| 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 | 60.1 | Low | 76.9 | Confident | 188 Ų | 188 | 126.2 Ų | 126.2 | 93% | 0.926 | 62% | 0.624 | S | S | * | * | 0 | -32.8 | 0 | -133.2 | 170.1 | 179.9 | 0 | 0 | 113.1 | I3 K4 F5 | M1-I3 PolarHBondContact O-N 3.32Å; M1-K4 PolarHBondContact O-N 3.42Å; M1-F5 HydrophobicContact CG-CE2 4.33Å; M1-F5 WeakPolarHBondContact O-CD2 3.43Å | |||
| 2 | H | 65.4 | Low | 77.5 | Confident | 161 Ų | 161 | 124.8 Ų | 124.8 | 75% | 0.745 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -58.9 | -41.1 | -175.4 | -67.4 | -70.1 | 0 | 0 | 0 | 116.7 | K4 F5 L6 | H2-K4 VanDerWaalsContact C-N 3.26Å; H2-K4 PolarHBondContact O-N 3.24Å; H2-F5 WeakPolarHBondContact O-CB 3.46Å; H2-F5 PolarHBondContact O-N 3.23Å; H2-L6 PolarHBondContact O-N 3.24Å |
| 3 | I | 75.3 | Confident | 78.2 | Confident | 128 Ų | 128 | 120.2 Ų | 120.2 | 66% | 0.656 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -60.2 | -34.5 | 179.9 | -90 | 156.8 | 0 | 0 | 0 | 112.8 | M1 F5 L6 I7 | M1-I3 PolarHBondContact O-N 3.32Å; I3-F5 VanDerWaalsContact C-N 3.29Å; I3-F5 PolarHBondContact O-N 3.28Å; I3-L6 PolarHBondContact O-N 3.4Å; I3-I7 HydrophobicContact CG2-CD1 4.22Å; I3-I7 PolarHBondContact O-N 3.07Å |
| 4 | K | 70.5 | Confident | 78.7 | Confident | 168 Ų | 168 | 116 Ų | 116 | 73% | 0.73 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -63.9 | -36.3 | 177.1 | -65.3 | -173 | 177.1 | -175.7 | 0 | 111.6 | M1 H2 A8 | M1-K4 PolarHBondContact O-N 3.42Å; H2-K4 VanDerWaalsContact C-N 3.26Å; H2-K4 PolarHBondContact O-N 3.24Å; K4-A8 PolarHBondContact O-N 3.26Å |
| 5 | F | 75.4 | Confident | 78.8 | Confident | 130 Ų | 130 | 116.1 Ų | 116.1 | 57% | 0.57 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -69.3 | -38.4 | 176.8 | -75.3 | -81.1 | 0 | 0 | 0 | 112.4 | M1 H2 I3 I7 A8 L9 | M1-F5 HydrophobicContact CG-CE2 4.33Å; M1-F5 WeakPolarHBondContact O-CD2 3.43Å; H2-F5 WeakPolarHBondContact O-CB 3.46Å; H2-F5 PolarHBondContact O-N 3.23Å; I3-F5 VanDerWaalsContact C-N 3.29Å; I3-F5 PolarHBondContact O-N 3.28Å; F5-I7 PolarHBondContact O-N 3.33Å; F5-A8 PolarHBondContact O-N 2.99Å; F5-L9 PolarHBondContact O-N 2.99Å |
| 6 | L | 79.3 | Confident | 78.9 | Confident | 120 Ų | 120 | 113.2 Ų | 113.2 | 63% | 0.628 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -62.4 | -42.3 | 177.4 | -70.5 | 173.7 | 0 | 0 | 0 | 112 | H2 I3 L9 F10 | H2-L6 PolarHBondContact O-N 3.24Å; I3-L6 PolarHBondContact O-N 3.4Å; L6-L9 PolarHBondContact O-N 3.48Å; L6-F10 WeakPolarHBondContact O-CB 3.46Å; L6-F10 PolarHBondContact O-N 3.05Å |
| 7 | I | 82.1 | Confident | 78.9 | Confident | 97 Ų | 97 | 112.9 Ų | 112.9 | 50% | 0.497 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -64 | -44.1 | 177.3 | -64.7 | 168 | 0 | 0 | 0 | 110.8 | I3 F5 L9 F10 L11 | I3-I7 HydrophobicContact CG2-CD1 4.22Å; I3-I7 PolarHBondContact O-N 3.07Å; F5-I7 PolarHBondContact O-N 3.33Å; I7-L9 PolarHBondContact O-N 2.98Å; I7-F10 PolarHBondContact O-N 3.27Å; I7-L11 HydrophobicContact CG2-CD1 4.14Å; I7-L11 HydrophobicContact CG2-CG 4.48Å; I7-L11 WeakPolarHBondContact O-CG 3.42Å; I7-L11 PolarHBondContact O-N 3.48Å |
| 8 | A | 82.5 | Confident | 78.6 | Confident | 47 Ų | 47 | 115.6 Ų | 115.6 | 39% | 0.388 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -61.2 | -44.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | K4 F5 F10 L11 I12 | K4-A8 PolarHBondContact O-N 3.26Å; F5-A8 PolarHBondContact O-N 2.99Å; A8-F10 VanDerWaalsContact C-N 3.34Å; A8-F10 PolarHBondContact O-N 3.11Å; A8-L11 PolarHBondContact O-N 3.46Å; A8-I12 VanDerWaalsContact O-CG1 3.31Å; A8-I12 WeakPolarHBondContact O-CG1 3.4Å; A8-I12 PolarHBondContact O-N 3.41Å; A8-I12 VanDerWaalsContact O-N 3.11Å |
| 9 | L | 83.5 | Confident | 78.3 | Confident | 113 Ų | 113 | 112.7 Ų | 112.7 | 59% | 0.592 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -60.2 | -43.2 | 175.8 | -113.7 | 133.9 | 0 | 0 | 0 | 111.9 | F5 L6 I7 I12 T13 | F5-L9 PolarHBondContact O-N 2.99Å; L6-L9 PolarHBondContact O-N 3.48Å; I7-L9 PolarHBondContact O-N 2.98Å; L9-I12 PolarHBondContact O-N 3.25Å; L9-T13 WeakPolarHBondContact O-CG2 3.31Å; L9-T13 PolarHBondContact O-N 3.47Å; L9-T13 PolarHBondContact O-OG1 3.07Å |
| 10 | F | 86.9 | Confident | 77.9 | Confident | 129 Ų | 129 | 112.8 Ų | 112.8 | 57% | 0.566 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -65 | -39.8 | 178.4 | -175 | -107 | 0 | 0 | 0 | 113 | L6 I7 A8 T13 I14 | L6-F10 WeakPolarHBondContact O-CB 3.46Å; L6-F10 PolarHBondContact O-N 3.05Å; I7-F10 PolarHBondContact O-N 3.27Å; A8-F10 VanDerWaalsContact C-N 3.34Å; A8-F10 PolarHBondContact O-N 3.11Å; F10-T13 WeakPolarHBondContact CA-OG1 3.23Å; F10-T13 PolarHBondContact O-N 3.05Å; F10-T13 PolarHBondContact O-OG1 3.33Å; F10-I14 HydrophobicContact CD1-CD1 3.76Å; F10-I14 HydrophobicContact CE1-CD1 3.27Å; F10-I14 HydrophobicContact CE1-CG1 4.29Å; F10-I14 HydrophobicContact CE2-CD1 4.31Å; F10-I14 HydrophobicContact CG-CD1 4.47Å; F10-I14 HydrophobicContact CZ-CD1 3.59Å; F10-I14 HydrophobicContact CZ-CG1 4.31Å; F10-I14 WeakPolarHBondContact O-CG1 3.39Å; F10-I14 PolarHBondContact O-N 3.35Å |
| 11 | L | 84.7 | Confident | 77.4 | Confident | 107 Ų | 107 | 114.7 Ų | 114.7 | 56% | 0.56 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -66 | -39.4 | 176.3 | -70.5 | 173.1 | 0 | 0 | 0 | 112.1 | I7 A8 N15 | I7-L11 HydrophobicContact CG2-CD1 4.14Å; I7-L11 HydrophobicContact CG2-CG 4.48Å; I7-L11 WeakPolarHBondContact O-CG 3.42Å; I7-L11 PolarHBondContact O-N 3.48Å; A8-L11 PolarHBondContact O-N 3.46Å; L11-N15 PolarHBondContact O-N 2.91Å |
| 12 | I | 84.8 | Confident | 77.7 | Confident | 110 Ų | 110 | 110 Ų | 110 | 56% | 0.564 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -64.5 | -45.3 | 177.1 | -67.2 | 165.2 | 0 | 0 | 0 | 110.5 | A8 L9 I14 N15 V16 | A8-I12 VanDerWaalsContact O-CG1 3.31Å; A8-I12 WeakPolarHBondContact O-CG1 3.4Å; A8-I12 PolarHBondContact O-N 3.41Å; A8-I12 VanDerWaalsContact O-N 3.11Å; L9-I12 PolarHBondContact O-N 3.25Å; I12-I14 PolarHBondContact O-N 3.35Å; I12-N15 PolarHBondContact O-N 3.23Å; I12-V16 WeakPolarHBondContact O-CG2 3.48Å; I12-V16 PolarHBondContact O-N 3.17Å |
| 13 | T | 86.6 | Confident | 77.6 | Confident | 64 Ų | 64 | 108.6 Ų | 108.6 | 39% | 0.393 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64.7 | -41 | 179.7 | 51.4 | 0 | 0 | 0 | 0 | 112 | L9 F10 N15 V16 I17 | L9-T13 WeakPolarHBondContact O-CG2 3.31Å; L9-T13 PolarHBondContact O-N 3.47Å; L9-T13 PolarHBondContact O-OG1 3.07Å; F10-T13 WeakPolarHBondContact CA-OG1 3.23Å; F10-T13 PolarHBondContact O-N 3.05Å; F10-T13 PolarHBondContact O-OG1 3.33Å; T13-N15 PolarHBondContact O-N 2.89Å; T13-V16 PolarHBondContact O-N 3.49Å; T13-I17 WeakPolarHBondContact O-CD1 3.45Å; T13-I17 VanDerWaalsContact O-CG1 3.23Å; T13-I17 WeakPolarHBondContact O-CG1 3.37Å; T13-I17 PolarHBondContact O-N 3.38Å |
| 14 | I | 84.2 | Confident | 77.1 | Confident | 62 Ų | 62 | 107.2 Ų | 107.2 | 32% | 0.318 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -56.7 | -50.2 | 172.1 | -73.3 | 177.5 | 0 | 0 | 0 | 110.4 | F10 I12 V16 I17 Y18 | F10-I14 HydrophobicContact CD1-CD1 3.76Å; F10-I14 HydrophobicContact CE1-CD1 3.27Å; F10-I14 HydrophobicContact CE1-CG1 4.29Å; F10-I14 HydrophobicContact CE2-CD1 4.31Å; F10-I14 HydrophobicContact CG-CD1 4.47Å; F10-I14 HydrophobicContact CZ-CD1 3.59Å; F10-I14 HydrophobicContact CZ-CG1 4.31Å; F10-I14 WeakPolarHBondContact O-CG1 3.39Å; F10-I14 PolarHBondContact O-N 3.35Å; I12-I14 PolarHBondContact O-N 3.35Å; I14-V16 VanDerWaalsContact C-N 3.3Å; I14-V16 PolarHBondContact O-N 2.97Å; I14-I17 PolarHBondContact O-N 3.01Å; I14-Y18 HydrophobicContact CG2-CD2 3.55Å; I14-Y18 HydrophobicContact CG2-CE2 3.69Å; I14-Y18 WeakPolarHBondContact O-CD2 3.3Å; I14-Y18 PolarHBondContact O-N 3.47Å |
| 15 | N | 80 | Confident | 77.2 | Confident | 117 Ų | 117 | 105.3 Ų | 105.3 | 63% | 0.626 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -59.9 | -41.4 | -177.7 | -167.2 | 36.8 | 0 | 0 | 0 | 112.1 | L11 I12 T13 Y18 S19 | L11-N15 PolarHBondContact O-N 2.91Å; I12-N15 PolarHBondContact O-N 3.23Å; T13-N15 PolarHBondContact O-N 2.89Å; N15-Y18 PolarHBondContact O-N 3.45Å; N15-S19 VanDerWaalsContact O-CB 3.3Å; N15-S19 WeakPolarHBondContact O-CB 3.49Å; N15-S19 PolarHBondContact O-N 2.92Å |
| 16 | V | 81.5 | Confident | 77 | Confident | 70 Ų | 70 | 101.6 Ų | 101.6 | 42% | 0.424 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.9 | -44.8 | 176.1 | 173 | 0 | 0 | 0 | 0 | 111.5 | I12 T13 I14 S19 Q20 | I12-V16 WeakPolarHBondContact O-CG2 3.48Å; I12-V16 PolarHBondContact O-N 3.17Å; T13-V16 PolarHBondContact O-N 3.49Å; I14-V16 VanDerWaalsContact C-N 3.3Å; I14-V16 PolarHBondContact O-N 2.97Å; V16-S19 PolarHBondContact O-N 3.49Å; V16-Q20 WeakPolarHBondContact O-CG 3.33Å; V16-Q20 PolarHBondContact O-N 3Å |
| 17 | I | 77.8 | Confident | 76.7 | Confident | 109 Ų | 109 | 103.6 Ų | 103.6 | 56% | 0.559 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.8 | -44.4 | 179.1 | -67.2 | 164 | 0 | 0 | 0 | 110.9 | T13 I14 Q20 K21 | T13-I17 WeakPolarHBondContact O-CD1 3.45Å; T13-I17 VanDerWaalsContact O-CG1 3.23Å; T13-I17 WeakPolarHBondContact O-CG1 3.37Å; T13-I17 PolarHBondContact O-N 3.38Å; I14-I17 PolarHBondContact O-N 3.01Å; I17-Q20 PolarHBondContact O-N 3.23Å; I17-K21 WeakPolarHBondContact O-CB 3.35Å; I17-K21 PolarHBondContact O-N 2.92Å |
| 18 | Y | 73.3 | Confident | 76.6 | Confident | 160 Ų | 160 | 103.7 Ų | 103.7 | 63% | 0.627 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -63.7 | -41.1 | 176.7 | -90.5 | -92.9 | 0 | 0 | 0 | 111.8 | I14 N15 K21 T22 | I14-Y18 HydrophobicContact CG2-CD2 3.55Å; I14-Y18 HydrophobicContact CG2-CE2 3.69Å; I14-Y18 WeakPolarHBondContact O-CD2 3.3Å; I14-Y18 PolarHBondContact O-N 3.47Å; N15-Y18 PolarHBondContact O-N 3.45Å; Y18-K21 PolarHBondContact O-N 3.33Å; Y18-T22 PolarHBondContact O-N 3.21Å; Y18-T22 VanDerWaalsContact O-N 3.15Å; Y18-T22 PolarHBondContact O-OG1 3.32Å |
| 19 | S | 73.1 | Confident | 76.4 | Confident | 61 Ų | 61 | 105.8 Ų | 105.8 | 43% | 0.427 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67.4 | -38.2 | 177.9 | -170.9 | 0 | 0 | 0 | 0 | 113 | N15 V16 T22 Q23 | N15-S19 VanDerWaalsContact O-CB 3.3Å; N15-S19 WeakPolarHBondContact O-CB 3.49Å; N15-S19 PolarHBondContact O-N 2.92Å; V16-S19 PolarHBondContact O-N 3.49Å; S19-T22 PolarHBondContact O-OG1 3.47Å; S19-Q23 PolarHBondContact O-N 3.12Å |
| 20 | Q | 71.6 | Confident | 76.2 | Confident | 114 Ų | 114 | 106.9 Ų | 106.9 | 53% | 0.533 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -69.2 | -42 | 175.6 | -75 | -175 | 28.4 | 0 | 0 | 111.3 | V16 I17 T22 Q23 D24 | V16-Q20 WeakPolarHBondContact O-CG 3.33Å; V16-Q20 PolarHBondContact O-N 3Å; I17-Q20 PolarHBondContact O-N 3.23Å; Q20-T22 VanDerWaalsContact C-N 3.29Å; Q20-T22 PolarHBondContact O-N 3.15Å; Q20-Q23 PolarHBondContact O-N 2.92Å; Q20-Q23 VanDerWaalsContact O-N 3.15Å; Q20-D24 PolarHBondContact O-N 3.15Å |
| 21 | K | 67.6 | Low | 76.1 | Confident | 153 Ų | 153 | 105.9 Ų | 105.9 | 67% | 0.665 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -60 | -38.5 | 178.6 | -172.8 | 176.6 | -179.2 | 179.6 | 0 | 112.4 | I17 Y18 K25 | I17-K21 WeakPolarHBondContact O-CB 3.35Å; I17-K21 PolarHBondContact O-N 2.92Å; Y18-K21 PolarHBondContact O-N 3.33Å; K21-K25 VanDerWaalsContact O-CB 3.31Å; K21-K25 WeakPolarHBondContact O-CB 3.33Å; K21-K25 PolarHBondContact O-N 2.93Å; K21-K25 VanDerWaalsContact O-N 3.12Å |
| 22 | T | 64.5 | Low | 76.1 | Confident | 89 Ų | 89 | 106.4 Ų | 106.4 | 55% | 0.546 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -71.4 | -37.2 | 176.2 | 50.3 | 0 | 0 | 0 | 0 | 112.4 | Y18 S19 Q20 S26 | Y18-T22 PolarHBondContact O-N 3.21Å; Y18-T22 VanDerWaalsContact O-N 3.15Å; Y18-T22 PolarHBondContact O-OG1 3.32Å; S19-T22 PolarHBondContact O-OG1 3.47Å; Q20-T22 VanDerWaalsContact C-N 3.29Å; Q20-T22 PolarHBondContact O-N 3.15Å; T22-S26 WeakPolarHBondContact O-CB 3.43Å; T22-S26 PolarHBondContact O-N 2.93Å |
| 23 | Q | 64.3 | Low | 76.1 | Confident | 133 Ų | 133 | 104.9 Ų | 104.9 | 62% | 0.621 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.5 | -45.8 | 175 | -78.9 | -170.2 | -43.6 | 0 | 0 | 112.7 | S19 Q20 S26 R27 | S19-Q23 PolarHBondContact O-N 3.12Å; Q20-Q23 PolarHBondContact O-N 2.92Å; Q20-Q23 VanDerWaalsContact O-N 3.15Å; Q23-S26 PolarHBondContact O-N 3.31Å; Q23-R27 WeakPolarHBondContact O-CB 3.5Å; Q23-R27 PolarHBondContact O-N 2.68Å |
| 24 | D | 64.5 | Low | 76.1 | Confident | 98 Ų | 98 | 107.6 Ų | 107.6 | 52% | 0.524 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.1 | -41.3 | 179.3 | -82.2 | -23.6 | 0 | 0 | 0 | 111.8 | Q20 S26 R27 N28 | Q20-D24 PolarHBondContact O-N 3.15Å; D24-S26 PolarHBondContact O-N 2.89Å; D24-R27 PolarHBondContact O-N 2.98Å; D24-N28 WeakPolarHBondContact O-CB 3.31Å; D24-N28 PolarHBondContact O-N 3.5Å |
| 25 | K | 72.9 | Confident | 76.4 | Confident | 128 Ų | 128 | 110.9 Ų | 110.9 | 56% | 0.557 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -59.5 | -48 | 173.6 | -166.4 | 178.3 | -166.9 | -90.8 | 0 | 111 | K21 R27 N28 E29 | K21-K25 VanDerWaalsContact O-CB 3.31Å; K21-K25 WeakPolarHBondContact O-CB 3.33Å; K21-K25 PolarHBondContact O-N 2.93Å; K21-K25 VanDerWaalsContact O-N 3.12Å; K25-R27 VanDerWaalsContact C-N 3.32Å; K25-R27 PolarHBondContact O-N 3.36Å; K25-N28 PolarHBondContact O-N 2.86Å; K25-E29 WeakPolarHBondContact CE-OE1 3.44Å; K25-E29 HydrophobicContact CG-CG 4.41Å; K25-E29 IonicContact NZ-OE1 2.68Å; K25-E29 PolarHBondContact NZ-OE1 3.31Å; K25-E29 WeakPolarHBondContact O-CB 3.38Å; K25-E29 VanDerWaalsContact O-CG 3.27Å; K25-E29 WeakPolarHBondContact O-CG 3.33Å; K25-E29 PolarHBondContact O-N 3.18Å |
| 26 | S | 71.3 | Confident | 76.7 | Confident | 52 Ų | 52 | 108.7 Ų | 108.7 | 36% | 0.364 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.2 | -37.4 | 178.8 | -173.2 | 0 | 0 | 0 | 0 | 112.6 | T22 Q23 D24 K30 | T22-S26 WeakPolarHBondContact O-CB 3.43Å; T22-S26 PolarHBondContact O-N 2.93Å; Q23-S26 PolarHBondContact O-N 3.31Å; D24-S26 PolarHBondContact O-N 2.89Å; S26-K30 WeakPolarHBondContact O-CB 3.46Å; S26-K30 WeakPolarHBondContact O-CG 3.23Å; S26-K30 PolarHBondContact O-N 3.05Å |
| 27 | R | 73.5 | Confident | 77 | Confident | 163 Ų | 163 | 109.4 Ų | 109.4 | 62% | 0.615 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -68.9 | -41 | 177.6 | -166 | 177 | -171.2 | -174 | 2.6 | 111.8 | Q23 D24 K25 K31 | Q23-R27 WeakPolarHBondContact O-CB 3.5Å; Q23-R27 PolarHBondContact O-N 2.68Å; D24-R27 PolarHBondContact O-N 2.98Å; K25-R27 VanDerWaalsContact C-N 3.32Å; K25-R27 PolarHBondContact O-N 3.36Å; R27-K31 WeakPolarHBondContact O-CG 3.27Å; R27-K31 PolarHBondContact O-N 2.86Å |
| 28 | N | 78.5 | Confident | 77.6 | Confident | 98 Ų | 98 | 112.2 Ų | 112.2 | 52% | 0.524 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -69.2 | -43.2 | 176.8 | -73.2 | -13.5 | 0 | 0 | 0 | 111.7 | D24 K25 K30 K31 E32 | D24-N28 WeakPolarHBondContact O-CB 3.31Å; D24-N28 PolarHBondContact O-N 3.5Å; K25-N28 PolarHBondContact O-N 2.86Å; N28-K30 VanDerWaalsContact C-N 3.3Å; N28-K30 PolarHBondContact O-N 3.39Å; N28-K31 PolarHBondContact O-N 3.15Å; N28-K31 VanDerWaalsContact O-N 3.15Å; N28-E32 WeakPolarHBondContact O-CB 3.28Å; N28-E32 PolarHBondContact O-N 3.3Å |
| 29 | E | 79.8 | Confident | 78.5 | Confident | 92 Ų | 92 | 106.8 Ų | 106.8 | 43% | 0.43 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.1 | -37.4 | 175.9 | -74.9 | 172.7 | 172.4 | 0 | 0 | 112 | K25 L33 | K25-E29 WeakPolarHBondContact CE-OE1 3.44Å; K25-E29 HydrophobicContact CG-CG 4.41Å; K25-E29 IonicContact NZ-OE1 2.68Å; K25-E29 PolarHBondContact NZ-OE1 3.31Å; K25-E29 WeakPolarHBondContact O-CB 3.38Å; K25-E29 VanDerWaalsContact O-CG 3.27Å; K25-E29 WeakPolarHBondContact O-CG 3.33Å; K25-E29 PolarHBondContact O-N 3.18Å; E29-L33 VanDerWaalsContact O-CB 3.28Å; E29-L33 WeakPolarHBondContact O-CB 3.4Å; E29-L33 PolarHBondContact O-N 2.95Å |
| 30 | K | 79.5 | Confident | 79.5 | Confident | 136 Ų | 136 | 108 Ų | 108 | 59% | 0.591 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.7 | -43.9 | 174 | -79.1 | 177.8 | -178 | -175.4 | 0 | 112.3 | S26 N28 L33 E34 | S26-K30 WeakPolarHBondContact O-CB 3.46Å; S26-K30 WeakPolarHBondContact O-CG 3.23Å; S26-K30 PolarHBondContact O-N 3.05Å; N28-K30 VanDerWaalsContact C-N 3.3Å; N28-K30 PolarHBondContact O-N 3.39Å; K30-L33 PolarHBondContact O-N 3.12Å; K30-E34 WeakPolarHBondContact O-CG 3.45Å; K30-E34 PolarHBondContact O-N 2.83Å |
| 31 | K | 83.6 | Confident | 80.4 | Confident | 108 Ų | 108 | 108.4 Ų | 108.4 | 47% | 0.47 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.7 | -46 | 176.6 | -73.2 | 178.7 | 176.6 | -175.3 | 0 | 111.3 | R27 N28 L33 E34 E35 | R27-K31 WeakPolarHBondContact O-CG 3.27Å; R27-K31 PolarHBondContact O-N 2.86Å; N28-K31 PolarHBondContact O-N 3.15Å; N28-K31 VanDerWaalsContact O-N 3.15Å; K31-L33 VanDerWaalsContact C-N 3.32Å; K31-L33 PolarHBondContact O-N 2.97Å; K31-E34 WeakPolarHBondContact O-CB 3.44Å; K31-E34 PolarHBondContact O-N 3.22Å; K31-E34 VanDerWaalsContact O-N 3.12Å; K31-E35 WeakPolarHBondContact O-CG 3.42Å; K31-E35 PolarHBondContact O-N 3.44Å |
| 32 | E | 85.8 | Confident | 81.6 | Confident | 117 Ų | 117 | 104.4 Ų | 104.4 | 55% | 0.547 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.8 | -43.3 | 176.7 | -171.6 | -179.2 | 178.2 | 0 | 0 | 111 | N28 E34 E35 I36 | N28-E32 WeakPolarHBondContact O-CB 3.28Å; N28-E32 PolarHBondContact O-N 3.3Å; E32-E34 VanDerWaalsContact C-N 3.35Å; E32-E34 PolarHBondContact O-N 3.42Å; E32-E35 PolarHBondContact O-N 3.4Å; E32-I36 HydrophobicContact CG-CD1 3.89Å; E32-I36 HydrophobicContact CG-CG1 4.5Å; E32-I36 WeakPolarHBondContact O-CB 3.47Å; E32-I36 VanDerWaalsContact O-CG1 3.23Å; E32-I36 WeakPolarHBondContact O-CG1 3.47Å; E32-I36 PolarHBondContact O-N 2.89Å |
| 33 | L | 83.4 | Confident | 82.9 | Confident | 79 Ų | 79 | 104 Ų | 104 | 41% | 0.414 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.4 | -38.7 | 174.9 | -179.2 | 62.3 | 0 | 0 | 0 | 112.5 | E29 K30 K31 E35 I36 K37 Y42 | E29-L33 VanDerWaalsContact O-CB 3.28Å; E29-L33 WeakPolarHBondContact O-CB 3.4Å; E29-L33 PolarHBondContact O-N 2.95Å; K30-L33 PolarHBondContact O-N 3.12Å; K31-L33 VanDerWaalsContact C-N 3.32Å; K31-L33 PolarHBondContact O-N 2.97Å; L33-E35 VanDerWaalsContact C-N 3.32Å; L33-I36 PolarHBondContact O-N 2.88Å; L33-K37 HydrophobicContact CG-CD 4.4Å; L33-K37 WeakPolarHBondContact O-CB 3.4Å; L33-K37 WeakPolarHBondContact O-CG 3.37Å; L33-K37 PolarHBondContact O-N 2.82Å; L33-Y42 HydrophobicContact CD1-CE2 4.47Å |
| 34 | E | 88.3 | Confident | 84.3 | Confident | 120 Ų | 120 | 103.6 Ų | 103.6 | 56% | 0.561 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.9 | -33.8 | 175.1 | -76.8 | -179.6 | -174.9 | 0 | 0 | 112.9 | K30 K31 E32 | K30-E34 WeakPolarHBondContact O-CG 3.45Å; K30-E34 PolarHBondContact O-N 2.83Å; K31-E34 WeakPolarHBondContact O-CB 3.44Å; K31-E34 PolarHBondContact O-N 3.22Å; K31-E34 VanDerWaalsContact O-N 3.12Å; E32-E34 VanDerWaalsContact C-N 3.35Å; E32-E34 PolarHBondContact O-N 3.42Å |
| 35 | E | 88.6 | Confident | 85.7 | Confident | 131 Ų | 131 | 103.2 Ų | 103.2 | 61% | 0.612 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -71.8 | -47.1 | 173 | -70.7 | 176.2 | -172.4 | 0 | 0 | 111.2 | K31 E32 L33 K37 K38 | K31-E35 WeakPolarHBondContact O-CG 3.42Å; K31-E35 PolarHBondContact O-N 3.44Å; E32-E35 PolarHBondContact O-N 3.4Å; L33-E35 VanDerWaalsContact C-N 3.32Å; E35-K37 PolarHBondContact O-N 3.33Å; E35-K38 WeakPolarHBondContact O-CB 3.19Å; E35-K38 PolarHBondContact O-N 3.48Å |
| 36 | I | 88.3 | Confident | 86.6 | Confident | 71 Ų | 71 | 103.1 Ų | 103.1 | 36% | 0.364 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -58.3 | -38.3 | 176 | -69.1 | 167.1 | 0 | 0 | 0 | 110.6 | E32 L33 K38 T39 Y42 | E32-I36 HydrophobicContact CG-CD1 3.89Å; E32-I36 HydrophobicContact CG-CG1 4.5Å; E32-I36 WeakPolarHBondContact O-CB 3.47Å; E32-I36 VanDerWaalsContact O-CG1 3.23Å; E32-I36 WeakPolarHBondContact O-CG1 3.47Å; E32-I36 PolarHBondContact O-N 2.89Å; L33-I36 PolarHBondContact O-N 2.88Å; I36-K38 PolarHBondContact O-N 3.27Å; I36-K38 VanDerWaalsContact O-N 3.09Å; I36-T39 WeakPolarHBondContact O-CB 3.33Å; I36-T39 WeakPolarHBondContact O-CG2 3.39Å; I36-T39 PolarHBondContact O-N 3Å; I36-T39 PolarHBondContact O-OG1 2.65Å; I36-Y42 HydrophobicContact CG2-CD2 3.92Å; I36-Y42 HydrophobicContact CG2-CG 4.39Å; I36-Y42 WeakPolarHBondContact O-CB 3.5Å |
| 37 | K | 87.5 | Confident | 87.6 | Confident | 85 Ų | 85 | 103.9 Ų | 103.9 | 37% | 0.37 | 49% | 0.491 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.9 | -26.6 | 176.2 | -86.6 | 169.7 | 177.4 | -179.5 | 0 | 114.1 | L33 E35 Y42 Q43 | L33-K37 HydrophobicContact CG-CD 4.4Å; L33-K37 WeakPolarHBondContact O-CB 3.4Å; L33-K37 WeakPolarHBondContact O-CG 3.37Å; L33-K37 PolarHBondContact O-N 2.82Å; E35-K37 PolarHBondContact O-N 3.33Å; K37-Y42 VanDerWaalsContact CA-CD1 3.49Å; K37-Y42 HydrophobicContact CB-CD1 4.23Å; K37-Y42 HydrophobicContact CB-CE1 4.09Å; K37-Y42 HydrophobicContact CG-CD1 4.1Å; K37-Y42 HydrophobicContact CG-CD2 4.44Å; K37-Y42 HydrophobicContact CG-CE1 3.53Å; K37-Y42 HydrophobicContact CG-CE2 3.91Å; K37-Y42 VanDerWaalsContact CG-CZ 3.42Å; K37-Y42 WeakPolarHBondContact O-CD1 3.07Å; K37-Q43 PolarHBondContact O-NE2 3.48Å |
| 38 | K | 89.8 | Confident | 88.6 | Confident | 169 Ų | 169 | 103.5 Ų | 103.5 | 74% | 0.735 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.8 | -12.2 | 178.5 | -60.9 | 171.2 | -173.5 | 173.9 | 0 | 112.6 | E35 I36 | E35-K38 WeakPolarHBondContact O-CB 3.19Å; E35-K38 PolarHBondContact O-N 3.48Å; I36-K38 PolarHBondContact O-N 3.27Å; I36-K38 VanDerWaalsContact O-N 3.09Å |
| 39 | T | 91.9 | Very high | 89.2 | Confident | 46 Ų | 46 | 102.5 Ų | 102.5 | 28% | 0.282 | 49% | 0.491 | S | S | . | . | S | Bend | trans | -72.5 | 144.2 | -179.6 | 67.9 | 0 | 0 | 0 | 0 | 111.5 | I36 Q41 Y42 Q43 | I36-T39 WeakPolarHBondContact O-CB 3.33Å; I36-T39 WeakPolarHBondContact O-CG2 3.39Å; I36-T39 PolarHBondContact O-N 3Å; I36-T39 PolarHBondContact O-OG1 2.65Å; T39-Q41 PolarHBondContact O-N 3.25Å; T39-Y42 PolarHBondContact O-N 2.91Å; T39-Y42 WeakPolarHBondContact OG1-CB 3.24Å; T39-Y42 PolarHBondContact OG1-N 2.9Å; T39-Q43 PolarHBondContact O-N 3.27Å |
| 40 | P | 93.3 | Very high | 89.9 | Confident | 86 Ų | 86 | 101.9 Ų | 101.9 | 56% | 0.558 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -57.1 | -36.1 | 174.6 | -26.1 | 34.8 | 0 | 0 | 0 | 113.2 | Q43 Q44 | P40-Q43 PolarHBondContact O-N 3.21Å; P40-Q44 WeakPolarHBondContact O-CG 3.45Å; P40-Q44 PolarHBondContact O-N 2.95Å |
| 41 | Q | 92.2 | Very high | 90.6 | Very high | 123 Ų | 123 | 99.8 Ų | 99.8 | 58% | 0.575 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -63.4 | -46 | 179.6 | -65 | 81.1 | -3.3 | 0 | 0 | 111.2 | T39 Q43 Q44 V45 | T39-Q41 PolarHBondContact O-N 3.25Å; Q41-Q43 VanDerWaalsContact C-N 3.31Å; Q41-Q43 PolarHBondContact O-N 3.2Å; Q41-Q44 PolarHBondContact O-N 3.28Å; Q41-V45 WeakPolarHBondContact O-CG2 3.33Å; Q41-V45 PolarHBondContact O-N 3.09Å |
| 42 | Y | 92.9 | Very high | 90.9 | Very high | 69 Ų | 69 | 97.7 Ų | 97.7 | 27% | 0.271 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.3 | -43.6 | 175.3 | 179.2 | -86 | 0 | 0 | 0 | 111.4 | L33 I36 K37 T39 Q44 V45 R46 | L33-Y42 HydrophobicContact CD1-CE2 4.47Å; I36-Y42 HydrophobicContact CG2-CD2 3.92Å; I36-Y42 HydrophobicContact CG2-CG 4.39Å; I36-Y42 WeakPolarHBondContact O-CB 3.5Å; K37-Y42 VanDerWaalsContact CA-CD1 3.49Å; K37-Y42 HydrophobicContact CB-CD1 4.23Å; K37-Y42 HydrophobicContact CB-CE1 4.09Å; K37-Y42 HydrophobicContact CG-CD1 4.1Å; K37-Y42 HydrophobicContact CG-CD2 4.44Å; K37-Y42 HydrophobicContact CG-CE1 3.53Å; K37-Y42 HydrophobicContact CG-CE2 3.91Å; K37-Y42 VanDerWaalsContact CG-CZ 3.42Å; K37-Y42 WeakPolarHBondContact O-CD1 3.07Å; T39-Y42 PolarHBondContact O-N 2.91Å; T39-Y42 WeakPolarHBondContact OG1-CB 3.24Å; T39-Y42 PolarHBondContact OG1-N 2.9Å; Y42-Q44 PolarHBondContact O-N 3.44Å; Y42-V45 PolarHBondContact O-N 3.01Å; Y42-R46 HydrophobicContact CD1-CB 4.44Å; Y42-R46 HydrophobicContact CE1-CB 4.2Å; Y42-R46 VanDerWaalsContact O-CB 3.24Å; Y42-R46 WeakPolarHBondContact O-CB 3.36Å; Y42-R46 PolarHBondContact O-N 3.32Å |
| 43 | Q | 90.8 | Very high | 91.2 | Very high | 81 Ų | 81 | 96.4 Ų | 96.4 | 38% | 0.379 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.8 | -42.3 | 178.7 | -66.5 | -66.2 | -18.8 | 0 | 0 | 111.8 | K37 T39 P40 Q41 R46 T47 | K37-Q43 PolarHBondContact O-NE2 3.48Å; T39-Q43 PolarHBondContact O-N 3.27Å; P40-Q43 PolarHBondContact O-N 3.21Å; Q41-Q43 VanDerWaalsContact C-N 3.31Å; Q41-Q43 PolarHBondContact O-N 3.2Å; Q43-R46 PolarHBondContact O-N 3.21Å; Q43-T47 PolarHBondContact O-N 3.41Å; Q43-T47 PolarHBondContact O-OG1 2.85Å; Q43-T47 VanDerWaalsContact O-OG1 3.05Å |
| 44 | Q | 93.8 | Very high | 91.6 | Very high | 124 Ų | 124 | 95.1 Ų | 95.1 | 58% | 0.579 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -60.7 | -46.7 | 175.3 | -73.6 | 175.8 | -4.2 | 0 | 0 | 112.3 | P40 Q41 Y42 T47 K48 | P40-Q44 WeakPolarHBondContact O-CG 3.45Å; P40-Q44 PolarHBondContact O-N 2.95Å; Q41-Q44 PolarHBondContact O-N 3.28Å; Y42-Q44 PolarHBondContact O-N 3.44Å; Q44-T47 PolarHBondContact O-N 2.91Å; Q44-K48 WeakPolarHBondContact O-CG 3.33Å; Q44-K48 PolarHBondContact O-N 3.29Å; Q44-K48 VanDerWaalsContact O-N 3.09Å |
| 45 | V | 93.2 | Very high | 91.6 | Very high | 90 Ų | 90 | 94.2 Ų | 94.2 | 55% | 0.545 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.3 | -44.8 | 177.6 | 174.3 | 0 | 0 | 0 | 0 | 110.6 | Q41 Y42 T47 K48 V49 | Q41-V45 WeakPolarHBondContact O-CG2 3.33Å; Q41-V45 PolarHBondContact O-N 3.09Å; Y42-V45 PolarHBondContact O-N 3.01Å; V45-T47 VanDerWaalsContact C-N 3.35Å; V45-T47 PolarHBondContact O-N 3.35Å; V45-K48 PolarHBondContact O-N 3.31Å; V45-V49 HydrophobicContact CG1-CG2 4.39Å; V45-V49 WeakPolarHBondContact O-CG2 3.5Å; V45-V49 PolarHBondContact O-N 3.05Å |
| 46 | R | 91.7 | Very high | 91.8 | Very high | 126 Ų | 126 | 95.2 Ų | 95.2 | 48% | 0.475 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -57.4 | -46.7 | 177.6 | 179.2 | 174.4 | 179.9 | -101.8 | -2.7 | 111.6 | Y42 Q43 V49 I50 | Y42-R46 HydrophobicContact CD1-CB 4.44Å; Y42-R46 HydrophobicContact CE1-CB 4.2Å; Y42-R46 VanDerWaalsContact O-CB 3.24Å; Y42-R46 WeakPolarHBondContact O-CB 3.36Å; Y42-R46 PolarHBondContact O-N 3.32Å; Q43-R46 PolarHBondContact O-N 3.21Å; R46-V49 PolarHBondContact O-N 3.48Å; R46-I50 HydrophobicContact CG-CD1 3.81Å; R46-I50 HydrophobicContact CG-CG1 4.47Å; R46-I50 VanDerWaalsContact O-CG1 3.31Å; R46-I50 WeakPolarHBondContact O-CG1 3.45Å; R46-I50 PolarHBondContact O-N 3.41Å |
| 47 | T | 93.8 | Very high | 92 | Very high | 68 Ų | 68 | 96.6 Ų | 96.6 | 42% | 0.417 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.6 | -43.3 | 177.6 | -61 | 0 | 0 | 0 | 0 | 111.7 | Q43 Q44 V45 V49 I50 N51 | Q43-T47 PolarHBondContact O-N 3.41Å; Q43-T47 PolarHBondContact O-OG1 2.85Å; Q43-T47 VanDerWaalsContact O-OG1 3.05Å; Q44-T47 PolarHBondContact O-N 2.91Å; V45-T47 VanDerWaalsContact C-N 3.35Å; V45-T47 PolarHBondContact O-N 3.35Å; T47-V49 VanDerWaalsContact C-N 3.33Å; T47-V49 PolarHBondContact O-N 3.21Å; T47-I50 PolarHBondContact O-N 3.48Å; T47-N51 WeakPolarHBondContact O-CB 3.47Å; T47-N51 VanDerWaalsContact O-CG 3.24Å; T47-N51 PolarHBondContact O-N 2.93Å; T47-N51 PolarHBondContact O-OD1 3.37Å |
| 48 | K | 92.9 | Very high | 92.2 | Very high | 154 Ų | 154 | 96.6 Ų | 96.6 | 67% | 0.67 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -58.7 | -44.3 | 175.5 | -73.8 | 178.1 | 179.4 | -177.3 | 0 | 112.1 | Q44 V45 N51 A52 | Q44-K48 WeakPolarHBondContact O-CG 3.33Å; Q44-K48 PolarHBondContact O-N 3.29Å; Q44-K48 VanDerWaalsContact O-N 3.09Å; V45-K48 PolarHBondContact O-N 3.31Å; K48-N51 PolarHBondContact O-N 2.96Å; K48-A52 WeakPolarHBondContact O-CB 3.42Å; K48-A52 PolarHBondContact O-N 3.41Å |
| 49 | V | 93 | Very high | 92.2 | Very high | 78 Ų | 78 | 93 Ų | 93 | 47% | 0.473 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.3 | -44.1 | 178.2 | 172.3 | 0 | 0 | 0 | 0 | 111.2 | V45 R46 T47 A52 L53 | V45-V49 HydrophobicContact CG1-CG2 4.39Å; V45-V49 WeakPolarHBondContact O-CG2 3.5Å; V45-V49 PolarHBondContact O-N 3.05Å; R46-V49 PolarHBondContact O-N 3.48Å; T47-V49 VanDerWaalsContact C-N 3.33Å; T47-V49 PolarHBondContact O-N 3.21Å; V49-A52 PolarHBondContact O-N 3.09Å; V49-L53 HydrophobicContact CG1-CD1 3.82Å; V49-L53 HydrophobicContact CG1-CG 4.4Å; V49-L53 WeakPolarHBondContact O-CB 3.31Å; V49-L53 VanDerWaalsContact O-CG 3.31Å; V49-L53 WeakPolarHBondContact O-CG 3.46Å; V49-L53 PolarHBondContact O-N 3.05Å |
| 50 | I | 94 | Very high | 92.2 | Very high | 78 Ų | 78 | 97.9 Ų | 97.9 | 40% | 0.4 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.1 | -46.2 | 177.5 | -71.5 | 169.1 | 0 | 0 | 0 | 110.6 | R46 T47 A52 L53 S54 | R46-I50 HydrophobicContact CG-CD1 3.81Å; R46-I50 HydrophobicContact CG-CG1 4.47Å; R46-I50 VanDerWaalsContact O-CG1 3.31Å; R46-I50 WeakPolarHBondContact O-CG1 3.45Å; R46-I50 PolarHBondContact O-N 3.41Å; T47-I50 PolarHBondContact O-N 3.48Å; I50-A52 PolarHBondContact O-N 2.92Å; I50-L53 PolarHBondContact O-N 3.28Å; I50-S54 WeakPolarHBondContact O-CB 3.22Å; I50-S54 PolarHBondContact O-N 3.23Å |
| 51 | N | 93 | Very high | 92.1 | Very high | 92 Ų | 92 | 97 Ų | 97 | 49% | 0.492 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62 | -45.7 | 179.6 | -68.3 | -4 | 0 | 0 | 0 | 111.3 | T47 K48 L53 S54 D55 | T47-N51 WeakPolarHBondContact O-CB 3.47Å; T47-N51 VanDerWaalsContact O-CG 3.24Å; T47-N51 PolarHBondContact O-N 2.93Å; T47-N51 PolarHBondContact O-OD1 3.37Å; K48-N51 PolarHBondContact O-N 2.96Å; N51-L53 VanDerWaalsContact C-N 3.29Å; N51-L53 PolarHBondContact O-N 3.49Å; N51-S54 WeakPolarHBondContact O-CB 3.31Å; N51-S54 PolarHBondContact O-N 3.07Å; N51-S54 VanDerWaalsContact O-N 3.17Å; N51-D55 PolarHBondContact O-N 3.22Å |
| 52 | A | 90.9 | Very high | 92.1 | Very high | 65 Ų | 65 | 94.8 Ų | 94.8 | 54% | 0.537 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.9 | -34.8 | 177 | 0 | 0 | 0 | 0 | 0 | 113 | K48 V49 I50 | K48-A52 WeakPolarHBondContact O-CB 3.42Å; K48-A52 PolarHBondContact O-N 3.41Å; V49-A52 PolarHBondContact O-N 3.09Å; I50-A52 PolarHBondContact O-N 2.92Å |
| 53 | L | 92.6 | Very high | 92.1 | Very high | 90 Ų | 90 | 95 Ų | 95 | 47% | 0.471 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -74.5 | -34.6 | 174.9 | -73.2 | 171.7 | 0 | 0 | 0 | 112.2 | V49 I50 N51 K56 I57 | V49-L53 HydrophobicContact CG1-CD1 3.82Å; V49-L53 HydrophobicContact CG1-CG 4.4Å; V49-L53 WeakPolarHBondContact O-CB 3.31Å; V49-L53 VanDerWaalsContact O-CG 3.31Å; V49-L53 WeakPolarHBondContact O-CG 3.46Å; V49-L53 PolarHBondContact O-N 3.05Å; I50-L53 PolarHBondContact O-N 3.28Å; N51-L53 VanDerWaalsContact C-N 3.29Å; N51-L53 PolarHBondContact O-N 3.49Å; L53-K56 PolarHBondContact O-N 2.81Å; L53-I57 WeakPolarHBondContact O-CB 3.32Å; L53-I57 WeakPolarHBondContact O-CD1 3.39Å; L53-I57 VanDerWaalsContact O-CG1 3.22Å; L53-I57 WeakPolarHBondContact O-CG1 3.48Å; L53-I57 PolarHBondContact O-N 2.99Å |
| 54 | S | 91.4 | Very high | 92.1 | Very high | 51 Ų | 51 | 95.6 Ų | 95.6 | 36% | 0.357 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -57.5 | -52.4 | 177.4 | -163 | 0 | 0 | 0 | 0 | 110.3 | I50 N51 K56 I57 D58 | I50-S54 WeakPolarHBondContact O-CB 3.22Å; I50-S54 PolarHBondContact O-N 3.23Å; N51-S54 WeakPolarHBondContact O-CB 3.31Å; N51-S54 PolarHBondContact O-N 3.07Å; N51-S54 VanDerWaalsContact O-N 3.17Å; S54-K56 PolarHBondContact O-N 2.79Å; S54-I57 PolarHBondContact O-N 2.92Å; S54-I57 VanDerWaalsContact O-N 3.08Å; S54-D58 PolarHBondContact O-N 3.39Å |
| 55 | D | 88.4 | Confident | 91.9 | Very high | 101 Ų | 101 | 94.9 Ų | 94.9 | 54% | 0.54 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59.1 | -38.1 | 178.8 | -64.1 | -18.4 | 0 | 0 | 0 | 111.7 | N51 N59 | N51-D55 PolarHBondContact O-N 3.22Å; D55-N59 WeakPolarHBondContact O-CB 3.31Å; D55-N59 PolarHBondContact O-N 3.17Å; D55-N59 PolarHBondContact O-ND2 3.45Å |
| 56 | K | 92.6 | Very high | 91.6 | Very high | 153 Ų | 153 | 99.4 Ų | 99.4 | 67% | 0.665 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -70.1 | -38.4 | 178.7 | -167.9 | 172.7 | -176.1 | 178.6 | 0 | 112 | L53 S54 Y60 | L53-K56 PolarHBondContact O-N 2.81Å; S54-K56 PolarHBondContact O-N 2.79Å; K56-Y60 WeakPolarHBondContact O-CB 3.34Å; K56-Y60 PolarHBondContact O-N 3.48Å |
| 57 | I | 92.4 | Very high | 90.9 | Very high | 99 Ų | 99 | 100.6 Ų | 100.6 | 51% | 0.508 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.1 | -46.2 | 175.9 | -70.7 | 163.6 | 0 | 0 | 0 | 109.6 | L53 S54 N59 Y60 V61 | L53-I57 WeakPolarHBondContact O-CB 3.32Å; L53-I57 WeakPolarHBondContact O-CD1 3.39Å; L53-I57 VanDerWaalsContact O-CG1 3.22Å; L53-I57 WeakPolarHBondContact O-CG1 3.48Å; L53-I57 PolarHBondContact O-N 2.99Å; S54-I57 PolarHBondContact O-N 2.92Å; S54-I57 VanDerWaalsContact O-N 3.08Å; I57-N59 PolarHBondContact O-N 3Å; I57-Y60 WeakPolarHBondContact O-CB 3.4Å; I57-Y60 PolarHBondContact O-N 3.5Å; I57-Y60 VanDerWaalsContact O-N 3.15Å; I57-V61 HydrophobicContact CG2-CG2 4.16Å; I57-V61 WeakPolarHBondContact O-CB 3.39Å; I57-V61 VanDerWaalsContact O-CG2 3.3Å; I57-V61 WeakPolarHBondContact O-CG2 3.49Å; I57-V61 PolarHBondContact O-N 2.95Å |
| 58 | D | 91.7 | Very high | 89.3 | Confident | 85 Ų | 85 | 105.3 Ų | 105.3 | 46% | 0.455 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.6 | -45.7 | 180 | -69 | -23.7 | 0 | 0 | 0 | 111.2 | S54 Y60 V61 L62 | S54-D58 PolarHBondContact O-N 3.39Å; D58-Y60 PolarHBondContact O-N 3.19Å; D58-V61 PolarHBondContact O-N 3.43Å; D58-L62 WeakPolarHBondContact O-CB 3.45Å; D58-L62 VanDerWaalsContact O-CG 3.24Å; D58-L62 WeakPolarHBondContact O-CG 3.22Å; D58-L62 PolarHBondContact O-N 2.9Å |
| 59 | N | 90.5 | Very high | 87.4 | Confident | 95 Ų | 95 | 107.1 Ų | 107.1 | 51% | 0.508 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.1 | -43 | 174.6 | -76.2 | -52.9 | 0 | 0 | 0 | 112.3 | D55 I57 L62 D63 | D55-N59 WeakPolarHBondContact O-CB 3.31Å; D55-N59 PolarHBondContact O-N 3.17Å; D55-N59 PolarHBondContact O-ND2 3.45Å; I57-N59 PolarHBondContact O-N 3Å; N59-L62 PolarHBondContact O-N 3.43Å; N59-D63 WeakPolarHBondContact O-CB 3.24Å; N59-D63 PolarHBondContact O-N 2.97Å |
| 60 | Y | 92.1 | Very high | 87.2 | Confident | 147 Ų | 147 | 108.6 Ų | 108.6 | 58% | 0.576 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -61.1 | -47 | 176.2 | 177.8 | -96.8 | 0 | 0 | 0 | 111.4 | K56 I57 D58 D63 Q64 | K56-Y60 WeakPolarHBondContact O-CB 3.34Å; K56-Y60 PolarHBondContact O-N 3.48Å; I57-Y60 WeakPolarHBondContact O-CB 3.4Å; I57-Y60 PolarHBondContact O-N 3.5Å; I57-Y60 VanDerWaalsContact O-N 3.15Å; D58-Y60 PolarHBondContact O-N 3.19Å; Y60-D63 PolarHBondContact O-N 3.34Å; Y60-Q64 HydrophobicContact CD1-CG 4.16Å; Y60-Q64 HydrophobicContact CE1-CG 3.75Å; Y60-Q64 HydrophobicContact CE2-CG 4.4Å; Y60-Q64 VanDerWaalsContact CE2-NE2 3.33Å; Y60-Q64 VanDerWaalsContact O-CG 3.32Å; Y60-Q64 WeakPolarHBondContact O-CG 3.34Å; Y60-Q64 PolarHBondContact O-N 3.15Å; Y60-Q64 PolarHBondContact OH-NE2 2.87Å |
| 61 | V | 91.1 | Very high | 86.8 | Confident | 68 Ų | 68 | 110.2 Ų | 110.2 | 41% | 0.412 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -62.7 | -45.1 | 178.6 | 171.2 | 0 | 0 | 0 | 0 | 110.7 | I57 D58 D63 Q64 I65 | I57-V61 HydrophobicContact CG2-CG2 4.16Å; I57-V61 WeakPolarHBondContact O-CB 3.39Å; I57-V61 VanDerWaalsContact O-CG2 3.3Å; I57-V61 WeakPolarHBondContact O-CG2 3.49Å; I57-V61 PolarHBondContact O-N 2.95Å; D58-V61 PolarHBondContact O-N 3.43Å; V61-D63 VanDerWaalsContact C-N 3.32Å; V61-D63 PolarHBondContact O-N 2.8Å; V61-Q64 PolarHBondContact O-N 3.43Å; V61-I65 HydrophobicContact CG1-CD1 3.84Å; V61-I65 WeakPolarHBondContact O-CG1 3.32Å; V61-I65 PolarHBondContact O-N 3.28Å |
| 62 | L | 91.6 | Very high | 86.5 | Confident | 76 Ų | 76 | 111.2 Ų | 111.2 | 40% | 0.398 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -59.3 | -42.7 | 175.3 | -74.9 | 171.8 | 0 | 0 | 0 | 111.9 | D58 N59 I65 R66 | D58-L62 WeakPolarHBondContact O-CB 3.45Å; D58-L62 VanDerWaalsContact O-CG 3.24Å; D58-L62 WeakPolarHBondContact O-CG 3.22Å; D58-L62 PolarHBondContact O-N 2.9Å; N59-L62 PolarHBondContact O-N 3.43Å; L62-I65 PolarHBondContact O-N 2.85Å; L62-R66 WeakPolarHBondContact O-CB 3.3Å; L62-R66 VanDerWaalsContact O-CG 3.29Å; L62-R66 WeakPolarHBondContact O-CG 3.47Å; L62-R66 PolarHBondContact O-N 3.08Å |
| 63 | D | 92.3 | Very high | 86.2 | Confident | 75 Ų | 75 | 113.9 Ų | 113.9 | 40% | 0.401 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63.6 | -40.2 | 175.8 | -86.4 | 4.4 | 0 | 0 | 0 | 112.2 | N59 Y60 V61 I65 R66 K67 | N59-D63 WeakPolarHBondContact O-CB 3.24Å; N59-D63 PolarHBondContact O-N 2.97Å; Y60-D63 PolarHBondContact O-N 3.34Å; V61-D63 VanDerWaalsContact C-N 3.32Å; V61-D63 PolarHBondContact O-N 2.8Å; D63-I65 VanDerWaalsContact C-N 3.33Å; D63-R66 PolarHBondContact O-N 3.48Å; D63-K67 VanDerWaalsContact O-CB 3.31Å; D63-K67 WeakPolarHBondContact O-CB 3.49Å; D63-K67 VanDerWaalsContact O-CG 3.22Å; D63-K67 WeakPolarHBondContact O-CG 3.21Å; D63-K67 PolarHBondContact O-N 3.12Å |
| 64 | Q | 90.8 | Very high | 85.8 | Confident | 92 Ų | 92 | 115.4 Ų | 115.4 | 43% | 0.43 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -65 | -37.8 | 175.9 | -65.7 | -52.7 | -46.2 | 0 | 0 | 111.9 | Y60 V61 | Y60-Q64 HydrophobicContact CD1-CG 4.16Å; Y60-Q64 HydrophobicContact CE1-CG 3.75Å; Y60-Q64 HydrophobicContact CE2-CG 4.4Å; Y60-Q64 VanDerWaalsContact CE2-NE2 3.33Å; Y60-Q64 VanDerWaalsContact O-CG 3.32Å; Y60-Q64 WeakPolarHBondContact O-CG 3.34Å; Y60-Q64 PolarHBondContact O-N 3.15Å; Y60-Q64 PolarHBondContact OH-NE2 2.87Å; V61-Q64 PolarHBondContact O-N 3.43Å |
| 65 | I | 89.8 | Confident | 85.4 | Confident | 110 Ų | 110 | 119.7 Ų | 119.7 | 56% | 0.564 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -70.9 | -44.5 | 177.7 | -65.2 | 166.6 | 0 | 0 | 0 | 110.7 | V61 L62 D63 K67 K68 | V61-I65 HydrophobicContact CG1-CD1 3.84Å; V61-I65 WeakPolarHBondContact O-CG1 3.32Å; V61-I65 PolarHBondContact O-N 3.28Å; L62-I65 PolarHBondContact O-N 2.85Å; D63-I65 VanDerWaalsContact C-N 3.33Å; I65-K67 VanDerWaalsContact C-N 3.33Å; I65-K67 PolarHBondContact O-N 2.88Å; I65-K68 WeakPolarHBondContact O-CB 3.29Å; I65-K68 PolarHBondContact O-N 3.3Å; I65-K68 VanDerWaalsContact O-N 3.12Å |
| 66 | R | 86.9 | Confident | 85.2 | Confident | 184 Ų | 184 | 121 Ų | 121 | 69% | 0.694 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -67.9 | -29.7 | -179.8 | -73.6 | 173.8 | -179.4 | 166 | 0.3 | 113.5 | L62 D63 | L62-R66 WeakPolarHBondContact O-CB 3.3Å; L62-R66 VanDerWaalsContact O-CG 3.29Å; L62-R66 WeakPolarHBondContact O-CG 3.47Å; L62-R66 PolarHBondContact O-N 3.08Å; D63-R66 PolarHBondContact O-N 3.48Å |
| 67 | K | 76.6 | Confident | 84.6 | Confident | 152 Ų | 152 | 118.5 Ų | 118.5 | 66% | 0.661 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.9 | -9.4 | 173.9 | -74.6 | 175.2 | -177.9 | 175.6 | 0 | 113.1 | D63 I65 P69 | D63-K67 VanDerWaalsContact O-CB 3.31Å; D63-K67 WeakPolarHBondContact O-CB 3.49Å; D63-K67 VanDerWaalsContact O-CG 3.22Å; D63-K67 WeakPolarHBondContact O-CG 3.21Å; D63-K67 PolarHBondContact O-N 3.12Å; I65-K67 VanDerWaalsContact C-N 3.33Å; I65-K67 PolarHBondContact O-N 2.88Å; K67-P69 WeakPolarHBondContact O-CD 3.4Å |
| 68 | K | 60.3 | Low | 84 | Confident | 167 Ų | 167 | 120.2 Ų | 120.2 | 73% | 0.726 | 59% | 0.589 | S | S | * | * | trans | -68.6 | 121.9 | 175.1 | -159.8 | 174.1 | -178.5 | 180 | 0 | 107.9 | I65 | I65-K68 WeakPolarHBondContact O-CB 3.29Å; I65-K68 PolarHBondContact O-N 3.3Å; I65-K68 VanDerWaalsContact O-N 3.12Å | ||
| 69 | P | 54.3 | Low | 83.3 | Confident | 191 Ų | 191 | 123.4 Ų | 123.4 | 100% | 1.24 | 60% | 0.601 | S | S | * | * | trans | -63.8 | 0 | -176.1 | 27.9 | -36 | 0 | 0 | 0 | 112.8 | K67 | K67-P69 WeakPolarHBondContact O-CD 3.4Š|
Retrieved 69 of 69 residues in 57.5 ms
(Link to these results)