| 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 | 39.6 | Very low | 48.5 | Very low | 246 Ų | 246 | 143.4 Ų | 143.4 | 100% | 1.212 | 81% | 0.812 | S | S | * | * | 0 | 80.3 | 0 | -103.6 | 167.6 | 148.2 | 0 | 0 | 108.6 | |||||
| 2 | Y | 37.5 | Very low | 48.7 | Very low | 228 Ų | 228 | 139.8 Ų | 139.8 | 89% | 0.894 | 80% | 0.8 | S | S | * | * | trans | -111.5 | 93.8 | 165 | -83.2 | -88.4 | 0 | 0 | 0 | 105.6 | ||||
| 3 | N | 48.3 | Very low | 48.8 | Very low | 176 Ų | 176 | 139 Ų | 139 | 94% | 0.941 | 79% | 0.792 | S | S | * | * | trans | -113.1 | 60.6 | 167.7 | -129.6 | 22.9 | 0 | 0 | 0 | 108 | ||||
| 4 | S | 54.2 | Low | 49.2 | Very low | 120 Ų | 120 | 138.6 Ų | 138.6 | 84% | 0.839 | 78% | 0.78 | S | S | * | * | trans | -98.6 | 103.1 | 163.3 | 179.9 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 5 | G | 47.5 | Very low | 49.5 | Very low | 65 Ų | 65 | 134.3 Ų | 134.3 | 67% | 0.67 | 76% | 0.762 | S | S | * | * | trans | -173.6 | -23.5 | -178.4 | 0 | 0 | 0 | 0 | 0 | 118.7 | K7 | G5-K7 PolarHBondContact O-N 3.02Š| ||
| 6 | S | 51.5 | Low | 49.6 | Very low | 113 Ų | 113 | 133.8 Ų | 133.8 | 79% | 0.79 | 76% | 0.757 | S | S | * | * | trans | -100 | 56.3 | -178.3 | -67.3 | 0 | 0 | 0 | 0 | 112.2 | V8 | S6-V8 PolarHBondContact O-N 3.28Š| ||
| 7 | K | 47.7 | Very low | 49.7 | Very low | 204 Ų | 204 | 132.6 Ų | 132.6 | 89% | 0.887 | 75% | 0.746 | S | S | * | * | trans | -75.4 | 77.6 | 146.7 | -161.6 | 173.5 | -173 | 177.3 | 0 | 105 | G5 T9 | G5-K7 PolarHBondContact O-N 3.02Å; K7-T9 PolarHBondContact O-N 2.75Å | ||
| 8 | V | 55.8 | Low | 50 | Low | 113 Ų | 113 | 128.1 Ų | 128.1 | 69% | 0.685 | 73% | 0.725 | S | S | * | * | trans | -61.7 | 91.2 | 173.5 | 179.9 | 0 | 0 | 0 | 0 | 106.1 | S6 S10 | S6-V8 PolarHBondContact O-N 3.28Å; V8-S10 PolarHBondContact O-N 3.16Å | ||
| 9 | T | 49.6 | Very low | 50.2 | Low | 101 Ų | 101 | 123.3 Ų | 123.3 | 62% | 0.62 | 70% | 0.703 | S | S | * | * | trans | 7.4 | 83.1 | 143.3 | 44.3 | 0 | 0 | 0 | 0 | 113.6 | K7 T11 | K7-T9 PolarHBondContact O-N 2.75Å; T9-T11 WeakPolarHBondContact CB-OG1 3.49Å; T9-T11 PolarHBondContact O-N 2.94Å; T9-T11 VanDerWaalsContact O-N 3.16Å | ||
| 10 | S | 53.7 | Low | 50.6 | Low | 113 Ų | 113 | 123 Ų | 123 | 79% | 0.79 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | 25.6 | 161.4 | 67.3 | 0 | 0 | 0 | 0 | 111.4 | V8 | V8-S10 PolarHBondContact O-N 3.16Š|
| 11 | T | 48.4 | Very low | 51.2 | Low | 98 Ų | 98 | 119.4 Ų | 119.4 | 60% | 0.601 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.4 | -8.4 | -176.8 | 24.6 | 0 | 0 | 0 | 0 | 113.4 | T9 | T9-T11 WeakPolarHBondContact CB-OG1 3.49Å; T9-T11 PolarHBondContact O-N 2.94Å; T9-T11 VanDerWaalsContact O-N 3.16Å |
| 12 | C | 51.3 | Low | 52.4 | Low | 100 Ų | 100 | 113.2 Ų | 113.2 | 68% | 0.676 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.3 | -17.4 | -179 | -146.4 | 0 | 0 | 0 | 0 | 113.9 | ||
| 13 | N | 48.9 | Very low | 53.8 | Low | 130 Ų | 130 | 110.2 Ų | 110.2 | 70% | 0.695 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.9 | -6.8 | 179.7 | -76.4 | 6.5 | 0 | 0 | 0 | 114.5 | I17 | N13-I17 VanDerWaalsContact O-CD1 3.23Å; N13-I17 WeakPolarHBondContact O-CD1 3.48Å; N13-I17 WeakPolarHBondContact O-CG1 3.33Å |
| 14 | H | 54.9 | Low | 54.9 | Low | 134 Ų | 134 | 104.3 Ų | 104.3 | 62% | 0.62 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -86.3 | -31.8 | -178.3 | -153.1 | 87.8 | 0 | 0 | 0 | 112.7 | S18 | H14-S18 PolarHBondContact O-N 3.11Å; H14-S18 PolarHBondContact O-OG 3.19Å; H14-S18 VanDerWaalsContact O-OG 3.11Å |
| 15 | S | 53.2 | Low | 55.6 | Low | 73 Ų | 73 | 105 Ų | 105 | 51% | 0.51 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -66.6 | -39.7 | -178.4 | 22 | 0 | 0 | 0 | 0 | 113 | A19 | S15-A19 PolarHBondContact O-N 3.29Å |
| 16 | N | 50.9 | Low | 56.7 | Low | 126 Ų | 126 | 107.4 Ų | 107.4 | 67% | 0.674 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -77.2 | -29.4 | -178.9 | -72.5 | 15.8 | 0 | 0 | 0 | 112.9 | L20 | N16-L20 WeakPolarHBondContact O-CB 3.23Å; N16-L20 PolarHBondContact O-N 3.1Å; N16-L20 VanDerWaalsContact O-N 3.1Å |
| 17 | I | 51.9 | Low | 58 | Low | 114 Ų | 114 | 106.1 Ų | 106.1 | 59% | 0.585 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -70.6 | -40.1 | 175.4 | -62.4 | 171.4 | 0 | 0 | 0 | 110.2 | N13 L20 S21 | N13-I17 VanDerWaalsContact O-CD1 3.23Å; N13-I17 WeakPolarHBondContact O-CD1 3.48Å; N13-I17 WeakPolarHBondContact O-CG1 3.33Å; I17-L20 PolarHBondContact O-N 3.02Å; I17-S21 PolarHBondContact O-N 3.39Å |
| 18 | S | 55.7 | Low | 59.2 | Low | 51 Ų | 51 | 100.9 Ų | 100.9 | 36% | 0.357 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -62.1 | -45.6 | 176.8 | -63.3 | 0 | 0 | 0 | 0 | 112.1 | H14 S21 E22 | H14-S18 PolarHBondContact O-N 3.11Å; H14-S18 PolarHBondContact O-OG 3.19Å; H14-S18 VanDerWaalsContact O-OG 3.11Å; S18-S21 PolarHBondContact O-N 2.89Å; S18-S21 PolarHBondContact O-OG 3.42Å; S18-E22 PolarHBondContact O-N 3.08Å; S18-E22 VanDerWaalsContact O-N 3.08Å |
| 19 | A | 54 | Low | 59.9 | Low | 37 Ų | 37 | 100.7 Ų | 100.7 | 31% | 0.306 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -62.8 | -44.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | S15 S21 E22 Y23 | S15-A19 PolarHBondContact O-N 3.29Å; A19-S21 VanDerWaalsContact C-N 3.26Å; A19-S21 PolarHBondContact O-N 2.92Å; A19-E22 PolarHBondContact O-N 3.06Å; A19-Y23 WeakPolarHBondContact O-CD2 3.37Å; A19-Y23 PolarHBondContact O-N 2.89Å |
| 20 | L | 56.9 | Low | 61.3 | Low | 117 Ų | 117 | 101.2 Ų | 101.2 | 61% | 0.613 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -57.6 | -42.4 | 176.2 | -171.6 | 69.3 | 0 | 0 | 0 | 111 | N16 I17 E22 Y23 T24 | N16-L20 WeakPolarHBondContact O-CB 3.23Å; N16-L20 PolarHBondContact O-N 3.1Å; N16-L20 VanDerWaalsContact O-N 3.1Å; I17-L20 PolarHBondContact O-N 3.02Å; L20-E22 VanDerWaalsContact C-N 3.33Å; L20-E22 PolarHBondContact O-N 3.22Å; L20-Y23 PolarHBondContact O-N 3.03Å; L20-T24 WeakPolarHBondContact O-CB 3.36Å; L20-T24 PolarHBondContact O-N 3.43Å; L20-T24 PolarHBondContact O-OG1 3.33Å |
| 21 | S | 63.2 | Low | 62.4 | Low | 49 Ų | 49 | 97.8 Ų | 97.8 | 34% | 0.343 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.3 | -36.4 | 176.2 | 85.9 | 0 | 0 | 0 | 0 | 113 | I17 S18 A19 K25 | I17-S21 PolarHBondContact O-N 3.39Å; S18-S21 PolarHBondContact O-N 2.89Å; S18-S21 PolarHBondContact O-OG 3.42Å; A19-S21 VanDerWaalsContact C-N 3.26Å; A19-S21 PolarHBondContact O-N 2.92Å; S21-K25 WeakPolarHBondContact O-CB 3.12Å; S21-K25 WeakPolarHBondContact O-CD 3.35Å; S21-K25 WeakPolarHBondContact O-CG 3.28Å; S21-K25 PolarHBondContact O-N 3.48Å |
| 22 | E | 65.6 | Low | 63.8 | Low | 115 Ų | 115 | 94.6 Ų | 94.6 | 54% | 0.537 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -70.3 | -46 | 177.9 | -77.7 | -177.2 | 168.3 | 0 | 0 | 112 | S18 A19 L20 K25 M26 | S18-E22 PolarHBondContact O-N 3.08Å; S18-E22 VanDerWaalsContact O-N 3.08Å; A19-E22 PolarHBondContact O-N 3.06Å; L20-E22 VanDerWaalsContact C-N 3.33Å; L20-E22 PolarHBondContact O-N 3.22Å; E22-K25 WeakPolarHBondContact O-CB 3.22Å; E22-K25 PolarHBondContact O-N 2.95Å; E22-M26 WeakPolarHBondContact O-CG 3.39Å; E22-M26 PolarHBondContact O-N 2.99Å |
| 23 | Y | 67.8 | Low | 65.1 | Low | 165 Ų | 165 | 94.3 Ų | 94.3 | 65% | 0.647 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.2 | -45.5 | 174.7 | -79.4 | -74.7 | 0 | 0 | 0 | 111.4 | A19 L20 K25 M26 V27 | A19-Y23 WeakPolarHBondContact O-CD2 3.37Å; A19-Y23 PolarHBondContact O-N 2.89Å; L20-Y23 PolarHBondContact O-N 3.03Å; Y23-K25 VanDerWaalsContact C-N 3.31Å; Y23-K25 PolarHBondContact O-N 3.06Å; Y23-M26 PolarHBondContact O-N 3.05Å; Y23-M26 VanDerWaalsContact O-N 3.14Å; Y23-V27 WeakPolarHBondContact O-CG2 3.24Å; Y23-V27 PolarHBondContact O-N 2.75Å |
| 24 | T | 71 | Confident | 66.5 | Low | 53 Ų | 53 | 93.6 Ų | 93.6 | 33% | 0.325 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.1 | -38.3 | 177.6 | -57 | 0 | 0 | 0 | 0 | 111.7 | L20 V27 F28 I79 | L20-T24 WeakPolarHBondContact O-CB 3.36Å; L20-T24 PolarHBondContact O-N 3.43Å; L20-T24 PolarHBondContact O-OG1 3.33Å; T24-V27 PolarHBondContact O-N 2.95Å; T24-F28 WeakPolarHBondContact O-CB 3.36Å; T24-F28 PolarHBondContact O-N 3.25Å; T24-I79 HydrophobicContact CG2-CD1 4.34Å; T24-I79 HydrophobicContact CG2-CG1 4.01Å |
| 25 | K | 68.9 | Low | 67.5 | Low | 133 Ų | 133 | 89.2 Ų | 89.2 | 58% | 0.578 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -60.8 | -43.7 | 172.5 | -78.3 | 166.5 | -174.7 | 171.1 | 0 | 111.9 | S21 E22 Y23 F28 L29 | S21-K25 WeakPolarHBondContact O-CB 3.12Å; S21-K25 WeakPolarHBondContact O-CD 3.35Å; S21-K25 WeakPolarHBondContact O-CG 3.28Å; S21-K25 PolarHBondContact O-N 3.48Å; E22-K25 WeakPolarHBondContact O-CB 3.22Å; E22-K25 PolarHBondContact O-N 2.95Å; Y23-K25 VanDerWaalsContact C-N 3.31Å; Y23-K25 PolarHBondContact O-N 3.06Å; K25-F28 PolarHBondContact O-N 3.32Å; K25-L29 WeakPolarHBondContact O-CB 3.02Å; K25-L29 PolarHBondContact O-N 3.4Å |
| 26 | M | 71.1 | Confident | 68.6 | Low | 116 Ų | 116 | 88.5 Ų | 88.5 | 57% | 0.571 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -64.3 | -45.1 | 178 | -70.3 | -175.6 | -173.8 | 0 | 0 | 111.6 | E22 Y23 L29 I30 | E22-M26 WeakPolarHBondContact O-CG 3.39Å; E22-M26 PolarHBondContact O-N 2.99Å; Y23-M26 PolarHBondContact O-N 3.05Å; Y23-M26 VanDerWaalsContact O-N 3.14Å; M26-L29 WeakPolarHBondContact O-CB 3.42Å; M26-L29 PolarHBondContact O-N 3.26Å; M26-I30 VanDerWaalsContact O-CG1 3.31Å; M26-I30 WeakPolarHBondContact O-CG1 3.45Å; M26-I30 PolarHBondContact O-N 2.99Å |
| 27 | V | 76.9 | Confident | 70 | Confident | 86 Ų | 86 | 86.7 Ų | 86.7 | 52% | 0.521 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -61.2 | -48.5 | 176.7 | 175.8 | 0 | 0 | 0 | 0 | 110 | Y23 T24 L29 I30 L31 | Y23-V27 WeakPolarHBondContact O-CG2 3.24Å; Y23-V27 PolarHBondContact O-N 2.75Å; T24-V27 PolarHBondContact O-N 2.95Å; V27-L29 VanDerWaalsContact C-N 3.27Å; V27-L29 PolarHBondContact O-N 3.07Å; V27-I30 PolarHBondContact O-N 3.47Å; V27-L31 WeakPolarHBondContact O-CB 3.43Å; V27-L31 PolarHBondContact O-N 3.15Å |
| 28 | F | 72.8 | Confident | 71.2 | Confident | 94 Ų | 94 | 84.6 Ų | 84.6 | 41% | 0.412 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -56.1 | -41.7 | 177.1 | -168.1 | -76.3 | 0 | 0 | 0 | 112.3 | T24 K25 L31 G32 I75 I79 | T24-F28 WeakPolarHBondContact O-CB 3.36Å; T24-F28 PolarHBondContact O-N 3.25Å; K25-F28 PolarHBondContact O-N 3.32Å; F28-L31 PolarHBondContact O-N 3.29Å; F28-G32 PolarHBondContact O-N 3.38Å; F28-I75 HydrophobicContact CD2-CB 4.25Å; F28-I75 HydrophobicContact CD2-CD1 3.84Å; F28-I75 HydrophobicContact CD2-CG2 3.23Å; F28-I75 HydrophobicContact CE2-CB 3.84Å; F28-I75 HydrophobicContact CE2-CD1 3.35Å; F28-I75 HydrophobicContact CE2-CG1 4.18Å; F28-I75 HydrophobicContact CE2-CG2 3.24Å; F28-I75 HydrophobicContact CG-CG2 4.5Å; F28-I75 HydrophobicContact CZ-CD1 3.77Å; F28-I79 HydrophobicContact CD2-CD1 4.09Å; F28-I79 HydrophobicContact CE2-CD1 4.43Å |
| 29 | L | 70.8 | Confident | 71.9 | Confident | 109 Ų | 109 | 83.8 Ų | 83.8 | 57% | 0.571 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -62.9 | -51.7 | 177.8 | -104 | 162.7 | 0 | 0 | 0 | 111.9 | K25 M26 V27 L31 G32 I33 | K25-L29 WeakPolarHBondContact O-CB 3.02Å; K25-L29 PolarHBondContact O-N 3.4Å; M26-L29 WeakPolarHBondContact O-CB 3.42Å; M26-L29 PolarHBondContact O-N 3.26Å; V27-L29 VanDerWaalsContact C-N 3.27Å; V27-L29 PolarHBondContact O-N 3.07Å; L29-L31 PolarHBondContact O-N 2.98Å; L29-G32 PolarHBondContact O-N 3.42Å; L29-I33 HydrophobicContact CD2-CD1 4.42Å; L29-I33 WeakPolarHBondContact O-CB 3.4Å; L29-I33 WeakPolarHBondContact O-CD1 3.3Å; L29-I33 WeakPolarHBondContact O-CG1 3.19Å; L29-I33 PolarHBondContact O-N 2.93Å |
| 30 | I | 79.5 | Confident | 73 | Confident | 113 Ų | 113 | 87 Ų | 87 | 58% | 0.579 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -56.7 | -44.4 | 178.2 | -66.8 | 163 | 0 | 0 | 0 | 109.8 | M26 V27 I33 E34 | M26-I30 VanDerWaalsContact O-CG1 3.31Å; M26-I30 WeakPolarHBondContact O-CG1 3.45Å; M26-I30 PolarHBondContact O-N 2.99Å; V27-I30 PolarHBondContact O-N 3.47Å; I30-I33 WeakPolarHBondContact O-CB 3.34Å; I30-I33 PolarHBondContact O-N 3.14Å; I30-E34 PolarHBondContact O-N 3.4Å |
| 31 | L | 76.4 | Confident | 74 | Confident | 41 Ų | 41 | 85.4 Ų | 85.4 | 22% | 0.215 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -68.8 | -39.7 | -176.3 | -158.5 | 75.7 | 0 | 0 | 0 | 112.6 | V27 F28 L29 E34 I35 Y71 I75 | V27-L31 WeakPolarHBondContact O-CB 3.43Å; V27-L31 PolarHBondContact O-N 3.15Å; F28-L31 PolarHBondContact O-N 3.29Å; L29-L31 PolarHBondContact O-N 2.98Å; L31-E34 PolarHBondContact O-N 2.89Å; L31-I35 PolarHBondContact O-N 3.28Å; L31-Y71 WeakPolarHBondContact CD1-OH 3.43Å; L31-Y71 HydrophobicContact CD2-CE1 3.42Å; L31-Y71 VanDerWaalsContact CD2-CE1 3.42Å; L31-Y71 VanDerWaalsContact CD2-CZ 3.45Å; L31-Y71 WeakPolarHBondContact CD2-OH 3.41Å; L31-Y71 HydrophobicContact CG-CE1 3.62Å; L31-Y71 WeakPolarHBondContact CG-OH 3.45Å; L31-I75 HydrophobicContact CD2-CD1 4.16Å; L31-I75 HydrophobicContact CD2-CG1 4.1Å |
| 32 | G | 78.2 | Confident | 74.5 | Confident | 31 Ų | 31 | 86 Ų | 86 | 32% | 0.32 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -67.4 | -36 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | F28 L29 I35 A36 | F28-G32 PolarHBondContact O-N 3.38Å; L29-G32 PolarHBondContact O-N 3.42Å; G32-I35 PolarHBondContact O-N 2.92Å; G32-A36 WeakPolarHBondContact O-CB 3.43Å; G32-A36 PolarHBondContact O-N 3.43Å |
| 33 | I | 79.4 | Confident | 74.7 | Confident | 93 Ų | 93 | 85.5 Ų | 85.5 | 48% | 0.477 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -65.8 | -44.8 | 174.5 | -69.2 | 161.9 | 0 | 0 | 0 | 110.6 | L29 I30 I35 A36 I37 | L29-I33 HydrophobicContact CD2-CD1 4.42Å; L29-I33 WeakPolarHBondContact O-CB 3.4Å; L29-I33 WeakPolarHBondContact O-CD1 3.3Å; L29-I33 WeakPolarHBondContact O-CG1 3.19Å; L29-I33 PolarHBondContact O-N 2.93Å; I30-I33 WeakPolarHBondContact O-CB 3.34Å; I30-I33 PolarHBondContact O-N 3.14Å; I33-I35 PolarHBondContact O-N 3.03Å; I33-A36 PolarHBondContact O-N 2.92Å; I33-I37 HydrophobicContact CG2-CD1 3.7Å; I33-I37 HydrophobicContact CG2-CG1 4.34Å; I33-I37 VanDerWaalsContact O-CG1 3.26Å; I33-I37 WeakPolarHBondContact O-CG1 3.3Å; I33-I37 PolarHBondContact O-N 2.96Å |
| 34 | E | 78.6 | Confident | 74.9 | Confident | 115 Ų | 115 | 82.6 Ų | 82.6 | 54% | 0.537 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -55.9 | -40.8 | 177.2 | -172.3 | 178.9 | 178 | 0 | 0 | 111.7 | I30 L31 T38 | I30-E34 PolarHBondContact O-N 3.4Å; L31-E34 PolarHBondContact O-N 2.89Å; E34-T38 PolarHBondContact O-N 3.45Å; E34-T38 PolarHBondContact O-OG1 2.91Å |
| 35 | I | 74.7 | Confident | 74.6 | Confident | 43 Ų | 43 | 84.2 Ų | 84.2 | 22% | 0.221 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -71.9 | -44.2 | 176.6 | -68.8 | 171.3 | 0 | 0 | 0 | 112 | L31 G32 I33 I37 T38 L39 Y71 | L31-I35 PolarHBondContact O-N 3.28Å; G32-I35 PolarHBondContact O-N 2.92Å; I33-I35 PolarHBondContact O-N 3.03Å; I35-I37 PolarHBondContact O-N 3.07Å; I35-T38 PolarHBondContact O-N 2.9Å; I35-T38 VanDerWaalsContact O-N 3.1Å; I35-L39 HydrophobicContact CG2-CD1 4.01Å; I35-L39 HydrophobicContact CG2-CG 4.19Å; I35-L39 WeakPolarHBondContact O-CB 3.35Å; I35-L39 WeakPolarHBondContact O-CG 3.06Å; I35-L39 PolarHBondContact O-N 3.22Å; I35-Y71 HydrophobicContact CD1-CD1 3.01Å; I35-Y71 HydrophobicContact CD1-CD2 3.81Å; I35-Y71 HydrophobicContact CD1-CE1 3.04Å; I35-Y71 HydrophobicContact CD1-CE2 3.89Å; I35-Y71 HydrophobicContact CD1-CG 3.36Å; I35-Y71 VanDerWaalsContact CD1-CZ 3.47Å; I35-Y71 HydrophobicContact CG1-CD1 4.49Å; I35-Y71 HydrophobicContact CG1-CE1 4.32Å |
| 36 | A | 76.6 | Confident | 74.2 | Confident | 58 Ų | 58 | 78.7 Ų | 78.7 | 48% | 0.479 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -57.5 | -39.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111 | G32 I33 L40 | G32-A36 WeakPolarHBondContact O-CB 3.43Å; G32-A36 PolarHBondContact O-N 3.43Å; I33-A36 PolarHBondContact O-N 2.92Å; A36-L40 VanDerWaalsContact O-CB 3.28Å; A36-L40 WeakPolarHBondContact O-CB 3.39Å; A36-L40 PolarHBondContact O-N 3.01Å |
| 37 | I | 79.5 | Confident | 73.3 | Confident | 88 Ų | 88 | 76.3 Ų | 76.3 | 45% | 0.451 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -64.6 | -47.1 | 174.5 | -66.9 | 165.8 | 0 | 0 | 0 | 110.7 | I33 I35 L39 L40 I41 | I33-I37 HydrophobicContact CG2-CD1 3.7Å; I33-I37 HydrophobicContact CG2-CG1 4.34Å; I33-I37 VanDerWaalsContact O-CG1 3.26Å; I33-I37 WeakPolarHBondContact O-CG1 3.3Å; I33-I37 PolarHBondContact O-N 2.96Å; I35-I37 PolarHBondContact O-N 3.07Å; I37-L39 VanDerWaalsContact C-N 3.33Å; I37-L39 PolarHBondContact O-N 3.05Å; I37-L40 WeakPolarHBondContact O-CB 3.43Å; I37-L40 PolarHBondContact O-N 3.32Å; I37-I41 HydrophobicContact CG2-CD1 3.72Å; I37-I41 HydrophobicContact CG2-CG1 4.35Å; I37-I41 WeakPolarHBondContact O-CB 3.18Å; I37-I41 VanDerWaalsContact O-CG1 3.25Å; I37-I41 WeakPolarHBondContact O-CG1 3.47Å; I37-I41 PolarHBondContact O-N 3.22Å |
| 38 | T | 77.2 | Confident | 72.2 | Confident | 70 Ų | 70 | 78.2 Ų | 78.2 | 43% | 0.429 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -61.5 | -42.2 | 179.7 | -57.4 | 0 | 0 | 0 | 0 | 111.6 | E34 I35 I41 I42 | E34-T38 PolarHBondContact O-N 3.45Å; E34-T38 PolarHBondContact O-OG1 2.91Å; I35-T38 PolarHBondContact O-N 2.9Å; I35-T38 VanDerWaalsContact O-N 3.1Å; T38-I41 PolarHBondContact O-N 3.48Å; T38-I42 HydrophobicContact CG2-CD1 4.15Å; T38-I42 VanDerWaalsContact O-CG1 3.29Å; T38-I42 WeakPolarHBondContact O-CG1 3.31Å; T38-I42 PolarHBondContact O-N 3.28Å |
| 39 | L | 71.7 | Confident | 71.2 | Confident | 34 Ų | 34 | 81 Ų | 81 | 18% | 0.178 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -64.7 | -42.4 | 174.8 | -70.4 | 179.6 | 0 | 0 | 0 | 112.1 | I35 I37 I41 I42 I43 I64 V68 | I35-L39 HydrophobicContact CG2-CD1 4.01Å; I35-L39 HydrophobicContact CG2-CG 4.19Å; I35-L39 WeakPolarHBondContact O-CB 3.35Å; I35-L39 WeakPolarHBondContact O-CG 3.06Å; I35-L39 PolarHBondContact O-N 3.22Å; I37-L39 VanDerWaalsContact C-N 3.33Å; I37-L39 PolarHBondContact O-N 3.05Å; L39-I41 VanDerWaalsContact C-N 3.32Å; L39-I41 PolarHBondContact O-N 3.36Å; L39-I42 PolarHBondContact O-N 3.45Å; L39-I43 WeakPolarHBondContact O-CB 3.03Å; L39-I43 VanDerWaalsContact O-CG1 3.24Å; L39-I43 WeakPolarHBondContact O-CG1 2.78Å; L39-I43 PolarHBondContact O-N 3.25Å; L39-I64 HydrophobicContact CD1-CG2 4.28Å; L39-I64 HydrophobicContact CD2-CB 4.03Å; L39-I64 HydrophobicContact CD2-CD1 4.41Å; L39-I64 HydrophobicContact CD2-CG1 3.76Å; L39-I64 HydrophobicContact CD2-CG2 3.44Å; L39-I64 VanDerWaalsContact CD2-CG2 3.44Å; L39-I64 HydrophobicContact CG-CG2 4.49Å; L39-V68 HydrophobicContact CD1-CG2 3.86Å |
| 40 | L | 75.8 | Confident | 70.1 | Confident | 104 Ų | 104 | 77 Ų | 77 | 55% | 0.545 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -60.7 | -43.7 | 175.5 | -169.6 | 78.7 | 0 | 0 | 0 | 110.8 | A36 I37 I43 I44 | A36-L40 VanDerWaalsContact O-CB 3.28Å; A36-L40 WeakPolarHBondContact O-CB 3.39Å; A36-L40 PolarHBondContact O-N 3.01Å; I37-L40 WeakPolarHBondContact O-CB 3.43Å; I37-L40 PolarHBondContact O-N 3.32Å; L40-I43 PolarHBondContact O-N 3.44Å; L40-I44 HydrophobicContact CD1-CD1 4.46Å; L40-I44 HydrophobicContact CD2-CD1 4.26Å; L40-I44 HydrophobicContact CG-CD1 3.84Å; L40-I44 WeakPolarHBondContact O-CB 3.4Å; L40-I44 WeakPolarHBondContact O-CG1 3.37Å; L40-I44 PolarHBondContact O-N 2.94Å |
| 41 | I | 78.5 | Confident | 68.8 | Low | 84 Ų | 84 | 77.6 Ų | 77.6 | 43% | 0.431 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -61.4 | -46.3 | 177.1 | -70.7 | 167.2 | 0 | 0 | 0 | 110.5 | I37 T38 L39 I43 I44 L45 | I37-I41 HydrophobicContact CG2-CD1 3.72Å; I37-I41 HydrophobicContact CG2-CG1 4.35Å; I37-I41 WeakPolarHBondContact O-CB 3.18Å; I37-I41 VanDerWaalsContact O-CG1 3.25Å; I37-I41 WeakPolarHBondContact O-CG1 3.47Å; I37-I41 PolarHBondContact O-N 3.22Å; T38-I41 PolarHBondContact O-N 3.48Å; L39-I41 VanDerWaalsContact C-N 3.32Å; L39-I41 PolarHBondContact O-N 3.36Å; I41-I43 PolarHBondContact O-N 3.33Å; I41-I44 PolarHBondContact O-N 3.31Å; I41-L45 HydrophobicContact CG2-CD1 3.49Å; I41-L45 VanDerWaalsContact CG2-CD1 3.49Å; I41-L45 HydrophobicContact CG2-CG 4.29Å; I41-L45 WeakPolarHBondContact O-CB 3.48Å; I41-L45 WeakPolarHBondContact O-CG 3.33Å; I41-L45 PolarHBondContact O-N 3.28Å |
| 42 | I | 72.9 | Confident | 67.8 | Low | 62 Ų | 62 | 83.5 Ų | 83.5 | 32% | 0.318 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -61.1 | -46.4 | 176.8 | -68.4 | 166 | 0 | 0 | 0 | 110.2 | T38 L39 I44 L45 S46 V60 I64 | T38-I42 HydrophobicContact CG2-CD1 4.15Å; T38-I42 VanDerWaalsContact O-CG1 3.29Å; T38-I42 WeakPolarHBondContact O-CG1 3.31Å; T38-I42 PolarHBondContact O-N 3.28Å; L39-I42 PolarHBondContact O-N 3.45Å; I42-I44 VanDerWaalsContact C-N 3.28Å; I42-I44 PolarHBondContact O-N 2.82Å; I42-L45 PolarHBondContact O-N 2.92Å; I42-S46 WeakPolarHBondContact O-CA 2.95Å; I42-S46 WeakPolarHBondContact O-CB 3.42Å; I42-S46 PolarHBondContact O-N 2.95Å; I42-V60 HydrophobicContact CG2-CG1 3.69Å; I42-I64 HydrophobicContact CG2-CD1 4.37Å |
| 43 | I | 71.4 | Confident | 66.7 | Low | 103 Ų | 103 | 90.1 Ų | 90.1 | 53% | 0.528 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.4 | -32.4 | 179.7 | -68.4 | 165.8 | 0 | 0 | 0 | 111.8 | L39 L40 I41 P47 | L39-I43 WeakPolarHBondContact O-CB 3.03Å; L39-I43 VanDerWaalsContact O-CG1 3.24Å; L39-I43 WeakPolarHBondContact O-CG1 2.78Å; L39-I43 PolarHBondContact O-N 3.25Å; L40-I43 PolarHBondContact O-N 3.44Å; I41-I43 PolarHBondContact O-N 3.33Å; I43-P47 WeakPolarHBondContact O-CD 3.41Å; I43-P47 WeakPolarHBondContact O-CG 3.17Å |
| 44 | I | 70.6 | Confident | 65.6 | Low | 104 Ų | 104 | 91.1 Ų | 91.1 | 53% | 0.533 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -79.1 | -40 | 177.5 | -67.7 | 168.2 | 0 | 0 | 0 | 111.6 | L40 I41 I42 P47 | L40-I44 HydrophobicContact CD1-CD1 4.46Å; L40-I44 HydrophobicContact CD2-CD1 4.26Å; L40-I44 HydrophobicContact CG-CD1 3.84Å; L40-I44 WeakPolarHBondContact O-CB 3.4Å; L40-I44 WeakPolarHBondContact O-CG1 3.37Å; L40-I44 PolarHBondContact O-N 2.94Å; I41-I44 PolarHBondContact O-N 3.31Å; I42-I44 VanDerWaalsContact C-N 3.28Å; I42-I44 PolarHBondContact O-N 2.82Å; I44-P47 WeakPolarHBondContact O-CD 3.37Å; I44-P47 VanDerWaalsContact O-CG 3.3Å; I44-P47 WeakPolarHBondContact O-CG 3.23Å |
| 45 | L | 65.9 | Low | 64.3 | Low | 88 Ų | 88 | 89.9 Ų | 89.9 | 46% | 0.461 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -76 | -32.4 | 179.1 | -75 | 168.9 | 0 | 0 | 0 | 112.5 | I41 I42 L48 E49 | I41-L45 HydrophobicContact CG2-CD1 3.49Å; I41-L45 VanDerWaalsContact CG2-CD1 3.49Å; I41-L45 HydrophobicContact CG2-CG 4.29Å; I41-L45 WeakPolarHBondContact O-CB 3.48Å; I41-L45 WeakPolarHBondContact O-CG 3.33Å; I41-L45 PolarHBondContact O-N 3.28Å; I42-L45 PolarHBondContact O-N 2.92Å; L45-L48 WeakPolarHBondContact O-CA 3.41Å; L45-L48 VanDerWaalsContact O-CB 3.29Å; L45-L48 WeakPolarHBondContact O-CB 3.33Å; L45-L48 PolarHBondContact O-N 2.97Å; L45-E49 PolarHBondContact O-N 3.32Å |
| 46 | S | 59.3 | Low | 63.9 | Low | 17 Ų | 17 | 92.6 Ų | 92.6 | 12% | 0.119 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -56 | -46.8 | -178.9 | -165.4 | 0 | 0 | 0 | 0 | 113.6 | I42 L48 T50 | I42-S46 WeakPolarHBondContact O-CA 2.95Å; I42-S46 WeakPolarHBondContact O-CB 3.42Å; I42-S46 PolarHBondContact O-N 2.95Å; S46-L48 VanDerWaalsContact C-N 3.31Å; S46-L48 PolarHBondContact O-N 3.5Å; S46-T50 VanDerWaalsContact O-CB 3.3Å; S46-T50 WeakPolarHBondContact O-CB 3.47Å; S46-T50 VanDerWaalsContact O-CG2 3.31Å; S46-T50 WeakPolarHBondContact O-CG2 3.26Å; S46-T50 PolarHBondContact O-N 3.25Å; S46-T50 PolarHBondContact O-OG1 2.92Å |
| 47 | P | 52.6 | Low | 63.1 | Low | 65 Ų | 65 | 93.7 Ų | 93.7 | 42% | 0.422 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.3 | -29.7 | 171.5 | 26.7 | -33.8 | 0 | 0 | 0 | 112.4 | I43 I44 T50 V51 | I43-P47 WeakPolarHBondContact O-CD 3.41Å; I43-P47 WeakPolarHBondContact O-CG 3.17Å; I44-P47 WeakPolarHBondContact O-CD 3.37Å; I44-P47 VanDerWaalsContact O-CG 3.3Å; I44-P47 WeakPolarHBondContact O-CG 3.23Å; P47-T50 VanDerWaalsContact CA-OG1 3.32Å; P47-T50 WeakPolarHBondContact CA-OG1 3.29Å; P47-T50 PolarHBondContact O-N 3.04Å; P47-V51 WeakPolarHBondContact O-CB 3.48Å; P47-V51 WeakPolarHBondContact O-CG2 3.24Å; P47-V51 PolarHBondContact O-N 3.28Å |
| 48 | L | 54.2 | Low | 62.1 | Low | 127 Ų | 127 | 98.7 Ų | 98.7 | 67% | 0.665 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -67.6 | -44 | 179 | -141.1 | 85.3 | 0 | 0 | 0 | 111.9 | L45 S46 | L45-L48 WeakPolarHBondContact O-CA 3.41Å; L45-L48 VanDerWaalsContact O-CB 3.29Å; L45-L48 WeakPolarHBondContact O-CB 3.33Å; L45-L48 PolarHBondContact O-N 2.97Å; S46-L48 VanDerWaalsContact C-N 3.31Å; S46-L48 PolarHBondContact O-N 3.5Å |
| 49 | E | 51.3 | Low | 61.7 | Low | 151 Ų | 151 | 99.8 Ų | 99.8 | 71% | 0.706 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -70.5 | -38.8 | 173.5 | -87.1 | -175.8 | 93.4 | 0 | 0 | 112 | L45 H52 K53 | L45-E49 PolarHBondContact O-N 3.32Å; E49-H52 WeakPolarHBondContact O-CB 3.48Å; E49-H52 PolarHBondContact O-N 3.4Å; E49-H52 VanDerWaalsContact O-N 3.1Å; E49-K53 PolarHBondContact O-N 3.3Å |
| 50 | T | 48.7 | Very low | 61.5 | Low | 27 Ų | 27 | 100.1 Ų | 100.1 | 17% | 0.166 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -82.9 | -16.8 | -175.4 | 57 | 0 | 0 | 0 | 0 | 115.3 | S46 P47 H52 K53 T54 P55 | S46-T50 VanDerWaalsContact O-CB 3.3Å; S46-T50 WeakPolarHBondContact O-CB 3.47Å; S46-T50 VanDerWaalsContact O-CG2 3.31Å; S46-T50 WeakPolarHBondContact O-CG2 3.26Å; S46-T50 PolarHBondContact O-N 3.25Å; S46-T50 PolarHBondContact O-OG1 2.92Å; P47-T50 VanDerWaalsContact CA-OG1 3.32Å; P47-T50 WeakPolarHBondContact CA-OG1 3.29Å; P47-T50 PolarHBondContact O-N 3.04Å; T50-H52 PolarHBondContact O-N 3.46Å; T50-K53 CarbonylContact O-C 3.34Å; T50-K53 PolarHBondContact O-N 3.27Å; T50-T54 WeakPolarHBondContact CB-O 3.46Å; T50-T54 WeakPolarHBondContact CG2-O 3.28Å; T50-T54 PolarHBondContact O-N 2.96Å; T50-P55 VanDerWaalsContact CB-CA 3.48Å |
| 51 | V | 52.3 | Low | 61.3 | Low | 125 Ų | 125 | 98.9 Ų | 98.9 | 76% | 0.758 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -58.8 | -30.1 | 161.4 | 164.2 | 0 | 0 | 0 | 0 | 110.1 | P47 | P47-V51 WeakPolarHBondContact O-CB 3.48Å; P47-V51 WeakPolarHBondContact O-CG2 3.24Å; P47-V51 PolarHBondContact O-N 3.28Å |
| 52 | H | 54.1 | Low | 61.1 | Low | 165 Ų | 165 | 98.1 Ų | 98.1 | 76% | 0.764 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -84.4 | -35 | 175.6 | -114.7 | -67.9 | 0 | 0 | 0 | 113.7 | E49 T50 | E49-H52 WeakPolarHBondContact O-CB 3.48Å; E49-H52 PolarHBondContact O-N 3.4Å; E49-H52 VanDerWaalsContact O-N 3.1Å; T50-H52 PolarHBondContact O-N 3.46Å |
| 53 | K | 55.9 | Low | 61.1 | Low | 170 Ų | 170 | 103 Ų | 103 | 74% | 0.739 | 53% | 0.534 | S | S | * | . | S | Bend | trans | -149.6 | 102 | 177.7 | -64.2 | -175.8 | -178.1 | 172.5 | 0 | 111 | E49 T50 | E49-K53 PolarHBondContact O-N 3.3Å; T50-K53 CarbonylContact O-C 3.34Å; T50-K53 PolarHBondContact O-N 3.27Å |
| 54 | T | 55.4 | Low | 61.3 | Low | 114 Ų | 114 | 99.3 Ų | 99.3 | 70% | 0.699 | 52% | 0.515 | S | S | * | . | trans | 63.5 | 94.5 | 164.8 | 52.8 | 0 | 0 | 0 | 0 | 117.8 | T50 N56 | T50-T54 WeakPolarHBondContact CB-O 3.46Å; T50-T54 WeakPolarHBondContact CG2-O 3.28Å; T50-T54 PolarHBondContact O-N 2.96Å; T54-N56 PolarHBondContact O-N 3.48Å | ||
| 55 | P | 52.1 | Low | 61.5 | Low | 88 Ų | 88 | 99.4 Ų | 99.4 | 57% | 0.571 | 52% | 0.516 | S | S | * | . | trans | -83.2 | 67.7 | -174.3 | 37.6 | -36.7 | 0 | 0 | 0 | 114.1 | T50 P57 | T50-P55 VanDerWaalsContact CB-CA 3.48Å; P55-P57 WeakPolarHBondContact O-CD 3.25Å | ||
| 56 | N | 65.5 | Low | 62 | Low | 101 Ų | 101 | 101.7 Ų | 101.7 | 54% | 0.54 | 53% | 0.526 | S | S | . | . | trans | -107.9 | 87.3 | 169.2 | -72.1 | -3.4 | 0 | 0 | 0 | 110.4 | T54 W58 T59 | T54-N56 PolarHBondContact O-N 3.48Å; N56-W58 PolarHBondContact O-N 2.91Å; N56-T59 PolarHBondContact O-N 3.27Å; N56-T59 PolarHBondContact O-OG1 3.13Å | ||
| 57 | P | 59.8 | Low | 62.8 | Low | 80 Ų | 80 | 108.8 Ų | 108.8 | 52% | 0.519 | 55% | 0.552 | S | S | . | * | G | 310 helix | trans | -58 | -22.1 | 173.2 | 24.5 | -34.5 | 0 | 0 | 0 | 112.4 | P55 T59 V60 L61 | P55-P57 WeakPolarHBondContact O-CD 3.25Å; P57-T59 PolarHBondContact O-N 3.41Å; P57-V60 PolarHBondContact O-N 3.32Å; P57-V60 VanDerWaalsContact O-N 3.1Å; P57-L61 PolarHBondContact O-N 3.07Å |
| 58 | W | 59.5 | Low | 63.8 | Low | 194 Ų | 194 | 108.2 Ų | 108.2 | 74% | 0.735 | 55% | 0.547 | S | S | * | . | G | 310 helix | trans | -56.8 | -27.6 | 173.7 | -61.8 | 97.7 | 0 | 0 | 0 | 114.3 | N56 V60 L61 P62 | N56-W58 PolarHBondContact O-N 2.91Å; W58-V60 VanDerWaalsContact C-N 3.32Å; W58-L61 HydrophobicContact CE3-CD2 4.2Å; W58-L61 HydrophobicContact CZ3-CD2 4.34Å; W58-P62 WeakPolarHBondContact O-CD 3.5Å |
| 59 | T | 68.4 | Low | 64.7 | Low | 93 Ų | 93 | 108.7 Ų | 108.7 | 57% | 0.571 | 54% | 0.544 | S | S | * | . | G | 310 helix | trans | -72 | -29.9 | 178 | -51.8 | 0 | 0 | 0 | 0 | 111.9 | N56 P57 | N56-T59 PolarHBondContact O-N 3.27Å; N56-T59 PolarHBondContact O-OG1 3.13Å; P57-T59 PolarHBondContact O-N 3.41Å |
| 60 | V | 67.1 | Low | 65.8 | Low | 41 Ų | 41 | 105.2 Ų | 105.2 | 25% | 0.248 | 54% | 0.536 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86.9 | -23.5 | -177.5 | -170.4 | 0 | 0 | 0 | 0 | 111.4 | I42 P57 W58 W63 I64 | I42-V60 HydrophobicContact CG2-CG1 3.69Å; P57-V60 PolarHBondContact O-N 3.32Å; P57-V60 VanDerWaalsContact O-N 3.1Å; W58-V60 VanDerWaalsContact C-N 3.32Å; V60-W63 WeakPolarHBondContact O-CB 3.46Å; V60-W63 PolarHBondContact O-N 3.3Å; V60-W63 VanDerWaalsContact O-N 3.13Å; V60-I64 HydrophobicContact CG1-CD1 3.95Å; V60-I64 HydrophobicContact CG1-CG1 4.2Å; V60-I64 PolarHBondContact O-N 2.84Å |
| 61 | L | 72.5 | Confident | 66.8 | Low | 77 Ų | 77 | 106.7 Ų | 106.7 | 40% | 0.403 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -56.9 | -44.9 | -177.7 | -174.7 | 67.9 | 0 | 0 | 0 | 114 | P57 W58 W63 I64 L65 | P57-L61 PolarHBondContact O-N 3.07Å; W58-L61 HydrophobicContact CE3-CD2 4.2Å; W58-L61 HydrophobicContact CZ3-CD2 4.34Å; L61-W63 VanDerWaalsContact C-N 3.32Å; L61-W63 PolarHBondContact O-N 3.42Å; L61-I64 PolarHBondContact O-N 2.87Å; L61-L65 HydrophobicContact CG-CD1 4.43Å; L61-L65 WeakPolarHBondContact O-CG 3.44Å; L61-L65 PolarHBondContact O-N 3.1Å |
| 62 | P | 73.2 | Confident | 67.8 | Low | 69 Ų | 69 | 103.6 Ų | 103.6 | 45% | 0.448 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.7 | -38.4 | 175.6 | -23.8 | 33.8 | 0 | 0 | 0 | 113.2 | W58 L65 M66 | W58-P62 WeakPolarHBondContact O-CD 3.5Å; P62-L65 PolarHBondContact O-N 2.99Å; P62-M66 WeakPolarHBondContact O-CG 3.18Å; P62-M66 PolarHBondContact O-N 3.3Å |
| 63 | W | 73.8 | Confident | 68.5 | Low | 164 Ų | 164 | 98.7 Ų | 98.7 | 62% | 0.621 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.3 | -46.9 | 177.5 | -69.5 | 88.8 | 0 | 0 | 0 | 110.6 | V60 L61 L65 M66 Y67 | V60-W63 WeakPolarHBondContact O-CB 3.46Å; V60-W63 PolarHBondContact O-N 3.3Å; V60-W63 VanDerWaalsContact O-N 3.13Å; L61-W63 VanDerWaalsContact C-N 3.32Å; L61-W63 PolarHBondContact O-N 3.42Å; W63-L65 VanDerWaalsContact C-N 3.32Å; W63-L65 PolarHBondContact O-N 3.17Å; W63-M66 PolarHBondContact O-N 2.91Å; W63-Y67 HydrophobicContact CE3-CE2 4.5Å; W63-Y67 VanDerWaalsContact O-CD2 3.23Å; W63-Y67 WeakPolarHBondContact O-CD2 3.31Å; W63-Y67 PolarHBondContact O-N 3.44Å |
| 64 | I | 75.1 | Confident | 69.2 | Low | 25 Ų | 25 | 95.2 Ų | 95.2 | 13% | 0.128 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -56.2 | -47.4 | 175.8 | -70.5 | 167.1 | 0 | 0 | 0 | 110.9 | L39 I42 V60 L61 M66 Y67 V68 | L39-I64 HydrophobicContact CD1-CG2 4.28Å; L39-I64 HydrophobicContact CD2-CB 4.03Å; L39-I64 HydrophobicContact CD2-CD1 4.41Å; L39-I64 HydrophobicContact CD2-CG1 3.76Å; L39-I64 HydrophobicContact CD2-CG2 3.44Å; L39-I64 VanDerWaalsContact CD2-CG2 3.44Å; L39-I64 HydrophobicContact CG-CG2 4.49Å; I42-I64 HydrophobicContact CG2-CD1 4.37Å; V60-I64 HydrophobicContact CG1-CD1 3.95Å; V60-I64 HydrophobicContact CG1-CG1 4.2Å; V60-I64 PolarHBondContact O-N 2.84Å; L61-I64 PolarHBondContact O-N 2.87Å; I64-M66 PolarHBondContact O-N 2.91Å; I64-Y67 PolarHBondContact O-N 3.06Å; I64-V68 WeakPolarHBondContact O-CG2 3.22Å; I64-V68 PolarHBondContact O-N 3.22Å |
| 65 | L | 74.6 | Confident | 69.8 | Low | 107 Ų | 107 | 90.5 Ų | 90.5 | 56% | 0.56 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -63.9 | -41.7 | 179.5 | -69.8 | 173.3 | 0 | 0 | 0 | 112.4 | L61 P62 W63 V68 F69 | L61-L65 HydrophobicContact CG-CD1 4.43Å; L61-L65 WeakPolarHBondContact O-CG 3.44Å; L61-L65 PolarHBondContact O-N 3.1Å; P62-L65 PolarHBondContact O-N 2.99Å; W63-L65 VanDerWaalsContact C-N 3.32Å; W63-L65 PolarHBondContact O-N 3.17Å; L65-V68 PolarHBondContact O-N 3.06Å; L65-F69 VanDerWaalsContact O-CB 3.3Å; L65-F69 WeakPolarHBondContact O-CB 3.3Å; L65-F69 PolarHBondContact O-N 3.32Å |
| 66 | M | 76.9 | Confident | 70.6 | Confident | 135 Ų | 135 | 90.9 Ų | 90.9 | 67% | 0.665 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -62.2 | -43.3 | 175.4 | -74.9 | -174 | 69.6 | 0 | 0 | 111.9 | P62 W63 I64 F69 S70 | P62-M66 WeakPolarHBondContact O-CG 3.18Å; P62-M66 PolarHBondContact O-N 3.3Å; W63-M66 PolarHBondContact O-N 2.91Å; I64-M66 PolarHBondContact O-N 2.91Å; M66-F69 PolarHBondContact O-N 2.95Å; M66-S70 WeakPolarHBondContact O-CB 3.04Å; M66-S70 PolarHBondContact O-N 2.86Å |
| 67 | Y | 75.3 | Confident | 70.8 | Confident | 167 Ų | 167 | 91.9 Ų | 91.9 | 66% | 0.655 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -61.2 | -48.9 | 176.6 | -90.5 | -74.6 | 0 | 0 | 0 | 111.5 | W63 I64 F69 Y71 | W63-Y67 HydrophobicContact CE3-CE2 4.5Å; W63-Y67 VanDerWaalsContact O-CD2 3.23Å; W63-Y67 WeakPolarHBondContact O-CD2 3.31Å; W63-Y67 PolarHBondContact O-N 3.44Å; I64-Y67 PolarHBondContact O-N 3.06Å; Y67-F69 PolarHBondContact O-N 2.88Å; Y67-Y71 WeakPolarHBondContact O-CB 3.47Å; Y67-Y71 PolarHBondContact O-N 3.2Å |
| 68 | V | 74.7 | Confident | 70.8 | Confident | 52 Ų | 52 | 93.6 Ų | 93.6 | 32% | 0.315 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62.2 | -44.5 | 178.6 | 174.1 | 0 | 0 | 0 | 0 | 111.2 | L39 I64 L65 Y71 C72 | L39-V68 HydrophobicContact CD1-CG2 3.86Å; I64-V68 WeakPolarHBondContact O-CG2 3.22Å; I64-V68 PolarHBondContact O-N 3.22Å; L65-V68 PolarHBondContact O-N 3.06Å; V68-Y71 WeakPolarHBondContact O-CB 3.29Å; V68-Y71 PolarHBondContact O-N 3.3Å; V68-C72 PolarHBondContact O-N 2.9Å; V68-C72 PolarHBondContact O-SG 3.1Å; V68-C72 VanDerWaalsContact O-SG 3.36Å |
| 69 | F | 72 | Confident | 71 | Confident | 138 Ų | 138 | 89 Ų | 89 | 61% | 0.605 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -65.4 | -47.2 | -179.5 | -174.8 | -104 | 0 | 0 | 0 | 112.5 | L65 M66 Y67 Y71 C72 N73 | L65-F69 VanDerWaalsContact O-CB 3.3Å; L65-F69 WeakPolarHBondContact O-CB 3.3Å; L65-F69 PolarHBondContact O-N 3.32Å; M66-F69 PolarHBondContact O-N 2.95Å; Y67-F69 PolarHBondContact O-N 2.88Å; F69-Y71 PolarHBondContact O-N 3.47Å; F69-C72 PolarHBondContact O-N 3.35Å; F69-N73 VanDerWaalsContact CD1-ND2 3.28Å; F69-N73 WeakPolarHBondContact CD1-ND2 3.33Å; F69-N73 WeakPolarHBondContact CE1-ND2 3.18Å; F69-N73 WeakPolarHBondContact CZ-ND2 2.84Å; F69-N73 VanDerWaalsContact O-CG 3.32Å; F69-N73 PolarHBondContact O-N 2.62Å; F69-N73 VanDerWaalsContact O-N 3.07Å; F69-N73 PolarHBondContact O-ND2 3.38Å |
| 70 | S | 74.6 | Confident | 70.4 | Confident | 78 Ų | 78 | 92 Ų | 92 | 55% | 0.545 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -56.2 | -36.9 | 174.8 | -173.2 | 0 | 0 | 0 | 0 | 111.1 | M66 L74 | M66-S70 WeakPolarHBondContact O-CB 3.04Å; M66-S70 PolarHBondContact O-N 2.86Å; S70-L74 PolarHBondContact O-N 3.35Å |
| 71 | Y | 70.9 | Confident | 70.5 | Confident | 58 Ų | 58 | 94.6 Ų | 94.6 | 23% | 0.227 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -72.3 | -47.4 | -179.7 | -151.2 | -105.6 | 0 | 0 | 0 | 113.7 | L31 I35 Y67 V68 F69 N73 L74 I75 | L31-Y71 WeakPolarHBondContact CD1-OH 3.43Å; L31-Y71 HydrophobicContact CD2-CE1 3.42Å; L31-Y71 VanDerWaalsContact CD2-CE1 3.42Å; L31-Y71 VanDerWaalsContact CD2-CZ 3.45Å; L31-Y71 WeakPolarHBondContact CD2-OH 3.41Å; L31-Y71 HydrophobicContact CG-CE1 3.62Å; L31-Y71 WeakPolarHBondContact CG-OH 3.45Å; I35-Y71 HydrophobicContact CD1-CD1 3.01Å; I35-Y71 HydrophobicContact CD1-CD2 3.81Å; I35-Y71 HydrophobicContact CD1-CE1 3.04Å; I35-Y71 HydrophobicContact CD1-CE2 3.89Å; I35-Y71 HydrophobicContact CD1-CG 3.36Å; I35-Y71 VanDerWaalsContact CD1-CZ 3.47Å; I35-Y71 HydrophobicContact CG1-CD1 4.49Å; I35-Y71 HydrophobicContact CG1-CE1 4.32Å; Y67-Y71 WeakPolarHBondContact O-CB 3.47Å; Y67-Y71 PolarHBondContact O-N 3.2Å; V68-Y71 WeakPolarHBondContact O-CB 3.29Å; V68-Y71 PolarHBondContact O-N 3.3Å; F69-Y71 PolarHBondContact O-N 3.47Å; Y71-N73 PolarHBondContact O-N 2.99Å; Y71-L74 HydrophobicContact CE2-CD2 4.21Å; Y71-L74 WeakPolarHBondContact O-CB 3.33Å; Y71-L74 PolarHBondContact O-N 2.83Å; Y71-I75 HydrophobicContact CD1-CD1 3.45Å; Y71-I75 VanDerWaalsContact CD1-CD1 3.45Å; Y71-I75 HydrophobicContact CD1-CG1 3.84Å; Y71-I75 HydrophobicContact CE1-CD1 3.5Å; Y71-I75 VanDerWaalsContact CE1-CD1 3.5Å; Y71-I75 HydrophobicContact CE1-CG1 3.81Å; Y71-I75 WeakPolarHBondContact O-CG1 3.39Å; Y71-I75 PolarHBondContact O-N 3.27Å |
| 72 | C | 71.6 | Confident | 70.4 | Confident | 60 Ų | 60 | 95.5 Ų | 95.5 | 41% | 0.405 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -54.5 | -42.3 | 174.8 | -71.3 | 0 | 0 | 0 | 0 | 110.9 | V68 F69 I75 I76 | V68-C72 PolarHBondContact O-N 2.9Å; V68-C72 PolarHBondContact O-SG 3.1Å; V68-C72 VanDerWaalsContact O-SG 3.36Å; F69-C72 PolarHBondContact O-N 3.35Å; C72-I75 PolarHBondContact O-N 3.03Å; C72-I76 WeakPolarHBondContact O-CD1 3.32Å; C72-I76 WeakPolarHBondContact O-CG1 3.37Å; C72-I76 PolarHBondContact O-N 3.48Å |
| 73 | N | 69 | Low | 70.3 | Confident | 61 Ų | 61 | 97 Ų | 97 | 33% | 0.326 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.1 | -44.9 | 175.8 | -66.5 | -35.6 | 0 | 0 | 0 | 112.4 | F69 Y71 I75 I76 I77 | F69-N73 VanDerWaalsContact CD1-ND2 3.28Å; F69-N73 WeakPolarHBondContact CD1-ND2 3.33Å; F69-N73 WeakPolarHBondContact CE1-ND2 3.18Å; F69-N73 WeakPolarHBondContact CZ-ND2 2.84Å; F69-N73 VanDerWaalsContact O-CG 3.32Å; F69-N73 PolarHBondContact O-N 2.62Å; F69-N73 VanDerWaalsContact O-N 3.07Å; F69-N73 PolarHBondContact O-ND2 3.38Å; Y71-N73 PolarHBondContact O-N 2.99Å; N73-I75 VanDerWaalsContact C-N 3.31Å; N73-I75 PolarHBondContact O-N 2.79Å; N73-I76 PolarHBondContact O-N 2.93Å; N73-I77 WeakPolarHBondContact O-CD1 3.11Å; N73-I77 VanDerWaalsContact O-CG1 3.24Å; N73-I77 WeakPolarHBondContact O-CG1 3.45Å; N73-I77 PolarHBondContact O-N 2.92Å |
| 74 | L | 70.8 | Confident | 70 | Confident | 97 Ų | 97 | 93.1 Ų | 93.1 | 51% | 0.508 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -57.1 | -46.4 | 176.9 | -170.6 | 88.4 | 0 | 0 | 0 | 111 | S70 Y71 I77 V78 | S70-L74 PolarHBondContact O-N 3.35Å; Y71-L74 HydrophobicContact CE2-CD2 4.21Å; Y71-L74 WeakPolarHBondContact O-CB 3.33Å; Y71-L74 PolarHBondContact O-N 2.83Å; L74-I77 PolarHBondContact O-N 3.29Å; L74-V78 WeakPolarHBondContact O-CG2 3.46Å; L74-V78 PolarHBondContact O-N 3.32Å |
| 75 | I | 69.1 | Low | 69.7 | Low | 15 Ų | 15 | 97.3 Ų | 97.3 | 8% | 0.077 | 52% | 0.517 | C | S | . | . | H | α-helix | trans | -70.3 | -38.3 | -178 | -52.1 | 167.3 | 0 | 0 | 0 | 111.7 | F28 L31 Y71 C72 N73 I77 V78 I79 | F28-I75 HydrophobicContact CD2-CB 4.25Å; F28-I75 HydrophobicContact CD2-CD1 3.84Å; F28-I75 HydrophobicContact CD2-CG2 3.23Å; F28-I75 HydrophobicContact CE2-CB 3.84Å; F28-I75 HydrophobicContact CE2-CD1 3.35Å; F28-I75 HydrophobicContact CE2-CG1 4.18Å; F28-I75 HydrophobicContact CE2-CG2 3.24Å; F28-I75 HydrophobicContact CG-CG2 4.5Å; F28-I75 HydrophobicContact CZ-CD1 3.77Å; L31-I75 HydrophobicContact CD2-CD1 4.16Å; L31-I75 HydrophobicContact CD2-CG1 4.1Å; Y71-I75 HydrophobicContact CD1-CD1 3.45Å; Y71-I75 VanDerWaalsContact CD1-CD1 3.45Å; Y71-I75 HydrophobicContact CD1-CG1 3.84Å; Y71-I75 HydrophobicContact CE1-CD1 3.5Å; Y71-I75 VanDerWaalsContact CE1-CD1 3.5Å; Y71-I75 HydrophobicContact CE1-CG1 3.81Å; Y71-I75 WeakPolarHBondContact O-CG1 3.39Å; Y71-I75 PolarHBondContact O-N 3.27Å; C72-I75 PolarHBondContact O-N 3.03Å; N73-I75 VanDerWaalsContact C-N 3.31Å; N73-I75 PolarHBondContact O-N 2.79Å; I75-I77 VanDerWaalsContact C-N 3.26Å; I75-I77 PolarHBondContact O-N 3.33Å; I75-V78 PolarHBondContact O-N 3.47Å; I75-V78 VanDerWaalsContact O-N 3.15Å; I75-I79 HydrophobicContact CG2-CD1 3.58Å; I75-I79 HydrophobicContact CG2-CG1 4.1Å; I75-I79 VanDerWaalsContact O-CG1 3.3Å; I75-I79 WeakPolarHBondContact O-CG1 3.3Å; I75-I79 PolarHBondContact O-N 3.2Å |
| 76 | I | 67.5 | Low | 69.4 | Low | 97 Ų | 97 | 96.7 Ų | 96.7 | 50% | 0.497 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -57.5 | -43.8 | 173.6 | -69.3 | 163.1 | 0 | 0 | 0 | 110.1 | C72 N73 V78 I79 C80 | C72-I76 WeakPolarHBondContact O-CD1 3.32Å; C72-I76 WeakPolarHBondContact O-CG1 3.37Å; C72-I76 PolarHBondContact O-N 3.48Å; N73-I76 PolarHBondContact O-N 2.93Å; I76-V78 VanDerWaalsContact C-N 3.32Å; I76-V78 PolarHBondContact O-N 3.5Å; I76-I79 PolarHBondContact O-N 3.1Å; I76-C80 WeakPolarHBondContact O-CB 3.35Å; I76-C80 PolarHBondContact O-N 2.84Å |
| 77 | I | 70.1 | Confident | 68.9 | Low | 122 Ų | 122 | 93.9 Ų | 93.9 | 63% | 0.626 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.3 | -36.6 | 177.5 | -67.3 | 163.2 | 0 | 0 | 0 | 112.1 | N73 L74 I75 I79 | N73-I77 WeakPolarHBondContact O-CD1 3.11Å; N73-I77 VanDerWaalsContact O-CG1 3.24Å; N73-I77 WeakPolarHBondContact O-CG1 3.45Å; N73-I77 PolarHBondContact O-N 2.92Å; L74-I77 PolarHBondContact O-N 3.29Å; I75-I77 VanDerWaalsContact C-N 3.26Å; I75-I77 PolarHBondContact O-N 3.33Å; I77-I79 VanDerWaalsContact C-N 3.31Å |
| 78 | V | 60 | Low | 68.4 | Low | 115 Ų | 115 | 88.3 Ų | 88.3 | 70% | 0.697 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -73.2 | -26.1 | 178.6 | 172.7 | 0 | 0 | 0 | 0 | 112 | L74 I75 I76 | L74-V78 WeakPolarHBondContact O-CG2 3.46Å; L74-V78 PolarHBondContact O-N 3.32Å; I75-V78 PolarHBondContact O-N 3.47Å; I75-V78 VanDerWaalsContact O-N 3.15Å; I76-V78 VanDerWaalsContact C-N 3.32Å; I76-V78 PolarHBondContact O-N 3.5Å |
| 79 | I | 63.2 | Low | 67.8 | Low | 98 Ų | 98 | 91.3 Ų | 91.3 | 50% | 0.503 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -91 | -36.8 | -178.1 | -65.4 | 173.5 | 0 | 0 | 0 | 112.8 | T24 F28 I75 I76 I77 | T24-I79 HydrophobicContact CG2-CD1 4.34Å; T24-I79 HydrophobicContact CG2-CG1 4.01Å; F28-I79 HydrophobicContact CD2-CD1 4.09Å; F28-I79 HydrophobicContact CE2-CD1 4.43Å; I75-I79 HydrophobicContact CG2-CD1 3.58Å; I75-I79 HydrophobicContact CG2-CG1 4.1Å; I75-I79 VanDerWaalsContact O-CG1 3.3Å; I75-I79 WeakPolarHBondContact O-CG1 3.3Å; I75-I79 PolarHBondContact O-N 3.2Å; I76-I79 PolarHBondContact O-N 3.1Å; I77-I79 VanDerWaalsContact C-N 3.31Å |
| 80 | C | 55.1 | Low | 67.5 | Low | 157 Ų | 157 | 87.1 Ų | 87.1 | 100% | 1.061 | 50% | 0.498 | S | S | * | . | trans | -76.8 | 0 | 179.6 | -81.5 | 0 | 0 | 0 | 0 | 112.7 | I76 | I76-C80 WeakPolarHBondContact O-CB 3.35Å; I76-C80 PolarHBondContact O-N 2.84Å |
Retrieved 80 of 80 residues in 46.3 ms
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