| 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 | 52.6 | Low | 48.8 | Very low | 149 Ų | 149 | 128.5 Ų | 128.5 | 97% | 0.968 | 66% | 0.659 | S | S | * | * | 0 | -50.1 | 0 | -10.7 | 29.3 | 0 | 0 | 0 | 114.3 | |||||
| 2 | I | 54.1 | Low | 48.6 | Very low | 163 Ų | 163 | 129.9 Ų | 129.9 | 84% | 0.836 | 66% | 0.664 | S | S | * | * | trans | -88 | -22.5 | -178.7 | -65.4 | 164.7 | 0 | 0 | 0 | 113 | ||||
| 3 | L | 45.8 | Very low | 48.7 | Very low | 138 Ų | 138 | 131.4 Ų | 131.4 | 72% | 0.723 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -96.4 | 7.2 | 176.8 | -72.9 | 168.3 | 0 | 0 | 0 | 114.3 | M5 | L3-M5 PolarHBondContact O-N 3.34Š|
| 4 | H | 42.5 | Very low | 49.5 | Very low | 149 Ų | 149 | 122.7 Ų | 122.7 | 69% | 0.69 | 62% | 0.618 | S | S | * | * | trans | -78.8 | 91.8 | 175.2 | -73.3 | -74.6 | 0 | 0 | 0 | 110.4 | S6 | H4-S6 VanDerWaalsContact C-N 3.35Š| ||
| 5 | M | 56.9 | Low | 50.5 | Low | 164 Ų | 164 | 121.1 Ų | 121.1 | 81% | 0.808 | 62% | 0.62 | S | S | * | * | trans | -93.6 | 9.8 | 170.1 | -70.7 | -84.5 | 165.6 | 0 | 0 | 112.5 | L3 | L3-M5 PolarHBondContact O-N 3.34Š| ||
| 6 | S | 44.3 | Very low | 51.6 | Low | 37 Ų | 37 | 117.9 Ų | 117.9 | 26% | 0.259 | 60% | 0.604 | S | S | . | * | trans | -102 | 127.1 | -177.6 | 175.1 | 0 | 0 | 0 | 0 | 111.8 | H4 Q8 R14 | H4-S6 VanDerWaalsContact C-N 3.35Å; S6-Q8 VanDerWaalsContact C-N 3.26Å; S6-Q8 PolarHBondContact O-N 3.12Å; S6-Q8 PolarHBondContact OG-N 3.34Å; S6-Q8 PolarHBondContact OG-O 3.5Å; S6-Q8 VanDerWaalsContact OG-O 3.07Å; S6-R14 PolarHBondContact OG-NH1 3.28Å | ||
| 7 | K | 52.2 | Low | 52.8 | Low | 196 Ų | 196 | 111.6 Ų | 111.6 | 85% | 0.852 | 57% | 0.573 | S | S | * | * | S | Bend | trans | -74.1 | -5.6 | 173.2 | -92 | -167 | 178.9 | -177.5 | 0 | 114.6 | W75 | K7-W75 HydrophobicContact CB-CZ3 4.37Š|
| 8 | Q | 41.7 | Very low | 53.9 | Low | 60 Ų | 60 | 109.9 Ų | 109.9 | 28% | 0.28 | 56% | 0.562 | S | S | . | * | trans | -112.2 | 126.8 | 173.5 | -83.4 | 176.7 | -54.1 | 0 | 0 | 110.7 | S6 S10 W75 | S6-Q8 VanDerWaalsContact C-N 3.26Å; S6-Q8 PolarHBondContact O-N 3.12Å; S6-Q8 PolarHBondContact OG-N 3.34Å; S6-Q8 PolarHBondContact OG-O 3.5Å; S6-Q8 VanDerWaalsContact OG-O 3.07Å; Q8-S10 VanDerWaalsContact C-N 3.31Å; Q8-W75 HydrophobicContact CG-CH2 4.19Å; Q8-W75 HydrophobicContact CG-CZ3 4.02Å | ||
| 9 | Q | 50.4 | Low | 55.3 | Low | 211 Ų | 211 | 107.6 Ų | 107.6 | 99% | 0.986 | 56% | 0.557 | S | S | * | * | S | Bend | trans | -78.7 | -14.4 | 177.7 | -170.5 | 169 | -23.7 | 0 | 0 | 112.7 | ||
| 10 | S | 44 | Very low | 56.5 | Low | 61 Ų | 61 | 102.8 Ų | 102.8 | 43% | 0.427 | 53% | 0.532 | S | S | . | . | trans | -107.5 | 122.8 | -177.5 | -177.1 | 0 | 0 | 0 | 0 | 111.6 | Q8 M12 | Q8-S10 VanDerWaalsContact C-N 3.31Å; S10-M12 PolarHBondContact O-N 3.28Å; S10-M12 VanDerWaalsContact OG-CB 3.24Å; S10-M12 WeakPolarHBondContact OG-CB 3.47Å; S10-M12 PolarHBondContact OG-N 2.89Å | ||
| 11 | M | 52.2 | Low | 57.7 | Low | 85 Ų | 85 | 103.9 Ų | 103.9 | 42% | 0.419 | 53% | 0.53 | S | S | . | . | G | 310 helix | trans | -73.9 | 6.5 | 173.1 | -146.9 | 170.8 | -147.8 | 0 | 0 | 112.6 | Q18 Y21 | M11-Q18 HydrophobicContact CG-CG 4.36Å; M11-Q18 WeakPolarHBondContact O-CG 3.3Å; M11-Q18 PolarHBondContact O-NE2 2.93Å; M11-Y21 HydrophobicContact CE-CD2 4.45Å; M11-Y21 HydrophobicContact CE-CG 4.49Å; M11-Y21 HydrophobicContact SD-CD2 4.48Å; M11-Y21 HydrophobicContact SD-CG 4.39Å |
| 12 | M | 46.8 | Very low | 59.2 | Low | 146 Ų | 146 | 105.7 Ų | 105.7 | 72% | 0.719 | 52% | 0.518 | S | S | * | . | G | 310 helix | trans | -78.7 | -21.4 | -171.8 | -159.8 | 175.1 | -178.6 | 0 | 0 | 114 | S10 | S10-M12 PolarHBondContact O-N 3.28Å; S10-M12 VanDerWaalsContact OG-CB 3.24Å; S10-M12 WeakPolarHBondContact OG-CB 3.47Å; S10-M12 PolarHBondContact OG-N 2.89Å |
| 13 | F | 49.5 | Very low | 60.7 | Low | 149 Ų | 149 | 102 Ų | 102 | 65% | 0.654 | 50% | 0.499 | S | S | * | . | G | 310 helix | trans | -106.5 | 18.7 | -176.8 | -71.5 | -75.7 | 0 | 0 | 0 | 114.4 | ||
| 14 | R | 60.6 | Low | 62.6 | Low | 10 Ų | 10 | 96.4 Ų | 96.4 | 4% | 0.038 | 47% | 0.47 | C | S | . | . | trans | -135.5 | 81.5 | -168.8 | -65.7 | -176.1 | 69.7 | 156.3 | 18.9 | 111.3 | S6 L16 S17 Q18 I65 S66 E69 | S6-R14 PolarHBondContact OG-NH1 3.28Å; R14-L16 PolarHBondContact O-N 2.93Å; R14-S17 PolarHBondContact NE-OG 3Å; R14-S17 PolarHBondContact O-N 2.94Å; R14-Q18 PolarHBondContact O-N 3.38Å; R14-I65 PolarHBondContact NH2-O 3.46Å; R14-S66 PolarHBondContact NH2-O 3.48Å; R14-E69 VanDerWaalsContact CA-OE1 3.24Å; R14-E69 WeakPolarHBondContact CA-OE1 3.47Å; R14-E69 VanDerWaalsContact CB-OE1 3.27Å; R14-E69 WeakPolarHBondContact CB-OE1 3.24Å; R14-E69 IonicContact CZ-OE2 3.13Å; R14-E69 IonicContact NE-OE2 2.67Å; R14-E69 PolarHBondContact NE-OE2 3.36Å; R14-E69 IonicContact NH2-OE2 2.76Å; R14-E69 PolarHBondContact NH2-OE2 3.27Å | ||
| 15 | P | 64.3 | Low | 64.8 | Low | 98 Ų | 98 | 90.7 Ų | 90.7 | 64% | 0.636 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -61.6 | -29.7 | -174.2 | 23.7 | -32.5 | 0 | 0 | 0 | 112.8 | S19 | P15-S19 PolarHBondContact O-N 3.17Å; P15-S19 VanDerWaalsContact O-N 3.13Å |
| 16 | L | 68.5 | Low | 66.4 | Low | 71 Ų | 71 | 85.3 Ų | 85.3 | 37% | 0.372 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -74.4 | -42.3 | 177.5 | -61.2 | 164.4 | 0 | 0 | 0 | 110.5 | R14 Q18 S19 L20 I65 E69 M72 | R14-L16 PolarHBondContact O-N 2.93Å; L16-Q18 VanDerWaalsContact C-N 3.32Å; L16-Q18 PolarHBondContact O-N 3.02Å; L16-S19 PolarHBondContact O-N 2.74Å; L16-S19 PolarHBondContact O-OG 3.04Å; L16-L20 PolarHBondContact O-N 3.35Å; L16-L20 VanDerWaalsContact O-N 3.1Å; L16-I65 HydrophobicContact CB-CG2 3.67Å; L16-E69 WeakPolarHBondContact CA-OE1 3.48Å; L16-E69 HydrophobicContact CB-CG 4.16Å; L16-E69 VanDerWaalsContact CB-OE1 3.29Å; L16-E69 WeakPolarHBondContact CB-OE1 3.42Å; L16-E69 HydrophobicContact CD1-CG 3.86Å; L16-E69 HydrophobicContact CG-CG 4.46Å; L16-E69 PolarHBondContact N-OE1 2.71Å; L16-M72 HydrophobicContact CD1-SD 4.45Å |
| 17 | S | 70.6 | Confident | 68.6 | Low | 11 Ų | 11 | 84.3 Ų | 84.3 | 8% | 0.077 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -62.7 | -36.2 | 173.9 | -69.7 | 0 | 0 | 0 | 0 | 113 | R14 L20 Y21 E69 | R14-S17 PolarHBondContact NE-OG 3Å; R14-S17 PolarHBondContact O-N 2.94Å; S17-L20 PolarHBondContact O-N 3.34Å; S17-Y21 PolarHBondContact O-N 3.37Å; S17-Y21 VanDerWaalsContact O-N 3.1Å; S17-E69 PolarHBondContact N-OE1 2.92Å; S17-E69 PolarHBondContact OG-OE2 3.47Å |
| 18 | Q | 72.9 | Confident | 70.4 | Confident | 81 Ų | 81 | 78.4 Ų | 78.4 | 38% | 0.379 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.8 | -42.3 | 173.5 | -76.1 | -178.2 | 3.5 | 0 | 0 | 112.2 | M11 R14 L16 L20 Y21 W22 | M11-Q18 HydrophobicContact CG-CG 4.36Å; M11-Q18 WeakPolarHBondContact O-CG 3.3Å; M11-Q18 PolarHBondContact O-NE2 2.93Å; R14-Q18 PolarHBondContact O-N 3.38Å; L16-Q18 VanDerWaalsContact C-N 3.32Å; L16-Q18 PolarHBondContact O-N 3.02Å; Q18-L20 VanDerWaalsContact C-N 3.31Å; Q18-L20 PolarHBondContact O-N 3.26Å; Q18-Y21 WeakPolarHBondContact O-CB 3.22Å; Q18-Y21 PolarHBondContact O-N 3.34Å; Q18-W22 VanDerWaalsContact O-CD1 3.3Å; Q18-W22 PolarHBondContact O-N 3.38Å; Q18-W22 VanDerWaalsContact O-N 3.1Å |
| 19 | S | 80.4 | Confident | 72.8 | Confident | 66 Ų | 66 | 81.7 Ų | 81.7 | 46% | 0.462 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.7 | -39.6 | 177.2 | 73.9 | 0 | 0 | 0 | 0 | 112.3 | P15 L16 Y21 W22 L23 | P15-S19 PolarHBondContact O-N 3.17Å; P15-S19 VanDerWaalsContact O-N 3.13Å; L16-S19 PolarHBondContact O-N 2.74Å; L16-S19 PolarHBondContact O-OG 3.04Å; S19-Y21 PolarHBondContact O-N 2.97Å; S19-W22 PolarHBondContact O-N 2.99Å; S19-L23 WeakPolarHBondContact O-CB 3.41Å; S19-L23 PolarHBondContact O-N 3.41Å |
| 20 | L | 80.9 | Confident | 74.6 | Confident | 11 Ų | 11 | 74.8 Ų | 74.8 | 6% | 0.058 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -63.4 | -39.4 | 173.9 | -84.9 | 179 | 0 | 0 | 0 | 113 | L16 S17 Q18 W22 L23 L24 T57 L61 I65 | L16-L20 PolarHBondContact O-N 3.35Å; L16-L20 VanDerWaalsContact O-N 3.1Å; S17-L20 PolarHBondContact O-N 3.34Å; Q18-L20 VanDerWaalsContact C-N 3.31Å; Q18-L20 PolarHBondContact O-N 3.26Å; L20-W22 VanDerWaalsContact C-N 3.34Å; L20-L23 PolarHBondContact O-N 2.95Å; L20-L24 PolarHBondContact O-N 3.47Å; L20-T57 HydrophobicContact CD2-CG2 4.2Å; L20-L61 HydrophobicContact CD1-CB 4.3Å; L20-L61 HydrophobicContact CD2-CB 3.76Å; L20-L61 HydrophobicContact CD2-CD2 3.62Å; L20-L61 HydrophobicContact CD2-CG 4.29Å; L20-I65 HydrophobicContact CD1-CB 3.59Å; L20-I65 HydrophobicContact CD1-CD1 3.26Å; L20-I65 HydrophobicContact CD1-CG1 3.8Å; L20-I65 HydrophobicContact CD1-CG2 3.88Å; L20-I65 HydrophobicContact CD2-CD1 3.88Å; L20-I65 HydrophobicContact CG-CD1 3.47Å; L20-I65 VanDerWaalsContact CG-CD1 3.47Å |
| 21 | Y | 80.9 | Confident | 76.6 | Confident | 126 Ų | 126 | 73.9 Ų | 73.9 | 49% | 0.494 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -62.4 | -44.4 | 177.2 | 178.1 | -96.6 | 0 | 0 | 0 | 111.2 | M11 S17 Q18 S19 L23 L24 A25 | M11-Y21 HydrophobicContact CE-CD2 4.45Å; M11-Y21 HydrophobicContact CE-CG 4.49Å; M11-Y21 HydrophobicContact SD-CD2 4.48Å; M11-Y21 HydrophobicContact SD-CG 4.39Å; S17-Y21 PolarHBondContact O-N 3.37Å; S17-Y21 VanDerWaalsContact O-N 3.1Å; Q18-Y21 WeakPolarHBondContact O-CB 3.22Å; Q18-Y21 PolarHBondContact O-N 3.34Å; S19-Y21 PolarHBondContact O-N 2.97Å; Y21-L23 VanDerWaalsContact C-N 3.33Å; Y21-L24 PolarHBondContact O-N 3.45Å; Y21-A25 WeakPolarHBondContact O-CB 3.49Å; Y21-A25 PolarHBondContact O-N 3.23Å |
| 22 | W | 83.1 | Confident | 78.4 | Confident | 186 Ų | 186 | 74.9 Ų | 74.9 | 71% | 0.705 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -65.8 | -36 | 175.1 | -79.6 | 106.6 | 0 | 0 | 0 | 112.7 | Q18 S19 L20 A25 A26 | Q18-W22 VanDerWaalsContact O-CD1 3.3Å; Q18-W22 PolarHBondContact O-N 3.38Å; Q18-W22 VanDerWaalsContact O-N 3.1Å; S19-W22 PolarHBondContact O-N 2.99Å; L20-W22 VanDerWaalsContact C-N 3.34Å; W22-A25 PolarHBondContact O-N 3.5Å; W22-A26 WeakPolarHBondContact O-CB 3.42Å; W22-A26 PolarHBondContact O-N 2.93Å |
| 23 | L | 85.5 | Confident | 80.4 | Confident | 85 Ų | 85 | 76.6 Ų | 76.6 | 45% | 0.445 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -62.8 | -44.6 | 173.4 | -168.7 | 153.4 | 0 | 0 | 0 | 111.3 | S19 L20 Y21 A26 D27 T57 | S19-L23 WeakPolarHBondContact O-CB 3.41Å; S19-L23 PolarHBondContact O-N 3.41Å; L20-L23 PolarHBondContact O-N 2.95Å; Y21-L23 VanDerWaalsContact C-N 3.33Å; L23-A26 PolarHBondContact O-N 3.18Å; L23-D27 WeakPolarHBondContact O-CB 3.42Å; L23-D27 PolarHBondContact O-N 3.43Å; L23-T57 HydrophobicContact CD2-CG2 4.19Å |
| 24 | L | 87.4 | Confident | 82.3 | Confident | 21 Ų | 21 | 70.7 Ų | 70.7 | 11% | 0.11 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -62.6 | -42.4 | 174.7 | -169.7 | 89 | 0 | 0 | 0 | 111.8 | L20 Y21 A26 D27 L28 Y54 T57 I58 | L20-L24 PolarHBondContact O-N 3.47Å; Y21-L24 PolarHBondContact O-N 3.45Å; L24-A26 VanDerWaalsContact C-N 3.33Å; L24-A26 PolarHBondContact O-N 3.02Å; L24-D27 PolarHBondContact O-N 2.71Å; L24-L28 WeakPolarHBondContact O-CG 3.27Å; L24-L28 PolarHBondContact O-N 3.4Å; L24-Y54 HydrophobicContact CD1-CD2 4.02Å; L24-Y54 HydrophobicContact CD1-CE2 3.91Å; L24-Y54 HydrophobicContact CG-CE2 4.41Å; L24-T57 HydrophobicContact CD1-CG2 4.04Å; L24-I58 HydrophobicContact CD1-CD1 3.92Å; L24-I58 HydrophobicContact CD1-CG1 3.55Å |
| 25 | A | 88.9 | Confident | 83.5 | Confident | 29 Ų | 29 | 73.5 Ų | 73.5 | 24% | 0.24 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -62.7 | -41.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y21 W22 L29 | Y21-A25 WeakPolarHBondContact O-CB 3.49Å; Y21-A25 PolarHBondContact O-N 3.23Å; W22-A25 PolarHBondContact O-N 3.5Å; A25-L29 WeakPolarHBondContact O-CG 3.38Å; A25-L29 PolarHBondContact O-N 3.49Å; A25-L29 VanDerWaalsContact O-N 3.12Å |
| 26 | A | 90.4 | Very high | 84.5 | Confident | 52 Ų | 52 | 72 Ų | 72 | 43% | 0.43 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.4 | -42.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112 | W22 L23 L24 L28 L29 V30 | W22-A26 WeakPolarHBondContact O-CB 3.42Å; W22-A26 PolarHBondContact O-N 2.93Å; L23-A26 PolarHBondContact O-N 3.18Å; L24-A26 VanDerWaalsContact C-N 3.33Å; L24-A26 PolarHBondContact O-N 3.02Å; A26-L28 PolarHBondContact O-N 2.85Å; A26-L29 WeakPolarHBondContact O-CB 3.33Å; A26-L29 PolarHBondContact O-N 3.19Å; A26-V30 WeakPolarHBondContact O-CG2 3.36Å; A26-V30 PolarHBondContact O-N 3.24Å |
| 27 | D | 89.6 | Confident | 85.3 | Confident | 15 Ų | 15 | 71.9 Ų | 71.9 | 8% | 0.08 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -63 | -40.2 | 178.2 | -170.6 | 73.8 | 0 | 0 | 0 | 112.2 | L23 L24 L29 V30 L31 Y54 | L23-D27 WeakPolarHBondContact O-CB 3.42Å; L23-D27 PolarHBondContact O-N 3.43Å; L24-D27 PolarHBondContact O-N 2.71Å; D27-L29 PolarHBondContact O-N 3.1Å; D27-V30 PolarHBondContact O-N 3.25Å; D27-L31 WeakPolarHBondContact O-CB 3.48Å; D27-L31 WeakPolarHBondContact O-CG 3.12Å; D27-L31 PolarHBondContact O-N 2.88Å; D27-Y54 WeakPolarHBondContact OD2-CA 3.27Å; D27-Y54 VanDerWaalsContact OD2-CB 3.22Å; D27-Y54 WeakPolarHBondContact OD2-CB 3.36Å |
| 28 | L | 89.3 | Confident | 85.8 | Confident | 73 Ų | 73 | 75.5 Ų | 75.5 | 38% | 0.382 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63 | -39.2 | 172.3 | -76.9 | 173.5 | 0 | 0 | 0 | 113 | L24 A26 V30 L31 T32 Y54 | L24-L28 WeakPolarHBondContact O-CG 3.27Å; L24-L28 PolarHBondContact O-N 3.4Å; A26-L28 PolarHBondContact O-N 2.85Å; L28-V30 VanDerWaalsContact C-N 3.34Å; L28-L31 PolarHBondContact O-N 3.41Å; L28-T32 WeakPolarHBondContact O-CB 3.15Å; L28-T32 PolarHBondContact O-N 2.63Å; L28-T32 PolarHBondContact O-OG1 2.76Å; L28-Y54 HydrophobicContact CD1-CE2 4.49Å; L28-Y54 HydrophobicContact CD2-CD2 4.13Å; L28-Y54 HydrophobicContact CD2-CE2 3.53Å; L28-Y54 HydrophobicContact CG-CD2 4.46Å; L28-Y54 HydrophobicContact CG-CE2 3.95Å |
| 29 | L | 92 | Very high | 86 | Confident | 128 Ų | 128 | 78 Ų | 78 | 67% | 0.67 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -64.2 | -41 | 174.6 | -71.9 | 172 | 0 | 0 | 0 | 111.1 | A25 A26 D27 T32 W33 | A25-L29 WeakPolarHBondContact O-CG 3.38Å; A25-L29 PolarHBondContact O-N 3.49Å; A25-L29 VanDerWaalsContact O-N 3.12Å; A26-L29 WeakPolarHBondContact O-CB 3.33Å; A26-L29 PolarHBondContact O-N 3.19Å; D27-L29 PolarHBondContact O-N 3.1Å; L29-T32 PolarHBondContact O-N 2.72Å; L29-W33 WeakPolarHBondContact O-CB 3.29Å; L29-W33 PolarHBondContact O-N 2.67Å |
| 30 | V | 87.9 | Confident | 86 | Confident | 66 Ų | 66 | 77.2 Ų | 77.2 | 40% | 0.4 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -64.8 | -44.7 | 176.2 | 172.1 | 0 | 0 | 0 | 0 | 111.2 | A26 D27 L28 T32 W33 I34 A50 | A26-V30 WeakPolarHBondContact O-CG2 3.36Å; A26-V30 PolarHBondContact O-N 3.24Å; D27-V30 PolarHBondContact O-N 3.25Å; L28-V30 VanDerWaalsContact C-N 3.34Å; V30-T32 PolarHBondContact O-N 3.22Å; V30-W33 WeakPolarHBondContact O-CB 3.49Å; V30-W33 PolarHBondContact O-N 3.28Å; V30-I34 HydrophobicContact CG1-CD1 3.66Å; V30-I34 HydrophobicContact CG1-CG1 4.44Å; V30-I34 VanDerWaalsContact O-CG1 3.27Å; V30-I34 WeakPolarHBondContact O-CG1 3.27Å; V30-I34 PolarHBondContact O-N 3.47Å; V30-A50 HydrophobicContact CG1-CB 4.44Å |
| 31 | L | 87.6 | Confident | 86 | Confident | 42 Ų | 42 | 86 Ų | 86 | 22% | 0.22 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -61.4 | -42.7 | 175.4 | -80.3 | 159.5 | 0 | 0 | 0 | 112.1 | D27 L28 W33 I34 G35 A50 Y54 | D27-L31 WeakPolarHBondContact O-CB 3.48Å; D27-L31 WeakPolarHBondContact O-CG 3.12Å; D27-L31 PolarHBondContact O-N 2.88Å; L28-L31 PolarHBondContact O-N 3.41Å; L31-W33 VanDerWaalsContact C-N 3.34Å; L31-W33 PolarHBondContact O-N 3.2Å; L31-I34 PolarHBondContact O-N 3.36Å; L31-G35 PolarHBondContact O-N 2.88Å; L31-A50 HydrophobicContact CD2-CB 3.92Å; L31-A50 HydrophobicContact CG-CB 4Å; L31-Y54 HydrophobicContact CD1-CD2 4.21Å; L31-Y54 HydrophobicContact CD1-CG 4.27Å |
| 32 | T | 89.2 | Confident | 85.9 | Confident | 107 Ų | 107 | 82.9 Ų | 82.9 | 66% | 0.656 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -63.3 | -41.9 | 176.6 | -54.9 | 0 | 0 | 0 | 0 | 111.1 | L28 L29 V30 G35 | L28-T32 WeakPolarHBondContact O-CB 3.15Å; L28-T32 PolarHBondContact O-N 2.63Å; L28-T32 PolarHBondContact O-OG1 2.76Å; L29-T32 PolarHBondContact O-N 2.72Å; V30-T32 PolarHBondContact O-N 3.22Å; T32-G35 PolarHBondContact O-N 3.44Å |
| 33 | W | 88.1 | Confident | 86 | Confident | 181 Ų | 181 | 77.1 Ų | 77.1 | 69% | 0.686 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -62.2 | -46.7 | 175.9 | -177.7 | -83.1 | 0 | 0 | 0 | 111.9 | L29 V30 L31 G35 G36 | L29-W33 WeakPolarHBondContact O-CB 3.29Å; L29-W33 PolarHBondContact O-N 2.67Å; V30-W33 WeakPolarHBondContact O-CB 3.49Å; V30-W33 PolarHBondContact O-N 3.28Å; L31-W33 VanDerWaalsContact C-N 3.34Å; L31-W33 PolarHBondContact O-N 3.2Å; W33-G35 VanDerWaalsContact C-N 3.33Å; W33-G35 PolarHBondContact O-N 2.68Å; W33-G36 PolarHBondContact O-N 2.95Å |
| 34 | I | 89.6 | Confident | 86 | Confident | 25 Ų | 25 | 75.7 Ų | 75.7 | 13% | 0.128 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -67.5 | -34.4 | -179.2 | -67.1 | 166.2 | 0 | 0 | 0 | 111.5 | V30 L31 G36 Q37 I46 | V30-I34 HydrophobicContact CG1-CD1 3.66Å; V30-I34 HydrophobicContact CG1-CG1 4.44Å; V30-I34 VanDerWaalsContact O-CG1 3.27Å; V30-I34 WeakPolarHBondContact O-CG1 3.27Å; V30-I34 PolarHBondContact O-N 3.47Å; L31-I34 PolarHBondContact O-N 3.36Å; I34-G36 PolarHBondContact O-N 3.09Å; I34-Q37 PolarHBondContact O-N 3.13Å; I34-I46 HydrophobicContact CD1-CB 3.94Å; I34-I46 HydrophobicContact CD1-CG2 3.4Å; I34-I46 VanDerWaalsContact CD1-CG2 3.4Å; I34-I46 HydrophobicContact CG1-CG2 4.46Å |
| 35 | G | 86.3 | Confident | 86.1 | Confident | 70 Ų | 70 | 78.6 Ų | 78.6 | 72% | 0.722 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -61 | -23.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | L31 T32 W33 | L31-G35 PolarHBondContact O-N 2.88Å; T32-G35 PolarHBondContact O-N 3.44Å; W33-G35 VanDerWaalsContact C-N 3.33Å; W33-G35 PolarHBondContact O-N 2.68Å |
| 36 | G | 85.7 | Confident | 86 | Confident | 67 Ų | 67 | 80.9 Ų | 80.9 | 69% | 0.691 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.1 | -8.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | W33 I34 | W33-G36 PolarHBondContact O-N 2.95Å; I34-G36 PolarHBondContact O-N 3.09Å |
| 37 | Q | 84.4 | Confident | 85.9 | Confident | 68 Ų | 68 | 79 Ų | 79 | 32% | 0.318 | 45% | 0.447 | S | S | . | . | S | Bend | trans | -88.3 | 148.8 | 179.3 | -65.6 | -59.4 | -46.5 | 0 | 0 | 111 | I34 V39 F43 | I34-Q37 PolarHBondContact O-N 3.13Å; Q37-V39 PolarHBondContact O-N 2.98Å; Q37-F43 HydrophobicContact CB-CD1 4.41Å; Q37-F43 HydrophobicContact CB-CD2 4.37Å; Q37-F43 HydrophobicContact CB-CG 4.19Å; Q37-F43 HydrophobicContact CG-CD1 4.37Å; Q37-F43 HydrophobicContact CG-CE1 4.41Å |
| 38 | P | 81.7 | Confident | 85.9 | Confident | 86 Ų | 86 | 84.1 Ų | 84.1 | 56% | 0.558 | 47% | 0.471 | S | S | * | . | trans | -61.6 | 138.6 | 173.6 | 26.2 | -33.2 | 0 | 0 | 0 | 110.1 | S40 | P38-S40 PolarHBondContact O-N 3.44Å; P38-S40 PolarHBondContact O-OG 3.28Å | ||
| 39 | V | 77.4 | Confident | 86 | Confident | 133 Ų | 133 | 84.5 Ų | 84.5 | 81% | 0.806 | 48% | 0.476 | S | S | * | . | S | Bend | trans | -70.2 | 75.6 | 179.1 | -169.9 | 0 | 0 | 0 | 0 | 109.7 | Q37 | Q37-V39 PolarHBondContact O-N 2.98Š|
| 40 | S | 79.9 | Confident | 85.8 | Confident | 50 Ų | 50 | 78.6 Ų | 78.6 | 35% | 0.35 | 45% | 0.446 | S | S | . | . | trans | -127.5 | 150.4 | -179.7 | 54.9 | 0 | 0 | 0 | 0 | 109 | P38 F43 | P38-S40 PolarHBondContact O-N 3.44Å; P38-S40 PolarHBondContact O-OG 3.28Å; S40-F43 PolarHBondContact O-N 2.66Å | ||
| 41 | Y | 80.5 | Confident | 85.9 | Confident | 195 Ų | 195 | 77.8 Ų | 77.8 | 77% | 0.765 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.9 | 126.7 | 169.8 | -175.8 | -89.8 | 0 | 0 | 0 | 108.3 | I45 | Y41-I45 HydrophobicContact CD2-CD1 4.03Å; Y41-I45 HydrophobicContact CE2-CD1 3.5Å; Y41-I45 VanDerWaalsContact CE2-CD1 3.5Å |
| 42 | P | 80.3 | Confident | 86.2 | Confident | 61 Ų | 61 | 80.3 Ų | 80.3 | 40% | 0.396 | 46% | 0.46 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -103 | -0.4 | 16.8 | 38.1 | -35.3 | 0 | 0 | 0 | 116.2 | T44 I45 I46 | P42-T44 VanDerWaalsContact C-N 3.26Å; P42-T44 PolarHBondContact O-N 3.24Å; P42-I45 PolarHBondContact O-N 3.41Å; P42-I45 VanDerWaalsContact O-N 3.14Å; P42-I46 PolarHBondContact O-N 3.13Å |
| 43 | F | 84.6 | Confident | 86.2 | Confident | 65 Ų | 65 | 79.4 Ų | 79.4 | 29% | 0.285 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -63.2 | -29.4 | -172.1 | -60.6 | -67.1 | 0 | 0 | 0 | 113.7 | Q37 S40 I45 I46 G47 | Q37-F43 HydrophobicContact CB-CD1 4.41Å; Q37-F43 HydrophobicContact CB-CD2 4.37Å; Q37-F43 HydrophobicContact CB-CG 4.19Å; Q37-F43 HydrophobicContact CG-CD1 4.37Å; Q37-F43 HydrophobicContact CG-CE1 4.41Å; S40-F43 PolarHBondContact O-N 2.66Å; F43-I45 VanDerWaalsContact C-N 3.34Å; F43-I45 PolarHBondContact O-N 3.03Å; F43-I46 HydrophobicContact CD1-CD1 4.45Å; F43-I46 PolarHBondContact O-N 3.36Å; F43-G47 PolarHBondContact O-N 3.42Å |
| 44 | T | 84.9 | Confident | 86.2 | Confident | 55 Ų | 55 | 74.1 Ų | 74.1 | 34% | 0.337 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -59.8 | -41.9 | 174.9 | -50.3 | 0 | 0 | 0 | 0 | 112.4 | P42 G47 Q48 | P42-T44 VanDerWaalsContact C-N 3.26Å; P42-T44 PolarHBondContact O-N 3.24Å; T44-G47 PolarHBondContact O-N 3.07Å; T44-Q48 WeakPolarHBondContact O-CG 3.24Å; T44-Q48 PolarHBondContact O-N 3.33Å; T44-Q48 VanDerWaalsContact O-N 3.09Å |
| 45 | I | 89.2 | Confident | 86.1 | Confident | 82 Ų | 82 | 79 Ų | 79 | 42% | 0.421 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -70.6 | -41.9 | -179.8 | -65.6 | 175.6 | 0 | 0 | 0 | 110.1 | Y41 P42 F43 G47 Q48 V49 | Y41-I45 HydrophobicContact CD2-CD1 4.03Å; Y41-I45 HydrophobicContact CE2-CD1 3.5Å; Y41-I45 VanDerWaalsContact CE2-CD1 3.5Å; P42-I45 PolarHBondContact O-N 3.41Å; P42-I45 VanDerWaalsContact O-N 3.14Å; F43-I45 VanDerWaalsContact C-N 3.34Å; F43-I45 PolarHBondContact O-N 3.03Å; I45-G47 VanDerWaalsContact C-N 3.3Å; I45-G47 PolarHBondContact O-N 3.36Å; I45-Q48 PolarHBondContact O-N 2.94Å; I45-V49 HydrophobicContact CG2-CG2 4.34Å; I45-V49 WeakPolarHBondContact O-CG2 3.27Å; I45-V49 PolarHBondContact O-N 3.5Å |
| 46 | I | 87.8 | Confident | 86.3 | Confident | 78 Ų | 78 | 78 Ų | 78 | 40% | 0.4 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.2 | -41.7 | 178.1 | -53 | 173.5 | 0 | 0 | 0 | 110 | I34 P42 F43 Q48 V49 A50 | I34-I46 HydrophobicContact CD1-CB 3.94Å; I34-I46 HydrophobicContact CD1-CG2 3.4Å; I34-I46 VanDerWaalsContact CD1-CG2 3.4Å; I34-I46 HydrophobicContact CG1-CG2 4.46Å; P42-I46 PolarHBondContact O-N 3.13Å; F43-I46 HydrophobicContact CD1-CD1 4.45Å; F43-I46 PolarHBondContact O-N 3.36Å; I46-Q48 PolarHBondContact O-N 3.41Å; I46-V49 PolarHBondContact O-N 3.24Å; I46-A50 VanDerWaalsContact O-CB 3.25Å; I46-A50 WeakPolarHBondContact O-CB 3.4Å; I46-A50 PolarHBondContact O-N 3.14Å |
| 47 | G | 88.5 | Confident | 86.2 | Confident | 12 Ų | 12 | 75 Ų | 75 | 12% | 0.124 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -64.2 | -38.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | F43 T44 I45 S51 | F43-G47 PolarHBondContact O-N 3.42Å; T44-G47 PolarHBondContact O-N 3.07Å; I45-G47 VanDerWaalsContact C-N 3.3Å; I45-G47 PolarHBondContact O-N 3.36Å; G47-S51 WeakPolarHBondContact O-CB 3.24Å; G47-S51 PolarHBondContact O-N 3.48Å; G47-S51 PolarHBondContact O-OG 2.86Å |
| 48 | Q | 88.1 | Confident | 86.2 | Confident | 122 Ų | 122 | 73.9 Ų | 73.9 | 57% | 0.57 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -65.5 | -47.6 | 174.7 | -74.7 | 176.2 | -2.7 | 0 | 0 | 111.7 | T44 I45 I46 S51 V52 | T44-Q48 WeakPolarHBondContact O-CG 3.24Å; T44-Q48 PolarHBondContact O-N 3.33Å; T44-Q48 VanDerWaalsContact O-N 3.09Å; I45-Q48 PolarHBondContact O-N 2.94Å; I46-Q48 PolarHBondContact O-N 3.41Å; Q48-S51 PolarHBondContact O-N 3.09Å; Q48-V52 WeakPolarHBondContact O-CG2 3.29Å; Q48-V52 PolarHBondContact O-N 3.29Å |
| 49 | V | 91.8 | Very high | 86.3 | Confident | 81 Ų | 81 | 75 Ų | 75 | 49% | 0.491 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62.7 | -44.4 | 178.2 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | I45 I46 S51 V52 L53 | I45-V49 HydrophobicContact CG2-CG2 4.34Å; I45-V49 WeakPolarHBondContact O-CG2 3.27Å; I45-V49 PolarHBondContact O-N 3.5Å; I46-V49 PolarHBondContact O-N 3.24Å; V49-S51 VanDerWaalsContact C-N 3.34Å; V49-S51 PolarHBondContact O-N 2.93Å; V49-V52 PolarHBondContact O-N 3.44Å; V49-L53 HydrophobicContact CG1-CD1 3.97Å; V49-L53 HydrophobicContact CG1-CG 4.45Å; V49-L53 WeakPolarHBondContact O-CB 3.49Å; V49-L53 WeakPolarHBondContact O-CG 3.41Å; V49-L53 PolarHBondContact O-N 3.4Å |
| 50 | A | 89.3 | Confident | 86.6 | Confident | 4 Ų | 4 | 73.3 Ų | 73.3 | 3% | 0.033 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -61.2 | -42.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | V30 L31 I46 V52 L53 Y54 | V30-A50 HydrophobicContact CG1-CB 4.44Å; L31-A50 HydrophobicContact CD2-CB 3.92Å; L31-A50 HydrophobicContact CG-CB 4Å; I46-A50 VanDerWaalsContact O-CB 3.25Å; I46-A50 WeakPolarHBondContact O-CB 3.4Å; I46-A50 PolarHBondContact O-N 3.14Å; A50-V52 PolarHBondContact O-N 3.46Å; A50-L53 WeakPolarHBondContact O-CB 3.48Å; A50-L53 PolarHBondContact O-N 3.49Å; A50-Y54 WeakPolarHBondContact O-CB 3.36Å; A50-Y54 PolarHBondContact O-N 3.19Å |
| 51 | S | 89.3 | Confident | 86.7 | Confident | 50 Ų | 50 | 73.6 Ų | 73.6 | 35% | 0.35 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -64 | -41.5 | 177.1 | -60.3 | 0 | 0 | 0 | 0 | 112.2 | G47 Q48 V49 Y54 F55 | G47-S51 WeakPolarHBondContact O-CB 3.24Å; G47-S51 PolarHBondContact O-N 3.48Å; G47-S51 PolarHBondContact O-OG 2.86Å; Q48-S51 PolarHBondContact O-N 3.09Å; V49-S51 VanDerWaalsContact C-N 3.34Å; V49-S51 PolarHBondContact O-N 2.93Å; S51-Y54 WeakPolarHBondContact O-CB 3.36Å; S51-Y54 PolarHBondContact O-N 3.1Å; S51-F55 VanDerWaalsContact O-CD2 3.31Å; S51-F55 WeakPolarHBondContact O-CD2 3.49Å; S51-F55 PolarHBondContact O-N 3.43Å |
| 52 | V | 93.1 | Very high | 86.7 | Confident | 95 Ų | 95 | 67.7 Ų | 67.7 | 58% | 0.576 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -64.2 | -42.1 | 174.7 | 172.4 | 0 | 0 | 0 | 0 | 110.7 | Q48 V49 A50 T56 | Q48-V52 WeakPolarHBondContact O-CG2 3.29Å; Q48-V52 PolarHBondContact O-N 3.29Å; V49-V52 PolarHBondContact O-N 3.44Å; A50-V52 PolarHBondContact O-N 3.46Å; V52-T56 VanDerWaalsContact O-CB 3.24Å; V52-T56 WeakPolarHBondContact O-CB 3.44Å; V52-T56 PolarHBondContact O-N 3.46Å; V52-T56 PolarHBondContact O-OG1 2.99Å |
| 53 | L | 89.3 | Confident | 86.6 | Confident | 88 Ų | 88 | 68 Ų | 68 | 46% | 0.461 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -61.6 | -43.3 | 175.6 | -79.4 | 170 | 0 | 0 | 0 | 112 | V49 A50 T56 T57 | V49-L53 HydrophobicContact CG1-CD1 3.97Å; V49-L53 HydrophobicContact CG1-CG 4.45Å; V49-L53 WeakPolarHBondContact O-CB 3.49Å; V49-L53 WeakPolarHBondContact O-CG 3.41Å; V49-L53 PolarHBondContact O-N 3.4Å; A50-L53 WeakPolarHBondContact O-CB 3.48Å; A50-L53 PolarHBondContact O-N 3.49Å; L53-T56 PolarHBondContact O-N 3.32Å; L53-T57 VanDerWaalsContact O-CB 3.27Å; L53-T57 WeakPolarHBondContact O-CB 3.46Å; L53-T57 PolarHBondContact O-N 2.89Å; L53-T57 PolarHBondContact O-OG1 3.29Å |
| 54 | Y | 88.8 | Confident | 86.5 | Confident | 69 Ų | 69 | 67.9 Ų | 67.9 | 27% | 0.271 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -55 | -56 | 176.2 | -176.4 | -103 | 0 | 0 | 0 | 111.9 | L24 D27 L28 L31 A50 S51 T56 T57 I58 | L24-Y54 HydrophobicContact CD1-CD2 4.02Å; L24-Y54 HydrophobicContact CD1-CE2 3.91Å; L24-Y54 HydrophobicContact CG-CE2 4.41Å; D27-Y54 WeakPolarHBondContact OD2-CA 3.27Å; D27-Y54 VanDerWaalsContact OD2-CB 3.22Å; D27-Y54 WeakPolarHBondContact OD2-CB 3.36Å; L28-Y54 HydrophobicContact CD1-CE2 4.49Å; L28-Y54 HydrophobicContact CD2-CD2 4.13Å; L28-Y54 HydrophobicContact CD2-CE2 3.53Å; L28-Y54 HydrophobicContact CG-CD2 4.46Å; L28-Y54 HydrophobicContact CG-CE2 3.95Å; L31-Y54 HydrophobicContact CD1-CD2 4.21Å; L31-Y54 HydrophobicContact CD1-CG 4.27Å; A50-Y54 WeakPolarHBondContact O-CB 3.36Å; A50-Y54 PolarHBondContact O-N 3.19Å; S51-Y54 WeakPolarHBondContact O-CB 3.36Å; S51-Y54 PolarHBondContact O-N 3.1Å; Y54-T56 PolarHBondContact O-N 3.1Å; Y54-T57 PolarHBondContact O-N 3.2Å; Y54-I58 HydrophobicContact CD1-CD1 4.25Å; Y54-I58 HydrophobicContact CD2-CD1 4.42Å; Y54-I58 HydrophobicContact CE1-CD1 3.6Å; Y54-I58 HydrophobicContact CE2-CD1 3.79Å; Y54-I58 PolarHBondContact O-N 3Å; Y54-I58 VanDerWaalsContact O-N 3.13Å; Y54-I58 WeakPolarHBondContact OH-CD1 3.49Å |
| 55 | F | 88.3 | Confident | 86.3 | Confident | 127 Ų | 127 | 66.7 Ų | 66.7 | 56% | 0.557 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -64.8 | -41.1 | -179.3 | -81.8 | -72.1 | 0 | 0 | 0 | 112.2 | S51 T57 I58 L59 | S51-F55 VanDerWaalsContact O-CD2 3.31Å; S51-F55 WeakPolarHBondContact O-CD2 3.49Å; S51-F55 PolarHBondContact O-N 3.43Å; F55-T57 VanDerWaalsContact C-N 3.3Å; F55-T57 PolarHBondContact O-N 3.33Å; F55-I58 PolarHBondContact O-N 3.44Å; F55-L59 HydrophobicContact CD1-CD1 4.35Å; F55-L59 VanDerWaalsContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CB 3.25Å; F55-L59 WeakPolarHBondContact O-CG 3.39Å; F55-L59 PolarHBondContact O-N 2.8Å |
| 56 | T | 89.3 | Confident | 85.6 | Confident | 50 Ų | 50 | 63.9 Ų | 63.9 | 31% | 0.307 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -62.5 | -39.9 | 177.4 | -57.8 | 0 | 0 | 0 | 0 | 111.1 | V52 L53 Y54 I60 L61 | V52-T56 VanDerWaalsContact O-CB 3.24Å; V52-T56 WeakPolarHBondContact O-CB 3.44Å; V52-T56 PolarHBondContact O-N 3.46Å; V52-T56 PolarHBondContact O-OG1 2.99Å; L53-T56 PolarHBondContact O-N 3.32Å; Y54-T56 PolarHBondContact O-N 3.1Å; T56-I60 HydrophobicContact CG2-CB 4.45Å; T56-I60 HydrophobicContact CG2-CD1 4.31Å; T56-I60 WeakPolarHBondContact O-CA 3.46Å; T56-I60 WeakPolarHBondContact O-CB 3.39Å; T56-I60 PolarHBondContact O-N 3.29Å; T56-L61 HydrophobicContact CG2-CD1 3.88Å; T56-L61 PolarHBondContact O-N 2.96Å; T56-L61 VanDerWaalsContact O-N 3.09Å |
| 57 | T | 84.9 | Confident | 85 | Confident | 4 Ų | 4 | 65.1 Ų | 65.1 | 3% | 0.025 | 35% | 0.352 | C | S | . | . | I | π-helix | trans | -65.4 | -45.9 | -179.7 | -60 | 0 | 0 | 0 | 0 | 111.4 | L20 L23 L24 L53 Y54 F55 L61 M62 | L20-T57 HydrophobicContact CD2-CG2 4.2Å; L23-T57 HydrophobicContact CD2-CG2 4.19Å; L24-T57 HydrophobicContact CD1-CG2 4.04Å; L53-T57 VanDerWaalsContact O-CB 3.27Å; L53-T57 WeakPolarHBondContact O-CB 3.46Å; L53-T57 PolarHBondContact O-N 2.89Å; L53-T57 PolarHBondContact O-OG1 3.29Å; Y54-T57 PolarHBondContact O-N 3.2Å; F55-T57 VanDerWaalsContact C-N 3.3Å; F55-T57 PolarHBondContact O-N 3.33Å; T57-L61 WeakPolarHBondContact O-CB 3.38Å; T57-L61 PolarHBondContact O-N 3.19Å; T57-M62 PolarHBondContact O-N 2.91Å |
| 58 | I | 83.4 | Confident | 84.6 | Confident | 45 Ų | 45 | 68.6 Ų | 68.6 | 23% | 0.231 | 37% | 0.367 | C | S | . | . | I | π-helix | trans | -73.3 | -46.4 | -179.7 | -65.2 | 179.8 | 0 | 0 | 0 | 112 | L24 Y54 F55 M62 | L24-I58 HydrophobicContact CD1-CD1 3.92Å; L24-I58 HydrophobicContact CD1-CG1 3.55Å; Y54-I58 HydrophobicContact CD1-CD1 4.25Å; Y54-I58 HydrophobicContact CD2-CD1 4.42Å; Y54-I58 HydrophobicContact CE1-CD1 3.6Å; Y54-I58 HydrophobicContact CE2-CD1 3.79Å; Y54-I58 PolarHBondContact O-N 3Å; Y54-I58 VanDerWaalsContact O-N 3.13Å; Y54-I58 WeakPolarHBondContact OH-CD1 3.49Å; F55-I58 PolarHBondContact O-N 3.44Å; I58-M62 WeakPolarHBondContact O-CB 3.46Å |
| 59 | L | 82.8 | Confident | 83.9 | Confident | 110 Ų | 110 | 63.1 Ų | 63.1 | 58% | 0.576 | 34% | 0.341 | S | S | * | . | I | π-helix | trans | -82 | -33.2 | -172.4 | -68.1 | 174.4 | 0 | 0 | 0 | 113.2 | F55 P63 | F55-L59 HydrophobicContact CD1-CD1 4.35Å; F55-L59 VanDerWaalsContact O-CB 3.29Å; F55-L59 WeakPolarHBondContact O-CB 3.25Å; F55-L59 WeakPolarHBondContact O-CG 3.39Å; F55-L59 PolarHBondContact O-N 2.8Å; L59-P63 WeakPolarHBondContact O-CD 3.4Å; L59-P63 WeakPolarHBondContact O-CG 3.22Å |
| 60 | I | 84.6 | Confident | 83 | Confident | 97 Ų | 97 | 61.5 Ų | 61.5 | 50% | 0.497 | 33% | 0.33 | S | S | . | . | I | π-helix | trans | -112.9 | -51.7 | -171.7 | -52.8 | -175.8 | 0 | 0 | 0 | 111.4 | T56 P63 T64 | T56-I60 HydrophobicContact CG2-CB 4.45Å; T56-I60 HydrophobicContact CG2-CD1 4.31Å; T56-I60 WeakPolarHBondContact O-CA 3.46Å; T56-I60 WeakPolarHBondContact O-CB 3.39Å; T56-I60 PolarHBondContact O-N 3.29Å; I60-P63 VanDerWaalsContact O-CD 3.27Å; I60-P63 WeakPolarHBondContact O-CD 3.31Å; I60-P63 WeakPolarHBondContact O-CG 3.46Å; I60-T64 HydrophobicContact CG2-CG2 4.34Å; I60-T64 WeakPolarHBondContact O-CB 3.44Å; I60-T64 WeakPolarHBondContact O-CG2 3.27Å; I60-T64 PolarHBondContact O-N 2.87Å; I60-T64 PolarHBondContact O-OG1 2.93Å |
| 61 | L | 81.6 | Confident | 82.2 | Confident | 56 Ų | 56 | 68.6 Ų | 68.6 | 29% | 0.293 | 36% | 0.36 | S | S | . | . | I | π-helix | trans | -69.8 | -40.5 | -174.7 | -82.8 | 69.8 | 0 | 0 | 0 | 112.2 | L20 T56 T57 T64 I65 | L20-L61 HydrophobicContact CD1-CB 4.3Å; L20-L61 HydrophobicContact CD2-CB 3.76Å; L20-L61 HydrophobicContact CD2-CD2 3.62Å; L20-L61 HydrophobicContact CD2-CG 4.29Å; T56-L61 HydrophobicContact CG2-CD1 3.88Å; T56-L61 PolarHBondContact O-N 2.96Å; T56-L61 VanDerWaalsContact O-N 3.09Å; T57-L61 WeakPolarHBondContact O-CB 3.38Å; T57-L61 PolarHBondContact O-N 3.19Å; L61-T64 VanDerWaalsContact CA-OG1 3.3Å; L61-T64 WeakPolarHBondContact CA-OG1 3.38Å; L61-T64 PolarHBondContact O-N 3.4Å; L61-T64 PolarHBondContact O-OG1 3.24Å; L61-I65 WeakPolarHBondContact O-CB 3.5Å; L61-I65 PolarHBondContact O-N 2.87Å |
| 62 | M | 81.6 | Confident | 81.2 | Confident | 71 Ų | 71 | 72.8 Ų | 72.8 | 35% | 0.35 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -56.4 | -53.3 | 176.8 | -87.9 | -162.8 | 175.5 | 0 | 0 | 113.4 | T57 I58 S66 | T57-M62 PolarHBondContact O-N 2.91Å; I58-M62 WeakPolarHBondContact O-CB 3.46Å; M62-S66 WeakPolarHBondContact O-CB 3.5Å; M62-S66 PolarHBondContact O-N 3.47Å; M62-S66 PolarHBondContact O-OG 2.82Å |
| 63 | P | 77.9 | Confident | 80.1 | Confident | 66 Ų | 66 | 72.5 Ų | 72.5 | 43% | 0.429 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -69.6 | -33.2 | 179.5 | 24.4 | -32.7 | 0 | 0 | 0 | 113.2 | L59 I60 S66 L67 | L59-P63 WeakPolarHBondContact O-CD 3.4Å; L59-P63 WeakPolarHBondContact O-CG 3.22Å; I60-P63 VanDerWaalsContact O-CD 3.27Å; I60-P63 WeakPolarHBondContact O-CD 3.31Å; I60-P63 WeakPolarHBondContact O-CG 3.46Å; P63-S66 WeakPolarHBondContact O-CB 3.42Å; P63-S66 PolarHBondContact O-N 2.96Å; P63-L67 PolarHBondContact O-N 2.92Å |
| 64 | T | 81.4 | Confident | 78.6 | Confident | 63 Ų | 63 | 77.3 Ų | 77.3 | 39% | 0.387 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -70.2 | -48.1 | -179.7 | 51.2 | 0 | 0 | 0 | 0 | 112.1 | I60 L61 S66 L67 I68 | I60-T64 HydrophobicContact CG2-CG2 4.34Å; I60-T64 WeakPolarHBondContact O-CB 3.44Å; I60-T64 WeakPolarHBondContact O-CG2 3.27Å; I60-T64 PolarHBondContact O-N 2.87Å; I60-T64 PolarHBondContact O-OG1 2.93Å; L61-T64 VanDerWaalsContact CA-OG1 3.3Å; L61-T64 WeakPolarHBondContact CA-OG1 3.38Å; L61-T64 PolarHBondContact O-N 3.4Å; L61-T64 PolarHBondContact O-OG1 3.24Å; T64-S66 PolarHBondContact O-N 3.24Å; T64-L67 WeakPolarHBondContact O-CB 3.43Å; T64-L67 PolarHBondContact O-N 3.5Å; T64-I68 VanDerWaalsContact O-CG1 3.27Å; T64-I68 WeakPolarHBondContact O-CG1 3.45Å; T64-I68 PolarHBondContact O-N 3.35Å |
| 65 | I | 81.1 | Confident | 77.1 | Confident | 30 Ų | 30 | 81.5 Ų | 81.5 | 15% | 0.154 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -64.3 | -33.4 | 172.6 | -71.4 | -176.7 | 0 | 0 | 0 | 110.1 | R14 L16 L20 L61 L67 I68 E69 | R14-I65 PolarHBondContact NH2-O 3.46Å; L16-I65 HydrophobicContact CB-CG2 3.67Å; L20-I65 HydrophobicContact CD1-CB 3.59Å; L20-I65 HydrophobicContact CD1-CD1 3.26Å; L20-I65 HydrophobicContact CD1-CG1 3.8Å; L20-I65 HydrophobicContact CD1-CG2 3.88Å; L20-I65 HydrophobicContact CD2-CD1 3.88Å; L20-I65 HydrophobicContact CG-CD1 3.47Å; L20-I65 VanDerWaalsContact CG-CD1 3.47Å; L61-I65 WeakPolarHBondContact O-CB 3.5Å; L61-I65 PolarHBondContact O-N 2.87Å; I65-L67 VanDerWaalsContact C-N 3.31Å; I65-L67 PolarHBondContact O-N 3.33Å; I65-I68 PolarHBondContact O-N 2.91Å; I65-E69 HydrophobicContact CG2-CG 4.44Å; I65-E69 PolarHBondContact O-N 3.15Å |
| 66 | S | 74.4 | Confident | 75 | Confident | 24 Ų | 24 | 83.9 Ų | 83.9 | 17% | 0.168 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -55.9 | -47 | 173.3 | -69.1 | 0 | 0 | 0 | 0 | 112.4 | R14 M62 P63 T64 N70 | R14-S66 PolarHBondContact NH2-O 3.48Å; M62-S66 WeakPolarHBondContact O-CB 3.5Å; M62-S66 PolarHBondContact O-N 3.47Å; M62-S66 PolarHBondContact O-OG 2.82Å; P63-S66 WeakPolarHBondContact O-CB 3.42Å; P63-S66 PolarHBondContact O-N 2.96Å; T64-S66 PolarHBondContact O-N 3.24Å; S66-N70 PolarHBondContact O-N 2.97Å; S66-N70 PolarHBondContact O-ND2 3.18Å; S66-N70 PolarHBondContact O-OD1 3.31Å |
| 67 | L | 76.6 | Confident | 74.2 | Confident | 103 Ų | 103 | 85.6 Ų | 85.6 | 54% | 0.539 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -70.4 | -41.3 | 179.3 | -167 | 101.4 | 0 | 0 | 0 | 112.8 | P63 T64 I65 N70 K71 | P63-L67 PolarHBondContact O-N 2.92Å; T64-L67 WeakPolarHBondContact O-CB 3.43Å; T64-L67 PolarHBondContact O-N 3.5Å; I65-L67 VanDerWaalsContact C-N 3.31Å; I65-L67 PolarHBondContact O-N 3.33Å; L67-N70 PolarHBondContact O-N 2.91Å; L67-K71 HydrophobicContact CD2-CD 4.43Å; L67-K71 WeakPolarHBondContact O-CG 3.39Å; L67-K71 PolarHBondContact O-N 3.12Å |
| 68 | I | 79.8 | Confident | 73.7 | Confident | 85 Ų | 85 | 89.8 Ų | 89.8 | 44% | 0.436 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.5 | -47.6 | -178.8 | -69.8 | 164.3 | 0 | 0 | 0 | 110.5 | T64 I65 N70 K71 M72 | T64-I68 VanDerWaalsContact O-CG1 3.27Å; T64-I68 WeakPolarHBondContact O-CG1 3.45Å; T64-I68 PolarHBondContact O-N 3.35Å; I65-I68 PolarHBondContact O-N 2.91Å; I68-N70 PolarHBondContact O-N 3.28Å; I68-K71 PolarHBondContact O-N 2.93Å; I68-M72 HydrophobicContact CG2-SD 4.29Å; I68-M72 PolarHBondContact O-N 3.47Å |
| 69 | E | 73.3 | Confident | 73.1 | Confident | 8 Ų | 8 | 92.3 Ų | 92.3 | 4% | 0.037 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -67.4 | -35.6 | 178.4 | -79.5 | 176.4 | 140 | 0 | 0 | 111.9 | R14 L16 S17 I65 K71 M72 L73 | R14-E69 VanDerWaalsContact CA-OE1 3.24Å; R14-E69 WeakPolarHBondContact CA-OE1 3.47Å; R14-E69 VanDerWaalsContact CB-OE1 3.27Å; R14-E69 WeakPolarHBondContact CB-OE1 3.24Å; R14-E69 IonicContact CZ-OE2 3.13Å; R14-E69 IonicContact NE-OE2 2.67Å; R14-E69 PolarHBondContact NE-OE2 3.36Å; R14-E69 IonicContact NH2-OE2 2.76Å; R14-E69 PolarHBondContact NH2-OE2 3.27Å; L16-E69 WeakPolarHBondContact CA-OE1 3.48Å; L16-E69 HydrophobicContact CB-CG 4.16Å; L16-E69 VanDerWaalsContact CB-OE1 3.29Å; L16-E69 WeakPolarHBondContact CB-OE1 3.42Å; L16-E69 HydrophobicContact CD1-CG 3.86Å; L16-E69 HydrophobicContact CG-CG 4.46Å; L16-E69 PolarHBondContact N-OE1 2.71Å; S17-E69 PolarHBondContact N-OE1 2.92Å; S17-E69 PolarHBondContact OG-OE2 3.47Å; I65-E69 HydrophobicContact CG2-CG 4.44Å; I65-E69 PolarHBondContact O-N 3.15Å; E69-K71 VanDerWaalsContact C-N 3.32Å; E69-K71 PolarHBondContact O-N 3.48Å; E69-M72 PolarHBondContact O-N 3.04Å; E69-L73 WeakPolarHBondContact O-CB 3.39Å; E69-L73 WeakPolarHBondContact O-CG 3.46Å; E69-L73 PolarHBondContact O-N 3.45Å |
| 70 | N | 71.9 | Confident | 72.6 | Confident | 47 Ų | 47 | 91.3 Ų | 91.3 | 25% | 0.251 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.4 | -42.7 | 172.4 | -73.1 | -10.9 | 0 | 0 | 0 | 111.5 | S66 L67 I68 L73 K74 | S66-N70 PolarHBondContact O-N 2.97Å; S66-N70 PolarHBondContact O-ND2 3.18Å; S66-N70 PolarHBondContact O-OD1 3.31Å; L67-N70 PolarHBondContact O-N 2.91Å; I68-N70 PolarHBondContact O-N 3.28Å; N70-L73 PolarHBondContact O-N 2.91Å; N70-K74 PolarHBondContact O-N 3.5Å |
| 71 | K | 72.4 | Confident | 71.8 | Confident | 152 Ų | 152 | 90.9 Ų | 90.9 | 66% | 0.661 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -65.9 | -40.7 | 175.4 | -75.6 | 178.1 | 177.8 | -72 | 0 | 112.2 | L67 I68 E69 K74 | L67-K71 HydrophobicContact CD2-CD 4.43Å; L67-K71 WeakPolarHBondContact O-CG 3.39Å; L67-K71 PolarHBondContact O-N 3.12Å; I68-K71 PolarHBondContact O-N 2.93Å; E69-K71 VanDerWaalsContact C-N 3.32Å; E69-K71 PolarHBondContact O-N 3.48Å; K71-K74 PolarHBondContact O-N 3.41Å |
| 72 | M | 69.3 | Low | 71.2 | Confident | 138 Ų | 138 | 93.3 Ų | 93.3 | 68% | 0.68 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -65.2 | -38 | 177.4 | -79.2 | -178.6 | 62.3 | 0 | 0 | 112.7 | L16 I68 E69 K74 | L16-M72 HydrophobicContact CD1-SD 4.45Å; I68-M72 HydrophobicContact CG2-SD 4.29Å; I68-M72 PolarHBondContact O-N 3.47Å; E69-M72 PolarHBondContact O-N 3.04Å; M72-K74 PolarHBondContact O-N 3.19Å |
| 73 | L | 70.2 | Confident | 70.4 | Confident | 90 Ų | 90 | 94.9 Ų | 94.9 | 47% | 0.471 | 51% | 0.506 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.1 | 6.3 | -180 | -68.4 | 170.3 | 0 | 0 | 0 | 113.6 | E69 N70 W75 | E69-L73 WeakPolarHBondContact O-CB 3.39Å; E69-L73 WeakPolarHBondContact O-CG 3.46Å; E69-L73 PolarHBondContact O-N 3.45Å; N70-L73 PolarHBondContact O-N 2.91Å; L73-W75 PolarHBondContact O-N 2.74Å; L73-W75 VanDerWaalsContact O-N 3.12Å |
| 74 | K | 57.6 | Low | 69.9 | Low | 188 Ų | 188 | 97.1 Ų | 97.1 | 82% | 0.817 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.3 | 35.3 | 178.3 | -69.2 | -175.4 | 177.4 | 179.3 | 0 | 114 | N70 K71 M72 A76 | N70-K74 PolarHBondContact O-N 3.5Å; K71-K74 PolarHBondContact O-N 3.41Å; M72-K74 PolarHBondContact O-N 3.19Å; K74-A76 PolarHBondContact O-N 2.92Å |
| 75 | W | 56.6 | Low | 68.9 | Low | 158 Ų | 158 | 99.9 Ų | 99.9 | 60% | 0.598 | 52% | 0.522 | S | S | * | . | trans | -85.7 | 99.9 | 160 | -79.6 | -1.4 | 0 | 0 | 0 | 107.4 | K7 Q8 L73 | K7-W75 HydrophobicContact CB-CZ3 4.37Å; Q8-W75 HydrophobicContact CG-CH2 4.19Å; Q8-W75 HydrophobicContact CG-CZ3 4.02Å; L73-W75 PolarHBondContact O-N 2.74Å; L73-W75 VanDerWaalsContact O-N 3.12Å | ||
| 76 | A | 43.8 | Very low | 67.8 | Low | 176 Ų | 176 | 106.3 Ų | 106.3 | 100% | 1.455 | 56% | 0.556 | S | S | * | * | trans | -62.9 | 0 | 165.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | K74 | K74-A76 PolarHBondContact O-N 2.92Š|
Retrieved 76 of 76 residues in 17.1 ms
(Link to these results)