| 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 | 64.1 | Low | 81.8 | Confident | 202 Ų | 202 | 120.8 Ų | 120.8 | 100% | 0.995 | 63% | 0.63 | S | S | * | * | 0 | -73.5 | 0 | -56.8 | -37.3 | -169.2 | 0 | 0 | 112.7 | I3 F4 | M1-I3 VanDerWaalsContact C-N 3.32Å; M1-I3 PolarHBondContact O-N 3Å; M1-F4 PolarHBondContact O-N 3.26Å | |||
| 2 | Q | 77.8 | Confident | 81.5 | Confident | 170 Ų | 170 | 117.8 Ų | 117.8 | 79% | 0.794 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -42.2 | -43.5 | -169.6 | -78.2 | 177.9 | -17.4 | 0 | 0 | 117.2 | F4 T5 L6 | Q2-F4 VanDerWaalsContact C-N 3.31Å; Q2-F4 PolarHBondContact O-N 2.95Å; Q2-T5 WeakPolarHBondContact O-CB 3.33Å; Q2-T5 PolarHBondContact O-N 2.89Å; Q2-T5 VanDerWaalsContact O-N 3.1Å; Q2-L6 PolarHBondContact O-N 3.14Å |
| 3 | I | 84.5 | Confident | 81 | Confident | 133 Ų | 133 | 115.5 Ų | 115.5 | 68% | 0.682 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -57.6 | -41.6 | -177.7 | -59.6 | 174.2 | 0 | 0 | 0 | 111.9 | M1 T5 L6 V7 | M1-I3 VanDerWaalsContact C-N 3.32Å; M1-I3 PolarHBondContact O-N 3Å; I3-T5 VanDerWaalsContact C-N 3.33Å; I3-T5 PolarHBondContact O-N 3.44Å; I3-L6 PolarHBondContact O-N 3.39Å; I3-V7 HydrophobicContact CG2-CG2 4.46Å; I3-V7 WeakPolarHBondContact O-CG2 3.45Å; I3-V7 PolarHBondContact O-N 2.81Å |
| 4 | F | 83.6 | Confident | 80.4 | Confident | 160 Ų | 160 | 111.9 Ų | 111.9 | 70% | 0.702 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -64.5 | -38 | 178.1 | -74.3 | -86.7 | 0 | 0 | 0 | 112.1 | M1 Q2 V7 L8 | M1-F4 PolarHBondContact O-N 3.26Å; Q2-F4 VanDerWaalsContact C-N 3.31Å; Q2-F4 PolarHBondContact O-N 2.95Å; F4-V7 PolarHBondContact O-N 3.48Å; F4-L8 WeakPolarHBondContact O-CB 3.5Å; F4-L8 WeakPolarHBondContact O-CG 3.43Å; F4-L8 PolarHBondContact O-N 2.84Å |
| 5 | T | 84.7 | Confident | 79.7 | Confident | 86 Ų | 86 | 113.4 Ų | 113.4 | 53% | 0.528 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -64.5 | -42.5 | 175 | -45.7 | 0 | 0 | 0 | 0 | 111.2 | Q2 I3 L8 V9 | Q2-T5 WeakPolarHBondContact O-CB 3.33Å; Q2-T5 PolarHBondContact O-N 2.89Å; Q2-T5 VanDerWaalsContact O-N 3.1Å; I3-T5 VanDerWaalsContact C-N 3.33Å; I3-T5 PolarHBondContact O-N 3.44Å; T5-L8 PolarHBondContact O-N 2.15Å; T5-V9 WeakPolarHBondContact O-CG2 3.45Å; T5-V9 PolarHBondContact O-N 3.4Å |
| 6 | L | 84.4 | Confident | 78.8 | Confident | 117 Ų | 117 | 114 Ų | 114 | 61% | 0.613 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -63.4 | -45 | 177.5 | -116.1 | 169 | 0 | 0 | 0 | 111.9 | Q2 I3 V9 V10 | Q2-L6 PolarHBondContact O-N 3.14Å; I3-L6 PolarHBondContact O-N 3.39Å; L6-V9 PolarHBondContact O-N 3.15Å; L6-V10 WeakPolarHBondContact O-CG2 3.1Å; L6-V10 PolarHBondContact O-N 3.03Å |
| 7 | V | 85.8 | Confident | 77.5 | Confident | 78 Ų | 78 | 111.7 Ų | 111.7 | 47% | 0.473 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -62.2 | -43.4 | 175.3 | 172.2 | 0 | 0 | 0 | 0 | 111.2 | I3 F4 V10 L11 | I3-V7 HydrophobicContact CG2-CG2 4.46Å; I3-V7 WeakPolarHBondContact O-CG2 3.45Å; I3-V7 PolarHBondContact O-N 2.81Å; F4-V7 PolarHBondContact O-N 3.48Å; V7-V10 PolarHBondContact O-N 3.37Å; V7-L11 HydrophobicContact CG1-CD1 3.81Å; V7-L11 HydrophobicContact CG1-CG 4.3Å; V7-L11 WeakPolarHBondContact O-CB 3.28Å; V7-L11 VanDerWaalsContact O-CG 3.28Å; V7-L11 WeakPolarHBondContact O-CG 2.96Å; V7-L11 PolarHBondContact O-N 3.49Å |
| 8 | L | 86.5 | Confident | 76.4 | Confident | 110 Ų | 110 | 112.3 Ų | 112.3 | 58% | 0.576 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -60.8 | -45 | 175.4 | -85.2 | 165.2 | 0 | 0 | 0 | 112.6 | F4 T5 L11 V12 | F4-L8 WeakPolarHBondContact O-CB 3.5Å; F4-L8 WeakPolarHBondContact O-CG 3.43Å; F4-L8 PolarHBondContact O-N 2.84Å; T5-L8 PolarHBondContact O-N 2.15Å; L8-L11 PolarHBondContact O-N 3.39Å; L8-V12 WeakPolarHBondContact O-CG2 2.88Å; L8-V12 PolarHBondContact O-N 2.67Å |
| 9 | V | 83.8 | Confident | 75.2 | Confident | 85 Ų | 85 | 110.2 Ų | 110.2 | 52% | 0.515 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -62.9 | -44.5 | 177.6 | 170.3 | 0 | 0 | 0 | 0 | 111.2 | T5 L6 L11 V12 V13 | T5-V9 WeakPolarHBondContact O-CG2 3.45Å; T5-V9 PolarHBondContact O-N 3.4Å; L6-V9 PolarHBondContact O-N 3.15Å; V9-L11 VanDerWaalsContact C-N 3.35Å; V9-L11 PolarHBondContact O-N 2.76Å; V9-V12 PolarHBondContact O-N 2.89Å; V9-V13 HydrophobicContact CG1-CG2 4.49Å; V9-V13 WeakPolarHBondContact O-CB 3.35Å; V9-V13 WeakPolarHBondContact O-CG2 2.79Å; V9-V13 PolarHBondContact O-N 3.08Å |
| 10 | V | 82.6 | Confident | 74.1 | Confident | 83 Ų | 83 | 109.2 Ų | 109.2 | 50% | 0.503 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -63.4 | -40.9 | 176.7 | 171.6 | 0 | 0 | 0 | 0 | 111.3 | L6 V7 S14 | L6-V10 WeakPolarHBondContact O-CG2 3.1Å; L6-V10 PolarHBondContact O-N 3.03Å; V7-V10 PolarHBondContact O-N 3.37Å; V10-S14 WeakPolarHBondContact O-CB 3.12Å; V10-S14 PolarHBondContact O-N 2.84Å; V10-S14 PolarHBondContact O-OG 3.28Å |
| 11 | L | 82.1 | Confident | 73 | Confident | 105 Ų | 105 | 109.4 Ų | 109.4 | 55% | 0.55 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -66.1 | -42.9 | 176.7 | -74.9 | 172.6 | 0 | 0 | 0 | 112.3 | V7 L8 V9 S14 F15 | V7-L11 HydrophobicContact CG1-CD1 3.81Å; V7-L11 HydrophobicContact CG1-CG 4.3Å; V7-L11 WeakPolarHBondContact O-CB 3.28Å; V7-L11 VanDerWaalsContact O-CG 3.28Å; V7-L11 WeakPolarHBondContact O-CG 2.96Å; V7-L11 PolarHBondContact O-N 3.49Å; L8-L11 PolarHBondContact O-N 3.39Å; V9-L11 VanDerWaalsContact C-N 3.35Å; V9-L11 PolarHBondContact O-N 2.76Å; L11-S14 PolarHBondContact O-N 3.1Å; L11-F15 VanDerWaalsContact O-CB 3.22Å; L11-F15 WeakPolarHBondContact O-CB 3.32Å; L11-F15 PolarHBondContact O-N 2.82Å |
| 12 | V | 78.6 | Confident | 72.4 | Confident | 85 Ų | 85 | 104.5 Ų | 104.5 | 52% | 0.515 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -62.9 | -50.7 | 176.5 | 169.6 | 0 | 0 | 0 | 0 | 110.7 | L8 V9 S14 F15 E16 | L8-V12 WeakPolarHBondContact O-CG2 2.88Å; L8-V12 PolarHBondContact O-N 2.67Å; V9-V12 PolarHBondContact O-N 2.89Å; V12-S14 VanDerWaalsContact C-N 3.27Å; V12-S14 PolarHBondContact O-N 3.16Å; V12-F15 PolarHBondContact O-N 3.4Å; V12-F15 VanDerWaalsContact O-N 3.11Å; V12-E16 HydrophobicContact CG1-CG 4.33Å; V12-E16 VanDerWaalsContact O-CG 3.3Å; V12-E16 WeakPolarHBondContact O-CG 3.31Å; V12-E16 PolarHBondContact O-N 2.04Å |
| 13 | V | 74.5 | Confident | 71 | Confident | 88 Ų | 88 | 99.8 Ų | 99.8 | 53% | 0.533 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -60.9 | -37.9 | 177.8 | 172.2 | 0 | 0 | 0 | 0 | 111.5 | V9 C17 | V9-V13 HydrophobicContact CG1-CG2 4.49Å; V9-V13 WeakPolarHBondContact O-CB 3.35Å; V9-V13 WeakPolarHBondContact O-CG2 2.79Å; V9-V13 PolarHBondContact O-N 3.08Å; V13-C17 WeakPolarHBondContact O-CB 3.36Å; V13-C17 PolarHBondContact O-N 3.14Å; V13-C17 VanDerWaalsContact O-N 3.16Å; V13-C17 PolarHBondContact O-SG 2.81Å |
| 14 | S | 72.9 | Confident | 69.1 | Low | 64 Ų | 64 | 102.2 Ų | 102.2 | 45% | 0.448 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -67.6 | -39.8 | 175.4 | -59.2 | 0 | 0 | 0 | 0 | 111.9 | V10 L11 V12 C17 H18 | V10-S14 WeakPolarHBondContact O-CB 3.12Å; V10-S14 PolarHBondContact O-N 2.84Å; V10-S14 PolarHBondContact O-OG 3.28Å; L11-S14 PolarHBondContact O-N 3.1Å; V12-S14 VanDerWaalsContact C-N 3.27Å; V12-S14 PolarHBondContact O-N 3.16Å; S14-C17 PolarHBondContact O-N 3.3Å; S14-H18 WeakPolarHBondContact O-CB 3.39Å; S14-H18 PolarHBondContact O-N 2.78Å |
| 15 | F | 69.8 | Low | 67.5 | Low | 135 Ų | 135 | 100 Ų | 100 | 59% | 0.592 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -70.8 | -40 | 179.8 | -169.9 | -104.6 | 0 | 0 | 0 | 112.2 | L11 V12 H18 N19 | L11-F15 VanDerWaalsContact O-CB 3.22Å; L11-F15 WeakPolarHBondContact O-CB 3.32Å; L11-F15 PolarHBondContact O-N 2.82Å; V12-F15 PolarHBondContact O-N 3.4Å; V12-F15 VanDerWaalsContact O-N 3.11Å; F15-H18 PolarHBondContact O-N 2.91Å; F15-N19 WeakPolarHBondContact CE1-ND2 3.26Å; F15-N19 VanDerWaalsContact CZ-ND2 3.3Å; F15-N19 WeakPolarHBondContact CZ-ND2 3.5Å; F15-N19 WeakPolarHBondContact O-CB 3.04Å; F15-N19 PolarHBondContact O-N 3.2Å |
| 16 | E | 64.9 | Low | 65.8 | Low | 123 Ų | 123 | 100.6 Ų | 100.6 | 58% | 0.575 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -57.9 | -48.6 | 171.4 | -71.1 | -76 | 91.2 | 0 | 0 | 110.9 | V12 H18 S20 | V12-E16 HydrophobicContact CG1-CG 4.33Å; V12-E16 VanDerWaalsContact O-CG 3.3Å; V12-E16 WeakPolarHBondContact O-CG 3.31Å; V12-E16 PolarHBondContact O-N 2.04Å; E16-H18 PolarHBondContact O-N 3Å; E16-S20 WeakPolarHBondContact O-CB 3.21Å; E16-S20 PolarHBondContact O-N 3.2Å; E16-S20 PolarHBondContact O-OG 2.97Å |
| 17 | C | 57.3 | Low | 63.9 | Low | 75 Ų | 75 | 101.1 Ų | 101.1 | 51% | 0.507 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -61.7 | -40.4 | 174.1 | -77.4 | 0 | 0 | 0 | 0 | 112.6 | V13 S14 S20 V21 | V13-C17 WeakPolarHBondContact O-CB 3.36Å; V13-C17 PolarHBondContact O-N 3.14Å; V13-C17 VanDerWaalsContact O-N 3.16Å; V13-C17 PolarHBondContact O-SG 2.81Å; S14-C17 PolarHBondContact O-N 3.3Å; C17-S20 PolarHBondContact O-N 2.73Å; C17-V21 WeakPolarHBondContact O-CG2 3.2Å; C17-V21 PolarHBondContact O-N 3.47Å |
| 18 | H | 57.9 | Low | 61.9 | Low | 122 Ų | 122 | 104.1 Ų | 104.1 | 57% | 0.565 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -73.7 | -39.2 | -178.4 | -139 | -111.5 | 0 | 0 | 0 | 112.2 | S14 F15 E16 S20 V21 I22 | S14-H18 WeakPolarHBondContact O-CB 3.39Å; S14-H18 PolarHBondContact O-N 2.78Å; F15-H18 PolarHBondContact O-N 2.91Å; E16-H18 PolarHBondContact O-N 3Å; H18-S20 VanDerWaalsContact C-N 3.34Å; H18-V21 CarbonylContact O-C 3.02Å; H18-V21 PolarHBondContact O-N 3.28Å; H18-V21 VanDerWaalsContact O-N 3.1Å; H18-I22 VanDerWaalsContact O-CG1 3.28Å; H18-I22 WeakPolarHBondContact O-CG1 3.37Å; H18-I22 PolarHBondContact O-N 3.19Å |
| 19 | N | 52.9 | Low | 59.8 | Low | 72 Ų | 72 | 103.2 Ų | 103.2 | 39% | 0.385 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -64.4 | -38.7 | 171.7 | -105.5 | -45.8 | 0 | 0 | 0 | 111.6 | F15 V21 I22 A23 | F15-N19 WeakPolarHBondContact CE1-ND2 3.26Å; F15-N19 VanDerWaalsContact CZ-ND2 3.3Å; F15-N19 WeakPolarHBondContact CZ-ND2 3.5Å; F15-N19 WeakPolarHBondContact O-CB 3.04Å; F15-N19 PolarHBondContact O-N 3.2Å; N19-V21 PolarHBondContact O-N 2.67Å; N19-V21 VanDerWaalsContact O-N 3.14Å; N19-I22 PolarHBondContact O-N 3.28Å; N19-I22 VanDerWaalsContact O-N 3.1Å; N19-A23 WeakPolarHBondContact O-CB 3.36Å; N19-A23 PolarHBondContact O-N 2.73Å |
| 20 | S | 52.8 | Low | 57.9 | Low | 90 Ų | 90 | 107.8 Ų | 107.8 | 63% | 0.629 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -63.6 | -15.1 | 173.1 | -56.4 | 0 | 0 | 0 | 0 | 113.8 | E16 C17 H18 | E16-S20 WeakPolarHBondContact O-CB 3.21Å; E16-S20 PolarHBondContact O-N 3.2Å; E16-S20 PolarHBondContact O-OG 2.97Å; C17-S20 PolarHBondContact O-N 2.73Å; H18-S20 VanDerWaalsContact C-N 3.34Å |
| 21 | V | 51.1 | Low | 55.9 | Low | 115 Ų | 115 | 106.7 Ų | 106.7 | 70% | 0.697 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -99.6 | -24.6 | 174.2 | 169.1 | 0 | 0 | 0 | 0 | 112.1 | C17 H18 N19 | C17-V21 WeakPolarHBondContact O-CG2 3.2Å; C17-V21 PolarHBondContact O-N 3.47Å; H18-V21 CarbonylContact O-C 3.02Å; H18-V21 PolarHBondContact O-N 3.28Å; H18-V21 VanDerWaalsContact O-N 3.1Å; N19-V21 PolarHBondContact O-N 2.67Å; N19-V21 VanDerWaalsContact O-N 3.14Å |
| 22 | I | 51 | Low | 54 | Low | 99 Ų | 99 | 102.8 Ų | 102.8 | 51% | 0.508 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -87.2 | -22.9 | 177.3 | -67.8 | 164.1 | 0 | 0 | 0 | 111.9 | H18 N19 E24 | H18-I22 VanDerWaalsContact O-CG1 3.28Å; H18-I22 WeakPolarHBondContact O-CG1 3.37Å; H18-I22 PolarHBondContact O-N 3.19Å; N19-I22 PolarHBondContact O-N 3.28Å; N19-I22 VanDerWaalsContact O-N 3.1Å; I22-E24 VanDerWaalsContact C-N 3.3Å; I22-E24 PolarHBondContact O-N 2.91Å |
| 23 | A | 48.9 | Very low | 52.5 | Low | 70 Ų | 70 | 99 Ų | 99 | 58% | 0.579 | 59% | 0.59 | S | S | * | * | S | Bend | trans | -71.8 | 82.4 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | N19 P25 | N19-A23 WeakPolarHBondContact O-CB 3.36Å; N19-A23 PolarHBondContact O-N 2.73Å; A23-P25 VanDerWaalsContact O-CD 3.24Å; A23-P25 WeakPolarHBondContact O-CD 3.49Å; A23-P25 VanDerWaalsContact O-N 3.12Å |
| 24 | E | 45 | Very low | 51 | Low | 184 Ų | 184 | 96.9 Ų | 96.9 | 86% | 0.86 | 58% | 0.579 | S | S | * | * | trans | -46.9 | 108.7 | -176 | -65.8 | 173.4 | 80.8 | 0 | 0 | 113.2 | I22 A26 | I22-E24 VanDerWaalsContact C-N 3.3Å; I22-E24 PolarHBondContact O-N 2.91Å; E24-A26 PolarHBondContact O-N 3.38Å | ||
| 25 | P | 51.1 | Low | 49.5 | Very low | 115 Ų | 115 | 98.2 Ų | 98.2 | 75% | 0.747 | 59% | 0.586 | S | S | * | * | trans | -80.3 | 121.9 | 177.8 | 30.9 | -31.3 | 0 | 0 | 0 | 110.2 | A23 | A23-P25 VanDerWaalsContact O-CD 3.24Å; A23-P25 WeakPolarHBondContact O-CD 3.49Å; A23-P25 VanDerWaalsContact O-N 3.12Å | ||
| 26 | A | 47.2 | Very low | 48.2 | Very low | 97 Ų | 97 | 95.1 Ų | 95.1 | 80% | 0.802 | 59% | 0.592 | S | S | * | * | trans | -56.2 | 129.6 | 175 | 0 | 0 | 0 | 0 | 0 | 110.8 | E24 D28 | E24-A26 PolarHBondContact O-N 3.38Å; A26-D28 PolarHBondContact O-N 3.33Å | ||
| 27 | P | 45 | Very low | 47.2 | Very low | 128 Ų | 128 | 92.5 Ų | 92.5 | 83% | 0.831 | 59% | 0.592 | S | S | * | * | trans | -84.8 | 104.7 | -169.9 | 31.6 | -34.4 | 0 | 0 | 0 | 112.1 | ||||
| 28 | D | 44.5 | Very low | 46.7 | Very low | 141 Ų | 141 | 89.7 Ų | 89.7 | 75% | 0.754 | 57% | 0.573 | S | S | * | * | trans | -145.3 | 104.4 | 151.3 | -153.5 | -143.4 | 0 | 0 | 0 | 115.6 | A26 | A26-D28 PolarHBondContact O-N 3.33Š| ||
| 29 | S | 41.7 | Very low | 46.2 | Very low | 92 Ų | 92 | 88.4 Ų | 88.4 | 64% | 0.643 | 58% | 0.575 | S | S | * | * | 33 | 89.4 | 125.7 | -36.5 | 0 | 0 | 0 | 0 | 120.9 | |||||
| 30 | Q | 43.5 | Very low | 45.7 | Very low | 180 Ų | 180 | 89.5 Ų | 89.5 | 84% | 0.841 | 58% | 0.578 | S | S | * | * | S | Bend | -172.2 | 73.3 | 126.7 | -107.3 | -177.4 | -44.1 | 0 | 0 | 114.7 | N62 | Q30-N62 PolarHBondContact O-ND2 3.4Š| |
| 31 | G | 41.5 | Very low | 45.2 | Very low | 60 Ų | 60 | 85.7 Ų | 85.7 | 62% | 0.619 | 55% | 0.551 | S | S | * | * | trans | 70.7 | 156.7 | 169.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 32 | G | 42.1 | Very low | 44.9 | Very low | 24 Ų | 24 | 85.1 Ų | 85.1 | 25% | 0.247 | 55% | 0.55 | C | S | . | . | trans | -179.6 | 144.3 | -178.6 | 0 | 0 | 0 | 0 | 0 | 118.3 | Q40 C59 | G32-Q40 PolarHBondContact O-OE1 3.46Å; G32-C59 CarbonylContact C-O 3.3Å; G32-C59 VanDerWaalsContact C-O 3.3Å; G32-C59 PolarHBondContact O-SG 2.88Å | ||
| 33 | C | 46.2 | Very low | 44.5 | Very low | 4 Ų | 4 | 90.6 Ų | 90.6 | 3% | 0.027 | 56% | 0.564 | C | S | . | * | -130.6 | 167.8 | 120.7 | -92.6 | 0 | 0 | 0 | 0 | 104.6 | C38 C59 C60 C63 | C33-C38 HydrophobicContact CB-CB 4.47Å; C33-C59 HydrophobicContact CB-CB 3.76Å; C33-C59 WeakPolarHBondContact CB-SG 3.3Å; C33-C59 PolarHBondContact N-O 2.95Å; C33-C59 WeakPolarHBondContact SG-CB 3.44Å; C33-C59 CovalentContact SG-SG 2.04Å; C33-C59 PolarHBondContact SG-SG 3.5Å; C33-C60 HydrophobicContact CB-CB 4.28Å; C33-C63 WeakPolarHBondContact O-CA 3.09Å; C33-C63 PolarHBondContact O-N 2.87Å; C33-C63 PolarHBondContact O-SG 3.48Å | |||
| 34 | C | 43.5 | Very low | 44.6 | Very low | 44 Ų | 44 | 90.1 Ų | 90.1 | 30% | 0.297 | 56% | 0.556 | S | S | . | * | trans | -131.3 | 152.3 | -170.3 | -50.1 | 0 | 0 | 0 | 0 | 113.2 | C38 | C34-C38 PolarHBondContact N-SG 3.49Å; C34-C38 PolarHBondContact O-SG 2.97Å | ||
| 35 | P | 41.2 | Very low | 44.5 | Very low | 92 Ų | 92 | 85 Ų | 85 | 60% | 0.597 | 54% | 0.54 | S | S | * | . | S | Bend | trans | -68 | 136.9 | 168.7 | 30.6 | -32.1 | 0 | 0 | 0 | 110.2 | ||
| 36 | G | 43.4 | Very low | 44.3 | Very low | 71 Ų | 71 | 79.7 Ų | 79.7 | 73% | 0.732 | 51% | 0.506 | S | S | * | . | S | Bend | trans | 104 | -163.9 | -166 | 0 | 0 | 0 | 0 | 0 | 111.5 | C38 | G36-C38 PolarHBondContact O-N 3.16Š|
| 37 | A | 42.6 | Very low | 44.3 | Very low | 68 Ų | 68 | 76.3 Ų | 76.3 | 56% | 0.562 | 48% | 0.476 | S | S | * | . | S | Bend | trans | -69.7 | 98.1 | 162.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | P39 C45 | A37-P39 WeakPolarHBondContact O-CD 3.33Å; A37-C45 HydrophobicContact CB-CB 4.48Å |
| 38 | C | 46.8 | Very low | 44.4 | Very low | 15 Ų | 15 | 81.7 Ų | 81.7 | 10% | 0.101 | 48% | 0.48 | C | S | . | . | trans | -44.9 | 109.4 | 171.2 | -66.3 | 0 | 0 | 0 | 0 | 109.1 | C33 C34 G36 Q40 C41 | C33-C38 HydrophobicContact CB-CB 4.47Å; C34-C38 PolarHBondContact N-SG 3.49Å; C34-C38 PolarHBondContact O-SG 2.97Å; G36-C38 PolarHBondContact O-N 3.16Å; C38-Q40 PolarHBondContact O-N 3.47Å; C38-C41 HydrophobicContact CB-CB 3.43Å; C38-C41 VanDerWaalsContact CB-CB 3.43Å; C38-C41 CarbonylContact O-C 3.04Å; C38-C41 VanDerWaalsContact O-CA 3.26Å; C38-C41 WeakPolarHBondContact O-CA 3.28Å; C38-C41 WeakPolarHBondContact O-CB 3.24Å; C38-C41 PolarHBondContact O-N 2.72Å | ||
| 39 | P | 48.8 | Very low | 44.4 | Very low | 96 Ų | 96 | 78.4 Ų | 78.4 | 62% | 0.623 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.1 | -23.9 | -171.8 | 27.3 | -34.4 | 0 | 0 | 0 | 112.3 | A37 C41 | A37-P39 WeakPolarHBondContact O-CD 3.33Å; P39-C41 PolarHBondContact O-N 2.89Å |
| 40 | Q | 42.3 | Very low | 44.7 | Very low | 95 Ų | 95 | 75.3 Ų | 75.3 | 44% | 0.444 | 46% | 0.458 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61 | -17.7 | 167 | -66.3 | 159.7 | -23 | 0 | 0 | 112.3 | G32 C38 C47 | G32-Q40 PolarHBondContact O-OE1 3.46Å; C38-Q40 PolarHBondContact O-N 3.47Å; Q40-C47 VanDerWaalsContact O-CA 3.31Å; Q40-C47 WeakPolarHBondContact O-CA 3.37Å; Q40-C47 WeakPolarHBondContact O-CB 3.38Å; Q40-C47 PolarHBondContact O-SG 3.31Å |
| 41 | C | 42.3 | Very low | 44.8 | Very low | 9 Ų | 9 | 74 Ų | 74 | 6% | 0.061 | 45% | 0.451 | C | S | . | . | trans | -103.3 | 107.1 | -176.6 | -110.6 | 0 | 0 | 0 | 0 | 107.9 | C38 P39 C44 C45 G46 C47 | C38-C41 HydrophobicContact CB-CB 3.43Å; C38-C41 VanDerWaalsContact CB-CB 3.43Å; C38-C41 CarbonylContact O-C 3.04Å; C38-C41 VanDerWaalsContact O-CA 3.26Å; C38-C41 WeakPolarHBondContact O-CA 3.28Å; C38-C41 WeakPolarHBondContact O-CB 3.24Å; C38-C41 PolarHBondContact O-N 2.72Å; P39-C41 PolarHBondContact O-N 2.89Å; C41-C44 VanDerWaalsContact CB-SG 3.59Å; C41-C44 WeakPolarHBondContact SG-CB 3.37Å; C41-C44 PolarHBondContact SG-O 2.85Å; C41-C44 CovalentContact SG-SG 2.15Å; C41-C44 PolarHBondContact SG-SG 2.93Å; C41-C45 CarbonylContact C-O 2.83Å; C41-C45 HydrophobicContact CB-CB 4.4Å; C41-C45 CarbonylContact O-C 3.57Å; C41-G46 PolarHBondContact O-N 3.25Å; C41-G46 WeakPolarHBondContact SG-CA 3.4Å; C41-G46 PolarHBondContact SG-N 3.14Å; C41-G46 VanDerWaalsContact SG-N 3.37Å; C41-C47 VanDerWaalsContact CA-N 3.28Å | ||
| 42 | P | 43.7 | Very low | 45.2 | Very low | 103 Ų | 103 | 74.4 Ų | 74.4 | 67% | 0.669 | 46% | 0.456 | S | S | * | . | S | Bend | trans | -62.8 | -27.1 | 145.8 | 33.9 | -7.6 | 0 | 0 | 0 | 131.7 | C45 G46 | P42-C45 CarbonylContact C-O 2.56Å; P42-C45 WeakPolarHBondContact CA-O 3.37Å; P42-C45 WeakPolarHBondContact CB-O 3.34Å; P42-C45 VanDerWaalsContact O-O 3.11Å; P42-G46 CarbonylContact C-O 3.59Å; P42-G46 WeakPolarHBondContact CA-O 3.3Å |
| 43 | R | 43.2 | Very low | 45.5 | Very low | 214 Ų | 214 | 76.8 Ų | 76.8 | 81% | 0.808 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -124.8 | -49.4 | 169.1 | -53.9 | -161.2 | 74.5 | -151.8 | 0.6 | 120.6 | C45 G46 | R43-C45 VanDerWaalsContact C-CA 3.46Å; R43-C45 VanDerWaalsContact CA-C 3.48Å; R43-C45 PolarHBondContact N-O 3.1Å; R43-C45 WeakPolarHBondContact O-CA 3.4Å; R43-C45 PolarHBondContact O-N 3.48Å; R43-G46 PolarHBondContact N-O 3.27Å |
| 44 | C | 50.3 | Low | 45.6 | Very low | 60 Ų | 60 | 83 Ų | 83 | 41% | 0.405 | 51% | 0.513 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.9 | 39.1 | 153.7 | 59.8 | 0 | 0 | 0 | 0 | 115.2 | C41 G46 C50 | C41-C44 VanDerWaalsContact CB-SG 3.59Å; C41-C44 WeakPolarHBondContact SG-CB 3.37Å; C41-C44 PolarHBondContact SG-O 2.85Å; C41-C44 CovalentContact SG-SG 2.15Å; C41-C44 PolarHBondContact SG-SG 2.93Å; C44-G46 PolarHBondContact O-N 3.1Å; C44-G46 WeakPolarHBondContact SG-CA 3.28Å; C44-G46 PolarHBondContact SG-N 3.46Å; C44-G46 VanDerWaalsContact SG-N 3.4Å; C44-C50 VanDerWaalsContact SG-SG 3.69Å |
| 45 | C | 43.1 | Very low | 46.1 | Very low | 77 Ų | 77 | 85 Ų | 85 | 52% | 0.52 | 53% | 0.527 | S | S | . | . | T | Hydrogen-bonded Turn | 50.3 | -29.5 | -115.3 | -67.8 | 0 | 0 | 0 | 0 | 115.4 | A37 C41 P42 R43 | A37-C45 HydrophobicContact CB-CB 4.48Å; C41-C45 CarbonylContact C-O 2.83Å; C41-C45 HydrophobicContact CB-CB 4.4Å; C41-C45 CarbonylContact O-C 3.57Å; P42-C45 CarbonylContact C-O 2.56Å; P42-C45 WeakPolarHBondContact CA-O 3.37Å; P42-C45 WeakPolarHBondContact CB-O 3.34Å; P42-C45 VanDerWaalsContact O-O 3.11Å; R43-C45 VanDerWaalsContact C-CA 3.46Å; R43-C45 VanDerWaalsContact CA-C 3.48Å; R43-C45 PolarHBondContact N-O 3.1Å; R43-C45 WeakPolarHBondContact O-CA 3.4Å; R43-C45 PolarHBondContact O-N 3.48Å | |
| 46 | G | 47.9 | Very low | 46.4 | Very low | 4 Ų | 4 | 83 Ų | 83 | 4% | 0.041 | 52% | 0.522 | C | S | . | . | trans | 37.8 | 124.5 | 148.2 | 0 | 0 | 0 | 0 | 0 | 141.6 | C41 P42 R43 C44 | C41-G46 PolarHBondContact O-N 3.25Å; C41-G46 WeakPolarHBondContact SG-CA 3.4Å; C41-G46 PolarHBondContact SG-N 3.14Å; C41-G46 VanDerWaalsContact SG-N 3.37Å; P42-G46 CarbonylContact C-O 3.59Å; P42-G46 WeakPolarHBondContact CA-O 3.3Å; R43-G46 PolarHBondContact N-O 3.27Å; C44-G46 PolarHBondContact O-N 3.1Å; C44-G46 WeakPolarHBondContact SG-CA 3.28Å; C44-G46 PolarHBondContact SG-N 3.46Å; C44-G46 VanDerWaalsContact SG-N 3.4Å | ||
| 47 | C | 47.1 | Very low | 46.6 | Very low | 26 Ų | 26 | 82.9 Ų | 82.9 | 18% | 0.176 | 52% | 0.521 | C | S | . | . | trans | -61.7 | 157.5 | -166.5 | -35 | 0 | 0 | 0 | 0 | 111.6 | Q40 C41 G49 C50 | Q40-C47 VanDerWaalsContact O-CA 3.31Å; Q40-C47 WeakPolarHBondContact O-CA 3.37Å; Q40-C47 WeakPolarHBondContact O-CB 3.38Å; Q40-C47 PolarHBondContact O-SG 3.31Å; C41-C47 VanDerWaalsContact CA-N 3.28Å; C47-G49 PolarHBondContact O-N 3.02Å; C47-G49 VanDerWaalsContact O-N 3.16Å; C47-C50 HydrophobicContact CB-CB 4.22Å; C47-C50 PolarHBondContact O-N 3.04Å | ||
| 48 | R | 46.2 | Very low | 46.9 | Very low | 240 Ų | 240 | 81.6 Ų | 81.6 | 91% | 0.906 | 52% | 0.515 | S | S | * | . | G | 310 helix | trans | -54.1 | -32.6 | 163 | -77 | -175.5 | 173.8 | 177.8 | -1.8 | 111.3 | C50 Q51 | R48-C50 PolarHBondContact O-N 3.44Å; R48-Q51 VanDerWaalsContact O-CB 3.28Å; R48-Q51 WeakPolarHBondContact O-CB 3.22Å; R48-Q51 PolarHBondContact O-N 2.99Å |
| 49 | G | 46.1 | Very low | 47.2 | Very low | 72 Ų | 72 | 82.8 Ų | 82.8 | 74% | 0.742 | 52% | 0.523 | S | S | * | . | G | 310 helix | trans | -70.8 | -18.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | C47 Q51 | C47-G49 PolarHBondContact O-N 3.02Å; C47-G49 VanDerWaalsContact O-N 3.16Å; G49-Q51 VanDerWaalsContact C-N 3.33Å |
| 50 | C | 48 | Very low | 47.3 | Very low | 28 Ų | 28 | 82.4 Ų | 82.4 | 19% | 0.189 | 52% | 0.521 | C | S | . | . | G | 310 helix | trans | -91.7 | 5.1 | 177.4 | -65.9 | 0 | 0 | 0 | 0 | 112.9 | C44 C47 R48 G52 G53 | C44-C50 VanDerWaalsContact SG-SG 3.69Å; C47-C50 HydrophobicContact CB-CB 4.22Å; C47-C50 PolarHBondContact O-N 3.04Å; R48-C50 PolarHBondContact O-N 3.44Å; C50-G52 PolarHBondContact O-N 2.97Å; C50-G53 PolarHBondContact O-N 3.1Å |
| 51 | Q | 44.5 | Very low | 47.7 | Very low | 151 Ų | 151 | 87.5 Ų | 87.5 | 71% | 0.706 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.6 | -17.2 | -177.2 | -163.4 | 165.5 | 45.7 | 0 | 0 | 113.5 | R48 G49 | R48-Q51 VanDerWaalsContact O-CB 3.28Å; R48-Q51 WeakPolarHBondContact O-CB 3.22Å; R48-Q51 PolarHBondContact O-N 2.99Å; G49-Q51 VanDerWaalsContact C-N 3.33Å |
| 52 | G | 50.5 | Low | 48.1 | Very low | 69 Ų | 69 | 91.4 Ų | 91.4 | 71% | 0.711 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.7 | 20 | 177.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | C50 N54 | C50-G52 PolarHBondContact O-N 2.97Å; G52-N54 PolarHBondContact O-N 3Å |
| 53 | G | 48.3 | Very low | 48.3 | Very low | 75 Ų | 75 | 88.1 Ų | 88.1 | 77% | 0.773 | 54% | 0.536 | S | S | * | . | S | Bend | trans | 70.1 | -2.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | C50 | C50-G53 PolarHBondContact O-N 3.1Š|
| 54 | N | 48.3 | Very low | 48.4 | Very low | 133 Ų | 133 | 87 Ų | 87 | 71% | 0.711 | 53% | 0.532 | S | S | * | . | trans | -107.2 | 77.4 | -168.9 | -159.7 | 1 | 0 | 0 | 0 | 111.6 | G52 G56 | G52-N54 PolarHBondContact O-N 3Å; N54-G56 PolarHBondContact O-N 3.39Å | ||
| 55 | C | 53.4 | Low | 48.3 | Very low | 88 Ų | 88 | 95.6 Ų | 95.6 | 60% | 0.595 | 56% | 0.556 | S | S | * | * | trans | -76 | 53.3 | 172.1 | -68.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 56 | G | 47.6 | Very low | 48.1 | Very low | 48 Ų | 48 | 100.8 Ų | 100.8 | 50% | 0.495 | 58% | 0.579 | S | S | . | * | trans | -86.2 | 147.4 | -171.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | N54 G58 | N54-G56 PolarHBondContact O-N 3.39Å; G56-G58 VanDerWaalsContact C-N 3.3Å; G56-G58 PolarHBondContact O-N 3.37Å | ||
| 57 | G | 47.5 | Very low | 48.1 | Very low | 69 Ų | 69 | 105.7 Ų | 105.7 | 71% | 0.711 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 75.8 | -50.2 | 152.2 | 0 | 0 | 0 | 0 | 0 | 118.3 | R61 | G57-R61 PolarHBondContact O-NE 3.11Š|
| 58 | G | 49.6 | Very low | 48.1 | Very low | 41 Ų | 41 | 109.8 Ų | 109.8 | 42% | 0.423 | 63% | 0.628 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -121 | -47.1 | -160.2 | 0 | 0 | 0 | 0 | 0 | 117.2 | G56 C60 R61 | G56-G58 VanDerWaalsContact C-N 3.3Å; G56-G58 PolarHBondContact O-N 3.37Å; G58-C60 PolarHBondContact O-N 2.95Å; G58-R61 WeakPolarHBondContact O-CB 3.5Å; G58-R61 WeakPolarHBondContact O-CG 3.42Å; G58-R61 PolarHBondContact O-N 3.35Å; G58-R61 VanDerWaalsContact O-N 3.14Å |
| 59 | C | 51.9 | Low | 48.3 | Very low | 40 Ų | 40 | 102.6 Ų | 102.6 | 27% | 0.27 | 61% | 0.613 | S | S | . | * | G | 310 helix | trans | -49 | -69 | -155.8 | -148 | 0 | 0 | 0 | 0 | 114.1 | G32 C33 R61 | G32-C59 CarbonylContact C-O 3.3Å; G32-C59 VanDerWaalsContact C-O 3.3Å; G32-C59 PolarHBondContact O-SG 2.88Å; C33-C59 HydrophobicContact CB-CB 3.76Å; C33-C59 WeakPolarHBondContact CB-SG 3.3Å; C33-C59 PolarHBondContact N-O 2.95Å; C33-C59 WeakPolarHBondContact SG-CB 3.44Å; C33-C59 CovalentContact SG-SG 2.04Å; C33-C59 PolarHBondContact SG-SG 3.5Å; C59-R61 PolarHBondContact O-N 2.86Å |
| 60 | C | 52.6 | Low | 48.4 | Very low | 88 Ų | 88 | 104.4 Ų | 104.4 | 60% | 0.595 | 61% | 0.605 | S | S | * | * | G | 310 helix | trans | -72.8 | 11.9 | -172.4 | -49.4 | 0 | 0 | 0 | 0 | 115.3 | C33 G58 C63 | C33-C60 HydrophobicContact CB-CB 4.28Å; G58-C60 PolarHBondContact O-N 2.95Å; C60-C63 PolarHBondContact O-SG 2.97Å; C60-C63 VanDerWaalsContact O-SG 3.4Å |
| 61 | R | 50.5 | Low | 48.4 | Very low | 203 Ų | 203 | 109.2 Ų | 109.2 | 77% | 0.766 | 63% | 0.631 | S | S | * | * | G | 310 helix | trans | -79.8 | -24.2 | 177.4 | -63.8 | -171.9 | 179.6 | -142.6 | -1.8 | 113.2 | G57 G58 C59 | G57-R61 PolarHBondContact O-NE 3.11Å; G58-R61 WeakPolarHBondContact O-CB 3.5Å; G58-R61 WeakPolarHBondContact O-CG 3.42Å; G58-R61 PolarHBondContact O-N 3.35Å; G58-R61 VanDerWaalsContact O-N 3.14Å; C59-R61 PolarHBondContact O-N 2.86Å |
| 62 | N | 49.1 | Very low | 48.7 | Very low | 90 Ų | 90 | 106.4 Ų | 106.4 | 48% | 0.481 | 63% | 0.626 | S | S | . | * | G | 310 helix | trans | -100.5 | 20 | 175.3 | -72.2 | 33.2 | 0 | 0 | 0 | 112.7 | Q30 R64 | Q30-N62 PolarHBondContact O-ND2 3.4Å; N62-R64 PolarHBondContact O-N 3.32Å |
| 63 | C | 49.2 | Very low | 48.5 | Very low | 35 Ų | 35 | 109.1 Ų | 109.1 | 24% | 0.236 | 62% | 0.62 | C | S | . | * | trans | -57.6 | 103.8 | 162.8 | -75.2 | 0 | 0 | 0 | 0 | 109.2 | C33 C60 R65 | C33-C63 WeakPolarHBondContact O-CA 3.09Å; C33-C63 PolarHBondContact O-N 2.87Å; C33-C63 PolarHBondContact O-SG 3.48Å; C60-C63 PolarHBondContact O-SG 2.97Å; C60-C63 VanDerWaalsContact O-SG 3.4Å; C63-R65 PolarHBondContact O-N 2.81Å | ||
| 64 | R | 44.9 | Very low | 48.5 | Very low | 190 Ų | 190 | 111.7 Ų | 111.7 | 72% | 0.717 | 61% | 0.608 | S | S | * | * | trans | -59 | 123.4 | 166.1 | -177.7 | 173.5 | 171.3 | 175.9 | -6.5 | 107.9 | N62 D66 | N62-R64 PolarHBondContact O-N 3.32Å; R64-D66 IonicContact CZ-OD2 3.15Å; R64-D66 IonicContact NE-OD2 2.73Å; R64-D66 PolarHBondContact NE-OD2 3.22Å; R64-D66 IonicContact NH2-OD1 3.62Å; R64-D66 IonicContact NH2-OD2 2.73Å; R64-D66 PolarHBondContact NH2-OD2 2.91Å; R64-D66 PolarHBondContact O-N 2.8Å | ||
| 65 | R | 47.6 | Very low | 48.6 | Very low | 241 Ų | 241 | 109.9 Ų | 109.9 | 91% | 0.909 | 60% | 0.599 | S | S | * | * | trans | -93.9 | 85.7 | 174.3 | -69.1 | -179 | 176.8 | -176.8 | -2 | 108.5 | C63 | C63-R65 PolarHBondContact O-N 2.81Š| ||
| 66 | D | 38.9 | Very low | 48.1 | Very low | 186 Ų | 186 | 111.9 Ų | 111.9 | 100% | 0.995 | 60% | 0.6 | S | S | * | * | trans | -115.5 | 0 | 160.2 | -103.4 | -106.2 | 0 | 0 | 0 | 106.3 | R64 | R64-D66 IonicContact CZ-OD2 3.15Å; R64-D66 IonicContact NE-OD2 2.73Å; R64-D66 PolarHBondContact NE-OD2 3.22Å; R64-D66 IonicContact NH2-OD1 3.62Å; R64-D66 IonicContact NH2-OD2 2.73Å; R64-D66 PolarHBondContact NH2-OD2 2.91Å; R64-D66 PolarHBondContact O-N 2.8Å |
Retrieved 66 of 66 residues in 18.1 ms
(Link to these results)