| 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 | 51.6 | Low | 59.6 | Low | 239 Ų | 239 | 125.5 Ų | 125.5 | 100% | 1.177 | 83% | 0.825 | S | S | * | * | 0 | 92.1 | 0 | -66.4 | 175.7 | 117.2 | 0 | 0 | 107.5 | S3 | M1-S3 PolarHBondContact O-N 3.14Š| |||
| 2 | S | 51.1 | Low | 60.3 | Low | 120 Ų | 120 | 123.4 Ų | 123.4 | 84% | 0.839 | 83% | 0.826 | S | S | * | * | trans | -86.3 | 96.5 | -172.5 | -54.2 | 0 | 0 | 0 | 0 | 110.1 | S4 | S2-S4 PolarHBondContact O-N 3.3Å; S2-S4 VanDerWaalsContact O-N 3.1Å | ||
| 3 | S | 56.6 | Low | 61.5 | Low | 115 Ų | 115 | 132 Ų | 132 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | trans | -69.4 | 99.3 | 174.4 | -59.5 | 0 | 0 | 0 | 0 | 109.9 | M1 S5 | M1-S3 PolarHBondContact O-N 3.14Å; S3-S5 PolarHBondContact O-N 3Å | ||
| 4 | S | 58.8 | Low | 63 | Low | 109 Ų | 109 | 139.6 Ų | 139.6 | 76% | 0.762 | 84% | 0.835 | S | S | * | * | trans | -79.6 | 100.1 | 168.6 | -63.2 | 0 | 0 | 0 | 0 | 108.8 | S2 R6 | S2-S4 PolarHBondContact O-N 3.3Å; S2-S4 VanDerWaalsContact O-N 3.1Å; S4-R6 PolarHBondContact O-N 2.8Å; S4-R6 VanDerWaalsContact O-N 3.13Å | ||
| 5 | S | 62.9 | Low | 64.5 | Low | 117 Ų | 117 | 146.3 Ų | 146.3 | 82% | 0.818 | 84% | 0.84 | S | S | * | * | trans | -61.6 | 107.5 | 169.8 | 32 | 0 | 0 | 0 | 0 | 109.6 | S3 G7 | S3-S5 PolarHBondContact O-N 3Å; S5-G7 PolarHBondContact O-N 3.49Å | ||
| 6 | R | 63.9 | Low | 66.1 | Low | 246 Ų | 246 | 148.9 Ų | 148.9 | 93% | 0.928 | 83% | 0.832 | S | S | * | * | trans | -69.2 | 98.9 | 170.6 | -63.7 | 179.9 | -161.4 | -155.5 | 2.4 | 107.9 | S4 | S4-R6 PolarHBondContact O-N 2.8Å; S4-R6 VanDerWaalsContact O-N 3.13Å | ||
| 7 | G | 64.1 | Low | 67.8 | Low | 55 Ų | 55 | 145 Ų | 145 | 57% | 0.567 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -59 | 154.7 | 166.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | S5 G9 | S5-G7 PolarHBondContact O-N 3.49Å; G7-G9 PolarHBondContact O-N 2.57Å |
| 8 | P | 60.5 | Low | 69.3 | Low | 134 Ų | 134 | 141.3 Ų | 141.3 | 87% | 0.87 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 116.8 | 174.8 | 26.1 | -31.1 | 0 | 0 | 0 | 107.9 | A10 | P8-A10 PolarHBondContact O-N 2.72Å; P8-A10 VanDerWaalsContact O-N 3.13Å |
| 9 | G | 63.3 | Low | 70.8 | Confident | 74 Ų | 74 | 135.3 Ų | 135.3 | 76% | 0.763 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -50 | 122.3 | -179.2 | 0 | 0 | 0 | 0 | 0 | 110 | G7 G11 | G7-G9 PolarHBondContact O-N 2.57Å; G9-G11 PolarHBondContact O-N 3.28Å |
| 10 | A | 62.3 | Low | 72 | Confident | 108 Ų | 108 | 139 Ų | 139 | 89% | 0.893 | 75% | 0.754 | S | S | * | * | trans | -54.5 | 100.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | P8 | P8-A10 PolarHBondContact O-N 2.72Å; P8-A10 VanDerWaalsContact O-N 3.13Å | ||
| 11 | G | 60.9 | Low | 73.2 | Confident | 63 Ų | 63 | 143.1 Ų | 143.1 | 65% | 0.649 | 76% | 0.759 | S | S | * | * | trans | 35.2 | 90.1 | 154.5 | 0 | 0 | 0 | 0 | 0 | 117 | G9 R13 | G9-G11 PolarHBondContact O-N 3.28Å; G11-R13 VanDerWaalsContact C-N 3.27Å; G11-R13 PolarHBondContact O-N 2.91Å | ||
| 12 | A | 67.4 | Low | 75.4 | Confident | 101 Ų | 101 | 132.9 Ų | 132.9 | 84% | 0.835 | 71% | 0.711 | S | S | * | * | trans | -55.6 | 100.5 | 149.8 | 0 | 0 | 0 | 0 | 0 | 107.4 | R14 | A12-R14 PolarHBondContact O-N 3.16Š| ||
| 13 | R | 76.4 | Confident | 77.6 | Confident | 235 Ų | 235 | 138.2 Ų | 138.2 | 89% | 0.887 | 71% | 0.713 | S | S | * | * | trans | -55.5 | 106.8 | -176.9 | -149.6 | 172.7 | 176.6 | -167.7 | -0.5 | 107 | G11 R15 | G11-R13 VanDerWaalsContact C-N 3.27Å; G11-R13 PolarHBondContact O-N 2.91Å; R13-R15 PolarHBondContact O-N 3.02Å; R13-R15 VanDerWaalsContact O-N 3.09Å | ||
| 14 | R | 82.9 | Confident | 79.5 | Confident | 239 Ų | 239 | 133.5 Ų | 133.5 | 90% | 0.902 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 122.5 | -175.4 | -80.2 | -173.1 | 178.5 | -155.1 | 0.9 | 108.1 | A12 R16 | A12-R14 PolarHBondContact O-N 3.16Å; R14-R16 PolarHBondContact O-N 3.01Å |
| 15 | R | 84.2 | Confident | 81.4 | Confident | 240 Ų | 240 | 128.8 Ų | 128.8 | 91% | 0.906 | 65% | 0.647 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 121.4 | 176 | -76.3 | -176.8 | -179 | 178.8 | 0.8 | 107.7 | R13 | R13-R15 PolarHBondContact O-N 3.02Å; R13-R15 VanDerWaalsContact O-N 3.09Å |
| 16 | R | 90.8 | Very high | 83 | Confident | 187 Ų | 187 | 128 Ų | 128 | 71% | 0.706 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 140.9 | 174.3 | -60.4 | -178.6 | -176 | 172.5 | -1.5 | 109.6 | R14 P60 | R14-R16 PolarHBondContact O-N 3.01Å; R16-P60 HydrophobicContact CB-CB 3.51Å; R16-P60 HydrophobicContact CG-CB 4.4Å |
| 17 | T | 94.1 | Very high | 84.6 | Confident | 83 Ų | 83 | 122.8 Ų | 122.8 | 51% | 0.509 | 62% | 0.618 | S | S | . | * | P | Polyproline II helix | trans | -93 | 162 | 176.8 | 64.4 | 0 | 0 | 0 | 0 | 110.5 | P60 V61 | T17-P60 CarbonylContact O-C 3.39Å; T17-P60 WeakPolarHBondContact O-CA 3.33Å; T17-P60 WeakPolarHBondContact O-CB 3.28Å; T17-V61 WeakPolarHBondContact CA-O 3.49Å; T17-V61 WeakPolarHBondContact CB-O 3.41Å; T17-V61 PolarHBondContact N-O 3.1Å; T17-V61 PolarHBondContact O-N 3.27Å; T17-V61 VanDerWaalsContact OG1-CG2 3.28Å; T17-V61 WeakPolarHBondContact OG1-CG2 3.45Å; T17-V61 PolarHBondContact OG1-O 3.28Å |
| 18 | R | 96.3 | Very high | 86.2 | Confident | 78 Ų | 78 | 125.5 Ų | 125.5 | 29% | 0.294 | 62% | 0.624 | S | S | . | * | P | Polyproline II helix | trans | -74.5 | 143.8 | 177.8 | -68.4 | 176.1 | 160.2 | -142.2 | -16.1 | 110.2 | R20 S51 R55 C57 | R18-R20 PolarHBondContact O-N 3.37Å; R18-S51 PolarHBondContact NH2-OG 3.09Å; R18-R55 VanDerWaalsContact CZ-O 3.24Å; R18-R55 PolarHBondContact NH1-O 2.87Å; R18-R55 PolarHBondContact NH2-O 2.8Å; R18-C57 HydrophobicContact CB-CB 4.37Å; R18-C57 HydrophobicContact CG-CB 4.1Å |
| 19 | C | 97.1 | Very high | 88 | Confident | 28 Ų | 28 | 121.7 Ų | 121.7 | 19% | 0.189 | 59% | 0.594 | C | S | . | * | trans | -70.6 | -17.3 | 178.6 | 71.1 | 0 | 0 | 0 | 0 | 114.6 | R21 C22 C57 A59 V61 | C19-R21 PolarHBondContact O-N 3.14Å; C19-C22 PolarHBondContact SG-N 2.89Å; C19-C22 VanDerWaalsContact SG-SG 3.64Å; C19-C57 PolarHBondContact N-SG 3.13Å; C19-A59 VanDerWaalsContact CB-O 3.3Å; C19-A59 WeakPolarHBondContact CB-O 3.48Å; C19-V61 HydrophobicContact CB-CG1 4.29Å | ||
| 20 | R | 95.6 | Very high | 89.6 | Confident | 209 Ų | 209 | 120.2 Ų | 120.2 | 79% | 0.789 | 57% | 0.571 | S | S | * | * | S | Bend | trans | 62 | 5.1 | 179.9 | -55.3 | 179.4 | -172.9 | -172.5 | 0.2 | 116 | R18 | R18-R20 PolarHBondContact O-N 3.37Š|
| 21 | R | 96.5 | Very high | 91.3 | Very high | 225 Ų | 225 | 115.9 Ų | 115.9 | 85% | 0.849 | 54% | 0.538 | S | S | * | . | trans | -118.5 | -25.2 | -176.6 | -62.9 | 174.5 | -172.3 | 165.2 | 1.3 | 114.4 | C19 | C19-R21 PolarHBondContact O-N 3.14Š| ||
| 22 | C | 96.8 | Very high | 93.1 | Very high | 25 Ų | 25 | 118.5 Ų | 118.5 | 17% | 0.169 | 54% | 0.537 | C | S | . | . | S | Bend | trans | -73.1 | 159.9 | -178.9 | 73.3 | 0 | 0 | 0 | 0 | 112.2 | C19 A24 C25 V26 | C19-C22 PolarHBondContact SG-N 2.89Å; C19-C22 VanDerWaalsContact SG-SG 3.64Å; C22-A24 PolarHBondContact O-N 3.13Å; C22-A24 VanDerWaalsContact O-N 3.13Å; C22-C25 WeakPolarHBondContact O-CB 3.34Å; C22-C25 PolarHBondContact O-N 3.49Å; C22-V26 PolarHBondContact O-N 3.47Å; C22-V26 VanDerWaalsContact O-N 3.14Å |
| 23 | R | 97.4 | Very high | 94.6 | Very high | 232 Ų | 232 | 114.6 Ų | 114.6 | 88% | 0.875 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -49.2 | -42.1 | 179.6 | -69.5 | -175.7 | 177.9 | -176.6 | -0.6 | 112.8 | V26 R27 | R23-V26 WeakPolarHBondContact O-CG2 3.37Å; R23-R27 WeakPolarHBondContact O-CB 3.48Å; R23-R27 PolarHBondContact O-N 3.5Å; R23-R27 VanDerWaalsContact O-N 3.14Å |
| 24 | A | 97.6 | Very high | 95.6 | Very high | 16 Ų | 16 | 109.1 Ų | 109.1 | 13% | 0.132 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -66.7 | -37.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | C22 R55 Q56 | C22-A24 PolarHBondContact O-N 3.13Å; C22-A24 VanDerWaalsContact O-N 3.13Å; A24-R55 VanDerWaalsContact O-CA 3.24Å; A24-R55 WeakPolarHBondContact O-CA 3.26Å; A24-R55 WeakPolarHBondContact O-CB 3.25Å; A24-R55 WeakPolarHBondContact O-CG 3.44Å; A24-Q56 WeakPolarHBondContact CB-O 3.14Å |
| 25 | C | 97.6 | Very high | 96.3 | Very high | 9 Ų | 9 | 99.9 Ų | 99.9 | 6% | 0.061 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -69 | -42.5 | 179.4 | -76.7 | 0 | 0 | 0 | 0 | 112.5 | C22 R55 C57 | C22-C25 WeakPolarHBondContact O-CB 3.34Å; C22-C25 PolarHBondContact O-N 3.49Å; C25-R55 PolarHBondContact O-NH2 2.81Å; C25-C57 VanDerWaalsContact SG-SG 3.64Å |
| 26 | V | 97.1 | Very high | 97 | Very high | 100 Ų | 100 | 88.5 Ų | 88.5 | 61% | 0.606 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -81.6 | -15.8 | -175.8 | -58.1 | 0 | 0 | 0 | 0 | 113.4 | C22 R23 | C22-V26 PolarHBondContact O-N 3.47Å; C22-V26 VanDerWaalsContact O-N 3.14Å; R23-V26 WeakPolarHBondContact O-CG2 3.37Å |
| 27 | R | 97.1 | Very high | 97.4 | Very high | 137 Ų | 137 | 87.4 Ų | 87.4 | 52% | 0.517 | 41% | 0.407 | S | S | . | . | S | Bend | trans | -64.2 | 149.2 | 176 | -158.5 | 174.7 | -176.8 | 165.4 | 2.1 | 111.3 | R23 R55 | R23-R27 WeakPolarHBondContact O-CB 3.48Å; R23-R27 PolarHBondContact O-N 3.5Å; R23-R27 VanDerWaalsContact O-N 3.14Å; R27-R55 HydrophobicContact CB-CG 4.41Å; R27-R55 VanDerWaalsContact O-CD 3.26Å; R27-R55 WeakPolarHBondContact O-CD 3.47Å; R27-R55 VanDerWaalsContact O-CZ 3.22Å; R27-R55 PolarHBondContact O-NE 3.45Å; R27-R55 PolarHBondContact O-NH2 3.35Å |
| 28 | T | 97.8 | Very high | 97.6 | Very high | 113 Ų | 113 | 84 Ų | 84 | 69% | 0.693 | 39% | 0.386 | S | S | * | . | P | Polyproline II helix | trans | -70.5 | 161.1 | 166.3 | 53 | 0 | 0 | 0 | 0 | 110.8 | ||
| 29 | E | 98.2 | Very high | 97.7 | Very high | 53 Ų | 53 | 81.6 Ų | 81.6 | 25% | 0.248 | 38% | 0.378 | C | S | . | . | P | Polyproline II helix | trans | -70.2 | 136.1 | 172.1 | -72.8 | 145.3 | 121.9 | 0 | 0 | 109.9 | G31 M39 K41 F42 C52 R55 | E29-G31 VanDerWaalsContact C-N 3.25Å; E29-G31 PolarHBondContact O-N 2.87Å; E29-M39 HydrophobicContact CG-CE 4.49Å; E29-M39 WeakPolarHBondContact OE1-CE 3.09Å; E29-K41 WeakPolarHBondContact OE1-CE 3.34Å; E29-K41 IonicContact OE1-NZ 2.57Å; E29-K41 PolarHBondContact OE1-NZ 3.46Å; E29-K41 IonicContact OE2-NZ 3.74Å; E29-K41 PolarHBondContact OE2-NZ 3.42Å; E29-F42 HydrophobicContact CB-CE2 3.94Å; E29-F42 HydrophobicContact CB-CZ 3.97Å; E29-C52 HydrophobicContact CB-CB 4.23Å; E29-C52 HydrophobicContact CG-CB 3.85Å; E29-R55 IonicContact OE2-NH1 2.72Å |
| 30 | C | 98.1 | Very high | 97.8 | Very high | 43 Ų | 43 | 88.3 Ų | 88.3 | 29% | 0.291 | 40% | 0.404 | S | S | . | . | trans | -72.5 | -15.1 | -174 | 67.7 | 0 | 0 | 0 | 0 | 114.5 | D32 C33 C52 L54 | C30-D32 PolarHBondContact O-N 3.12Å; C30-C33 VanDerWaalsContact SG-CB 3.57Å; C30-C33 PolarHBondContact SG-N 2.88Å; C30-C33 VanDerWaalsContact SG-N 3.42Å; C30-C33 VanDerWaalsContact SG-SG 3.63Å; C30-C52 PolarHBondContact SG-SG 2.7Å; C30-L54 HydrophobicContact CB-CD1 3.81Å; C30-L54 HydrophobicContact CB-CG 4.46Å | ||
| 31 | G | 97.9 | Very high | 97.9 | Very high | 18 Ų | 18 | 84.5 Ų | 84.5 | 19% | 0.186 | 39% | 0.393 | C | S | . | . | S | Bend | trans | 78.3 | -34.1 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | E29 C36 | E29-G31 VanDerWaalsContact C-N 3.25Å; E29-G31 PolarHBondContact O-N 2.87Å; G31-C36 VanDerWaalsContact C-CB 3.48Å; G31-C36 WeakPolarHBondContact O-CB 3.38Å |
| 32 | D | 97.9 | Very high | 98 | Very high | 117 Ų | 117 | 78.1 Ų | 78.1 | 63% | 0.626 | 37% | 0.372 | S | S | * | . | S | Bend | trans | -101.2 | -16.7 | -167.2 | -62.5 | -51.5 | 0 | 0 | 0 | 116.1 | C30 R37 | C30-D32 PolarHBondContact O-N 3.12Å; D32-R37 PolarHBondContact O-NE 3.03Å |
| 33 | C | 98.4 | Very high | 98 | Very high | 20 Ų | 20 | 80.4 Ų | 80.4 | 14% | 0.135 | 40% | 0.4 | C | S | . | . | S | Bend | trans | -70.8 | 158 | -179.7 | 77.2 | 0 | 0 | 0 | 0 | 111.7 | C30 F35 C36 R37 L53 | C30-C33 VanDerWaalsContact SG-CB 3.57Å; C30-C33 PolarHBondContact SG-N 2.88Å; C30-C33 VanDerWaalsContact SG-N 3.42Å; C30-C33 VanDerWaalsContact SG-SG 3.63Å; C33-F35 PolarHBondContact O-N 3.46Å; C33-F35 VanDerWaalsContact O-N 3.12Å; C33-C36 WeakPolarHBondContact O-CA 3.45Å; C33-C36 WeakPolarHBondContact O-CB 3.44Å; C33-C36 PolarHBondContact O-N 3.01Å; C33-C36 PolarHBondContact SG-N 3.16Å; C33-C36 VanDerWaalsContact SG-N 3.35Å; C33-C36 PolarHBondContact SG-SG 3.21Å; C33-R37 PolarHBondContact O-N 2.87Å; C33-L53 HydrophobicContact CB-CB 4.22Å; C33-L53 HydrophobicContact CB-CD1 4.04Å; C33-L53 HydrophobicContact CB-CG 4.32Å; C33-L53 PolarHBondContact SG-N 2.88Å |
| 34 | H | 98.1 | Very high | 98.1 | Very high | 120 Ų | 120 | 70 Ų | 70 | 56% | 0.556 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -50.7 | -40.4 | -179.7 | -179.9 | -113.6 | 0 | 0 | 0 | 113.4 | D38 M48 | H34-D38 PolarHBondContact O-N 3.34Å; H34-M48 WeakPolarHBondContact CE1-CE 3.24Å; H34-M48 PolarHBondContact CE1-SD 3.1Å |
| 35 | F | 98.6 | Very high | 98.1 | Very high | 45 Ų | 45 | 73.3 Ų | 73.3 | 20% | 0.197 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -73 | -31.7 | 175.9 | -59.8 | -35.4 | 0 | 0 | 0 | 113.9 | C33 M39 M48 Q50 S51 L53 | C33-F35 PolarHBondContact O-N 3.46Å; C33-F35 VanDerWaalsContact O-N 3.12Å; F35-M39 VanDerWaalsContact O-CG 3.32Å; F35-M39 WeakPolarHBondContact O-CG 3.43Å; F35-M48 HydrophobicContact CD1-SD 4.14Å; F35-M48 HydrophobicContact CE1-SD 4.33Å; F35-Q50 HydrophobicContact CB-CB 4.22Å; F35-Q50 HydrophobicContact CD1-CB 3.76Å; F35-Q50 HydrophobicContact CD1-CG 4.16Å; F35-Q50 HydrophobicContact CD2-CB 4.06Å; F35-Q50 HydrophobicContact CE1-CB 4.09Å; F35-Q50 HydrophobicContact CE1-CG 4.04Å; F35-Q50 HydrophobicContact CE2-CB 4.35Å; F35-Q50 HydrophobicContact CG-CB 3.76Å; F35-Q50 HydrophobicContact CZ-CB 4.38Å; F35-Q50 HydrophobicContact CZ-CG 4.35Å; F35-S51 WeakPolarHBondContact CB-O 3.24Å; F35-S51 VanDerWaalsContact CD2-O 3.24Å; F35-S51 WeakPolarHBondContact CD2-O 3.46Å; F35-L53 HydrophobicContact CD2-CD2 3.61Å; F35-L53 HydrophobicContact CD2-CG 3.63Å; F35-L53 HydrophobicContact CE2-CD2 3.29Å; F35-L53 HydrophobicContact CE2-CG 3.86Å; F35-L53 HydrophobicContact CZ-CD2 4.28Å |
| 36 | C | 98.6 | Very high | 98.1 | Very high | 0 Ų | 0 | 73.8 Ų | 73.8 | 0% | 0 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -69 | -45.2 | 173.3 | -76.2 | 0 | 0 | 0 | 0 | 110.6 | G31 C33 D38 M39 F42 C52 | G31-C36 VanDerWaalsContact C-CB 3.48Å; G31-C36 WeakPolarHBondContact O-CB 3.38Å; C33-C36 WeakPolarHBondContact O-CA 3.45Å; C33-C36 WeakPolarHBondContact O-CB 3.44Å; C33-C36 PolarHBondContact O-N 3.01Å; C33-C36 PolarHBondContact SG-N 3.16Å; C33-C36 VanDerWaalsContact SG-N 3.35Å; C33-C36 PolarHBondContact SG-SG 3.21Å; C36-D38 PolarHBondContact O-N 3.38Å; C36-D38 VanDerWaalsContact O-N 3.16Å; C36-M39 WeakPolarHBondContact O-CB 3.37Å; C36-M39 PolarHBondContact O-N 2.74Å; C36-F42 HydrophobicContact CB-CD2 3.98Å; C36-F42 HydrophobicContact CB-CE2 4.08Å; C36-F42 WeakPolarHBondContact O-CB 3.4Å; C36-F42 VanDerWaalsContact O-CD2 3.25Å; C36-F42 WeakPolarHBondContact O-CD2 3.06Å; C36-C52 WeakPolarHBondContact SG-CB 3.21Å |
| 37 | R | 98.5 | Very high | 98.1 | Very high | 164 Ų | 164 | 79.1 Ų | 79.1 | 62% | 0.619 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -60.3 | -24.3 | 176.7 | -66.9 | -176.7 | 178.1 | -177.7 | 0.2 | 113.3 | D32 C33 G44 | D32-R37 PolarHBondContact O-NE 3.03Å; C33-R37 PolarHBondContact O-N 2.87Å; R37-G44 WeakPolarHBondContact O-CA 3.47Å |
| 38 | D | 98.6 | Very high | 98.2 | Very high | 13 Ų | 13 | 76.2 Ų | 76.2 | 7% | 0.07 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -76.5 | -22.3 | 171.3 | -179.8 | 71.1 | 0 | 0 | 0 | 113.5 | H34 C36 G44 P45 G46 R47 M48 | H34-D38 PolarHBondContact O-N 3.34Å; C36-D38 PolarHBondContact O-N 3.38Å; C36-D38 VanDerWaalsContact O-N 3.16Å; D38-G44 CarbonylContact O-C 3.27Å; D38-G44 VanDerWaalsContact O-C 3.27Å; D38-G44 WeakPolarHBondContact O-CA 3.41Å; D38-P45 WeakPolarHBondContact OD1-CG 3.44Å; D38-G46 WeakPolarHBondContact O-CA 3.32Å; D38-G46 PolarHBondContact O-N 3.48Å; D38-G46 PolarHBondContact OD1-N 2.78Å; D38-R47 PolarHBondContact OD1-N 3.47Å; D38-R47 VanDerWaalsContact OD1-N 3.09Å; D38-R47 PolarHBondContact OD2-N 3.28Å; D38-M48 HydrophobicContact CB-CB 4.45Å; D38-M48 HydrophobicContact CB-CG 4.34Å; D38-M48 HydrophobicContact CB-SD 4.24Å; D38-M48 VanDerWaalsContact OD2-CB 3.29Å; D38-M48 WeakPolarHBondContact OD2-CB 3.3Å; D38-M48 PolarHBondContact OD2-N 3.29Å |
| 39 | M | 98.6 | Very high | 98.1 | Very high | 26 Ų | 26 | 79.6 Ų | 79.6 | 13% | 0.128 | 40% | 0.398 | C | S | . | . | S | Bend | trans | -71 | 137.7 | -175 | -57 | 173.3 | 177.2 | 0 | 0 | 112.1 | E29 F35 C36 K41 F42 G43 G44 Q50 | E29-M39 HydrophobicContact CG-CE 4.49Å; E29-M39 WeakPolarHBondContact OE1-CE 3.09Å; F35-M39 VanDerWaalsContact O-CG 3.32Å; F35-M39 WeakPolarHBondContact O-CG 3.43Å; C36-M39 WeakPolarHBondContact O-CB 3.37Å; C36-M39 PolarHBondContact O-N 2.74Å; M39-K41 VanDerWaalsContact C-N 3.26Å; M39-K41 HydrophobicContact CB-CG 4.25Å; M39-K41 PolarHBondContact O-N 3.47Å; M39-K41 VanDerWaalsContact O-N 3.16Å; M39-F42 HydrophobicContact CB-CD2 3.93Å; M39-F42 HydrophobicContact CG-CD2 4.35Å; M39-F42 CarbonylContact O-C 3.5Å; M39-F42 WeakPolarHBondContact O-CA 3.15Å; M39-F42 PolarHBondContact O-N 3.33Å; M39-F42 HydrophobicContact SD-CD2 3.89Å; M39-F42 HydrophobicContact SD-CE2 3.79Å; M39-G43 PolarHBondContact O-N 3.11Å; M39-G44 PolarHBondContact O-N 2.96Å; M39-Q50 WeakPolarHBondContact CE-O 3.45Å |
| 40 | K | 98.3 | Very high | 98.1 | Very high | 169 Ų | 169 | 82.1 Ų | 82.1 | 74% | 0.735 | 41% | 0.41 | S | S | * | . | G | 310 helix | trans | -53.6 | -38.5 | 179.3 | -67.6 | -171.4 | 176.5 | -174 | 0 | 114 | F42 G43 | K40-F42 PolarHBondContact O-N 2.7Å; K40-G43 PolarHBondContact O-N 3.33Å |
| 41 | K | 97.9 | Very high | 98 | Very high | 129 Ų | 129 | 82.1 Ų | 82.1 | 56% | 0.561 | 41% | 0.41 | S | S | * | . | G | 310 helix | trans | -66.8 | -20.9 | 178.7 | 70.8 | -176.6 | 174.3 | -165.6 | 0 | 114.1 | E29 M39 | E29-K41 WeakPolarHBondContact OE1-CE 3.34Å; E29-K41 IonicContact OE1-NZ 2.57Å; E29-K41 PolarHBondContact OE1-NZ 3.46Å; E29-K41 IonicContact OE2-NZ 3.74Å; E29-K41 PolarHBondContact OE2-NZ 3.42Å; M39-K41 VanDerWaalsContact C-N 3.26Å; M39-K41 HydrophobicContact CB-CG 4.25Å; M39-K41 PolarHBondContact O-N 3.47Å; M39-K41 VanDerWaalsContact O-N 3.16Å |
| 42 | F | 98.2 | Very high | 98 | Very high | 91 Ų | 91 | 81.2 Ų | 81.2 | 40% | 0.399 | 40% | 0.402 | S | S | . | . | G | 310 helix | trans | -102.2 | 16.4 | 174.5 | -62.1 | -57.9 | 0 | 0 | 0 | 111.1 | E29 C36 M39 K40 | E29-F42 HydrophobicContact CB-CE2 3.94Å; E29-F42 HydrophobicContact CB-CZ 3.97Å; C36-F42 HydrophobicContact CB-CD2 3.98Å; C36-F42 HydrophobicContact CB-CE2 4.08Å; C36-F42 WeakPolarHBondContact O-CB 3.4Å; C36-F42 VanDerWaalsContact O-CD2 3.25Å; C36-F42 WeakPolarHBondContact O-CD2 3.06Å; M39-F42 HydrophobicContact CB-CD2 3.93Å; M39-F42 HydrophobicContact CG-CD2 4.35Å; M39-F42 CarbonylContact O-C 3.5Å; M39-F42 WeakPolarHBondContact O-CA 3.15Å; M39-F42 PolarHBondContact O-N 3.33Å; M39-F42 HydrophobicContact SD-CD2 3.89Å; M39-F42 HydrophobicContact SD-CE2 3.79Å; K40-F42 PolarHBondContact O-N 2.7Å |
| 43 | G | 98.1 | Very high | 98 | Very high | 74 Ų | 74 | 79.3 Ų | 79.3 | 76% | 0.763 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 83.6 | 3.9 | 178 | 0 | 0 | 0 | 0 | 0 | 115.5 | M39 K40 | M39-G43 PolarHBondContact O-N 3.11Å; K40-G43 PolarHBondContact O-N 3.33Å |
| 44 | G | 98 | Very high | 98 | Very high | 12 Ų | 12 | 82.1 Ų | 82.1 | 12% | 0.124 | 40% | 0.404 | C | S | . | . | trans | -80 | 166.2 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | R37 D38 M39 G46 | R37-G44 WeakPolarHBondContact O-CA 3.47Å; D38-G44 CarbonylContact O-C 3.27Å; D38-G44 VanDerWaalsContact O-C 3.27Å; D38-G44 WeakPolarHBondContact O-CA 3.41Å; M39-G44 PolarHBondContact O-N 2.96Å; G44-G46 VanDerWaalsContact C-N 3.29Å; G44-G46 PolarHBondContact O-N 3.38Å | ||
| 45 | P | 98.3 | Very high | 98 | Very high | 86 Ų | 86 | 79 Ų | 79 | 56% | 0.558 | 39% | 0.388 | S | S | * | . | trans | -72.7 | -15.8 | -177.8 | 29.4 | -35.1 | 0 | 0 | 0 | 114.3 | D38 R47 | D38-P45 WeakPolarHBondContact OD1-CG 3.44Å; P45-R47 HydrophobicContact CB-CG 4.19Å; P45-R47 PolarHBondContact O-N 3.49Å | ||
| 46 | G | 97.9 | Very high | 97.9 | Very high | 19 Ų | 19 | 82.1 Ų | 82.1 | 20% | 0.196 | 40% | 0.403 | C | S | . | . | trans | 70.1 | 28.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | D38 G44 | D38-G46 WeakPolarHBondContact O-CA 3.32Å; D38-G46 PolarHBondContact O-N 3.48Å; D38-G46 PolarHBondContact OD1-N 2.78Å; G44-G46 VanDerWaalsContact C-N 3.29Å; G44-G46 PolarHBondContact O-N 3.38Å | ||
| 47 | R | 98 | Very high | 97.8 | Very high | 212 Ų | 212 | 83.3 Ų | 83.3 | 80% | 0.8 | 41% | 0.411 | S | S | * | . | trans | -85.3 | -33.1 | -174.6 | -68.5 | 180 | -177.4 | -178.4 | 1.4 | 112.2 | D38 P45 | D38-R47 PolarHBondContact OD1-N 3.47Å; D38-R47 VanDerWaalsContact OD1-N 3.09Å; D38-R47 PolarHBondContact OD2-N 3.28Å; P45-R47 HydrophobicContact CB-CG 4.19Å; P45-R47 PolarHBondContact O-N 3.49Å | ||
| 48 | M | 97.5 | Very high | 97.6 | Very high | 77 Ų | 77 | 81.1 Ų | 81.1 | 38% | 0.379 | 42% | 0.416 | S | S | . | . | S | Bend | trans | -80.9 | -30.6 | -173 | -58.5 | -176.9 | 176 | 0 | 0 | 112.5 | H34 F35 D38 Q50 | H34-M48 WeakPolarHBondContact CE1-CE 3.24Å; H34-M48 PolarHBondContact CE1-SD 3.1Å; F35-M48 HydrophobicContact CD1-SD 4.14Å; F35-M48 HydrophobicContact CE1-SD 4.33Å; D38-M48 HydrophobicContact CB-CB 4.45Å; D38-M48 HydrophobicContact CB-CG 4.34Å; D38-M48 HydrophobicContact CB-SD 4.24Å; D38-M48 VanDerWaalsContact OD2-CB 3.29Å; D38-M48 WeakPolarHBondContact OD2-CB 3.3Å; D38-M48 PolarHBondContact OD2-N 3.29Å; M48-Q50 HydrophobicContact CB-CG 4.21Å; M48-Q50 WeakPolarHBondContact O-CG 3.49Å; M48-Q50 PolarHBondContact O-N 2.85Å; M48-Q50 VanDerWaalsContact O-N 3.1Å; M48-Q50 PolarHBondContact O-NE2 3.23Å |
| 49 | K | 96.4 | Very high | 97.4 | Very high | 183 Ų | 183 | 83.3 Ų | 83.3 | 80% | 0.796 | 44% | 0.435 | S | S | * | . | trans | 52.5 | 33.3 | 179.6 | -56.3 | -179.2 | -179 | -179.6 | 0 | 112.8 | ||||
| 50 | Q | 97.4 | Very high | 97.2 | Very high | 107 Ų | 107 | 84.7 Ų | 84.7 | 50% | 0.5 | 45% | 0.446 | S | S | . | . | trans | -98 | 152.6 | 177.6 | -61.9 | -50.8 | -55.7 | 0 | 0 | 110.8 | F35 M39 M48 | F35-Q50 HydrophobicContact CB-CB 4.22Å; F35-Q50 HydrophobicContact CD1-CB 3.76Å; F35-Q50 HydrophobicContact CD1-CG 4.16Å; F35-Q50 HydrophobicContact CD2-CB 4.06Å; F35-Q50 HydrophobicContact CE1-CB 4.09Å; F35-Q50 HydrophobicContact CE1-CG 4.04Å; F35-Q50 HydrophobicContact CE2-CB 4.35Å; F35-Q50 HydrophobicContact CG-CB 3.76Å; F35-Q50 HydrophobicContact CZ-CB 4.38Å; F35-Q50 HydrophobicContact CZ-CG 4.35Å; M39-Q50 WeakPolarHBondContact CE-O 3.45Å; M48-Q50 HydrophobicContact CB-CG 4.21Å; M48-Q50 WeakPolarHBondContact O-CG 3.49Å; M48-Q50 PolarHBondContact O-N 2.85Å; M48-Q50 VanDerWaalsContact O-N 3.1Å; M48-Q50 PolarHBondContact O-NE2 3.23Å | ||
| 51 | S | 96.9 | Very high | 96.8 | Very high | 42 Ų | 42 | 82.8 Ų | 82.8 | 29% | 0.294 | 45% | 0.449 | S | S | . | . | trans | -75.4 | 158.4 | 170.3 | 58.7 | 0 | 0 | 0 | 0 | 112 | R18 F35 L53 | R18-S51 PolarHBondContact NH2-OG 3.09Å; F35-S51 WeakPolarHBondContact CB-O 3.24Å; F35-S51 VanDerWaalsContact CD2-O 3.24Å; F35-S51 WeakPolarHBondContact CD2-O 3.46Å; S51-L53 PolarHBondContact O-N 2.81Å | ||
| 52 | C | 98.4 | Very high | 96.7 | Very high | 0 Ų | 0 | 80.5 Ų | 80.5 | 0% | 0 | 44% | 0.443 | C | S | . | . | trans | -46 | 137.5 | 170.5 | 176.9 | 0 | 0 | 0 | 0 | 112.5 | E29 C30 C36 L54 R55 | E29-C52 HydrophobicContact CB-CB 4.23Å; E29-C52 HydrophobicContact CG-CB 3.85Å; C30-C52 PolarHBondContact SG-SG 2.7Å; C36-C52 WeakPolarHBondContact SG-CB 3.21Å; C52-L54 VanDerWaalsContact C-N 3.28Å; C52-L54 PolarHBondContact O-N 2.95Å; C52-L54 PolarHBondContact SG-N 2.7Å; C52-R55 HydrophobicContact CB-CB 4.08Å; C52-R55 HydrophobicContact CB-CG 3.92Å; C52-R55 WeakPolarHBondContact O-CA 3.47Å; C52-R55 PolarHBondContact O-N 3.18Å | ||
| 53 | L | 97.9 | Very high | 96.6 | Very high | 77 Ų | 77 | 79.9 Ų | 79.9 | 40% | 0.403 | 45% | 0.445 | S | S | . | . | G | 310 helix | trans | -54.3 | -44.5 | 177.2 | -78.9 | 176.1 | 0 | 0 | 0 | 111.9 | C33 F35 S51 R55 Q56 | C33-L53 HydrophobicContact CB-CB 4.22Å; C33-L53 HydrophobicContact CB-CD1 4.04Å; C33-L53 HydrophobicContact CB-CG 4.32Å; C33-L53 PolarHBondContact SG-N 2.88Å; F35-L53 HydrophobicContact CD2-CD2 3.61Å; F35-L53 HydrophobicContact CD2-CG 3.63Å; F35-L53 HydrophobicContact CE2-CD2 3.29Å; F35-L53 HydrophobicContact CE2-CG 3.86Å; F35-L53 HydrophobicContact CZ-CD2 4.28Å; S51-L53 PolarHBondContact O-N 2.81Å; L53-R55 PolarHBondContact O-N 3.09Å; L53-R55 VanDerWaalsContact O-N 3.11Å; L53-Q56 WeakPolarHBondContact O-CG 3.29Å; L53-Q56 PolarHBondContact O-N 3.13Å |
| 54 | L | 97.6 | Very high | 96.6 | Very high | 79 Ų | 79 | 80.3 Ų | 80.3 | 41% | 0.414 | 43% | 0.428 | S | S | . | . | G | 310 helix | trans | -72.7 | -4 | -179.6 | -54.5 | -171.7 | 0 | 0 | 0 | 113.7 | C30 C52 | C30-L54 HydrophobicContact CB-CD1 3.81Å; C30-L54 HydrophobicContact CB-CG 4.46Å; C52-L54 VanDerWaalsContact C-N 3.28Å; C52-L54 PolarHBondContact O-N 2.95Å; C52-L54 PolarHBondContact SG-N 2.7Å |
| 55 | R | 97.8 | Very high | 96.5 | Very high | 55 Ų | 55 | 84.3 Ų | 84.3 | 21% | 0.208 | 45% | 0.446 | C | S | . | . | G | 310 helix | trans | -109.4 | 14.1 | 177.9 | -61.9 | -171.2 | 69.6 | -170.9 | 8.7 | 113.2 | R18 A24 C25 R27 E29 C52 L53 C57 | R18-R55 VanDerWaalsContact CZ-O 3.24Å; R18-R55 PolarHBondContact NH1-O 2.87Å; R18-R55 PolarHBondContact NH2-O 2.8Å; A24-R55 VanDerWaalsContact O-CA 3.24Å; A24-R55 WeakPolarHBondContact O-CA 3.26Å; A24-R55 WeakPolarHBondContact O-CB 3.25Å; A24-R55 WeakPolarHBondContact O-CG 3.44Å; C25-R55 PolarHBondContact O-NH2 2.81Å; R27-R55 HydrophobicContact CB-CG 4.41Å; R27-R55 VanDerWaalsContact O-CD 3.26Å; R27-R55 WeakPolarHBondContact O-CD 3.47Å; R27-R55 VanDerWaalsContact O-CZ 3.22Å; R27-R55 PolarHBondContact O-NE 3.45Å; R27-R55 PolarHBondContact O-NH2 3.35Å; E29-R55 IonicContact OE2-NH1 2.72Å; C52-R55 HydrophobicContact CB-CB 4.08Å; C52-R55 HydrophobicContact CB-CG 3.92Å; C52-R55 WeakPolarHBondContact O-CA 3.47Å; C52-R55 PolarHBondContact O-N 3.18Å; L53-R55 PolarHBondContact O-N 3.09Å; L53-R55 VanDerWaalsContact O-N 3.11Å; R55-C57 PolarHBondContact O-N 3.02Å |
| 56 | Q | 96.8 | Very high | 96.4 | Very high | 110 Ų | 110 | 84.2 Ų | 84.2 | 51% | 0.514 | 44% | 0.439 | S | S | . | . | trans | -66.4 | 123.5 | 175.3 | -72.6 | -178.7 | -6.4 | 0 | 0 | 110.7 | A24 L53 T58 | A24-Q56 WeakPolarHBondContact CB-O 3.14Å; L53-Q56 WeakPolarHBondContact O-CG 3.29Å; L53-Q56 PolarHBondContact O-N 3.13Å; Q56-T58 PolarHBondContact O-N 3.06Å | ||
| 57 | C | 97.1 | Very high | 96.3 | Very high | 24 Ų | 24 | 88.5 Ų | 88.5 | 16% | 0.162 | 46% | 0.455 | C | S | . | . | trans | -73.2 | 127.6 | -174.6 | -177.9 | 0 | 0 | 0 | 0 | 110.7 | R18 C19 C25 R55 P60 | R18-C57 HydrophobicContact CB-CB 4.37Å; R18-C57 HydrophobicContact CG-CB 4.1Å; C19-C57 PolarHBondContact N-SG 3.13Å; C25-C57 VanDerWaalsContact SG-SG 3.64Å; R55-C57 PolarHBondContact O-N 3.02Å; C57-P60 HydrophobicContact CB-CG 4.4Å | ||
| 58 | T | 94.6 | Very high | 96.1 | Very high | 119 Ų | 119 | 79.7 Ų | 79.7 | 73% | 0.73 | 43% | 0.43 | S | S | * | . | S | Bend | trans | -73.5 | -29.5 | 179.9 | 53.1 | 0 | 0 | 0 | 0 | 113.7 | Q56 | Q56-T58 PolarHBondContact O-N 3.06Š|
| 59 | A | 94.4 | Very high | 96 | Very high | 58 Ų | 58 | 79.9 Ų | 79.9 | 48% | 0.479 | 43% | 0.434 | S | S | . | . | S | Bend | trans | -135.4 | 79.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | C19 | C19-A59 VanDerWaalsContact CB-O 3.3Å; C19-A59 WeakPolarHBondContact CB-O 3.48Å |
| 60 | P | 93.4 | Very high | 96 | Very high | 55 Ų | 55 | 71.3 Ų | 71.3 | 36% | 0.357 | 40% | 0.404 | S | S | . | . | trans | -65.2 | 142.7 | 176 | -20.3 | 34 | 0 | 0 | 0 | 112.3 | R16 T17 C57 | R16-P60 HydrophobicContact CB-CB 3.51Å; R16-P60 HydrophobicContact CG-CB 4.4Å; T17-P60 CarbonylContact O-C 3.39Å; T17-P60 WeakPolarHBondContact O-CA 3.33Å; T17-P60 WeakPolarHBondContact O-CB 3.28Å; C57-P60 HydrophobicContact CB-CG 4.4Å | ||
| 61 | V | 89.8 | Confident | 95.9 | Very high | 130 Ų | 130 | 68.1 Ų | 68.1 | 79% | 0.788 | 40% | 0.395 | S | S | * | . | trans | -109.4 | 0 | -179.1 | -58 | 0 | 0 | 0 | 0 | 112.8 | T17 C19 | T17-V61 WeakPolarHBondContact CA-O 3.49Å; T17-V61 WeakPolarHBondContact CB-O 3.41Å; T17-V61 PolarHBondContact N-O 3.1Å; T17-V61 PolarHBondContact O-N 3.27Å; T17-V61 VanDerWaalsContact OG1-CG2 3.28Å; T17-V61 WeakPolarHBondContact OG1-CG2 3.45Å; T17-V61 PolarHBondContact OG1-O 3.28Å; C19-V61 HydrophobicContact CB-CG1 4.29Å |
Retrieved 61 of 61 residues in 12.3 ms
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