| 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 | P | 49.8 | Very low | 49.8 | Very low | 150 Ų | 150 | 118.3 Ų | 118.3 | 97% | 0.974 | 61% | 0.609 | S | S | * | * | 0 | -50.8 | 0 | -8.5 | 27.5 | 0 | 0 | 0 | 113.9 | |||||
| 2 | I | 54.1 | Low | 49.6 | Very low | 160 Ų | 160 | 120.1 Ų | 120.1 | 82% | 0.821 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.8 | -29.3 | -176.4 | -65.8 | 163.4 | 0 | 0 | 0 | 113.2 | ||
| 3 | L | 47.6 | Very low | 49.8 | Very low | 108 Ų | 108 | 121.6 Ų | 121.6 | 57% | 0.565 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91 | 4.8 | 176.4 | -70.9 | 170.7 | 0 | 0 | 0 | 114.1 | M5 I58 L59 | L3-M5 PolarHBondContact O-N 3.25Å; L3-I58 HydrophobicContact CD1-CG2 4.43Å; L3-L59 HydrophobicContact CD1-CD2 4.47Å |
| 4 | H | 44.8 | Very low | 50.7 | Low | 146 Ų | 146 | 113.8 Ų | 113.8 | 68% | 0.676 | 58% | 0.575 | S | S | * | * | trans | -77.3 | 92.1 | 175.5 | -86.6 | -75.8 | 0 | 0 | 0 | 110.2 | S6 | H4-S6 VanDerWaalsContact C-N 3.32Š| ||
| 5 | M | 56.7 | Low | 51.8 | Low | 141 Ų | 141 | 112.2 Ų | 112.2 | 70% | 0.695 | 58% | 0.576 | S | S | * | * | trans | -90.6 | 6.8 | 171.8 | -67.6 | -81.3 | 174 | 0 | 0 | 112.7 | L3 | L3-M5 PolarHBondContact O-N 3.25Š| ||
| 6 | S | 44.7 | Very low | 53 | Low | 29 Ų | 29 | 109.4 Ų | 109.4 | 20% | 0.203 | 56% | 0.562 | C | S | . | * | trans | -92.9 | 127.2 | -176.9 | 178.3 | 0 | 0 | 0 | 0 | 111.6 | H4 Q8 R14 | H4-S6 VanDerWaalsContact C-N 3.32Å; S6-Q8 PolarHBondContact O-N 2.9Å; S6-Q8 PolarHBondContact OG-N 3.26Å; S6-Q8 PolarHBondContact OG-O 3.36Å; S6-R14 VanDerWaalsContact CB-NH1 3.26Å; S6-R14 PolarHBondContact OG-NH1 3.03Å | ||
| 7 | K | 51.7 | Low | 54.2 | Low | 156 Ų | 156 | 103.4 Ų | 103.4 | 68% | 0.678 | 53% | 0.531 | S | S | * | . | S | Bend | trans | -69.3 | -12.7 | 171.3 | -83.1 | -174.8 | 179.2 | 173.5 | 0 | 113.5 | W75 A76 | K7-W75 HydrophobicContact CB-CE3 4.44Å; K7-W75 HydrophobicContact CB-CZ3 4.36Å; K7-A76 PolarHBondContact NZ-O 2.94Å |
| 8 | Q | 43.8 | Very low | 55.3 | Low | 58 Ų | 58 | 102.1 Ų | 102.1 | 27% | 0.271 | 52% | 0.523 | S | S | . | . | trans | -109.6 | 131.3 | 175 | -89.9 | 173.1 | -29.3 | 0 | 0 | 111.3 | S6 W75 | S6-Q8 PolarHBondContact O-N 2.9Å; S6-Q8 PolarHBondContact OG-N 3.26Å; S6-Q8 PolarHBondContact OG-O 3.36Å; Q8-W75 HydrophobicContact CG-CH2 4.12Å; Q8-W75 HydrophobicContact CG-CZ3 3.86Å | ||
| 9 | Q | 52 | Low | 56.7 | Low | 208 Ų | 208 | 100.2 Ų | 100.2 | 97% | 0.972 | 52% | 0.519 | S | S | * | . | S | Bend | trans | -80.1 | -18.1 | 178.6 | -166 | 170.5 | -18.1 | 0 | 0 | 112.8 | ||
| 10 | S | 47.4 | Very low | 58 | Low | 65 Ų | 65 | 95.7 Ų | 95.7 | 46% | 0.455 | 50% | 0.496 | S | S | . | . | trans | -106.1 | 129.3 | -178.9 | -177.1 | 0 | 0 | 0 | 0 | 111.8 | M12 | S10-M12 PolarHBondContact O-N 3.47Å; S10-M12 WeakPolarHBondContact OG-CB 3.41Å; S10-M12 PolarHBondContact OG-N 3.46Å | ||
| 11 | M | 55 | Low | 59.2 | Low | 80 Ų | 80 | 97.2 Ų | 97.2 | 39% | 0.394 | 50% | 0.496 | S | S | . | . | G | 310 helix | trans | -76.1 | 2.2 | 175.1 | -139.8 | 169.5 | -144.9 | 0 | 0 | 112.6 | F13 Q18 Y21 | M11-F13 PolarHBondContact O-N 3.24Å; M11-Q18 HydrophobicContact CG-CG 4.33Å; M11-Q18 WeakPolarHBondContact O-CG 3.43Å; M11-Q18 PolarHBondContact O-NE2 2.89Å; M11-Y21 HydrophobicContact SD-CG 4.32Å |
| 12 | M | 47.8 | Very low | 60.8 | Low | 140 Ų | 140 | 98.8 Ų | 98.8 | 69% | 0.69 | 48% | 0.483 | S | S | * | . | G | 310 helix | trans | -70.2 | -25.1 | -172.2 | -167.4 | 173.9 | 177.7 | 0 | 0 | 114 | S10 | S10-M12 PolarHBondContact O-N 3.47Å; S10-M12 WeakPolarHBondContact OG-CB 3.41Å; S10-M12 PolarHBondContact OG-N 3.46Å |
| 13 | F | 51.4 | Low | 62.3 | Low | 140 Ų | 140 | 95.2 Ų | 95.2 | 61% | 0.614 | 47% | 0.465 | S | S | * | . | G | 310 helix | trans | -106.7 | 18.3 | -177.6 | -67.5 | -76.2 | 0 | 0 | 0 | 114.1 | M11 | M11-F13 PolarHBondContact O-N 3.24Š|
| 14 | R | 63.6 | Low | 64.3 | Low | 12 Ų | 12 | 91 Ų | 91 | 5% | 0.045 | 44% | 0.443 | C | S | . | . | trans | -132.7 | 80.4 | -170.7 | -69.6 | -175.2 | 65.8 | -160.9 | -14.9 | 111.3 | S6 L16 S17 Q18 S66 E69 | S6-R14 VanDerWaalsContact CB-NH1 3.26Å; S6-R14 PolarHBondContact OG-NH1 3.03Å; R14-L16 PolarHBondContact O-N 3.29Å; R14-S17 PolarHBondContact NE-OG 2.95Å; R14-S17 PolarHBondContact NH2-OG 3.09Å; R14-S17 PolarHBondContact O-N 3.39Å; R14-S17 VanDerWaalsContact O-N 3.12Å; R14-Q18 PolarHBondContact O-N 2.93Å; R14-S66 PolarHBondContact NH1-OG 3.24Å; R14-S66 VanDerWaalsContact NH2-CB 3.31Å; R14-S66 PolarHBondContact NH2-OG 2.88Å; R14-E69 WeakPolarHBondContact CA-OE1 3.49Å; R14-E69 WeakPolarHBondContact CB-OE1 3.49Å; R14-E69 WeakPolarHBondContact CB-OE2 3.39Å; R14-E69 IonicContact CZ-OE2 3.12Å; R14-E69 IonicContact NE-OE2 2.71Å; R14-E69 PolarHBondContact NE-OE2 2.92Å; R14-E69 IonicContact NH2-OE2 2.7Å; R14-E69 PolarHBondContact NH2-OE2 2.78Å | ||
| 15 | P | 66.9 | Low | 66.4 | Low | 90 Ų | 90 | 85.5 Ų | 85.5 | 58% | 0.584 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -62 | -28.6 | -173.2 | 24.3 | -33.3 | 0 | 0 | 0 | 113.4 | S19 | P15-S19 PolarHBondContact O-N 3.46Å |
| 16 | L | 70.7 | Confident | 68.1 | Low | 68 Ų | 68 | 81 Ų | 81 | 36% | 0.356 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -77.5 | -31.6 | 177.1 | -60.7 | 169.2 | 0 | 0 | 0 | 111.8 | R14 S19 L20 I65 E69 | R14-L16 PolarHBondContact O-N 3.29Å; L16-S19 PolarHBondContact O-OG 3.49Å; L16-L20 PolarHBondContact O-N 3.41Å; L16-I65 HydrophobicContact CB-CD1 4.37Å; L16-I65 HydrophobicContact CB-CG2 3.59Å; L16-E69 WeakPolarHBondContact CA-OE1 3.47Å; L16-E69 HydrophobicContact CB-CG 4.14Å; L16-E69 VanDerWaalsContact CB-OE1 3.31Å; L16-E69 WeakPolarHBondContact CB-OE1 3.37Å; L16-E69 HydrophobicContact CD1-CG 3.96Å; L16-E69 HydrophobicContact CG-CG 4.46Å; L16-E69 PolarHBondContact N-OE1 3.33Å |
| 17 | S | 72.8 | Confident | 70.3 | Confident | 6 Ų | 6 | 80 Ų | 80 | 4% | 0.042 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -71.5 | -35.4 | 172.2 | -69.7 | 0 | 0 | 0 | 0 | 112.8 | R14 L20 Y21 E69 | R14-S17 PolarHBondContact NE-OG 2.95Å; R14-S17 PolarHBondContact NH2-OG 3.09Å; R14-S17 PolarHBondContact O-N 3.39Å; R14-S17 VanDerWaalsContact O-N 3.12Å; S17-L20 PolarHBondContact O-N 3.14Å; S17-Y21 PolarHBondContact O-N 3.16Å; S17-E69 PolarHBondContact N-OE1 3.11Å; S17-E69 PolarHBondContact OG-OE2 3.01Å |
| 18 | Q | 75.4 | Confident | 72.1 | Confident | 80 Ų | 80 | 76.1 Ų | 76.1 | 37% | 0.374 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -64 | -42.5 | 174 | -73.3 | -178.7 | 6.2 | 0 | 0 | 111.8 | M11 R14 L20 Y21 W22 | M11-Q18 HydrophobicContact CG-CG 4.33Å; M11-Q18 WeakPolarHBondContact O-CG 3.43Å; M11-Q18 PolarHBondContact O-NE2 2.89Å; R14-Q18 PolarHBondContact O-N 2.93Å; Q18-L20 PolarHBondContact O-N 2.92Å; Q18-Y21 WeakPolarHBondContact O-CB 3.41Å; Q18-Y21 PolarHBondContact O-N 3.02Å; Q18-W22 VanDerWaalsContact O-CD1 3.23Å; Q18-W22 PolarHBondContact O-N 2.74Å |
| 19 | S | 81.8 | Confident | 74.4 | Confident | 66 Ų | 66 | 79.3 Ų | 79.3 | 46% | 0.462 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -64.4 | -39.5 | 176.9 | 66.8 | 0 | 0 | 0 | 0 | 112.1 | P15 L16 Y21 W22 L23 | P15-S19 PolarHBondContact O-N 3.46Å; L16-S19 PolarHBondContact O-OG 3.49Å; S19-Y21 VanDerWaalsContact C-N 3.34Å; S19-Y21 PolarHBondContact O-N 3.32Å; S19-W22 PolarHBondContact O-N 2.94Å; S19-L23 WeakPolarHBondContact O-CB 3.31Å; S19-L23 PolarHBondContact O-N 3.34Å |
| 20 | L | 82.2 | Confident | 76.2 | Confident | 11 Ų | 11 | 72.9 Ų | 72.9 | 6% | 0.058 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -62.5 | -38.7 | 172.7 | -85.1 | 177.5 | 0 | 0 | 0 | 113.4 | L16 S17 Q18 L23 L24 T57 L61 I65 | L16-L20 PolarHBondContact O-N 3.41Å; S17-L20 PolarHBondContact O-N 3.14Å; Q18-L20 PolarHBondContact O-N 2.92Å; L20-L23 PolarHBondContact O-N 3.16Å; L20-L24 WeakPolarHBondContact O-CB 3.28Å; L20-L24 PolarHBondContact O-N 2.92Å; L20-T57 HydrophobicContact CD2-CG2 4.18Å; L20-L61 HydrophobicContact CD1-CB 4.13Å; L20-L61 HydrophobicContact CD2-CB 3.76Å; L20-L61 HydrophobicContact CD2-CD2 3.56Å; L20-L61 HydrophobicContact CD2-CG 4.25Å; L20-I65 HydrophobicContact CD1-CB 3.57Å; L20-I65 HydrophobicContact CD1-CD1 3.38Å; L20-I65 HydrophobicContact CD1-CG1 3.5Å; L20-I65 HydrophobicContact CD1-CG2 3.95Å; L20-I65 HydrophobicContact CD2-CD1 4.35Å; L20-I65 HydrophobicContact CG-CD1 3.77Å; L20-I65 HydrophobicContact CG-CG1 4.42Å |
| 21 | Y | 82.3 | Confident | 78.2 | Confident | 127 Ų | 127 | 71.8 Ų | 71.8 | 50% | 0.498 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -62.5 | -45.2 | 176.3 | 176.3 | -98.3 | 0 | 0 | 0 | 111.3 | M11 S17 Q18 S19 L23 L24 A25 | M11-Y21 HydrophobicContact SD-CG 4.32Å; S17-Y21 PolarHBondContact O-N 3.16Å; Q18-Y21 WeakPolarHBondContact O-CB 3.41Å; Q18-Y21 PolarHBondContact O-N 3.02Å; S19-Y21 VanDerWaalsContact C-N 3.34Å; S19-Y21 PolarHBondContact O-N 3.32Å; Y21-L23 VanDerWaalsContact C-N 3.33Å; Y21-L23 PolarHBondContact O-N 3.31Å; Y21-L24 PolarHBondContact O-N 3.21Å; Y21-A25 WeakPolarHBondContact O-CB 3.34Å; Y21-A25 PolarHBondContact O-N 3.29Å |
| 22 | W | 83.9 | Confident | 79.8 | Confident | 184 Ų | 184 | 73.1 Ų | 73.1 | 70% | 0.697 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -65.4 | -35.6 | 175.2 | -79.3 | 108.5 | 0 | 0 | 0 | 112.8 | Q18 S19 A25 A26 | Q18-W22 VanDerWaalsContact O-CD1 3.23Å; Q18-W22 PolarHBondContact O-N 2.74Å; S19-W22 PolarHBondContact O-N 2.94Å; W22-A25 PolarHBondContact O-N 3.14Å; W22-A26 WeakPolarHBondContact O-CB 3.34Å; W22-A26 PolarHBondContact O-N 3.12Å |
| 23 | L | 86.5 | Confident | 81.8 | Confident | 84 Ų | 84 | 73.7 Ų | 73.7 | 44% | 0.44 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -63.2 | -44.7 | 173.7 | -169.9 | 152.2 | 0 | 0 | 0 | 111.2 | S19 L20 Y21 A26 D27 T57 | S19-L23 WeakPolarHBondContact O-CB 3.31Å; S19-L23 PolarHBondContact O-N 3.34Å; L20-L23 PolarHBondContact O-N 3.16Å; Y21-L23 VanDerWaalsContact C-N 3.33Å; Y21-L23 PolarHBondContact O-N 3.31Å; L23-A26 PolarHBondContact O-N 3.25Å; L23-D27 WeakPolarHBondContact O-CB 3.4Å; L23-D27 PolarHBondContact O-N 3.2Å; L23-T57 HydrophobicContact CD2-CG2 4.22Å |
| 24 | L | 88.6 | Confident | 83.7 | Confident | 21 Ų | 21 | 68 Ų | 68 | 11% | 0.11 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -63.5 | -40.7 | 175.3 | -172.9 | 74.1 | 0 | 0 | 0 | 111.9 | L20 Y21 D27 L28 Y54 T57 I58 M62 | L20-L24 WeakPolarHBondContact O-CB 3.28Å; L20-L24 PolarHBondContact O-N 2.92Å; Y21-L24 PolarHBondContact O-N 3.21Å; L24-D27 PolarHBondContact O-N 2.7Å; L24-L28 WeakPolarHBondContact O-CG 3.48Å; L24-L28 PolarHBondContact O-N 2.74Å; L24-Y54 HydrophobicContact CD1-CD2 3.74Å; L24-Y54 HydrophobicContact CD1-CE2 3.77Å; L24-T57 HydrophobicContact CB-CG2 4.39Å; L24-T57 HydrophobicContact CD1-CG2 4.11Å; L24-I58 HydrophobicContact CD1-CD1 4.02Å; L24-I58 HydrophobicContact CD1-CG1 3.74Å; L24-I58 HydrophobicContact CD2-CD1 4.47Å; L24-I58 HydrophobicContact CD2-CG1 4.31Å; L24-M62 HydrophobicContact CD2-CE 4.25Å |
| 25 | A | 89.6 | Confident | 84.8 | Confident | 29 Ų | 29 | 70.7 Ų | 70.7 | 24% | 0.24 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -62.7 | -42.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y21 W22 L28 L29 | Y21-A25 WeakPolarHBondContact O-CB 3.34Å; Y21-A25 PolarHBondContact O-N 3.29Å; W22-A25 PolarHBondContact O-N 3.14Å; A25-L28 PolarHBondContact O-N 3.41Å; A25-L29 WeakPolarHBondContact O-CG 3.47Å; A25-L29 PolarHBondContact O-N 2.94Å; A25-L29 VanDerWaalsContact O-N 3.11Å |
| 26 | A | 91.7 | Very high | 85.8 | Confident | 46 Ų | 46 | 69.6 Ų | 69.6 | 38% | 0.38 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -64 | -41.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | W22 L23 L28 L29 I30 | W22-A26 WeakPolarHBondContact O-CB 3.34Å; W22-A26 PolarHBondContact O-N 3.12Å; L23-A26 PolarHBondContact O-N 3.25Å; A26-L28 PolarHBondContact O-N 3.39Å; A26-L29 WeakPolarHBondContact O-CB 3.44Å; A26-L29 PolarHBondContact O-N 2.61Å; A26-I30 VanDerWaalsContact O-CG1 3.32Å; A26-I30 WeakPolarHBondContact O-CG1 3.29Å; A26-I30 PolarHBondContact O-N 2.74Å |
| 27 | D | 90.6 | Very high | 86.5 | Confident | 10 Ų | 10 | 69.6 Ų | 69.6 | 5% | 0.053 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63.5 | -40.7 | 178 | -171 | 72.4 | 0 | 0 | 0 | 112.2 | L23 L24 L29 I30 L31 Y54 | L23-D27 WeakPolarHBondContact O-CB 3.4Å; L23-D27 PolarHBondContact O-N 3.2Å; L24-D27 PolarHBondContact O-N 2.7Å; D27-L29 PolarHBondContact O-N 2.71Å; D27-I30 PolarHBondContact O-N 3.42Å; D27-L31 WeakPolarHBondContact O-CB 3.31Å; D27-L31 WeakPolarHBondContact O-CG 3.2Å; D27-L31 PolarHBondContact O-N 2.7Å; D27-Y54 WeakPolarHBondContact OD2-CA 3.37Å; D27-Y54 WeakPolarHBondContact OD2-CB 3.15Å; D27-Y54 PolarHBondContact OD2-N 2.9Å |
| 28 | L | 90.2 | Very high | 87 | Confident | 74 Ų | 74 | 73.3 Ų | 73.3 | 39% | 0.387 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62.8 | -39.2 | 172.5 | -77.3 | 173.2 | 0 | 0 | 0 | 112.9 | L24 A25 A26 L31 T32 Y54 | L24-L28 WeakPolarHBondContact O-CG 3.48Å; L24-L28 PolarHBondContact O-N 2.74Å; A25-L28 PolarHBondContact O-N 3.41Å; A26-L28 PolarHBondContact O-N 3.39Å; L28-L31 PolarHBondContact O-N 3.02Å; L28-T32 WeakPolarHBondContact O-CB 3.49Å; L28-T32 PolarHBondContact O-N 3.48Å; L28-T32 PolarHBondContact O-OG1 3.08Å; L28-Y54 HydrophobicContact CD2-CD2 4.1Å; L28-Y54 HydrophobicContact CD2-CE2 3.54Å; L28-Y54 HydrophobicContact CG-CD2 4.44Å; L28-Y54 HydrophobicContact CG-CE2 3.99Å |
| 29 | L | 93 | Very high | 87.2 | Confident | 124 Ų | 124 | 75.9 Ų | 75.9 | 65% | 0.649 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -64.3 | -41.5 | 174.7 | -71.4 | 171.7 | 0 | 0 | 0 | 111.3 | A25 A26 D27 T32 W33 | A25-L29 WeakPolarHBondContact O-CG 3.47Å; A25-L29 PolarHBondContact O-N 2.94Å; A25-L29 VanDerWaalsContact O-N 3.11Å; A26-L29 WeakPolarHBondContact O-CB 3.44Å; A26-L29 PolarHBondContact O-N 2.61Å; D27-L29 PolarHBondContact O-N 2.71Å; L29-T32 PolarHBondContact O-N 3.36Å; L29-W33 WeakPolarHBondContact O-CB 3.33Å; L29-W33 PolarHBondContact O-N 2.95Å |
| 30 | I | 88.8 | Confident | 87.3 | Confident | 73 Ų | 73 | 75.3 Ų | 75.3 | 37% | 0.374 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -63.9 | -45.9 | 176.5 | -68.2 | 165.1 | 0 | 0 | 0 | 110.7 | A26 D27 T32 W33 I34 A50 | A26-I30 VanDerWaalsContact O-CG1 3.32Å; A26-I30 WeakPolarHBondContact O-CG1 3.29Å; A26-I30 PolarHBondContact O-N 2.74Å; D27-I30 PolarHBondContact O-N 3.42Å; I30-T32 VanDerWaalsContact C-N 3.35Å; I30-T32 PolarHBondContact O-N 2.92Å; I30-W33 PolarHBondContact O-N 2.9Å; I30-I34 HydrophobicContact CG2-CD1 3.6Å; I30-I34 HydrophobicContact CG2-CG1 4.4Å; I30-I34 VanDerWaalsContact O-CG1 3.27Å; I30-I34 WeakPolarHBondContact O-CG1 3.2Å; I30-I34 PolarHBondContact O-N 3.47Å; I30-A50 HydrophobicContact CG2-CB 4.34Å |
| 31 | L | 88.6 | Confident | 87.2 | Confident | 43 Ų | 43 | 84 Ų | 84 | 23% | 0.225 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -60.9 | -42.4 | 176.4 | -80.3 | 162.4 | 0 | 0 | 0 | 112.2 | D27 L28 W33 I34 G35 A50 Y54 | D27-L31 WeakPolarHBondContact O-CB 3.31Å; D27-L31 WeakPolarHBondContact O-CG 3.2Å; D27-L31 PolarHBondContact O-N 2.7Å; L28-L31 PolarHBondContact O-N 3.02Å; L31-W33 VanDerWaalsContact C-N 3.34Å; L31-I34 PolarHBondContact O-N 3.15Å; L31-G35 PolarHBondContact O-N 3.44Å; L31-A50 HydrophobicContact CD2-CB 3.89Å; L31-A50 HydrophobicContact CG-CB 3.99Å; L31-Y54 HydrophobicContact CD1-CD2 4.26Å; L31-Y54 HydrophobicContact CD1-CG 4.28Å |
| 32 | T | 90.4 | Very high | 87.2 | Confident | 108 Ų | 108 | 80.8 Ų | 80.8 | 66% | 0.663 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -63.7 | -42.3 | 177 | -55.1 | 0 | 0 | 0 | 0 | 111 | L28 L29 I30 G35 | L28-T32 WeakPolarHBondContact O-CB 3.49Å; L28-T32 PolarHBondContact O-N 3.48Å; L28-T32 PolarHBondContact O-OG1 3.08Å; L29-T32 PolarHBondContact O-N 3.36Å; I30-T32 VanDerWaalsContact C-N 3.35Å; I30-T32 PolarHBondContact O-N 2.92Å; T32-G35 PolarHBondContact O-N 3.31Å |
| 33 | W | 89.3 | Confident | 87.3 | Confident | 151 Ų | 151 | 74.4 Ų | 74.4 | 57% | 0.572 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -64.9 | -43.7 | 177.4 | 178.4 | 58.5 | 0 | 0 | 0 | 112.2 | L29 I30 L31 G35 G36 F43 | L29-W33 WeakPolarHBondContact O-CB 3.33Å; L29-W33 PolarHBondContact O-N 2.95Å; I30-W33 PolarHBondContact O-N 2.9Å; L31-W33 VanDerWaalsContact C-N 3.34Å; W33-G35 VanDerWaalsContact C-N 3.34Å; W33-G35 PolarHBondContact O-N 3.01Å; W33-G36 PolarHBondContact O-N 2.81Å; W33-F43 HydrophobicContact CH2-CE1 4.49Å |
| 34 | I | 90.7 | Very high | 87.3 | Confident | 21 Ų | 21 | 73.2 Ų | 73.2 | 11% | 0.108 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -67.5 | -34.2 | 178.2 | -67.7 | 166.2 | 0 | 0 | 0 | 111.6 | I30 L31 G36 Q37 I46 | I30-I34 HydrophobicContact CG2-CD1 3.6Å; I30-I34 HydrophobicContact CG2-CG1 4.4Å; I30-I34 VanDerWaalsContact O-CG1 3.27Å; I30-I34 WeakPolarHBondContact O-CG1 3.2Å; I30-I34 PolarHBondContact O-N 3.47Å; L31-I34 PolarHBondContact O-N 3.15Å; I34-G36 PolarHBondContact O-N 2.98Å; I34-G36 VanDerWaalsContact O-N 3.17Å; I34-Q37 PolarHBondContact O-N 3.28Å; I34-I46 HydrophobicContact CD1-CB 3.91Å; I34-I46 HydrophobicContact CD1-CG2 3.39Å; I34-I46 HydrophobicContact CG1-CG2 4.48Å |
| 35 | G | 87.6 | Confident | 87.4 | Confident | 69 Ų | 69 | 76.1 Ų | 76.1 | 71% | 0.711 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -61 | -22.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | L31 T32 W33 | L31-G35 PolarHBondContact O-N 3.44Å; T32-G35 PolarHBondContact O-N 3.31Å; W33-G35 VanDerWaalsContact C-N 3.34Å; W33-G35 PolarHBondContact O-N 3.01Å |
| 36 | G | 86.8 | Confident | 87.3 | Confident | 66 Ų | 66 | 78.1 Ų | 78.1 | 68% | 0.68 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.2 | -7.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | W33 I34 | W33-G36 PolarHBondContact O-N 2.81Å; I34-G36 PolarHBondContact O-N 2.98Å; I34-G36 VanDerWaalsContact O-N 3.17Å |
| 37 | Q | 85.9 | Confident | 87.2 | Confident | 68 Ų | 68 | 76.5 Ų | 76.5 | 32% | 0.318 | 43% | 0.434 | S | S | . | . | S | Bend | trans | -87.2 | 150 | 178.2 | -65.2 | -57.7 | -46.8 | 0 | 0 | 110.9 | I34 F43 | I34-Q37 PolarHBondContact O-N 3.28Å; Q37-F43 HydrophobicContact CB-CB 4.49Å; Q37-F43 HydrophobicContact CB-CD1 4.35Å; Q37-F43 HydrophobicContact CB-CD2 4.32Å; Q37-F43 HydrophobicContact CB-CG 4.14Å; Q37-F43 HydrophobicContact CG-CD1 4.25Å; Q37-F43 HydrophobicContact CG-CE1 4.3Å |
| 38 | P | 83.7 | Confident | 87.1 | Confident | 84 Ų | 84 | 82.1 Ų | 82.1 | 55% | 0.545 | 46% | 0.46 | S | S | . | . | trans | -61 | 145.3 | 172 | 26.7 | -33.7 | 0 | 0 | 0 | 110.4 | S40 | P38-S40 PolarHBondContact O-N 3.36Š| ||
| 39 | V | 80.1 | Confident | 87.2 | Confident | 135 Ų | 135 | 82.4 Ų | 82.4 | 82% | 0.818 | 47% | 0.465 | S | S | * | . | S | Bend | trans | -75.6 | 71.3 | 178.7 | -169 | 0 | 0 | 0 | 0 | 109.6 | ||
| 40 | S | 82.2 | Confident | 87.1 | Confident | 53 Ų | 53 | 76.7 Ų | 76.7 | 37% | 0.371 | 44% | 0.436 | S | S | . | . | trans | -120.5 | 155.1 | 174.2 | 58.8 | 0 | 0 | 0 | 0 | 110.5 | P38 F43 T44 | P38-S40 PolarHBondContact O-N 3.36Å; S40-F43 PolarHBondContact O-N 3.32Å; S40-T44 PolarHBondContact O-N 3.49Å | ||
| 41 | Y | 81.9 | Confident | 87.2 | Confident | 193 Ų | 193 | 75.6 Ų | 75.6 | 76% | 0.757 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.7 | 128.3 | 167.3 | -175.8 | -90.8 | 0 | 0 | 0 | 108.4 | I45 | Y41-I45 HydrophobicContact CD2-CD1 4.08Å; Y41-I45 HydrophobicContact CE2-CD1 3.56Å |
| 42 | P | 81.2 | Confident | 87.4 | Confident | 60 Ų | 60 | 80.2 Ų | 80.2 | 39% | 0.39 | 46% | 0.456 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -101.9 | -0.8 | 15.1 | 37.9 | -35.3 | 0 | 0 | 0 | 116 | T44 I45 I46 | P42-T44 VanDerWaalsContact C-N 3.27Å; P42-T44 PolarHBondContact O-N 2.9Å; P42-I45 PolarHBondContact O-N 3.49Å; P42-I45 VanDerWaalsContact O-N 3.15Å; P42-I46 PolarHBondContact O-N 3.06Å |
| 43 | F | 86.1 | Confident | 87.4 | Confident | 51 Ų | 51 | 79.1 Ų | 79.1 | 22% | 0.224 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -63 | -29.9 | -171.6 | -59.8 | -67.4 | 0 | 0 | 0 | 113.6 | W33 Q37 S40 I45 I46 G47 | W33-F43 HydrophobicContact CH2-CE1 4.49Å; Q37-F43 HydrophobicContact CB-CB 4.49Å; Q37-F43 HydrophobicContact CB-CD1 4.35Å; Q37-F43 HydrophobicContact CB-CD2 4.32Å; Q37-F43 HydrophobicContact CB-CG 4.14Å; Q37-F43 HydrophobicContact CG-CD1 4.25Å; Q37-F43 HydrophobicContact CG-CE1 4.3Å; S40-F43 PolarHBondContact O-N 3.32Å; F43-I45 VanDerWaalsContact C-N 3.35Å; F43-I45 PolarHBondContact O-N 3.44Å; F43-I46 PolarHBondContact O-N 3.24Å; F43-G47 PolarHBondContact O-N 2.87Å |
| 44 | T | 86.5 | Confident | 87.5 | Confident | 58 Ų | 58 | 75.4 Ų | 75.4 | 36% | 0.356 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -59.8 | -42.2 | 175 | -49.6 | 0 | 0 | 0 | 0 | 112.6 | S40 P42 G47 Q48 | S40-T44 PolarHBondContact O-N 3.49Å; P42-T44 VanDerWaalsContact C-N 3.27Å; P42-T44 PolarHBondContact O-N 2.9Å; T44-G47 PolarHBondContact O-N 3.4Å; T44-Q48 WeakPolarHBondContact O-CG 3.48Å; T44-Q48 PolarHBondContact O-N 3.36Å; T44-Q48 VanDerWaalsContact O-N 3.08Å |
| 45 | I | 90.1 | Very high | 87.3 | Confident | 82 Ų | 82 | 80.5 Ų | 80.5 | 42% | 0.421 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -70.3 | -41.9 | -179.6 | -64.5 | 179.8 | 0 | 0 | 0 | 109.9 | Y41 P42 F43 G47 Q48 V49 | Y41-I45 HydrophobicContact CD2-CD1 4.08Å; Y41-I45 HydrophobicContact CE2-CD1 3.56Å; P42-I45 PolarHBondContact O-N 3.49Å; P42-I45 VanDerWaalsContact O-N 3.15Å; F43-I45 VanDerWaalsContact C-N 3.35Å; F43-I45 PolarHBondContact O-N 3.44Å; I45-G47 VanDerWaalsContact C-N 3.31Å; I45-G47 PolarHBondContact O-N 3.33Å; I45-Q48 PolarHBondContact O-N 3.48Å; I45-V49 HydrophobicContact CG2-CG2 4.35Å; I45-V49 WeakPolarHBondContact O-CG2 3.44Å; I45-V49 PolarHBondContact O-N 3.19Å |
| 46 | I | 88.5 | Confident | 87.4 | Confident | 71 Ų | 71 | 79.5 Ų | 79.5 | 36% | 0.364 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -62.6 | -41.8 | 178.5 | -53 | 173.6 | 0 | 0 | 0 | 110.1 | I34 P42 F43 Q48 V49 A50 | I34-I46 HydrophobicContact CD1-CB 3.91Å; I34-I46 HydrophobicContact CD1-CG2 3.39Å; I34-I46 HydrophobicContact CG1-CG2 4.48Å; P42-I46 PolarHBondContact O-N 3.06Å; F43-I46 PolarHBondContact O-N 3.24Å; I46-Q48 PolarHBondContact O-N 3.02Å; I46-V49 PolarHBondContact O-N 3.41Å; I46-A50 VanDerWaalsContact O-CB 3.23Å; I46-A50 WeakPolarHBondContact O-CB 3.42Å; I46-A50 PolarHBondContact O-N 2.94Å |
| 47 | G | 89.4 | Confident | 87.4 | Confident | 13 Ų | 13 | 76.5 Ų | 76.5 | 13% | 0.134 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -63.3 | -38.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | F43 T44 I45 S51 | F43-G47 PolarHBondContact O-N 2.87Å; T44-G47 PolarHBondContact O-N 3.4Å; I45-G47 VanDerWaalsContact C-N 3.31Å; I45-G47 PolarHBondContact O-N 3.33Å; G47-S51 WeakPolarHBondContact O-CB 3.28Å; G47-S51 PolarHBondContact O-N 2.85Å; G47-S51 PolarHBondContact O-OG 2.87Å |
| 48 | Q | 88.9 | Confident | 87.3 | Confident | 127 Ų | 127 | 75.2 Ų | 75.2 | 59% | 0.593 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -66.1 | -46.5 | 175.7 | -75.3 | 175.9 | -7 | 0 | 0 | 112 | T44 I45 I46 S51 M52 | T44-Q48 WeakPolarHBondContact O-CG 3.48Å; T44-Q48 PolarHBondContact O-N 3.36Å; T44-Q48 VanDerWaalsContact O-N 3.08Å; I45-Q48 PolarHBondContact O-N 3.48Å; I46-Q48 PolarHBondContact O-N 3.02Å; Q48-S51 PolarHBondContact O-N 3.27Å; Q48-M52 WeakPolarHBondContact O-CB 3.29Å; Q48-M52 PolarHBondContact O-N 3.4Å |
| 49 | V | 92.6 | Very high | 87.3 | Confident | 80 Ų | 80 | 76 Ų | 76 | 49% | 0.485 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -64.6 | -43.5 | 177.8 | 173.8 | 0 | 0 | 0 | 0 | 111 | I45 I46 M52 L53 | I45-V49 HydrophobicContact CG2-CG2 4.35Å; I45-V49 WeakPolarHBondContact O-CG2 3.44Å; I45-V49 PolarHBondContact O-N 3.19Å; I46-V49 PolarHBondContact O-N 3.41Å; V49-M52 PolarHBondContact O-N 3.43Å; V49-L53 HydrophobicContact CG1-CD1 4.05Å; V49-L53 WeakPolarHBondContact O-CB 3.47Å; V49-L53 WeakPolarHBondContact O-CG 3.47Å; V49-L53 PolarHBondContact O-N 3.21Å |
| 50 | A | 90.2 | Very high | 87.5 | Confident | 5 Ų | 5 | 74.2 Ų | 74.2 | 4% | 0.041 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -62.3 | -44 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | I30 L31 I46 M52 L53 Y54 | I30-A50 HydrophobicContact CG2-CB 4.34Å; L31-A50 HydrophobicContact CD2-CB 3.89Å; L31-A50 HydrophobicContact CG-CB 3.99Å; I46-A50 VanDerWaalsContact O-CB 3.23Å; I46-A50 WeakPolarHBondContact O-CB 3.42Å; I46-A50 PolarHBondContact O-N 2.94Å; A50-M52 VanDerWaalsContact C-N 3.33Å; A50-M52 PolarHBondContact O-N 3.44Å; A50-L53 WeakPolarHBondContact O-CB 3.34Å; A50-L53 PolarHBondContact O-N 3.47Å; A50-Y54 WeakPolarHBondContact O-CB 3.48Å; A50-Y54 PolarHBondContact O-N 3.15Å |
| 51 | S | 90.8 | Very high | 87.5 | Confident | 50 Ų | 50 | 74.3 Ų | 74.3 | 35% | 0.35 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.3 | -40.4 | 175.9 | -58.7 | 0 | 0 | 0 | 0 | 112.1 | G47 Q48 Y54 F55 | G47-S51 WeakPolarHBondContact O-CB 3.28Å; G47-S51 PolarHBondContact O-N 2.85Å; G47-S51 PolarHBondContact O-OG 2.87Å; Q48-S51 PolarHBondContact O-N 3.27Å; S51-Y54 WeakPolarHBondContact O-CB 3.4Å; S51-Y54 PolarHBondContact O-N 3.2Å; S51-F55 VanDerWaalsContact O-CD2 3.27Å; S51-F55 WeakPolarHBondContact O-CD2 3.33Å; S51-F55 PolarHBondContact O-N 2.82Å |
| 52 | M | 93.4 | Very high | 87.5 | Confident | 139 Ų | 139 | 68.3 Ų | 68.3 | 69% | 0.685 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -64.7 | -41.4 | 175.6 | -171 | 178.2 | -174.5 | 0 | 0 | 111.6 | Q48 V49 A50 T56 | Q48-M52 WeakPolarHBondContact O-CB 3.29Å; Q48-M52 PolarHBondContact O-N 3.4Å; V49-M52 PolarHBondContact O-N 3.43Å; A50-M52 VanDerWaalsContact C-N 3.33Å; A50-M52 PolarHBondContact O-N 3.44Å; M52-T56 VanDerWaalsContact O-CB 3.28Å; M52-T56 WeakPolarHBondContact O-CB 3.38Å; M52-T56 PolarHBondContact O-N 3.38Å; M52-T56 PolarHBondContact O-OG1 3.31Å |
| 53 | L | 90 | Very high | 87.3 | Confident | 86 Ų | 86 | 67.6 Ų | 67.6 | 45% | 0.45 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -63.5 | -42.4 | 175.1 | -82.7 | 169 | 0 | 0 | 0 | 111.8 | V49 A50 T56 T57 | V49-L53 HydrophobicContact CG1-CD1 4.05Å; V49-L53 WeakPolarHBondContact O-CB 3.47Å; V49-L53 WeakPolarHBondContact O-CG 3.47Å; V49-L53 PolarHBondContact O-N 3.21Å; A50-L53 WeakPolarHBondContact O-CB 3.34Å; A50-L53 PolarHBondContact O-N 3.47Å; L53-T56 PolarHBondContact O-N 3.37Å; L53-T57 VanDerWaalsContact O-CB 3.26Å; L53-T57 WeakPolarHBondContact O-CB 3.43Å; L53-T57 PolarHBondContact O-N 2.83Å; L53-T57 PolarHBondContact O-OG1 2.72Å |
| 54 | Y | 89.9 | Confident | 87.1 | Confident | 72 Ų | 72 | 68.2 Ų | 68.2 | 28% | 0.282 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -54.5 | -55.6 | 176.4 | -177.3 | -103.6 | 0 | 0 | 0 | 111.9 | L24 D27 L28 L31 A50 S51 T56 T57 I58 | L24-Y54 HydrophobicContact CD1-CD2 3.74Å; L24-Y54 HydrophobicContact CD1-CE2 3.77Å; D27-Y54 WeakPolarHBondContact OD2-CA 3.37Å; D27-Y54 WeakPolarHBondContact OD2-CB 3.15Å; D27-Y54 PolarHBondContact OD2-N 2.9Å; L28-Y54 HydrophobicContact CD2-CD2 4.1Å; L28-Y54 HydrophobicContact CD2-CE2 3.54Å; L28-Y54 HydrophobicContact CG-CD2 4.44Å; L28-Y54 HydrophobicContact CG-CE2 3.99Å; L31-Y54 HydrophobicContact CD1-CD2 4.26Å; L31-Y54 HydrophobicContact CD1-CG 4.28Å; A50-Y54 WeakPolarHBondContact O-CB 3.48Å; A50-Y54 PolarHBondContact O-N 3.15Å; S51-Y54 WeakPolarHBondContact O-CB 3.4Å; S51-Y54 PolarHBondContact O-N 3.2Å; Y54-T56 PolarHBondContact O-N 3.48Å; Y54-T57 PolarHBondContact O-N 2.9Å; Y54-I58 HydrophobicContact CD1-CD1 4.3Å; Y54-I58 HydrophobicContact CD2-CD1 4.32Å; Y54-I58 HydrophobicContact CE1-CD1 3.67Å; Y54-I58 HydrophobicContact CE2-CD1 3.68Å; Y54-I58 PolarHBondContact O-N 3.29Å; Y54-I58 VanDerWaalsContact O-N 3.15Å; Y54-I58 WeakPolarHBondContact OH-CD1 3.23Å |
| 55 | F | 88.5 | Confident | 86.9 | Confident | 129 Ų | 129 | 66.9 Ų | 66.9 | 57% | 0.566 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -65.2 | -41.2 | -179.4 | -79.9 | -71.2 | 0 | 0 | 0 | 112.3 | S51 T57 I58 L59 | S51-F55 VanDerWaalsContact O-CD2 3.27Å; S51-F55 WeakPolarHBondContact O-CD2 3.33Å; S51-F55 PolarHBondContact O-N 2.82Å; F55-T57 VanDerWaalsContact C-N 3.3Å; F55-T57 PolarHBondContact O-N 2.93Å; F55-I58 PolarHBondContact O-N 3.34Å; F55-L59 HydrophobicContact CD1-CD1 4.41Å; F55-L59 VanDerWaalsContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CB 3.44Å; F55-L59 PolarHBondContact O-N 3.08Å |
| 56 | T | 89.7 | Confident | 86.2 | Confident | 47 Ų | 47 | 63.7 Ų | 63.7 | 29% | 0.288 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -62.8 | -39.7 | 177.8 | -58 | 0 | 0 | 0 | 0 | 111.1 | M52 L53 Y54 I60 L61 | M52-T56 VanDerWaalsContact O-CB 3.28Å; M52-T56 WeakPolarHBondContact O-CB 3.38Å; M52-T56 PolarHBondContact O-N 3.38Å; M52-T56 PolarHBondContact O-OG1 3.31Å; L53-T56 PolarHBondContact O-N 3.37Å; Y54-T56 PolarHBondContact O-N 3.48Å; T56-I60 HydrophobicContact CG2-CB 4.48Å; T56-I60 HydrophobicContact CG2-CD1 4.28Å; T56-I60 WeakPolarHBondContact O-CA 3.26Å; T56-I60 WeakPolarHBondContact O-CB 3.5Å; T56-I60 PolarHBondContact O-N 2.98Å; T56-L61 HydrophobicContact CG2-CD1 3.83Å; T56-L61 PolarHBondContact O-N 2.78Å; T56-L61 VanDerWaalsContact O-N 3.08Å |
| 57 | T | 85.9 | Confident | 85.6 | Confident | 3 Ų | 3 | 65.3 Ų | 65.3 | 2% | 0.018 | 35% | 0.345 | C | S | . | . | I | π-helix | trans | -65.6 | -46.4 | -179.3 | -60.2 | 0 | 0 | 0 | 0 | 111.4 | L20 L23 L24 L53 Y54 F55 L61 M62 | L20-T57 HydrophobicContact CD2-CG2 4.18Å; L23-T57 HydrophobicContact CD2-CG2 4.22Å; L24-T57 HydrophobicContact CB-CG2 4.39Å; L24-T57 HydrophobicContact CD1-CG2 4.11Å; L53-T57 VanDerWaalsContact O-CB 3.26Å; L53-T57 WeakPolarHBondContact O-CB 3.43Å; L53-T57 PolarHBondContact O-N 2.83Å; L53-T57 PolarHBondContact O-OG1 2.72Å; Y54-T57 PolarHBondContact O-N 2.9Å; F55-T57 VanDerWaalsContact C-N 3.3Å; F55-T57 PolarHBondContact O-N 2.93Å; T57-L61 PolarHBondContact O-N 3.41Å; T57-M62 PolarHBondContact O-N 2.99Å |
| 58 | I | 83.9 | Confident | 85.2 | Confident | 41 Ų | 41 | 69 Ų | 69 | 21% | 0.21 | 36% | 0.361 | C | S | . | . | I | π-helix | trans | -73.3 | -46.3 | -179.1 | -65.2 | 178.7 | 0 | 0 | 0 | 112 | L3 L24 Y54 F55 | L3-I58 HydrophobicContact CD1-CG2 4.43Å; L24-I58 HydrophobicContact CD1-CD1 4.02Å; L24-I58 HydrophobicContact CD1-CG1 3.74Å; L24-I58 HydrophobicContact CD2-CD1 4.47Å; L24-I58 HydrophobicContact CD2-CG1 4.31Å; Y54-I58 HydrophobicContact CD1-CD1 4.3Å; Y54-I58 HydrophobicContact CD2-CD1 4.32Å; Y54-I58 HydrophobicContact CE1-CD1 3.67Å; Y54-I58 HydrophobicContact CE2-CD1 3.68Å; Y54-I58 PolarHBondContact O-N 3.29Å; Y54-I58 VanDerWaalsContact O-N 3.15Å; Y54-I58 WeakPolarHBondContact OH-CD1 3.23Å; F55-I58 PolarHBondContact O-N 3.34Å |
| 59 | L | 83.2 | Confident | 84.5 | Confident | 102 Ų | 102 | 63.1 Ų | 63.1 | 53% | 0.534 | 33% | 0.333 | S | S | . | . | I | π-helix | trans | -81.7 | -34.2 | -172.6 | -68.5 | 173.8 | 0 | 0 | 0 | 113.2 | L3 F55 P63 | L3-L59 HydrophobicContact CD1-CD2 4.47Å; F55-L59 HydrophobicContact CD1-CD1 4.41Å; F55-L59 VanDerWaalsContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CB 3.44Å; F55-L59 PolarHBondContact O-N 3.08Å; L59-P63 WeakPolarHBondContact O-CG 3.22Å |
| 60 | I | 84.5 | Confident | 83.6 | Confident | 97 Ų | 97 | 60.9 Ų | 60.9 | 50% | 0.497 | 32% | 0.319 | S | S | . | . | I | π-helix | trans | -112.6 | -51.2 | -171 | -58.8 | 171.8 | 0 | 0 | 0 | 111.3 | T56 P63 T64 | T56-I60 HydrophobicContact CG2-CB 4.48Å; T56-I60 HydrophobicContact CG2-CD1 4.28Å; T56-I60 WeakPolarHBondContact O-CA 3.26Å; T56-I60 WeakPolarHBondContact O-CB 3.5Å; T56-I60 PolarHBondContact O-N 2.98Å; I60-P63 VanDerWaalsContact O-CD 3.29Å; I60-P63 WeakPolarHBondContact O-CD 3.47Å; I60-P63 WeakPolarHBondContact O-CG 3.37Å; I60-T64 HydrophobicContact CG2-CG2 4.37Å; I60-T64 WeakPolarHBondContact O-CB 3.49Å; I60-T64 WeakPolarHBondContact O-CG2 3.44Å; I60-T64 PolarHBondContact O-N 3.22Å; I60-T64 PolarHBondContact O-OG1 3.41Å |
| 61 | L | 81.9 | Confident | 82.8 | Confident | 55 Ų | 55 | 68 Ų | 68 | 29% | 0.288 | 35% | 0.349 | S | S | . | . | I | π-helix | trans | -70.7 | -41.2 | -174.4 | -83.2 | 69.7 | 0 | 0 | 0 | 112.5 | L20 T56 T57 T64 I65 | L20-L61 HydrophobicContact CD1-CB 4.13Å; L20-L61 HydrophobicContact CD2-CB 3.76Å; L20-L61 HydrophobicContact CD2-CD2 3.56Å; L20-L61 HydrophobicContact CD2-CG 4.25Å; T56-L61 HydrophobicContact CG2-CD1 3.83Å; T56-L61 PolarHBondContact O-N 2.78Å; T56-L61 VanDerWaalsContact O-N 3.08Å; T57-L61 PolarHBondContact O-N 3.41Å; L61-T64 VanDerWaalsContact CA-OG1 3.31Å; L61-T64 WeakPolarHBondContact CA-OG1 3.35Å; L61-T64 PolarHBondContact O-N 2.94Å; L61-T64 PolarHBondContact O-OG1 2.92Å; L61-I65 WeakPolarHBondContact O-CB 3.35Å; L61-I65 WeakPolarHBondContact O-CG1 3.45Å; L61-I65 PolarHBondContact O-N 3.32Å |
| 62 | M | 82 | Confident | 81.9 | Confident | 67 Ų | 67 | 71.9 Ų | 71.9 | 33% | 0.33 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -55.8 | -51.4 | 177.1 | -86.9 | -163.6 | 173.9 | 0 | 0 | 114.1 | L24 T57 S66 | L24-M62 HydrophobicContact CD2-CE 4.25Å; T57-M62 PolarHBondContact O-N 2.99Å; M62-S66 WeakPolarHBondContact O-CB 3.44Å; M62-S66 PolarHBondContact O-N 3.36Å; M62-S66 VanDerWaalsContact O-N 3.16Å; M62-S66 PolarHBondContact O-OG 3.47Å |
| 63 | P | 77.4 | Confident | 80.9 | Confident | 45 Ų | 45 | 69.2 Ų | 69.2 | 29% | 0.292 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -70.4 | -36.3 | 178.9 | 24.3 | -32.3 | 0 | 0 | 0 | 112.8 | L59 I60 S66 L67 | L59-P63 WeakPolarHBondContact O-CG 3.22Å; I60-P63 VanDerWaalsContact O-CD 3.29Å; I60-P63 WeakPolarHBondContact O-CD 3.47Å; I60-P63 WeakPolarHBondContact O-CG 3.37Å; P63-S66 PolarHBondContact O-N 2.89Å; P63-L67 PolarHBondContact O-N 3.24Å |
| 64 | T | 81.7 | Confident | 79.4 | Confident | 63 Ų | 63 | 74 Ų | 74 | 39% | 0.387 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -68.1 | -47.3 | -179.1 | 51.8 | 0 | 0 | 0 | 0 | 112.2 | I60 L61 S66 L67 I68 | I60-T64 HydrophobicContact CG2-CG2 4.37Å; I60-T64 WeakPolarHBondContact O-CB 3.49Å; I60-T64 WeakPolarHBondContact O-CG2 3.44Å; I60-T64 PolarHBondContact O-N 3.22Å; I60-T64 PolarHBondContact O-OG1 3.41Å; L61-T64 VanDerWaalsContact CA-OG1 3.31Å; L61-T64 WeakPolarHBondContact CA-OG1 3.35Å; L61-T64 PolarHBondContact O-N 2.94Å; L61-T64 PolarHBondContact O-OG1 2.92Å; T64-S66 PolarHBondContact O-N 3.5Å; T64-L67 WeakPolarHBondContact O-CB 3.45Å; T64-L67 PolarHBondContact O-N 2.97Å; T64-L67 VanDerWaalsContact O-N 3.14Å; T64-I68 VanDerWaalsContact O-CG1 3.28Å; T64-I68 WeakPolarHBondContact O-CG1 3.27Å; T64-I68 PolarHBondContact O-N 3.21Å |
| 65 | I | 81.8 | Confident | 77.9 | Confident | 31 Ų | 31 | 77.3 Ų | 77.3 | 16% | 0.159 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -63.7 | -32.5 | 174.5 | -66 | -145.4 | 0 | 0 | 0 | 110.8 | L16 L20 L61 I68 E69 | L16-I65 HydrophobicContact CB-CD1 4.37Å; L16-I65 HydrophobicContact CB-CG2 3.59Å; L20-I65 HydrophobicContact CD1-CB 3.57Å; L20-I65 HydrophobicContact CD1-CD1 3.38Å; L20-I65 HydrophobicContact CD1-CG1 3.5Å; L20-I65 HydrophobicContact CD1-CG2 3.95Å; L20-I65 HydrophobicContact CD2-CD1 4.35Å; L20-I65 HydrophobicContact CG-CD1 3.77Å; L20-I65 HydrophobicContact CG-CG1 4.42Å; L61-I65 WeakPolarHBondContact O-CB 3.35Å; L61-I65 WeakPolarHBondContact O-CG1 3.45Å; L61-I65 PolarHBondContact O-N 3.32Å; I65-I68 PolarHBondContact O-N 3.5Å; I65-E69 HydrophobicContact CG2-CG 4.33Å; I65-E69 WeakPolarHBondContact O-CB 3.27Å; I65-E69 PolarHBondContact O-N 2.97Å |
| 66 | S | 75 | Confident | 75.8 | Confident | 15 Ų | 15 | 78.2 Ų | 78.2 | 11% | 0.105 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -65.6 | -38.5 | 171.9 | -55.5 | 0 | 0 | 0 | 0 | 115.1 | R14 M62 P63 T64 N70 | R14-S66 PolarHBondContact NH1-OG 3.24Å; R14-S66 VanDerWaalsContact NH2-CB 3.31Å; R14-S66 PolarHBondContact NH2-OG 2.88Å; M62-S66 WeakPolarHBondContact O-CB 3.44Å; M62-S66 PolarHBondContact O-N 3.36Å; M62-S66 VanDerWaalsContact O-N 3.16Å; M62-S66 PolarHBondContact O-OG 3.47Å; P63-S66 PolarHBondContact O-N 2.89Å; T64-S66 PolarHBondContact O-N 3.5Å; S66-N70 WeakPolarHBondContact O-CB 3.32Å; S66-N70 PolarHBondContact O-N 2.93Å; S66-N70 VanDerWaalsContact O-N 3.14Å; S66-N70 PolarHBondContact O-ND2 3.48Å; S66-N70 VanDerWaalsContact O-ND2 3.16Å |
| 67 | L | 77.4 | Confident | 75.1 | Confident | 105 Ų | 105 | 79.8 Ų | 79.8 | 55% | 0.55 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -66.5 | -41.8 | 172.2 | -163.6 | 95.2 | 0 | 0 | 0 | 111.7 | P63 T64 N70 K71 | P63-L67 PolarHBondContact O-N 3.24Å; T64-L67 WeakPolarHBondContact O-CB 3.45Å; T64-L67 PolarHBondContact O-N 2.97Å; T64-L67 VanDerWaalsContact O-N 3.14Å; L67-N70 PolarHBondContact O-N 3.47Å; L67-K71 HydrophobicContact CD2-CD 4.45Å; L67-K71 WeakPolarHBondContact O-CG 3.46Å; L67-K71 PolarHBondContact O-N 3.17Å |
| 68 | I | 80.6 | Confident | 74.5 | Confident | 90 Ų | 90 | 83.8 Ų | 83.8 | 46% | 0.462 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -64.7 | -49.4 | -178.6 | -68.3 | 164 | 0 | 0 | 0 | 110.6 | T64 I65 N70 K71 M72 | T64-I68 VanDerWaalsContact O-CG1 3.28Å; T64-I68 WeakPolarHBondContact O-CG1 3.27Å; T64-I68 PolarHBondContact O-N 3.21Å; I65-I68 PolarHBondContact O-N 3.5Å; I68-N70 PolarHBondContact O-N 3.48Å; I68-K71 PolarHBondContact O-N 3.28Å; I68-M72 WeakPolarHBondContact O-CB 3.48Å; I68-M72 PolarHBondContact O-N 2.93Å |
| 69 | E | 74.4 | Confident | 74 | Confident | 3 Ų | 3 | 86.2 Ų | 86.2 | 1% | 0.014 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -64.1 | -38.9 | 178.6 | -77.1 | 179.5 | 134.8 | 0 | 0 | 112 | R14 L16 S17 I65 K71 M72 L73 | R14-E69 WeakPolarHBondContact CA-OE1 3.49Å; R14-E69 WeakPolarHBondContact CB-OE1 3.49Å; R14-E69 WeakPolarHBondContact CB-OE2 3.39Å; R14-E69 IonicContact CZ-OE2 3.12Å; R14-E69 IonicContact NE-OE2 2.71Å; R14-E69 PolarHBondContact NE-OE2 2.92Å; R14-E69 IonicContact NH2-OE2 2.7Å; R14-E69 PolarHBondContact NH2-OE2 2.78Å; L16-E69 WeakPolarHBondContact CA-OE1 3.47Å; L16-E69 HydrophobicContact CB-CG 4.14Å; L16-E69 VanDerWaalsContact CB-OE1 3.31Å; L16-E69 WeakPolarHBondContact CB-OE1 3.37Å; L16-E69 HydrophobicContact CD1-CG 3.96Å; L16-E69 HydrophobicContact CG-CG 4.46Å; L16-E69 PolarHBondContact N-OE1 3.33Å; S17-E69 PolarHBondContact N-OE1 3.11Å; S17-E69 PolarHBondContact OG-OE2 3.01Å; I65-E69 HydrophobicContact CG2-CG 4.33Å; I65-E69 WeakPolarHBondContact O-CB 3.27Å; I65-E69 PolarHBondContact O-N 2.97Å; E69-K71 PolarHBondContact O-N 3.49Å; E69-M72 PolarHBondContact O-N 3.41Å; E69-L73 WeakPolarHBondContact O-CB 3.4Å; E69-L73 WeakPolarHBondContact O-CG 3.4Å; E69-L73 PolarHBondContact O-N 2.91Å |
| 70 | N | 73 | Confident | 73.5 | Confident | 34 Ų | 34 | 85.2 Ų | 85.2 | 18% | 0.182 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -60.1 | -44.4 | 174.1 | -73.5 | -16 | 0 | 0 | 0 | 111.9 | S66 L67 I68 K74 W75 | S66-N70 WeakPolarHBondContact O-CB 3.32Å; S66-N70 PolarHBondContact O-N 2.93Å; S66-N70 VanDerWaalsContact O-N 3.14Å; S66-N70 PolarHBondContact O-ND2 3.48Å; S66-N70 VanDerWaalsContact O-ND2 3.16Å; L67-N70 PolarHBondContact O-N 3.47Å; I68-N70 PolarHBondContact O-N 3.48Å; N70-K74 PolarHBondContact O-N 2.95Å; N70-W75 PolarHBondContact O-N 2.74Å |
| 71 | K | 73.8 | Confident | 72.8 | Confident | 154 Ų | 154 | 84.5 Ų | 84.5 | 67% | 0.67 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -64.5 | -40.4 | 175.8 | -76.3 | 177.4 | 178.3 | -72.8 | 0 | 112 | L67 I68 E69 K74 | L67-K71 HydrophobicContact CD2-CD 4.45Å; L67-K71 WeakPolarHBondContact O-CG 3.46Å; L67-K71 PolarHBondContact O-N 3.17Å; I68-K71 PolarHBondContact O-N 3.28Å; E69-K71 PolarHBondContact O-N 3.49Å; K71-K74 PolarHBondContact O-N 3.44Å |
| 72 | M | 71.8 | Confident | 72.2 | Confident | 131 Ų | 131 | 86.5 Ų | 86.5 | 65% | 0.645 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -68.4 | -35.5 | -178.4 | -145.3 | 175.7 | 75.2 | 0 | 0 | 112.1 | I68 E69 K74 | I68-M72 WeakPolarHBondContact O-CB 3.48Å; I68-M72 PolarHBondContact O-N 2.93Å; E69-M72 PolarHBondContact O-N 3.41Å; M72-K74 PolarHBondContact O-N 3.46Å |
| 73 | L | 71.7 | Confident | 71.5 | Confident | 84 Ų | 84 | 87.9 Ų | 87.9 | 44% | 0.44 | 46% | 0.462 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.8 | 7 | 176.8 | -67.1 | 171.1 | 0 | 0 | 0 | 113.7 | E69 W75 | E69-L73 WeakPolarHBondContact O-CB 3.4Å; E69-L73 WeakPolarHBondContact O-CG 3.4Å; E69-L73 PolarHBondContact O-N 2.91Å; L73-W75 PolarHBondContact O-N 3.27Å; L73-W75 VanDerWaalsContact O-N 3.09Å |
| 74 | K | 59.4 | Low | 71 | Confident | 187 Ų | 187 | 91.2 Ų | 91.2 | 81% | 0.813 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.2 | 29.8 | 178.8 | -67.1 | -174.7 | 178.7 | 179.6 | 0 | 114.5 | N70 K71 M72 A76 | N70-K74 PolarHBondContact O-N 2.95Å; K71-K74 PolarHBondContact O-N 3.44Å; M72-K74 PolarHBondContact O-N 3.46Å; K74-A76 PolarHBondContact O-N 3.4Å |
| 75 | W | 57.7 | Low | 70.1 | Confident | 140 Ų | 140 | 93.5 Ų | 93.5 | 53% | 0.53 | 48% | 0.483 | S | S | . | . | trans | -84.7 | 100.2 | 163.3 | -81.3 | -1.9 | 0 | 0 | 0 | 108 | K7 Q8 N70 L73 | K7-W75 HydrophobicContact CB-CE3 4.44Å; K7-W75 HydrophobicContact CB-CZ3 4.36Å; Q8-W75 HydrophobicContact CG-CH2 4.12Å; Q8-W75 HydrophobicContact CG-CZ3 3.86Å; N70-W75 PolarHBondContact O-N 2.74Å; L73-W75 PolarHBondContact O-N 3.27Å; L73-W75 VanDerWaalsContact O-N 3.09Å | ||
| 76 | A | 44.8 | Very low | 69 | Low | 148 Ų | 148 | 99.2 Ų | 99.2 | 100% | 1.223 | 51% | 0.512 | S | S | * | . | trans | -60.8 | 0 | 164.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | K7 K74 | K7-A76 PolarHBondContact NZ-O 2.94Å; K74-A76 PolarHBondContact O-N 3.4Å |
Retrieved 76 of 76 residues in 17.8 ms
(Link to these results)