicContact OE2-CD2 3.6Å; E29-H49 IonicContact OE2-CE1 2.8Å; E29-H49 PolarHBondContact OE2-CE1 2.8Å; E29-H49 IonicContact OE2-CG 3.76Å; E29-H49 IonicContact OE2-ND1 3.28Å; E29-H49 PolarHBondContact OE2-ND1 3.14Å; E29-H49 IonicContact OE2-NE2 3.08Å; E29-H49 PolarHBondContact OE2-NE2 3.06Å; E29-H49 VanDerWaalsContact OE2-NE2 3.08Å |
| 30 | C | 92.9 | Very high | 85.1 | Confident | 51 Ų | 51 | 87.8 Ų | 87.8 | 35% | 0.345 | 42% | 0.424 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.9 | -11 | -178.3 | 62.8 | 0 | 0 | 0 | 0 | 113.8 | C27 A32 | C27-C30 WeakPolarHBondContact CB-SG 3.39Å; C27-C30 VanDerWaalsContact SG-SG 3.62Å; C30-A32 PolarHBondContact O-N 3.37Å; C30-A32 VanDerWaalsContact O-N 3.13Å; C30-A32 VanDerWaalsContact SG-CB 3.53Å |
| 31 | R | 90 | Very high | 86.7 | Confident | 196 Ų | 196 | 90 Ų | 90 | 74% | 0.74 | 43% | 0.431 | S | S | * | . | trans | 58.4 | 16.8 | -174.9 | -54.8 | 121.8 | -176.3 | -105.5 | -0.3 | 114.7 | I26 C27 E29 | I26-R31 HydrophobicContact CG2-CB 4.29Å; C27-R31 VanDerWaalsContact O-CA 3.26Å; C27-R31 WeakPolarHBondContact O-CA 3.43Å; C27-R31 PolarHBondContact O-N 3.13Å; E29-R31 VanDerWaalsContact C-N 3.29Å; E29-R31 PolarHBondContact O-N 3.49Å | ||
| 32 | A | 91 | Very high | 87.8 | Confident | 13 Ų | 13 | 86.2 Ų | 86.2 | 11% | 0.107 | 42% | 0.42 | C | S | . | . | trans | -66.2 | 145.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | I26 C27 C30 E46 | I26-A32 WeakPolarHBondContact CA-O 3.3Å; C27-A32 PolarHBondContact N-O 3.18Å; C30-A32 PolarHBondContact O-N 3.37Å; C30-A32 VanDerWaalsContact O-N 3.13Å; C30-A32 VanDerWaalsContact SG-CB 3.53Å; A32-E46 VanDerWaalsContact CB-CD 3.48Å; A32-E46 HydrophobicContact CB-CG 4.26Å; A32-E46 VanDerWaalsContact CB-OE2 3.25Å; A32-E46 WeakPolarHBondContact CB-OE2 3.34Å | ||
| 33 | E | 90.6 | Very high | 88.7 | Confident | 117 Ų | 117 | 88.3 Ų | 88.3 | 55% | 0.547 | 42% | 0.42 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.2 | 117.2 | 175.2 | -62.9 | -168.5 | -164.6 | 0 | 0 | 109.9 | Y25 K55 | Y25-E33 CarbonylContact O-C 3.52Å; Y25-E33 WeakPolarHBondContact O-CA 3.1Å; E33-K55 IonicContact OE1-NZ 2.66Å; E33-K55 PolarHBondContact OE1-NZ 3.27Å; E33-K55 IonicContact OE2-NZ 2.74Å; E33-K55 PolarHBondContact OE2-NZ 3.41Å |
| 34 | N | 89.6 | Confident | 89.2 | Confident | 5 Ų | 5 | 85.9 Ų | 85.9 | 3% | 0.027 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.1 | 124.2 | 175.4 | -61.6 | -49.4 | 0 | 0 | 0 | 109.7 | Y25 I36 C44 L45 L52 | Y25-N34 PolarHBondContact N-O 2.77Å; Y25-N34 PolarHBondContact O-N 2.82Å; N34-I36 HydrophobicContact CB-CG1 4.36Å; N34-C44 WeakPolarHBondContact ND2-CA 3.25Å; N34-C44 PolarHBondContact ND2-SG 3.17Å; N34-L45 PolarHBondContact OD1-N 3.39Å; N34-L52 WeakPolarHBondContact ND2-CD2 3.25Å |
| 35 | E | 87.9 | Confident | 89.2 | Confident | 134 Ų | 134 | 91.6 Ų | 91.6 | 63% | 0.626 | 43% | 0.433 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -88.2 | 107.1 | 169.6 | -64.3 | -169.6 | -175.8 | 0 | 0 | 109.2 | ||
| 36 | I | 85.9 | Confident | 89 | Confident | 22 Ų | 22 | 94.9 Ų | 94.9 | 11% | 0.113 | 45% | 0.451 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.1 | 127.5 | -179.8 | -62.1 | -176.2 | 0 | 0 | 0 | 109.2 | Y25 N34 E40 L52 | Y25-I36 HydrophobicContact CD2-CB 4.04Å; Y25-I36 HydrophobicContact CD2-CG1 4.35Å; Y25-I36 HydrophobicContact CE2-CB 4.19Å; N34-I36 HydrophobicContact CB-CG1 4.36Å; I36-E40 HydrophobicContact CG2-CB 4.08Å; I36-L52 HydrophobicContact CD1-CD1 3.07Å; I36-L52 HydrophobicContact CG1-CD1 4.36Å |
| 37 | R | 83.6 | Confident | 89 | Confident | 178 Ų | 178 | 94.9 Ų | 94.9 | 67% | 0.672 | 46% | 0.455 | S | S | * | . | trans | -80.6 | 150.8 | 174.7 | -66.5 | -176.6 | 178.6 | -175.2 | 1.2 | 110.5 | R39 E40 | R37-R39 PolarHBondContact O-N 2.83Å; R37-E40 HydrophobicContact CB-CB 4.43Å; R37-E40 PolarHBondContact N-OE2 3.44Å; R37-E40 VanDerWaalsContact O-CB 3.31Å; R37-E40 WeakPolarHBondContact O-CB 3.44Å; R37-E40 PolarHBondContact O-N 3.14Å; R37-E40 VanDerWaalsContact O-N 3.11Å | ||
| 38 | P | 82.9 | Confident | 88.8 | Confident | 109 Ų | 109 | 96.9 Ų | 96.9 | 71% | 0.708 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.9 | 134.4 | 171.5 | 24.7 | -33 | 0 | 0 | 0 | 109.8 | E40 | P38-E40 VanDerWaalsContact C-N 3.35Š|
| 39 | R | 83.6 | Confident | 88.7 | Confident | 260 Ų | 260 | 98.6 Ų | 98.6 | 98% | 0.981 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.1 | -0.5 | -176 | -48.8 | 172.7 | 179.6 | 168.6 | -0.9 | 116.4 | R37 | R37-R39 PolarHBondContact O-N 2.83Š|
| 40 | E | 85.1 | Confident | 88.7 | Confident | 101 Ų | 101 | 101.1 Ų | 101.1 | 47% | 0.472 | 48% | 0.479 | S | S | . | . | S | Bend | trans | -80.1 | 156.3 | 173 | -172.7 | 171.1 | -164.4 | 0 | 0 | 111.9 | I36 R37 P38 V42 | I36-E40 HydrophobicContact CG2-CB 4.08Å; R37-E40 HydrophobicContact CB-CB 4.43Å; R37-E40 PolarHBondContact N-OE2 3.44Å; R37-E40 VanDerWaalsContact O-CB 3.31Å; R37-E40 WeakPolarHBondContact O-CB 3.44Å; R37-E40 PolarHBondContact O-N 3.14Å; R37-E40 VanDerWaalsContact O-N 3.11Å; P38-E40 VanDerWaalsContact C-N 3.35Å; E40-V42 PolarHBondContact O-N 3.39Å |
| 41 | L | 88.4 | Confident | 88.6 | Confident | 109 Ų | 109 | 102.9 Ų | 102.9 | 57% | 0.571 | 49% | 0.488 | S | S | * | . | trans | -67.9 | 127.9 | 179.3 | -177.2 | 58 | 0 | 0 | 0 | 111.3 | R43 | L41-R43 HydrophobicContact CD2-CG 4.43Å; L41-R43 HydrophobicContact CG-CG 4.1Å; L41-R43 PolarHBondContact O-N 3.13Å | ||
| 42 | V | 88.4 | Confident | 88.7 | Confident | 78 Ų | 78 | 95 Ų | 95 | 47% | 0.473 | 46% | 0.46 | S | S | . | . | trans | -77 | 93.2 | -178.3 | -173.5 | 0 | 0 | 0 | 0 | 110.8 | E40 L52 | E40-V42 PolarHBondContact O-N 3.39Å; V42-L52 HydrophobicContact CG1-CD1 3.91Å; V42-L52 HydrophobicContact CG1-CG 4.46Å | ||
| 43 | R | 90.5 | Very high | 88.8 | Confident | 117 Ų | 117 | 101.5 Ų | 101.5 | 44% | 0.442 | 48% | 0.483 | S | S | . | . | trans | -146.7 | 145.9 | 175.7 | -68.5 | -179.9 | -174.9 | 177.1 | 1.9 | 110.8 | L41 R50 | L41-R43 HydrophobicContact CD2-CG 4.43Å; L41-R43 HydrophobicContact CG-CG 4.1Å; L41-R43 PolarHBondContact O-N 3.13Å; R43-R50 HydrophobicContact CG-CG 4.28Å | ||
| 44 | C | 91.2 | Very high | 88.8 | Confident | 5 Ų | 5 | 103.6 Ų | 103.6 | 3% | 0.034 | 49% | 0.49 | C | S | . | . | trans | -73.7 | 135.4 | 167.3 | -173.7 | 0 | 0 | 0 | 0 | 110.6 | C27 N34 E46 C47 G48 H49 L52 | C27-C44 HydrophobicContact CB-CB 4.21Å; C27-C44 VanDerWaalsContact CB-SG 3.58Å; C27-C44 VanDerWaalsContact SG-SG 3.67Å; N34-C44 WeakPolarHBondContact ND2-CA 3.25Å; N34-C44 PolarHBondContact ND2-SG 3.17Å; C44-E46 VanDerWaalsContact C-N 3.35Å; C44-C47 PolarHBondContact SG-SG 2.66Å; C44-G48 WeakPolarHBondContact O-CA 3.49Å; C44-G48 PolarHBondContact O-N 3.38Å; C44-G48 VanDerWaalsContact O-N 3.13Å; C44-H49 WeakPolarHBondContact CB-O 3.4Å; C44-H49 PolarHBondContact N-O 3.29Å; C44-L52 HydrophobicContact CB-CD2 4.13Å | ||
| 45 | L | 88.3 | Confident | 88.8 | Confident | 150 Ų | 150 | 106.8 Ų | 106.8 | 79% | 0.785 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.7 | -30.1 | -178.2 | -64.3 | 176.7 | 0 | 0 | 0 | 112.9 | N34 | N34-L45 PolarHBondContact OD1-N 3.39Š|
| 46 | E | 89.8 | Confident | 88.9 | Confident | 145 Ų | 145 | 110.4 Ų | 110.4 | 68% | 0.678 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.8 | -45.7 | -176.6 | -62.6 | -177.5 | 175.7 | 0 | 0 | 114.1 | A32 C44 | A32-E46 VanDerWaalsContact CB-CD 3.48Å; A32-E46 HydrophobicContact CB-CG 4.26Å; A32-E46 VanDerWaalsContact CB-OE2 3.25Å; A32-E46 WeakPolarHBondContact CB-OE2 3.34Å; C44-E46 VanDerWaalsContact C-N 3.35Å |
| 47 | C | 91.7 | Very high | 89.1 | Confident | 48 Ų | 48 | 113 Ų | 113 | 32% | 0.324 | 53% | 0.532 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -114.6 | -6 | -171.4 | 63.7 | 0 | 0 | 0 | 0 | 114.4 | C27 C44 H49 | C27-C47 PolarHBondContact SG-SG 2.74Å; C44-C47 PolarHBondContact SG-SG 2.66Å; C47-H49 WeakPolarHBondContact CB-ND1 3.35Å; C47-H49 PolarHBondContact O-N 3.49Å; C47-H49 PolarHBondContact O-ND1 3.12Å; C47-H49 PolarHBondContact SG-ND1 2.94Å |
| 48 | G | 89.5 | Confident | 89.3 | Confident | 43 Ų | 43 | 114.7 Ų | 114.7 | 44% | 0.443 | 54% | 0.544 | S | S | . | . | trans | 74.6 | -3.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | C44 | C44-G48 WeakPolarHBondContact O-CA 3.49Å; C44-G48 PolarHBondContact O-N 3.38Å; C44-G48 VanDerWaalsContact O-N 3.13Å | ||
| 49 | H | 89.7 | Confident | 89.7 | Confident | 68 Ų | 68 | 118.8 Ų | 118.8 | 32% | 0.315 | 55% | 0.546 | S | S | . | . | trans | -60.9 | 144.1 | 175.7 | -67.5 | 88.4 | 0 | 0 | 0 | 111.7 | E29 C44 C47 | E29-H49 VanDerWaalsContact CD-NE2 3.29Å; E29-H49 IonicContact OE1-CD2 3.06Å; E29-H49 PolarHBondContact OE1-CD2 3.08Å; E29-H49 IonicContact OE1-CE1 3.71Å; E29-H49 IonicContact OE1-CG 3.71Å; E29-H49 IonicContact OE1-NE2 3.14Å; E29-H49 PolarHBondContact OE1-NE2 3.28Å; E29-H49 VanDerWaalsContact OE1-NE2 3.14Å; E29-H49 IonicContact OE2-CD2 3.6Å; E29-H49 IonicContact OE2-CE1 2.8Å; E29-H49 PolarHBondContact OE2-CE1 2.8Å; E29-H49 IonicContact OE2-CG 3.76Å; E29-H49 IonicContact OE2-ND1 3.28Å; E29-H49 PolarHBondContact OE2-ND1 3.14Å; E29-H49 IonicContact OE2-NE2 3.08Å; E29-H49 PolarHBondContact OE2-NE2 3.06Å; E29-H49 VanDerWaalsContact OE2-NE2 3.08Å; C44-H49 WeakPolarHBondContact CB-O 3.4Å; C44-H49 PolarHBondContact N-O 3.29Å; C47-H49 WeakPolarHBondContact CB-ND1 3.35Å; C47-H49 PolarHBondContact O-N 3.49Å; C47-H49 PolarHBondContact O-ND1 3.12Å; C47-H49 PolarHBondContact SG-ND1 2.94Å | ||
| 50 | R | 91.5 | Very high | 90 | Very high | 174 Ų | 174 | 114.7 Ų | 114.7 | 66% | 0.657 | 54% | 0.54 | S | S | * | . | trans | -99.6 | -1.2 | -174.6 | -59.8 | -179.1 | -174.4 | 168.3 | 2 | 113.5 | R43 | R43-R50 HydrophobicContact CG-CG 4.28Š| ||
| 51 | V | 92 | Very high | 90.2 | Very high | 89 Ų | 89 | 112.7 Ų | 112.7 | 54% | 0.539 | 54% | 0.537 | S | S | . | . | trans | -97.3 | 117.9 | 178.3 | -176 | 0 | 0 | 0 | 0 | 109 | G28 Y53 | G28-V51 PolarHBondContact N-O 2.83Å; V51-Y53 HydrophobicContact CG1-CE2 4.46Å | ||
| 52 | L | 92.2 | Very high | 90.4 | Very high | 29 Ų | 29 | 113.2 Ų | 113.2 | 15% | 0.152 | 54% | 0.544 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.3 | 130.2 | -178.1 | -59.5 | 175.9 | 0 | 0 | 0 | 109.5 | Y25 I26 C27 N34 I36 V42 C44 | Y25-L52 HydrophobicContact CD1-CB 4.43Å; Y25-L52 HydrophobicContact CG-CB 4.47Å; I26-L52 CarbonylContact O-C 3.55Å; I26-L52 WeakPolarHBondContact O-CA 3.26Å; C27-L52 HydrophobicContact CB-CD2 4.06Å; N34-L52 WeakPolarHBondContact ND2-CD2 3.25Å; I36-L52 HydrophobicContact CD1-CD1 3.07Å; I36-L52 HydrophobicContact CG1-CD1 4.36Å; V42-L52 HydrophobicContact CG1-CD1 3.91Å; V42-L52 HydrophobicContact CG1-CG 4.46Å; C44-L52 HydrophobicContact CB-CD2 4.13Å |
| 53 | Y | 93.3 | Very high | 90.6 | Very high | 151 Ų | 151 | 117.6 Ų | 117.6 | 59% | 0.592 | 56% | 0.557 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -93.6 | 144.2 | 177 | -63.7 | -73 | 0 | 0 | 0 | 110.7 | Y25 I26 V51 | Y25-Y53 CarbonylContact C-O 3.45Å; Y25-Y53 VanDerWaalsContact CA-O 3.25Å; Y25-Y53 WeakPolarHBondContact CA-O 3.31Å; I26-Y53 PolarHBondContact N-O 2.75Å; I26-Y53 PolarHBondContact O-N 3.3Å; V51-Y53 HydrophobicContact CG1-CE2 4.46Å |
| 54 | K | 90.7 | Very high | 90.8 | Very high | 160 Ų | 160 | 118.8 Ų | 118.8 | 70% | 0.696 | 57% | 0.568 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -74 | 131.7 | 173.2 | -175.1 | -176.6 | 174.7 | -169.5 | 0 | 109.9 | V23 Y25 | V23-K54 HydrophobicContact CG1-CG 4.08Å; Y25-K54 HydrophobicContact CD1-CB 4.46Å; Y25-K54 HydrophobicContact CE1-CB 4.4Å |
| 55 | K | 89.7 | Confident | 90.9 | Very high | 73 Ų | 73 | 124 Ų | 124 | 32% | 0.317 | 61% | 0.611 | S | S | . | * | P | Polyproline II helix | trans | -60.8 | 144.2 | 176.3 | -169.1 | 165.6 | -173.2 | 172.9 | 0 | 111.7 | S24 I26 E33 | S24-K55 VanDerWaalsContact O-CB 3.29Å; S24-K55 WeakPolarHBondContact O-CB 3.29Å; S24-K55 PolarHBondContact O-N 2.78Å; S24-K55 WeakPolarHBondContact OG-CD 3.4Å; I26-K55 HydrophobicContact CD1-CB 4.14Å; I26-K55 HydrophobicContact CD1-CD 4.46Å; I26-K55 HydrophobicContact CD1-CG 4.02Å; I26-K55 HydrophobicContact CG1-CB 4.37Å; E33-K55 IonicContact OE1-NZ 2.66Å; E33-K55 PolarHBondContact OE1-NZ 3.27Å; E33-K55 IonicContact OE2-NZ 2.74Å; E33-K55 PolarHBondContact OE2-NZ 3.41Å |
| 56 | R | 90 | Very high | 90.9 | Very high | 210 Ų | 210 | 130.1 Ų | 130.1 | 79% | 0.792 | 62% | 0.624 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 139.8 | 175.5 | -172.5 | 177.8 | -177.5 | 170 | 2.7 | 110.1 | ||
| 57 | S | 89.4 | Confident | 91 | Very high | 76 Ų | 76 | 129.4 Ų | 129.4 | 53% | 0.531 | 62% | 0.621 | S | S | . | * | P | Polyproline II helix | trans | -63.7 | 140.3 | 173.8 | -175.8 | 0 | 0 | 0 | 0 | 110.8 | R59 | S57-R59 PolarHBondContact O-N 3.34Å; S57-R59 PolarHBondContact OG-N 3.23Å |
| 58 | K | 87.9 | Confident | 91 | Very high | 214 Ų | 214 | 133.7 Ų | 133.7 | 93% | 0.93 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -73.8 | -8.6 | 171.1 | -66 | -176.3 | 179.3 | -178.4 | 0 | 113.1 | ||
| 59 | R | 90 | Very high | 91 | Very high | 195 Ų | 195 | 138.7 Ų | 138.7 | 74% | 0.736 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -74.5 | 134.9 | 178.7 | -64.4 | -179 | 175.8 | 168.6 | -5 | 110.1 | S57 S61 | S57-R59 PolarHBondContact O-N 3.34Å; S57-R59 PolarHBondContact OG-N 3.23Å; R59-S61 PolarHBondContact O-N 3.39Å |
| 60 | M | 91 | Very high | 91.1 | Very high | 174 Ų | 174 | 142.9 Ų | 142.9 | 86% | 0.857 | 67% | 0.667 | S | S | * | * | trans | -62 | 125.4 | 173.1 | -174.4 | -171.6 | -79.3 | 0 | 0 | 109.3 | V62 | M60-V62 HydrophobicContact CG-CG2 4.43Å; M60-V62 HydrophobicContact SD-CG2 4.23Å | ||
| 61 | S | 89.8 | Confident | 91.1 | Very high | 58 Ų | 58 | 140.9 Ų | 140.9 | 41% | 0.406 | 67% | 0.668 | S | S | . | * | trans | -104.1 | 118.6 | 170.5 | 53.4 | 0 | 0 | 0 | 0 | 108 | R59 F63 | R59-S61 PolarHBondContact O-N 3.39Å; S61-F63 VanDerWaalsContact OG-CE2 3.27Å; S61-F63 WeakPolarHBondContact OG-CE2 3.27Å | ||
| 62 | V | 92.8 | Very high | 91 | Very high | 120 Ų | 120 | 144.4 Ų | 144.4 | 73% | 0.727 | 68% | 0.676 | S | S | * | * | trans | -93.9 | 136.3 | 173.3 | -177.7 | 0 | 0 | 0 | 0 | 108 | M60 | M60-V62 HydrophobicContact CG-CG2 4.43Å; M60-V62 HydrophobicContact SD-CG2 4.23Å | ||
| 63 | F | 92.6 | Very high | 91 | Very high | 170 Ų | 170 | 152.6 Ų | 152.6 | 75% | 0.746 | 71% | 0.714 | S | S | * | * | trans | -122.4 | 137.1 | 176.7 | -60.8 | -85.2 | 0 | 0 | 0 | 108.5 | S61 | S61-F63 VanDerWaalsContact OG-CE2 3.27Å; S61-F63 WeakPolarHBondContact OG-CE2 3.27Å | ||
| 64 | E | 94.1 | Very high | 90.8 | Very high | 142 Ų | 142 | 152.8 Ų | 152.8 | 66% | 0.664 | 72% | 0.723 | S | S | * | * | trans | -89.6 | 132.9 | 168.2 | -68.2 | -170.2 | -179.3 | 0 | 0 | 109.4 | R66 | E64-R66 PolarHBondContact O-N 3.22Å; E64-R66 IonicContact OE1-NH2 3.89Å; E64-R66 IonicContact OE2-CZ 3.03Å; E64-R66 IonicContact OE2-NE 2.81Å; E64-R66 PolarHBondContact OE2-NE 2.72Å; E64-R66 IonicContact OE2-NH2 2.72Å; E64-R66 PolarHBondContact OE2-NH2 2.81Å | ||
| 65 | A | 92.6 | Very high | 90.8 | Very high | 114 Ų | 114 | 152.2 Ų | 152.2 | 94% | 0.942 | 73% | 0.725 | S | S | * | * | trans | -89.1 | 72.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 66 | R | 89.6 | Confident | 90.9 | Very high | 280 Ų | 280 | 159.4 Ų | 159.4 | 100% | 1.057 | 76% | 0.763 | S | S | * | * | trans | -100.7 | 0 | 173.1 | -64.6 | -174.8 | -168.5 | -175.2 | 3.5 | 111.3 | E64 | E64-R66 PolarHBondContact O-N 3.22Å; E64-R66 IonicContact OE1-NH2 3.89Å; E64-R66 IonicContact OE2-CZ 3.03Å; E64-R66 IonicContact OE2-NE 2.81Å; E64-R66 PolarHBondContact OE2-NE 2.72Å; E64-R66 IonicContact OE2-NH2 2.72Å; E64-R66 PolarHBondContact OE2-NH2 2.81Å |
Retrieved 66 of 66 residues in 161.4 ms
(Link to these results)