| 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 | 59.1 | Low | 76.6 | Confident | 118 Ų | 118 | 89.5 Ų | 89.5 | 58% | 0.581 | 44% | 0.441 | S | S | * | . | 0 | 128.4 | 0 | -148.7 | 141.1 | 83.8 | 0 | 0 | 107.2 | C5 F30 E34 | M1-C5 HydrophobicContact CG-CB 4.41Å; M1-F30 HydrophobicContact CE-CZ 4.1Å; M1-E34 HydrophobicContact CE-CG 4.11Å | |||
| 2 | N | 67.3 | Low | 77.6 | Confident | 130 Ų | 130 | 95.5 Ų | 95.5 | 70% | 0.695 | 46% | 0.458 | S | S | * | . | trans | -76.8 | 144.3 | -168.5 | -67.7 | -30 | 0 | 0 | 0 | 111.5 | H4 C5 | N2-H4 PolarHBondContact O-N 3.05Å; N2-C5 WeakPolarHBondContact O-CB 3.46Å; N2-C5 PolarHBondContact O-N 3.49Å | ||
| 3 | Q | 73 | Confident | 78 | Confident | 121 Ų | 121 | 92.3 Ų | 92.3 | 57% | 0.565 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -45 | -40.1 | 176.8 | -162.4 | 82.4 | -5.6 | 0 | 0 | 112.2 | C5 L6 E7 | Q3-C5 VanDerWaalsContact C-N 3.3Å; Q3-C5 PolarHBondContact O-N 3.01Å; Q3-L6 WeakPolarHBondContact O-CB 3.48Å; Q3-L6 PolarHBondContact O-N 2.97Å; Q3-E7 PolarHBondContact O-N 3.13Å |
| 4 | H | 78.9 | Confident | 78.5 | Confident | 141 Ų | 141 | 99.2 Ų | 99.2 | 65% | 0.653 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -51.6 | -43.8 | 175.8 | -172.1 | -103.4 | 0 | 0 | 0 | 113.1 | N2 L6 E7 T8 | N2-H4 PolarHBondContact O-N 3.05Å; H4-L6 VanDerWaalsContact C-N 3.34Å; H4-L6 PolarHBondContact O-N 3.41Å; H4-E7 PolarHBondContact O-N 2.97Å; H4-T8 PolarHBondContact O-N 3.34Å; H4-T8 PolarHBondContact O-OG1 3.45Å |
| 5 | C | 74.5 | Confident | 79 | Confident | 50 Ų | 50 | 105.5 Ų | 105.5 | 34% | 0.338 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -68.3 | -31.4 | -176.3 | -159.5 | 0 | 0 | 0 | 0 | 113 | M1 N2 Q3 N9 | M1-C5 HydrophobicContact CG-CB 4.41Å; N2-C5 WeakPolarHBondContact O-CB 3.46Å; N2-C5 PolarHBondContact O-N 3.49Å; Q3-C5 VanDerWaalsContact C-N 3.3Å; Q3-C5 PolarHBondContact O-N 3.01Å; C5-N9 WeakPolarHBondContact O-CB 3.35Å; C5-N9 PolarHBondContact O-N 3.3Å; C5-N9 VanDerWaalsContact O-N 3.11Å; C5-N9 PolarHBondContact O-ND2 3Å |
| 6 | L | 73.4 | Confident | 79.2 | Confident | 9 Ų | 9 | 101.8 Ų | 101.8 | 5% | 0.047 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -67.7 | -43.3 | 172.6 | -70.1 | 160.4 | 0 | 0 | 0 | 111.2 | Q3 H4 N9 R10 F30 E34 | Q3-L6 WeakPolarHBondContact O-CB 3.48Å; Q3-L6 PolarHBondContact O-N 2.97Å; H4-L6 VanDerWaalsContact C-N 3.34Å; H4-L6 PolarHBondContact O-N 3.41Å; L6-N9 PolarHBondContact O-N 2.83Å; L6-R10 WeakPolarHBondContact O-CB 3.31Å; L6-R10 PolarHBondContact O-N 3.28Å; L6-F30 HydrophobicContact CB-CE1 4.48Å; L6-F30 HydrophobicContact CD2-CD1 3.62Å; L6-F30 HydrophobicContact CD2-CE1 3.29Å; L6-F30 HydrophobicContact CD2-CZ 4.44Å; L6-F30 HydrophobicContact CG-CE1 4.18Å; L6-E34 WeakPolarHBondContact CD1-OE1 3.46Å; L6-E34 WeakPolarHBondContact CD1-OE2 3.36Å; L6-E34 HydrophobicContact CD2-CB 4.16Å; L6-E34 VanDerWaalsContact CD2-CD 3.45Å; L6-E34 HydrophobicContact CD2-CG 3.81Å; L6-E34 HydrophobicContact CG-CG 4.47Å |
| 7 | E | 81.9 | Confident | 79.5 | Confident | 108 Ų | 108 | 100.5 Ų | 100.5 | 51% | 0.505 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -67.8 | -43.6 | -179 | -70.5 | 176.2 | 178.5 | 0 | 0 | 110.9 | Q3 H4 N9 R10 F11 | Q3-E7 PolarHBondContact O-N 3.13Å; H4-E7 PolarHBondContact O-N 2.97Å; E7-N9 PolarHBondContact O-N 3.46Å; E7-R10 PolarHBondContact O-N 2.97Å; E7-F11 WeakPolarHBondContact O-CB 3.45Å; E7-F11 PolarHBondContact O-N 2.72Å |
| 8 | T | 83.4 | Confident | 79.8 | Confident | 71 Ų | 71 | 98.3 Ų | 98.3 | 44% | 0.436 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.1 | -46.8 | 174.8 | -36.3 | 0 | 0 | 0 | 0 | 111 | H4 F11 Y12 | H4-T8 PolarHBondContact O-N 3.34Å; H4-T8 PolarHBondContact O-OG1 3.45Å; T8-F11 PolarHBondContact O-N 2.99Å; T8-Y12 WeakPolarHBondContact O-CB 3.35Å; T8-Y12 PolarHBondContact O-N 3.07Å |
| 9 | N | 81.6 | Confident | 80.2 | Confident | 47 Ų | 47 | 102.3 Ų | 102.3 | 25% | 0.251 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.5 | -45.9 | 178.1 | -89.9 | -69.8 | 0 | 0 | 0 | 111.9 | C5 L6 E7 F11 Y12 W13 F30 | C5-N9 WeakPolarHBondContact O-CB 3.35Å; C5-N9 PolarHBondContact O-N 3.3Å; C5-N9 VanDerWaalsContact O-N 3.11Å; C5-N9 PolarHBondContact O-ND2 3Å; L6-N9 PolarHBondContact O-N 2.83Å; E7-N9 PolarHBondContact O-N 3.46Å; N9-F11 VanDerWaalsContact C-N 3.29Å; N9-F11 PolarHBondContact O-N 3.48Å; N9-Y12 PolarHBondContact O-N 3.42Å; N9-W13 PolarHBondContact O-N 3.05Å; N9-F30 HydrophobicContact CB-CE1 4.17Å; N9-F30 HydrophobicContact CB-CZ 4.16Å |
| 10 | R | 83.7 | Confident | 80.4 | Confident | 73 Ų | 73 | 108.3 Ų | 108.3 | 28% | 0.275 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -57.2 | -44.7 | 176.4 | -97.2 | -169.1 | -84.4 | -125.7 | -2.9 | 111.9 | L6 E7 R14 I27 E31 | L6-R10 WeakPolarHBondContact O-CB 3.31Å; L6-R10 PolarHBondContact O-N 3.28Å; E7-R10 PolarHBondContact O-N 2.97Å; R10-R14 WeakPolarHBondContact O-CG 3.3Å; R10-R14 PolarHBondContact O-N 2.9Å; R10-I27 HydrophobicContact CG-CD1 4.15Å; R10-I27 HydrophobicContact CG-CG1 4.1Å; R10-I27 HydrophobicContact CG-CG2 4.26Å; R10-E31 IonicContact CZ-OE1 2.82Å; R10-E31 IonicContact NH1-OE1 2.86Å; R10-E31 PolarHBondContact NH1-OE1 3.11Å |
| 11 | F | 86.2 | Confident | 80.7 | Confident | 116 Ų | 116 | 113.2 Ų | 113.2 | 51% | 0.509 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.8 | -46.1 | 178.5 | -173.1 | -99 | 0 | 0 | 0 | 111.4 | E7 T8 N9 W13 R14 R15 | E7-F11 WeakPolarHBondContact O-CB 3.45Å; E7-F11 PolarHBondContact O-N 2.72Å; T8-F11 PolarHBondContact O-N 2.99Å; N9-F11 VanDerWaalsContact C-N 3.29Å; N9-F11 PolarHBondContact O-N 3.48Å; F11-W13 PolarHBondContact O-N 3.34Å; F11-R14 PolarHBondContact O-N 2.92Å; F11-R15 HydrophobicContact CE1-CG 4.48Å; F11-R15 VanDerWaalsContact CE1-NH1 3.32Å; F11-R15 VanDerWaalsContact CZ-CZ 3.5Å; F11-R15 VanDerWaalsContact CZ-NH1 3.29Å; F11-R15 PolarHBondContact O-N 3.38Å |
| 12 | Y | 88.2 | Confident | 82.1 | Confident | 162 Ų | 162 | 110.4 Ų | 110.4 | 64% | 0.635 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -58.7 | -47.6 | 178.3 | -155.8 | -89.5 | 0 | 0 | 0 | 111.6 | T8 N9 R14 R15 S16 | T8-Y12 WeakPolarHBondContact O-CB 3.35Å; T8-Y12 PolarHBondContact O-N 3.07Å; N9-Y12 PolarHBondContact O-N 3.42Å; Y12-R14 VanDerWaalsContact C-N 3.32Å; Y12-R14 PolarHBondContact O-N 3.04Å; Y12-R15 PolarHBondContact O-N 3.43Å; Y12-R15 VanDerWaalsContact O-N 3.11Å; Y12-S16 WeakPolarHBondContact O-CB 3.17Å; Y12-S16 PolarHBondContact O-N 3.48Å |
| 13 | W | 83.5 | Confident | 83 | Confident | 54 Ų | 54 | 104.9 Ų | 104.9 | 21% | 0.205 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -64.5 | -35.4 | 177.8 | -66.8 | 120 | 0 | 0 | 0 | 112.8 | N9 F11 R15 S16 L18 V23 | N9-W13 PolarHBondContact O-N 3.05Å; F11-W13 PolarHBondContact O-N 3.34Å; W13-R15 VanDerWaalsContact C-N 3.32Å; W13-R15 PolarHBondContact O-N 3.32Å; W13-S16 PolarHBondContact O-OG 3.49Å; W13-L18 HydrophobicContact CE3-CD1 4.12Å; W13-L18 HydrophobicContact CZ3-CD1 4.16Å; W13-V23 HydrophobicContact CB-CG1 4.12Å; W13-V23 VanDerWaalsContact O-CG2 3.3Å; W13-V23 WeakPolarHBondContact O-CG2 3.32Å |
| 14 | R | 84.4 | Confident | 83.7 | Confident | 189 Ų | 189 | 108 Ų | 108 | 71% | 0.713 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -67.1 | -31.7 | 174.4 | -75 | -174.2 | -174.9 | -160.4 | 5.3 | 112.9 | R10 F11 Y12 V23 | R10-R14 WeakPolarHBondContact O-CG 3.3Å; R10-R14 PolarHBondContact O-N 2.9Å; F11-R14 PolarHBondContact O-N 2.92Å; Y12-R14 VanDerWaalsContact C-N 3.32Å; Y12-R14 PolarHBondContact O-N 3.04Å; R14-V23 HydrophobicContact CG-CG1 4.25Å |
| 15 | R | 85.8 | Confident | 84.2 | Confident | 194 Ų | 194 | 110.3 Ų | 110.3 | 73% | 0.732 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -86.5 | -18.1 | 179.4 | -96.5 | -168.4 | 169.9 | 158.4 | 1.2 | 115.3 | F11 Y12 W13 G17 | F11-R15 HydrophobicContact CE1-CG 4.48Å; F11-R15 VanDerWaalsContact CE1-NH1 3.32Å; F11-R15 VanDerWaalsContact CZ-CZ 3.5Å; F11-R15 VanDerWaalsContact CZ-NH1 3.29Å; F11-R15 PolarHBondContact O-N 3.38Å; Y12-R15 PolarHBondContact O-N 3.43Å; Y12-R15 VanDerWaalsContact O-N 3.11Å; W13-R15 VanDerWaalsContact C-N 3.32Å; W13-R15 PolarHBondContact O-N 3.32Å; R15-G17 PolarHBondContact O-N 3.42Å |
| 16 | S | 82.1 | Confident | 85 | Confident | 46 Ų | 46 | 113.1 Ų | 113.1 | 32% | 0.322 | 50% | 0.497 | S | S | . | . | S | Bend | trans | -67.3 | 10.7 | -172.1 | 60.9 | 0 | 0 | 0 | 0 | 117.4 | Y12 W13 L18 | Y12-S16 WeakPolarHBondContact O-CB 3.17Å; Y12-S16 PolarHBondContact O-N 3.48Å; W13-S16 PolarHBondContact O-OG 3.49Å; S16-L18 PolarHBondContact O-N 3.2Å; S16-L18 WeakPolarHBondContact OG-CD1 3.35Å |
| 17 | G | 84.8 | Confident | 85.6 | Confident | 79 Ų | 79 | 113.9 Ų | 113.9 | 81% | 0.814 | 50% | 0.501 | S | S | * | . | trans | 66.3 | 0.6 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | R15 | R15-G17 PolarHBondContact O-N 3.42Š| ||
| 18 | L | 85.3 | Confident | 86 | Confident | 62 Ų | 62 | 113.8 Ų | 113.8 | 33% | 0.325 | 50% | 0.503 | S | S | . | . | trans | -66.9 | 143.7 | 179.1 | -88.4 | 136 | 0 | 0 | 0 | 111.7 | W13 S16 R20 T22 V23 | W13-L18 HydrophobicContact CE3-CD1 4.12Å; W13-L18 HydrophobicContact CZ3-CD1 4.16Å; S16-L18 PolarHBondContact O-N 3.2Å; S16-L18 WeakPolarHBondContact OG-CD1 3.35Å; L18-R20 PolarHBondContact O-N 2.91Å; L18-T22 HydrophobicContact CD2-CG2 3.47Å; L18-T22 VanDerWaalsContact CD2-CG2 3.47Å; L18-V23 HydrophobicContact CB-CG2 3.69Å | ||
| 19 | K | 87.7 | Confident | 86.3 | Confident | 173 Ų | 173 | 114.5 Ų | 114.5 | 75% | 0.752 | 51% | 0.507 | S | S | * | . | trans | -52.2 | 138.4 | 173.8 | -67.9 | -173.2 | -179.8 | -179.9 | 0 | 109.9 | R21 T22 V23 | K19-R21 PolarHBondContact O-N 3.44Å; K19-T22 WeakPolarHBondContact O-CA 3.49Å; K19-T22 WeakPolarHBondContact O-CB 3.38Å; K19-T22 PolarHBondContact O-N 3.04Å; K19-V23 PolarHBondContact O-N 3.06Å; K19-V23 VanDerWaalsContact O-N 3.13Å | ||
| 20 | R | 83.2 | Confident | 86.6 | Confident | 222 Ų | 222 | 114.6 Ų | 114.6 | 84% | 0.838 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -48.2 | -38.5 | -178.4 | -80.6 | -172.4 | -178.2 | 163.4 | 0.7 | 113.5 | L18 V23 R24 | L18-R20 PolarHBondContact O-N 2.91Å; R20-V23 PolarHBondContact O-N 3.01Å; R20-R24 PolarHBondContact O-N 2.91Å |
| 21 | R | 87.2 | Confident | 86.8 | Confident | 213 Ų | 213 | 115.1 Ų | 115.1 | 80% | 0.804 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.5 | -43 | 177.3 | -71 | -175.1 | -180 | 160.4 | 0.4 | 112 | K19 R24 R25 | K19-R21 PolarHBondContact O-N 3.44Å; R21-R24 PolarHBondContact O-N 3.25Å; R21-R25 WeakPolarHBondContact O-CG 3.41Å; R21-R25 PolarHBondContact O-N 3.11Å |
| 22 | T | 87.2 | Confident | 87 | Confident | 58 Ų | 58 | 117.7 Ų | 117.7 | 36% | 0.356 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -69.1 | -41.6 | 179.4 | -45.5 | 0 | 0 | 0 | 0 | 111.4 | L18 K19 R25 R26 | L18-T22 HydrophobicContact CD2-CG2 3.47Å; L18-T22 VanDerWaalsContact CD2-CG2 3.47Å; K19-T22 WeakPolarHBondContact O-CA 3.49Å; K19-T22 WeakPolarHBondContact O-CB 3.38Å; K19-T22 PolarHBondContact O-N 3.04Å; T22-R25 PolarHBondContact O-N 3.5Å; T22-R26 PolarHBondContact O-N 3.27Å |
| 23 | V | 86.9 | Confident | 87 | Confident | 15 Ų | 15 | 115 Ų | 115 | 9% | 0.091 | 51% | 0.512 | C | S | . | . | H | α-helix | trans | -60.1 | -47.4 | 175.2 | 177.8 | 0 | 0 | 0 | 0 | 110.8 | W13 R14 L18 K19 R20 R25 R26 I27 | W13-V23 HydrophobicContact CB-CG1 4.12Å; W13-V23 VanDerWaalsContact O-CG2 3.3Å; W13-V23 WeakPolarHBondContact O-CG2 3.32Å; R14-V23 HydrophobicContact CG-CG1 4.25Å; L18-V23 HydrophobicContact CB-CG2 3.69Å; K19-V23 PolarHBondContact O-N 3.06Å; K19-V23 VanDerWaalsContact O-N 3.13Å; R20-V23 PolarHBondContact O-N 3.01Å; V23-R25 PolarHBondContact O-N 2.9Å; V23-R26 PolarHBondContact O-N 3.38Å; V23-I27 HydrophobicContact CG1-CD1 3.91Å; V23-I27 WeakPolarHBondContact O-CG1 3.32Å; V23-I27 PolarHBondContact O-N 3.18Å |
| 24 | R | 88 | Confident | 87 | Confident | 186 Ų | 186 | 113.1 Ų | 113.1 | 70% | 0.702 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -58.2 | -47.8 | 176 | -96.1 | -175.8 | 172.3 | 148.7 | -1.6 | 112.4 | R20 R21 R26 I27 I28 | R20-R24 PolarHBondContact O-N 2.91Å; R21-R24 PolarHBondContact O-N 3.25Å; R24-R26 VanDerWaalsContact C-N 3.32Å; R24-R26 PolarHBondContact O-N 2.6Å; R24-I27 PolarHBondContact O-N 3.11Å; R24-I28 WeakPolarHBondContact O-CG1 3.45Å; R24-I28 PolarHBondContact O-N 3.26Å; R24-I28 VanDerWaalsContact O-N 3.07Å |
| 25 | R | 89.7 | Confident | 87 | Confident | 190 Ų | 190 | 112.6 Ų | 112.6 | 72% | 0.717 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -58.9 | -44.3 | 178.2 | -76.8 | -177.8 | 178.7 | 175.4 | -1.1 | 111.6 | R21 T22 V23 I28 V29 | R21-R25 WeakPolarHBondContact O-CG 3.41Å; R21-R25 PolarHBondContact O-N 3.11Å; T22-R25 PolarHBondContact O-N 3.5Å; V23-R25 PolarHBondContact O-N 2.9Å; R25-I28 PolarHBondContact O-N 3.34Å; R25-V29 VanDerWaalsContact O-CG2 3.31Å; R25-V29 WeakPolarHBondContact O-CG2 3.39Å; R25-V29 PolarHBondContact O-N 2.89Å |
| 26 | R | 90 | Very high | 87.1 | Confident | 108 Ų | 108 | 111.1 Ų | 111.1 | 41% | 0.408 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.2 | -44.4 | 177.6 | -83.6 | -175 | 146.7 | 153.3 | -6.8 | 112.7 | T22 V23 R24 I28 V29 F30 | T22-R26 PolarHBondContact O-N 3.27Å; V23-R26 PolarHBondContact O-N 3.38Å; R24-R26 VanDerWaalsContact C-N 3.32Å; R24-R26 PolarHBondContact O-N 2.6Å; R26-I28 PolarHBondContact O-N 3.37Å; R26-V29 PolarHBondContact O-N 3.46Å; R26-F30 WeakPolarHBondContact O-CB 3.35Å; R26-F30 PolarHBondContact O-N 3.28Å |
| 27 | I | 87.7 | Confident | 87.2 | Confident | 26 Ų | 26 | 115.1 Ų | 115.1 | 13% | 0.133 | 51% | 0.509 | C | S | . | . | H | α-helix | trans | -59.8 | -48.2 | 177.9 | -67.8 | 170.6 | 0 | 0 | 0 | 110.5 | R10 V23 R24 V29 F30 E31 | R10-I27 HydrophobicContact CG-CD1 4.15Å; R10-I27 HydrophobicContact CG-CG1 4.1Å; R10-I27 HydrophobicContact CG-CG2 4.26Å; V23-I27 HydrophobicContact CG1-CD1 3.91Å; V23-I27 WeakPolarHBondContact O-CG1 3.32Å; V23-I27 PolarHBondContact O-N 3.18Å; R24-I27 PolarHBondContact O-N 3.11Å; I27-V29 PolarHBondContact O-N 3.48Å; I27-F30 PolarHBondContact O-N 2.92Å; I27-E31 HydrophobicContact CG2-CG 4.44Å; I27-E31 WeakPolarHBondContact O-CG 3.48Å; I27-E31 PolarHBondContact O-N 2.96Å |
| 28 | I | 89.2 | Confident | 87.1 | Confident | 106 Ų | 106 | 115.2 Ų | 115.2 | 54% | 0.544 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.9 | -45.3 | -179.4 | -67.4 | 165.7 | 0 | 0 | 0 | 111.1 | R24 R25 R26 F30 R32 | R24-I28 WeakPolarHBondContact O-CG1 3.45Å; R24-I28 PolarHBondContact O-N 3.26Å; R24-I28 VanDerWaalsContact O-N 3.07Å; R25-I28 PolarHBondContact O-N 3.34Å; R26-I28 PolarHBondContact O-N 3.37Å; I28-F30 VanDerWaalsContact C-N 3.32Å; I28-F30 PolarHBondContact O-N 3.34Å; I28-R32 WeakPolarHBondContact O-CB 3.43Å; I28-R32 PolarHBondContact O-N 2.89Å |
| 29 | V | 90.1 | Very high | 86.9 | Confident | 85 Ų | 85 | 115.1 Ų | 115.1 | 52% | 0.515 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.8 | -43 | 178 | 172.1 | 0 | 0 | 0 | 0 | 110.6 | R25 R26 I27 R32 I33 | R25-V29 VanDerWaalsContact O-CG2 3.31Å; R25-V29 WeakPolarHBondContact O-CG2 3.39Å; R25-V29 PolarHBondContact O-N 2.89Å; R26-V29 PolarHBondContact O-N 3.46Å; I27-V29 PolarHBondContact O-N 3.48Å; V29-R32 PolarHBondContact O-N 2.91Å; V29-I33 HydrophobicContact CG1-CD1 3.82Å; V29-I33 HydrophobicContact CG1-CG1 4.46Å; V29-I33 VanDerWaalsContact O-CG1 3.32Å; V29-I33 WeakPolarHBondContact O-CG1 3.33Å; V29-I33 PolarHBondContact O-N 2.83Å |
| 30 | F | 88.5 | Confident | 86.5 | Confident | 50 Ų | 50 | 111.7 Ų | 111.7 | 22% | 0.219 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -62.6 | -49.2 | 179.8 | -169 | -101.6 | 0 | 0 | 0 | 112 | M1 L6 N9 R26 I27 I28 R32 I33 E34 | M1-F30 HydrophobicContact CE-CZ 4.1Å; L6-F30 HydrophobicContact CB-CE1 4.48Å; L6-F30 HydrophobicContact CD2-CD1 3.62Å; L6-F30 HydrophobicContact CD2-CE1 3.29Å; L6-F30 HydrophobicContact CD2-CZ 4.44Å; L6-F30 HydrophobicContact CG-CE1 4.18Å; N9-F30 HydrophobicContact CB-CE1 4.17Å; N9-F30 HydrophobicContact CB-CZ 4.16Å; R26-F30 WeakPolarHBondContact O-CB 3.35Å; R26-F30 PolarHBondContact O-N 3.28Å; I27-F30 PolarHBondContact O-N 2.92Å; I28-F30 VanDerWaalsContact C-N 3.32Å; I28-F30 PolarHBondContact O-N 3.34Å; F30-R32 VanDerWaalsContact C-N 3.28Å; F30-R32 PolarHBondContact O-N 3.42Å; F30-I33 PolarHBondContact O-N 3.29Å; F30-E34 WeakPolarHBondContact O-CB 3.13Å; F30-E34 PolarHBondContact O-N 2.87Å |
| 31 | E | 87.9 | Confident | 86.3 | Confident | 83 Ų | 83 | 104.5 Ų | 104.5 | 39% | 0.388 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -59.2 | -39.7 | 176.5 | -73.3 | -178.9 | 147.1 | 0 | 0 | 112 | R10 I27 E34 Y35 | R10-E31 IonicContact CZ-OE1 2.82Å; R10-E31 IonicContact NH1-OE1 2.86Å; R10-E31 PolarHBondContact NH1-OE1 3.11Å; I27-E31 HydrophobicContact CG2-CG 4.44Å; I27-E31 WeakPolarHBondContact O-CG 3.48Å; I27-E31 PolarHBondContact O-N 2.96Å; E31-E34 PolarHBondContact O-N 2.95Å; E31-Y35 WeakPolarHBondContact O-CB 3.45Å; E31-Y35 PolarHBondContact O-N 3.48Å |
| 32 | R | 88.9 | Confident | 85.9 | Confident | 171 Ų | 171 | 98.7 Ų | 98.7 | 65% | 0.645 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -67.6 | -40.1 | 179.9 | -160.9 | 178.2 | -178.1 | -161.5 | 0.8 | 112.4 | I28 V29 F30 E34 R36 | I28-R32 WeakPolarHBondContact O-CB 3.43Å; I28-R32 PolarHBondContact O-N 2.89Å; V29-R32 PolarHBondContact O-N 2.91Å; F30-R32 VanDerWaalsContact C-N 3.28Å; F30-R32 PolarHBondContact O-N 3.42Å; R32-E34 VanDerWaalsContact C-N 3.32Å; R32-R36 PolarHBondContact O-N 3.47Å; R32-R36 VanDerWaalsContact O-N 3.11Å |
| 33 | I | 88.1 | Confident | 85.3 | Confident | 105 Ų | 105 | 100.1 Ų | 100.1 | 54% | 0.538 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -63.7 | -43.2 | 173.5 | -68.1 | 167.3 | 0 | 0 | 0 | 109.7 | V29 F30 Y35 R36 Y37 | V29-I33 HydrophobicContact CG1-CD1 3.82Å; V29-I33 HydrophobicContact CG1-CG1 4.46Å; V29-I33 VanDerWaalsContact O-CG1 3.32Å; V29-I33 WeakPolarHBondContact O-CG1 3.33Å; V29-I33 PolarHBondContact O-N 2.83Å; F30-I33 PolarHBondContact O-N 3.29Å; I33-Y35 PolarHBondContact O-N 3.3Å; I33-R36 PolarHBondContact O-N 2.93Å; I33-Y37 WeakPolarHBondContact O-CB 3.39Å; I33-Y37 PolarHBondContact O-N 2.8Å |
| 34 | E | 83.4 | Confident | 84.6 | Confident | 15 Ų | 15 | 104.6 Ų | 104.6 | 7% | 0.07 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -65.6 | -41.9 | -177.6 | -148.3 | -125.2 | 176.1 | 0 | 0 | 112 | M1 L6 F30 E31 R32 Y37 K38 | M1-E34 HydrophobicContact CE-CG 4.11Å; L6-E34 WeakPolarHBondContact CD1-OE1 3.46Å; L6-E34 WeakPolarHBondContact CD1-OE2 3.36Å; L6-E34 HydrophobicContact CD2-CB 4.16Å; L6-E34 VanDerWaalsContact CD2-CD 3.45Å; L6-E34 HydrophobicContact CD2-CG 3.81Å; L6-E34 HydrophobicContact CG-CG 4.47Å; F30-E34 WeakPolarHBondContact O-CB 3.13Å; F30-E34 PolarHBondContact O-N 2.87Å; E31-E34 PolarHBondContact O-N 2.95Å; R32-E34 VanDerWaalsContact C-N 3.32Å; E34-Y37 PolarHBondContact O-N 3.34Å; E34-K38 WeakPolarHBondContact O-CB 3.39Å; E34-K38 WeakPolarHBondContact O-CG 3.45Å; E34-K38 PolarHBondContact O-N 2.92Å; E34-K38 WeakPolarHBondContact OE1-CE 3.46Å; E34-K38 IonicContact OE1-NZ 2.6Å; E34-K38 PolarHBondContact OE1-NZ 2.86Å; E34-K38 IonicContact OE2-NZ 3.67Å; E34-K38 PolarHBondContact OE2-NZ 3.37Å |
| 35 | Y | 86.1 | Confident | 83.6 | Confident | 177 Ų | 177 | 98.7 Ų | 98.7 | 69% | 0.694 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -60.6 | -45.5 | 173.4 | -173.2 | -92.2 | 0 | 0 | 0 | 111.7 | E31 I33 K38 S39 | E31-Y35 WeakPolarHBondContact O-CB 3.45Å; E31-Y35 PolarHBondContact O-N 3.48Å; I33-Y35 PolarHBondContact O-N 3.3Å; Y35-K38 PolarHBondContact O-N 3.35Å; Y35-S39 WeakPolarHBondContact O-CB 3.26Å; Y35-S39 PolarHBondContact O-N 3.18Å |
| 36 | R | 86.9 | Confident | 82.5 | Confident | 164 Ų | 164 | 93 Ų | 93 | 62% | 0.619 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -64.1 | -42.1 | 176.6 | -78.4 | -158 | 173.7 | -166.4 | -1.4 | 112.5 | R32 I33 S39 I40 | R32-R36 PolarHBondContact O-N 3.47Å; R32-R36 VanDerWaalsContact O-N 3.11Å; I33-R36 PolarHBondContact O-N 2.93Å; R36-S39 PolarHBondContact O-N 3.03Å; R36-I40 VanDerWaalsContact O-CG1 3.26Å; R36-I40 WeakPolarHBondContact O-CG1 3.48Å; R36-I40 PolarHBondContact O-N 3.27Å |
| 37 | Y | 84.8 | Confident | 81.2 | Confident | 130 Ų | 130 | 95 Ų | 95 | 51% | 0.51 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -61.8 | -45.9 | 177.4 | -178.2 | -93.9 | 0 | 0 | 0 | 111 | I33 E34 S39 I40 V41 | I33-Y37 WeakPolarHBondContact O-CB 3.39Å; I33-Y37 PolarHBondContact O-N 2.8Å; E34-Y37 PolarHBondContact O-N 3.34Å; Y37-S39 PolarHBondContact O-N 2.85Å; Y37-I40 PolarHBondContact O-N 2.91Å; Y37-V41 HydrophobicContact CD1-CG2 4.01Å; Y37-V41 HydrophobicContact CE1-CG2 3.58Å; Y37-V41 HydrophobicContact CE2-CG2 4.15Å; Y37-V41 HydrophobicContact CG-CG2 4.47Å; Y37-V41 WeakPolarHBondContact O-CB 3.49Å; Y37-V41 VanDerWaalsContact O-CG2 3.31Å; Y37-V41 WeakPolarHBondContact O-CG2 3.16Å; Y37-V41 PolarHBondContact O-N 3.4Å |
| 38 | K | 81.8 | Confident | 80.1 | Confident | 81 Ų | 81 | 101 Ų | 101 | 35% | 0.352 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -57.6 | -48.7 | 174.6 | -78.2 | 174 | 177.9 | 159.5 | 0 | 111.1 | E34 Y35 I40 V41 T42 | E34-K38 WeakPolarHBondContact O-CB 3.39Å; E34-K38 WeakPolarHBondContact O-CG 3.45Å; E34-K38 PolarHBondContact O-N 2.92Å; E34-K38 WeakPolarHBondContact OE1-CE 3.46Å; E34-K38 IonicContact OE1-NZ 2.6Å; E34-K38 PolarHBondContact OE1-NZ 2.86Å; E34-K38 IonicContact OE2-NZ 3.67Å; E34-K38 PolarHBondContact OE2-NZ 3.37Å; Y35-K38 PolarHBondContact O-N 3.35Å; K38-I40 PolarHBondContact O-N 3.05Å; K38-V41 PolarHBondContact O-N 2.82Å; K38-T42 WeakPolarHBondContact O-CG2 3.33Å; K38-T42 PolarHBondContact O-N 2.81Å; K38-T42 PolarHBondContact O-OG1 2.92Å |
| 39 | S | 81.4 | Confident | 78.8 | Confident | 60 Ų | 60 | 104.3 Ų | 104.3 | 42% | 0.42 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -56.4 | -47.5 | 176.9 | 174.1 | 0 | 0 | 0 | 0 | 112 | Y35 R36 Y37 V41 T42 D43 | Y35-S39 WeakPolarHBondContact O-CB 3.26Å; Y35-S39 PolarHBondContact O-N 3.18Å; R36-S39 PolarHBondContact O-N 3.03Å; Y37-S39 PolarHBondContact O-N 2.85Å; S39-V41 PolarHBondContact O-N 2.89Å; S39-T42 WeakPolarHBondContact CA-OG1 3.4Å; S39-T42 PolarHBondContact O-N 3.19Å; S39-T42 PolarHBondContact O-OG1 3.26Å; S39-D43 WeakPolarHBondContact O-CB 3.31Å; S39-D43 PolarHBondContact O-N 2.76Å |
| 40 | I | 79.2 | Confident | 77.7 | Confident | 100 Ų | 100 | 103.1 Ų | 103.1 | 51% | 0.513 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.2 | -44.1 | 178.6 | -66.7 | 164.1 | 0 | 0 | 0 | 111.3 | R36 Y37 K38 T42 D43 L44 | R36-I40 VanDerWaalsContact O-CG1 3.26Å; R36-I40 WeakPolarHBondContact O-CG1 3.48Å; R36-I40 PolarHBondContact O-N 3.27Å; Y37-I40 PolarHBondContact O-N 2.91Å; K38-I40 PolarHBondContact O-N 3.05Å; I40-T42 VanDerWaalsContact C-N 3.34Å; I40-T42 PolarHBondContact O-N 3.37Å; I40-D43 PolarHBondContact O-N 3.43Å; I40-L44 HydrophobicContact CG2-CD1 3.98Å; I40-L44 PolarHBondContact O-N 3.49Å |
| 41 | V | 79.7 | Confident | 76.7 | Confident | 72 Ų | 72 | 110 Ų | 110 | 44% | 0.436 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.5 | -37.1 | 179.7 | 171.9 | 0 | 0 | 0 | 0 | 111.4 | Y37 K38 S39 P45 | Y37-V41 HydrophobicContact CD1-CG2 4.01Å; Y37-V41 HydrophobicContact CE1-CG2 3.58Å; Y37-V41 HydrophobicContact CE2-CG2 4.15Å; Y37-V41 HydrophobicContact CG-CG2 4.47Å; Y37-V41 WeakPolarHBondContact O-CB 3.49Å; Y37-V41 VanDerWaalsContact O-CG2 3.31Å; Y37-V41 WeakPolarHBondContact O-CG2 3.16Å; Y37-V41 PolarHBondContact O-N 3.4Å; K38-V41 PolarHBondContact O-N 2.82Å; S39-V41 PolarHBondContact O-N 2.89Å; V41-P45 WeakPolarHBondContact O-CD 3.16Å |
| 42 | T | 77.9 | Confident | 75.7 | Confident | 91 Ų | 91 | 111.3 Ų | 111.3 | 56% | 0.558 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -74.3 | -30.1 | 174.2 | 49.8 | 0 | 0 | 0 | 0 | 112.8 | K38 S39 I40 P45 T46 | K38-T42 WeakPolarHBondContact O-CG2 3.33Å; K38-T42 PolarHBondContact O-N 2.81Å; K38-T42 PolarHBondContact O-OG1 2.92Å; S39-T42 WeakPolarHBondContact CA-OG1 3.4Å; S39-T42 PolarHBondContact O-N 3.19Å; S39-T42 PolarHBondContact O-OG1 3.26Å; I40-T42 VanDerWaalsContact C-N 3.34Å; I40-T42 PolarHBondContact O-N 3.37Å; T42-P45 VanDerWaalsContact O-CD 3.3Å; T42-P45 WeakPolarHBondContact O-CD 3.47Å; T42-P45 WeakPolarHBondContact O-CG 3.3Å; T42-T46 PolarHBondContact O-OG1 3.24Å |
| 43 | D | 75.5 | Confident | 74.8 | Confident | 88 Ų | 88 | 109.6 Ų | 109.6 | 47% | 0.471 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -84.1 | -24.7 | -176.6 | -159.1 | 46.3 | 0 | 0 | 0 | 112.9 | S39 I40 T46 K47 | S39-D43 WeakPolarHBondContact O-CB 3.31Å; S39-D43 PolarHBondContact O-N 2.76Å; I40-D43 PolarHBondContact O-N 3.43Å; D43-T46 VanDerWaalsContact C-OG1 3.25Å; D43-T46 WeakPolarHBondContact CA-OG1 3.26Å; D43-T46 PolarHBondContact O-N 3.27Å; D43-T46 PolarHBondContact O-OG1 2.92Å; D43-T46 PolarHBondContact OD1-OG1 2.93Å; D43-T46 VanDerWaalsContact OD1-OG1 3.05Å; D43-K47 VanDerWaalsContact O-CB 3.3Å; D43-K47 WeakPolarHBondContact O-CB 3.3Å; D43-K47 PolarHBondContact O-N 2.9Å |
| 44 | L | 71.5 | Confident | 73.9 | Confident | 108 Ų | 108 | 109.6 Ų | 109.6 | 57% | 0.565 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -55.3 | -51.8 | 173.2 | -119.9 | 76.7 | 0 | 0 | 0 | 113.6 | I40 K48 | I40-L44 HydrophobicContact CG2-CD1 3.98Å; I40-L44 PolarHBondContact O-N 3.49Å; L44-K48 PolarHBondContact O-N 3.22Å |
| 45 | P | 66.7 | Low | 73.3 | Confident | 62 Ų | 62 | 112.6 Ų | 112.6 | 40% | 0.403 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -71.4 | -33.3 | 179.3 | 26.2 | -33.2 | 0 | 0 | 0 | 112.7 | V41 T42 K48 R49 | V41-P45 WeakPolarHBondContact O-CD 3.16Å; T42-P45 VanDerWaalsContact O-CD 3.3Å; T42-P45 WeakPolarHBondContact O-CD 3.47Å; T42-P45 WeakPolarHBondContact O-CG 3.3Å; P45-K48 PolarHBondContact O-N 2.86Å; P45-R49 WeakPolarHBondContact O-CB 2.96Å; P45-R49 VanDerWaalsContact O-CG 3.26Å; P45-R49 WeakPolarHBondContact O-CG 3.27Å; P45-R49 PolarHBondContact O-N 3.44Å |
| 46 | T | 66.2 | Low | 72.7 | Confident | 71 Ų | 71 | 113.4 Ų | 113.4 | 44% | 0.436 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -65.2 | -41 | 174.6 | 44.2 | 0 | 0 | 0 | 0 | 110.9 | T42 D43 R49 S50 | T42-T46 PolarHBondContact O-OG1 3.24Å; D43-T46 VanDerWaalsContact C-OG1 3.25Å; D43-T46 WeakPolarHBondContact CA-OG1 3.26Å; D43-T46 PolarHBondContact O-N 3.27Å; D43-T46 PolarHBondContact O-OG1 2.92Å; D43-T46 PolarHBondContact OD1-OG1 2.93Å; D43-T46 VanDerWaalsContact OD1-OG1 3.05Å; T46-R49 PolarHBondContact O-N 3.47Å; T46-S50 PolarHBondContact O-N 2.88Å |
| 47 | K | 63.8 | Low | 72.3 | Confident | 149 Ų | 149 | 115.2 Ų | 115.2 | 65% | 0.648 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -66.3 | -42.3 | 176.3 | -151 | 171.4 | -173.5 | 177.1 | 0 | 112.1 | D43 R49 S50 R51 | D43-K47 VanDerWaalsContact O-CB 3.3Å; D43-K47 WeakPolarHBondContact O-CB 3.3Å; D43-K47 PolarHBondContact O-N 2.9Å; K47-R49 PolarHBondContact O-N 3.19Å; K47-S50 PolarHBondContact O-N 3.34Å; K47-S50 PolarHBondContact O-OG 2.87Å; K47-R51 PolarHBondContact O-N 3.45Å |
| 48 | K | 65.6 | Low | 72.1 | Confident | 154 Ų | 154 | 110.7 Ų | 110.7 | 67% | 0.67 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -62.3 | -39.3 | 172.3 | -83.3 | -171.1 | 174.6 | -176.8 | 0 | 112.6 | L44 P45 R51 L52 | L44-K48 PolarHBondContact O-N 3.22Å; P45-K48 PolarHBondContact O-N 2.86Å; K48-R51 PolarHBondContact O-N 3.07Å; K48-L52 PolarHBondContact O-N 3.2Å; K48-L52 VanDerWaalsContact O-N 3.07Å |
| 49 | R | 61.2 | Low | 72 | Confident | 175 Ų | 175 | 111.2 Ų | 111.2 | 66% | 0.66 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -66.3 | -40.3 | 175.5 | -77.5 | 177.1 | 177.6 | 179.4 | 0 | 112.3 | P45 T46 K47 R51 L52 Q53 | P45-R49 WeakPolarHBondContact O-CB 2.96Å; P45-R49 VanDerWaalsContact O-CG 3.26Å; P45-R49 WeakPolarHBondContact O-CG 3.27Å; P45-R49 PolarHBondContact O-N 3.44Å; T46-R49 PolarHBondContact O-N 3.47Å; K47-R49 PolarHBondContact O-N 3.19Å; R49-R51 VanDerWaalsContact C-N 3.33Å; R49-R51 PolarHBondContact O-N 2.91Å; R49-L52 PolarHBondContact O-N 2.77Å; R49-Q53 WeakPolarHBondContact O-CG 3.25Å; R49-Q53 PolarHBondContact O-N 3.46Å |
| 50 | S | 67.6 | Low | 72 | Confident | 60 Ų | 60 | 113.5 Ų | 113.5 | 42% | 0.42 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -60.3 | -43.6 | 176.2 | 77.4 | 0 | 0 | 0 | 0 | 111.7 | T46 K47 Q53 V54 | T46-S50 PolarHBondContact O-N 2.88Å; K47-S50 PolarHBondContact O-N 3.34Å; K47-S50 PolarHBondContact O-OG 2.87Å; S50-Q53 PolarHBondContact O-N 3.28Å; S50-V54 VanDerWaalsContact O-CG2 3.27Å; S50-V54 WeakPolarHBondContact O-CG2 3.41Å; S50-V54 PolarHBondContact O-N 3.49Å |
| 51 | R | 66.7 | Low | 72.1 | Confident | 193 Ų | 193 | 112.5 Ų | 112.5 | 73% | 0.728 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -65.3 | -41.9 | 177.5 | -175.1 | 175.4 | 161.8 | -154.8 | -5.6 | 111.8 | K47 K48 R49 Q53 V54 V55 | K47-R51 PolarHBondContact O-N 3.45Å; K48-R51 PolarHBondContact O-N 3.07Å; R49-R51 VanDerWaalsContact C-N 3.33Å; R49-R51 PolarHBondContact O-N 2.91Å; R51-Q53 VanDerWaalsContact C-N 3.33Å; R51-Q53 PolarHBondContact O-N 2.94Å; R51-V54 PolarHBondContact O-N 2.92Å; R51-V55 WeakPolarHBondContact O-CG2 3.41Å; R51-V55 PolarHBondContact O-N 3.29Å |
| 52 | L | 66 | Low | 72.1 | Confident | 111 Ų | 111 | 114.7 Ų | 114.7 | 58% | 0.581 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -63.1 | -38.6 | 173.8 | -82.9 | 165.4 | 0 | 0 | 0 | 112.1 | K48 R49 V55 R56 | K48-L52 PolarHBondContact O-N 3.2Å; K48-L52 VanDerWaalsContact O-N 3.07Å; R49-L52 PolarHBondContact O-N 2.77Å; L52-V55 PolarHBondContact O-N 3.28Å; L52-R56 WeakPolarHBondContact O-CB 3.34Å; L52-R56 VanDerWaalsContact O-CG 3.25Å; L52-R56 WeakPolarHBondContact O-CG 3.44Å; L52-R56 PolarHBondContact O-N 3.32Å |
| 53 | Q | 70.8 | Confident | 72.4 | Confident | 136 Ų | 136 | 118.7 Ų | 118.7 | 64% | 0.636 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -65.6 | -40.8 | 175.1 | -74.5 | -176.4 | 10.7 | 0 | 0 | 112.1 | R49 S50 R51 R56 R57 | R49-Q53 WeakPolarHBondContact O-CG 3.25Å; R49-Q53 PolarHBondContact O-N 3.46Å; S50-Q53 PolarHBondContact O-N 3.28Å; R51-Q53 VanDerWaalsContact C-N 3.33Å; R51-Q53 PolarHBondContact O-N 2.94Å; Q53-R56 PolarHBondContact O-N 3.49Å; Q53-R57 WeakPolarHBondContact O-CB 3.33Å; Q53-R57 PolarHBondContact O-N 2.89Å |
| 54 | V | 70 | Confident | 72.7 | Confident | 105 Ų | 105 | 117.6 Ų | 117.6 | 64% | 0.636 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -62.8 | -46.3 | 175 | 176.9 | 0 | 0 | 0 | 0 | 111 | S50 R51 R57 G58 | S50-V54 VanDerWaalsContact O-CG2 3.27Å; S50-V54 WeakPolarHBondContact O-CG2 3.41Å; S50-V54 PolarHBondContact O-N 3.49Å; R51-V54 PolarHBondContact O-N 2.92Å; V54-R57 PolarHBondContact O-N 3.47Å; V54-G58 PolarHBondContact O-N 3.07Å |
| 55 | V | 69.9 | Low | 73.3 | Confident | 77 Ų | 77 | 115.6 Ų | 115.6 | 47% | 0.467 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -61.6 | -46.4 | 177.4 | 172.8 | 0 | 0 | 0 | 0 | 111 | R51 L52 R57 G58 D59 | R51-V55 WeakPolarHBondContact O-CG2 3.41Å; R51-V55 PolarHBondContact O-N 3.29Å; L52-V55 PolarHBondContact O-N 3.28Å; V55-R57 VanDerWaalsContact C-N 3.3Å; V55-R57 PolarHBondContact O-N 2.95Å; V55-G58 PolarHBondContact O-N 3.22Å; V55-D59 PolarHBondContact O-N 2.95Å |
| 56 | R | 73.8 | Confident | 74 | Confident | 194 Ų | 194 | 116.2 Ų | 116.2 | 73% | 0.732 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -63.7 | -34.4 | 178.2 | -70.4 | -179.5 | 91.3 | -163.8 | 6.5 | 112.7 | L52 Q53 L60 | L52-R56 WeakPolarHBondContact O-CB 3.34Å; L52-R56 VanDerWaalsContact O-CG 3.25Å; L52-R56 WeakPolarHBondContact O-CG 3.44Å; L52-R56 PolarHBondContact O-N 3.32Å; Q53-R56 PolarHBondContact O-N 3.49Å; R56-L60 VanDerWaalsContact O-CB 3.3Å; R56-L60 WeakPolarHBondContact O-CB 3.4Å; R56-L60 PolarHBondContact O-N 3.44Å |
| 57 | R | 78.3 | Confident | 74.9 | Confident | 202 Ų | 202 | 117.7 Ų | 117.7 | 76% | 0.762 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -69.1 | -42 | 173.3 | -86.5 | -172.7 | 167.6 | -159.3 | -2.8 | 112.3 | Q53 V54 V55 L60 C61 | Q53-R57 WeakPolarHBondContact O-CB 3.33Å; Q53-R57 PolarHBondContact O-N 2.89Å; V54-R57 PolarHBondContact O-N 3.47Å; V55-R57 VanDerWaalsContact C-N 3.3Å; V55-R57 PolarHBondContact O-N 2.95Å; R57-L60 PolarHBondContact O-N 3.43Å; R57-C61 WeakPolarHBondContact O-CB 3.44Å; R57-C61 PolarHBondContact O-N 3.32Å |
| 58 | G | 80.3 | Confident | 76 | Confident | 36 Ų | 36 | 115.8 Ų | 115.8 | 37% | 0.371 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -60.3 | -49.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | V54 V55 L60 C61 L62 | V54-G58 PolarHBondContact O-N 3.07Å; V55-G58 PolarHBondContact O-N 3.22Å; G58-L60 VanDerWaalsContact C-N 3.3Å; G58-L60 PolarHBondContact O-N 2.69Å; G58-C61 WeakPolarHBondContact O-CB 3.47Å; G58-C61 PolarHBondContact O-N 2.93Å; G58-C61 VanDerWaalsContact O-N 3.15Å; G58-L62 WeakPolarHBondContact O-CG 3.43Å; G58-L62 PolarHBondContact O-N 3.39Å |
| 59 | D | 80.4 | Confident | 76.8 | Confident | 92 Ų | 92 | 111.3 Ų | 111.3 | 49% | 0.492 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -60 | -39.7 | 175.2 | -94.6 | 19.4 | 0 | 0 | 0 | 112.4 | V55 L62 R63 | V55-D59 PolarHBondContact O-N 2.95Å; D59-L62 PolarHBondContact O-N 3.33Å; D59-R63 WeakPolarHBondContact O-CG 3.39Å; D59-R63 PolarHBondContact O-N 3.36Å |
| 60 | L | 80.1 | Confident | 77.9 | Confident | 107 Ų | 107 | 107.5 Ų | 107.5 | 56% | 0.56 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -64.5 | -43.6 | 175.5 | -175.3 | 63.7 | 0 | 0 | 0 | 111 | R56 R57 G58 L62 R63 V64 | R56-L60 VanDerWaalsContact O-CB 3.3Å; R56-L60 WeakPolarHBondContact O-CB 3.4Å; R56-L60 PolarHBondContact O-N 3.44Å; R57-L60 PolarHBondContact O-N 3.43Å; G58-L60 VanDerWaalsContact C-N 3.3Å; G58-L60 PolarHBondContact O-N 2.69Å; L60-L62 VanDerWaalsContact C-N 3.32Å; L60-L62 PolarHBondContact O-N 3.01Å; L60-R63 PolarHBondContact O-N 2.92Å; L60-V64 HydrophobicContact CD1-CG2 4.4Å; L60-V64 HydrophobicContact CG-CG2 4.38Å; L60-V64 VanDerWaalsContact O-CG2 3.28Å; L60-V64 WeakPolarHBondContact O-CG2 3.42Å; L60-V64 PolarHBondContact O-N 2.81Å |
| 61 | C | 81.3 | Confident | 78.7 | Confident | 80 Ų | 80 | 109.3 Ų | 109.3 | 54% | 0.541 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -59.9 | -43.1 | 177 | -165.9 | 0 | 0 | 0 | 0 | 111.5 | R57 G58 V64 T65 | R57-C61 WeakPolarHBondContact O-CB 3.44Å; R57-C61 PolarHBondContact O-N 3.32Å; G58-C61 WeakPolarHBondContact O-CB 3.47Å; G58-C61 PolarHBondContact O-N 2.93Å; G58-C61 VanDerWaalsContact O-N 3.15Å; C61-V64 PolarHBondContact O-N 3.15Å; C61-T65 PolarHBondContact O-N 2.89Å; C61-T65 PolarHBondContact O-OG1 2.88Å |
| 62 | L | 80.8 | Confident | 79.5 | Confident | 117 Ų | 117 | 104.9 Ų | 104.9 | 61% | 0.613 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63.1 | -40.6 | 175.2 | -71.3 | 173 | 0 | 0 | 0 | 112.2 | G58 D59 L60 T65 S66 | G58-L62 WeakPolarHBondContact O-CG 3.43Å; G58-L62 PolarHBondContact O-N 3.39Å; D59-L62 PolarHBondContact O-N 3.33Å; L60-L62 VanDerWaalsContact C-N 3.32Å; L60-L62 PolarHBondContact O-N 3.01Å; L62-T65 WeakPolarHBondContact CA-OG1 3.48Å; L62-T65 PolarHBondContact O-OG1 3.38Å; L62-S66 VanDerWaalsContact O-CB 3.3Å; L62-S66 WeakPolarHBondContact O-CB 3.3Å; L62-S66 PolarHBondContact O-N 3.4Å |
| 63 | R | 83.8 | Confident | 80.4 | Confident | 176 Ų | 176 | 108.6 Ų | 108.6 | 66% | 0.664 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -66.8 | -40.9 | 175 | -75.3 | 177.8 | 179.4 | -110.6 | -0.3 | 112.1 | D59 L60 S66 I67 | D59-R63 WeakPolarHBondContact O-CG 3.39Å; D59-R63 PolarHBondContact O-N 3.36Å; L60-R63 PolarHBondContact O-N 2.92Å; R63-S66 PolarHBondContact O-N 2.98Å; R63-I67 WeakPolarHBondContact O-CD1 3.46Å; R63-I67 VanDerWaalsContact O-CG1 3.25Å; R63-I67 WeakPolarHBondContact O-CG1 3.28Å; R63-I67 PolarHBondContact O-N 3.15Å |
| 64 | V | 81.3 | Confident | 80.9 | Confident | 64 Ų | 64 | 106.2 Ų | 106.2 | 39% | 0.388 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64.5 | -48.7 | 178.5 | 171.3 | 0 | 0 | 0 | 0 | 110.6 | L60 C61 S66 I67 E68 | L60-V64 HydrophobicContact CD1-CG2 4.4Å; L60-V64 HydrophobicContact CG-CG2 4.38Å; L60-V64 VanDerWaalsContact O-CG2 3.28Å; L60-V64 WeakPolarHBondContact O-CG2 3.42Å; L60-V64 PolarHBondContact O-N 2.81Å; C61-V64 PolarHBondContact O-N 3.15Å; V64-S66 VanDerWaalsContact C-N 3.31Å; V64-S66 PolarHBondContact O-N 3.48Å; V64-I67 PolarHBondContact O-N 3.47Å; V64-E68 HydrophobicContact CG1-CG 4.49Å; V64-E68 PolarHBondContact O-N 3.03Å |
| 65 | T | 84.1 | Confident | 81.4 | Confident | 67 Ų | 67 | 103.5 Ų | 103.5 | 41% | 0.411 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.5 | -35.2 | 176.3 | 33.2 | 0 | 0 | 0 | 0 | 112.6 | C61 L62 I67 S69 | C61-T65 PolarHBondContact O-N 2.89Å; C61-T65 PolarHBondContact O-OG1 2.88Å; L62-T65 WeakPolarHBondContact CA-OG1 3.48Å; L62-T65 PolarHBondContact O-OG1 3.38Å; T65-I67 VanDerWaalsContact C-N 3.31Å; T65-I67 PolarHBondContact O-N 2.98Å; T65-S69 WeakPolarHBondContact O-CB 3.25Å; T65-S69 PolarHBondContact O-N 3.19Å; T65-S69 PolarHBondContact O-OG 2.93Å |
| 66 | S | 82.5 | Confident | 81.9 | Confident | 75 Ų | 75 | 106.6 Ų | 106.6 | 52% | 0.524 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -65.4 | -33.5 | 172.2 | -176.2 | 0 | 0 | 0 | 0 | 112.7 | L62 R63 V64 S69 N70 | L62-S66 VanDerWaalsContact O-CB 3.3Å; L62-S66 WeakPolarHBondContact O-CB 3.3Å; L62-S66 PolarHBondContact O-N 3.4Å; R63-S66 PolarHBondContact O-N 2.98Å; V64-S66 VanDerWaalsContact C-N 3.31Å; V64-S66 PolarHBondContact O-N 3.48Å; S66-S69 WeakPolarHBondContact CA-OG 3.3Å; S66-S69 PolarHBondContact O-OG 2.83Å; S66-N70 WeakPolarHBondContact O-CB 3.35Å; S66-N70 PolarHBondContact O-N 3.19Å |
| 67 | I | 85.4 | Confident | 82.2 | Confident | 102 Ų | 102 | 100.8 Ų | 100.8 | 52% | 0.523 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -73.9 | -46.6 | 176.3 | -69.5 | 163.1 | 0 | 0 | 0 | 110.1 | R63 V64 T65 S69 N70 I71 | R63-I67 WeakPolarHBondContact O-CD1 3.46Å; R63-I67 VanDerWaalsContact O-CG1 3.25Å; R63-I67 WeakPolarHBondContact O-CG1 3.28Å; R63-I67 PolarHBondContact O-N 3.15Å; V64-I67 PolarHBondContact O-N 3.47Å; T65-I67 VanDerWaalsContact C-N 3.31Å; T65-I67 PolarHBondContact O-N 2.98Å; I67-S69 PolarHBondContact O-N 2.96Å; I67-N70 WeakPolarHBondContact O-CB 3.44Å; I67-N70 PolarHBondContact O-N 3.41Å; I67-N70 VanDerWaalsContact O-N 3.13Å; I67-I71 HydrophobicContact CG2-CD1 3.87Å; I67-I71 HydrophobicContact CG2-CG1 4.45Å; I67-I71 WeakPolarHBondContact O-CG1 3.49Å; I67-I71 PolarHBondContact O-N 3.08Å |
| 68 | E | 85.5 | Confident | 81.7 | Confident | 109 Ų | 109 | 98.1 Ų | 98.1 | 51% | 0.509 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -57 | -50 | 177.2 | -73.6 | 176.9 | 157.9 | 0 | 0 | 111.4 | V64 N70 I71 D72 | V64-E68 HydrophobicContact CG1-CG 4.49Å; V64-E68 PolarHBondContact O-N 3.03Å; E68-N70 VanDerWaalsContact C-N 3.25Å; E68-N70 PolarHBondContact O-N 2.85Å; E68-I71 WeakPolarHBondContact O-CB 3.46Å; E68-I71 PolarHBondContact O-N 2.98Å; E68-I71 VanDerWaalsContact O-N 3.08Å; E68-D72 PolarHBondContact O-N 2.93Å |
| 69 | S | 82.9 | Confident | 80.9 | Confident | 59 Ų | 59 | 103.7 Ų | 103.7 | 41% | 0.413 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.1 | -30 | 177 | 55.9 | 0 | 0 | 0 | 0 | 113.7 | T65 S66 I67 R73 | T65-S69 WeakPolarHBondContact O-CB 3.25Å; T65-S69 PolarHBondContact O-N 3.19Å; T65-S69 PolarHBondContact O-OG 2.93Å; S66-S69 WeakPolarHBondContact CA-OG 3.3Å; S66-S69 PolarHBondContact O-OG 2.83Å; I67-S69 PolarHBondContact O-N 2.96Å; S69-R73 WeakPolarHBondContact O-CG 3.36Å; S69-R73 PolarHBondContact O-N 3.13Å; S69-R73 VanDerWaalsContact O-N 3.11Å |
| 70 | N | 85.4 | Confident | 79.7 | Confident | 96 Ų | 96 | 101.9 Ų | 101.9 | 51% | 0.513 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -72 | -38.1 | 174 | -164.7 | 31.6 | 0 | 0 | 0 | 111.6 | S66 I67 E68 R73 L74 | S66-N70 WeakPolarHBondContact O-CB 3.35Å; S66-N70 PolarHBondContact O-N 3.19Å; I67-N70 WeakPolarHBondContact O-CB 3.44Å; I67-N70 PolarHBondContact O-N 3.41Å; I67-N70 VanDerWaalsContact O-N 3.13Å; E68-N70 VanDerWaalsContact C-N 3.25Å; E68-N70 PolarHBondContact O-N 2.85Å; N70-R73 PolarHBondContact O-N 3.24Å; N70-L74 WeakPolarHBondContact O-CG 3.46Å; N70-L74 PolarHBondContact O-N 3.45Å |
| 71 | I | 82.9 | Confident | 78.3 | Confident | 97 Ų | 97 | 105.1 Ų | 105.1 | 50% | 0.497 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -63.7 | -44.6 | 174.1 | -66.1 | 164.9 | 0 | 0 | 0 | 110.2 | I67 E68 R73 L74 A75 | I67-I71 HydrophobicContact CG2-CD1 3.87Å; I67-I71 HydrophobicContact CG2-CG1 4.45Å; I67-I71 WeakPolarHBondContact O-CG1 3.49Å; I67-I71 PolarHBondContact O-N 3.08Å; E68-I71 WeakPolarHBondContact O-CB 3.46Å; E68-I71 PolarHBondContact O-N 2.98Å; E68-I71 VanDerWaalsContact O-N 3.08Å; I71-R73 VanDerWaalsContact C-N 3.32Å; I71-R73 PolarHBondContact O-N 3.27Å; I71-L74 PolarHBondContact O-N 3.4Å; I71-A75 WeakPolarHBondContact O-CB 3.35Å; I71-A75 PolarHBondContact O-N 3.11Å |
| 72 | D | 83.9 | Confident | 76.5 | Confident | 100 Ų | 100 | 106.5 Ų | 106.5 | 54% | 0.535 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -61.3 | -41.1 | 177.6 | -73.8 | -20.2 | 0 | 0 | 0 | 111.8 | E68 A75 Q76 | E68-D72 PolarHBondContact O-N 2.93Å; D72-A75 PolarHBondContact O-N 2.93Å; D72-Q76 WeakPolarHBondContact O-CB 3.34Å; D72-Q76 WeakPolarHBondContact O-CG 3.43Å; D72-Q76 PolarHBondContact O-N 3.4Å |
| 73 | R | 84.6 | Confident | 75 | Confident | 190 Ų | 190 | 106.6 Ų | 106.6 | 72% | 0.717 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -63.9 | -41.6 | 174.8 | -79.4 | -179.1 | 152.1 | -162.7 | -5.8 | 112.6 | S69 N70 I71 Q76 S77 | S69-R73 WeakPolarHBondContact O-CG 3.36Å; S69-R73 PolarHBondContact O-N 3.13Å; S69-R73 VanDerWaalsContact O-N 3.11Å; N70-R73 PolarHBondContact O-N 3.24Å; I71-R73 VanDerWaalsContact C-N 3.32Å; I71-R73 PolarHBondContact O-N 3.27Å; R73-Q76 PolarHBondContact O-N 2.97Å; R73-S77 PolarHBondContact O-N 2.69Å |
| 74 | L | 82.6 | Confident | 73.5 | Confident | 85 Ų | 85 | 103.6 Ų | 103.6 | 45% | 0.445 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -63.5 | -47.5 | 174.9 | -74.8 | 166 | 0 | 0 | 0 | 110.7 | N70 I71 Q76 S77 H78 | N70-L74 WeakPolarHBondContact O-CG 3.46Å; N70-L74 PolarHBondContact O-N 3.45Å; I71-L74 PolarHBondContact O-N 3.4Å; L74-Q76 VanDerWaalsContact C-N 3.3Å; L74-Q76 PolarHBondContact O-N 3.04Å; L74-S77 WeakPolarHBondContact CA-OG 3.48Å; L74-S77 PolarHBondContact O-N 3.27Å; L74-S77 VanDerWaalsContact O-N 3.09Å; L74-S77 PolarHBondContact O-OG 3.22Å; L74-H78 PolarHBondContact O-CD2 3.45Å; L74-H78 PolarHBondContact O-N 3.34Å |
| 75 | A | 80.1 | Confident | 71.8 | Confident | 48 Ų | 48 | 106 Ų | 106 | 40% | 0.397 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -58 | -41.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | I71 D72 H78 L79 | I71-A75 WeakPolarHBondContact O-CB 3.35Å; I71-A75 PolarHBondContact O-N 3.11Å; D72-A75 PolarHBondContact O-N 2.93Å; A75-H78 PolarHBondContact O-N 3.36Å; A75-L79 WeakPolarHBondContact O-CG 3.35Å; A75-L79 PolarHBondContact O-N 2.98Å |
| 76 | Q | 81 | Confident | 69.7 | Low | 143 Ų | 143 | 117.1 Ų | 117.1 | 67% | 0.668 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -65.2 | -40.1 | 174.6 | -75 | -176.7 | 2.9 | 0 | 0 | 112.8 | D72 R73 L74 H78 L79 G80 | D72-Q76 WeakPolarHBondContact O-CB 3.34Å; D72-Q76 WeakPolarHBondContact O-CG 3.43Å; D72-Q76 PolarHBondContact O-N 3.4Å; R73-Q76 PolarHBondContact O-N 2.97Å; L74-Q76 VanDerWaalsContact C-N 3.3Å; L74-Q76 PolarHBondContact O-N 3.04Å; Q76-H78 VanDerWaalsContact C-N 3.27Å; Q76-H78 PolarHBondContact O-N 3.09Å; Q76-L79 PolarHBondContact O-N 2.97Å; Q76-G80 PolarHBondContact O-N 3.24Å |
| 77 | S | 78.6 | Confident | 69.1 | Low | 71 Ų | 71 | 119.2 Ų | 119.2 | 50% | 0.497 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -65 | -30.9 | 177.2 | 68.9 | 0 | 0 | 0 | 0 | 112.9 | R73 L74 | R73-S77 PolarHBondContact O-N 2.69Å; L74-S77 WeakPolarHBondContact CA-OG 3.48Å; L74-S77 PolarHBondContact O-N 3.27Å; L74-S77 VanDerWaalsContact O-N 3.09Å; L74-S77 PolarHBondContact O-OG 3.22Å |
| 78 | H | 68.2 | Low | 68.2 | Low | 147 Ų | 147 | 120.1 Ų | 120.1 | 68% | 0.681 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -81.2 | -18 | 177.5 | -67.1 | -57 | 0 | 0 | 0 | 114 | L74 A75 Q76 | L74-H78 PolarHBondContact O-CD2 3.45Å; L74-H78 PolarHBondContact O-N 3.34Å; A75-H78 PolarHBondContact O-N 3.36Å; Q76-H78 VanDerWaalsContact C-N 3.27Å; Q76-H78 PolarHBondContact O-N 3.09Å |
| 79 | L | 62.9 | Low | 67.3 | Low | 152 Ų | 152 | 120.7 Ų | 120.7 | 80% | 0.796 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -88.6 | -7.2 | 175.5 | -72.9 | 167.6 | 0 | 0 | 0 | 113.1 | A75 Q76 | A75-L79 WeakPolarHBondContact O-CG 3.35Å; A75-L79 PolarHBondContact O-N 2.98Å; Q76-L79 PolarHBondContact O-N 2.97Å |
| 80 | G | 56 | Low | 66.3 | Low | 55 Ų | 55 | 124.4 Ų | 124.4 | 57% | 0.567 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -89.8 | -4.4 | -174.2 | 0 | 0 | 0 | 0 | 0 | 116.6 | Q76 P82 | Q76-G80 PolarHBondContact O-N 3.24Å; G80-P82 WeakPolarHBondContact O-CD 3.09Å |
| 81 | E | 50.3 | Low | 65.1 | Low | 175 Ų | 175 | 126.1 Ų | 126.1 | 82% | 0.818 | 68% | 0.68 | S | S | * | * | trans | -104.7 | 90.2 | 173.4 | -72 | -154.1 | 150.8 | 0 | 0 | 111.2 | S83 | E81-S83 PolarHBondContact O-N 3.38Š| ||
| 82 | P | 44.9 | Very low | 64 | Low | 109 Ų | 109 | 128.1 Ų | 128.1 | 71% | 0.708 | 69% | 0.692 | S | S | * | * | trans | -66.5 | 118.5 | 154.4 | 28.9 | -28 | 0 | 0 | 0 | 106.1 | G80 S84 | G80-P82 WeakPolarHBondContact O-CD 3.09Å; P82-S84 PolarHBondContact O-N 2.84Å | ||
| 83 | S | 48.3 | Very low | 62.5 | Low | 118 Ų | 118 | 130.1 Ų | 130.1 | 83% | 0.825 | 70% | 0.703 | S | S | * | * | trans | -56.6 | 91.9 | 165.9 | 8.4 | 0 | 0 | 0 | 0 | 107.3 | E81 S85 | E81-S83 PolarHBondContact O-N 3.38Å; S83-S85 PolarHBondContact O-N 2.73Å | ||
| 84 | S | 51.3 | Low | 60.9 | Low | 113 Ų | 113 | 125.5 Ų | 125.5 | 79% | 0.79 | 70% | 0.702 | S | S | * | * | trans | -71.3 | 75 | 166.8 | 174.6 | 0 | 0 | 0 | 0 | 107.2 | P82 R86 | P82-S84 PolarHBondContact O-N 2.84Å; S84-R86 PolarHBondContact O-N 3.16Å; S84-R86 VanDerWaalsContact O-N 3.16Å | ||
| 85 | S | 46.1 | Very low | 59 | Low | 116 Ų | 116 | 128.8 Ų | 128.8 | 81% | 0.811 | 72% | 0.724 | S | S | * | * | trans | -72 | 98.2 | 160.7 | -173.7 | 0 | 0 | 0 | 0 | 106.8 | S83 | S83-S85 PolarHBondContact O-N 2.73Š| ||
| 86 | R | 40.8 | Very low | 57.1 | Low | 299 Ų | 299 | 136.2 Ų | 136.2 | 100% | 1.128 | 75% | 0.754 | S | S | * | * | trans | -79.8 | 0 | 163.9 | 178.3 | -178.8 | -96.6 | -163.5 | -5.3 | 109.3 | S84 | S84-R86 PolarHBondContact O-N 3.16Å; S84-R86 VanDerWaalsContact O-N 3.16Å |
Retrieved 86 of 86 residues in 55.7 ms
(Link to these results)