| 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 | 65.6 | Low | 83.6 | Confident | 183 Ų | 183 | 120.2 Ų | 120.2 | 90% | 0.901 | 59% | 0.589 | S | S | * | * | 0 | 127.5 | 0 | -70.8 | -69.9 | 163.6 | 0 | 0 | 106.6 | |||||
| 2 | D | 92.6 | Very high | 83.3 | Confident | 91 Ų | 91 | 116.3 Ų | 116.3 | 49% | 0.487 | 59% | 0.591 | S | S | . | * | trans | -68.8 | 156 | 178.2 | 178.8 | 28.9 | 0 | 0 | 0 | 111.2 | H4 D5 L6 | D2-H4 VanDerWaalsContact C-N 3.26Å; D2-H4 PolarHBondContact O-N 2.9Å; D2-H4 IonicContact OD2-CD2 3.43Å; D2-H4 PolarHBondContact OD2-CD2 3.19Å; D2-H4 IonicContact OD2-CG 3.86Å; D2-D5 HydrophobicContact CB-CB 4.41Å; D2-D5 WeakPolarHBondContact O-CB 3.22Å; D2-D5 PolarHBondContact O-N 3.49Å; D2-D5 VanDerWaalsContact O-N 3.14Å; D2-L6 PolarHBondContact O-N 3.05Å | ||
| 3 | V | 87 | Confident | 82.6 | Confident | 89 Ų | 89 | 113 Ų | 113 | 54% | 0.539 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -58.3 | -40.1 | 177.4 | 175 | 0 | 0 | 0 | 0 | 110.7 | L6 F7 | V3-L6 WeakPolarHBondContact O-CB 2.79Å; V3-L6 PolarHBondContact O-N 3.39Å; V3-F7 HydrophobicContact CG1-CD2 4.07Å; V3-F7 HydrophobicContact CG1-CE2 3.54Å; V3-F7 WeakPolarHBondContact O-CD2 3.37Å; V3-F7 PolarHBondContact O-N 3.42Å |
| 4 | H | 86.6 | Confident | 82.5 | Confident | 130 Ų | 130 | 110.9 Ų | 110.9 | 60% | 0.602 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -67.1 | -36.8 | 176.8 | -65.1 | -68 | 0 | 0 | 0 | 112.6 | D2 L6 F7 R8 | D2-H4 VanDerWaalsContact C-N 3.26Å; D2-H4 PolarHBondContact O-N 2.9Å; D2-H4 IonicContact OD2-CD2 3.43Å; D2-H4 PolarHBondContact OD2-CD2 3.19Å; D2-H4 IonicContact OD2-CG 3.86Å; H4-L6 VanDerWaalsContact C-N 3.31Å; H4-F7 PolarHBondContact O-N 3.21Å; H4-R8 WeakPolarHBondContact O-CG 3.19Å; H4-R8 PolarHBondContact O-N 3.49Å; H4-R8 VanDerWaalsContact O-N 3.07Å |
| 5 | D | 88.9 | Confident | 82.5 | Confident | 77 Ų | 77 | 116.3 Ų | 116.3 | 41% | 0.412 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -67.1 | -33.3 | 174.7 | -84.4 | -10 | 0 | 0 | 0 | 112.3 | D2 R8 R9 | D2-D5 HydrophobicContact CB-CB 4.41Å; D2-D5 WeakPolarHBondContact O-CB 3.22Å; D2-D5 PolarHBondContact O-N 3.49Å; D2-D5 VanDerWaalsContact O-N 3.14Å; D5-R8 PolarHBondContact O-N 3.05Å; D5-R9 WeakPolarHBondContact O-CB 3.04Å; D5-R9 VanDerWaalsContact O-CG 3.29Å; D5-R9 WeakPolarHBondContact O-CG 3.5Å; D5-R9 PolarHBondContact O-N 3.43Å |
| 6 | L | 87.2 | Confident | 82.5 | Confident | 91 Ų | 91 | 118 Ų | 118 | 48% | 0.476 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -61.9 | -50.4 | 174.2 | -178.5 | 61.5 | 0 | 0 | 0 | 111.1 | D2 V3 H4 R8 R9 L10 | D2-L6 PolarHBondContact O-N 3.05Å; V3-L6 WeakPolarHBondContact O-CB 2.79Å; V3-L6 PolarHBondContact O-N 3.39Å; H4-L6 VanDerWaalsContact C-N 3.31Å; L6-R8 VanDerWaalsContact C-N 3.35Å; L6-R8 PolarHBondContact O-N 3.44Å; L6-R9 PolarHBondContact O-N 2.8Å; L6-L10 HydrophobicContact CD1-CD1 3.95Å; L6-L10 HydrophobicContact CD1-CG 4.06Å; L6-L10 HydrophobicContact CG-CD1 3.77Å; L6-L10 HydrophobicContact CG-CG 4.3Å; L6-L10 WeakPolarHBondContact O-CB 3.49Å; L6-L10 WeakPolarHBondContact O-CG 3.35Å; L6-L10 PolarHBondContact O-N 3.15Å |
| 7 | F | 84.6 | Confident | 82.8 | Confident | 136 Ų | 136 | 115.1 Ų | 115.1 | 60% | 0.596 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -64.3 | -38.4 | 178.1 | -69.2 | -65.9 | 0 | 0 | 0 | 112.9 | V3 H4 R9 L10 G11 | V3-F7 HydrophobicContact CG1-CD2 4.07Å; V3-F7 HydrophobicContact CG1-CE2 3.54Å; V3-F7 WeakPolarHBondContact O-CD2 3.37Å; V3-F7 PolarHBondContact O-N 3.42Å; H4-F7 PolarHBondContact O-N 3.21Å; F7-R9 VanDerWaalsContact C-N 3.32Å; F7-R9 PolarHBondContact O-N 2.91Å; F7-L10 PolarHBondContact O-N 2.9Å; F7-G11 PolarHBondContact O-N 3.06Å |
| 8 | R | 84.9 | Confident | 82.8 | Confident | 193 Ų | 193 | 113.9 Ų | 113.9 | 73% | 0.728 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -61 | -42.4 | 174.8 | -76.9 | -175.6 | 173.7 | -115.9 | 0.9 | 111.6 | H4 D5 L6 A12 | H4-R8 WeakPolarHBondContact O-CG 3.19Å; H4-R8 PolarHBondContact O-N 3.49Å; H4-R8 VanDerWaalsContact O-N 3.07Å; D5-R8 PolarHBondContact O-N 3.05Å; L6-R8 VanDerWaalsContact C-N 3.35Å; L6-R8 PolarHBondContact O-N 3.44Å; R8-A12 WeakPolarHBondContact O-CA 2.71Å; R8-A12 WeakPolarHBondContact O-CB 3.09Å; R8-A12 PolarHBondContact O-N 2.88Å |
| 9 | R | 83.4 | Confident | 83.1 | Confident | 163 Ų | 163 | 118.8 Ų | 118.8 | 62% | 0.615 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -73.5 | -38.6 | 178.4 | -71.8 | 174.6 | 70.5 | -165.4 | 0.8 | 113 | D5 L6 F7 G11 A12 | D5-R9 WeakPolarHBondContact O-CB 3.04Å; D5-R9 VanDerWaalsContact O-CG 3.29Å; D5-R9 WeakPolarHBondContact O-CG 3.5Å; D5-R9 PolarHBondContact O-N 3.43Å; L6-R9 PolarHBondContact O-N 2.8Å; F7-R9 VanDerWaalsContact C-N 3.32Å; F7-R9 PolarHBondContact O-N 2.91Å; R9-G11 VanDerWaalsContact C-N 3.32Å; R9-G11 PolarHBondContact O-N 3.47Å; R9-A12 PolarHBondContact O-N 2.62Å |
| 10 | L | 81.9 | Confident | 83.4 | Confident | 123 Ų | 123 | 122.2 Ų | 122.2 | 64% | 0.644 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -65.6 | -35.4 | 177.7 | -71.4 | 172.5 | 0 | 0 | 0 | 112.1 | L6 F7 | L6-L10 HydrophobicContact CD1-CD1 3.95Å; L6-L10 HydrophobicContact CD1-CG 4.06Å; L6-L10 HydrophobicContact CG-CD1 3.77Å; L6-L10 HydrophobicContact CG-CG 4.3Å; L6-L10 WeakPolarHBondContact O-CB 3.49Å; L6-L10 WeakPolarHBondContact O-CG 3.35Å; L6-L10 PolarHBondContact O-N 3.15Å; F7-L10 PolarHBondContact O-N 2.9Å |
| 11 | G | 76.5 | Confident | 83.5 | Confident | 46 Ų | 46 | 122 Ų | 122 | 47% | 0.474 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -93.2 | -11 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | F7 R9 G13 A14 | F7-G11 PolarHBondContact O-N 3.06Å; R9-G11 VanDerWaalsContact C-N 3.32Å; R9-G11 PolarHBondContact O-N 3.47Å; G11-G13 PolarHBondContact O-N 3.15Å; G11-A14 PolarHBondContact O-N 3.43Å |
| 12 | A | 80 | Confident | 84.4 | Confident | 74 Ų | 74 | 116.5 Ų | 116.5 | 61% | 0.612 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.4 | 121.5 | -177.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | R8 R9 A14 | R8-A12 WeakPolarHBondContact O-CA 2.71Å; R8-A12 WeakPolarHBondContact O-CB 3.09Å; R8-A12 PolarHBondContact O-N 2.88Å; R9-A12 PolarHBondContact O-N 2.62Å; A12-A14 PolarHBondContact O-N 3.11Å |
| 13 | G | 74 | Confident | 84.2 | Confident | 73 Ų | 73 | 115 Ų | 115 | 75% | 0.753 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 77.5 | 3.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | G11 K15 | G11-G13 PolarHBondContact O-N 3.15Å; G13-K15 PolarHBondContact O-N 3.37Å |
| 14 | A | 81.3 | Confident | 84.2 | Confident | 83 Ų | 83 | 114 Ų | 114 | 69% | 0.686 | 59% | 0.588 | S | S | * | * | trans | -66 | 106.5 | 168.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | G11 A12 | G11-A14 PolarHBondContact O-N 3.43Å; A12-A14 PolarHBondContact O-N 3.11Å | ||
| 15 | K | 82.4 | Confident | 84.2 | Confident | 192 Ų | 192 | 109 Ų | 109 | 84% | 0.835 | 57% | 0.568 | S | S | * | * | trans | -103.9 | 124.5 | 175.5 | -61.4 | 177.1 | 92.9 | 175.7 | 0 | 107.7 | G13 D17 | G13-K15 PolarHBondContact O-N 3.37Å; K15-D17 PolarHBondContact O-N 3.46Å | ||
| 16 | F | 82.4 | Confident | 83.9 | Confident | 144 Ų | 144 | 108.7 Ų | 108.7 | 63% | 0.632 | 58% | 0.576 | S | S | * | * | trans | -64.7 | 119.3 | 170.3 | -178.5 | -98.1 | 0 | 0 | 0 | 109 | T18 F21 | F16-T18 HydrophobicContact CE1-CG2 4.39Å; F16-T18 PolarHBondContact O-N 3.06Å; F16-F21 HydrophobicContact CE1-CB 4.11Å; F16-F21 HydrophobicContact CE1-CG 4.31Å; F16-F21 HydrophobicContact CE2-CB 4.15Å; F16-F21 HydrophobicContact CE2-CD2 4.04Å; F16-F21 HydrophobicContact CE2-CG 4.09Å; F16-F21 HydrophobicContact CZ-CB 3.53Å; F16-F21 AromaticContact CZ-CD1 3.83Å; F16-F21 HydrophobicContact CZ-CD1 3.83Å; F16-F21 AromaticContact CZ-CD2 3.8Å; F16-F21 HydrophobicContact CZ-CD2 3.8Å; F16-F21 HydrophobicContact CZ-CE2 4.48Å; F16-F21 AromaticContact CZ-CG 3.42Å; F16-F21 HydrophobicContact CZ-CG 3.42Å; F16-F21 VanDerWaalsContact CZ-CG 3.42Å | ||
| 17 | D | 87.8 | Confident | 83.8 | Confident | 69 Ų | 69 | 113.1 Ų | 113.1 | 37% | 0.369 | 59% | 0.587 | S | S | . | * | trans | -91.8 | 97.8 | 176.8 | -173.2 | -19.5 | 0 | 0 | 0 | 109.6 | K15 R19 R20 F21 | K15-D17 PolarHBondContact O-N 3.46Å; D17-R19 PolarHBondContact O-N 3.43Å; D17-R19 WeakPolarHBondContact OD1-CA 3.32Å; D17-R19 VanDerWaalsContact OD1-CB 3.31Å; D17-R19 WeakPolarHBondContact OD1-CB 2.98Å; D17-R19 PolarHBondContact OD1-N 3.17Å; D17-R20 HydrophobicContact CB-CB 4.01Å; D17-R20 HydrophobicContact CB-CG 4.07Å; D17-R20 PolarHBondContact O-N 3.14Å; D17-R20 PolarHBondContact OD1-N 3.09Å; D17-R20 VanDerWaalsContact OD1-N 3.17Å; D17-R20 WeakPolarHBondContact OD2-CD 3.12Å; D17-R20 WeakPolarHBondContact OD2-CG 3.02Å; D17-F21 PolarHBondContact O-N 3.32Å | ||
| 18 | T | 83.9 | Confident | 83.7 | Confident | 94 Ų | 94 | 113.3 Ų | 113.3 | 58% | 0.577 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -59.1 | -29.4 | 179.2 | -39.1 | 0 | 0 | 0 | 0 | 112.3 | F16 S22 | F16-T18 HydrophobicContact CE1-CG2 4.39Å; F16-T18 PolarHBondContact O-N 3.06Å; T18-S22 VanDerWaalsContact O-CB 3.28Å; T18-S22 WeakPolarHBondContact O-CB 3.45Å; T18-S22 PolarHBondContact O-N 2.76Å; T18-S22 PolarHBondContact O-OG 3.26Å; T18-S22 VanDerWaalsContact O-OG 3.1Å |
| 19 | R | 88.2 | Confident | 83 | Confident | 207 Ų | 207 | 109.7 Ų | 109.7 | 78% | 0.781 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -73 | -44.2 | 179.8 | -63.4 | 172.4 | 60 | -165.8 | -2.2 | 111 | D17 S22 A23 | D17-R19 PolarHBondContact O-N 3.43Å; D17-R19 WeakPolarHBondContact OD1-CA 3.32Å; D17-R19 VanDerWaalsContact OD1-CB 3.31Å; D17-R19 WeakPolarHBondContact OD1-CB 2.98Å; D17-R19 PolarHBondContact OD1-N 3.17Å; R19-S22 WeakPolarHBondContact CA-OG 3.3Å; R19-S22 PolarHBondContact O-N 3.02Å; R19-S22 PolarHBondContact O-OG 3.25Å; R19-A23 PolarHBondContact O-N 3.45Å; R19-A23 VanDerWaalsContact O-N 3.09Å |
| 20 | R | 88 | Confident | 82.2 | Confident | 185 Ų | 185 | 108.1 Ų | 108.1 | 70% | 0.698 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -62.6 | -45.5 | 174.2 | -71.4 | 173.3 | 72 | -179.2 | 3.4 | 110.8 | D17 S22 A23 D24 | D17-R20 HydrophobicContact CB-CB 4.01Å; D17-R20 HydrophobicContact CB-CG 4.07Å; D17-R20 PolarHBondContact O-N 3.14Å; D17-R20 PolarHBondContact OD1-N 3.09Å; D17-R20 VanDerWaalsContact OD1-N 3.17Å; D17-R20 WeakPolarHBondContact OD2-CD 3.12Å; D17-R20 WeakPolarHBondContact OD2-CG 3.02Å; R20-S22 PolarHBondContact O-N 3.33Å; R20-A23 PolarHBondContact O-N 3.4Å; R20-D24 PolarHBondContact O-N 3.42Å; R20-D24 VanDerWaalsContact O-N 3.14Å |
| 21 | F | 86.4 | Confident | 81.4 | Confident | 119 Ų | 119 | 105.2 Ų | 105.2 | 52% | 0.522 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -63.2 | -42.4 | 176.8 | -177.4 | -96.8 | 0 | 0 | 0 | 112.5 | F16 D17 A23 D24 A25 | F16-F21 HydrophobicContact CE1-CB 4.11Å; F16-F21 HydrophobicContact CE1-CG 4.31Å; F16-F21 HydrophobicContact CE2-CB 4.15Å; F16-F21 HydrophobicContact CE2-CD2 4.04Å; F16-F21 HydrophobicContact CE2-CG 4.09Å; F16-F21 HydrophobicContact CZ-CB 3.53Å; F16-F21 AromaticContact CZ-CD1 3.83Å; F16-F21 HydrophobicContact CZ-CD1 3.83Å; F16-F21 AromaticContact CZ-CD2 3.8Å; F16-F21 HydrophobicContact CZ-CD2 3.8Å; F16-F21 HydrophobicContact CZ-CE2 4.48Å; F16-F21 AromaticContact CZ-CG 3.42Å; F16-F21 HydrophobicContact CZ-CG 3.42Å; F16-F21 VanDerWaalsContact CZ-CG 3.42Å; D17-F21 PolarHBondContact O-N 3.32Å; F21-A23 VanDerWaalsContact C-N 3.33Å; F21-A23 PolarHBondContact O-N 3.38Å; F21-D24 PolarHBondContact O-N 3.38Å; F21-A25 HydrophobicContact CE1-CB 4.31Å; F21-A25 VanDerWaalsContact O-CB 3.3Å; F21-A25 WeakPolarHBondContact O-CB 3.3Å; F21-A25 PolarHBondContact O-N 3.38Å |
| 22 | S | 84.9 | Confident | 80.9 | Confident | 68 Ų | 68 | 112.6 Ų | 112.6 | 48% | 0.476 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -64.8 | -37 | 179.3 | 60.8 | 0 | 0 | 0 | 0 | 112.8 | T18 R19 R20 A25 A26 | T18-S22 VanDerWaalsContact O-CB 3.28Å; T18-S22 WeakPolarHBondContact O-CB 3.45Å; T18-S22 PolarHBondContact O-N 2.76Å; T18-S22 PolarHBondContact O-OG 3.26Å; T18-S22 VanDerWaalsContact O-OG 3.1Å; R19-S22 WeakPolarHBondContact CA-OG 3.3Å; R19-S22 PolarHBondContact O-N 3.02Å; R19-S22 PolarHBondContact O-OG 3.25Å; R20-S22 PolarHBondContact O-N 3.33Å; S22-A25 PolarHBondContact O-N 3.41Å; S22-A26 PolarHBondContact O-N 3.36Å |
| 23 | A | 87.9 | Confident | 80.1 | Confident | 58 Ų | 58 | 117.3 Ų | 117.3 | 48% | 0.479 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -64.8 | -44 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | R19 R20 F21 A26 R27 | R19-A23 PolarHBondContact O-N 3.45Å; R19-A23 VanDerWaalsContact O-N 3.09Å; R20-A23 PolarHBondContact O-N 3.4Å; F21-A23 VanDerWaalsContact C-N 3.33Å; F21-A23 PolarHBondContact O-N 3.38Å; A23-A26 PolarHBondContact O-N 3.28Å; A23-R27 PolarHBondContact O-N 3.07Å |
| 24 | D | 87.9 | Confident | 79.6 | Confident | 70 Ų | 70 | 122.4 Ų | 122.4 | 37% | 0.374 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -67.8 | -41.4 | 175.2 | -84 | -17.1 | 0 | 0 | 0 | 112.3 | R20 F21 A26 R27 F28 | R20-D24 PolarHBondContact O-N 3.42Å; R20-D24 VanDerWaalsContact O-N 3.14Å; F21-D24 PolarHBondContact O-N 3.38Å; D24-A26 PolarHBondContact O-N 3.44Å; D24-R27 WeakPolarHBondContact O-CA 3.48Å; D24-R27 VanDerWaalsContact O-CB 3.3Å; D24-R27 WeakPolarHBondContact O-CB 3.47Å; D24-R27 PolarHBondContact O-N 3.17Å; D24-R27 WeakPolarHBondContact OD1-CD 3.44Å; D24-R27 IonicContact OD1-CZ 3.8Å; D24-R27 IonicContact OD1-NH1 2.8Å; D24-R27 PolarHBondContact OD1-NH1 2.81Å; D24-F28 HydrophobicContact CB-CE2 4.3Å; D24-F28 WeakPolarHBondContact O-CD2 3.42Å; D24-F28 PolarHBondContact O-N 3.32Å; D24-F28 VanDerWaalsContact O-N 3.17Å |
| 25 | A | 85.2 | Confident | 78.5 | Confident | 23 Ų | 23 | 127.5 Ų | 127.5 | 19% | 0.19 | 61% | 0.606 | C | S | . | * | H | α-helix | trans | -60.1 | -32.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | F21 S22 F28 Q29 I30 | F21-A25 HydrophobicContact CE1-CB 4.31Å; F21-A25 VanDerWaalsContact O-CB 3.3Å; F21-A25 WeakPolarHBondContact O-CB 3.3Å; F21-A25 PolarHBondContact O-N 3.38Å; S22-A25 PolarHBondContact O-N 3.41Å; A25-F28 PolarHBondContact O-N 3.23Å; A25-Q29 PolarHBondContact O-N 3.06Å; A25-I30 PolarHBondContact O-N 3.14Å |
| 26 | A | 82.6 | Confident | 77.4 | Confident | 71 Ų | 71 | 125 Ų | 125 | 59% | 0.587 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -66.5 | -38.3 | 173 | 0 | 0 | 0 | 0 | 0 | 112 | S22 A23 D24 F28 Q29 | S22-A26 PolarHBondContact O-N 3.36Å; A23-A26 PolarHBondContact O-N 3.28Å; D24-A26 PolarHBondContact O-N 3.44Å; A26-F28 VanDerWaalsContact C-N 3.28Å; A26-F28 PolarHBondContact O-N 3.41Å; A26-Q29 PolarHBondContact O-N 3.45Å |
| 27 | R | 85.4 | Confident | 76.3 | Confident | 184 Ų | 184 | 124.1 Ų | 124.1 | 69% | 0.694 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -62.4 | -36.7 | 175.3 | -62.7 | 167.5 | 62.3 | -161 | 1.3 | 111.9 | A23 D24 Q29 | A23-R27 PolarHBondContact O-N 3.07Å; D24-R27 WeakPolarHBondContact O-CA 3.48Å; D24-R27 VanDerWaalsContact O-CB 3.3Å; D24-R27 WeakPolarHBondContact O-CB 3.47Å; D24-R27 PolarHBondContact O-N 3.17Å; D24-R27 WeakPolarHBondContact OD1-CD 3.44Å; D24-R27 IonicContact OD1-CZ 3.8Å; D24-R27 IonicContact OD1-NH1 2.8Å; D24-R27 PolarHBondContact OD1-NH1 2.81Å; R27-Q29 VanDerWaalsContact C-N 3.26Å; R27-Q29 PolarHBondContact O-N 2.97Å |
| 28 | F | 82.1 | Confident | 75 | Confident | 140 Ų | 140 | 127.3 Ų | 127.3 | 61% | 0.614 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.7 | 0.7 | 176.7 | -61.4 | -68.4 | 0 | 0 | 0 | 113.8 | D24 A25 A26 I30 | D24-F28 HydrophobicContact CB-CE2 4.3Å; D24-F28 WeakPolarHBondContact O-CD2 3.42Å; D24-F28 PolarHBondContact O-N 3.32Å; D24-F28 VanDerWaalsContact O-N 3.17Å; A25-F28 PolarHBondContact O-N 3.23Å; A26-F28 VanDerWaalsContact C-N 3.28Å; A26-F28 PolarHBondContact O-N 3.41Å; F28-I30 HydrophobicContact CB-CD1 3.5Å; F28-I30 HydrophobicContact CB-CG1 3.59Å; F28-I30 HydrophobicContact CG-CD1 4.27Å; F28-I30 PolarHBondContact O-N 3.38Å |
| 29 | Q | 70.5 | Confident | 73.9 | Confident | 118 Ų | 118 | 124.5 Ų | 124.5 | 55% | 0.551 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 50.8 | 28.8 | -178.8 | -55.9 | 176.4 | 30.3 | 0 | 0 | 113.6 | A25 A26 R27 G31 R33 | A25-Q29 PolarHBondContact O-N 3.06Å; A26-Q29 PolarHBondContact O-N 3.45Å; R27-Q29 VanDerWaalsContact C-N 3.26Å; R27-Q29 PolarHBondContact O-N 2.97Å; Q29-G31 VanDerWaalsContact C-N 3.27Å; Q29-G31 PolarHBondContact O-N 2.8Å; Q29-R33 HydrophobicContact CB-CG 4.22Å |
| 30 | I | 66.3 | Low | 72.7 | Confident | 130 Ų | 130 | 118.6 Ų | 118.6 | 67% | 0.667 | 59% | 0.59 | S | S | * | * | trans | -73.3 | -21.6 | -174.6 | -63 | 169.5 | 0 | 0 | 0 | 111.1 | A25 F28 | A25-I30 PolarHBondContact O-N 3.14Å; F28-I30 HydrophobicContact CB-CD1 3.5Å; F28-I30 HydrophobicContact CB-CG1 3.59Å; F28-I30 HydrophobicContact CG-CD1 4.27Å; F28-I30 PolarHBondContact O-N 3.38Å | ||
| 31 | G | 65.6 | Low | 71.4 | Confident | 61 Ų | 61 | 117.2 Ų | 117.2 | 63% | 0.629 | 59% | 0.591 | S | S | * | * | S | Bend | trans | -90.7 | -41.7 | -165.3 | 0 | 0 | 0 | 0 | 0 | 117.3 | Q29 | Q29-G31 VanDerWaalsContact C-N 3.27Å; Q29-G31 PolarHBondContact O-N 2.8Å |
| 32 | K | 66.1 | Low | 70.4 | Confident | 201 Ų | 201 | 115.6 Ų | 115.6 | 87% | 0.874 | 59% | 0.591 | S | S | * | * | trans | -165.4 | 72.7 | -171.2 | -66.6 | -70.4 | 179.5 | 160.4 | 0 | 109.8 | K34 | K32-K34 PolarHBondContact O-N 3.15Š| ||
| 33 | R | 62.3 | Low | 69.4 | Low | 173 Ų | 173 | 117 Ų | 117 | 65% | 0.653 | 59% | 0.593 | S | S | * | * | trans | -69.7 | 123.4 | 154.6 | -76.9 | -169.3 | -101.1 | 162.3 | -5.6 | 106.4 | Q29 Y35 | Q29-R33 HydrophobicContact CB-CG 4.22Å; R33-Y35 PolarHBondContact O-N 3Å | ||
| 34 | K | 64.8 | Low | 68.3 | Low | 180 Ų | 180 | 121.2 Ų | 121.2 | 78% | 0.783 | 60% | 0.603 | S | S | * | * | trans | -55.8 | 127.4 | 158.4 | -70.9 | -98.3 | -177.1 | 165.1 | 0 | 104.8 | K32 D36 | K32-K34 PolarHBondContact O-N 3.15Å; K34-D36 PolarHBondContact O-N 3.43Å | ||
| 35 | Y | 58.4 | Low | 67.4 | Low | 191 Ų | 191 | 119.6 Ų | 119.6 | 75% | 0.749 | 60% | 0.602 | S | S | * | * | S | Bend | trans | -72.9 | 63 | -176.9 | -167.7 | -93.5 | 0 | 0 | 0 | 108.8 | R33 | R33-Y35 PolarHBondContact O-N 3Š|
| 36 | D | 59.4 | Low | 66.8 | Low | 139 Ų | 139 | 124.9 Ų | 124.9 | 74% | 0.743 | 63% | 0.627 | S | S | * | * | trans | -120.3 | 27.4 | 175.6 | -59 | -40.3 | 0 | 0 | 0 | 109.1 | K34 | K34-D36 PolarHBondContact O-N 3.43Š| ||
| 37 | F | 58.4 | Low | 66.2 | Low | 125 Ų | 125 | 125 Ų | 125 | 55% | 0.548 | 62% | 0.617 | S | S | . | * | S | Bend | trans | -85.3 | 108.7 | 159.5 | -161.5 | -78.5 | 0 | 0 | 0 | 103.8 | S39 V42 | F37-S39 WeakPolarHBondContact O-CA 3.41Å; F37-S39 PolarHBondContact O-N 3.38Å; F37-V42 HydrophobicContact CD1-CB 4.43Å; F37-V42 HydrophobicContact CD1-CG2 4.31Å; F37-V42 HydrophobicContact CE1-CB 3.7Å; F37-V42 HydrophobicContact CE1-CG2 3.2Å; F37-V42 HydrophobicContact CZ-CG2 3.57Å |
| 38 | D | 60.8 | Low | 65.7 | Low | 137 Ų | 137 | 124.2 Ų | 124.2 | 73% | 0.733 | 62% | 0.619 | S | S | * | * | trans | -51.6 | 87.4 | 170 | -88.4 | -41.6 | 0 | 0 | 0 | 108 | S40 E41 | D38-S40 PolarHBondContact O-N 3.14Å; D38-S40 VanDerWaalsContact O-N 3.11Å; D38-E41 PolarHBondContact O-N 3.44Å | ||
| 39 | S | 61.1 | Low | 65.4 | Low | 35 Ų | 35 | 127.3 Ų | 127.3 | 25% | 0.245 | 63% | 0.633 | C | S | . | * | H | α-helix | trans | -70.5 | -13.1 | -168.6 | 54.3 | 0 | 0 | 0 | 0 | 110.1 | F37 E41 L43 | F37-S39 WeakPolarHBondContact O-CA 3.41Å; F37-S39 PolarHBondContact O-N 3.38Å; S39-E41 PolarHBondContact O-N 3.27Å; S39-L43 WeakPolarHBondContact O-CA 3.2Å; S39-L43 WeakPolarHBondContact O-CB 3.39Å; S39-L43 WeakPolarHBondContact O-CD1 3.44Å; S39-L43 WeakPolarHBondContact O-CG 3.28Å; S39-L43 PolarHBondContact O-N 3.28Å |
| 40 | S | 62.2 | Low | 65.5 | Low | 83 Ų | 83 | 123.4 Ų | 123.4 | 58% | 0.58 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -53 | -50.9 | 173.2 | -179.6 | 0 | 0 | 0 | 0 | 112.7 | D38 Q44 | D38-S40 PolarHBondContact O-N 3.14Å; D38-S40 VanDerWaalsContact O-N 3.11Å; S40-Q44 WeakPolarHBondContact O-CB 3.29Å; S40-Q44 PolarHBondContact O-N 3.07Å |
| 41 | E | 61.1 | Low | 65.5 | Low | 155 Ų | 155 | 125.3 Ų | 125.3 | 72% | 0.724 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -71.6 | -41.1 | -176.6 | -75.1 | -169.4 | 164.9 | 0 | 0 | 112.5 | D38 S39 Q44 G45 | D38-E41 PolarHBondContact O-N 3.44Å; S39-E41 PolarHBondContact O-N 3.27Å; E41-Q44 PolarHBondContact O-N 3.43Å; E41-G45 PolarHBondContact O-N 3.47Å |
| 42 | V | 64.5 | Low | 65.7 | Low | 85 Ų | 85 | 129 Ų | 129 | 52% | 0.515 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -73.7 | -31 | 178.7 | 162.1 | 0 | 0 | 0 | 0 | 112.7 | F37 | F37-V42 HydrophobicContact CD1-CB 4.43Å; F37-V42 HydrophobicContact CD1-CG2 4.31Å; F37-V42 HydrophobicContact CE1-CB 3.7Å; F37-V42 HydrophobicContact CE1-CG2 3.2Å; F37-V42 HydrophobicContact CZ-CG2 3.57Å |
| 43 | L | 64.9 | Low | 65.8 | Low | 99 Ų | 99 | 129.2 Ų | 129.2 | 52% | 0.518 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -76.7 | -32.4 | 173.3 | -66.2 | 170.9 | 0 | 0 | 0 | 111.7 | S39 G45 L46 | S39-L43 WeakPolarHBondContact O-CA 3.2Å; S39-L43 WeakPolarHBondContact O-CB 3.39Å; S39-L43 WeakPolarHBondContact O-CD1 3.44Å; S39-L43 WeakPolarHBondContact O-CG 3.28Å; S39-L43 PolarHBondContact O-N 3.28Å; L43-G45 VanDerWaalsContact C-N 3.33Å; L43-L46 WeakPolarHBondContact O-CB 3.41Å; L43-L46 PolarHBondContact O-N 3.46Å |
| 44 | Q | 65.6 | Low | 65.6 | Low | 146 Ų | 146 | 126.2 Ų | 126.2 | 68% | 0.682 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -65.4 | -38.8 | 173.3 | -175.8 | 171.4 | 68.8 | 0 | 0 | 111.2 | S40 E41 L46 D47 | S40-Q44 WeakPolarHBondContact O-CB 3.29Å; S40-Q44 PolarHBondContact O-N 3.07Å; E41-Q44 PolarHBondContact O-N 3.43Å; Q44-L46 PolarHBondContact O-N 3.48Å; Q44-D47 PolarHBondContact O-N 3.01Å |
| 45 | G | 67.4 | Low | 65.4 | Low | 36 Ų | 36 | 123.9 Ų | 123.9 | 37% | 0.371 | 64% | 0.642 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -72.1 | 4.5 | 169.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | E41 L43 F48 | E41-G45 PolarHBondContact O-N 3.47Å; L43-G45 VanDerWaalsContact C-N 3.33Å; G45-F48 WeakPolarHBondContact O-CD2 3.46Å; G45-F48 WeakPolarHBondContact O-CE2 3.42Å; G45-F48 WeakPolarHBondContact O-CZ 3.09Å |
| 46 | L | 73.2 | Confident | 65.6 | Low | 133 Ų | 133 | 121.1 Ų | 121.1 | 70% | 0.696 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.2 | -5.1 | 176 | -143.3 | 73.2 | 0 | 0 | 0 | 112.5 | L43 Q44 F48 | L43-L46 WeakPolarHBondContact O-CB 3.41Å; L43-L46 PolarHBondContact O-N 3.46Å; Q44-L46 PolarHBondContact O-N 3.48Å; L46-F48 PolarHBondContact O-N 2.85Å; L46-F48 VanDerWaalsContact O-N 3.15Å |
| 47 | D | 71.1 | Confident | 65.2 | Low | 74 Ų | 74 | 117.5 Ų | 117.5 | 40% | 0.396 | 64% | 0.643 | S | S | . | * | trans | -85.6 | 36.6 | 178.3 | -158.3 | 17.7 | 0 | 0 | 0 | 112.2 | Q44 F49 G50 K52 | Q44-D47 PolarHBondContact O-N 3.01Å; D47-F49 VanDerWaalsContact C-N 3.26Å; D47-F49 PolarHBondContact O-N 3.48Å; D47-G50 VanDerWaalsContact OD1-CA 3.22Å; D47-G50 WeakPolarHBondContact OD1-CA 3.31Å; D47-G50 PolarHBondContact OD1-N 3.1Å; D47-K52 WeakPolarHBondContact OD2-CE 3.04Å; D47-K52 IonicContact OD2-NZ 3.43Å; D47-K52 PolarHBondContact OD2-NZ 2.96Å | ||
| 48 | F | 74 | Confident | 64.8 | Low | 167 Ų | 167 | 118 Ų | 118 | 73% | 0.732 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -67.6 | -26.8 | -180 | -72.9 | -67.6 | 0 | 0 | 0 | 113.3 | G45 L46 | G45-F48 WeakPolarHBondContact O-CD2 3.46Å; G45-F48 WeakPolarHBondContact O-CE2 3.42Å; G45-F48 WeakPolarHBondContact O-CZ 3.09Å; L46-F48 PolarHBondContact O-N 2.85Å; L46-F48 VanDerWaalsContact O-N 3.15Å |
| 49 | F | 75.5 | Confident | 64.3 | Low | 206 Ų | 206 | 117.6 Ų | 117.6 | 90% | 0.904 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -111.1 | 3.9 | -176 | -61 | -75.8 | 0 | 0 | 0 | 113 | D47 | D47-F49 VanDerWaalsContact C-N 3.26Å; D47-F49 PolarHBondContact O-N 3.48Å |
| 50 | G | 72.4 | Confident | 63.6 | Low | 35 Ų | 35 | 118.6 Ų | 118.6 | 36% | 0.361 | 68% | 0.678 | S | S | . | * | trans | -77.6 | 123.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | D47 K52 | D47-G50 VanDerWaalsContact OD1-CA 3.22Å; D47-G50 WeakPolarHBondContact OD1-CA 3.31Å; D47-G50 PolarHBondContact OD1-N 3.1Å; G50-K52 VanDerWaalsContact C-N 3.27Å; G50-K52 PolarHBondContact O-N 2.85Å | ||
| 51 | N | 66.9 | Low | 63 | Low | 171 Ų | 171 | 119.3 Ų | 119.3 | 91% | 0.914 | 69% | 0.689 | S | S | * | * | trans | -74.8 | 72 | 174.7 | -177.7 | 10.3 | 0 | 0 | 0 | 111.8 | ||||
| 52 | K | 69.3 | Low | 62.7 | Low | 138 Ų | 138 | 116.8 Ų | 116.8 | 60% | 0.6 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -146.8 | 99.8 | 168.3 | 49.9 | -169.4 | 174.7 | -175.2 | 0 | 111.1 | D47 G50 S54 | D47-K52 WeakPolarHBondContact OD2-CE 3.04Å; D47-K52 IonicContact OD2-NZ 3.43Å; D47-K52 PolarHBondContact OD2-NZ 2.96Å; G50-K52 VanDerWaalsContact C-N 3.27Å; G50-K52 PolarHBondContact O-N 2.85Å; K52-S54 PolarHBondContact O-N 3.21Å |
| 53 | K | 68.1 | Low | 61.7 | Low | 206 Ų | 206 | 121.8 Ų | 121.8 | 90% | 0.896 | 71% | 0.706 | S | S | * | * | trans | 14.4 | 84.3 | 150.3 | 20.1 | -178.4 | 170.4 | -172.1 | 0 | 113.6 | ||||
| 54 | S | 57.9 | Low | 60.7 | Low | 110 Ų | 110 | 123.3 Ų | 123.3 | 77% | 0.769 | 72% | 0.72 | S | S | * | * | trans | -61.3 | 132.1 | 176 | 56.3 | 0 | 0 | 0 | 0 | 111 | K52 | K52-S54 PolarHBondContact O-N 3.21Š| ||
| 55 | V | 61.4 | Low | 59.6 | Low | 131 Ų | 131 | 125.2 Ų | 125.2 | 79% | 0.794 | 73% | 0.728 | S | S | * | * | trans | -69.8 | 132.7 | 162 | 177 | 0 | 0 | 0 | 0 | 107.8 | G57 | V55-G57 PolarHBondContact O-N 3.26Š| ||
| 56 | P | 61.5 | Low | 58.7 | Low | 132 Ų | 132 | 131.5 Ų | 131.5 | 86% | 0.857 | 75% | 0.748 | S | S | * | * | trans | -73.5 | 110 | 174.2 | -0.1 | 15.8 | 0 | 0 | 0 | 108.3 | ||||
| 57 | G | 52.8 | Low | 57.4 | Low | 64 Ų | 64 | 133.4 Ų | 133.4 | 66% | 0.66 | 75% | 0.751 | S | S | * | * | trans | -155.8 | 79.1 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | V55 | V55-G57 PolarHBondContact O-N 3.26Š| ||
| 58 | V | 49.3 | Very low | 56.1 | Low | 136 Ų | 136 | 135.4 Ų | 135.4 | 82% | 0.824 | 77% | 0.768 | S | S | * | * | trans | 63.6 | 89.9 | 157.6 | -171.7 | 0 | 0 | 0 | 0 | 115.7 | G60 | V58-G60 PolarHBondContact O-N 2.86Š| ||
| 59 | C | 50.9 | Low | 54.5 | Low | 128 Ų | 128 | 135.3 Ų | 135.3 | 87% | 0.865 | 77% | 0.769 | S | S | * | * | trans | -65.3 | 85.5 | 149.3 | -175 | 0 | 0 | 0 | 0 | 108.3 | A61 | C59-A61 PolarHBondContact O-N 3.41Š| ||
| 60 | G | 46.2 | Very low | 53 | Low | 56 Ų | 56 | 132.8 Ų | 132.8 | 58% | 0.577 | 77% | 0.765 | S | S | * | * | trans | -94.6 | 66.1 | 169.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | V58 S62 | V58-G60 PolarHBondContact O-N 2.86Å; G60-S62 PolarHBondContact O-N 3.5Å | ||
| 61 | A | 48.2 | Very low | 51.4 | Low | 98 Ų | 98 | 134.5 Ų | 134.5 | 81% | 0.81 | 78% | 0.783 | S | S | * | * | trans | -72.9 | 81.4 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | C59 | C59-A61 PolarHBondContact O-N 3.41Š| ||
| 62 | S | 54.7 | Low | 50.6 | Low | 102 Ų | 102 | 135 Ų | 135 | 71% | 0.713 | 78% | 0.78 | S | S | * | * | trans | -137.5 | 79.3 | 163.8 | 62.9 | 0 | 0 | 0 | 0 | 109.3 | G60 | G60-S62 PolarHBondContact O-N 3.5Š| ||
| 63 | Q | 44.3 | Very low | 49.5 | Very low | 190 Ų | 190 | 138.1 Ų | 138.1 | 89% | 0.888 | 79% | 0.794 | S | S | * | * | trans | -135.6 | 103.7 | 150.8 | -77.9 | -159.5 | 1 | 0 | 0 | 109.6 | H65 | Q63-H65 PolarHBondContact O-N 3.38Å; Q63-H65 VanDerWaalsContact O-N 3.15Å | ||
| 64 | T | 43.3 | Very low | 48.6 | Very low | 131 Ų | 131 | 137.9 Ų | 137.9 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | trans | -34.4 | 105.5 | 165.3 | -47.5 | 0 | 0 | 0 | 0 | 112.2 | Q66 | T64-Q66 HydrophobicContact CG2-CG 4.49Å; T64-Q66 PolarHBondContact O-N 3.38Å | ||
| 65 | H | 43.2 | Very low | 47.9 | Very low | 185 Ų | 185 | 141 Ų | 141 | 86% | 0.856 | 80% | 0.795 | S | S | * | * | trans | -72 | 96.8 | 162.3 | -105.8 | -89.7 | 0 | 0 | 0 | 108.3 | Q63 K67 | Q63-H65 PolarHBondContact O-N 3.38Å; Q63-H65 VanDerWaalsContact O-N 3.15Å; H65-K67 PolarHBondContact O-N 3.09Å | ||
| 66 | Q | 49.2 | Very low | 47.2 | Very low | 168 Ų | 168 | 141.9 Ų | 141.9 | 79% | 0.785 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -64 | 125.1 | 157 | -70.6 | -148.3 | 13.7 | 0 | 0 | 108.5 | T64 P68 | T64-Q66 HydrophobicContact CG2-CG 4.49Å; T64-Q66 PolarHBondContact O-N 3.38Å; Q66-P68 WeakPolarHBondContact O-CD 3.2Å |
| 67 | K | 45.9 | Very low | 46.4 | Very low | 174 Ų | 174 | 140.2 Ų | 140.2 | 76% | 0.757 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 123.8 | 173.6 | 176.7 | -177.2 | -175.5 | 176.2 | 0 | 111.5 | H65 | H65-K67 PolarHBondContact O-N 3.09Š|
| 68 | P | 42.6 | Very low | 46.3 | Very low | 116 Ų | 116 | 144 Ų | 144 | 75% | 0.753 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -95.4 | 124.7 | 149.4 | 11.6 | 8.4 | 0 | 0 | 0 | 108.2 | Q66 N70 | Q66-P68 WeakPolarHBondContact O-CD 3.2Å; P68-N70 PolarHBondContact O-N 2.97Å |
| 69 | Q | 41.8 | Very low | 45.9 | Very low | 164 Ų | 164 | 142.1 Ų | 142.1 | 77% | 0.766 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 131.3 | 175.4 | -68.3 | 171.6 | -34.7 | 0 | 0 | 110.6 | ||
| 70 | N | 42.4 | Very low | 45.8 | Very low | 153 Ų | 153 | 145.4 Ų | 145.4 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | trans | 17.2 | 118.9 | 140.4 | -167.8 | 15.3 | 0 | 0 | 0 | 117.7 | P68 | P68-N70 PolarHBondContact O-N 2.97Š| ||
| 71 | G | 40.2 | Very low | 45.8 | Very low | 72 Ų | 72 | 152.8 Ų | 152.8 | 74% | 0.742 | 79% | 0.788 | S | S | * | * | trans | 178.9 | 58.8 | 170 | 0 | 0 | 0 | 0 | 0 | 111.5 | K73 | G71-K73 PolarHBondContact O-N 3.23Š| ||
| 72 | E | 49.4 | Very low | 45.9 | Very low | 181 Ų | 181 | 158.3 Ų | 158.3 | 85% | 0.846 | 79% | 0.794 | S | S | * | * | trans | -55.5 | 113.3 | 175 | -61.1 | 176.5 | 151.1 | 0 | 0 | 111.3 | ||||
| 73 | K | 45.3 | Very low | 45.7 | Very low | 204 Ų | 204 | 164.6 Ų | 164.6 | 89% | 0.887 | 80% | 0.802 | S | S | * | * | trans | -136.6 | 95.3 | 148.1 | -70.1 | -166.2 | -178.8 | -177.1 | 0 | 108.5 | G71 E75 | G71-K73 PolarHBondContact O-N 3.23Å; K73-E75 PolarHBondContact O-N 2.9Å | ||
| 74 | K | 50 | Low | 45.6 | Very low | 201 Ų | 201 | 164.4 Ų | 164.4 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | trans | -68.3 | 103.7 | 167.9 | -164.8 | -177.8 | -172.9 | -174.4 | 0 | 107.2 | ||||
| 75 | E | 43.1 | Very low | 46 | Very low | 176 Ų | 176 | 166.3 Ų | 166.3 | 82% | 0.822 | 80% | 0.801 | S | S | * | * | trans | -116.4 | 95 | 162.9 | -166.1 | 170.7 | 174.5 | 0 | 0 | 107.9 | K73 S77 | K73-E75 PolarHBondContact O-N 2.9Å; E75-S77 PolarHBondContact O-N 3.23Å; E75-S77 VanDerWaalsContact O-N 3.09Å | ||
| 76 | E | 47.5 | Very low | 46.5 | Very low | 149 Ų | 149 | 162.6 Ų | 162.6 | 70% | 0.696 | 80% | 0.796 | S | S | * | * | trans | -66 | 96.6 | 167 | -179.4 | 179 | -177.4 | 0 | 0 | 108 | L78 | E76-L78 HydrophobicContact CG-CD1 4.47Å; E76-L78 HydrophobicContact CG-CG 4.27Å | ||
| 77 | S | 43.9 | Very low | 47.1 | Very low | 97 Ų | 97 | 164 Ų | 164 | 68% | 0.678 | 80% | 0.799 | S | S | * | * | trans | -104.2 | 78.9 | 165.9 | 54.8 | 0 | 0 | 0 | 0 | 109.1 | E75 T79 | E75-S77 PolarHBondContact O-N 3.23Å; E75-S77 VanDerWaalsContact O-N 3.09Å; S77-T79 PolarHBondContact O-N 3.41Å; S77-T79 VanDerWaalsContact O-N 3.14Å | ||
| 78 | L | 50.3 | Low | 48.1 | Very low | 143 Ų | 143 | 165 Ų | 165 | 75% | 0.749 | 80% | 0.804 | S | S | * | * | trans | -67.3 | 101.3 | 157.6 | -75.7 | 172 | 0 | 0 | 0 | 108.4 | E76 | E76-L78 HydrophobicContact CG-CD1 4.47Å; E76-L78 HydrophobicContact CG-CG 4.27Å | ||
| 79 | T | 40.8 | Very low | 49.4 | Very low | 96 Ų | 96 | 169.1 Ų | 169.1 | 59% | 0.589 | 81% | 0.81 | S | S | * | * | trans | -144.2 | 83.3 | 155.1 | 55.4 | 0 | 0 | 0 | 0 | 111.3 | S77 R81 | S77-T79 PolarHBondContact O-N 3.41Å; S77-T79 VanDerWaalsContact O-N 3.14Å; T79-R81 PolarHBondContact O-N 3.27Å | ||
| 80 | E | 48.9 | Very low | 50.6 | Low | 198 Ų | 198 | 172.7 Ų | 172.7 | 93% | 0.925 | 82% | 0.816 | S | S | * | * | trans | -69.1 | 113.5 | 143 | -82.4 | -166.7 | 145 | 0 | 0 | 107.7 | ||||
| 81 | R | 46.8 | Very low | 51.9 | Low | 211 Ų | 211 | 174.9 Ų | 174.9 | 80% | 0.796 | 82% | 0.819 | S | S | * | * | trans | -130.4 | 102.8 | 159.5 | -67.5 | -169.1 | -160.5 | 160.9 | 8.3 | 109.2 | T79 R83 | T79-R81 PolarHBondContact O-N 3.27Å; R81-R83 PolarHBondContact O-N 3.34Å | ||
| 82 | K | 49.9 | Very low | 52.2 | Low | 213 Ų | 213 | 177.4 Ų | 177.4 | 93% | 0.926 | 82% | 0.82 | S | S | * | * | trans | -49.8 | 124.7 | 167.9 | -156.8 | -175.5 | -176.6 | -172.6 | 0 | 108.8 | E84 | K82-E84 PolarHBondContact O-N 3.04Š| ||
| 83 | R | 51.3 | Low | 52 | Low | 235 Ų | 235 | 177.2 Ų | 177.2 | 89% | 0.887 | 82% | 0.821 | S | S | * | * | trans | -74.4 | 117 | 177 | -70.9 | 176.4 | 177.8 | 163.9 | -0.4 | 109.2 | R81 | R81-R83 PolarHBondContact O-N 3.34Š| ||
| 84 | E | 42 | Very low | 52.2 | Low | 186 Ų | 186 | 173 Ų | 173 | 87% | 0.869 | 81% | 0.813 | S | S | * | * | trans | -113.1 | 113.3 | 159.7 | -167.4 | 170.5 | -178.9 | 0 | 0 | 108.4 | K82 S86 | K82-E84 PolarHBondContact O-N 3.04Å; E84-S86 PolarHBondContact O-N 3.23Å | ||
| 85 | Q | 51.9 | Low | 52.3 | Low | 170 Ų | 170 | 168.6 Ų | 168.6 | 79% | 0.794 | 81% | 0.807 | S | S | * | * | trans | -83.5 | 91.6 | 177.8 | -72.6 | -176.5 | -8 | 0 | 0 | 109.6 | K87 | Q85-K87 PolarHBondContact O-N 3.43Š| ||
| 86 | S | 53.2 | Low | 52.5 | Low | 108 Ų | 108 | 168.9 Ų | 168.9 | 76% | 0.755 | 81% | 0.808 | S | S | * | * | trans | -82.5 | 104.4 | 167.7 | 66.2 | 0 | 0 | 0 | 0 | 110.2 | E84 K88 | E84-S86 PolarHBondContact O-N 3.23Å; S86-K88 PolarHBondContact O-N 2.88Å; S86-K88 VanDerWaalsContact O-N 3.15Å | ||
| 87 | K | 61.4 | Low | 52.5 | Low | 196 Ų | 196 | 167.8 Ų | 167.8 | 85% | 0.852 | 81% | 0.812 | S | S | * | * | trans | -70 | 100.1 | 171.2 | -67.3 | 178.1 | -179.1 | 175 | 0 | 109.9 | Q85 | Q85-K87 PolarHBondContact O-N 3.43Š| ||
| 88 | K | 68.3 | Low | 52.4 | Low | 196 Ų | 196 | 165.8 Ų | 165.8 | 85% | 0.852 | 81% | 0.806 | S | S | * | * | trans | -92.1 | 103.5 | 170.5 | -166 | 168 | -176.3 | 172.3 | 0 | 110.1 | S86 R90 | S86-K88 PolarHBondContact O-N 2.88Å; S86-K88 VanDerWaalsContact O-N 3.15Å; K88-R90 PolarHBondContact O-N 3.17Å | ||
| 89 | K | 68.8 | Low | 52.2 | Low | 203 Ų | 203 | 169.1 Ų | 169.1 | 88% | 0.883 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 121.3 | 168 | -82.2 | -177 | 173.8 | -178.7 | 0 | 109.2 | ||
| 90 | R | 67.9 | Low | 52.4 | Low | 238 Ų | 238 | 173 Ų | 173 | 90% | 0.898 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 129.5 | 164.5 | -85.7 | 175.4 | 141.7 | 166.2 | -7.3 | 108.4 | K88 | K88-R90 PolarHBondContact O-N 3.17Š|
| 91 | K | 68.1 | Low | 52.2 | Low | 200 Ų | 200 | 171 Ų | 171 | 87% | 0.87 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 123.8 | 161.8 | -70.5 | -174.1 | 176.6 | -176.4 | 0 | 107.6 | ||
| 92 | T | 47 | Very low | 52.1 | Low | 124 Ų | 124 | 167.6 Ų | 167.6 | 76% | 0.761 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 119.3 | 167.9 | -53.7 | 0 | 0 | 0 | 0 | 107.3 | ||
| 93 | M | 45.8 | Very low | 52 | Low | 178 Ų | 178 | 161 Ų | 161 | 88% | 0.877 | 80% | 0.8 | S | S | * | * | trans | -87 | 105.1 | 167.3 | -70.3 | -73.5 | -81.1 | 0 | 0 | 106.9 | S95 | M93-S95 PolarHBondContact O-N 3.3Š| ||
| 94 | T | 49.7 | Very low | 52 | Low | 116 Ų | 116 | 156.9 Ų | 156.9 | 71% | 0.712 | 79% | 0.791 | S | S | * | * | trans | -79.6 | 105.5 | 163.5 | 40.1 | 0 | 0 | 0 | 0 | 107.3 | E96 | T94-E96 PolarHBondContact O-N 3.45Š| ||
| 95 | S | 51.9 | Low | 52.4 | Low | 107 Ų | 107 | 158.2 Ų | 158.2 | 75% | 0.748 | 79% | 0.789 | S | S | * | * | trans | -79.9 | 99.3 | 164.6 | 52 | 0 | 0 | 0 | 0 | 107.8 | M93 T97 | M93-S95 PolarHBondContact O-N 3.3Å; S95-T97 PolarHBondContact O-N 3.29Å | ||
| 96 | E | 46.4 | Very low | 52.2 | Low | 182 Ų | 182 | 153.7 Ų | 153.7 | 85% | 0.85 | 79% | 0.788 | S | S | * | * | trans | -71.2 | 105.3 | 163.6 | -66.5 | -179.8 | 177.8 | 0 | 0 | 107.6 | T94 G98 | T94-E96 PolarHBondContact O-N 3.45Å; E96-G98 PolarHBondContact O-N 3.25Å | ||
| 97 | T | 47.8 | Very low | 52.2 | Low | 127 Ų | 127 | 156.3 Ų | 156.3 | 78% | 0.779 | 79% | 0.793 | S | S | * | * | trans | -78.4 | 103.5 | 168.5 | -34.2 | 0 | 0 | 0 | 0 | 107 | S95 F99 | S95-T97 PolarHBondContact O-N 3.29Å; T97-F99 PolarHBondContact O-N 3.28Å | ||
| 98 | G | 41.8 | Very low | 51.5 | Low | 54 Ų | 54 | 154 Ų | 154 | 56% | 0.557 | 79% | 0.789 | S | S | * | * | trans | -59.5 | 127.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | E96 H100 | E96-G98 PolarHBondContact O-N 3.25Å; G98-H100 PolarHBondContact O-N 3.13Å; G98-H100 VanDerWaalsContact O-N 3.13Å | ||
| 99 | F | 46.1 | Very low | 50.6 | Low | 213 Ų | 213 | 152.1 Ų | 152.1 | 93% | 0.934 | 79% | 0.788 | S | S | * | * | trans | -69.8 | 98.8 | 161.1 | -78.4 | -89.5 | 0 | 0 | 0 | 108.2 | T97 H101 | T97-F99 PolarHBondContact O-N 3.28Å; F99-H101 PolarHBondContact O-N 3.42Å | ||
| 100 | H | 46.3 | Very low | 49.7 | Very low | 178 Ų | 178 | 150.6 Ų | 150.6 | 82% | 0.824 | 79% | 0.788 | S | S | * | * | trans | -79.7 | 105.4 | 165.8 | -80.1 | -79 | 0 | 0 | 0 | 109.6 | G98 | G98-H100 PolarHBondContact O-N 3.13Å; G98-H100 VanDerWaalsContact O-N 3.13Å | ||
| 101 | H | 43.3 | Very low | 49.1 | Very low | 155 Ų | 155 | 145.8 Ų | 145.8 | 72% | 0.718 | 79% | 0.786 | S | S | * | * | trans | -16.3 | 121.5 | 148.2 | -174.6 | 81.9 | 0 | 0 | 0 | 115.1 | F99 S103 | F99-H101 PolarHBondContact O-N 3.42Å; H101-S103 VanDerWaalsContact CE1-CB 3.45Å; H101-S103 WeakPolarHBondContact CE1-CB 3.43Å; H101-S103 WeakPolarHBondContact NE2-CB 3.45Å | ||
| 102 | V | 46.3 | Very low | 48.3 | Very low | 140 Ų | 140 | 145 Ų | 145 | 85% | 0.848 | 81% | 0.805 | S | S | * | * | trans | -124.6 | 96.5 | 152.7 | -174.3 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 103 | S | 47.1 | Very low | 48.3 | Very low | 75 Ų | 75 | 146 Ų | 146 | 52% | 0.524 | 81% | 0.807 | S | S | . | * | trans | -102.9 | 161.3 | 155.8 | -170.3 | 0 | 0 | 0 | 0 | 108.2 | H101 | H101-S103 VanDerWaalsContact CE1-CB 3.45Å; H101-S103 WeakPolarHBondContact CE1-CB 3.43Å; H101-S103 WeakPolarHBondContact NE2-CB 3.45Å | ||
| 104 | Q | 51.6 | Low | 48.5 | Very low | 149 Ų | 149 | 144.3 Ų | 144.3 | 70% | 0.696 | 80% | 0.804 | S | S | * | * | trans | 93.7 | 111.6 | -169.7 | -55.7 | -178.3 | 75.6 | 0 | 0 | 110.5 | ||||
| 105 | Y | 48.8 | Very low | 48.4 | Very low | 214 Ų | 214 | 145.9 Ų | 145.9 | 84% | 0.839 | 81% | 0.809 | S | S | * | * | -143 | 134.8 | 51.5 | -52 | -83.8 | 0 | 0 | 0 | 112.1 | |||||
| 106 | G | 49.1 | Very low | 48.2 | Very low | 74 Ų | 74 | 148.2 Ų | 148.2 | 76% | 0.763 | 81% | 0.812 | S | S | * | * | trans | -81.4 | 130.3 | 152.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 107 | L | 52.7 | Low | 48.3 | Very low | 164 Ų | 164 | 146.1 Ų | 146.1 | 86% | 0.859 | 81% | 0.81 | S | S | * | * | trans | -140.3 | 124.4 | 153.6 | -81.1 | 178.8 | 0 | 0 | 0 | 107.9 | ||||
| 108 | D | 47.8 | Very low | 48.3 | Very low | 146 Ų | 146 | 147.3 Ų | 147.3 | 78% | 0.781 | 81% | 0.812 | S | S | * | * | trans | -56.3 | 144.3 | 176.4 | -49.8 | -65.8 | 0 | 0 | 0 | 111.8 | ||||
| 109 | L | 49.2 | Very low | 48.8 | Very low | 158 Ų | 158 | 154 Ų | 154 | 83% | 0.827 | 83% | 0.83 | S | S | * | * | -171.5 | 119 | 118.7 | -122.1 | 66.5 | 0 | 0 | 0 | 111.8 | |||||
| 110 | L | 48.6 | Very low | 49 | Very low | 170 Ų | 170 | 149.5 Ų | 149.5 | 89% | 0.89 | 82% | 0.822 | S | S | * | * | trans | -38.6 | 127.7 | 155 | -167.1 | 70.7 | 0 | 0 | 0 | 111.4 | ||||
| 111 | T | 54.8 | Low | 49.2 | Very low | 137 Ų | 137 | 147.1 Ų | 147.1 | 84% | 0.84 | 82% | 0.822 | S | S | * | * | trans | -143.4 | 133.8 | 154.9 | -38.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 112 | S | 51.5 | Low | 49.8 | Very low | 183 Ų | 183 | 146.4 Ų | 146.4 | 100% | 1.28 | 83% | 0.832 | S | S | * | * | trans | -56.8 | 0 | -160.4 | -170.3 | 0 | 0 | 0 | 0 | 117.5 |
Retrieved 112 of 112 residues in 177.6 ms
(Link to these results)