| 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 | 34.1 | Very low | 51 | Low | 228 Ų | 228 | 118.6 Ų | 118.6 | 100% | 1.123 | 66% | 0.663 | S | S | * | * | 0 | 110.2 | 0 | -81.2 | 162.1 | 153.5 | 0 | 0 | 107.4 | N3 | M1-N3 PolarHBondContact O-N 2.97Š| |||
| 2 | V | 40.8 | Very low | 51.9 | Low | 114 Ų | 114 | 114.3 Ų | 114.3 | 69% | 0.691 | 65% | 0.654 | S | S | * | * | trans | -76.3 | 114.9 | 173.7 | -82.9 | 0 | 0 | 0 | 0 | 107.3 | L4 | V2-L4 VanDerWaalsContact C-N 3.31Å; V2-L4 HydrophobicContact CG2-CD1 4.23Å; V2-L4 PolarHBondContact O-N 3.07Å | ||
| 3 | N | 37.3 | Very low | 52.7 | Low | 151 Ų | 151 | 111.1 Ų | 111.1 | 81% | 0.807 | 63% | 0.633 | S | S | * | * | trans | -69.1 | 90.6 | 172.9 | -77.9 | -76.8 | 0 | 0 | 0 | 107.7 | M1 G5 | M1-N3 PolarHBondContact O-N 2.97Å; N3-G5 PolarHBondContact O-N 3.16Å | ||
| 4 | L | 53.3 | Low | 53.4 | Low | 103 Ų | 103 | 105.1 Ų | 105.1 | 54% | 0.539 | 60% | 0.604 | S | S | . | * | trans | -64.6 | 118.8 | 156.3 | -84.5 | 88.7 | 0 | 0 | 0 | 105.8 | V2 L6 | V2-L4 VanDerWaalsContact C-N 3.31Å; V2-L4 HydrophobicContact CG2-CD1 4.23Å; V2-L4 PolarHBondContact O-N 3.07Å; L4-L6 PolarHBondContact O-N 2.92Å | ||
| 5 | G | 52.9 | Low | 53.8 | Low | 80 Ų | 80 | 103.9 Ų | 103.9 | 83% | 0.825 | 61% | 0.612 | S | S | * | * | S | Bend | trans | -70.6 | 46 | -177 | 0 | 0 | 0 | 0 | 0 | 114.1 | N3 | N3-G5 PolarHBondContact O-N 3.16Š|
| 6 | L | 49.7 | Very low | 54.5 | Low | 89 Ų | 89 | 107.7 Ų | 107.7 | 47% | 0.466 | 62% | 0.618 | S | S | . | * | trans | -127.6 | 19 | -171.8 | -83.8 | 161.5 | 0 | 0 | 0 | 113 | L4 K8 V9 D10 | L4-L6 PolarHBondContact O-N 2.92Å; L6-K8 PolarHBondContact O-N 3.37Å; L6-V9 HydrophobicContact CD2-CB 4.49Å; L6-V9 PolarHBondContact O-N 2.98Å; L6-D10 WeakPolarHBondContact CB-OD2 3.35Å; L6-D10 PolarHBondContact O-N 3.22Å | ||
| 7 | T | 56.6 | Low | 55 | Low | 91 Ų | 91 | 104.7 Ų | 104.7 | 56% | 0.558 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -46.6 | -38.5 | -170.9 | 49.3 | 0 | 0 | 0 | 0 | 115.4 | D11 | T7-D11 VanDerWaalsContact O-CG 3.23Å; T7-D11 PolarHBondContact O-N 2.92Å |
| 8 | K | 53.8 | Low | 55.4 | Low | 183 Ų | 183 | 104.1 Ų | 104.1 | 80% | 0.796 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -77.3 | -32.8 | -178 | -73.9 | -88.7 | -175.6 | 169.6 | 0 | 114.2 | L6 | L6-K8 PolarHBondContact O-N 3.37Å |
| 9 | V | 57.8 | Low | 56.1 | Low | 91 Ų | 91 | 98.6 Ų | 98.6 | 55% | 0.552 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -84.2 | -38.9 | -178.8 | -179.2 | 0 | 0 | 0 | 0 | 109.5 | L6 D11 A12 L13 | L6-V9 HydrophobicContact CD2-CB 4.49Å; L6-V9 PolarHBondContact O-N 2.98Å; V9-D11 PolarHBondContact O-N 3.46Å; V9-A12 PolarHBondContact O-N 3.15Å; V9-L13 WeakPolarHBondContact O-CB 3.48Å; V9-L13 PolarHBondContact O-N 3.46Å |
| 10 | D | 63.4 | Low | 56.6 | Low | 54 Ų | 54 | 96 Ų | 96 | 29% | 0.289 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -61.2 | -40.5 | 175.2 | -79.3 | -53.4 | 0 | 0 | 0 | 112 | L6 A12 L13 A14 | L6-D10 WeakPolarHBondContact CB-OD2 3.35Å; L6-D10 PolarHBondContact O-N 3.22Å; D10-A12 PolarHBondContact O-N 2.93Å; D10-L13 PolarHBondContact O-N 3.05Å; D10-A14 WeakPolarHBondContact O-CA 3.34Å; D10-A14 WeakPolarHBondContact O-CB 3.43Å; D10-A14 PolarHBondContact O-N 3.01Å |
| 11 | D | 61.3 | Low | 57.3 | Low | 121 Ų | 121 | 98.7 Ų | 98.7 | 65% | 0.647 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -67.6 | -39.1 | -179.8 | -73.5 | -25.3 | 0 | 0 | 0 | 112.8 | T7 V9 A15 | T7-D11 VanDerWaalsContact O-CG 3.23Å; T7-D11 PolarHBondContact O-N 2.92Å; V9-D11 PolarHBondContact O-N 3.46Å; D11-A15 WeakPolarHBondContact O-CB 3.47Å; D11-A15 PolarHBondContact O-N 3.35Å |
| 12 | A | 62.2 | Low | 59 | Low | 67 Ų | 67 | 93 Ų | 93 | 55% | 0.554 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -73.2 | -31.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | V9 D10 | V9-A12 PolarHBondContact O-N 3.15Å; D10-A12 PolarHBondContact O-N 2.93Å |
| 13 | L | 62.4 | Low | 60.4 | Low | 72 Ų | 72 | 90.8 Ų | 90.8 | 38% | 0.377 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -84 | -37 | 179 | -166.2 | 65.2 | 0 | 0 | 0 | 112.1 | V9 D10 A15 K16 H17 L20 | V9-L13 WeakPolarHBondContact O-CB 3.48Å; V9-L13 PolarHBondContact O-N 3.46Å; D10-L13 PolarHBondContact O-N 3.05Å; L13-A15 VanDerWaalsContact C-N 3.26Å; L13-A15 PolarHBondContact O-N 3.16Å; L13-K16 CarbonylContact O-C 3.59Å; L13-K16 WeakPolarHBondContact O-CA 3.32Å; L13-K16 PolarHBondContact O-N 3.24Å; L13-H17 PolarHBondContact O-N 2.91Å; L13-L20 HydrophobicContact CD2-CD1 3.89Å; L13-L20 HydrophobicContact CG-CD1 3.93Å |
| 14 | A | 61.4 | Low | 62.2 | Low | 28 Ų | 28 | 86.1 Ų | 86.1 | 23% | 0.231 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -64.6 | -31.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | D10 K16 H17 | D10-A14 WeakPolarHBondContact O-CA 3.34Å; D10-A14 WeakPolarHBondContact O-CB 3.43Å; D10-A14 PolarHBondContact O-N 3.01Å; A14-K16 PolarHBondContact O-N 2.94Å; A14-H17 CarbonylContact O-C 3.3Å; A14-H17 VanDerWaalsContact O-C 3.3Å; A14-H17 PolarHBondContact O-N 3.49Å |
| 15 | A | 60.1 | Low | 63.3 | Low | 87 Ų | 87 | 84 Ų | 84 | 72% | 0.719 | 49% | 0.489 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.7 | -28 | 171 | 0 | 0 | 0 | 0 | 0 | 113 | D11 L13 | D11-A15 WeakPolarHBondContact O-CB 3.47Å; D11-A15 PolarHBondContact O-N 3.35Å; L13-A15 VanDerWaalsContact C-N 3.26Å; L13-A15 PolarHBondContact O-N 3.16Å |
| 16 | K | 65.1 | Low | 64.5 | Low | 164 Ų | 164 | 82.2 Ų | 82.2 | 71% | 0.713 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.3 | -30.2 | 175.1 | -71.4 | -173.9 | 176.6 | 177.5 | 0 | 113.1 | L13 A14 | L13-K16 CarbonylContact O-C 3.59Å; L13-K16 WeakPolarHBondContact O-CA 3.32Å; L13-K16 PolarHBondContact O-N 3.24Å; A14-K16 PolarHBondContact O-N 2.94Å |
| 17 | H | 62.9 | Low | 65.8 | Low | 57 Ų | 57 | 82.3 Ų | 82.3 | 26% | 0.264 | 46% | 0.461 | S | S | . | . | trans | -129.8 | 88.3 | -177.1 | -59.6 | -72.3 | 0 | 0 | 0 | 110.4 | L13 A14 G19 L20 E94 | L13-H17 PolarHBondContact O-N 2.91Å; A14-H17 CarbonylContact O-C 3.3Å; A14-H17 VanDerWaalsContact O-C 3.3Å; A14-H17 PolarHBondContact O-N 3.49Å; H17-G19 PolarHBondContact O-N 2.92Å; H17-L20 HydrophobicContact CB-CD1 4.12Å; H17-L20 PolarHBondContact O-N 3.38Å; H17-L20 VanDerWaalsContact O-N 3.14Å; H17-E94 IonicContact CE1-OE1 2.74Å; H17-E94 PolarHBondContact CE1-OE1 3.49Å; H17-E94 IonicContact CG-OE1 3.44Å; H17-E94 IonicContact ND1-OE1 3.67Å; H17-E94 PolarHBondContact ND1-OE1 3.14Å; H17-E94 IonicContact ND1-OE2 3.78Å | ||
| 18 | P | 62.9 | Low | 66.9 | Low | 93 Ų | 93 | 80.6 Ų | 80.6 | 60% | 0.604 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.4 | -16.6 | -177.5 | 25.1 | -34 | 0 | 0 | 0 | 113.4 | L20 | P18-L20 VanDerWaalsContact C-N 3.34Å; P18-L20 PolarHBondContact O-N 2.88Å |
| 19 | G | 67 | Low | 68.1 | Low | 1 Ų | 1 | 77.4 Ų | 77.4 | 1% | 0.01 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -71.7 | -20.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | H17 Q21 Q22 Y23 | H17-G19 PolarHBondContact O-N 2.92Å; G19-Q21 PolarHBondContact O-N 3.5Å; G19-Q22 PolarHBondContact O-N 3.48Å; G19-Y23 WeakPolarHBondContact O-CB 3.42Å; G19-Y23 PolarHBondContact O-N 3.23Å |
| 20 | L | 67 | Low | 69.2 | Low | 45 Ų | 45 | 73.1 Ų | 73.1 | 24% | 0.236 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -65.1 | -39.7 | -177.4 | -114.3 | 152.9 | 0 | 0 | 0 | 112.2 | L13 H17 P18 Y23 A24 | L13-L20 HydrophobicContact CD2-CD1 3.89Å; L13-L20 HydrophobicContact CG-CD1 3.93Å; H17-L20 HydrophobicContact CB-CD1 4.12Å; H17-L20 PolarHBondContact O-N 3.38Å; H17-L20 VanDerWaalsContact O-N 3.14Å; P18-L20 VanDerWaalsContact C-N 3.34Å; P18-L20 PolarHBondContact O-N 2.88Å; L20-Y23 PolarHBondContact O-N 3.41Å; L20-A24 WeakPolarHBondContact O-CB 3.34Å; L20-A24 PolarHBondContact O-N 3.42Å |
| 21 | Q | 70.3 | Confident | 69.8 | Low | 153 Ų | 153 | 76.8 Ų | 76.8 | 72% | 0.715 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -67.9 | -38.3 | 177.2 | -165.9 | -177.8 | -1.6 | 0 | 0 | 111.7 | G19 A24 A25 | G19-Q21 PolarHBondContact O-N 3.5Å; Q21-A24 PolarHBondContact O-N 3.16Å; Q21-A25 WeakPolarHBondContact O-CB 3.5Å; Q21-A25 PolarHBondContact O-N 2.94Å |
| 22 | Q | 70.3 | Confident | 71 | Confident | 109 Ų | 109 | 77.1 Ų | 77.1 | 51% | 0.509 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -68 | -39.3 | 175.3 | -66.1 | -156.2 | -5.2 | 0 | 0 | 111.9 | G19 A25 C26 | G19-Q22 PolarHBondContact O-N 3.48Å; Q22-A25 PolarHBondContact O-N 3.22Å; Q22-C26 VanDerWaalsContact O-CB 3.25Å; Q22-C26 WeakPolarHBondContact O-CB 3.14Å; Q22-C26 PolarHBondContact O-N 2.83Å |
| 23 | Y | 70.1 | Confident | 72.1 | Confident | 67 Ų | 67 | 77.9 Ų | 77.9 | 26% | 0.263 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.6 | -47.2 | 173.6 | 176.8 | -100.7 | 0 | 0 | 0 | 111.7 | G19 L20 A25 C26 Q27 C86 W90 | G19-Y23 WeakPolarHBondContact O-CB 3.42Å; G19-Y23 PolarHBondContact O-N 3.23Å; L20-Y23 PolarHBondContact O-N 3.41Å; Y23-A25 PolarHBondContact O-N 3.4Å; Y23-C26 CarbonylContact O-C 3.6Å; Y23-C26 PolarHBondContact O-N 3.4Å; Y23-Q27 WeakPolarHBondContact O-CB 3.32Å; Y23-Q27 PolarHBondContact O-N 3Å; Y23-C86 HydrophobicContact CD2-CB 4.19Å; Y23-C86 HydrophobicContact CE2-CB 4.28Å; Y23-W90 HydrophobicContact CD2-CB 4.38Å |
| 24 | A | 75.1 | Confident | 73 | Confident | 53 Ų | 53 | 74.6 Ų | 74.6 | 44% | 0.438 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -62 | -42.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | L20 Q21 Q27 S28 | L20-A24 WeakPolarHBondContact O-CB 3.34Å; L20-A24 PolarHBondContact O-N 3.42Å; Q21-A24 PolarHBondContact O-N 3.16Å; A24-Q27 PolarHBondContact O-N 2.98Å; A24-S28 PolarHBondContact O-N 2.94Å |
| 25 | A | 77 | Confident | 74.1 | Confident | 60 Ų | 60 | 76 Ų | 76 | 50% | 0.496 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -61.1 | -45.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q21 Q22 Y23 S28 H29 | Q21-A25 WeakPolarHBondContact O-CB 3.5Å; Q21-A25 PolarHBondContact O-N 2.94Å; Q22-A25 PolarHBondContact O-N 3.22Å; Y23-A25 PolarHBondContact O-N 3.4Å; A25-S28 PolarHBondContact O-N 3.49Å; A25-S28 PolarHBondContact O-OG 3.47Å; A25-H29 PolarHBondContact O-N 3.31Å; A25-H29 VanDerWaalsContact O-N 3.17Å |
| 26 | C | 78 | Confident | 75.5 | Confident | 41 Ų | 41 | 74.1 Ų | 74.1 | 28% | 0.277 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -65.9 | -39.6 | 179.5 | -166 | 0 | 0 | 0 | 0 | 112.6 | Q22 Y23 S28 H29 A30 C86 | Q22-C26 VanDerWaalsContact O-CB 3.25Å; Q22-C26 WeakPolarHBondContact O-CB 3.14Å; Q22-C26 PolarHBondContact O-N 2.83Å; Y23-C26 CarbonylContact O-C 3.6Å; Y23-C26 PolarHBondContact O-N 3.4Å; C26-S28 VanDerWaalsContact C-N 3.33Å; C26-S28 PolarHBondContact O-N 3.01Å; C26-H29 PolarHBondContact O-N 3.27Å; C26-A30 WeakPolarHBondContact O-CB 3.42Å; C26-A30 PolarHBondContact O-N 2.9Å; C26-C86 HydrophobicContact CB-CB 3.59Å; C26-C86 WeakPolarHBondContact CB-SG 3.28Å; C26-C86 PolarHBondContact O-SG 3.35Å; C26-C86 VanDerWaalsContact O-SG 3.37Å; C26-C86 WeakPolarHBondContact SG-CA 3.25Å; C26-C86 WeakPolarHBondContact SG-CB 3.02Å; C26-C86 CovalentContact SG-SG 2.02Å; C26-C86 PolarHBondContact SG-SG 3.07Å |
| 27 | Q | 77.9 | Confident | 76.5 | Confident | 91 Ų | 91 | 68.5 Ų | 68.5 | 43% | 0.425 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -60.7 | -42 | 175.9 | -176.8 | -180 | -6.4 | 0 | 0 | 111.8 | Y23 A24 H29 A30 F31 | Y23-Q27 WeakPolarHBondContact O-CB 3.32Å; Y23-Q27 PolarHBondContact O-N 3Å; A24-Q27 PolarHBondContact O-N 2.98Å; Q27-H29 VanDerWaalsContact C-N 3.33Å; Q27-H29 PolarHBondContact O-N 3.17Å; Q27-A30 PolarHBondContact O-N 3.48Å; Q27-F31 WeakPolarHBondContact O-CB 3.17Å; Q27-F31 PolarHBondContact O-N 3.3Å |
| 28 | S | 78.4 | Confident | 77.6 | Confident | 55 Ų | 55 | 69.2 Ų | 69.2 | 39% | 0.385 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -65.8 | -37.1 | 176.8 | 76.8 | 0 | 0 | 0 | 0 | 112.2 | A24 A25 C26 F31 M32 | A24-S28 PolarHBondContact O-N 2.94Å; A25-S28 PolarHBondContact O-N 3.49Å; A25-S28 PolarHBondContact O-OG 3.47Å; C26-S28 VanDerWaalsContact C-N 3.33Å; C26-S28 PolarHBondContact O-N 3.01Å; S28-F31 PolarHBondContact O-N 3.41Å; S28-M32 WeakPolarHBondContact O-CG 3.33Å; S28-M32 PolarHBondContact O-N 3.4Å |
| 29 | H | 80.3 | Confident | 78.9 | Confident | 116 Ų | 116 | 70.1 Ų | 70.1 | 54% | 0.537 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -69.4 | -42.6 | 176.3 | -174.7 | -96.3 | 0 | 0 | 0 | 111.8 | A25 C26 Q27 F31 M32 K33 | A25-H29 PolarHBondContact O-N 3.31Å; A25-H29 VanDerWaalsContact O-N 3.17Å; C26-H29 PolarHBondContact O-N 3.27Å; Q27-H29 VanDerWaalsContact C-N 3.33Å; Q27-H29 PolarHBondContact O-N 3.17Å; H29-F31 VanDerWaalsContact C-N 3.32Å; H29-F31 PolarHBondContact O-N 2.94Å; H29-M32 PolarHBondContact O-N 2.66Å; H29-K33 WeakPolarHBondContact O-CB 3.34Å; H29-K33 PolarHBondContact O-N 3.5Å |
| 30 | A | 79.1 | Confident | 80 | Confident | 1 Ų | 1 | 76 Ų | 76 | 1% | 0.008 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -59.6 | -42.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | C26 Q27 K33 G34 E82 T83 | C26-A30 WeakPolarHBondContact O-CB 3.42Å; C26-A30 PolarHBondContact O-N 2.9Å; Q27-A30 PolarHBondContact O-N 3.48Å; A30-K33 PolarHBondContact O-N 2.83Å; A30-G34 PolarHBondContact O-N 3.49Å; A30-E82 HydrophobicContact CB-CB 3.64Å; A30-T83 HydrophobicContact CB-CG2 3.92Å |
| 31 | F | 77.7 | Confident | 81 | Confident | 131 Ų | 131 | 75.1 Ų | 75.1 | 58% | 0.575 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -64.1 | -46.4 | 175.3 | -179.1 | -99.4 | 0 | 0 | 0 | 112.5 | Q27 S28 H29 K33 G34 T35 | Q27-F31 WeakPolarHBondContact O-CB 3.17Å; Q27-F31 PolarHBondContact O-N 3.3Å; S28-F31 PolarHBondContact O-N 3.41Å; H29-F31 VanDerWaalsContact C-N 3.32Å; H29-F31 PolarHBondContact O-N 2.94Å; F31-K33 VanDerWaalsContact C-N 3.29Å; F31-K33 PolarHBondContact O-N 3.46Å; F31-G34 PolarHBondContact O-N 2.88Å; F31-T35 HydrophobicContact CD1-CG2 4.39Å; F31-T35 HydrophobicContact CE1-CG2 3.92Å; F31-T35 HydrophobicContact CE2-CG2 4.26Å; F31-T35 HydrophobicContact CZ-CG2 3.85Å; F31-T35 PolarHBondContact O-N 3.31Å; F31-T35 PolarHBondContact O-OG1 2.94Å |
| 32 | M | 85.6 | Confident | 81.8 | Confident | 128 Ų | 128 | 69.3 Ų | 69.3 | 63% | 0.631 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -62 | -37.9 | 176.2 | -72.5 | -133.4 | -58.6 | 0 | 0 | 112.5 | S28 H29 T35 A36 | S28-M32 WeakPolarHBondContact O-CG 3.33Å; S28-M32 PolarHBondContact O-N 3.4Å; H29-M32 PolarHBondContact O-N 2.66Å; M32-T35 PolarHBondContact O-OG1 3.49Å; M32-A36 VanDerWaalsContact O-CB 3.3Å; M32-A36 WeakPolarHBondContact O-CB 3.3Å; M32-A36 PolarHBondContact O-N 2.91Å |
| 33 | K | 85.3 | Confident | 82.6 | Confident | 84 Ų | 84 | 66.9 Ų | 66.9 | 37% | 0.365 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -65.5 | -42.8 | 175.5 | -171.8 | 168.8 | 175.4 | -175.5 | 0 | 111.1 | H29 A30 F31 A36 T37 E82 | H29-K33 WeakPolarHBondContact O-CB 3.34Å; H29-K33 PolarHBondContact O-N 3.5Å; A30-K33 PolarHBondContact O-N 2.83Å; F31-K33 VanDerWaalsContact C-N 3.29Å; F31-K33 PolarHBondContact O-N 3.46Å; K33-A36 PolarHBondContact O-N 3.42Å; K33-T37 WeakPolarHBondContact O-CG2 3.23Å; K33-T37 PolarHBondContact O-N 3.38Å; K33-T37 PolarHBondContact O-OG1 3.24Å; K33-E82 HydrophobicContact CD-CG 3.99Å; K33-E82 VanDerWaalsContact NZ-CD 3.34Å; K33-E82 IonicContact NZ-OE1 3.91Å; K33-E82 PolarHBondContact NZ-OE1 2.98Å; K33-E82 IonicContact NZ-OE2 2.71Å |
| 34 | G | 82.1 | Confident | 83.5 | Confident | 2 Ų | 2 | 65 Ų | 65 | 2% | 0.021 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -57.5 | -49.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | A30 F31 T37 F38 T79 | A30-G34 PolarHBondContact O-N 3.49Å; F31-G34 PolarHBondContact O-N 2.88Å; G34-T37 WeakPolarHBondContact CA-OG1 3.42Å; G34-T37 PolarHBondContact O-N 2.87Å; G34-T37 PolarHBondContact O-OG1 2.97Å; G34-F38 PolarHBondContact O-N 3.05Å; G34-T79 VanDerWaalsContact CA-OG1 3.26Å; G34-T79 WeakPolarHBondContact CA-OG1 3.48Å |
| 35 | T | 85.1 | Confident | 84 | Confident | 59 Ų | 59 | 65.4 Ų | 65.4 | 36% | 0.362 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -66.4 | -38.2 | 178.4 | 56.2 | 0 | 0 | 0 | 0 | 112.2 | F31 M32 F38 I39 | F31-T35 HydrophobicContact CD1-CG2 4.39Å; F31-T35 HydrophobicContact CE1-CG2 3.92Å; F31-T35 HydrophobicContact CE2-CG2 4.26Å; F31-T35 HydrophobicContact CZ-CG2 3.85Å; F31-T35 PolarHBondContact O-N 3.31Å; F31-T35 PolarHBondContact O-OG1 2.94Å; M32-T35 PolarHBondContact O-OG1 3.49Å; T35-F38 WeakPolarHBondContact O-CB 3.4Å; T35-F38 PolarHBondContact O-N 2.71Å; T35-I39 WeakPolarHBondContact O-CG1 3.24Å; T35-I39 PolarHBondContact O-N 2.81Å; T35-I39 VanDerWaalsContact O-N 3.11Å |
| 36 | A | 88.4 | Confident | 84.4 | Confident | 46 Ų | 46 | 65.9 Ų | 65.9 | 38% | 0.38 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -61.5 | -44.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | M32 K33 F38 I39 L40 | M32-A36 VanDerWaalsContact O-CB 3.3Å; M32-A36 WeakPolarHBondContact O-CB 3.3Å; M32-A36 PolarHBondContact O-N 2.91Å; K33-A36 PolarHBondContact O-N 3.42Å; A36-F38 VanDerWaalsContact C-N 3.29Å; A36-F38 PolarHBondContact O-N 2.88Å; A36-I39 PolarHBondContact O-N 3.45Å; A36-L40 WeakPolarHBondContact O-CB 3.39Å; A36-L40 WeakPolarHBondContact O-CG 3.2Å; A36-L40 PolarHBondContact O-N 3.09Å |
| 37 | T | 86.1 | Confident | 84.8 | Confident | 46 Ų | 46 | 69.2 Ų | 69.2 | 28% | 0.282 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -65.4 | -31.4 | 176.1 | 53 | 0 | 0 | 0 | 0 | 113 | K33 G34 G41 V78 | K33-T37 WeakPolarHBondContact O-CG2 3.23Å; K33-T37 PolarHBondContact O-N 3.38Å; K33-T37 PolarHBondContact O-OG1 3.24Å; G34-T37 WeakPolarHBondContact CA-OG1 3.42Å; G34-T37 PolarHBondContact O-N 2.87Å; G34-T37 PolarHBondContact O-OG1 2.97Å; T37-G41 WeakPolarHBondContact O-CA 3.39Å; T37-G41 PolarHBondContact O-N 3.49Å; T37-V78 HydrophobicContact CG2-CG1 4.21Å |
| 38 | F | 86.4 | Confident | 85.1 | Confident | 72 Ų | 72 | 69.8 Ų | 69.8 | 32% | 0.316 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -64.8 | -48.8 | 174.5 | -178.2 | -107.8 | 0 | 0 | 0 | 112.1 | G34 T35 A36 G41 T42 T68 S71 S75 | G34-F38 PolarHBondContact O-N 3.05Å; T35-F38 WeakPolarHBondContact O-CB 3.4Å; T35-F38 PolarHBondContact O-N 2.71Å; A36-F38 VanDerWaalsContact C-N 3.29Å; A36-F38 PolarHBondContact O-N 2.88Å; F38-G41 PolarHBondContact O-N 3.49Å; F38-T42 WeakPolarHBondContact O-CB 3.44Å; F38-T42 PolarHBondContact O-N 3.24Å; F38-T42 PolarHBondContact O-OG1 3.41Å; F38-T68 HydrophobicContact CZ-CG2 4.28Å; F38-S71 VanDerWaalsContact CD2-OG 3.23Å; F38-S71 WeakPolarHBondContact CD2-OG 3.11Å; F38-S71 PolarHBondContact O-OG 2.92Å; F38-S75 WeakPolarHBondContact CA-OG 3.39Å; F38-S75 WeakPolarHBondContact CB-OG 3.3Å; F38-S75 PolarHBondContact N-OG 3.06Å; F38-S75 VanDerWaalsContact N-OG 3.15Å |
| 39 | I | 89.7 | Confident | 85.3 | Confident | 113 Ų | 113 | 68.4 Ų | 68.4 | 58% | 0.579 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -65.1 | -46.4 | -178.4 | -64.7 | 167.7 | 0 | 0 | 0 | 110.3 | T35 A36 S43 | T35-I39 WeakPolarHBondContact O-CG1 3.24Å; T35-I39 PolarHBondContact O-N 2.81Å; T35-I39 VanDerWaalsContact O-N 3.11Å; A36-I39 PolarHBondContact O-N 3.45Å; I39-S43 WeakPolarHBondContact O-CB 3.36Å; I39-S43 PolarHBondContact O-N 2.77Å; I39-S43 VanDerWaalsContact O-N 3.14Å; I39-S43 PolarHBondContact O-OG 3.05Å |
| 40 | L | 90.3 | Very high | 85.3 | Confident | 125 Ų | 125 | 68.9 Ų | 68.9 | 65% | 0.654 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -67.9 | -38.1 | 178 | -67.8 | 175.6 | 0 | 0 | 0 | 112.3 | A36 S43 G44 | A36-L40 WeakPolarHBondContact O-CB 3.39Å; A36-L40 WeakPolarHBondContact O-CG 3.2Å; A36-L40 PolarHBondContact O-N 3.09Å; L40-S43 WeakPolarHBondContact CA-OG 3.28Å; L40-S43 PolarHBondContact O-OG 2.89Å; L40-S43 VanDerWaalsContact O-OG 3.05Å; L40-G44 PolarHBondContact O-N 3.03Å |
| 41 | G | 88.1 | Confident | 85.6 | Confident | 26 Ų | 26 | 73.6 Ų | 73.6 | 27% | 0.268 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -64.6 | -48.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | T37 F38 S43 G44 L45 | T37-G41 WeakPolarHBondContact O-CA 3.39Å; T37-G41 PolarHBondContact O-N 3.49Å; F38-G41 PolarHBondContact O-N 3.49Å; G41-S43 PolarHBondContact O-N 2.91Å; G41-G44 PolarHBondContact O-N 3.46Å; G41-L45 VanDerWaalsContact O-CB 3.3Å; G41-L45 WeakPolarHBondContact O-CB 3.35Å; G41-L45 VanDerWaalsContact O-CG 3.32Å; G41-L45 WeakPolarHBondContact O-CG 3.45Å; G41-L45 PolarHBondContact O-N 2.72Å |
| 42 | T | 87.6 | Confident | 85.7 | Confident | 31 Ų | 31 | 71.8 Ų | 71.8 | 19% | 0.19 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -64.1 | -43.4 | 179.8 | -55.4 | 0 | 0 | 0 | 0 | 111.3 | F38 F46 S67 S71 | F38-T42 WeakPolarHBondContact O-CB 3.44Å; F38-T42 PolarHBondContact O-N 3.24Å; F38-T42 PolarHBondContact O-OG1 3.41Å; T42-F46 VanDerWaalsContact O-CB 3.23Å; T42-F46 WeakPolarHBondContact O-CB 3.44Å; T42-F46 PolarHBondContact O-N 3.23Å; T42-S67 PolarHBondContact O-OG 3.41Å; T42-S67 VanDerWaalsContact O-OG 3.09Å; T42-S71 PolarHBondContact N-OG 3.33Å; T42-S71 WeakPolarHBondContact OG1-CB 3.38Å; T42-S71 PolarHBondContact OG1-OG 2.68Å |
| 43 | S | 87.2 | Confident | 85.2 | Confident | 58 Ų | 58 | 68 Ų | 68 | 41% | 0.406 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -67.9 | -43.8 | 178.5 | 55.8 | 0 | 0 | 0 | 0 | 112.3 | I39 L40 G41 F46 L47 | I39-S43 WeakPolarHBondContact O-CB 3.36Å; I39-S43 PolarHBondContact O-N 2.77Å; I39-S43 VanDerWaalsContact O-N 3.14Å; I39-S43 PolarHBondContact O-OG 3.05Å; L40-S43 WeakPolarHBondContact CA-OG 3.28Å; L40-S43 PolarHBondContact O-OG 2.89Å; L40-S43 VanDerWaalsContact O-OG 3.05Å; G41-S43 PolarHBondContact O-N 2.91Å; S43-F46 PolarHBondContact O-N 3.25Å; S43-L47 WeakPolarHBondContact O-CG 3.23Å; S43-L47 PolarHBondContact O-N 3.05Å; S43-L47 VanDerWaalsContact O-N 3.07Å |
| 44 | G | 88.2 | Confident | 84.8 | Confident | 28 Ų | 28 | 72.8 Ų | 72.8 | 29% | 0.289 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -61.1 | -50.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L40 G41 F46 L47 I48 | L40-G44 PolarHBondContact O-N 3.03Å; G41-G44 PolarHBondContact O-N 3.46Å; G44-F46 VanDerWaalsContact C-N 3.31Å; G44-F46 PolarHBondContact O-N 3.09Å; G44-L47 PolarHBondContact O-N 2.8Å; G44-I48 WeakPolarHBondContact O-CG1 3.4Å; G44-I48 PolarHBondContact O-N 3.39Å |
| 45 | L | 86.2 | Confident | 84.5 | Confident | 61 Ų | 61 | 83.5 Ų | 83.5 | 32% | 0.319 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -61.4 | -39.6 | 177.8 | -75.6 | 171.1 | 0 | 0 | 0 | 111.9 | G41 I48 Q49 S67 A70 | G41-L45 VanDerWaalsContact O-CB 3.3Å; G41-L45 WeakPolarHBondContact O-CB 3.35Å; G41-L45 VanDerWaalsContact O-CG 3.32Å; G41-L45 WeakPolarHBondContact O-CG 3.45Å; G41-L45 PolarHBondContact O-N 2.72Å; L45-I48 PolarHBondContact O-N 3.14Å; L45-Q49 WeakPolarHBondContact O-CB 3.08Å; L45-Q49 WeakPolarHBondContact O-CG 3.36Å; L45-Q49 PolarHBondContact O-N 2.92Å; L45-S67 WeakPolarHBondContact CB-OG 3.11Å; L45-A70 HydrophobicContact CD1-CB 3.94Å |
| 46 | F | 84.2 | Confident | 83.8 | Confident | 70 Ų | 70 | 85.8 Ų | 85.8 | 31% | 0.307 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -64.2 | -41.2 | 177.5 | -176.6 | -103.2 | 0 | 0 | 0 | 112.6 | T42 S43 G44 Q49 K50 L60 | T42-F46 VanDerWaalsContact O-CB 3.23Å; T42-F46 WeakPolarHBondContact O-CB 3.44Å; T42-F46 PolarHBondContact O-N 3.23Å; S43-F46 PolarHBondContact O-N 3.25Å; G44-F46 VanDerWaalsContact C-N 3.31Å; G44-F46 PolarHBondContact O-N 3.09Å; F46-Q49 PolarHBondContact O-N 2.97Å; F46-K50 WeakPolarHBondContact O-CB 3.3Å; F46-K50 PolarHBondContact O-N 3.24Å; F46-L60 HydrophobicContact CE2-CD2 4.4Å |
| 47 | L | 86.8 | Confident | 82.8 | Confident | 111 Ų | 111 | 89.6 Ų | 89.6 | 58% | 0.581 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -65.2 | -43.5 | 176.1 | -69.9 | 176.5 | 0 | 0 | 0 | 111.7 | S43 G44 K50 V51 | S43-L47 WeakPolarHBondContact O-CG 3.23Å; S43-L47 PolarHBondContact O-N 3.05Å; S43-L47 VanDerWaalsContact O-N 3.07Å; G44-L47 PolarHBondContact O-N 2.8Å; L47-K50 PolarHBondContact O-N 3.16Å; L47-V51 WeakPolarHBondContact O-CG2 3.42Å; L47-V51 PolarHBondContact O-N 3.46Å |
| 48 | I | 85.1 | Confident | 81.8 | Confident | 102 Ų | 102 | 95.1 Ų | 95.1 | 52% | 0.523 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.8 | -47.3 | 177 | -67.4 | 165.3 | 0 | 0 | 0 | 110.3 | G44 L45 K50 V51 I52 | G44-I48 WeakPolarHBondContact O-CG1 3.4Å; G44-I48 PolarHBondContact O-N 3.39Å; L45-I48 PolarHBondContact O-N 3.14Å; I48-K50 VanDerWaalsContact C-N 3.28Å; I48-K50 PolarHBondContact O-N 3.4Å; I48-V51 PolarHBondContact O-N 3.29Å; I48-V51 VanDerWaalsContact O-N 3.16Å; I48-I52 HydrophobicContact CG2-CD1 3.75Å; I48-I52 WeakPolarHBondContact O-CG1 3.45Å; I48-I52 PolarHBondContact O-N 3.25Å |
| 49 | Q | 81.4 | Confident | 81.1 | Confident | 26 Ų | 26 | 95.2 Ų | 95.2 | 12% | 0.121 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -59.6 | -38.2 | 176.2 | -73.8 | 169.5 | -15.4 | 0 | 0 | 112 | L45 F46 I52 Q53 N63 | L45-Q49 WeakPolarHBondContact O-CB 3.08Å; L45-Q49 WeakPolarHBondContact O-CG 3.36Å; L45-Q49 PolarHBondContact O-N 2.92Å; F46-Q49 PolarHBondContact O-N 2.97Å; Q49-I52 PolarHBondContact O-N 3.12Å; Q49-Q53 WeakPolarHBondContact O-CB 3.49Å; Q49-Q53 WeakPolarHBondContact O-CG 3.09Å; Q49-Q53 PolarHBondContact O-N 3.33Å; Q49-N63 HydrophobicContact CB-CB 4.27Å; Q49-N63 PolarHBondContact NE2-O 2.74Å; Q49-N63 PolarHBondContact OE1-O 3.16Å |
| 50 | K | 81.3 | Confident | 80 | Confident | 126 Ų | 126 | 94.7 Ų | 94.7 | 55% | 0.548 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -67.6 | -34.3 | 176.5 | -172 | 172.2 | -177 | 163.3 | 0 | 112.9 | F46 L47 I48 | F46-K50 WeakPolarHBondContact O-CB 3.3Å; F46-K50 PolarHBondContact O-N 3.24Å; L47-K50 PolarHBondContact O-N 3.16Å; I48-K50 VanDerWaalsContact C-N 3.28Å; I48-K50 PolarHBondContact O-N 3.4Å |
| 51 | V | 84.6 | Confident | 79.4 | Confident | 100 Ų | 100 | 96.5 Ų | 96.5 | 61% | 0.606 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -70.1 | -42.3 | 173.7 | 173 | 0 | 0 | 0 | 0 | 110.7 | L47 I48 Q53 K54 | L47-V51 WeakPolarHBondContact O-CG2 3.42Å; L47-V51 PolarHBondContact O-N 3.46Å; I48-V51 PolarHBondContact O-N 3.29Å; I48-V51 VanDerWaalsContact O-N 3.16Å; V51-Q53 VanDerWaalsContact C-N 3.32Å; V51-Q53 PolarHBondContact O-N 3.11Å; V51-K54 WeakPolarHBondContact O-CB 3.18Å; V51-K54 PolarHBondContact O-N 2.9Å; V51-K54 VanDerWaalsContact O-N 3.15Å |
| 52 | I | 81.3 | Confident | 78.9 | Confident | 94 Ų | 94 | 102.8 Ų | 102.8 | 48% | 0.482 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.5 | -35.8 | 177.7 | -66.6 | 166.7 | 0 | 0 | 0 | 111.3 | I48 Q49 K54 R55 L56 | I48-I52 HydrophobicContact CG2-CD1 3.75Å; I48-I52 WeakPolarHBondContact O-CG1 3.45Å; I48-I52 PolarHBondContact O-N 3.25Å; Q49-I52 PolarHBondContact O-N 3.12Å; I52-K54 PolarHBondContact O-N 3.33Å; I52-K54 VanDerWaalsContact O-N 3.16Å; I52-R55 PolarHBondContact O-N 2.92Å; I52-L56 PolarHBondContact O-N 3Å; I52-L56 VanDerWaalsContact O-N 3.07Å |
| 53 | Q | 74.4 | Confident | 78.4 | Confident | 47 Ų | 47 | 102.2 Ų | 102.2 | 22% | 0.22 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -59.6 | -23.6 | 173.9 | -87.8 | -172.9 | -34.5 | 0 | 0 | 114 | Q49 V51 R55 L56 Y58 N63 | Q49-Q53 WeakPolarHBondContact O-CB 3.49Å; Q49-Q53 WeakPolarHBondContact O-CG 3.09Å; Q49-Q53 PolarHBondContact O-N 3.33Å; V51-Q53 VanDerWaalsContact C-N 3.32Å; V51-Q53 PolarHBondContact O-N 3.11Å; Q53-R55 PolarHBondContact O-N 2.9Å; Q53-L56 WeakPolarHBondContact CA-O 3.25Å; Q53-Y58 PolarHBondContact NE2-O 3.44Å; Q53-N63 WeakPolarHBondContact CG-ND2 3.5Å; Q53-N63 PolarHBondContact NE2-ND2 3.21Å |
| 54 | K | 76.4 | Confident | 78.1 | Confident | 185 Ų | 185 | 104 Ų | 104 | 80% | 0.804 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.8 | -18.9 | 172.8 | -67.3 | -164.3 | 173.6 | -173.5 | 0 | 112.9 | V51 I52 | V51-K54 WeakPolarHBondContact O-CB 3.18Å; V51-K54 PolarHBondContact O-N 2.9Å; V51-K54 VanDerWaalsContact O-N 3.15Å; I52-K54 PolarHBondContact O-N 3.33Å; I52-K54 VanDerWaalsContact O-N 3.16Å |
| 55 | R | 76.4 | Confident | 78 | Confident | 227 Ų | 227 | 108.4 Ų | 108.4 | 86% | 0.857 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.8 | -29.9 | -178.3 | -71.4 | -68.7 | -167.4 | 148.2 | 0.8 | 113.5 | I52 Q53 | I52-R55 PolarHBondContact O-N 2.92Å; Q53-R55 PolarHBondContact O-N 2.9Å |
| 56 | L | 70.1 | Confident | 77.9 | Confident | 107 Ų | 107 | 109.3 Ų | 109.3 | 56% | 0.56 | 53% | 0.528 | S | S | * | . | S | Bend | trans | -130.8 | 108 | -178.8 | -81.3 | 150.1 | 0 | 0 | 0 | 109.7 | I52 Q53 Y58 | I52-L56 PolarHBondContact O-N 3Å; I52-L56 VanDerWaalsContact O-N 3.07Å; Q53-L56 WeakPolarHBondContact CA-O 3.25Å; L56-Y58 PolarHBondContact O-N 3.43Å |
| 57 | P | 66.9 | Low | 77.8 | Confident | 127 Ų | 127 | 106 Ų | 106 | 83% | 0.825 | 51% | 0.514 | S | S | * | . | trans | -73.2 | 93.7 | -178.7 | 28.3 | -32.5 | 0 | 0 | 0 | 111.1 | ||||
| 58 | Y | 65.6 | Low | 77.7 | Confident | 162 Ų | 162 | 103.4 Ų | 103.4 | 64% | 0.635 | 50% | 0.502 | S | S | * | . | trans | -108.2 | 149.1 | 171.7 | -108 | -99.5 | 0 | 0 | 0 | 111.1 | Q53 L56 L60 | Q53-Y58 PolarHBondContact NE2-O 3.44Å; L56-Y58 PolarHBondContact O-N 3.43Å; Y58-L60 PolarHBondContact O-N 3.41Å | ||
| 59 | P | 70.9 | Confident | 77.9 | Confident | 74 Ų | 74 | 101.3 Ų | 101.3 | 48% | 0.481 | 50% | 0.5 | S | S | . | . | trans | -61.9 | 132.1 | 178.7 | 24.8 | -34.7 | 0 | 0 | 0 | 112.6 | Q61 W62 | P59-Q61 PolarHBondContact O-N 2.83Å; P59-Q61 VanDerWaalsContact O-N 3.16Å; P59-W62 PolarHBondContact O-N 3.33Å | ||
| 60 | L | 67.1 | Low | 78.2 | Confident | 102 Ų | 102 | 102.5 Ų | 102.5 | 53% | 0.534 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.1 | -26.8 | -174.4 | -122.2 | 146.3 | 0 | 0 | 0 | 114.2 | F46 Y58 W62 N63 L64 | F46-L60 HydrophobicContact CE2-CD2 4.4Å; Y58-L60 PolarHBondContact O-N 3.41Å; L60-W62 PolarHBondContact O-N 2.86Å; L60-N63 PolarHBondContact O-N 2.87Å; L60-L64 PolarHBondContact O-N 2.97Å |
| 61 | Q | 77.2 | Confident | 78.5 | Confident | 162 Ų | 162 | 96.7 Ų | 96.7 | 76% | 0.757 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.4 | -38 | 179.5 | -65.7 | 176.9 | -44.5 | 0 | 0 | 112.6 | P59 L65 | P59-Q61 PolarHBondContact O-N 2.83Å; P59-Q61 VanDerWaalsContact O-N 3.16Å; Q61-L65 PolarHBondContact O-N 2.98Å |
| 62 | W | 78.3 | Confident | 78.6 | Confident | 158 Ų | 158 | 95 Ų | 95 | 60% | 0.598 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -70.8 | -32.8 | -179.6 | -101.1 | 94.4 | 0 | 0 | 0 | 112.6 | P59 L60 L65 I66 | P59-W62 PolarHBondContact O-N 3.33Å; L60-W62 PolarHBondContact O-N 2.86Å; W62-L65 PolarHBondContact O-N 2.65Å; W62-I66 HydrophobicContact CE3-CD1 3.54Å; W62-I66 HydrophobicContact CE3-CG1 3.79Å; W62-I66 HydrophobicContact CZ3-CD1 4.01Å; W62-I66 HydrophobicContact CZ3-CG1 4.11Å; W62-I66 WeakPolarHBondContact O-CB 3.49Å; W62-I66 VanDerWaalsContact O-CG1 3.28Å; W62-I66 WeakPolarHBondContact O-CG1 3.37Å; W62-I66 PolarHBondContact O-N 2.88Å |
| 63 | N | 77.3 | Confident | 79 | Confident | 19 Ų | 19 | 95.5 Ų | 95.5 | 10% | 0.102 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -65.7 | -44.5 | 177.1 | -74.1 | -13.8 | 0 | 0 | 0 | 111.8 | Q49 Q53 L60 L65 I66 S67 | Q49-N63 HydrophobicContact CB-CB 4.27Å; Q49-N63 PolarHBondContact NE2-O 2.74Å; Q49-N63 PolarHBondContact OE1-O 3.16Å; Q53-N63 WeakPolarHBondContact CG-ND2 3.5Å; Q53-N63 PolarHBondContact NE2-ND2 3.21Å; L60-N63 PolarHBondContact O-N 2.87Å; N63-L65 PolarHBondContact O-N 3.21Å; N63-I66 PolarHBondContact O-N 3.25Å; N63-S67 WeakPolarHBondContact O-CB 3.48Å; N63-S67 PolarHBondContact O-N 2.98Å |
| 64 | L | 79.8 | Confident | 79.6 | Confident | 95 Ų | 95 | 95 Ų | 95 | 50% | 0.497 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.3 | -41.5 | 179.2 | -126 | 156.2 | 0 | 0 | 0 | 111.6 | L60 T68 | L60-L64 PolarHBondContact O-N 2.97Å; L64-T68 WeakPolarHBondContact O-CB 3.35Å; L64-T68 PolarHBondContact O-N 2.89Å; L64-T68 PolarHBondContact O-OG1 3.28Å |
| 65 | L | 85.7 | Confident | 79.9 | Confident | 121 Ų | 121 | 86.6 Ų | 86.6 | 63% | 0.634 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -63.5 | -51.8 | 174.2 | -92.4 | 166.8 | 0 | 0 | 0 | 112.1 | Q61 W62 N63 S67 T68 A69 | Q61-L65 PolarHBondContact O-N 2.98Å; W62-L65 PolarHBondContact O-N 2.65Å; N63-L65 PolarHBondContact O-N 3.21Å; L65-S67 PolarHBondContact O-N 2.92Å; L65-T68 PolarHBondContact O-N 3.15Å; L65-A69 VanDerWaalsContact O-CB 3.28Å; L65-A69 WeakPolarHBondContact O-CB 3.26Å; L65-A69 PolarHBondContact O-N 2.92Å |
| 66 | I | 84.1 | Confident | 80.2 | Confident | 81 Ų | 81 | 82.3 Ų | 82.3 | 42% | 0.415 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.9 | -42.9 | -179.4 | -68.9 | 167.8 | 0 | 0 | 0 | 110.8 | W62 N63 A70 | W62-I66 HydrophobicContact CE3-CD1 3.54Å; W62-I66 HydrophobicContact CE3-CG1 3.79Å; W62-I66 HydrophobicContact CZ3-CD1 4.01Å; W62-I66 HydrophobicContact CZ3-CG1 4.11Å; W62-I66 WeakPolarHBondContact O-CB 3.49Å; W62-I66 VanDerWaalsContact O-CG1 3.28Å; W62-I66 WeakPolarHBondContact O-CG1 3.37Å; W62-I66 PolarHBondContact O-N 2.88Å; N63-I66 PolarHBondContact O-N 3.25Å; I66-A70 WeakPolarHBondContact O-CB 3.31Å; I66-A70 PolarHBondContact O-N 2.98Å |
| 67 | S | 83.2 | Confident | 81 | Confident | 1 Ų | 1 | 79.9 Ų | 79.9 | 1% | 0.007 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -61.7 | -46.7 | 179.4 | 179.7 | 0 | 0 | 0 | 0 | 111.4 | T42 L45 N63 L65 S71 | T42-S67 PolarHBondContact O-OG 3.41Å; T42-S67 VanDerWaalsContact O-OG 3.09Å; L45-S67 WeakPolarHBondContact CB-OG 3.11Å; N63-S67 WeakPolarHBondContact O-CB 3.48Å; N63-S67 PolarHBondContact O-N 2.98Å; L65-S67 PolarHBondContact O-N 2.92Å; S67-S71 WeakPolarHBondContact O-CB 3.27Å; S67-S71 PolarHBondContact O-N 3.11Å |
| 68 | T | 85.3 | Confident | 81.7 | Confident | 56 Ų | 56 | 75.8 Ų | 75.8 | 34% | 0.344 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -68 | -43.4 | -179.4 | -50.8 | 0 | 0 | 0 | 0 | 111.5 | F38 L64 L65 S71 S72 | F38-T68 HydrophobicContact CZ-CG2 4.28Å; L64-T68 WeakPolarHBondContact O-CB 3.35Å; L64-T68 PolarHBondContact O-N 2.89Å; L64-T68 PolarHBondContact O-OG1 3.28Å; L65-T68 PolarHBondContact O-N 3.15Å; T68-S71 PolarHBondContact O-N 3.31Å; T68-S72 VanDerWaalsContact O-CB 3.27Å; T68-S72 WeakPolarHBondContact O-CB 2.97Å; T68-S72 PolarHBondContact O-N 3.38Å |
| 69 | A | 89.5 | Confident | 82.4 | Confident | 58 Ų | 58 | 69.7 Ų | 69.7 | 48% | 0.479 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -64.1 | -47.7 | 178 | 0 | 0 | 0 | 0 | 0 | 111.6 | L65 S71 S72 V73 | L65-A69 VanDerWaalsContact O-CB 3.28Å; L65-A69 WeakPolarHBondContact O-CB 3.26Å; L65-A69 PolarHBondContact O-N 2.92Å; A69-S71 PolarHBondContact O-N 3.37Å; A69-S72 PolarHBondContact O-N 3.37Å; A69-V73 WeakPolarHBondContact O-CG2 3.42Å; A69-V73 PolarHBondContact O-N 3.38Å |
| 70 | A | 87.7 | Confident | 82.8 | Confident | 50 Ų | 50 | 70.6 Ų | 70.6 | 41% | 0.413 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63 | -43.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | L45 I66 V73 G74 | L45-A70 HydrophobicContact CD1-CB 3.94Å; I66-A70 WeakPolarHBondContact O-CB 3.31Å; I66-A70 PolarHBondContact O-N 2.98Å; A70-V73 PolarHBondContact O-N 3.01Å; A70-G74 PolarHBondContact O-N 2.84Å |
| 71 | S | 86.4 | Confident | 83.6 | Confident | 5 Ų | 5 | 73.7 Ų | 73.7 | 4% | 0.035 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -64.2 | -40.4 | 176.5 | -173.8 | 0 | 0 | 0 | 0 | 112.1 | F38 T42 S67 T68 A69 G74 S75 | F38-S71 VanDerWaalsContact CD2-OG 3.23Å; F38-S71 WeakPolarHBondContact CD2-OG 3.11Å; F38-S71 PolarHBondContact O-OG 2.92Å; T42-S71 PolarHBondContact N-OG 3.33Å; T42-S71 WeakPolarHBondContact OG1-CB 3.38Å; T42-S71 PolarHBondContact OG1-OG 2.68Å; S67-S71 WeakPolarHBondContact O-CB 3.27Å; S67-S71 PolarHBondContact O-N 3.11Å; T68-S71 PolarHBondContact O-N 3.31Å; A69-S71 PolarHBondContact O-N 3.37Å; S71-G74 PolarHBondContact O-N 3.41Å; S71-S75 VanDerWaalsContact O-CB 3.24Å; S71-S75 WeakPolarHBondContact O-CB 3.45Å; S71-S75 PolarHBondContact O-N 3.28Å; S71-S75 PolarHBondContact O-OG 3.26Å |
| 72 | S | 86.5 | Confident | 83.8 | Confident | 64 Ų | 64 | 67.2 Ų | 67.2 | 45% | 0.448 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -60.9 | -50.4 | 176.7 | -178.2 | 0 | 0 | 0 | 0 | 111.6 | T68 A69 G74 S75 Y76 | T68-S72 VanDerWaalsContact O-CB 3.27Å; T68-S72 WeakPolarHBondContact O-CB 2.97Å; T68-S72 PolarHBondContact O-N 3.38Å; A69-S72 PolarHBondContact O-N 3.37Å; S72-G74 PolarHBondContact O-N 3.24Å; S72-S75 PolarHBondContact O-N 3.11Å; S72-Y76 WeakPolarHBondContact O-CB 3.42Å; S72-Y76 PolarHBondContact O-N 3.4Å |
| 73 | V | 90.8 | Very high | 83.9 | Confident | 105 Ų | 105 | 61.4 Ų | 61.4 | 64% | 0.636 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -61.6 | -44.8 | 177.7 | 175.2 | 0 | 0 | 0 | 0 | 111.1 | A69 A70 S75 Y76 A77 | A69-V73 WeakPolarHBondContact O-CG2 3.42Å; A69-V73 PolarHBondContact O-N 3.38Å; A70-V73 PolarHBondContact O-N 3.01Å; V73-S75 PolarHBondContact O-N 3.21Å; V73-Y76 PolarHBondContact O-N 3.36Å; V73-A77 WeakPolarHBondContact O-CB 3.16Å; V73-A77 PolarHBondContact O-N 2.93Å |
| 74 | G | 87.1 | Confident | 84.1 | Confident | 35 Ų | 35 | 64.4 Ų | 64.4 | 36% | 0.361 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -61.7 | -43.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | A70 S71 S72 A77 V78 | A70-G74 PolarHBondContact O-N 2.84Å; S71-G74 PolarHBondContact O-N 3.41Å; S72-G74 PolarHBondContact O-N 3.24Å; G74-A77 PolarHBondContact O-N 2.92Å; G74-V78 WeakPolarHBondContact O-CG2 3.36Å; G74-V78 PolarHBondContact O-N 3.18Å |
| 75 | S | 81.2 | Confident | 84.2 | Confident | 10 Ų | 10 | 64 Ų | 64 | 7% | 0.07 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -68.6 | -39 | 179.7 | -56.2 | 0 | 0 | 0 | 0 | 111.8 | F38 S71 S72 V73 V78 T79 | F38-S75 WeakPolarHBondContact CA-OG 3.39Å; F38-S75 WeakPolarHBondContact CB-OG 3.3Å; F38-S75 PolarHBondContact N-OG 3.06Å; F38-S75 VanDerWaalsContact N-OG 3.15Å; S71-S75 VanDerWaalsContact O-CB 3.24Å; S71-S75 WeakPolarHBondContact O-CB 3.45Å; S71-S75 PolarHBondContact O-N 3.28Å; S71-S75 PolarHBondContact O-OG 3.26Å; S72-S75 PolarHBondContact O-N 3.11Å; V73-S75 PolarHBondContact O-N 3.21Å; S75-V78 PolarHBondContact O-N 2.97Å; S75-T79 VanDerWaalsContact O-CB 3.31Å; S75-T79 WeakPolarHBondContact O-CB 3.28Å; S75-T79 PolarHBondContact O-N 2.02Å; S75-T79 PolarHBondContact O-OG1 3.17Å |
| 76 | Y | 84.5 | Confident | 83.9 | Confident | 137 Ų | 137 | 58.4 Ų | 58.4 | 54% | 0.537 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62 | -45.9 | 173.1 | -179.3 | -102 | 0 | 0 | 0 | 111.1 | S72 V73 V78 T79 R80 | S72-Y76 WeakPolarHBondContact O-CB 3.42Å; S72-Y76 PolarHBondContact O-N 3.4Å; V73-Y76 PolarHBondContact O-N 3.36Å; Y76-V78 PolarHBondContact O-N 3.15Å; Y76-T79 PolarHBondContact O-N 3.37Å; Y76-R80 VanDerWaalsContact O-CB 3.25Å; Y76-R80 WeakPolarHBondContact O-CB 3.49Å; Y76-R80 PolarHBondContact O-N 2.83Å |
| 77 | A | 86.1 | Confident | 83.6 | Confident | 55 Ų | 55 | 56.3 Ų | 56.3 | 46% | 0.455 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -61.4 | -45.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | V73 G74 R80 W81 | V73-A77 WeakPolarHBondContact O-CB 3.16Å; V73-A77 PolarHBondContact O-N 2.93Å; G74-A77 PolarHBondContact O-N 2.92Å; A77-R80 PolarHBondContact O-N 2.97Å; A77-W81 WeakPolarHBondContact O-CB 3.47Å; A77-W81 PolarHBondContact O-N 3.4Å |
| 78 | V | 82.6 | Confident | 83.5 | Confident | 42 Ų | 42 | 58.9 Ų | 58.9 | 26% | 0.255 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -62.9 | -46.5 | 175.8 | 170 | 0 | 0 | 0 | 0 | 111.2 | T37 G74 S75 Y76 R80 W81 E82 | T37-V78 HydrophobicContact CG2-CG1 4.21Å; G74-V78 WeakPolarHBondContact O-CG2 3.36Å; G74-V78 PolarHBondContact O-N 3.18Å; S75-V78 PolarHBondContact O-N 2.97Å; Y76-V78 PolarHBondContact O-N 3.15Å; V78-R80 VanDerWaalsContact C-N 3.32Å; V78-R80 PolarHBondContact O-N 3.45Å; V78-W81 PolarHBondContact O-N 3.43Å; V78-E82 HydrophobicContact CG1-CG 4.38Å; V78-E82 WeakPolarHBondContact O-CG 3.45Å; V78-E82 PolarHBondContact O-N 3.33Å |
| 79 | T | 80.4 | Confident | 83.1 | Confident | 34 Ų | 34 | 60.6 Ų | 60.6 | 21% | 0.209 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -59.8 | -46 | 178.5 | -53.7 | 0 | 0 | 0 | 0 | 110.3 | G34 S75 Y76 W81 E82 T83 | G34-T79 VanDerWaalsContact CA-OG1 3.26Å; G34-T79 WeakPolarHBondContact CA-OG1 3.48Å; S75-T79 VanDerWaalsContact O-CB 3.31Å; S75-T79 WeakPolarHBondContact O-CB 3.28Å; S75-T79 PolarHBondContact O-N 2.02Å; S75-T79 PolarHBondContact O-OG1 3.17Å; Y76-T79 PolarHBondContact O-N 3.37Å; T79-W81 VanDerWaalsContact C-N 3.31Å; T79-W81 PolarHBondContact O-N 3.49Å; T79-E82 PolarHBondContact O-N 3.4Å; T79-T83 WeakPolarHBondContact O-CG2 3.48Å; T79-T83 PolarHBondContact O-N 3.28Å; T79-T83 PolarHBondContact O-OG1 3.41Å |
| 80 | R | 79.1 | Confident | 82.5 | Confident | 92 Ų | 92 | 60.2 Ų | 60.2 | 35% | 0.347 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -63.5 | -37.1 | 178.8 | -158.9 | 176.9 | -159.9 | 177.6 | 3.5 | 111.5 | Y76 A77 V78 T83 M84 E107 | Y76-R80 VanDerWaalsContact O-CB 3.25Å; Y76-R80 WeakPolarHBondContact O-CB 3.49Å; Y76-R80 PolarHBondContact O-N 2.83Å; A77-R80 PolarHBondContact O-N 2.97Å; V78-R80 VanDerWaalsContact C-N 3.32Å; V78-R80 PolarHBondContact O-N 3.45Å; R80-T83 WeakPolarHBondContact CA-OG1 3.28Å; R80-T83 PolarHBondContact O-OG1 3.47Å; R80-M84 WeakPolarHBondContact O-CG 3.38Å; R80-M84 PolarHBondContact O-N 3Å; R80-M84 VanDerWaalsContact O-N 3.11Å; R80-E107 PolarHBondContact NH1-O 3.39Å |
| 81 | W | 83.1 | Confident | 81.9 | Confident | 168 Ų | 168 | 59.1 Ų | 59.1 | 64% | 0.636 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -69.8 | -43.5 | 176.7 | -175 | 19.5 | 0 | 0 | 0 | 112.1 | A77 V78 T79 M84 K85 | A77-W81 WeakPolarHBondContact O-CB 3.47Å; A77-W81 PolarHBondContact O-N 3.4Å; V78-W81 PolarHBondContact O-N 3.43Å; T79-W81 VanDerWaalsContact C-N 3.31Å; T79-W81 PolarHBondContact O-N 3.49Å; W81-M84 WeakPolarHBondContact O-CB 3.46Å; W81-M84 PolarHBondContact O-N 3.01Å; W81-K85 PolarHBondContact O-N 3.48Å; W81-K85 VanDerWaalsContact O-N 3.16Å |
| 82 | E | 82.1 | Confident | 81.4 | Confident | 25 Ų | 25 | 62.6 Ų | 62.6 | 12% | 0.117 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -68 | -38.2 | 178.6 | -68.1 | -67.4 | 158.4 | 0 | 0 | 111.9 | A30 K33 V78 T79 M84 K85 C86 | A30-E82 HydrophobicContact CB-CB 3.64Å; K33-E82 HydrophobicContact CD-CG 3.99Å; K33-E82 VanDerWaalsContact NZ-CD 3.34Å; K33-E82 IonicContact NZ-OE1 3.91Å; K33-E82 PolarHBondContact NZ-OE1 2.98Å; K33-E82 IonicContact NZ-OE2 2.71Å; V78-E82 HydrophobicContact CG1-CG 4.38Å; V78-E82 WeakPolarHBondContact O-CG 3.45Å; V78-E82 PolarHBondContact O-N 3.33Å; T79-E82 PolarHBondContact O-N 3.4Å; E82-M84 VanDerWaalsContact C-N 3.32Å; E82-M84 PolarHBondContact O-N 3.46Å; E82-K85 WeakPolarHBondContact O-CB 2.99Å; E82-K85 PolarHBondContact O-N 2.94Å; E82-K85 IonicContact OE1-NZ 2.97Å; E82-K85 PolarHBondContact OE1-NZ 3.05Å; E82-K85 IonicContact OE2-NZ 3.86Å; E82-C86 PolarHBondContact O-N 3.17Å; E82-C86 VanDerWaalsContact O-N 3.12Å; E82-C86 PolarHBondContact O-SG 3.31Å |
| 83 | T | 80.3 | Confident | 80.8 | Confident | 36 Ų | 36 | 63.1 Ų | 63.1 | 22% | 0.221 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -64.3 | -37.4 | 172.7 | 47.5 | 0 | 0 | 0 | 0 | 112.1 | A30 T79 R80 K85 C86 T87 | A30-T83 HydrophobicContact CB-CG2 3.92Å; T79-T83 WeakPolarHBondContact O-CG2 3.48Å; T79-T83 PolarHBondContact O-N 3.28Å; T79-T83 PolarHBondContact O-OG1 3.41Å; R80-T83 WeakPolarHBondContact CA-OG1 3.28Å; R80-T83 PolarHBondContact O-OG1 3.47Å; T83-K85 VanDerWaalsContact C-N 3.31Å; T83-K85 PolarHBondContact O-N 3.38Å; T83-C86 WeakPolarHBondContact O-CB 3.43Å; T83-C86 PolarHBondContact O-N 3.19Å; T83-C86 VanDerWaalsContact O-N 3.15Å; T83-T87 PolarHBondContact O-N 3.47Å; T83-T87 PolarHBondContact O-OG1 3.17Å; T83-T87 VanDerWaalsContact O-OG1 3.11Å |
| 84 | M | 80.7 | Confident | 79.8 | Confident | 83 Ų | 83 | 61.6 Ų | 61.6 | 41% | 0.409 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -61 | -39 | 174.5 | -71 | -72.8 | -177.3 | 0 | 0 | 112.2 | R80 W81 E82 C86 T87 D88 R101 | R80-M84 WeakPolarHBondContact O-CG 3.38Å; R80-M84 PolarHBondContact O-N 3Å; R80-M84 VanDerWaalsContact O-N 3.11Å; W81-M84 WeakPolarHBondContact O-CB 3.46Å; W81-M84 PolarHBondContact O-N 3.01Å; E82-M84 VanDerWaalsContact C-N 3.32Å; E82-M84 PolarHBondContact O-N 3.46Å; M84-C86 VanDerWaalsContact C-N 3.34Å; M84-T87 PolarHBondContact O-N 2.9Å; M84-D88 WeakPolarHBondContact O-CB 3.38Å; M84-D88 PolarHBondContact O-N 3.28Å; M84-R101 PolarHBondContact SD-NH1 2.69Å |
| 85 | K | 81 | Confident | 79.2 | Confident | 85 Ų | 85 | 63.6 Ų | 63.6 | 37% | 0.37 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -63.7 | -40 | 174.4 | -65.4 | 175 | -170.7 | 169 | 0 | 111.9 | W81 E82 T83 T87 D88 L89 | W81-K85 PolarHBondContact O-N 3.48Å; W81-K85 VanDerWaalsContact O-N 3.16Å; E82-K85 WeakPolarHBondContact O-CB 2.99Å; E82-K85 PolarHBondContact O-N 2.94Å; E82-K85 IonicContact OE1-NZ 2.97Å; E82-K85 PolarHBondContact OE1-NZ 3.05Å; E82-K85 IonicContact OE2-NZ 3.86Å; T83-K85 VanDerWaalsContact C-N 3.31Å; T83-K85 PolarHBondContact O-N 3.38Å; K85-T87 VanDerWaalsContact C-N 3.35Å; K85-D88 PolarHBondContact O-N 2.95Å; K85-L89 PolarHBondContact O-N 3.49Å; K85-L89 VanDerWaalsContact O-N 3.09Å |
| 86 | C | 80 | Confident | 78.6 | Confident | 4 Ų | 4 | 66 Ų | 66 | 3% | 0.027 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -62.8 | -42.3 | 176 | -61.2 | 0 | 0 | 0 | 0 | 111.9 | Y23 C26 E82 T83 M84 W90 | Y23-C86 HydrophobicContact CD2-CB 4.19Å; Y23-C86 HydrophobicContact CE2-CB 4.28Å; C26-C86 HydrophobicContact CB-CB 3.59Å; C26-C86 WeakPolarHBondContact CB-SG 3.28Å; C26-C86 PolarHBondContact O-SG 3.35Å; C26-C86 VanDerWaalsContact O-SG 3.37Å; C26-C86 WeakPolarHBondContact SG-CA 3.25Å; C26-C86 WeakPolarHBondContact SG-CB 3.02Å; C26-C86 CovalentContact SG-SG 2.02Å; C26-C86 PolarHBondContact SG-SG 3.07Å; E82-C86 PolarHBondContact O-N 3.17Å; E82-C86 VanDerWaalsContact O-N 3.12Å; E82-C86 PolarHBondContact O-SG 3.31Å; T83-C86 WeakPolarHBondContact O-CB 3.43Å; T83-C86 PolarHBondContact O-N 3.19Å; T83-C86 VanDerWaalsContact O-N 3.15Å; M84-C86 VanDerWaalsContact C-N 3.34Å; C86-W90 PolarHBondContact O-N 3.45Å |
| 87 | T | 79.2 | Confident | 77.6 | Confident | 37 Ų | 37 | 67.3 Ų | 67.3 | 23% | 0.227 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -65.4 | -41.2 | 177 | -53.7 | 0 | 0 | 0 | 0 | 111.5 | T83 M84 K85 W90 M91 | T83-T87 PolarHBondContact O-N 3.47Å; T83-T87 PolarHBondContact O-OG1 3.17Å; T83-T87 VanDerWaalsContact O-OG1 3.11Å; M84-T87 PolarHBondContact O-N 2.9Å; K85-T87 VanDerWaalsContact C-N 3.35Å; T87-W90 WeakPolarHBondContact O-CB 3.45Å; T87-W90 PolarHBondContact O-N 2.79Å; T87-M91 HydrophobicContact CG2-CG 4.46Å; T87-M91 VanDerWaalsContact O-CG 3.28Å; T87-M91 WeakPolarHBondContact O-CG 3.5Å; T87-M91 PolarHBondContact O-N 2.98Å |
| 88 | D | 79.3 | Confident | 76.5 | Confident | 55 Ų | 55 | 68.3 Ų | 68.3 | 29% | 0.294 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63.4 | -43.6 | 179.7 | -172.1 | 35.3 | 0 | 0 | 0 | 112.6 | M84 K85 W90 M91 L92 V98 P99 | M84-D88 WeakPolarHBondContact O-CB 3.38Å; M84-D88 PolarHBondContact O-N 3.28Å; K85-D88 PolarHBondContact O-N 2.95Å; D88-W90 VanDerWaalsContact C-N 3.31Å; D88-W90 PolarHBondContact O-N 2.76Å; D88-M91 WeakPolarHBondContact O-CB 3.34Å; D88-M91 PolarHBondContact O-N 3.42Å; D88-L92 WeakPolarHBondContact O-CB 3.47Å; D88-L92 PolarHBondContact O-N 2.89Å; D88-V98 WeakPolarHBondContact OD1-CG1 3.5Å; D88-P99 VanDerWaalsContact OD1-CD 3.3Å; D88-P99 WeakPolarHBondContact OD1-CD 3.19Å |
| 89 | L | 78.6 | Confident | 75.4 | Confident | 93 Ų | 93 | 68.6 Ų | 68.6 | 49% | 0.487 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -60.8 | -42.1 | 174.9 | -162.3 | 86.4 | 0 | 0 | 0 | 111.7 | K85 L92 I93 | K85-L89 PolarHBondContact O-N 3.49Å; K85-L89 VanDerWaalsContact O-N 3.09Å; L89-L92 PolarHBondContact O-N 3.35Å; L89-I93 HydrophobicContact CD2-CD1 4.38Å; L89-I93 HydrophobicContact CG-CD1 4.26Å; L89-I93 WeakPolarHBondContact O-CD1 3.29Å; L89-I93 VanDerWaalsContact O-CG1 3.28Å; L89-I93 WeakPolarHBondContact O-CG1 3.49Å; L89-I93 PolarHBondContact O-N 3.39Å |
| 90 | W | 76.8 | Confident | 74.1 | Confident | 49 Ų | 49 | 74.7 Ų | 74.7 | 19% | 0.186 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -62.4 | -45.9 | 176.4 | 177.6 | 60.9 | 0 | 0 | 0 | 111.6 | Y23 C86 T87 D88 L92 I93 E94 Y121 | Y23-W90 HydrophobicContact CD2-CB 4.38Å; C86-W90 PolarHBondContact O-N 3.45Å; T87-W90 WeakPolarHBondContact O-CB 3.45Å; T87-W90 PolarHBondContact O-N 2.79Å; D88-W90 VanDerWaalsContact C-N 3.31Å; D88-W90 PolarHBondContact O-N 2.76Å; W90-L92 VanDerWaalsContact C-N 3.31Å; W90-L92 PolarHBondContact O-N 3.05Å; W90-I93 PolarHBondContact O-N 3.44Å; W90-E94 WeakPolarHBondContact O-CB 3.42Å; W90-E94 PolarHBondContact O-N 2.74Å; W90-Y121 HydrophobicContact CH2-CD1 4.45Å; W90-Y121 HydrophobicContact CH2-CE1 4.13Å; W90-Y121 HydrophobicContact CZ3-CE1 4.01Å; W90-Y121 AromaticContact CZ3-CZ 3.92Å |
| 91 | M | 73.9 | Confident | 73.2 | Confident | 27 Ų | 27 | 78.6 Ų | 78.6 | 13% | 0.133 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -59.1 | -40.7 | 175.8 | -72.4 | -59.3 | -73.1 | 0 | 0 | 112.8 | T87 D88 E94 T95 P99 Y121 | T87-M91 HydrophobicContact CG2-CG 4.46Å; T87-M91 VanDerWaalsContact O-CG 3.28Å; T87-M91 WeakPolarHBondContact O-CG 3.5Å; T87-M91 PolarHBondContact O-N 2.98Å; D88-M91 WeakPolarHBondContact O-CB 3.34Å; D88-M91 PolarHBondContact O-N 3.42Å; M91-E94 PolarHBondContact O-N 3.4Å; M91-T95 HydrophobicContact CE-CG2 4.24Å; M91-T95 WeakPolarHBondContact O-CB 3.37Å; M91-T95 PolarHBondContact O-N 2.98Å; M91-T95 PolarHBondContact O-OG1 3.03Å; M91-P99 HydrophobicContact CG-CG 4.45Å; M91-Y121 HydrophobicContact CE-CE1 3.64Å; M91-Y121 HydrophobicContact SD-CE1 3.34Å; M91-Y121 WeakPolarHBondContact SD-CE1 3.4Å; M91-Y121 VanDerWaalsContact SD-CZ 3.59Å; M91-Y121 PolarHBondContact SD-OH 3.47Å |
| 92 | L | 76.9 | Confident | 71.4 | Confident | 79 Ų | 79 | 76.1 Ų | 76.1 | 41% | 0.414 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -65.8 | -40 | 177.7 | -179.7 | 135.4 | 0 | 0 | 0 | 111.9 | D88 L89 W90 E94 G96 V98 | D88-L92 WeakPolarHBondContact O-CB 3.47Å; D88-L92 PolarHBondContact O-N 2.89Å; L89-L92 PolarHBondContact O-N 3.35Å; W90-L92 VanDerWaalsContact C-N 3.31Å; W90-L92 PolarHBondContact O-N 3.05Å; L92-E94 VanDerWaalsContact C-N 3.35Å; L92-G96 WeakPolarHBondContact O-CA 3.48Å; L92-G96 PolarHBondContact O-N 3.44Å; L92-V98 HydrophobicContact CD1-CG2 3.52Å |
| 93 | I | 72.4 | Confident | 70 | Confident | 75 Ų | 75 | 80.7 Ų | 80.7 | 39% | 0.385 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -67.4 | -38.8 | 177.7 | -67 | 163.2 | 0 | 0 | 0 | 110.8 | L89 W90 | L89-I93 HydrophobicContact CD2-CD1 4.38Å; L89-I93 HydrophobicContact CG-CD1 4.26Å; L89-I93 WeakPolarHBondContact O-CD1 3.29Å; L89-I93 VanDerWaalsContact O-CG1 3.28Å; L89-I93 WeakPolarHBondContact O-CG1 3.49Å; L89-I93 PolarHBondContact O-N 3.39Å; W90-I93 PolarHBondContact O-N 3.44Å |
| 94 | E | 71.6 | Confident | 68.2 | Low | 73 Ų | 73 | 85.8 Ų | 85.8 | 34% | 0.341 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -82.6 | -39.9 | -175 | -159.9 | 67.5 | -151.3 | 0 | 0 | 113 | H17 W90 M91 L92 | H17-E94 IonicContact CE1-OE1 2.74Å; H17-E94 PolarHBondContact CE1-OE1 3.49Å; H17-E94 IonicContact CG-OE1 3.44Å; H17-E94 IonicContact ND1-OE1 3.67Å; H17-E94 PolarHBondContact ND1-OE1 3.14Å; H17-E94 IonicContact ND1-OE2 3.78Å; W90-E94 WeakPolarHBondContact O-CB 3.42Å; W90-E94 PolarHBondContact O-N 2.74Å; M91-E94 PolarHBondContact O-N 3.4Å; L92-E94 VanDerWaalsContact C-N 3.35Å |
| 95 | T | 73.7 | Confident | 66.3 | Low | 76 Ų | 76 | 88.6 Ų | 88.6 | 47% | 0.466 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -115 | -11.8 | -171.2 | 69.4 | 0 | 0 | 0 | 0 | 114.3 | M91 K97 | M91-T95 HydrophobicContact CE-CG2 4.24Å; M91-T95 WeakPolarHBondContact O-CB 3.37Å; M91-T95 PolarHBondContact O-N 2.98Å; M91-T95 PolarHBondContact O-OG1 3.03Å; T95-K97 PolarHBondContact O-N 3.39Å; T95-K97 PolarHBondContact OG1-N 3.44Å; T95-K97 PolarHBondContact OG1-O 2.87Å |
| 96 | G | 67.8 | Low | 65 | Low | 62 Ų | 62 | 89.1 Ų | 89.1 | 64% | 0.639 | 49% | 0.494 | S | S | * | . | S | Bend | trans | 69.2 | 7.5 | -173.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | L92 | L92-G96 WeakPolarHBondContact O-CA 3.48Å; L92-G96 PolarHBondContact O-N 3.44Å |
| 97 | K | 64.4 | Low | 62.8 | Low | 163 Ų | 163 | 96.5 Ų | 96.5 | 71% | 0.709 | 53% | 0.528 | S | S | * | . | trans | -127 | 136.4 | 179.4 | -87.9 | 179.3 | 175 | 169 | 0 | 111.7 | T95 | T95-K97 PolarHBondContact O-N 3.39Å; T95-K97 PolarHBondContact OG1-N 3.44Å; T95-K97 PolarHBondContact OG1-O 2.87Å | ||
| 98 | V | 62.7 | Low | 60.8 | Low | 76 Ų | 76 | 100 Ų | 100 | 46% | 0.461 | 55% | 0.551 | S | S | . | * | trans | -83.9 | 122.8 | 170.3 | 178.9 | 0 | 0 | 0 | 0 | 108.1 | D88 L92 D100 | D88-V98 WeakPolarHBondContact OD1-CG1 3.5Å; L92-V98 HydrophobicContact CD1-CG2 3.52Å; V98-D100 PolarHBondContact O-N 3.41Å | ||
| 99 | P | 59.6 | Low | 59 | Low | 49 Ų | 49 | 101.5 Ų | 101.5 | 32% | 0.318 | 57% | 0.571 | S | S | . | * | trans | -64.1 | 114.4 | 166.5 | 23.2 | -32.9 | 0 | 0 | 0 | 110.9 | D88 M91 R101 | D88-P99 VanDerWaalsContact OD1-CD 3.3Å; D88-P99 WeakPolarHBondContact OD1-CD 3.19Å; M91-P99 HydrophobicContact CG-CG 4.45Å; P99-R101 PolarHBondContact O-N 3.01Å | ||
| 100 | D | 53.2 | Low | 57 | Low | 161 Ų | 161 | 102.8 Ų | 102.8 | 86% | 0.861 | 59% | 0.586 | S | S | * | * | trans | -61.1 | 106.4 | 172.4 | -101 | -40.3 | 0 | 0 | 0 | 110.2 | V98 | V98-D100 PolarHBondContact O-N 3.41Š| ||
| 101 | R | 60.2 | Low | 55.1 | Low | 174 Ų | 174 | 109.1 Ų | 109.1 | 66% | 0.657 | 62% | 0.617 | S | S | * | * | trans | -122.4 | 85.4 | 174.4 | -70.3 | -175.9 | 170.8 | 177.3 | -0.4 | 109.3 | M84 P99 | M84-R101 PolarHBondContact SD-NH1 2.69Å; P99-R101 PolarHBondContact O-N 3.01Å | ||
| 102 | T | 46 | Very low | 53.6 | Low | 117 Ų | 117 | 117.1 Ų | 117.1 | 72% | 0.718 | 65% | 0.654 | S | S | * | * | trans | -54.2 | 129 | 168.4 | -45.7 | 0 | 0 | 0 | 0 | 109.2 | L104 | T102-L104 PolarHBondContact O-N 3.41Š| ||
| 103 | P | 52.1 | Low | 51.8 | Low | 121 Ų | 121 | 117.3 Ų | 117.3 | 79% | 0.786 | 66% | 0.66 | S | S | * | * | trans | -78.2 | 93.9 | -167.1 | 31.1 | -33.6 | 0 | 0 | 0 | 110.3 | ||||
| 104 | L | 43 | Very low | 50.3 | Low | 142 Ų | 142 | 119 Ų | 119 | 74% | 0.743 | 69% | 0.685 | S | S | * | * | trans | -105.1 | 108.3 | 168 | -71.1 | 167.9 | 0 | 0 | 0 | 108.6 | T102 | T102-L104 PolarHBondContact O-N 3.41Š| ||
| 105 | I | 39.3 | Very low | 48.8 | Very low | 143 Ų | 143 | 118 Ų | 118 | 73% | 0.733 | 69% | 0.694 | S | S | * | * | 48.3 | 121.6 | 129.1 | -55.5 | 167.9 | 0 | 0 | 0 | 115.6 | E107 | I105-E107 PolarHBondContact O-N 2.97Å; I105-E107 VanDerWaalsContact O-N 3.17Å | |||
| 106 | A | 53.7 | Low | 47.5 | Very low | 96 Ų | 96 | 119.7 Ų | 119.7 | 79% | 0.793 | 71% | 0.706 | S | S | * | * | trans | -32 | 115.1 | 170.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 107 | E | 34.2 | Very low | 46.6 | Very low | 159 Ų | 159 | 122.4 Ų | 122.4 | 74% | 0.743 | 70% | 0.701 | S | S | * | * | trans | -129.4 | 144 | 159.7 | -89.6 | -171.9 | 130.3 | 0 | 0 | 111.4 | R80 I105 | R80-E107 PolarHBondContact NH1-O 3.39Å; I105-E107 PolarHBondContact O-N 2.97Å; I105-E107 VanDerWaalsContact O-N 3.17Å | ||
| 108 | P | 38.2 | Very low | 45.7 | Very low | 109 Ų | 109 | 122.5 Ų | 122.5 | 71% | 0.708 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -70 | 166.5 | -172.9 | 33.3 | -36.5 | 0 | 0 | 0 | 110.8 | P110 | P108-P110 WeakPolarHBondContact O-CD 3.11Š|
| 109 | A | 41.8 | Very low | 45.8 | Very low | 87 Ų | 87 | 120.7 Ų | 120.7 | 72% | 0.719 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -47.4 | 130 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 110 | P | 36.5 | Very low | 45.5 | Very low | 121 Ų | 121 | 124.3 Ų | 124.3 | 79% | 0.786 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -86.2 | 128.1 | 162.2 | -3.6 | 22.6 | 0 | 0 | 0 | 109.5 | P108 | P108-P110 WeakPolarHBondContact O-CD 3.11Š|
| 111 | E | 35.6 | Very low | 45.5 | Very low | 181 Ų | 181 | 121.7 Ų | 121.7 | 85% | 0.846 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 151.8 | 174.7 | -64.1 | 167.5 | 141.5 | 0 | 0 | 113.3 | P113 | E111-P113 VanDerWaalsContact O-CD 3.29Å; E111-P113 WeakPolarHBondContact O-CD 3.45Å |
| 112 | E | 42.7 | Very low | 45 | Very low | 196 Ų | 196 | 116.2 Ų | 116.2 | 92% | 0.916 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 138.1 | 166.4 | -76.6 | -178.8 | 111.1 | 0 | 0 | 111.5 | ||
| 113 | P | 39.3 | Very low | 45.4 | Very low | 83 Ų | 83 | 115.6 Ų | 115.6 | 54% | 0.539 | 68% | 0.683 | S | S | . | * | trans | -113.4 | 129.7 | 143.3 | 31.2 | -30.5 | 0 | 0 | 0 | 111.9 | E111 K117 | E111-P113 VanDerWaalsContact O-CD 3.29Å; E111-P113 WeakPolarHBondContact O-CD 3.45Å; P113-K117 VanDerWaalsContact CD-NZ 3.29Å; P113-K117 VanDerWaalsContact CG-NZ 3.32Å; P113-K117 WeakPolarHBondContact O-CE 2.95Å; P113-K117 PolarHBondContact O-NZ 3.49Å | ||
| 114 | A | 40.1 | Very low | 45.2 | Very low | 110 Ų | 110 | 114.3 Ų | 114.3 | 91% | 0.909 | 67% | 0.672 | S | S | * | * | trans | -62 | 129.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 115 | G | 40.8 | Very low | 45.5 | Very low | 51 Ų | 51 | 113.1 Ų | 113.1 | 53% | 0.526 | 67% | 0.665 | S | S | . | * | S | Bend | trans | 148.2 | 147.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | K117 | G115-K117 PolarHBondContact O-N 3.22Š|
| 116 | P | 46.3 | Very low | 45.6 | Very low | 112 Ų | 112 | 118.8 Ų | 118.8 | 73% | 0.727 | 69% | 0.688 | S | S | * | * | trans | -69.2 | 105 | -174 | 27.5 | -32.4 | 0 | 0 | 0 | 109.7 | ||||
| 117 | K | 49.5 | Very low | 45.2 | Very low | 119 Ų | 119 | 119.9 Ų | 119.9 | 52% | 0.517 | 68% | 0.682 | S | S | . | * | P | Polyproline II helix | trans | -92.3 | 119.4 | -179.9 | -72 | 174.1 | -173.6 | 171.3 | 0 | 108.8 | P113 G115 T119 | P113-K117 VanDerWaalsContact CD-NZ 3.29Å; P113-K117 VanDerWaalsContact CG-NZ 3.32Å; P113-K117 WeakPolarHBondContact O-CE 2.95Å; P113-K117 PolarHBondContact O-NZ 3.49Å; G115-K117 PolarHBondContact O-N 3.22Å; K117-T119 PolarHBondContact O-N 3.3Å |
| 118 | K | 44.5 | Very low | 45.8 | Very low | 165 Ų | 165 | 117.8 Ų | 117.8 | 72% | 0.717 | 68% | 0.679 | S | S | * | * | B | Isolated β-bridge | trans | -66.8 | 122.6 | 160.4 | -64.5 | -168.9 | 176.9 | -175 | 0 | 107.5 | V124 | K118-V124 HydrophobicContact CG-CG2 4.4Å |
| 119 | T | 65.5 | Low | 46.2 | Very low | 39 Ų | 39 | 118.3 Ų | 118.3 | 24% | 0.239 | 68% | 0.678 | C | S | . | * | P | Polyproline II helix | trans | -69.8 | 155.9 | 177.8 | 68.3 | 0 | 0 | 0 | 0 | 108.9 | K117 Y121 G122 D123 M125 | K117-T119 PolarHBondContact O-N 3.3Å; T119-Y121 PolarHBondContact O-N 2.96Å; T119-Y121 PolarHBondContact OG1-N 3Å; T119-G122 PolarHBondContact O-N 3.42Å; T119-D123 PolarHBondContact N-O 2.77Å; T119-D123 PolarHBondContact OG1-N 2.98Å; T119-D123 PolarHBondContact OG1-O 2.96Å; T119-M125 HydrophobicContact CG2-CG 3.89Å; T119-M125 HydrophobicContact CG2-SD 4.43Å |
| 120 | P | 53.8 | Low | 46.5 | Very low | 124 Ų | 124 | 120.2 Ų | 120.2 | 81% | 0.805 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.6 | -2.7 | 171.4 | 22.8 | -32 | 0 | 0 | 0 | 113.7 | ||
| 121 | Y | 52.8 | Low | 47.1 | Very low | 106 Ų | 106 | 120.1 Ų | 120.1 | 42% | 0.416 | 67% | 0.668 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -100.1 | 2.3 | 177.1 | -54.5 | -75.6 | 0 | 0 | 0 | 113.4 | W90 M91 T119 D123 | W90-Y121 HydrophobicContact CH2-CD1 4.45Å; W90-Y121 HydrophobicContact CH2-CE1 4.13Å; W90-Y121 HydrophobicContact CZ3-CE1 4.01Å; W90-Y121 AromaticContact CZ3-CZ 3.92Å; M91-Y121 HydrophobicContact CE-CE1 3.64Å; M91-Y121 HydrophobicContact SD-CE1 3.34Å; M91-Y121 WeakPolarHBondContact SD-CE1 3.4Å; M91-Y121 VanDerWaalsContact SD-CZ 3.59Å; M91-Y121 PolarHBondContact SD-OH 3.47Å; T119-Y121 PolarHBondContact O-N 2.96Å; T119-Y121 PolarHBondContact OG1-N 3Å; Y121-D123 VanDerWaalsContact C-N 3.28Å; Y121-D123 PolarHBondContact O-N 3.3Å |
| 122 | G | 50 | Low | 47.8 | Very low | 59 Ų | 59 | 116.1 Ų | 116.1 | 61% | 0.608 | 66% | 0.656 | S | S | * | * | S | Bend | trans | 83.6 | -3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | T119 | T119-G122 PolarHBondContact O-N 3.42Š|
| 123 | D | 54.6 | Low | 48.2 | Very low | 105 Ų | 105 | 110.4 Ų | 110.4 | 56% | 0.561 | 64% | 0.638 | S | S | * | * | trans | -77.9 | 132.5 | 175.2 | -65 | -44.1 | 0 | 0 | 0 | 111.1 | T119 Y121 | T119-D123 PolarHBondContact N-O 2.77Å; T119-D123 PolarHBondContact OG1-N 2.98Å; T119-D123 PolarHBondContact OG1-O 2.96Å; Y121-D123 VanDerWaalsContact C-N 3.28Å; Y121-D123 PolarHBondContact O-N 3.3Å | ||
| 124 | V | 47 | Very low | 48.9 | Very low | 93 Ų | 93 | 112.5 Ų | 112.5 | 56% | 0.564 | 65% | 0.645 | S | S | * | * | B | Isolated β-bridge | trans | -88.5 | 113.4 | 172 | -173.4 | 0 | 0 | 0 | 0 | 107.1 | K118 | K118-V124 HydrophobicContact CG-CG2 4.4Å |
| 125 | M | 49.7 | Very low | 49.6 | Very low | 118 Ų | 118 | 112.7 Ų | 112.7 | 58% | 0.581 | 62% | 0.624 | S | S | * | * | trans | -80.9 | 118.8 | 170 | -57.5 | -68.4 | -78.3 | 0 | 0 | 107.7 | T119 | T119-M125 HydrophobicContact CG2-CG 3.89Å; T119-M125 HydrophobicContact CG2-SD 4.43Å | ||
| 126 | E | 41 | Very low | 50.4 | Low | 261 Ų | 261 | 118.3 Ų | 118.3 | 100% | 1.22 | 63% | 0.632 | S | S | * | * | trans | -76.7 | 0 | 167.5 | -92.4 | 170.9 | 102.7 | 0 | 0 | 111.8 |
Retrieved 126 of 126 residues in 34.2 ms
(Link to these results)