| 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 | 61.8 | Low | 79.1 | Confident | 207 Ų | 207 | 115.1 Ų | 115.1 | 100% | 1.02 | 62% | 0.617 | S | S | * | * | 0 | -45.2 | 0 | -140.3 | 170.2 | -173.4 | 0 | 0 | 112.9 | F3 | M1-F3 PolarHBondContact O-N 3.41Š| |||
| 2 | F | 64.4 | Low | 80 | Confident | 180 Ų | 180 | 121.3 Ų | 121.3 | 79% | 0.789 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -61.8 | -36.1 | -178.7 | -74.1 | -81.5 | 0 | 0 | 0 | 115.9 | N4 S5 V6 | F2-N4 PolarHBondContact O-N 3.38Å; F2-S5 PolarHBondContact O-N 3.35Å; F2-V6 PolarHBondContact O-N 3.02Å; F2-V6 VanDerWaalsContact O-N 3.15Å |
| 3 | F | 70.7 | Confident | 80.8 | Confident | 179 Ų | 179 | 119.8 Ų | 119.8 | 79% | 0.785 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -60.6 | -41.6 | -178.8 | -90.7 | -84.9 | 0 | 0 | 0 | 113.6 | M1 S5 V6 V7 | M1-F3 PolarHBondContact O-N 3.41Å; F3-S5 VanDerWaalsContact C-N 3.29Å; F3-S5 PolarHBondContact O-N 3.24Å; F3-V6 PolarHBondContact O-N 3.45Å; F3-V7 VanDerWaalsContact O-CG2 3.31Å; F3-V7 WeakPolarHBondContact O-CG2 3.35Å; F3-V7 PolarHBondContact O-N 2.84Å |
| 4 | N | 75.5 | Confident | 81.6 | Confident | 126 Ų | 126 | 122.2 Ų | 122.2 | 67% | 0.674 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -66 | -32.4 | 178.3 | -74 | -21.8 | 0 | 0 | 0 | 112.4 | F2 T8 | F2-N4 PolarHBondContact O-N 3.38Å; N4-T8 WeakPolarHBondContact O-CB 3.44Å; N4-T8 PolarHBondContact O-N 3.36Å; N4-T8 PolarHBondContact O-OG1 3.47Å |
| 5 | S | 79 | Confident | 82.2 | Confident | 73 Ų | 73 | 121.9 Ų | 121.9 | 51% | 0.51 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -68.2 | -46.7 | 176.6 | -173.9 | 0 | 0 | 0 | 0 | 111.3 | F2 F3 V7 T8 V9 | F2-S5 PolarHBondContact O-N 3.35Å; F3-S5 VanDerWaalsContact C-N 3.29Å; F3-S5 PolarHBondContact O-N 3.24Å; S5-V7 PolarHBondContact O-N 2.6Å; S5-T8 PolarHBondContact O-N 3.11Å; S5-V9 VanDerWaalsContact O-CG2 3.32Å; S5-V9 WeakPolarHBondContact O-CG2 3.22Å; S5-V9 PolarHBondContact O-N 3.07Å |
| 6 | V | 83.5 | Confident | 82.7 | Confident | 91 Ų | 91 | 119.1 Ų | 119.1 | 55% | 0.552 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -63 | -42.2 | 178.5 | 178 | 0 | 0 | 0 | 0 | 111.5 | F2 F3 V9 S10 | F2-V6 PolarHBondContact O-N 3.02Å; F2-V6 VanDerWaalsContact O-N 3.15Å; F3-V6 PolarHBondContact O-N 3.45Å; V6-V9 PolarHBondContact O-N 3.34Å; V6-S10 VanDerWaalsContact O-CB 3.31Å; V6-S10 WeakPolarHBondContact O-CB 3.3Å; V6-S10 PolarHBondContact O-N 3.01Å; V6-S10 PolarHBondContact O-OG 2.88Å |
| 7 | V | 85.4 | Confident | 83.2 | Confident | 90 Ų | 90 | 121 Ų | 121 | 55% | 0.545 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -64.5 | -43.1 | 177 | 173.9 | 0 | 0 | 0 | 0 | 111 | F3 S5 S10 L11 | F3-V7 VanDerWaalsContact O-CG2 3.31Å; F3-V7 WeakPolarHBondContact O-CG2 3.35Å; F3-V7 PolarHBondContact O-N 2.84Å; S5-V7 PolarHBondContact O-N 2.6Å; V7-S10 PolarHBondContact O-N 3.36Å; V7-L11 WeakPolarHBondContact O-CB 3.48Å; V7-L11 PolarHBondContact O-N 2.98Å |
| 8 | T | 85.1 | Confident | 83.7 | Confident | 66 Ų | 66 | 117.7 Ų | 117.7 | 41% | 0.405 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -65.1 | -42.6 | 179.1 | -55.6 | 0 | 0 | 0 | 0 | 111.8 | N4 S5 L11 R12 | N4-T8 WeakPolarHBondContact O-CB 3.44Å; N4-T8 PolarHBondContact O-N 3.36Å; N4-T8 PolarHBondContact O-OG1 3.47Å; S5-T8 PolarHBondContact O-N 3.11Å; T8-L11 PolarHBondContact O-N 2.9Å; T8-R12 WeakPolarHBondContact O-CG 3.48Å; T8-R12 PolarHBondContact O-N 3.45Å |
| 9 | V | 86.8 | Confident | 84 | Confident | 77 Ų | 77 | 117.5 Ų | 117.5 | 47% | 0.467 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -65.1 | -42.6 | 176.3 | 173.3 | 0 | 0 | 0 | 0 | 110.8 | S5 V6 R12 L13 | S5-V9 VanDerWaalsContact O-CG2 3.32Å; S5-V9 WeakPolarHBondContact O-CG2 3.22Å; S5-V9 PolarHBondContact O-N 3.07Å; V6-V9 PolarHBondContact O-N 3.34Å; V9-R12 PolarHBondContact O-N 2.95Å; V9-L13 HydrophobicContact CG1-CD1 3.91Å; V9-L13 WeakPolarHBondContact O-CB 3.46Å; V9-L13 WeakPolarHBondContact O-CG 3.28Å; V9-L13 PolarHBondContact O-N 3.3Å |
| 10 | S | 88.5 | Confident | 84.4 | Confident | 64 Ų | 64 | 117.8 Ų | 117.8 | 45% | 0.448 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -63.5 | -42 | 177.3 | -57.7 | 0 | 0 | 0 | 0 | 111.8 | V6 V7 L13 Y14 | V6-S10 VanDerWaalsContact O-CB 3.31Å; V6-S10 WeakPolarHBondContact O-CB 3.3Å; V6-S10 PolarHBondContact O-N 3.01Å; V6-S10 PolarHBondContact O-OG 2.88Å; V7-S10 PolarHBondContact O-N 3.36Å; S10-L13 PolarHBondContact O-N 3.4Å; S10-Y14 WeakPolarHBondContact O-CB 3.31Å; S10-Y14 PolarHBondContact O-N 3.17Å |
| 11 | L | 89.6 | Confident | 84.8 | Confident | 113 Ų | 113 | 119.4 Ų | 119.4 | 59% | 0.592 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -64.4 | -42.2 | 176.7 | -171.6 | 70.7 | 0 | 0 | 0 | 111.6 | V7 T8 Y14 L15 | V7-L11 WeakPolarHBondContact O-CB 3.48Å; V7-L11 PolarHBondContact O-N 2.98Å; T8-L11 PolarHBondContact O-N 2.9Å; L11-Y14 PolarHBondContact O-N 2.98Å; L11-L15 WeakPolarHBondContact O-CB 3.36Å; L11-L15 PolarHBondContact O-N 2.58Å |
| 12 | R | 89.6 | Confident | 86.3 | Confident | 189 Ų | 189 | 114.3 Ų | 114.3 | 71% | 0.713 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -64.4 | -41.8 | 176 | -74.4 | -179.4 | -178.5 | -173.2 | 1.3 | 112.3 | T8 V9 S16 | T8-R12 WeakPolarHBondContact O-CG 3.48Å; T8-R12 PolarHBondContact O-N 3.45Å; V9-R12 PolarHBondContact O-N 2.95Å; R12-S16 VanDerWaalsContact O-CB 3.32Å; R12-S16 WeakPolarHBondContact O-CB 3.32Å; R12-S16 PolarHBondContact O-N 2.89Å |
| 13 | L | 90.7 | Very high | 87.5 | Confident | 103 Ų | 103 | 109.9 Ų | 109.9 | 54% | 0.539 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.5 | -43.4 | 175.3 | -77.7 | 164.4 | 0 | 0 | 0 | 111.4 | V9 S10 S16 F17 | V9-L13 HydrophobicContact CG1-CD1 3.91Å; V9-L13 WeakPolarHBondContact O-CB 3.46Å; V9-L13 WeakPolarHBondContact O-CG 3.28Å; V9-L13 PolarHBondContact O-N 3.3Å; S10-L13 PolarHBondContact O-N 3.4Å; L13-S16 PolarHBondContact O-N 2.87Å; L13-F17 PolarHBondContact O-N 3.39Å |
| 14 | Y | 91.9 | Very high | 88.5 | Confident | 153 Ų | 153 | 102.9 Ų | 102.9 | 60% | 0.6 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.8 | -44.8 | 177.7 | -174.1 | -108.1 | 0 | 0 | 0 | 112 | S10 L11 S16 F17 I18 | S10-Y14 WeakPolarHBondContact O-CB 3.31Å; S10-Y14 PolarHBondContact O-N 3.17Å; L11-Y14 PolarHBondContact O-N 2.98Å; Y14-S16 VanDerWaalsContact C-N 3.33Å; Y14-S16 PolarHBondContact O-N 3.26Å; Y14-F17 PolarHBondContact O-N 3.32Å; Y14-I18 HydrophobicContact CD1-CD1 3.63Å; Y14-I18 HydrophobicContact CE1-CD1 3.19Å; Y14-I18 HydrophobicContact CE1-CG1 4.23Å; Y14-I18 HydrophobicContact CE2-CD1 4.39Å; Y14-I18 HydrophobicContact CG-CD1 4.4Å; Y14-I18 WeakPolarHBondContact O-CG1 3.39Å; Y14-I18 PolarHBondContact O-N 3.01Å |
| 15 | L | 90.1 | Very high | 89.2 | Confident | 118 Ų | 118 | 98.9 Ų | 98.9 | 62% | 0.618 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -65.1 | -38.1 | 177.7 | -153.8 | 73.6 | 0 | 0 | 0 | 111.9 | L11 I18 H19 | L11-L15 WeakPolarHBondContact O-CB 3.36Å; L11-L15 PolarHBondContact O-N 2.58Å; L15-I18 PolarHBondContact O-N 3.34Å; L15-H19 WeakPolarHBondContact O-CB 3.31Å; L15-H19 PolarHBondContact O-N 2.74Å |
| 16 | S | 89.9 | Confident | 89.8 | Confident | 77 Ų | 77 | 99.7 Ų | 99.7 | 54% | 0.538 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63 | -42.9 | 173.4 | -173.7 | 0 | 0 | 0 | 0 | 111.9 | R12 L13 Y14 H19 L20 | R12-S16 VanDerWaalsContact O-CB 3.32Å; R12-S16 WeakPolarHBondContact O-CB 3.32Å; R12-S16 PolarHBondContact O-N 2.89Å; L13-S16 PolarHBondContact O-N 2.87Å; Y14-S16 VanDerWaalsContact C-N 3.33Å; Y14-S16 PolarHBondContact O-N 3.26Å; S16-H19 PolarHBondContact O-N 2.92Å; S16-L20 WeakPolarHBondContact O-CB 3.36Å; S16-L20 PolarHBondContact O-N 3.49Å |
| 17 | F | 91.2 | Very high | 90.1 | Very high | 151 Ų | 151 | 100.8 Ų | 100.8 | 66% | 0.662 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.9 | -43.8 | 175.4 | -106.3 | -83.1 | 0 | 0 | 0 | 112.6 | L13 Y14 L20 F21 | L13-F17 PolarHBondContact O-N 3.39Å; Y14-F17 PolarHBondContact O-N 3.32Å; F17-L20 PolarHBondContact O-N 3.36Å; F17-F21 WeakPolarHBondContact O-CB 3.34Å; F17-F21 PolarHBondContact O-N 3.15Å |
| 18 | I | 92.3 | Very high | 90.2 | Very high | 61 Ų | 61 | 101.9 Ų | 101.9 | 31% | 0.313 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.3 | -46.5 | 175.6 | -70.9 | 169.8 | 0 | 0 | 0 | 110.3 | Y14 L15 L20 F21 I22 | Y14-I18 HydrophobicContact CD1-CD1 3.63Å; Y14-I18 HydrophobicContact CE1-CD1 3.19Å; Y14-I18 HydrophobicContact CE1-CG1 4.23Å; Y14-I18 HydrophobicContact CE2-CD1 4.39Å; Y14-I18 HydrophobicContact CG-CD1 4.4Å; Y14-I18 WeakPolarHBondContact O-CG1 3.39Å; Y14-I18 PolarHBondContact O-N 3.01Å; L15-I18 PolarHBondContact O-N 3.34Å; I18-L20 VanDerWaalsContact C-N 3.34Å; I18-L20 PolarHBondContact O-N 2.86Å; I18-F21 PolarHBondContact O-N 3.44Å; I18-I22 HydrophobicContact CG2-CD1 3.59Å; I18-I22 HydrophobicContact CG2-CG1 4.24Å; I18-I22 VanDerWaalsContact O-CG1 3.32Å; I18-I22 WeakPolarHBondContact O-CG1 3.37Å; I18-I22 PolarHBondContact O-N 3.03Å |
| 19 | H | 90 | Very high | 90.4 | Very high | 115 Ų | 115 | 103.8 Ų | 103.8 | 53% | 0.532 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62 | -42.5 | 180 | -168.9 | -82.5 | 0 | 0 | 0 | 111.7 | L15 S16 F21 I22 M23 | L15-H19 WeakPolarHBondContact O-CB 3.31Å; L15-H19 PolarHBondContact O-N 2.74Å; S16-H19 PolarHBondContact O-N 2.92Å; H19-F21 VanDerWaalsContact C-N 3.35Å; H19-I22 PolarHBondContact O-N 3.37Å; H19-M23 VanDerWaalsContact CE1-CE 3.41Å; H19-M23 WeakPolarHBondContact CE1-CE 3.45Å; H19-M23 WeakPolarHBondContact O-CB 3.47Å; H19-M23 VanDerWaalsContact O-CG 3.26Å; H19-M23 WeakPolarHBondContact O-CG 3.49Å; H19-M23 PolarHBondContact O-N 3.18Å |
| 20 | L | 91.5 | Very high | 90.4 | Very high | 123 Ų | 123 | 104.6 Ų | 104.6 | 64% | 0.644 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64.2 | -39.6 | 175.7 | -172.6 | 64.8 | 0 | 0 | 0 | 112 | S16 F17 I18 G24 | S16-L20 WeakPolarHBondContact O-CB 3.36Å; S16-L20 PolarHBondContact O-N 3.49Å; F17-L20 PolarHBondContact O-N 3.36Å; I18-L20 VanDerWaalsContact C-N 3.34Å; I18-L20 PolarHBondContact O-N 2.86Å; L20-G24 PolarHBondContact O-N 3.34Å |
| 21 | F | 92.7 | Very high | 90.2 | Very high | 152 Ų | 152 | 108.4 Ų | 108.4 | 67% | 0.667 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -66.5 | -43.3 | 177.8 | -176.1 | -96.6 | 0 | 0 | 0 | 112.4 | F17 I18 H19 G24 S25 | F17-F21 WeakPolarHBondContact O-CB 3.34Å; F17-F21 PolarHBondContact O-N 3.15Å; I18-F21 PolarHBondContact O-N 3.44Å; H19-F21 VanDerWaalsContact C-N 3.35Å; F21-G24 PolarHBondContact O-N 2.99Å; F21-S25 WeakPolarHBondContact O-CB 3.35Å; F21-S25 PolarHBondContact O-N 3.44Å; F21-S25 PolarHBondContact O-OG 3.35Å |
| 22 | I | 92.6 | Very high | 89.9 | Confident | 100 Ų | 100 | 107.1 Ų | 107.1 | 51% | 0.513 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.2 | -47.5 | 176.7 | -67.6 | 170.4 | 0 | 0 | 0 | 110.2 | I18 H19 G24 S25 L26 | I18-I22 HydrophobicContact CG2-CD1 3.59Å; I18-I22 HydrophobicContact CG2-CG1 4.24Å; I18-I22 VanDerWaalsContact O-CG1 3.32Å; I18-I22 WeakPolarHBondContact O-CG1 3.37Å; I18-I22 PolarHBondContact O-N 3.03Å; H19-I22 PolarHBondContact O-N 3.37Å; I22-G24 PolarHBondContact O-N 3.37Å; I22-S25 PolarHBondContact O-N 2.93Å; I22-L26 WeakPolarHBondContact O-CB 3.32Å; I22-L26 PolarHBondContact O-N 2.87Å |
| 23 | M | 90.9 | Very high | 89.6 | Confident | 86 Ų | 86 | 102.9 Ų | 102.9 | 42% | 0.424 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.5 | -41.6 | 178.6 | -70.8 | -63.4 | -177.6 | 0 | 0 | 112 | H19 S25 L26 I27 | H19-M23 VanDerWaalsContact CE1-CE 3.41Å; H19-M23 WeakPolarHBondContact CE1-CE 3.45Å; H19-M23 WeakPolarHBondContact O-CB 3.47Å; H19-M23 VanDerWaalsContact O-CG 3.26Å; H19-M23 WeakPolarHBondContact O-CG 3.49Å; H19-M23 PolarHBondContact O-N 3.18Å; M23-S25 PolarHBondContact O-N 2.69Å; M23-L26 PolarHBondContact O-N 3.48Å; M23-I27 WeakPolarHBondContact O-CD1 3.47Å; M23-I27 VanDerWaalsContact O-CG1 3.27Å; M23-I27 WeakPolarHBondContact O-CG1 3.29Å; M23-I27 PolarHBondContact O-N 3.4Å |
| 24 | G | 90.7 | Very high | 89.1 | Confident | 32 Ų | 32 | 102.3 Ų | 102.3 | 33% | 0.33 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.9 | -42.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | L20 F21 I22 I27 L28 | L20-G24 PolarHBondContact O-N 3.34Å; F21-G24 PolarHBondContact O-N 2.99Å; I22-G24 PolarHBondContact O-N 3.37Å; G24-I27 PolarHBondContact O-N 2.9Å; G24-L28 PolarHBondContact O-N 3.27Å; G24-L28 VanDerWaalsContact O-N 3.09Å |
| 25 | S | 90.5 | Very high | 88.5 | Confident | 42 Ų | 42 | 98.4 Ų | 98.4 | 29% | 0.294 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.7 | -38.4 | 177.2 | -56.5 | 0 | 0 | 0 | 0 | 112.1 | F21 I22 M23 L28 L29 | F21-S25 WeakPolarHBondContact O-CB 3.35Å; F21-S25 PolarHBondContact O-N 3.44Å; F21-S25 PolarHBondContact O-OG 3.35Å; I22-S25 PolarHBondContact O-N 2.93Å; M23-S25 PolarHBondContact O-N 2.69Å; S25-L28 PolarHBondContact O-N 3.27Å; S25-L29 WeakPolarHBondContact O-CG 3.41Å; S25-L29 PolarHBondContact O-N 3.01Å |
| 26 | L | 91.3 | Very high | 87.8 | Confident | 91 Ų | 91 | 99.2 Ų | 99.2 | 48% | 0.476 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65 | -40.9 | 176.1 | -174.1 | 67.3 | 0 | 0 | 0 | 111.8 | I22 M23 L29 L30 | I22-L26 WeakPolarHBondContact O-CB 3.32Å; I22-L26 PolarHBondContact O-N 2.87Å; M23-L26 PolarHBondContact O-N 3.48Å; L26-L29 PolarHBondContact O-N 3.43Å; L26-L30 HydrophobicContact CG-CD1 4.16Å; L26-L30 WeakPolarHBondContact O-CB 3.49Å; L26-L30 WeakPolarHBondContact O-CG 3.41Å; L26-L30 PolarHBondContact O-N 2.87Å |
| 27 | I | 89.7 | Confident | 87.2 | Confident | 113 Ų | 113 | 98.3 Ų | 98.3 | 58% | 0.579 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.5 | -42.7 | 176.1 | -68.9 | 163.9 | 0 | 0 | 0 | 110.9 | M23 G24 L30 Y31 | M23-I27 WeakPolarHBondContact O-CD1 3.47Å; M23-I27 VanDerWaalsContact O-CG1 3.27Å; M23-I27 WeakPolarHBondContact O-CG1 3.29Å; M23-I27 PolarHBondContact O-N 3.4Å; G24-I27 PolarHBondContact O-N 2.9Å; I27-L30 PolarHBondContact O-N 3.46Å; I27-Y31 WeakPolarHBondContact O-CB 3.32Å; I27-Y31 PolarHBondContact O-N 2.95Å |
| 28 | L | 88.3 | Confident | 86.3 | Confident | 114 Ų | 114 | 95.1 Ų | 95.1 | 60% | 0.597 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62 | -45 | 175.9 | -78.3 | 162.9 | 0 | 0 | 0 | 111.8 | G24 S25 L30 Y31 D32 | G24-L28 PolarHBondContact O-N 3.27Å; G24-L28 VanDerWaalsContact O-N 3.09Å; S25-L28 PolarHBondContact O-N 3.27Å; L28-L30 VanDerWaalsContact C-N 3.35Å; L28-L30 PolarHBondContact O-N 2.94Å; L28-Y31 PolarHBondContact O-N 3.43Å; L28-D32 PolarHBondContact O-N 3.23Å |
| 29 | L | 88.6 | Confident | 85.3 | Confident | 105 Ų | 105 | 95.8 Ų | 95.8 | 55% | 0.55 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.1 | -40.3 | 175.9 | -78.4 | 166.7 | 0 | 0 | 0 | 112.6 | S25 L26 N33 | S25-L29 WeakPolarHBondContact O-CG 3.41Å; S25-L29 PolarHBondContact O-N 3.01Å; L26-L29 PolarHBondContact O-N 3.43Å; L29-N33 WeakPolarHBondContact O-CB 3.41Å; L29-N33 PolarHBondContact O-N 3.09Å; L29-N33 VanDerWaalsContact O-N 3.07Å; L29-N33 PolarHBondContact O-ND2 3.36Å |
| 30 | L | 87.3 | Confident | 84.3 | Confident | 95 Ų | 95 | 97.5 Ų | 97.5 | 50% | 0.497 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.3 | -42.5 | 174.9 | -80 | 160.4 | 0 | 0 | 0 | 111.2 | L26 I27 L28 N33 I34 | L26-L30 HydrophobicContact CG-CD1 4.16Å; L26-L30 WeakPolarHBondContact O-CB 3.49Å; L26-L30 WeakPolarHBondContact O-CG 3.41Å; L26-L30 PolarHBondContact O-N 2.87Å; I27-L30 PolarHBondContact O-N 3.46Å; L28-L30 VanDerWaalsContact C-N 3.35Å; L28-L30 PolarHBondContact O-N 2.94Å; L30-N33 PolarHBondContact O-N 3.41Å; L30-I34 VanDerWaalsContact O-CG1 3.26Å; L30-I34 WeakPolarHBondContact O-CG1 3.32Å; L30-I34 PolarHBondContact O-N 3.48Å |
| 31 | Y | 85.4 | Confident | 83.1 | Confident | 144 Ų | 144 | 97.6 Ų | 97.6 | 57% | 0.565 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.9 | -44.3 | 179.6 | -167.5 | -107.3 | 0 | 0 | 0 | 112 | I27 L28 N33 I34 I35 | I27-Y31 WeakPolarHBondContact O-CB 3.32Å; I27-Y31 PolarHBondContact O-N 2.95Å; L28-Y31 PolarHBondContact O-N 3.43Å; Y31-N33 VanDerWaalsContact C-N 3.33Å; Y31-N33 PolarHBondContact O-N 3.24Å; Y31-I34 PolarHBondContact O-N 2.91Å; Y31-I35 HydrophobicContact CD1-CD1 3.56Å; Y31-I35 HydrophobicContact CD1-CG1 4.39Å; Y31-I35 HydrophobicContact CE1-CD1 3.16Å; Y31-I35 HydrophobicContact CE1-CG1 4.17Å; Y31-I35 HydrophobicContact CG-CD1 4.4Å; Y31-I35 WeakPolarHBondContact O-CG1 3.37Å; Y31-I35 PolarHBondContact O-N 3.34Å |
| 32 | D | 83 | Confident | 81.7 | Confident | 86 Ų | 86 | 95.5 Ų | 95.5 | 46% | 0.46 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.3 | -40.9 | 175.6 | -78.8 | -11.1 | 0 | 0 | 0 | 111.6 | L28 I35 Q36 | L28-D32 PolarHBondContact O-N 3.23Å; D32-I35 PolarHBondContact O-N 2.93Å; D32-Q36 WeakPolarHBondContact O-CB 3.33Å; D32-Q36 VanDerWaalsContact O-CG 3.32Å; D32-Q36 WeakPolarHBondContact O-CG 3.48Å; D32-Q36 PolarHBondContact O-N 3.42Å |
| 33 | N | 83.1 | Confident | 80.3 | Confident | 99 Ų | 99 | 95.2 Ų | 95.2 | 53% | 0.529 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.5 | -40.1 | 176 | -78.7 | -40.8 | 0 | 0 | 0 | 112.5 | L29 L30 Y31 Q36 S37 | L29-N33 WeakPolarHBondContact O-CB 3.41Å; L29-N33 PolarHBondContact O-N 3.09Å; L29-N33 VanDerWaalsContact O-N 3.07Å; L29-N33 PolarHBondContact O-ND2 3.36Å; L30-N33 PolarHBondContact O-N 3.41Å; Y31-N33 VanDerWaalsContact C-N 3.33Å; Y31-N33 PolarHBondContact O-N 3.24Å; N33-Q36 PolarHBondContact O-N 3.06Å; N33-S37 WeakPolarHBondContact O-CB 3.41Å; N33-S37 PolarHBondContact O-N 2.96Å |
| 34 | I | 81.1 | Confident | 79 | Confident | 92 Ų | 92 | 97.7 Ų | 97.7 | 47% | 0.472 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66 | -45 | 176.9 | -68.2 | 163.7 | 0 | 0 | 0 | 110.4 | L30 Y31 Q36 S37 N38 | L30-I34 VanDerWaalsContact O-CG1 3.26Å; L30-I34 WeakPolarHBondContact O-CG1 3.32Å; L30-I34 PolarHBondContact O-N 3.48Å; Y31-I34 PolarHBondContact O-N 2.91Å; I34-Q36 PolarHBondContact O-N 3.21Å; I34-S37 PolarHBondContact O-N 3.43Å; I34-N38 VanDerWaalsContact O-CG 3.26Å; I34-N38 PolarHBondContact O-N 2.95Å; I34-N38 PolarHBondContact O-OD1 3.39Å |
| 35 | I | 77.7 | Confident | 77.5 | Confident | 71 Ų | 71 | 99.8 Ų | 99.8 | 36% | 0.364 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61 | -47.1 | 176.7 | -70.6 | 175.6 | 0 | 0 | 0 | 110.5 | Y31 D32 S37 N38 V39 | Y31-I35 HydrophobicContact CD1-CD1 3.56Å; Y31-I35 HydrophobicContact CD1-CG1 4.39Å; Y31-I35 HydrophobicContact CE1-CD1 3.16Å; Y31-I35 HydrophobicContact CE1-CG1 4.17Å; Y31-I35 HydrophobicContact CG-CD1 4.4Å; Y31-I35 WeakPolarHBondContact O-CG1 3.37Å; Y31-I35 PolarHBondContact O-N 3.34Å; D32-I35 PolarHBondContact O-N 2.93Å; I35-S37 VanDerWaalsContact C-N 3.31Å; I35-S37 PolarHBondContact O-N 2.9Å; I35-N38 PolarHBondContact O-N 3.46Å; I35-V39 HydrophobicContact CG2-CG2 4.26Å; I35-V39 WeakPolarHBondContact O-CB 3.3Å; I35-V39 VanDerWaalsContact O-CG2 3.25Å; I35-V39 WeakPolarHBondContact O-CG2 3.48Å; I35-V39 PolarHBondContact O-N 2.95Å |
| 36 | Q | 75.7 | Confident | 76 | Confident | 134 Ų | 134 | 102.5 Ų | 102.5 | 63% | 0.626 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -63.7 | -36.9 | 178.6 | -74 | -173.6 | 20.6 | 0 | 0 | 112.4 | D32 N33 I34 K40 | D32-Q36 WeakPolarHBondContact O-CB 3.33Å; D32-Q36 VanDerWaalsContact O-CG 3.32Å; D32-Q36 WeakPolarHBondContact O-CG 3.48Å; D32-Q36 PolarHBondContact O-N 3.42Å; N33-Q36 PolarHBondContact O-N 3.06Å; I34-Q36 PolarHBondContact O-N 3.21Å; Q36-K40 VanDerWaalsContact O-CB 3.29Å; Q36-K40 WeakPolarHBondContact O-CB 3.41Å; Q36-K40 PolarHBondContact O-N 3.39Å |
| 37 | S | 77.1 | Confident | 74.4 | Confident | 58 Ų | 58 | 104 Ų | 104 | 41% | 0.406 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.3 | -49.4 | 175.1 | -166.5 | 0 | 0 | 0 | 0 | 111.2 | N33 I34 I35 V39 K40 E41 | N33-S37 WeakPolarHBondContact O-CB 3.41Å; N33-S37 PolarHBondContact O-N 2.96Å; I34-S37 PolarHBondContact O-N 3.43Å; I35-S37 VanDerWaalsContact C-N 3.31Å; I35-S37 PolarHBondContact O-N 2.9Å; S37-V39 PolarHBondContact O-N 3.42Å; S37-K40 WeakPolarHBondContact O-CB 3.45Å; S37-K40 PolarHBondContact O-N 2.96Å; S37-K40 VanDerWaalsContact O-N 3.16Å; S37-E41 PolarHBondContact O-N 2.94Å |
| 38 | N | 71.9 | Confident | 72.9 | Confident | 84 Ų | 84 | 102.8 Ų | 102.8 | 45% | 0.449 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.1 | -42.4 | -179.1 | -67.5 | -3.1 | 0 | 0 | 0 | 111.7 | I34 I35 K40 E41 D42 | I34-N38 VanDerWaalsContact O-CG 3.26Å; I34-N38 PolarHBondContact O-N 2.95Å; I34-N38 PolarHBondContact O-OD1 3.39Å; I35-N38 PolarHBondContact O-N 3.46Å; N38-K40 VanDerWaalsContact C-N 3.28Å; N38-K40 PolarHBondContact O-N 3.23Å; N38-E41 PolarHBondContact O-N 2.92Å; N38-D42 PolarHBondContact O-N 3.26Å |
| 39 | V | 72.4 | Confident | 71.1 | Confident | 76 Ų | 76 | 105.5 Ų | 105.5 | 46% | 0.461 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.6 | -38 | 175.7 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | I35 S37 D42 I43 | I35-V39 HydrophobicContact CG2-CG2 4.26Å; I35-V39 WeakPolarHBondContact O-CB 3.3Å; I35-V39 VanDerWaalsContact O-CG2 3.25Å; I35-V39 WeakPolarHBondContact O-CG2 3.48Å; I35-V39 PolarHBondContact O-N 2.95Å; S37-V39 PolarHBondContact O-N 3.42Å; V39-D42 PolarHBondContact O-N 3.44Å; V39-I43 HydrophobicContact CG1-CD1 3.88Å; V39-I43 WeakPolarHBondContact O-CD1 3.26Å; V39-I43 VanDerWaalsContact O-CG1 3.23Å; V39-I43 WeakPolarHBondContact O-CG1 3.43Å; V39-I43 PolarHBondContact O-N 3.38Å |
| 40 | K | 68.7 | Low | 69.4 | Low | 151 Ų | 151 | 108.1 Ų | 108.1 | 66% | 0.657 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -68.5 | -37.2 | 177.2 | -170.7 | 175.7 | -177.5 | 179.1 | 0 | 112.1 | Q36 S37 N38 K44 | Q36-K40 VanDerWaalsContact O-CB 3.29Å; Q36-K40 WeakPolarHBondContact O-CB 3.41Å; Q36-K40 PolarHBondContact O-N 3.39Å; S37-K40 WeakPolarHBondContact O-CB 3.45Å; S37-K40 PolarHBondContact O-N 2.96Å; S37-K40 VanDerWaalsContact O-N 3.16Å; N38-K40 VanDerWaalsContact C-N 3.28Å; N38-K40 PolarHBondContact O-N 3.23Å; K40-K44 WeakPolarHBondContact O-CB 3.49Å; K40-K44 PolarHBondContact O-N 2.94Å; K40-K44 VanDerWaalsContact O-N 3.09Å |
| 41 | E | 66.7 | Low | 67.9 | Low | 125 Ų | 125 | 109.1 Ų | 109.1 | 58% | 0.584 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -66.8 | -42.6 | 174.5 | -73.1 | -172.9 | 174.4 | 0 | 0 | 112 | S37 N38 I43 K44 S45 | S37-E41 PolarHBondContact O-N 2.94Å; N38-E41 PolarHBondContact O-N 2.92Å; E41-I43 PolarHBondContact O-N 2.99Å; E41-K44 PolarHBondContact O-N 3.44Å; E41-S45 WeakPolarHBondContact O-CB 3.27Å; E41-S45 PolarHBondContact O-N 2.89Å |
| 42 | D | 62.4 | Low | 66.4 | Low | 107 Ų | 107 | 108.6 Ų | 108.6 | 57% | 0.572 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.3 | -41.2 | 175.8 | -78.7 | -13.2 | 0 | 0 | 0 | 112.1 | N38 V39 K44 S45 N46 | N38-D42 PolarHBondContact O-N 3.26Å; V39-D42 PolarHBondContact O-N 3.44Å; D42-K44 VanDerWaalsContact C-N 3.34Å; D42-K44 PolarHBondContact O-N 3.45Å; D42-S45 PolarHBondContact O-N 3.04Å; D42-N46 WeakPolarHBondContact O-CB 3.35Å; D42-N46 PolarHBondContact O-N 3.1Å; D42-N46 PolarHBondContact O-ND2 3.21Å |
| 43 | I | 64.6 | Low | 65 | Low | 94 Ų | 94 | 106.8 Ų | 106.8 | 48% | 0.482 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.3 | -40.4 | 175.6 | -67.3 | 165.1 | 0 | 0 | 0 | 110.8 | V39 E41 N46 Q47 | V39-I43 HydrophobicContact CG1-CD1 3.88Å; V39-I43 WeakPolarHBondContact O-CD1 3.26Å; V39-I43 VanDerWaalsContact O-CG1 3.23Å; V39-I43 WeakPolarHBondContact O-CG1 3.43Å; V39-I43 PolarHBondContact O-N 3.38Å; E41-I43 PolarHBondContact O-N 2.99Å; I43-N46 PolarHBondContact O-N 3.1Å; I43-Q47 PolarHBondContact O-N 3.45Å |
| 44 | K | 62.8 | Low | 63.6 | Low | 139 Ų | 139 | 104.7 Ų | 104.7 | 60% | 0.604 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -67.7 | -39.3 | 178.1 | -127.2 | 179.5 | -179 | -172.4 | 0 | 112.2 | K40 E41 D42 Q47 N48 | K40-K44 WeakPolarHBondContact O-CB 3.49Å; K40-K44 PolarHBondContact O-N 2.94Å; K40-K44 VanDerWaalsContact O-N 3.09Å; E41-K44 PolarHBondContact O-N 3.44Å; D42-K44 VanDerWaalsContact C-N 3.34Å; D42-K44 PolarHBondContact O-N 3.45Å; K44-Q47 PolarHBondContact O-N 3.35Å; K44-N48 PolarHBondContact O-N 3.28Å; K44-N48 VanDerWaalsContact O-N 3.11Å |
| 45 | S | 58.7 | Low | 62.3 | Low | 75 Ų | 75 | 108.4 Ų | 108.4 | 52% | 0.524 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.8 | -44.8 | 174.9 | -173.9 | 0 | 0 | 0 | 0 | 110.9 | E41 D42 Q47 N48 Y49 | E41-S45 WeakPolarHBondContact O-CB 3.27Å; E41-S45 PolarHBondContact O-N 2.89Å; D42-S45 PolarHBondContact O-N 3.04Å; S45-Q47 PolarHBondContact O-N 2.92Å; S45-N48 PolarHBondContact O-N 2.96Å; S45-Y49 PolarHBondContact O-N 2.97Å |
| 46 | N | 58.9 | Low | 61.1 | Low | 99 Ų | 99 | 111.2 Ų | 111.2 | 53% | 0.529 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -65.8 | -37.5 | 176.1 | -75.6 | -27.4 | 0 | 0 | 0 | 112.7 | D42 I43 N48 Y49 Y50 | D42-N46 WeakPolarHBondContact O-CB 3.35Å; D42-N46 PolarHBondContact O-N 3.1Å; D42-N46 PolarHBondContact O-ND2 3.21Å; I43-N46 PolarHBondContact O-N 3.1Å; N46-N48 PolarHBondContact O-N 3.24Å; N46-Y49 WeakPolarHBondContact O-CB 3.4Å; N46-Y49 PolarHBondContact O-N 3.29Å; N46-Y50 VanDerWaalsContact O-CD2 3.24Å; N46-Y50 WeakPolarHBondContact O-CD2 3.39Å; N46-Y50 PolarHBondContact O-N 3.49Å |
| 47 | Q | 57.9 | Low | 59.8 | Low | 123 Ų | 123 | 111 Ų | 111 | 58% | 0.575 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -62.8 | -40.6 | 174.7 | -91.1 | 175.8 | -24.9 | 0 | 0 | 112.7 | I43 K44 S45 Y49 Y50 D51 | I43-Q47 PolarHBondContact O-N 3.45Å; K44-Q47 PolarHBondContact O-N 3.35Å; S45-Q47 PolarHBondContact O-N 2.92Å; Q47-Y49 VanDerWaalsContact C-N 3.29Å; Q47-Y49 PolarHBondContact O-N 3.01Å; Q47-Y50 PolarHBondContact O-N 3.39Å; Q47-D51 PolarHBondContact O-N 2.8Å |
| 48 | N | 59.4 | Low | 58.5 | Low | 87 Ų | 87 | 114.5 Ų | 114.5 | 47% | 0.465 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -63.2 | -36.4 | 175.4 | -72.2 | -27.6 | 0 | 0 | 0 | 112 | K44 S45 N46 Y50 D51 H52 | K44-N48 PolarHBondContact O-N 3.28Å; K44-N48 VanDerWaalsContact O-N 3.11Å; S45-N48 PolarHBondContact O-N 2.96Å; N46-N48 PolarHBondContact O-N 3.24Å; N48-Y50 VanDerWaalsContact C-N 3.35Å; N48-Y50 PolarHBondContact O-N 3.48Å; N48-D51 PolarHBondContact O-N 3.47Å; N48-H52 PolarHBondContact O-CD2 3.4Å; N48-H52 PolarHBondContact O-N 2.92Å; N48-H52 VanDerWaalsContact O-N 3.17Å |
| 49 | Y | 49.7 | Very low | 57.3 | Low | 172 Ų | 172 | 116.9 Ų | 116.9 | 68% | 0.675 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -62.6 | -40.5 | 176.1 | -171.8 | -98.8 | 0 | 0 | 0 | 112.3 | S45 N46 Q47 S53 | S45-Y49 PolarHBondContact O-N 2.97Å; N46-Y49 WeakPolarHBondContact O-CB 3.4Å; N46-Y49 PolarHBondContact O-N 3.29Å; Q47-Y49 VanDerWaalsContact C-N 3.29Å; Q47-Y49 PolarHBondContact O-N 3.01Å; Y49-S53 PolarHBondContact O-N 2.92Å |
| 50 | Y | 53 | Low | 56.3 | Low | 160 Ų | 160 | 120.1 Ų | 120.1 | 63% | 0.627 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -72.9 | -36.8 | 178 | -77 | -74.2 | 0 | 0 | 0 | 113 | N46 Q47 N48 H52 S53 A54 | N46-Y50 VanDerWaalsContact O-CD2 3.24Å; N46-Y50 WeakPolarHBondContact O-CD2 3.39Å; N46-Y50 PolarHBondContact O-N 3.49Å; Q47-Y50 PolarHBondContact O-N 3.39Å; N48-Y50 VanDerWaalsContact C-N 3.35Å; N48-Y50 PolarHBondContact O-N 3.48Å; Y50-H52 VanDerWaalsContact C-N 3.33Å; Y50-H52 PolarHBondContact O-N 3.48Å; Y50-S53 WeakPolarHBondContact CA-OG 3.26Å; Y50-S53 PolarHBondContact O-N 2.89Å; Y50-S53 VanDerWaalsContact O-N 3.15Å; Y50-S53 PolarHBondContact O-OG 2.99Å; Y50-A54 PolarHBondContact O-N 3.02Å |
| 51 | D | 55.2 | Low | 55.1 | Low | 116 Ų | 116 | 122.8 Ų | 122.8 | 62% | 0.62 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -64.6 | -35.2 | 176.2 | -98.3 | -4.9 | 0 | 0 | 0 | 112.5 | Q47 N48 K55 | Q47-D51 PolarHBondContact O-N 2.8Å; N48-D51 PolarHBondContact O-N 3.47Å; D51-K55 PolarHBondContact O-N 3.1Å |
| 52 | H | 54.3 | Low | 54 | Low | 133 Ų | 133 | 124.8 Ų | 124.8 | 62% | 0.616 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -70.3 | -32.8 | 173.1 | -72.2 | -60 | 0 | 0 | 0 | 112.8 | N48 Y50 K55 L56 | N48-H52 PolarHBondContact O-CD2 3.4Å; N48-H52 PolarHBondContact O-N 2.92Å; N48-H52 VanDerWaalsContact O-N 3.17Å; Y50-H52 VanDerWaalsContact C-N 3.33Å; Y50-H52 PolarHBondContact O-N 3.48Å; H52-K55 PolarHBondContact O-N 3.32Å; H52-L56 PolarHBondContact O-N 3.07Å |
| 53 | S | 53.8 | Low | 53.1 | Low | 47 Ų | 47 | 126.5 Ų | 126.5 | 33% | 0.329 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -72.4 | -32.6 | 176.3 | 75.5 | 0 | 0 | 0 | 0 | 113.1 | Y49 Y50 N57 | Y49-S53 PolarHBondContact O-N 2.92Å; Y50-S53 WeakPolarHBondContact CA-OG 3.26Å; Y50-S53 PolarHBondContact O-N 2.89Å; Y50-S53 VanDerWaalsContact O-N 3.15Å; Y50-S53 PolarHBondContact O-OG 2.99Å; S53-N57 PolarHBondContact O-ND2 3.48Å |
| 54 | A | 53.1 | Low | 52.1 | Low | 56 Ų | 56 | 126.6 Ų | 126.6 | 46% | 0.463 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -69.2 | -35.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y50 L56 N57 | Y50-A54 PolarHBondContact O-N 3.02Å; A54-L56 VanDerWaalsContact C-N 3.34Å; A54-L56 PolarHBondContact O-N 2.98Å; A54-N57 PolarHBondContact O-N 3.33Å |
| 55 | K | 53.6 | Low | 51.2 | Low | 170 Ų | 170 | 127.3 Ų | 127.3 | 74% | 0.739 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -74.5 | -21.7 | 178.8 | -133.3 | 172.3 | -175.7 | 178.9 | 0 | 114.2 | D51 H52 | D51-K55 PolarHBondContact O-N 3.1Å; H52-K55 PolarHBondContact O-N 3.32Å |
| 56 | L | 52.7 | Low | 50.4 | Low | 130 Ų | 130 | 132.9 Ų | 132.9 | 68% | 0.681 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -84.3 | -12.3 | 175.7 | -95.4 | 156.4 | 0 | 0 | 0 | 113.7 | H52 A54 | H52-L56 PolarHBondContact O-N 3.07Å; A54-L56 VanDerWaalsContact C-N 3.34Å; A54-L56 PolarHBondContact O-N 2.98Å |
| 57 | N | 49.2 | Very low | 49.5 | Very low | 128 Ų | 128 | 134.4 Ų | 134.4 | 68% | 0.684 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -89.1 | -8.9 | 179 | -81.2 | -35.6 | 0 | 0 | 0 | 114.2 | S53 A54 | S53-N57 PolarHBondContact O-ND2 3.48Å; A54-N57 PolarHBondContact O-N 3.33Å |
| 58 | D | 50 | Low | 48.8 | Very low | 132 Ų | 132 | 135.1 Ų | 135.1 | 71% | 0.706 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -83.9 | -15.6 | 175.1 | -79.8 | -20.4 | 0 | 0 | 0 | 113.1 | I60 | D58-I60 PolarHBondContact O-N 3.28Š|
| 59 | D | 46.6 | Very low | 47.9 | Very low | 135 Ų | 135 | 136.8 Ų | 136.8 | 72% | 0.722 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -82.5 | 75.6 | 165.9 | -78.7 | -20.7 | 0 | 0 | 0 | 109 | Y61 | D59-Y61 VanDerWaalsContact C-N 3.29Å; D59-Y61 PolarHBondContact O-N 2.94Å |
| 60 | I | 51.5 | Low | 47.6 | Very low | 144 Ų | 144 | 134.8 Ų | 134.8 | 74% | 0.738 | 68% | 0.677 | S | S | * | * | trans | -55.5 | 93.8 | 169.5 | -61.8 | 169.5 | 0 | 0 | 0 | 107.8 | D58 E62 | D58-I60 PolarHBondContact O-N 3.28Å; I60-E62 HydrophobicContact CG2-CB 4.45Å; I60-E62 PolarHBondContact O-N 3.35Å | ||
| 61 | Y | 42.9 | Very low | 47.2 | Very low | 206 Ų | 206 | 132.7 Ų | 132.7 | 81% | 0.808 | 68% | 0.683 | S | S | * | * | trans | -67.2 | 88.6 | 157.1 | -133.9 | -91.4 | 0 | 0 | 0 | 106 | D59 F63 | D59-Y61 VanDerWaalsContact C-N 3.29Å; D59-Y61 PolarHBondContact O-N 2.94Å; Y61-F63 VanDerWaalsContact C-N 3.29Å; Y61-F63 PolarHBondContact O-N 3.02Å | ||
| 62 | E | 44.5 | Very low | 46.4 | Very low | 168 Ų | 168 | 134.9 Ų | 134.9 | 79% | 0.785 | 69% | 0.69 | S | S | * | * | trans | -55.6 | 92.5 | 171.1 | -171.4 | 174.4 | -168.2 | 0 | 0 | 107.8 | I60 P64 | I60-E62 HydrophobicContact CG2-CB 4.45Å; I60-E62 PolarHBondContact O-N 3.35Å; E62-P64 WeakPolarHBondContact O-CD 3.44Å | ||
| 63 | F | 43.3 | Very low | 45.9 | Very low | 143 Ų | 143 | 135.1 Ų | 135.1 | 63% | 0.627 | 70% | 0.701 | S | S | * | * | trans | -70 | 113.7 | 165.7 | -87.5 | -83.2 | 0 | 0 | 0 | 107.4 | Y61 | Y61-F63 VanDerWaalsContact C-N 3.29Å; Y61-F63 PolarHBondContact O-N 3.02Å | ||
| 64 | P | 42.2 | Very low | 45.3 | Very low | 95 Ų | 95 | 140.7 Ų | 140.7 | 62% | 0.617 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.6 | 144.6 | 165.3 | 32.5 | -30 | 0 | 0 | 0 | 107.8 | E62 | E62-P64 WeakPolarHBondContact O-CD 3.44Š|
| 65 | D | 43.9 | Very low | 44.9 | Very low | 155 Ų | 155 | 143.5 Ų | 143.5 | 83% | 0.829 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 83.4 | 25.9 | 161.7 | -56.1 | -24.6 | 0 | 0 | 0 | 120.5 | ||
| 66 | R | 42.4 | Very low | 44.5 | Very low | 191 Ų | 191 | 141.2 Ų | 141.2 | 72% | 0.721 | 74% | 0.735 | S | S | * | * | trans | -120.8 | 73.3 | 161.7 | -55.6 | -171.9 | -149.3 | -87.4 | -0.1 | 111.9 | I68 | R66-I68 VanDerWaalsContact C-N 3.34Å; R66-I68 PolarHBondContact O-N 3.35Å | ||
| 67 | V | 40 | Very low | 44.1 | Very low | 131 Ų | 131 | 142 Ų | 142 | 79% | 0.794 | 74% | 0.74 | S | S | * | * | trans | -67.7 | 94.6 | 163.5 | -178.4 | 0 | 0 | 0 | 0 | 107.9 | V69 | V67-V69 HydrophobicContact CG1-CG2 3.86Å; V67-V69 PolarHBondContact O-N 2.93Å | ||
| 68 | I | 44 | Very low | 43.7 | Very low | 139 Ų | 139 | 141 Ų | 141 | 71% | 0.713 | 74% | 0.743 | S | S | * | * | trans | -87.5 | 102.4 | 164.6 | -57.2 | 177.5 | 0 | 0 | 0 | 106.4 | R66 I70 | R66-I68 VanDerWaalsContact C-N 3.34Å; R66-I68 PolarHBondContact O-N 3.35Å; I68-I70 HydrophobicContact CG2-CG1 4.18Å; I68-I70 PolarHBondContact O-N 3.2Å; I68-I70 VanDerWaalsContact O-N 3.08Å | ||
| 69 | V | 39.7 | Very low | 43.3 | Very low | 121 Ų | 121 | 140.6 Ų | 140.6 | 73% | 0.733 | 75% | 0.745 | S | S | * | * | trans | -71.3 | 99.2 | 171 | -178.8 | 0 | 0 | 0 | 0 | 107.8 | V67 | V67-V69 HydrophobicContact CG1-CG2 3.86Å; V67-V69 PolarHBondContact O-N 2.93Å | ||
| 70 | I | 44.8 | Very low | 43.2 | Very low | 131 Ų | 131 | 142.8 Ų | 142.8 | 67% | 0.672 | 75% | 0.751 | S | S | * | * | trans | -83.1 | 126.3 | 164.5 | -56.4 | 176 | 0 | 0 | 0 | 106.8 | I68 Q72 | I68-I70 HydrophobicContact CG2-CG1 4.18Å; I68-I70 PolarHBondContact O-N 3.2Å; I68-I70 VanDerWaalsContact O-N 3.08Å; I70-Q72 PolarHBondContact O-N 3.17Å | ||
| 71 | P | 44.4 | Very low | 42.9 | Very low | 115 Ų | 115 | 142.7 Ų | 142.7 | 75% | 0.747 | 75% | 0.751 | S | S | * | * | trans | -63.4 | 110.9 | 175 | -12.8 | 26.2 | 0 | 0 | 0 | 108.9 | T73 | P71-T73 PolarHBondContact O-N 3Š| ||
| 72 | Q | 37.1 | Very low | 43 | Very low | 163 Ų | 163 | 140.7 Ų | 140.7 | 76% | 0.762 | 75% | 0.753 | S | S | * | * | trans | -72.3 | 119.6 | 171.6 | -70 | -161.1 | -0.5 | 0 | 0 | 109.6 | I70 | I70-Q72 PolarHBondContact O-N 3.17Š| ||
| 73 | T | 43.5 | Very low | 42.9 | Very low | 138 Ų | 138 | 140.3 Ų | 140.3 | 85% | 0.847 | 76% | 0.756 | S | S | * | * | trans | -83.8 | 106.2 | 150.9 | 41 | 0 | 0 | 0 | 0 | 107.7 | P71 | P71-T73 PolarHBondContact O-N 3Š| ||
| 74 | E | 41.7 | Very low | 42.9 | Very low | 163 Ų | 163 | 138.2 Ų | 138.2 | 76% | 0.762 | 75% | 0.751 | S | S | * | * | trans | 43.7 | 127.1 | 169.5 | -66.1 | -165.2 | 158.8 | 0 | 0 | 119.7 | V76 | E74-V76 PolarHBondContact O-N 3.17Å; E74-V76 VanDerWaalsContact O-N 3.15Å | ||
| 75 | P | 45.3 | Very low | 43.2 | Very low | 116 Ų | 116 | 142.2 Ų | 142.2 | 75% | 0.753 | 76% | 0.762 | S | S | * | * | trans | -74.6 | 106.3 | 170.5 | 31.3 | -29.9 | 0 | 0 | 0 | 109.2 | ||||
| 76 | V | 45.9 | Very low | 43.7 | Very low | 122 Ų | 122 | 138.3 Ų | 138.3 | 74% | 0.739 | 74% | 0.744 | S | S | * | * | trans | -87 | 123.8 | 167.2 | -179.7 | 0 | 0 | 0 | 0 | 108.5 | E74 S78 | E74-V76 PolarHBondContact O-N 3.17Å; E74-V76 VanDerWaalsContact O-N 3.15Å; V76-S78 PolarHBondContact O-N 2.94Å | ||
| 77 | D | 42.9 | Very low | 44.1 | Very low | 146 Ų | 146 | 136.8 Ų | 136.8 | 78% | 0.781 | 74% | 0.739 | S | S | * | * | trans | -41.2 | 117.5 | 179.2 | -98.4 | -35.8 | 0 | 0 | 0 | 112.8 | T79 | D77-T79 VanDerWaalsContact C-N 3.25Å; D77-T79 PolarHBondContact O-N 3.22Å; D77-T79 VanDerWaalsContact O-N 3.1Å | ||
| 78 | S | 41.6 | Very low | 44.3 | Very low | 107 Ų | 107 | 139.5 Ų | 139.5 | 75% | 0.748 | 74% | 0.736 | S | S | * | * | trans | -87.2 | 42.7 | -172.8 | -33.1 | 0 | 0 | 0 | 0 | 113 | V76 | V76-S78 PolarHBondContact O-N 2.94Š| ||
| 79 | T | 41.8 | Very low | 44.6 | Very low | 123 Ų | 123 | 138.8 Ų | 138.8 | 76% | 0.755 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -100.4 | 0.4 | -179.3 | 43 | 0 | 0 | 0 | 0 | 115.5 | D77 | D77-T79 VanDerWaalsContact C-N 3.25Å; D77-T79 PolarHBondContact O-N 3.22Å; D77-T79 VanDerWaalsContact O-N 3.1Å |
| 80 | E | 43.7 | Very low | 45.3 | Very low | 181 Ų | 181 | 138.1 Ų | 138.1 | 85% | 0.846 | 73% | 0.726 | S | S | * | * | trans | -140.7 | 64.1 | 179.3 | -68 | -172.8 | 168.7 | 0 | 0 | 111.8 | ||||
| 81 | I | 46.2 | Very low | 45.6 | Very low | 143 Ų | 143 | 136.6 Ų | 136.6 | 73% | 0.733 | 72% | 0.717 | S | S | * | * | trans | -110.6 | 69.5 | 161.8 | -51.7 | 177.4 | 0 | 0 | 0 | 106.8 | L83 | I81-L83 PolarHBondContact O-N 3.38Š| ||
| 82 | L | 44.8 | Very low | 46 | Very low | 163 Ų | 163 | 136.9 Ų | 136.9 | 85% | 0.853 | 71% | 0.712 | S | S | * | * | trans | -66.9 | 112.2 | 158.5 | -159.6 | 135.8 | 0 | 0 | 0 | 104.8 | D84 | L82-D84 VanDerWaalsContact C-N 3.31Å; L82-D84 PolarHBondContact O-N 3.45Å | ||
| 83 | L | 41.1 | Very low | 46.8 | Very low | 160 Ų | 160 | 130.6 Ų | 130.6 | 84% | 0.838 | 69% | 0.691 | S | S | * | * | trans | -52.5 | 91.4 | -176 | -69.5 | 161.7 | 0 | 0 | 0 | 110.4 | I81 | I81-L83 PolarHBondContact O-N 3.38Š| ||
| 84 | D | 43.5 | Very low | 47.2 | Very low | 100 Ų | 100 | 129.2 Ų | 129.2 | 54% | 0.535 | 68% | 0.678 | S | S | . | * | trans | -88.4 | 110.3 | 170.5 | -167.1 | -13.1 | 0 | 0 | 0 | 107 | L82 T86 Y87 | L82-D84 VanDerWaalsContact C-N 3.31Å; L82-D84 PolarHBondContact O-N 3.45Å; D84-T86 PolarHBondContact O-N 3.09Å; D84-T86 WeakPolarHBondContact OD1-CB 3.35Å; D84-T86 WeakPolarHBondContact OD1-CG2 3.43Å; D84-T86 PolarHBondContact OD1-N 3.26Å; D84-T86 PolarHBondContact OD1-OG1 2.97Å; D84-T86 PolarHBondContact OD2-OG1 3.48Å; D84-Y87 WeakPolarHBondContact O-CB 3.42Å; D84-Y87 PolarHBondContact O-N 3.4Å | ||
| 85 | E | 49.6 | Very low | 47.7 | Very low | 179 Ų | 179 | 128 Ų | 128 | 84% | 0.836 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.6 | -7.1 | 176.2 | -73.7 | -179.4 | 149.4 | 0 | 0 | 112.9 | ||
| 86 | T | 54.3 | Low | 48 | Very low | 73 Ų | 73 | 128.6 Ų | 128.6 | 45% | 0.448 | 67% | 0.672 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.7 | -18.6 | 171.8 | 62.5 | 0 | 0 | 0 | 0 | 114.3 | D84 Y88 N89 N90 | D84-T86 PolarHBondContact O-N 3.09Å; D84-T86 WeakPolarHBondContact OD1-CB 3.35Å; D84-T86 WeakPolarHBondContact OD1-CG2 3.43Å; D84-T86 PolarHBondContact OD1-N 3.26Å; D84-T86 PolarHBondContact OD1-OG1 2.97Å; D84-T86 PolarHBondContact OD2-OG1 3.48Å; T86-Y88 VanDerWaalsContact C-N 3.33Å; T86-Y88 PolarHBondContact O-N 2.9Å; T86-N89 PolarHBondContact O-N 3.45Å; T86-N90 PolarHBondContact O-N 3.35Å |
| 87 | Y | 50.3 | Low | 48.2 | Very low | 158 Ų | 158 | 130.7 Ų | 130.7 | 62% | 0.62 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -65.6 | -33.3 | -174.6 | -161.8 | -96.7 | 0 | 0 | 0 | 113.1 | D84 M91 | D84-Y87 WeakPolarHBondContact O-CB 3.42Å; D84-Y87 PolarHBondContact O-N 3.4Å; Y87-M91 HydrophobicContact CD1-CE 4.38Å; Y87-M91 HydrophobicContact CE1-CE 3.92Å; Y87-M91 HydrophobicContact CE1-CG 4.47Å; Y87-M91 HydrophobicContact CE1-SD 4.33Å |
| 88 | Y | 45.2 | Very low | 48.3 | Very low | 188 Ų | 188 | 126.8 Ų | 126.8 | 74% | 0.737 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -77.8 | -23.6 | 178.5 | -88 | -82.3 | 0 | 0 | 0 | 114.1 | T86 | T86-Y88 VanDerWaalsContact C-N 3.33Å; T86-Y88 PolarHBondContact O-N 2.9Å |
| 89 | N | 50.4 | Low | 48.2 | Very low | 125 Ų | 125 | 131.5 Ų | 131.5 | 67% | 0.668 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -80.2 | -25.7 | 177.8 | -76.9 | -51.4 | 0 | 0 | 0 | 112.8 | T86 | T86-N89 PolarHBondContact O-N 3.45Å |
| 90 | N | 54 | Low | 48 | Very low | 106 Ų | 106 | 130.2 Ų | 130.2 | 57% | 0.567 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -77.9 | -33.8 | 175.9 | -75.8 | -12.8 | 0 | 0 | 0 | 112.9 | T86 L92 G93 D94 | T86-N90 PolarHBondContact O-N 3.35Å; N90-L92 VanDerWaalsContact C-N 3.34Å; N90-L92 PolarHBondContact O-N 3.07Å; N90-G93 PolarHBondContact O-N 2.92Å; N90-D94 PolarHBondContact O-N 3.5Å |
| 91 | M | 51.1 | Low | 47.9 | Very low | 99 Ų | 99 | 129.3 Ų | 129.3 | 49% | 0.488 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -68 | -31 | 179.9 | -72.2 | -138.3 | -80.9 | 0 | 0 | 113.5 | Y87 L95 | Y87-M91 HydrophobicContact CD1-CE 4.38Å; Y87-M91 HydrophobicContact CE1-CE 3.92Å; Y87-M91 HydrophobicContact CE1-CG 4.47Å; Y87-M91 HydrophobicContact CE1-SD 4.33Å; M91-L95 VanDerWaalsContact O-CB 3.31Å; M91-L95 WeakPolarHBondContact O-CB 3.26Å; M91-L95 PolarHBondContact O-N 3.44Å |
| 92 | L | 52.7 | Low | 47.4 | Very low | 122 Ų | 122 | 129.7 Ų | 129.7 | 64% | 0.639 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -76.5 | -31.1 | 174.5 | -143.5 | 79.7 | 0 | 0 | 0 | 112.1 | N90 L96 | N90-L92 VanDerWaalsContact C-N 3.34Å; N90-L92 PolarHBondContact O-N 3.07Å; L92-L96 WeakPolarHBondContact O-CG 3.48Å; L92-L96 PolarHBondContact O-N 3.35Å |
| 93 | G | 52.5 | Low | 47.4 | Very low | 30 Ų | 30 | 130.8 Ų | 130.8 | 31% | 0.309 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -63.8 | -49.8 | 171 | 0 | 0 | 0 | 0 | 0 | 111.5 | N90 L96 Q97 | N90-G93 PolarHBondContact O-N 2.92Å; G93-L96 PolarHBondContact O-N 2.93Å; G93-Q97 WeakPolarHBondContact O-CB 3.41Å; G93-Q97 PolarHBondContact O-N 2.71Å |
| 94 | D | 53.3 | Low | 47.4 | Very low | 109 Ų | 109 | 128.8 Ų | 128.8 | 58% | 0.583 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -71.5 | -31.6 | -178.6 | -71.8 | -25.5 | 0 | 0 | 0 | 113.2 | N90 L96 Q97 G98 | N90-D94 PolarHBondContact O-N 3.5Å; D94-L96 VanDerWaalsContact C-N 3.28Å; D94-L96 PolarHBondContact O-N 3.3Å; D94-Q97 PolarHBondContact O-N 3.09Å; D94-G98 PolarHBondContact O-N 3.06Å |
| 95 | L | 51.3 | Low | 47.3 | Very low | 138 Ų | 138 | 132.1 Ų | 132.1 | 72% | 0.723 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -68.3 | -28.1 | 174 | -143.6 | 84.4 | 0 | 0 | 0 | 112.5 | M91 | M91-L95 VanDerWaalsContact O-CB 3.31Å; M91-L95 WeakPolarHBondContact O-CB 3.26Å; M91-L95 PolarHBondContact O-N 3.44Å |
| 96 | L | 51.4 | Low | 47.1 | Very low | 129 Ų | 129 | 129.9 Ų | 129.9 | 68% | 0.675 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -89.3 | -28.4 | 175.3 | -68.9 | 171.8 | 0 | 0 | 0 | 112.3 | L92 G93 D94 | L92-L96 WeakPolarHBondContact O-CG 3.48Å; L92-L96 PolarHBondContact O-N 3.35Å; G93-L96 PolarHBondContact O-N 2.93Å; D94-L96 VanDerWaalsContact C-N 3.28Å; D94-L96 PolarHBondContact O-N 3.3Å |
| 97 | Q | 51.6 | Low | 46.5 | Very low | 165 Ų | 165 | 132.6 Ų | 132.6 | 77% | 0.771 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -74.9 | -28.8 | 173.8 | -138.5 | 91.4 | 49 | 0 | 0 | 112.4 | G93 D94 | G93-Q97 WeakPolarHBondContact O-CB 3.41Å; G93-Q97 PolarHBondContact O-N 2.71Å; D94-Q97 PolarHBondContact O-N 3.09Å |
| 98 | G | 44.4 | Very low | 46 | Very low | 64 Ų | 64 | 131.7 Ų | 131.7 | 66% | 0.66 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -80.4 | -8.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | D94 S100 | D94-G98 PolarHBondContact O-N 3.06Å; G98-S100 VanDerWaalsContact C-N 3.28Å; G98-S100 PolarHBondContact O-N 3.17Å |
| 99 | R | 38.8 | Very low | 46.2 | Very low | 207 Ų | 207 | 128.3 Ų | 128.3 | 78% | 0.781 | 71% | 0.705 | S | S | * | * | trans | -76.2 | 85.3 | 166.9 | -94.9 | -168.4 | 174.5 | -161.8 | -0.1 | 109.1 | I101 | R99-I101 WeakPolarHBondContact O-CG1 3.38Å; R99-I101 PolarHBondContact O-N 3.07Å | ||
| 100 | S | 38.3 | Very low | 45.9 | Very low | 95 Ų | 95 | 130.8 Ų | 130.8 | 66% | 0.664 | 71% | 0.712 | S | S | * | * | trans | -52.7 | 99.2 | 161.8 | 172.3 | 0 | 0 | 0 | 0 | 109.6 | G98 L102 | G98-S100 VanDerWaalsContact C-N 3.28Å; G98-S100 PolarHBondContact O-N 3.17Å; S100-L102 PolarHBondContact O-N 2.89Å | ||
| 101 | I | 40.3 | Very low | 45.6 | Very low | 162 Ų | 162 | 132.8 Ų | 132.8 | 83% | 0.831 | 72% | 0.721 | S | S | * | * | trans | -73 | 60.3 | 166.2 | -46.6 | 170.9 | 0 | 0 | 0 | 107.5 | R99 | R99-I101 WeakPolarHBondContact O-CG1 3.38Å; R99-I101 PolarHBondContact O-N 3.07Å | ||
| 102 | L | 37.1 | Very low | 45.1 | Very low | 151 Ų | 151 | 132.4 Ų | 132.4 | 79% | 0.791 | 73% | 0.729 | S | S | * | * | trans | -157.4 | 79.7 | -178.6 | -104.6 | 116.3 | 0 | 0 | 0 | 110 | S100 | S100-L102 PolarHBondContact O-N 2.89Š| ||
| 103 | E | 43.6 | Very low | 44.8 | Very low | 186 Ų | 186 | 133.3 Ų | 133.3 | 87% | 0.869 | 73% | 0.729 | S | S | * | * | trans | -115.7 | 123.4 | 154.6 | -157.6 | 169.7 | -160.8 | 0 | 0 | 107.7 | ||||
| 104 | P | 40.8 | Very low | 44.1 | Very low | 118 Ų | 118 | 141.8 Ų | 141.8 | 77% | 0.766 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 142.4 | -177.1 | -11.7 | 26.9 | 0 | 0 | 0 | 112.5 | ||
| 105 | L | 41.5 | Very low | 43.3 | Very low | 171 Ų | 171 | 142.4 Ų | 142.4 | 90% | 0.895 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 133.6 | -176.3 | -64.3 | 97.7 | 0 | 0 | 0 | 115 | ||
| 106 | T | 46.7 | Very low | 42.7 | Very low | 131 Ų | 131 | 141.6 Ų | 141.6 | 80% | 0.804 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 131.1 | 156.4 | 45.7 | 0 | 0 | 0 | 0 | 110.7 | ||
| 107 | P | 42.1 | Very low | 42.1 | Very low | 130 Ų | 130 | 146.9 Ų | 146.9 | 84% | 0.844 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 146.6 | -177.3 | -9.2 | 25.4 | 0 | 0 | 0 | 114.2 | ||
| 108 | I | 39.6 | Very low | 41.3 | Very low | 140 Ų | 140 | 145 Ų | 145 | 72% | 0.718 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 149.3 | -175.5 | -57.5 | 158.2 | 0 | 0 | 0 | 112.3 | E110 | I108-E110 HydrophobicContact CG2-CG 4.19Š|
| 109 | P | 49.1 | Very low | 41 | Very low | 116 Ų | 116 | 147.1 Ų | 147.1 | 75% | 0.753 | 79% | 0.788 | S | S | * | * | trans | -95.1 | 106.9 | 150.6 | 12.4 | 6.6 | 0 | 0 | 0 | 110.1 | I111 | P109-I111 PolarHBondContact O-N 3.42Š| ||
| 110 | E | 42.9 | Very low | 40.8 | Very low | 177 Ų | 177 | 143.4 Ų | 143.4 | 83% | 0.827 | 79% | 0.788 | S | S | * | * | trans | -72 | 112.3 | 171.6 | -66.8 | -177.7 | 173.7 | 0 | 0 | 109.2 | I108 | I108-E110 HydrophobicContact CG2-CG 4.19Š| ||
| 111 | I | 48.1 | Very low | 40.7 | Very low | 148 Ų | 148 | 144.5 Ų | 144.5 | 76% | 0.759 | 79% | 0.791 | S | S | * | * | trans | -138.1 | 113.6 | 161.6 | 52 | 167.6 | 0 | 0 | 0 | 109.8 | P109 | P109-I111 PolarHBondContact O-N 3.42Š| ||
| 112 | S | 41 | Very low | 40.2 | Very low | 91 Ų | 91 | 141.4 Ų | 141.4 | 64% | 0.636 | 78% | 0.784 | S | S | * | * | trans | 54.9 | 126.9 | 136.1 | 42.5 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 113 | E | 45.4 | Very low | 40.2 | Very low | 141 Ų | 141 | 141.9 Ų | 141.9 | 66% | 0.659 | 79% | 0.785 | S | S | * | * | cis | -168.9 | 161.1 | 20.4 | -89.6 | 144.2 | -146.1 | 0 | 0 | 107.8 | ||||
| 114 | Y | 38.2 | Very low | 39.7 | Very low | 209 Ų | 209 | 139.9 Ų | 139.9 | 82% | 0.82 | 78% | 0.781 | S | S | * | * | trans | 74 | 88.8 | 169.8 | -46.7 | -78.2 | 0 | 0 | 0 | 117.2 | ||||
| 115 | S | 37.5 | Very low | 39.6 | Very low | 121 Ų | 121 | 138.9 Ų | 138.9 | 85% | 0.846 | 77% | 0.774 | S | S | * | * | 172.4 | 105.3 | 91.3 | -158.7 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 116 | T | 38.6 | Very low | 39.1 | Very low | 122 Ų | 122 | 135.4 Ų | 135.4 | 75% | 0.748 | 76% | 0.764 | S | S | * | * | trans | -61.7 | 148.6 | 179.4 | 47.1 | 0 | 0 | 0 | 0 | 113 | ||||
| 117 | R | 38.7 | Very low | 38.5 | Very low | 239 Ų | 239 | 138.5 Ų | 138.5 | 90% | 0.902 | 77% | 0.767 | S | S | * | * | trans | 99.3 | 87 | 156.4 | -51.7 | 178.5 | 92.7 | 165.4 | 5.7 | 115.6 | ||||
| 118 | S | 33.6 | Very low | 38.2 | Very low | 127 Ų | 127 | 136.8 Ų | 136.8 | 89% | 0.888 | 76% | 0.758 | S | S | * | * | trans | -147.9 | 89.8 | 134.6 | -166.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 119 | S | 38.8 | Very low | 38.2 | Very low | 108 Ų | 108 | 142.2 Ų | 142.2 | 76% | 0.755 | 77% | 0.769 | S | S | * | * | trans | -95.3 | 124.9 | 169.4 | -56.9 | 0 | 0 | 0 | 0 | 108 | ||||
| 120 | V | 34.7 | Very low | 37.5 | Very low | 128 Ų | 128 | 145.4 Ų | 145.4 | 78% | 0.776 | 77% | 0.774 | S | S | * | * | trans | 28.5 | 109.2 | 137.3 | -161.9 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 121 | T | 35.9 | Very low | 37.2 | Very low | 119 Ų | 119 | 141.7 Ų | 141.7 | 73% | 0.73 | 77% | 0.768 | S | S | * | * | 157 | 121.2 | 122.6 | 46.6 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 122 | S | 30.7 | Very low | 36.8 | Very low | 97 Ų | 97 | 139.8 Ų | 139.8 | 68% | 0.678 | 77% | 0.767 | S | S | * | * | trans | 65.4 | 145.3 | 137.3 | 76.3 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 123 | I | 36.4 | Very low | 36.6 | Very low | 160 Ų | 160 | 142.1 Ų | 142.1 | 82% | 0.821 | 77% | 0.773 | S | S | * | * | trans | 89.3 | 93.5 | 157.6 | -51.4 | 154.7 | 0 | 0 | 0 | 115.5 | ||||
| 124 | N | 33.4 | Very low | 36.3 | Very low | 144 Ų | 144 | 143.8 Ų | 143.8 | 77% | 0.77 | 79% | 0.785 | S | S | * | * | trans | -57.3 | 170 | 149.3 | -156 | 11.4 | 0 | 0 | 0 | 109.9 | ||||
| 125 | P | 39.3 | Very low | 36.3 | Very low | 97 Ų | 97 | 138.6 Ų | 138.6 | 63% | 0.63 | 78% | 0.78 | S | S | * | * | cis | -124.9 | -171.5 | -20.7 | 17.7 | 8 | 0 | 0 | 0 | 111.4 | ||||
| 126 | S | 30.2 | Very low | 36.4 | Very low | 98 Ų | 98 | 138.4 Ų | 138.4 | 69% | 0.685 | 78% | 0.775 | S | S | * | * | trans | 92.3 | 123.5 | 150.1 | -40.3 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 127 | K | 34.5 | Very low | 36.2 | Very low | 197 Ų | 197 | 138 Ų | 138 | 86% | 0.857 | 78% | 0.777 | S | S | * | * | trans | 57.7 | 106.2 | 145.5 | -60.5 | 173.5 | -178.5 | -179.4 | 0 | 116.9 | ||||
| 128 | S | 34.7 | Very low | 36 | Very low | 93 Ų | 93 | 135 Ų | 135 | 65% | 0.65 | 77% | 0.774 | S | S | * | * | 161.9 | 115 | 117 | 65.4 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 129 | W | 40.9 | Very low | 35.9 | Very low | 255 Ų | 255 | 133.4 Ų | 133.4 | 97% | 0.966 | 76% | 0.762 | S | S | * | * | trans | -135.8 | 78.3 | 134.9 | -79.1 | 90.9 | 0 | 0 | 0 | 105.6 | ||||
| 130 | Q | 35.2 | Very low | 36.1 | Very low | 183 Ų | 183 | 136.2 Ų | 136.2 | 86% | 0.855 | 77% | 0.767 | S | S | * | * | trans | -86.3 | 114.1 | 159.9 | -77.2 | -180 | -48 | 0 | 0 | 107.1 | ||||
| 131 | S | 36.5 | Very low | 36.1 | Very low | 99 Ų | 99 | 137.9 Ų | 137.9 | 69% | 0.692 | 77% | 0.767 | S | S | * | * | trans | -179.2 | 131.1 | 153 | -2.5 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 132 | S | 39.4 | Very low | 36.2 | Very low | 107 Ų | 107 | 140.3 Ų | 140.3 | 75% | 0.748 | 77% | 0.773 | S | S | * | * | cis | -158.3 | 126.3 | 16.8 | -60 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 133 | D | 37 | Very low | 36.4 | Very low | 141 Ų | 141 | 146.1 Ų | 146.1 | 75% | 0.754 | 78% | 0.78 | S | S | * | * | 58 | 94.5 | 86 | -157.9 | 13.6 | 0 | 0 | 0 | 113.1 | |||||
| 134 | L | 37.3 | Very low | 36.4 | Very low | 175 Ų | 175 | 143.9 Ų | 143.9 | 92% | 0.916 | 78% | 0.777 | S | S | * | * | trans | -160.7 | 79.4 | 145.4 | -73.7 | -168.5 | 0 | 0 | 0 | 108.2 | ||||
| 135 | S | 39.8 | Very low | 36.2 | Very low | 101 Ų | 101 | 140.8 Ų | 140.8 | 71% | 0.706 | 78% | 0.779 | S | S | * | * | trans | -85.2 | 169.2 | 155.3 | -51.6 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 136 | P | 39.9 | Very low | 35.6 | Very low | 116 Ų | 116 | 139.4 Ų | 139.4 | 75% | 0.753 | 78% | 0.782 | S | S | * | * | -154.4 | 152.2 | 75.7 | 36.8 | -14.9 | 0 | 0 | 0 | 118 | |||||
| 137 | S | 34.3 | Very low | 35.7 | Very low | 113 Ų | 113 | 140.8 Ų | 140.8 | 79% | 0.79 | 79% | 0.786 | S | S | * | * | trans | 71.7 | 143.4 | 141.2 | -56.2 | 0 | 0 | 0 | 0 | 119 | ||||
| 138 | E | 34.2 | Very low | 35.7 | Very low | 177 Ų | 177 | 139.3 Ų | 139.3 | 83% | 0.827 | 79% | 0.785 | S | S | * | * | cis | -163.2 | 138.1 | 44.6 | -155.9 | 177.3 | 170.2 | 0 | 0 | 112.9 | ||||
| 139 | S | 31.9 | Very low | 35.5 | Very low | 93 Ų | 93 | 138.6 Ų | 138.6 | 65% | 0.65 | 79% | 0.793 | S | S | * | * | trans | 36.5 | 119.7 | 149.3 | 70.4 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 140 | I | 41.6 | Very low | 35 | Very low | 168 Ų | 168 | 129.7 Ų | 129.7 | 86% | 0.862 | 78% | 0.78 | S | S | * | * | -156.2 | 131.5 | 95.1 | -149.9 | 81.7 | 0 | 0 | 0 | 110.4 | |||||
| 141 | E | 34.1 | Very low | 34.8 | Very low | 162 Ų | 162 | 126.6 Ų | 126.6 | 76% | 0.757 | 78% | 0.779 | S | S | * | * | trans | -85.1 | 127.4 | 179.9 | 166.2 | -170.9 | -167.6 | 0 | 0 | 109.8 | ||||
| 142 | I | 39.1 | Very low | 34.3 | Very low | 170 Ų | 170 | 128.6 Ų | 128.6 | 87% | 0.872 | 79% | 0.787 | S | S | * | * | trans | -145.6 | 106.8 | 138.4 | -56.3 | -173 | 0 | 0 | 0 | 110.1 | ||||
| 143 | R | 34.9 | Very low | 34.1 | Very low | 219 Ų | 219 | 127.3 Ų | 127.3 | 83% | 0.826 | 78% | 0.783 | S | S | * | * | trans | 11.2 | 152.4 | 158.6 | -101.9 | -151.5 | 160.7 | 95.6 | -4.9 | 124.7 | ||||
| 144 | P | 35.4 | Very low | 33.7 | Very low | 114 Ų | 114 | 127.1 Ų | 127.1 | 74% | 0.74 | 79% | 0.787 | S | S | * | * | trans | -108.5 | 175.8 | -163.4 | 44.6 | -35.6 | 0 | 0 | 0 | 113.8 | ||||
| 145 | G | 29.7 | Very low | 33.5 | Very low | 79 Ų | 79 | 125.5 Ų | 125.5 | 81% | 0.814 | 78% | 0.779 | S | S | * | * | trans | 122.4 | 115.4 | 144.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 146 | G | 27.6 | Very low | 33.1 | Very low | 67 Ų | 67 | 126 Ų | 126 | 69% | 0.691 | 78% | 0.778 | S | S | * | * | trans | 161.5 | 38.9 | 169.9 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 147 | V | 31.9 | Very low | 32.9 | Very low | 127 Ų | 127 | 126.7 Ų | 126.7 | 77% | 0.77 | 79% | 0.785 | S | S | * | * | trans | 47.9 | 126.1 | 140 | -107 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 148 | I | 34.4 | Very low | 33.3 | Very low | 166 Ų | 166 | 132.2 Ų | 132.2 | 85% | 0.851 | 79% | 0.789 | S | S | * | * | trans | 88.3 | 105.1 | 139.7 | -55.4 | 154.7 | 0 | 0 | 0 | 116.4 | ||||
| 149 | G | 31.3 | Very low | 33.3 | Very low | 78 Ų | 78 | 135 Ų | 135 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | trans | 112.2 | 103.3 | 143.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 150 | G | 30.3 | Very low | 33.8 | Very low | 68 Ų | 68 | 139 Ų | 139 | 70% | 0.701 | 81% | 0.805 | S | S | * | * | trans | 100 | 77.7 | 152 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 151 | S | 29.2 | Very low | 33.9 | Very low | 119 Ų | 119 | 138.8 Ų | 138.8 | 83% | 0.832 | 81% | 0.805 | S | S | * | * | trans | 47.4 | 80.8 | 133.9 | -173 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 152 | T | 27.7 | Very low | 34 | Very low | 140 Ų | 140 | 138 Ų | 138 | 86% | 0.859 | 80% | 0.801 | S | S | * | * | trans | -122.4 | 82.4 | 154.8 | 56.3 | 0 | 0 | 0 | 0 | 109 | ||||
| 153 | A | 34.7 | Very low | 34.3 | Very low | 81 Ų | 81 | 135.8 Ų | 135.8 | 67% | 0.669 | 80% | 0.797 | S | S | * | * | trans | -104.9 | 93.7 | 170.7 | 0 | 0 | 0 | 0 | 0 | 109 | N155 | A153-N155 PolarHBondContact O-N 3.24Š| ||
| 154 | T | 28.1 | Very low | 34.5 | Very low | 136 Ų | 136 | 132.1 Ų | 132.1 | 83% | 0.834 | 79% | 0.788 | S | S | * | * | trans | -57.8 | 122.2 | 159.1 | 43.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 155 | N | 32.8 | Very low | 34.7 | Very low | 141 Ų | 141 | 135.4 Ų | 135.4 | 75% | 0.754 | 80% | 0.798 | S | S | * | * | trans | -140.4 | 108.2 | 172 | -105.6 | -31.6 | 0 | 0 | 0 | 111.6 | A153 | A153-N155 PolarHBondContact O-N 3.24Š| ||
| 156 | V | 31.5 | Very low | 35 | Very low | 113 Ų | 113 | 138.8 Ų | 138.8 | 69% | 0.685 | 79% | 0.792 | S | S | * | * | trans | 52.9 | 92.8 | 132.4 | -150.8 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 157 | S | 35.7 | Very low | 35.4 | Very low | 129 Ų | 129 | 141.5 Ų | 141.5 | 90% | 0.902 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -91.1 | 120.9 | 153.4 | -74.1 | 0 | 0 | 0 | 0 | 110.3 | ||
| 158 | R | 42.5 | Very low | 35.4 | Very low | 230 Ų | 230 | 141.9 Ų | 141.9 | 87% | 0.868 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 142.1 | -176.8 | -65.6 | 178 | -176.4 | -168.3 | 0.5 | 111.7 | ||
| 159 | R | 33.9 | Very low | 35.4 | Very low | 235 Ų | 235 | 145 Ų | 145 | 89% | 0.887 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -48.2 | 130.6 | 168.2 | -76.6 | 166 | 153 | 165.1 | -8.4 | 112.7 | ||
| 160 | L | 44.3 | Very low | 35.6 | Very low | 176 Ų | 176 | 146.5 Ų | 146.5 | 92% | 0.921 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -102.9 | 130.6 | 147.7 | -74.3 | 173.6 | 0 | 0 | 0 | 108.2 | ||
| 161 | L | 42.8 | Very low | 35.8 | Very low | 164 Ų | 164 | 148.2 Ų | 148.2 | 86% | 0.859 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 136.7 | -175.5 | -72.6 | 152.9 | 0 | 0 | 0 | 111 | ||
| 162 | H | 36.5 | Very low | 36.1 | Very low | 147 Ų | 147 | 150.2 Ų | 150.2 | 68% | 0.681 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -67 | 162.2 | 165.3 | -113.3 | -84.1 | 0 | 0 | 0 | 111.2 | F164 | H162-F164 HydrophobicContact CB-CD2 4.18Å; H162-F164 HydrophobicContact CB-CE2 4.18Å |
| 163 | P | 45.9 | Very low | 36.6 | Very low | 122 Ų | 122 | 150.9 Ų | 150.9 | 79% | 0.792 | 78% | 0.784 | S | S | * | * | -115.8 | 139.6 | 118.9 | 0.1 | 19.1 | 0 | 0 | 0 | 111.1 | |||||
| 164 | F | 37.4 | Very low | 36.7 | Very low | 143 Ų | 143 | 151.5 Ų | 151.5 | 63% | 0.627 | 78% | 0.783 | S | S | * | * | trans | -78.6 | 135.9 | 172.9 | -72.3 | -98.6 | 0 | 0 | 0 | 110.3 | H162 H166 | H162-F164 HydrophobicContact CB-CD2 4.18Å; H162-F164 HydrophobicContact CB-CE2 4.18Å; F164-H166 AromaticContact CD1-CD2 3.86Å; F164-H166 AromaticContact CD1-NE2 3.55Å; F164-H166 AromaticContact CE1-NE2 3.77Å | ||
| 165 | L | 41.7 | Very low | 37.1 | Very low | 182 Ų | 182 | 154.4 Ų | 154.4 | 95% | 0.953 | 79% | 0.785 | S | S | * | * | trans | -141.3 | 97.2 | 140.8 | -85.1 | 176 | 0 | 0 | 0 | 108.2 | ||||
| 166 | H | 34 | Very low | 37.3 | Very low | 151 Ų | 151 | 153.4 Ų | 153.4 | 70% | 0.699 | 79% | 0.788 | S | S | * | * | trans | -74.8 | 137.4 | 165.7 | -71.6 | -59.5 | 0 | 0 | 0 | 109.7 | F164 | F164-H166 AromaticContact CD1-CD2 3.86Å; F164-H166 AromaticContact CD1-NE2 3.55Å; F164-H166 AromaticContact CE1-NE2 3.77Å | ||
| 167 | S | 36.3 | Very low | 37.3 | Very low | 124 Ų | 124 | 151.7 Ų | 151.7 | 87% | 0.867 | 79% | 0.794 | S | S | * | * | -156.2 | 131.3 | 127.7 | -144.6 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 168 | N | 32.1 | Very low | 37.4 | Very low | 135 Ų | 135 | 151.7 Ų | 151.7 | 72% | 0.722 | 79% | 0.79 | S | S | * | * | trans | -71.8 | 146.5 | -171.1 | -75.2 | -59.6 | 0 | 0 | 0 | 114.6 | ||||
| 169 | R | 35.1 | Very low | 37.3 | Very low | 231 Ų | 231 | 149.6 Ų | 149.6 | 87% | 0.872 | 79% | 0.791 | S | S | * | * | 174.7 | 103.8 | 126.6 | -104 | 174.3 | 151 | -178.4 | -7.6 | 108.3 | |||||
| 170 | T | 34.4 | Very low | 37.3 | Very low | 110 Ų | 110 | 147.9 Ų | 147.9 | 68% | 0.675 | 79% | 0.79 | S | S | * | * | 36.2 | 124.6 | 85.7 | 73.7 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 171 | S | 34.8 | Very low | 36.8 | Very low | 104 Ų | 104 | 145.1 Ų | 145.1 | 73% | 0.727 | 79% | 0.785 | S | S | * | * | cis | 175.5 | 156.2 | 12.5 | 38.6 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 172 | H | 35.5 | Very low | 36.3 | Very low | 161 Ų | 161 | 147.3 Ų | 147.3 | 75% | 0.745 | 79% | 0.788 | S | S | * | * | trans | 85 | 128.1 | 146 | -123.5 | -109.2 | 0 | 0 | 0 | 120.3 | ||||
| 173 | E | 37.8 | Very low | 36.3 | Very low | 154 Ų | 154 | 149.7 Ų | 149.7 | 72% | 0.72 | 80% | 0.796 | S | S | * | * | trans | 98.4 | 92.1 | 139.6 | -116.2 | 158.9 | 159.5 | 0 | 0 | 120.8 | ||||
| 174 | S | 38.4 | Very low | 35.7 | Very low | 94 Ų | 94 | 151.6 Ų | 151.6 | 66% | 0.657 | 80% | 0.8 | S | S | * | * | 70.3 | 113.2 | 117.2 | -57.1 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 175 | F | 34.8 | Very low | 35.9 | Very low | 197 Ų | 197 | 150.6 Ų | 150.6 | 86% | 0.864 | 81% | 0.808 | S | S | * | * | trans | 46.3 | 116.7 | 130.6 | -78.5 | -91.5 | 0 | 0 | 0 | 119.3 | ||||
| 176 | S | 37.7 | Very low | 35.4 | Very low | 119 Ų | 119 | 145.9 Ų | 145.9 | 83% | 0.832 | 80% | 0.795 | S | S | * | * | 171.9 | 110.8 | 106.8 | -77.1 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 177 | G | 31.6 | Very low | 35.3 | Very low | 77 Ų | 77 | 146.8 Ų | 146.8 | 79% | 0.794 | 80% | 0.804 | S | S | * | * | 79.9 | 149 | 128.1 | 0 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 178 | P | 38.2 | Very low | 35.1 | Very low | 129 Ų | 129 | 145.7 Ų | 145.7 | 84% | 0.838 | 80% | 0.796 | S | S | * | * | trans | -107.8 | 141.2 | -160.1 | 36.6 | -23.6 | 0 | 0 | 0 | 113.5 | ||||
| 179 | Q | 39.1 | Very low | 35.1 | Very low | 187 Ų | 187 | 145.3 Ų | 145.3 | 87% | 0.874 | 80% | 0.799 | S | S | * | * | trans | -141.8 | 107.2 | 165.7 | -93.5 | -169.4 | -13.7 | 0 | 0 | 113 | ||||
| 180 | K | 35.5 | Very low | 35 | Very low | 199 Ų | 199 | 141.7 Ų | 141.7 | 87% | 0.865 | 79% | 0.791 | S | S | * | * | 21.2 | 114.9 | 127.6 | -59.3 | 175 | 180 | -179.2 | 0 | 116 | |||||
| 181 | S | 34.3 | Very low | 34.8 | Very low | 118 Ų | 118 | 141.9 Ų | 141.9 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | -178.6 | 128.6 | 108.8 | 53.5 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 182 | F | 31 | Very low | 34.9 | Very low | 209 Ų | 209 | 144.4 Ų | 144.4 | 92% | 0.917 | 80% | 0.801 | S | S | * | * | trans | -62.5 | 125.6 | 164 | -73.5 | -99.1 | 0 | 0 | 0 | 110.1 | ||||
| 183 | K | 37.7 | Very low | 34.8 | Very low | 198 Ų | 198 | 141.7 Ų | 141.7 | 86% | 0.861 | 80% | 0.8 | S | S | * | * | trans | -168.4 | 105.2 | 145.2 | -124.6 | 163.6 | 179 | 175 | 0 | 111.2 | ||||
| 184 | N | 32.5 | Very low | 34.5 | Very low | 161 Ų | 161 | 139.8 Ų | 139.8 | 86% | 0.861 | 80% | 0.804 | S | S | * | * | trans | -61.1 | 142.4 | 149.8 | -82.7 | -38.5 | 0 | 0 | 0 | 108.6 | ||||
| 185 | P | 41.4 | Very low | 34.5 | Very low | 123 Ų | 123 | 142.8 Ų | 142.8 | 80% | 0.799 | 81% | 0.811 | S | S | * | * | trans | -119.8 | 106.3 | 145 | 28.8 | -13.5 | 0 | 0 | 0 | 108.9 | ||||
| 186 | A | 30.8 | Very low | 34.4 | Very low | 83 Ų | 83 | 142.1 Ų | 142.1 | 69% | 0.686 | 81% | 0.81 | S | S | * | * | trans | -59.1 | 152.7 | 148.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 187 | L | 31.3 | Very low | 34.4 | Very low | 169 Ų | 169 | 141.9 Ų | 141.9 | 89% | 0.885 | 81% | 0.809 | S | S | * | * | trans | 76.9 | 106 | 162.2 | -47.2 | 175.2 | 0 | 0 | 0 | 117 | ||||
| 188 | S | 32.3 | Very low | 34.7 | Very low | 101 Ų | 101 | 146 Ų | 146 | 71% | 0.706 | 81% | 0.807 | S | S | * | * | trans | -153.8 | 88.5 | 134.2 | -169.6 | 0 | 0 | 0 | 0 | 110.3 | H190 | S188-H190 PolarHBondContact O-N 2.94Š| ||
| 189 | V | 32.3 | Very low | 35.2 | Very low | 127 Ų | 127 | 145.6 Ų | 145.6 | 77% | 0.77 | 80% | 0.804 | S | S | * | * | trans | -70.9 | 111.8 | 155 | 177.5 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 190 | H | 34.1 | Very low | 35.1 | Very low | 155 Ų | 155 | 143.4 Ų | 143.4 | 72% | 0.718 | 80% | 0.799 | S | S | * | * | trans | -121.6 | 97.6 | 166.3 | -102.3 | 39.6 | 0 | 0 | 0 | 109 | S188 I192 | S188-H190 PolarHBondContact O-N 2.94Å; H190-I192 PolarHBondContact O-N 3.09Å | ||
| 191 | S | 30.8 | Very low | 35.5 | Very low | 114 Ų | 114 | 144.6 Ų | 144.6 | 80% | 0.797 | 80% | 0.798 | S | S | * | * | trans | -56.1 | 123.2 | 158.6 | -49.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 192 | I | 36.7 | Very low | 35.9 | Very low | 157 Ų | 157 | 144.3 Ų | 144.3 | 81% | 0.805 | 79% | 0.786 | S | S | * | * | trans | -125.3 | 118.3 | 168.2 | -26.5 | 179 | 0 | 0 | 0 | 108.7 | H190 | H190-I192 PolarHBondContact O-N 3.09Š| ||
| 193 | S | 32.7 | Very low | 36.1 | Very low | 105 Ų | 105 | 145.6 Ų | 145.6 | 73% | 0.734 | 79% | 0.785 | S | S | * | * | trans | -29.7 | 130.7 | 177.7 | -68 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 194 | S | 31.9 | Very low | 36.5 | Very low | 114 Ų | 114 | 145 Ų | 145 | 80% | 0.797 | 78% | 0.777 | S | S | * | * | 18.6 | 109.3 | 119.5 | 170.6 | 0 | 0 | 0 | 0 | 117.9 | |||||
| 195 | I | 37.7 | Very low | 36.8 | Very low | 157 Ų | 157 | 142.1 Ų | 142.1 | 81% | 0.805 | 77% | 0.77 | S | S | * | * | trans | -153.3 | 106.5 | 146.9 | 8.6 | 174 | 0 | 0 | 0 | 110.9 | ||||
| 196 | H | 33.1 | Very low | 36.9 | Very low | 182 Ų | 182 | 144.3 Ų | 144.3 | 84% | 0.843 | 76% | 0.763 | S | S | * | * | trans | 52.1 | 109.7 | 133.4 | -118.8 | -66.4 | 0 | 0 | 0 | 119.6 | ||||
| 197 | S | 38.2 | Very low | 37.2 | Very low | 115 Ų | 115 | 148.2 Ų | 148.2 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | 169.5 | 92.8 | 117.7 | 39.3 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 198 | E | 37.1 | Very low | 37.5 | Very low | 163 Ų | 163 | 144.5 Ų | 144.5 | 76% | 0.762 | 75% | 0.751 | S | S | * | * | trans | -92.1 | 131.7 | 162.8 | -142.9 | -106.7 | 178 | 0 | 0 | 107.3 | D200 | E198-D200 PolarHBondContact O-N 3.02Š| ||
| 199 | P | 48.8 | Very low | 38.1 | Very low | 120 Ų | 120 | 147.6 Ų | 147.6 | 78% | 0.779 | 75% | 0.754 | S | S | * | * | trans | -92.5 | 85.3 | 172.9 | 33.7 | -26.9 | 0 | 0 | 0 | 110 | R201 | P199-R201 PolarHBondContact O-N 3.16Š| ||
| 200 | D | 36 | Very low | 38.4 | Very low | 141 Ų | 141 | 146.5 Ų | 146.5 | 75% | 0.754 | 75% | 0.753 | S | S | * | * | trans | -67.3 | 104.2 | 160.6 | -163.2 | 1 | 0 | 0 | 0 | 108.9 | E198 | E198-D200 PolarHBondContact O-N 3.02Š| ||
| 201 | R | 44.4 | Very low | 39 | Very low | 225 Ų | 225 | 146.3 Ų | 146.3 | 85% | 0.849 | 75% | 0.754 | S | S | * | * | trans | -141.8 | 103.1 | 164.3 | -95.5 | -167.5 | -169.3 | -167.6 | 4.5 | 112.5 | P199 | P199-R201 PolarHBondContact O-N 3.16Š| ||
| 202 | I | 42.9 | Very low | 39.3 | Very low | 111 Ų | 111 | 148.7 Ų | 148.7 | 57% | 0.569 | 75% | 0.752 | S | S | * | * | trans | 90.1 | 73.3 | 136.7 | -49.2 | 158.9 | 0 | 0 | 0 | 115 | R204 | I202-R204 PolarHBondContact O-N 3.39Š| ||
| 203 | R | 36.2 | Very low | 39.4 | Very low | 237 Ų | 237 | 146.8 Ų | 146.8 | 89% | 0.894 | 75% | 0.753 | S | S | * | * | -5.1 | 110.8 | 115.9 | 176 | 179.3 | 148.1 | 149.2 | -2.6 | 114 | |||||
| 204 | R | 45.4 | Very low | 39.7 | Very low | 185 Ų | 185 | 147.4 Ų | 147.4 | 70% | 0.698 | 76% | 0.755 | S | S | * | * | trans | -160.4 | 99.3 | 149.2 | -106.7 | -174.3 | -83 | 172 | 2 | 111 | I202 Y206 | I202-R204 PolarHBondContact O-N 3.39Å; R204-Y206 WeakPolarHBondContact CD-OH 3.41Å; R204-Y206 HydrophobicContact CG-CE1 4.01Å; R204-Y206 WeakPolarHBondContact CG-OH 3.48Å | ||
| 205 | S | 39.1 | Very low | 40.1 | Very low | 101 Ų | 101 | 145.3 Ų | 145.3 | 71% | 0.706 | 75% | 0.751 | S | S | * | * | trans | -90.9 | 122.1 | 171.3 | 41.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 206 | Y | 42.8 | Very low | 40.2 | Very low | 169 Ų | 169 | 146.2 Ų | 146.2 | 66% | 0.663 | 75% | 0.752 | S | S | * | * | trans | -170.8 | 114.6 | 154.1 | 18.2 | -106.4 | 0 | 0 | 0 | 108.4 | R204 | R204-Y206 WeakPolarHBondContact CD-OH 3.41Å; R204-Y206 HydrophobicContact CG-CE1 4.01Å; R204-Y206 WeakPolarHBondContact CG-OH 3.48Å | ||
| 207 | E | 37.7 | Very low | 40.4 | Very low | 164 Ų | 164 | 144 Ų | 144 | 77% | 0.766 | 75% | 0.746 | S | S | * | * | 92.9 | 105.8 | 81 | -167.6 | 83.6 | -136.4 | 0 | 0 | 110.8 | |||||
| 208 | T | 36.8 | Very low | 40.1 | Very low | 91 Ų | 91 | 144 Ų | 144 | 56% | 0.558 | 75% | 0.745 | S | S | * | * | trans | 60.8 | 130.1 | 131.6 | -32 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 209 | H | 45.3 | Very low | 40.3 | Very low | 166 Ų | 166 | 147.3 Ų | 147.3 | 77% | 0.769 | 75% | 0.752 | S | S | * | * | -174 | 154.6 | 72.2 | -50.2 | -77.5 | 0 | 0 | 0 | 105.6 | |||||
| 210 | S | 39.3 | Very low | 40 | Very low | 105 Ų | 105 | 149.5 Ų | 149.5 | 73% | 0.734 | 75% | 0.754 | S | S | * | * | 173.3 | 127.8 | 50.8 | -166.1 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 211 | M | 46.1 | Very low | 40.2 | Very low | 150 Ų | 150 | 149.3 Ų | 149.3 | 74% | 0.739 | 75% | 0.753 | S | S | * | * | trans | 44.3 | 106.1 | 143.7 | -44.5 | -56.7 | -86 | 0 | 0 | 119.1 | ||||
| 212 | E | 38.1 | Very low | 40 | Very low | 164 Ų | 164 | 146 Ų | 146 | 77% | 0.766 | 75% | 0.751 | S | S | * | * | 81.3 | 110.5 | 85.3 | -171.7 | 161.7 | -174.3 | 0 | 0 | 114.6 | |||||
| 213 | S | 38 | Very low | 39.8 | Very low | 117 Ų | 117 | 145.3 Ų | 145.3 | 82% | 0.818 | 76% | 0.757 | S | S | * | * | trans | -171.6 | 122.2 | 133.2 | -168.7 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 214 | P | 39.2 | Very low | 39.9 | Very low | 119 Ų | 119 | 139.7 Ų | 139.7 | 77% | 0.773 | 75% | 0.753 | S | S | * | * | trans | -93.7 | 132.5 | 176.2 | 34.6 | -26.8 | 0 | 0 | 0 | 110.4 | ||||
| 215 | G | 40.3 | Very low | 39.6 | Very low | 70 Ų | 70 | 135 Ų | 135 | 72% | 0.722 | 75% | 0.749 | S | S | * | * | trans | 157 | 139.1 | 166.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 216 | Q | 40 | Very low | 39.5 | Very low | 175 Ų | 175 | 138.7 Ų | 138.7 | 82% | 0.818 | 76% | 0.76 | S | S | * | * | trans | 86.3 | 90.4 | 160.7 | -82.5 | 159.6 | -23.4 | 0 | 0 | 118.6 | ||||
| 217 | D | 37.3 | Very low | 39.4 | Very low | 135 Ų | 135 | 139.6 Ų | 139.6 | 72% | 0.722 | 76% | 0.762 | S | S | * | * | 59.7 | 109.4 | 109.4 | -55.2 | -23.8 | 0 | 0 | 0 | 118.1 | |||||
| 218 | C | 32 | Very low | 39.4 | Very low | 117 Ų | 117 | 138 Ų | 138 | 79% | 0.791 | 76% | 0.764 | S | S | * | * | trans | 22.2 | 116.1 | 134.3 | -54.4 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 219 | Y | 41 | Very low | 39.9 | Very low | 232 Ų | 232 | 140.7 Ų | 140.7 | 91% | 0.91 | 77% | 0.77 | S | S | * | * | -168.1 | 123.5 | 125.6 | -109.4 | -81.7 | 0 | 0 | 0 | 109.3 | D221 | Y219-D221 PolarHBondContact O-N 3.34Š| |||
| 220 | M | 42.7 | Very low | 39.4 | Very low | 165 Ų | 165 | 138.2 Ų | 138.2 | 81% | 0.813 | 77% | 0.771 | S | S | * | * | trans | -58.1 | 125 | 165.6 | -86.5 | -80.9 | 174.2 | 0 | 0 | 109.3 | L222 | M220-L222 HydrophobicContact SD-CD1 4.46Å; M220-L222 HydrophobicContact SD-CG 4.4Å | ||
| 221 | D | 39.1 | Very low | 39.6 | Very low | 138 Ų | 138 | 138 Ų | 138 | 74% | 0.738 | 77% | 0.769 | S | S | * | * | trans | -124.1 | 81.9 | 165.6 | -153.4 | 0.8 | 0 | 0 | 0 | 109.9 | Y219 S223 | Y219-D221 PolarHBondContact O-N 3.34Å; D221-S223 VanDerWaalsContact C-N 3.28Å; D221-S223 PolarHBondContact O-N 2.94Å | ||
| 222 | L | 41.4 | Very low | 39.3 | Very low | 154 Ų | 154 | 142 Ų | 142 | 81% | 0.806 | 78% | 0.776 | S | S | * | * | trans | -85 | 66.1 | 166.4 | -71.5 | 171 | 0 | 0 | 0 | 108.6 | M220 | M220-L222 HydrophobicContact SD-CD1 4.46Å; M220-L222 HydrophobicContact SD-CG 4.4Å | ||
| 223 | S | 39 | Very low | 39.3 | Very low | 98 Ų | 98 | 139.9 Ų | 139.9 | 69% | 0.685 | 78% | 0.779 | S | S | * | * | trans | -163 | 64.5 | 177.2 | -82.7 | 0 | 0 | 0 | 0 | 114.3 | D221 | D221-S223 VanDerWaalsContact C-N 3.28Å; D221-S223 PolarHBondContact O-N 2.94Å | ||
| 224 | S | 38.4 | Very low | 39.7 | Very low | 118 Ų | 118 | 139.1 Ų | 139.1 | 83% | 0.825 | 77% | 0.774 | S | S | * | * | trans | -170.7 | 127.5 | 149.1 | 51.8 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 225 | S | 37.6 | Very low | 40 | Very low | 86 Ų | 86 | 137 Ų | 137 | 60% | 0.601 | 76% | 0.762 | S | S | * | * | -166 | 104.8 | 51.2 | 164.9 | 0 | 0 | 0 | 0 | 107.7 | R227 | S225-R227 VanDerWaalsContact C-N 3.29Å; S225-R227 PolarHBondContact O-N 3.47Å | |||
| 226 | L | 36.7 | Very low | 40.6 | Very low | 179 Ų | 179 | 140 Ų | 140 | 94% | 0.937 | 76% | 0.761 | S | S | * | * | trans | -62.1 | 93.6 | 157.3 | -77.1 | 163 | 0 | 0 | 0 | 107.8 | ||||
| 227 | R | 42.5 | Very low | 41.6 | Very low | 188 Ų | 188 | 134.2 Ų | 134.2 | 71% | 0.709 | 74% | 0.743 | S | S | * | * | trans | -112.9 | 90.4 | 169.1 | -125.7 | 171.7 | -158.4 | 164.9 | 11.4 | 109.9 | S225 H229 | S225-R227 VanDerWaalsContact C-N 3.29Å; S225-R227 PolarHBondContact O-N 3.47Å; R227-H229 VanDerWaalsContact CD-NE2 3.25Å; R227-H229 WeakPolarHBondContact CD-NE2 3.4Å; R227-H229 WeakPolarHBondContact CG-NE2 3.32Å; R227-H229 PolarHBondContact O-N 3.42Å; R227-H229 VanDerWaalsContact O-N 3.15Å | ||
| 228 | T | 35.8 | Very low | 42.4 | Very low | 131 Ų | 131 | 132.6 Ų | 132.6 | 80% | 0.804 | 73% | 0.731 | S | S | * | * | trans | -59.9 | 103 | 164.1 | 49.1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 229 | H | 47.4 | Very low | 43.7 | Very low | 148 Ų | 148 | 133.8 Ų | 133.8 | 69% | 0.685 | 72% | 0.723 | S | S | * | * | trans | -113 | 94.4 | 164.1 | -61.5 | -60.8 | 0 | 0 | 0 | 109.1 | R227 S231 | R227-H229 VanDerWaalsContact CD-NE2 3.25Å; R227-H229 WeakPolarHBondContact CD-NE2 3.4Å; R227-H229 WeakPolarHBondContact CG-NE2 3.32Å; R227-H229 PolarHBondContact O-N 3.42Å; R227-H229 VanDerWaalsContact O-N 3.15Å; H229-S231 PolarHBondContact O-N 3.29Å | ||
| 230 | S | 36.4 | Very low | 44.7 | Very low | 113 Ų | 113 | 126.9 Ų | 126.9 | 79% | 0.79 | 70% | 0.702 | S | S | * | * | trans | -40.6 | 121.3 | 156.6 | 169.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 231 | S | 42.4 | Very low | 45.7 | Very low | 100 Ų | 100 | 126.3 Ų | 126.3 | 70% | 0.699 | 69% | 0.691 | S | S | * | * | 170.1 | 107 | 119.4 | -72.1 | 0 | 0 | 0 | 0 | 110.4 | H229 | H229-S231 PolarHBondContact O-N 3.29Š| |||
| 232 | R | 40.8 | Very low | 46.5 | Very low | 235 Ų | 235 | 125 Ų | 125 | 89% | 0.887 | 68% | 0.683 | S | S | * | * | trans | 41.7 | 118.6 | 133.4 | -71.6 | 174.2 | 142.1 | 172.4 | -7.5 | 118.1 | ||||
| 233 | S | 38 | Very low | 47.1 | Very low | 119 Ų | 119 | 123.6 Ų | 123.6 | 83% | 0.832 | 67% | 0.672 | S | S | * | * | trans | 69.3 | 79.2 | 146 | 53.1 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 234 | S | 45.8 | Very low | 47.8 | Very low | 102 Ų | 102 | 123.9 Ų | 123.9 | 71% | 0.713 | 67% | 0.67 | S | S | * | * | trans | -157.2 | 128.9 | 149.2 | 54.5 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 235 | S | 44.6 | Very low | 48.2 | Very low | 73 Ų | 73 | 122 Ų | 122 | 51% | 0.51 | 66% | 0.657 | S | S | . | * | cis | -166 | 140.6 | -16.3 | 173.4 | 0 | 0 | 0 | 0 | 101.7 | A237 E238 | S235-A237 PolarHBondContact O-N 3.49Å; S235-A237 VanDerWaalsContact OG-CB 3.24Å; S235-A237 WeakPolarHBondContact OG-CB 3.49Å; S235-A237 PolarHBondContact OG-N 2.93Å; S235-E238 PolarHBondContact O-N 2.94Å | ||
| 236 | L | 53.9 | Low | 48.8 | Very low | 133 Ų | 133 | 123.6 Ų | 123.6 | 70% | 0.696 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -50.4 | -20.4 | 169.5 | -175.3 | 140.2 | 0 | 0 | 0 | 111.7 | E238 F239 L240 | L236-E238 PolarHBondContact O-N 3.41Å; L236-F239 PolarHBondContact O-N 3.44Å; L236-L240 HydrophobicContact CD2-CD1 3.42Å; L236-L240 VanDerWaalsContact CD2-CD1 3.42Å; L236-L240 HydrophobicContact CD2-CG 3.84Å; L236-L240 WeakPolarHBondContact O-CG 3.42Å; L236-L240 PolarHBondContact O-N 3.11Å |
| 237 | A | 60.9 | Low | 49.4 | Very low | 55 Ų | 55 | 122.4 Ų | 122.4 | 46% | 0.455 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -62 | -30.2 | 169.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | S235 R241 | S235-A237 PolarHBondContact O-N 3.49Å; S235-A237 VanDerWaalsContact OG-CB 3.24Å; S235-A237 WeakPolarHBondContact OG-CB 3.49Å; S235-A237 PolarHBondContact OG-N 2.93Å; A237-R241 WeakPolarHBondContact O-CB 3.49Å; A237-R241 PolarHBondContact O-N 3.42Å |
| 238 | E | 53.7 | Low | 49.8 | Very low | 101 Ų | 101 | 117 Ų | 117 | 47% | 0.472 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -75.3 | -33.8 | 176.6 | -163.8 | 164.9 | -140.5 | 0 | 0 | 111.1 | S235 L236 R241 L242 | S235-E238 PolarHBondContact O-N 2.94Å; L236-E238 PolarHBondContact O-N 3.41Å; E238-R241 IonicContact OE1-NH2 3.75Å; E238-L242 WeakPolarHBondContact O-CB 3.43Å; E238-L242 WeakPolarHBondContact O-CD1 3.46Å; E238-L242 WeakPolarHBondContact O-CG 3.48Å; E238-L242 PolarHBondContact O-N 3.03Å |
| 239 | F | 59.6 | Low | 50.4 | Low | 141 Ų | 141 | 116.5 Ų | 116.5 | 62% | 0.618 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -70.5 | -47.2 | 172.7 | -154.7 | -92.8 | 0 | 0 | 0 | 111.7 | L236 R241 L242 E243 | L236-F239 PolarHBondContact O-N 3.44Å; F239-R241 VanDerWaalsContact C-N 3.31Å; F239-R241 PolarHBondContact O-N 3.31Å; F239-L242 PolarHBondContact O-N 3.39Å; F239-E243 HydrophobicContact CD1-CG 4.34Å; F239-E243 HydrophobicContact CE1-CG 4.39Å; F239-E243 VanDerWaalsContact CE1-OE1 3.24Å; F239-E243 WeakPolarHBondContact CE1-OE1 3.25Å; F239-E243 WeakPolarHBondContact O-CG 3.23Å; F239-E243 PolarHBondContact O-N 3.09Å |
| 240 | L | 61.1 | Low | 50.5 | Low | 87 Ų | 87 | 120.9 Ų | 120.9 | 46% | 0.455 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -62.8 | -36.3 | 173.6 | -71.9 | 177 | 0 | 0 | 0 | 112.2 | L236 E243 T244 | L236-L240 HydrophobicContact CD2-CD1 3.42Å; L236-L240 VanDerWaalsContact CD2-CD1 3.42Å; L236-L240 HydrophobicContact CD2-CG 3.84Å; L236-L240 WeakPolarHBondContact O-CG 3.42Å; L236-L240 PolarHBondContact O-N 3.11Å; L240-E243 PolarHBondContact O-N 2.76Å; L240-T244 WeakPolarHBondContact O-CG2 3.29Å; L240-T244 PolarHBondContact O-N 3Å; L240-T244 PolarHBondContact O-OG1 3Å |
| 241 | R | 65.1 | Low | 51.1 | Low | 154 Ų | 154 | 118.1 Ų | 118.1 | 58% | 0.581 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -66.6 | -42.7 | 176.2 | -163.6 | 179.1 | 70.5 | -161.6 | -3.9 | 110.5 | A237 E238 F239 E243 T244 S245 | A237-R241 WeakPolarHBondContact O-CB 3.49Å; A237-R241 PolarHBondContact O-N 3.42Å; E238-R241 IonicContact OE1-NH2 3.75Å; F239-R241 VanDerWaalsContact C-N 3.31Å; F239-R241 PolarHBondContact O-N 3.31Å; R241-E243 VanDerWaalsContact C-N 3.35Å; R241-T244 WeakPolarHBondContact CA-OG1 3.43Å; R241-T244 CarbonylContact O-C 3.6Å; R241-T244 PolarHBondContact O-N 2.75Å; R241-T244 PolarHBondContact O-OG1 3.48Å; R241-S245 WeakPolarHBondContact O-CB 3.46Å; R241-S245 PolarHBondContact O-N 3.27Å; R241-S245 VanDerWaalsContact O-N 3.07Å; R241-S245 PolarHBondContact O-OG 3.25Å |
| 242 | L | 55.7 | Low | 51.3 | Low | 110 Ų | 110 | 120.4 Ų | 120.4 | 58% | 0.576 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -62.3 | -37.9 | 172.7 | -83.8 | 157.2 | 0 | 0 | 0 | 112.4 | E238 F239 T244 S245 | E238-L242 WeakPolarHBondContact O-CB 3.43Å; E238-L242 WeakPolarHBondContact O-CD1 3.46Å; E238-L242 WeakPolarHBondContact O-CG 3.48Å; E238-L242 PolarHBondContact O-N 3.03Å; F239-L242 PolarHBondContact O-N 3.39Å; L242-T244 VanDerWaalsContact C-N 3.34Å; L242-T244 PolarHBondContact O-N 3.19Å; L242-S245 PolarHBondContact O-N 3.03Å; L242-S245 VanDerWaalsContact O-N 3.16Å |
| 243 | E | 54.6 | Low | 51.8 | Low | 124 Ų | 124 | 116.7 Ų | 116.7 | 58% | 0.579 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -66.9 | -32.7 | 174.3 | -76 | 179.3 | 164.2 | 0 | 0 | 112.7 | F239 L240 R241 S245 | F239-E243 HydrophobicContact CD1-CG 4.34Å; F239-E243 HydrophobicContact CE1-CG 4.39Å; F239-E243 VanDerWaalsContact CE1-OE1 3.24Å; F239-E243 WeakPolarHBondContact CE1-OE1 3.25Å; F239-E243 WeakPolarHBondContact O-CG 3.23Å; F239-E243 PolarHBondContact O-N 3.09Å; L240-E243 PolarHBondContact O-N 2.76Å; R241-E243 VanDerWaalsContact C-N 3.35Å; E243-S245 VanDerWaalsContact C-N 3.33Å |
| 244 | T | 53.2 | Low | 52.2 | Low | 104 Ų | 104 | 115.1 Ų | 115.1 | 64% | 0.638 | 66% | 0.655 | S | S | * | * | G | 310 helix | trans | -81.5 | -7.1 | 172.8 | 59.3 | 0 | 0 | 0 | 0 | 114.2 | L240 R241 L242 | L240-T244 WeakPolarHBondContact O-CG2 3.29Å; L240-T244 PolarHBondContact O-N 3Å; L240-T244 PolarHBondContact O-OG1 3Å; R241-T244 WeakPolarHBondContact CA-OG1 3.43Å; R241-T244 CarbonylContact O-C 3.6Å; R241-T244 PolarHBondContact O-N 2.75Å; R241-T244 PolarHBondContact O-OG1 3.48Å; L242-T244 VanDerWaalsContact C-N 3.34Å; L242-T244 PolarHBondContact O-N 3.19Å |
| 245 | S | 46.5 | Very low | 52.4 | Low | 80 Ų | 80 | 116 Ų | 116 | 56% | 0.559 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -93.5 | 3.5 | -174.1 | -59.2 | 0 | 0 | 0 | 0 | 114.1 | R241 L242 E243 | R241-S245 WeakPolarHBondContact O-CB 3.46Å; R241-S245 PolarHBondContact O-N 3.27Å; R241-S245 VanDerWaalsContact O-N 3.07Å; R241-S245 PolarHBondContact O-OG 3.25Å; L242-S245 PolarHBondContact O-N 3.03Å; L242-S245 VanDerWaalsContact O-N 3.16Å; E243-S245 VanDerWaalsContact C-N 3.33Å |
| 246 | C | 49.8 | Very low | 52.4 | Low | 119 Ų | 119 | 118.4 Ų | 118.4 | 80% | 0.804 | 66% | 0.663 | S | S | * | * | G | 310 helix | trans | -99.4 | 14.4 | 176.8 | -66.6 | 0 | 0 | 0 | 0 | 113.4 | ||
| 247 | D | 49 | Very low | 52.2 | Low | 153 Ų | 153 | 119.4 Ų | 119.4 | 82% | 0.818 | 67% | 0.669 | S | S | * | * | trans | -99.8 | 80.6 | 178.4 | -155.8 | 16 | 0 | 0 | 0 | 109.1 | ||||
| 248 | G | 51.3 | Low | 51.9 | Low | 76 Ų | 76 | 122.4 Ų | 122.4 | 78% | 0.784 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -179 | -1.1 | -176.3 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||
| 249 | S | 48.9 | Very low | 51.8 | Low | 119 Ų | 119 | 123.6 Ų | 123.6 | 83% | 0.832 | 69% | 0.691 | S | S | * | * | trans | -130.8 | 51.1 | 176.9 | -156.7 | 0 | 0 | 0 | 0 | 111.2 | G251 | S249-G251 PolarHBondContact O-N 3.4Š| ||
| 250 | R | 48.3 | Very low | 51.6 | Low | 241 Ų | 241 | 122.8 Ų | 122.8 | 91% | 0.909 | 69% | 0.693 | S | S | * | * | trans | -73.3 | 91.2 | 153.7 | -73 | 179.7 | 84 | 116.1 | -2.1 | 105.2 | D252 | R250-D252 PolarHBondContact O-N 2.96Š| ||
| 251 | G | 49.3 | Very low | 51.3 | Low | 55 Ų | 55 | 123.6 Ų | 123.6 | 57% | 0.567 | 70% | 0.698 | S | S | * | * | trans | -45.3 | 132.6 | 165.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | S249 L253 | S249-G251 PolarHBondContact O-N 3.4Å; G251-L253 PolarHBondContact O-N 3.35Å | ||
| 252 | D | 46.4 | Very low | 50.8 | Low | 148 Ų | 148 | 121.2 Ų | 121.2 | 79% | 0.791 | 70% | 0.697 | S | S | * | * | trans | -52.5 | 79.1 | 171.4 | -170 | 19.1 | 0 | 0 | 0 | 109.6 | R250 C254 | R250-D252 PolarHBondContact O-N 2.96Å; D252-C254 VanDerWaalsContact C-N 3.27Å; D252-C254 PolarHBondContact O-N 3.48Å; D252-C254 VanDerWaalsContact O-N 3.17Å | ||
| 253 | L | 53.1 | Low | 50.8 | Low | 156 Ų | 156 | 121 Ų | 121 | 82% | 0.817 | 70% | 0.696 | S | S | * | * | trans | -78.6 | 92.4 | 163.1 | -72.2 | 171.2 | 0 | 0 | 0 | 104.2 | G251 V255 | G251-L253 PolarHBondContact O-N 3.35Å; L253-V255 PolarHBondContact O-N 3.41Å | ||
| 254 | C | 46.5 | Very low | 51 | Low | 86 Ų | 86 | 120.8 Ų | 120.8 | 58% | 0.581 | 69% | 0.693 | S | S | * | * | trans | -42.9 | 115.4 | 157.3 | -69.9 | 0 | 0 | 0 | 0 | 106.4 | D252 D256 | D252-C254 VanDerWaalsContact C-N 3.27Å; D252-C254 PolarHBondContact O-N 3.48Å; D252-C254 VanDerWaalsContact O-N 3.17Å; C254-D256 PolarHBondContact O-N 2.99Å | ||
| 255 | V | 48.2 | Very low | 51.2 | Low | 121 Ų | 121 | 123.9 Ų | 123.9 | 73% | 0.733 | 69% | 0.693 | S | S | * | * | trans | -69.9 | 84.2 | 171.4 | -172.2 | 0 | 0 | 0 | 0 | 104.4 | L253 D257 | L253-V255 PolarHBondContact O-N 3.41Å; V255-D257 VanDerWaalsContact C-N 3.33Å; V255-D257 PolarHBondContact O-N 3.49Å | ||
| 256 | D | 45.8 | Very low | 51.8 | Low | 124 Ų | 124 | 125.3 Ų | 125.3 | 66% | 0.663 | 69% | 0.694 | S | S | * | * | trans | -62.7 | 98.5 | 169.5 | -77.5 | -36.1 | 0 | 0 | 0 | 106.6 | C254 V258 | C254-D256 PolarHBondContact O-N 2.99Å; D256-V258 VanDerWaalsContact C-N 3.33Å; D256-V258 WeakPolarHBondContact O-CG2 3.48Å; D256-V258 PolarHBondContact O-N 3.18Å | ||
| 257 | D | 49.2 | Very low | 52.5 | Low | 154 Ų | 154 | 123.8 Ų | 123.8 | 82% | 0.824 | 68% | 0.684 | S | S | * | * | S | Bend | trans | 30.1 | 42.4 | 144.4 | -67.2 | -35.7 | 0 | 0 | 0 | 119.9 | V255 | V255-D257 VanDerWaalsContact C-N 3.33Å; V255-D257 PolarHBondContact O-N 3.49Å |
| 258 | V | 54 | Low | 53.4 | Low | 117 Ų | 117 | 121.8 Ų | 121.8 | 71% | 0.709 | 67% | 0.67 | S | S | * | * | trans | -102.7 | 4.9 | 173.8 | -154.9 | 0 | 0 | 0 | 0 | 113.8 | D256 | D256-V258 VanDerWaalsContact C-N 3.33Å; D256-V258 WeakPolarHBondContact O-CG2 3.48Å; D256-V258 PolarHBondContact O-N 3.18Å | ||
| 259 | D | 52.8 | Low | 54.5 | Low | 126 Ų | 126 | 124.2 Ų | 124.2 | 67% | 0.674 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.2 | 15.9 | -175.7 | -78.8 | -25.6 | 0 | 0 | 0 | 115.1 | ||
| 260 | N | 54.9 | Low | 55.8 | Low | 124 Ų | 124 | 123.2 Ų | 123.2 | 66% | 0.663 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.1 | -13.2 | -178.9 | -102.4 | -56.2 | 0 | 0 | 0 | 115.6 | ||
| 261 | D | 55.1 | Low | 57.4 | Low | 104 Ų | 104 | 117 Ų | 117 | 56% | 0.556 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -88.2 | -27.3 | -175.9 | -84 | -27.2 | 0 | 0 | 0 | 113.4 | K264 R265 | D261-K264 PolarHBondContact O-N 3.45Å; D261-R265 WeakPolarHBondContact O-CG 3.45Å; D261-R265 PolarHBondContact O-N 3.04Å; D261-R265 VanDerWaalsContact O-N 3.11Å |
| 262 | D | 54.4 | Low | 59 | Low | 104 Ų | 104 | 118 Ų | 118 | 56% | 0.556 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -73.5 | -39.4 | -180 | -75.2 | -26.3 | 0 | 0 | 0 | 112.1 | K264 R265 L266 | D262-K264 VanDerWaalsContact C-N 3.28Å; D262-K264 PolarHBondContact O-N 3.41Å; D262-R265 PolarHBondContact O-N 3.49Å; D262-L266 WeakPolarHBondContact O-CG 3.43Å; D262-L266 PolarHBondContact O-N 3.31Å |
| 263 | D | 56.2 | Low | 61 | Low | 105 Ų | 105 | 114.6 Ų | 114.6 | 56% | 0.561 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -64.3 | -34.7 | 174.2 | -80.2 | -14.2 | 0 | 0 | 0 | 111.6 | C267 | D263-C267 WeakPolarHBondContact O-CB 3.5Å; D263-C267 PolarHBondContact O-N 3.11Å; D263-C267 PolarHBondContact O-SG 3.37Å |
| 264 | K | 59.1 | Low | 62.8 | Low | 120 Ų | 120 | 112.8 Ų | 112.8 | 52% | 0.522 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -70.7 | -38.9 | 177.5 | -169.3 | 169.7 | 179.1 | -68.9 | 0 | 112.1 | D261 D262 C267 E268 | D261-K264 PolarHBondContact O-N 3.45Å; D262-K264 VanDerWaalsContact C-N 3.28Å; D262-K264 PolarHBondContact O-N 3.41Å; K264-C267 PolarHBondContact O-N 3.2Å; K264-E268 IonicContact NZ-OE1 2.71Å; K264-E268 PolarHBondContact NZ-OE1 3.26Å; K264-E268 WeakPolarHBondContact O-CG 3.48Å; K264-E268 PolarHBondContact O-N 2.85Å |
| 265 | R | 56.9 | Low | 64.9 | Low | 169 Ų | 169 | 112.8 Ų | 112.8 | 64% | 0.638 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -68.8 | -39.3 | 176.2 | -72.8 | -177.1 | -172.2 | -168.4 | 7.6 | 112.6 | D261 D262 E268 H269 | D261-R265 WeakPolarHBondContact O-CG 3.45Å; D261-R265 PolarHBondContact O-N 3.04Å; D261-R265 VanDerWaalsContact O-N 3.11Å; D262-R265 PolarHBondContact O-N 3.49Å; R265-E268 PolarHBondContact O-N 2.94Å; R265-H269 PolarHBondContact O-N 2.98Å; R265-H269 VanDerWaalsContact O-N 3.09Å |
| 266 | L | 59.3 | Low | 67.1 | Low | 110 Ų | 110 | 111.8 Ų | 111.8 | 58% | 0.576 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -64.5 | -42.8 | 174.3 | -73.4 | 168.6 | 0 | 0 | 0 | 111.4 | D262 E268 H269 D270 | D262-L266 WeakPolarHBondContact O-CG 3.43Å; D262-L266 PolarHBondContact O-N 3.31Å; L266-E268 PolarHBondContact O-N 3.1Å; L266-H269 PolarHBondContact O-N 2.94Å; L266-D270 PolarHBondContact O-N 3.23Å; L266-D270 VanDerWaalsContact O-N 3.07Å |
| 267 | C | 64.1 | Low | 69.3 | Low | 87 Ų | 87 | 109.3 Ų | 109.3 | 59% | 0.588 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -63.2 | -38.1 | 176.1 | -69.9 | 0 | 0 | 0 | 0 | 113 | D263 K264 Q271 | D263-C267 WeakPolarHBondContact O-CB 3.5Å; D263-C267 PolarHBondContact O-N 3.11Å; D263-C267 PolarHBondContact O-SG 3.37Å; K264-C267 PolarHBondContact O-N 3.2Å; C267-Q271 PolarHBondContact O-N 3.31Å; C267-Q271 VanDerWaalsContact O-N 3.17Å |
| 268 | E | 68.6 | Low | 71.3 | Confident | 111 Ų | 111 | 106.9 Ų | 106.9 | 52% | 0.519 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -67.4 | -38.7 | 176.5 | -75.6 | 174.4 | -166 | 0 | 0 | 111.9 | K264 R265 L266 S272 | K264-E268 IonicContact NZ-OE1 2.71Å; K264-E268 PolarHBondContact NZ-OE1 3.26Å; K264-E268 WeakPolarHBondContact O-CG 3.48Å; K264-E268 PolarHBondContact O-N 2.85Å; R265-E268 PolarHBondContact O-N 2.94Å; L266-E268 PolarHBondContact O-N 3.1Å; E268-S272 PolarHBondContact O-N 2.98Å; E268-S272 VanDerWaalsContact O-N 3.1Å |
| 269 | H | 72.8 | Confident | 73.1 | Confident | 127 Ų | 127 | 104.7 Ų | 104.7 | 59% | 0.588 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -66 | -43.1 | 176.9 | -170.6 | -10.8 | 0 | 0 | 0 | 111.9 | R265 L266 Q271 S272 L273 | R265-H269 PolarHBondContact O-N 2.98Å; R265-H269 VanDerWaalsContact O-N 3.09Å; L266-H269 PolarHBondContact O-N 2.94Å; H269-Q271 PolarHBondContact O-N 3.41Å; H269-S272 PolarHBondContact O-N 2.73Å; H269-L273 PolarHBondContact O-N 3.15Å |
| 270 | D | 77.9 | Confident | 74.9 | Confident | 99 Ų | 99 | 102.6 Ų | 102.6 | 53% | 0.529 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.8 | -39.9 | 178.6 | -84.9 | -9.3 | 0 | 0 | 0 | 111.9 | L266 L273 H274 | L266-D270 PolarHBondContact O-N 3.23Å; L266-D270 VanDerWaalsContact O-N 3.07Å; D270-L273 WeakPolarHBondContact O-CB 3.24Å; D270-L273 PolarHBondContact O-N 3.42Å; D270-H274 PolarHBondContact O-CD2 3.5Å; D270-H274 PolarHBondContact O-N 3.22Å |
| 271 | Q | 81.9 | Confident | 76.6 | Confident | 110 Ų | 110 | 102.3 Ų | 102.3 | 51% | 0.514 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.3 | -43.1 | 175.6 | -173.2 | 60.9 | 49.7 | 0 | 0 | 111.7 | C267 H269 L273 H274 D275 | C267-Q271 PolarHBondContact O-N 3.31Å; C267-Q271 VanDerWaalsContact O-N 3.17Å; H269-Q271 PolarHBondContact O-N 3.41Å; Q271-L273 VanDerWaalsContact C-N 3.26Å; Q271-L273 PolarHBondContact O-N 3.44Å; Q271-H274 PolarHBondContact O-N 3.43Å; Q271-D275 PolarHBondContact NE2-OD1 3.28Å; Q271-D275 PolarHBondContact O-N 3.5Å |
| 272 | S | 82.8 | Confident | 78.2 | Confident | 75 Ų | 75 | 102.4 Ų | 102.4 | 52% | 0.524 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.4 | -34.5 | 176.3 | -177.5 | 0 | 0 | 0 | 0 | 112.4 | E268 H269 L276 | E268-S272 PolarHBondContact O-N 2.98Å; E268-S272 VanDerWaalsContact O-N 3.1Å; H269-S272 PolarHBondContact O-N 2.73Å; S272-L276 WeakPolarHBondContact O-CB 3.02Å; S272-L276 PolarHBondContact O-N 3.48Å; S272-L276 VanDerWaalsContact O-N 3.07Å |
| 273 | L | 87.5 | Confident | 79.8 | Confident | 78 Ų | 78 | 102.1 Ų | 102.1 | 41% | 0.408 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -67.7 | -44 | 175.6 | -169.4 | 97.2 | 0 | 0 | 0 | 110.7 | H269 D270 Q271 L276 I277 | H269-L273 PolarHBondContact O-N 3.15Å; D270-L273 WeakPolarHBondContact O-CB 3.24Å; D270-L273 PolarHBondContact O-N 3.42Å; Q271-L273 VanDerWaalsContact C-N 3.26Å; Q271-L273 PolarHBondContact O-N 3.44Å; L273-L276 PolarHBondContact O-N 3.26Å; L273-I277 HydrophobicContact CD2-CD1 3.95Å; L273-I277 HydrophobicContact CG-CD1 4.03Å; L273-I277 VanDerWaalsContact O-CG1 3.26Å; L273-I277 WeakPolarHBondContact O-CG1 3.49Å; L273-I277 PolarHBondContact O-N 3.47Å |
| 274 | H | 91 | Very high | 81 | Confident | 117 Ų | 117 | 102.8 Ų | 102.8 | 54% | 0.542 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.9 | -43.2 | 176.4 | -81.5 | -62.1 | 0 | 0 | 0 | 112.4 | D270 Q271 L276 I277 Q278 | D270-H274 PolarHBondContact O-CD2 3.5Å; D270-H274 PolarHBondContact O-N 3.22Å; Q271-H274 PolarHBondContact O-N 3.43Å; H274-L276 VanDerWaalsContact C-N 3.34Å; H274-L276 PolarHBondContact O-N 3.25Å; H274-I277 PolarHBondContact O-N 3.02Å; H274-Q278 WeakPolarHBondContact O-CB 3.31Å; H274-Q278 PolarHBondContact O-N 2.76Å |
| 275 | D | 91.3 | Very high | 82.1 | Confident | 87 Ų | 87 | 103.6 Ų | 103.6 | 47% | 0.465 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.3 | -40.3 | 176.4 | -69.2 | -5.3 | 0 | 0 | 0 | 111.5 | Q271 Q278 S279 | Q271-D275 PolarHBondContact NE2-OD1 3.28Å; Q271-D275 PolarHBondContact O-N 3.5Å; D275-Q278 PolarHBondContact O-N 3.25Å; D275-S279 WeakPolarHBondContact O-CB 3.37Å; D275-S279 PolarHBondContact O-N 2.97Å |
| 276 | L | 93.3 | Very high | 83 | Confident | 100 Ų | 100 | 101.6 Ų | 101.6 | 52% | 0.524 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.9 | -45.3 | 175.9 | 178.1 | 63.2 | 0 | 0 | 0 | 112 | S272 L273 H274 Q278 S279 I280 | S272-L276 WeakPolarHBondContact O-CB 3.02Å; S272-L276 PolarHBondContact O-N 3.48Å; S272-L276 VanDerWaalsContact O-N 3.07Å; L273-L276 PolarHBondContact O-N 3.26Å; H274-L276 VanDerWaalsContact C-N 3.34Å; H274-L276 PolarHBondContact O-N 3.25Å; L276-Q278 VanDerWaalsContact C-N 3.31Å; L276-Q278 PolarHBondContact O-N 3.17Å; L276-S279 PolarHBondContact O-N 3.44Å; L276-I280 HydrophobicContact CD1-CD1 4.18Å; L276-I280 HydrophobicContact CD1-CG1 4.44Å; L276-I280 HydrophobicContact CG-CD1 4.11Å; L276-I280 WeakPolarHBondContact O-CG1 3.19Å; L276-I280 PolarHBondContact O-N 3.15Å |
| 277 | I | 92.6 | Very high | 83.4 | Confident | 72 Ų | 72 | 102 Ų | 102 | 37% | 0.369 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.6 | -43.8 | 177.4 | -69.4 | 164.6 | 0 | 0 | 0 | 110.1 | L273 H274 I280 Q281 | L273-I277 HydrophobicContact CD2-CD1 3.95Å; L273-I277 HydrophobicContact CG-CD1 4.03Å; L273-I277 VanDerWaalsContact O-CG1 3.26Å; L273-I277 WeakPolarHBondContact O-CG1 3.49Å; L273-I277 PolarHBondContact O-N 3.47Å; H274-I277 PolarHBondContact O-N 3.02Å; I277-I280 PolarHBondContact O-N 3.39Å; I277-Q281 WeakPolarHBondContact O-CG 3.36Å; I277-Q281 PolarHBondContact O-N 3.5Å |
| 278 | Q | 91.4 | Very high | 83.5 | Confident | 103 Ų | 103 | 103.4 Ų | 103.4 | 48% | 0.481 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.7 | -42.6 | 177 | -174.2 | 173.8 | -12.9 | 0 | 0 | 111.7 | H274 D275 L276 I280 Q281 E282 | H274-Q278 WeakPolarHBondContact O-CB 3.31Å; H274-Q278 PolarHBondContact O-N 2.76Å; D275-Q278 PolarHBondContact O-N 3.25Å; L276-Q278 VanDerWaalsContact C-N 3.31Å; L276-Q278 PolarHBondContact O-N 3.17Å; Q278-I280 PolarHBondContact O-N 3.22Å; Q278-Q281 PolarHBondContact O-N 3.3Å; Q278-E282 PolarHBondContact NE2-OE1 3.45Å; Q278-E282 VanDerWaalsContact NE2-OE1 3.09Å; Q278-E282 WeakPolarHBondContact O-CG 3.24Å; Q278-E282 PolarHBondContact O-N 3.01Å |
| 279 | S | 90.8 | Very high | 83.1 | Confident | 70 Ų | 70 | 102.9 Ų | 102.9 | 49% | 0.49 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.3 | -42.1 | 176.3 | -179.3 | 0 | 0 | 0 | 0 | 112.5 | D275 L276 E282 L283 | D275-S279 WeakPolarHBondContact O-CB 3.37Å; D275-S279 PolarHBondContact O-N 2.97Å; L276-S279 PolarHBondContact O-N 3.44Å; S279-E282 PolarHBondContact O-N 2.8Å; S279-L283 WeakPolarHBondContact O-CB 3.5Å; S279-L283 PolarHBondContact O-N 2.88Å |
| 280 | I | 90.2 | Very high | 82.3 | Confident | 83 Ų | 83 | 104.2 Ų | 104.2 | 43% | 0.426 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.4 | -40.5 | 176.4 | -67.1 | 167.1 | 0 | 0 | 0 | 110.9 | L276 I277 Q278 L283 Q284 | L276-I280 HydrophobicContact CD1-CD1 4.18Å; L276-I280 HydrophobicContact CD1-CG1 4.44Å; L276-I280 HydrophobicContact CG-CD1 4.11Å; L276-I280 WeakPolarHBondContact O-CG1 3.19Å; L276-I280 PolarHBondContact O-N 3.15Å; I277-I280 PolarHBondContact O-N 3.39Å; Q278-I280 PolarHBondContact O-N 3.22Å; I280-L283 PolarHBondContact O-N 2.84Å; I280-Q284 WeakPolarHBondContact O-CB 3.43Å; I280-Q284 VanDerWaalsContact O-CG 3.29Å; I280-Q284 WeakPolarHBondContact O-CG 3.44Å; I280-Q284 PolarHBondContact O-N 3.26Å |
| 281 | Q | 90.6 | Very high | 81.2 | Confident | 118 Ų | 118 | 103.5 Ų | 103.5 | 55% | 0.551 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -66.4 | -41.1 | 177.1 | -72.7 | 176.1 | -6.8 | 0 | 0 | 112.3 | I277 Q278 Q284 K285 | I277-Q281 WeakPolarHBondContact O-CG 3.36Å; I277-Q281 PolarHBondContact O-N 3.5Å; Q278-Q281 PolarHBondContact O-N 3.3Å; Q281-Q284 PolarHBondContact O-N 3.04Å; Q281-K285 WeakPolarHBondContact O-CB 3.45Å; Q281-K285 PolarHBondContact O-N 3.34Å |
| 282 | E | 89.1 | Confident | 79.9 | Confident | 106 Ų | 106 | 102.6 Ų | 102.6 | 50% | 0.495 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.6 | -41.4 | 174.7 | -76.8 | 178.2 | -168.4 | 0 | 0 | 111.6 | Q278 S279 K285 Q286 | Q278-E282 PolarHBondContact NE2-OE1 3.45Å; Q278-E282 VanDerWaalsContact NE2-OE1 3.09Å; Q278-E282 WeakPolarHBondContact O-CG 3.24Å; Q278-E282 PolarHBondContact O-N 3.01Å; S279-E282 PolarHBondContact O-N 2.8Å; E282-K285 WeakPolarHBondContact O-CB 3.49Å; E282-K285 PolarHBondContact O-N 2.81Å; E282-Q286 WeakPolarHBondContact O-CG 3.41Å; E282-Q286 PolarHBondContact O-N 3.17Å |
| 283 | L | 87.8 | Confident | 78.1 | Confident | 97 Ų | 97 | 101.5 Ų | 101.5 | 51% | 0.508 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.8 | -42.7 | 175.7 | -175.3 | 64.8 | 0 | 0 | 0 | 111.8 | S279 I280 K285 Q286 H287 | S279-L283 WeakPolarHBondContact O-CB 3.5Å; S279-L283 PolarHBondContact O-N 2.88Å; I280-L283 PolarHBondContact O-N 2.84Å; L283-K285 VanDerWaalsContact C-N 3.3Å; L283-K285 PolarHBondContact O-N 2.89Å; L283-Q286 PolarHBondContact O-N 2.99Å; L283-H287 PolarHBondContact O-N 3.41Å |
| 284 | Q | 82.6 | Confident | 76 | Confident | 120 Ų | 120 | 105.4 Ų | 105.4 | 56% | 0.561 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -61.9 | -39.6 | 174.2 | -76 | 177.5 | -12.2 | 0 | 0 | 111.6 | I280 Q281 H287 L288 | I280-Q284 WeakPolarHBondContact O-CB 3.43Å; I280-Q284 VanDerWaalsContact O-CG 3.29Å; I280-Q284 WeakPolarHBondContact O-CG 3.44Å; I280-Q284 PolarHBondContact O-N 3.26Å; Q281-Q284 PolarHBondContact O-N 3.04Å; Q284-H287 PolarHBondContact O-N 3.39Å; Q284-L288 WeakPolarHBondContact O-CG 3.37Å; Q284-L288 PolarHBondContact O-N 3.04Å |
| 285 | K | 82 | Confident | 73.7 | Confident | 137 Ų | 137 | 106.4 Ų | 106.4 | 60% | 0.596 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -65.1 | -43.7 | 175.7 | -171.8 | -178 | 175.5 | -172.2 | 0 | 111.8 | Q281 E282 L283 L288 D289 | Q281-K285 WeakPolarHBondContact O-CB 3.45Å; Q281-K285 PolarHBondContact O-N 3.34Å; E282-K285 WeakPolarHBondContact O-CB 3.49Å; E282-K285 PolarHBondContact O-N 2.81Å; L283-K285 VanDerWaalsContact C-N 3.3Å; L283-K285 PolarHBondContact O-N 2.89Å; K285-L288 PolarHBondContact O-N 2.84Å; K285-D289 WeakPolarHBondContact O-CB 3.41Å; K285-D289 PolarHBondContact O-N 2.73Å |
| 286 | Q | 76 | Confident | 71.2 | Confident | 126 Ų | 126 | 107.9 Ų | 107.9 | 59% | 0.589 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -60.9 | -44.7 | 175.3 | -74.8 | -178.7 | -17.7 | 0 | 0 | 111.7 | E282 L283 L288 D289 E290 | E282-Q286 WeakPolarHBondContact O-CG 3.41Å; E282-Q286 PolarHBondContact O-N 3.17Å; L283-Q286 PolarHBondContact O-N 2.99Å; Q286-L288 VanDerWaalsContact C-N 3.3Å; Q286-L288 PolarHBondContact O-N 3.42Å; Q286-D289 PolarHBondContact O-N 2.89Å; Q286-E290 VanDerWaalsContact O-CB 3.3Å; Q286-E290 WeakPolarHBondContact O-CB 3.43Å; Q286-E290 PolarHBondContact O-N 3.04Å |
| 287 | H | 68.2 | Low | 68.7 | Low | 120 Ų | 120 | 108.6 Ų | 108.6 | 56% | 0.556 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -64.2 | -35 | 177.4 | -113.6 | -73.5 | 0 | 0 | 0 | 112.5 | L283 Q284 S291 | L283-H287 PolarHBondContact O-N 3.41Å; Q284-H287 PolarHBondContact O-N 3.39Å; H287-S291 VanDerWaalsContact O-CB 3.28Å; H287-S291 WeakPolarHBondContact O-CB 3.49Å; H287-S291 PolarHBondContact O-N 3.33Å; H287-S291 VanDerWaalsContact O-N 3.11Å; H287-S291 PolarHBondContact O-OG 2.88Å |
| 288 | L | 66.1 | Low | 66.3 | Low | 115 Ų | 115 | 112.8 Ų | 112.8 | 60% | 0.602 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -71.2 | -43 | 174.4 | -72.6 | 167.3 | 0 | 0 | 0 | 111.8 | Q284 K285 Q286 S291 T292 | Q284-L288 WeakPolarHBondContact O-CG 3.37Å; Q284-L288 PolarHBondContact O-N 3.04Å; K285-L288 PolarHBondContact O-N 2.84Å; Q286-L288 VanDerWaalsContact C-N 3.3Å; Q286-L288 PolarHBondContact O-N 3.42Å; L288-S291 PolarHBondContact O-N 2.96Å; L288-T292 WeakPolarHBondContact O-CB 3.07Å; L288-T292 PolarHBondContact O-N 3.49Å; L288-T292 PolarHBondContact O-OG1 2.99Å |
| 289 | D | 59.3 | Low | 63.6 | Low | 100 Ų | 100 | 113.2 Ų | 113.2 | 54% | 0.535 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -68.5 | -34.9 | 179.4 | -78.1 | -23.5 | 0 | 0 | 0 | 112 | K285 Q286 T292 G293 | K285-D289 WeakPolarHBondContact O-CB 3.41Å; K285-D289 PolarHBondContact O-N 2.73Å; Q286-D289 PolarHBondContact O-N 2.89Å; D289-T292 PolarHBondContact O-N 3.08Å; D289-G293 PolarHBondContact O-N 2.91Å |
| 290 | E | 56.4 | Low | 61 | Low | 156 Ų | 156 | 113.2 Ų | 113.2 | 73% | 0.729 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -74.8 | -31.5 | 176.5 | -154.3 | 166.8 | -150.1 | 0 | 0 | 111.9 | Q286 T292 | Q286-E290 VanDerWaalsContact O-CB 3.3Å; Q286-E290 WeakPolarHBondContact O-CB 3.43Å; Q286-E290 PolarHBondContact O-N 3.04Å; E290-T292 VanDerWaalsContact C-N 3.32Å |
| 291 | S | 55.3 | Low | 58.7 | Low | 84 Ų | 84 | 116.4 Ų | 116.4 | 59% | 0.587 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -72.5 | -25.5 | 171.7 | -55.4 | 0 | 0 | 0 | 0 | 113.1 | H287 L288 | H287-S291 VanDerWaalsContact O-CB 3.28Å; H287-S291 WeakPolarHBondContact O-CB 3.49Å; H287-S291 PolarHBondContact O-N 3.33Å; H287-S291 VanDerWaalsContact O-N 3.11Å; H287-S291 PolarHBondContact O-OG 2.88Å; L288-S291 PolarHBondContact O-N 2.96Å |
| 292 | T | 53.2 | Low | 56.6 | Low | 90 Ų | 90 | 118.8 Ų | 118.8 | 55% | 0.552 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -98.9 | -18.5 | -177 | -40.4 | 0 | 0 | 0 | 0 | 112.1 | L288 D289 E290 L294 | L288-T292 WeakPolarHBondContact O-CB 3.07Å; L288-T292 PolarHBondContact O-N 3.49Å; L288-T292 PolarHBondContact O-OG1 2.99Å; D289-T292 PolarHBondContact O-N 3.08Å; E290-T292 VanDerWaalsContact C-N 3.32Å; T292-L294 VanDerWaalsContact C-N 3.27Å; T292-L294 PolarHBondContact O-N 3.36Å |
| 293 | G | 45.7 | Very low | 54.2 | Low | 52 Ų | 52 | 120.7 Ų | 120.7 | 54% | 0.536 | 67% | 0.671 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -72.6 | -10.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | D289 | D289-G293 PolarHBondContact O-N 2.91Š|
| 294 | L | 43.4 | Very low | 52.2 | Low | 161 Ų | 161 | 121.1 Ų | 121.1 | 84% | 0.843 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.2 | 27.2 | 176.7 | -146 | 91.6 | 0 | 0 | 0 | 113.5 | T292 | T292-L294 VanDerWaalsContact C-N 3.27Å; T292-L294 PolarHBondContact O-N 3.36Å |
| 295 | I | 42 | Very low | 50.4 | Low | 137 Ų | 137 | 121 Ų | 121 | 70% | 0.703 | 69% | 0.694 | S | S | * | * | trans | -123.2 | 66.8 | 162.7 | -43.1 | 176.3 | 0 | 0 | 0 | 107.2 | P297 | I295-P297 VanDerWaalsContact O-CD 3.22Å; I295-P297 WeakPolarHBondContact O-CD 2.81Å | ||
| 296 | T | 39.2 | Very low | 48.2 | Very low | 119 Ų | 119 | 119.7 Ų | 119.7 | 73% | 0.73 | 70% | 0.703 | S | S | * | * | trans | -68.7 | 112.9 | 163.1 | -43.6 | 0 | 0 | 0 | 0 | 107.1 | L298 | T296-L298 PolarHBondContact O-N 3.23Š| ||
| 297 | P | 41 | Very low | 46.9 | Very low | 115 Ų | 115 | 119.2 Ų | 119.2 | 75% | 0.747 | 71% | 0.713 | S | S | * | * | trans | -69.1 | 109.6 | 167.6 | 29.1 | -27.9 | 0 | 0 | 0 | 106.1 | I295 S299 | I295-P297 VanDerWaalsContact O-CD 3.22Å; I295-P297 WeakPolarHBondContact O-CD 2.81Å; P297-S299 PolarHBondContact O-N 2.58Å | ||
| 298 | L | 41.1 | Very low | 45.7 | Very low | 159 Ų | 159 | 124.4 Ų | 124.4 | 83% | 0.832 | 73% | 0.728 | S | S | * | * | trans | -49.8 | 124.2 | 172.2 | -167.9 | 71.5 | 0 | 0 | 0 | 108.6 | T296 G300 | T296-L298 PolarHBondContact O-N 3.23Å; L298-G300 PolarHBondContact O-N 3.16Å | ||
| 299 | S | 35.5 | Very low | 45.2 | Very low | 112 Ų | 112 | 126.6 Ų | 126.6 | 78% | 0.783 | 74% | 0.739 | S | S | * | * | trans | -39.2 | 127.1 | 167.8 | 54.2 | 0 | 0 | 0 | 0 | 111.9 | P297 | P297-S299 PolarHBondContact O-N 2.58Š| ||
| 300 | G | 36.9 | Very low | 44.5 | Very low | 71 Ų | 71 | 126.7 Ų | 126.7 | 73% | 0.732 | 75% | 0.754 | S | S | * | * | trans | 179.8 | 118.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | L298 | L298-G300 PolarHBondContact O-N 3.16Š| ||
| 301 | D | 40.8 | Very low | 44.2 | Very low | 150 Ų | 150 | 126.7 Ų | 126.7 | 80% | 0.802 | 76% | 0.757 | S | S | * | * | trans | -48.8 | 179.4 | 178.7 | -69 | -53.8 | 0 | 0 | 0 | 114.8 | ||||
| 302 | E | 47.2 | Very low | 43.6 | Very low | 167 Ų | 167 | 125.9 Ų | 125.9 | 78% | 0.78 | 76% | 0.762 | S | S | * | * | trans | 98.9 | 81.2 | 162.4 | -42.2 | -71.8 | 115.6 | 0 | 0 | 114.9 | ||||
| 303 | D | 39.4 | Very low | 42.9 | Very low | 146 Ų | 146 | 127 Ų | 127 | 78% | 0.781 | 77% | 0.774 | S | S | * | * | 51.5 | 119.9 | 124.5 | -73.4 | -26.5 | 0 | 0 | 0 | 121.3 | |||||
| 304 | S | 45.3 | Very low | 42.8 | Very low | 106 Ų | 106 | 129.4 Ų | 129.4 | 74% | 0.741 | 78% | 0.782 | S | S | * | * | trans | 84.5 | 117.7 | 132.4 | -66.6 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 305 | S | 45.2 | Very low | 42.8 | Very low | 117 Ų | 117 | 128.7 Ų | 128.7 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | trans | 99.1 | 85.1 | 145.4 | -52.9 | 0 | 0 | 0 | 0 | 117.9 | S307 | S305-S307 PolarHBondContact O-N 3.07Š| ||
| 306 | S | 35.6 | Very low | 43.3 | Very low | 111 Ų | 111 | 130.8 Ų | 130.8 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | trans | -34.2 | 123.5 | 144.8 | 163.1 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 307 | S | 48.7 | Very low | 43.5 | Very low | 115 Ų | 115 | 132.2 Ų | 132.2 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | trans | -165.3 | 106.7 | 140.9 | -81.3 | 0 | 0 | 0 | 0 | 111.8 | S305 | S305-S307 PolarHBondContact O-N 3.07Š| ||
| 308 | R | 42.6 | Very low | 43.6 | Very low | 229 Ų | 229 | 135.5 Ų | 135.5 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | trans | -12.5 | 128.3 | 151.3 | -47.3 | 167.4 | 84.8 | -154.9 | 7 | 114.3 | ||||
| 309 | L | 56.3 | Low | 43.7 | Very low | 161 Ų | 161 | 135.6 Ų | 135.6 | 84% | 0.843 | 79% | 0.787 | S | S | * | * | trans | -156.6 | 121.9 | 132.5 | -79.9 | -170.2 | 0 | 0 | 0 | 109.8 | ||||
| 310 | A | 43.6 | Very low | 44.2 | Very low | 102 Ų | 102 | 138.6 Ų | 138.6 | 84% | 0.843 | 79% | 0.792 | S | S | * | * | trans | -67.6 | 129.9 | 164.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 311 | I | 50.1 | Low | 44.4 | Very low | 156 Ų | 156 | 138.3 Ų | 138.3 | 80% | 0.8 | 79% | 0.79 | S | S | * | * | trans | -143.5 | 116.4 | 163.4 | -57.9 | -179.9 | 0 | 0 | 0 | 107.4 | ||||
| 312 | G | 42.5 | Very low | 44.4 | Very low | 67 Ų | 67 | 140.6 Ų | 140.6 | 69% | 0.691 | 80% | 0.795 | S | S | * | * | trans | -84.7 | 164.3 | 169.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 313 | S | 38.4 | Very low | 44 | Very low | 115 Ų | 115 | 137.8 Ų | 137.8 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | trans | 71.3 | 128 | 150.8 | -162.6 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 314 | S | 44.2 | Very low | 44.2 | Very low | 101 Ų | 101 | 137.7 Ų | 137.7 | 71% | 0.706 | 79% | 0.792 | S | S | * | * | trans | 76.8 | 141.5 | 146.2 | 46.1 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 315 | D | 43 | Very low | 44 | Very low | 147 Ų | 147 | 142.4 Ų | 142.4 | 79% | 0.786 | 79% | 0.794 | S | S | * | * | trans | 80.2 | 91.3 | 164.2 | -73.2 | -39.1 | 0 | 0 | 0 | 119.3 | ||||
| 316 | I | 52.5 | Low | 43.5 | Very low | 180 Ų | 180 | 144 Ų | 144 | 92% | 0.923 | 79% | 0.793 | S | S | * | * | trans | -140.2 | 78.1 | 145.5 | -34.7 | 164.4 | 0 | 0 | 0 | 108.7 | ||||
| 317 | D | 42.8 | Very low | 43.7 | Very low | 150 Ų | 150 | 143.3 Ų | 143.3 | 80% | 0.802 | 80% | 0.795 | S | S | * | * | trans | -87.1 | 142.4 | 157.4 | -137.4 | -21.6 | 0 | 0 | 0 | 108.2 | ||||
| 318 | R | 44.1 | Very low | 43.1 | Very low | 184 Ų | 184 | 146.8 Ų | 146.8 | 69% | 0.694 | 80% | 0.798 | S | S | * | * | trans | 76 | 89 | 159.6 | -156.2 | -178.4 | 90.2 | -119.3 | 6.7 | 118.5 | ||||
| 319 | Q | 43.1 | Very low | 43.1 | Very low | 160 Ų | 160 | 143.6 Ų | 143.6 | 75% | 0.748 | 80% | 0.797 | S | S | * | * | 170.2 | 125.3 | 124.7 | -95.8 | 159 | 78.6 | 0 | 0 | 109.7 | |||||
| 320 | I | 45.1 | Very low | 42.1 | Very low | 176 Ų | 176 | 145.1 Ų | 145.1 | 90% | 0.903 | 80% | 0.8 | S | S | * | * | trans | 169.8 | 84.3 | 138.3 | -79 | 147.1 | 0 | 0 | 0 | 104.4 | ||||
| 321 | G | 42.3 | Very low | 41.5 | Very low | 65 Ų | 65 | 145.4 Ų | 145.4 | 67% | 0.67 | 80% | 0.796 | S | S | * | * | trans | -87.8 | 150.1 | 156.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 322 | E | 40.9 | Very low | 40.7 | Very low | 197 Ų | 197 | 143.4 Ų | 143.4 | 92% | 0.921 | 80% | 0.796 | S | S | * | * | trans | 69.8 | 85.1 | 153 | -60.1 | -179.3 | 171.8 | 0 | 0 | 118.1 | ||||
| 323 | S | 39.2 | Very low | 40.4 | Very low | 109 Ų | 109 | 145.6 Ų | 145.6 | 76% | 0.762 | 80% | 0.795 | S | S | * | * | trans | -174.6 | 126 | 149.1 | -130.2 | 0 | 0 | 0 | 0 | 104.2 | ||||
| 324 | I | 42.6 | Very low | 40.2 | Very low | 144 Ų | 144 | 146 Ų | 146 | 74% | 0.738 | 80% | 0.795 | S | S | * | * | cis | -161.3 | 137.5 | 34.5 | -66.6 | 176.2 | 0 | 0 | 0 | 107.2 | ||||
| 325 | R | 41.8 | Very low | 39.9 | Very low | 204 Ų | 204 | 148.4 Ų | 148.4 | 77% | 0.77 | 80% | 0.8 | S | S | * | * | trans | -27.6 | 144.3 | 159.2 | -79.5 | 163.8 | -81.8 | 151.4 | -1.6 | 117.7 | ||||
| 326 | N | 33.6 | Very low | 39.4 | Very low | 150 Ų | 150 | 149.2 Ų | 149.2 | 80% | 0.802 | 80% | 0.803 | S | S | * | * | trans | 62.7 | 105.7 | 138 | -51.3 | -7 | 0 | 0 | 0 | 119.2 | ||||
| 327 | A | 41 | Very low | 38.3 | Very low | 98 Ų | 98 | 146.3 Ų | 146.3 | 81% | 0.81 | 80% | 0.799 | S | S | * | * | trans | -150.3 | 90.7 | 142.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | L329 | A327-L329 PolarHBondContact O-N 3.49Š| ||
| 328 | E | 36 | Very low | 37.7 | Very low | 188 Ų | 188 | 144 Ų | 144 | 88% | 0.879 | 80% | 0.801 | S | S | * | * | trans | -60.2 | 119.3 | 157.8 | -72.1 | 166.2 | 144.1 | 0 | 0 | 108.2 | ||||
| 329 | L | 42 | Very low | 37.1 | Very low | 162 Ų | 162 | 140.9 Ų | 140.9 | 85% | 0.848 | 81% | 0.807 | S | S | * | * | trans | -130.2 | 84.2 | 156.1 | -77 | 176.5 | 0 | 0 | 0 | 107.2 | A327 S331 | A327-L329 PolarHBondContact O-N 3.49Å; L329-S331 PolarHBondContact O-N 3.24Å | ||
| 330 | E | 34.9 | Very low | 36.7 | Very low | 192 Ų | 192 | 138.4 Ų | 138.4 | 90% | 0.897 | 81% | 0.807 | S | S | * | * | trans | -62.1 | 113.3 | 151.5 | -65.5 | -172.4 | 153.9 | 0 | 0 | 107.8 | ||||
| 331 | S | 31.4 | Very low | 36.3 | Very low | 109 Ų | 109 | 137.4 Ų | 137.4 | 76% | 0.762 | 80% | 0.803 | S | S | * | * | trans | -148.2 | 99.1 | 161.1 | 171.5 | 0 | 0 | 0 | 0 | 108.6 | L329 | L329-S331 PolarHBondContact O-N 3.24Š| ||
| 332 | S | 33.1 | Very low | 36.1 | Very low | 114 Ų | 114 | 139.9 Ų | 139.9 | 80% | 0.797 | 81% | 0.807 | S | S | * | * | trans | -62.3 | 121.9 | 174.8 | -37.3 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 333 | V | 36.3 | Very low | 35.9 | Very low | 112 Ų | 112 | 138 Ų | 138 | 68% | 0.679 | 80% | 0.798 | S | S | * | * | trans | -157.2 | 121 | 144.5 | -173.8 | 0 | 0 | 0 | 0 | 108.6 | L335 | V333-L335 HydrophobicContact CG1-CB 3.96Å; V333-L335 HydrophobicContact CG1-CD1 3.99Å; V333-L335 HydrophobicContact CG1-CG 3.91Å | ||
| 334 | P | 34.4 | Very low | 35.7 | Very low | 124 Ų | 124 | 138.2 Ų | 138.2 | 81% | 0.805 | 80% | 0.795 | S | S | * | * | trans | -105 | 96.2 | 161.2 | 32.7 | -19.3 | 0 | 0 | 0 | 108.4 | ||||
| 335 | L | 38.3 | Very low | 35.3 | Very low | 152 Ų | 152 | 136.9 Ų | 136.9 | 80% | 0.796 | 79% | 0.789 | S | S | * | * | trans | -139.6 | 131.6 | 173 | -74.5 | 176.2 | 0 | 0 | 0 | 111.5 | V333 | V333-L335 HydrophobicContact CG1-CB 3.96Å; V333-L335 HydrophobicContact CG1-CD1 3.99Å; V333-L335 HydrophobicContact CG1-CG 3.91Å | ||
| 336 | L | 32.2 | Very low | 35.2 | Very low | 163 Ų | 163 | 133.1 Ų | 133.1 | 85% | 0.853 | 79% | 0.789 | S | S | * | * | trans | -56.4 | 156.8 | -179 | -62.4 | 156.2 | 0 | 0 | 0 | 113 | ||||
| 337 | S | 28.9 | Very low | 35.5 | Very low | 119 Ų | 119 | 131.4 Ų | 131.4 | 83% | 0.832 | 78% | 0.784 | S | S | * | * | trans | 97.4 | 135.6 | 156.7 | -47.3 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 338 | A | 30.6 | Very low | 35.5 | Very low | 103 Ų | 103 | 130.9 Ų | 130.9 | 85% | 0.851 | 78% | 0.775 | S | S | * | * | trans | 85.2 | 89.4 | 164.6 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 339 | S | 32.1 | Very low | 35.6 | Very low | 117 Ų | 117 | 132.4 Ų | 132.4 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | -148.1 | 112.2 | 112 | -168.3 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 340 | S | 33.7 | Very low | 35.7 | Very low | 109 Ų | 109 | 128.9 Ų | 128.9 | 76% | 0.762 | 77% | 0.767 | S | S | * | * | trans | -52.1 | 123.3 | -178.6 | 37.8 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 341 | L | 37.1 | Very low | 36.2 | Very low | 155 Ų | 155 | 127 Ų | 127 | 81% | 0.812 | 76% | 0.759 | S | S | * | * | trans | -60.1 | 140.4 | 152.4 | -80 | 87.4 | 0 | 0 | 0 | 108.7 | Q343 | L341-Q343 VanDerWaalsContact C-N 3.34Å; L341-Q343 PolarHBondContact O-N 2.96Å | ||
| 342 | P | 37.2 | Very low | 36.5 | Very low | 117 Ų | 117 | 130 Ų | 130 | 76% | 0.76 | 76% | 0.763 | S | S | * | * | trans | -70.3 | 99.7 | 159.2 | 28.9 | -26.8 | 0 | 0 | 0 | 107.3 | V344 | P342-V344 VanDerWaalsContact C-N 3.31Å; P342-V344 PolarHBondContact O-N 3.33Å | ||
| 343 | Q | 37.9 | Very low | 37.1 | Very low | 157 Ų | 157 | 133.2 Ų | 133.2 | 73% | 0.734 | 77% | 0.765 | S | S | * | * | trans | -65.9 | 95.2 | 163.7 | -169.3 | 178.1 | -6.9 | 0 | 0 | 107.1 | L341 N345 | L341-Q343 VanDerWaalsContact C-N 3.34Å; L341-Q343 PolarHBondContact O-N 2.96Å; Q343-N345 PolarHBondContact O-N 2.98Å | ||
| 344 | V | 34.4 | Very low | 37.5 | Very low | 113 Ų | 113 | 136.4 Ų | 136.4 | 69% | 0.685 | 77% | 0.772 | S | S | * | * | trans | -72.6 | 82.3 | 169.4 | -178.3 | 0 | 0 | 0 | 0 | 107.3 | P342 T346 | P342-V344 VanDerWaalsContact C-N 3.31Å; P342-V344 PolarHBondContact O-N 3.33Å; V344-T346 HydrophobicContact CG1-CG2 3.82Å; V344-T346 PolarHBondContact O-N 2.88Å | ||
| 345 | N | 33.5 | Very low | 37.9 | Very low | 116 Ų | 116 | 137.3 Ų | 137.3 | 62% | 0.62 | 77% | 0.77 | S | S | * | * | trans | -78.8 | 91.5 | 155 | -84.6 | -3.9 | 0 | 0 | 0 | 106.8 | Q343 T347 | Q343-N345 PolarHBondContact O-N 2.98Å; N345-T347 PolarHBondContact O-N 3.24Å; N345-T347 VanDerWaalsContact O-N 3.17Å | ||
| 346 | T | 40.8 | Very low | 38.1 | Very low | 125 Ų | 125 | 137.5 Ų | 137.5 | 77% | 0.767 | 77% | 0.771 | S | S | * | * | trans | -83.6 | 77.7 | 157 | 48 | 0 | 0 | 0 | 0 | 108 | V344 S348 | V344-T346 HydrophobicContact CG1-CG2 3.82Å; V344-T346 PolarHBondContact O-N 2.88Å; T346-S348 PolarHBondContact O-N 3.4Å | ||
| 347 | T | 40.7 | Very low | 38.4 | Very low | 115 Ų | 115 | 137.9 Ų | 137.9 | 71% | 0.706 | 77% | 0.768 | S | S | * | * | trans | -50.1 | 132.8 | 152.9 | 13.2 | 0 | 0 | 0 | 0 | 108.7 | N345 K349 | N345-T347 PolarHBondContact O-N 3.24Å; N345-T347 VanDerWaalsContact O-N 3.17Å; T347-K349 PolarHBondContact O-N 2.81Å | ||
| 348 | S | 40 | Very low | 38.9 | Very low | 87 Ų | 87 | 137.2 Ų | 137.2 | 61% | 0.608 | 76% | 0.761 | S | S | * | * | trans | -21.3 | 114.7 | 168.2 | 44.2 | 0 | 0 | 0 | 0 | 114.2 | T346 S350 | T346-S348 PolarHBondContact O-N 3.4Å; S348-S350 PolarHBondContact O-N 2.88Å | ||
| 349 | K | 37.6 | Very low | 39.2 | Very low | 220 Ų | 220 | 140 Ų | 140 | 96% | 0.957 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | 83.4 | 158.5 | -86.3 | 178.1 | 171.6 | 171.5 | 0 | 108.5 | T347 | T347-K349 PolarHBondContact O-N 2.81Š|
| 350 | S | 45.2 | Very low | 39.4 | Very low | 87 Ų | 87 | 144.6 Ų | 144.6 | 61% | 0.608 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -152.2 | -12.9 | 165.4 | 55.8 | 0 | 0 | 0 | 0 | 115.6 | S348 | S348-S350 PolarHBondContact O-N 2.88Š|
| 351 | E | 43.9 | Very low | 39.5 | Very low | 154 Ų | 154 | 147.6 Ų | 147.6 | 72% | 0.72 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -111.1 | -11.1 | -173.8 | -88.2 | -177.4 | 138.2 | 0 | 0 | 117.3 | ||
| 352 | M | 38.5 | Very low | 39.4 | Very low | 172 Ų | 172 | 147.7 Ų | 147.7 | 85% | 0.847 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.2 | 7.6 | -179 | -83.5 | -166 | -75.5 | 0 | 0 | 116.1 | ||
| 353 | Q | 45.5 | Very low | 39.4 | Very low | 181 Ų | 181 | 146.8 Ų | 146.8 | 85% | 0.846 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.5 | -0.2 | 170.4 | -77.4 | -174.4 | 38.9 | 0 | 0 | 114.5 | ||
| 354 | Q | 45.1 | Very low | 39.5 | Very low | 178 Ų | 178 | 144.7 Ų | 144.7 | 83% | 0.832 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -89.1 | -6.9 | 173.1 | -70.5 | -171.2 | 17.2 | 0 | 0 | 114 | ||
| 355 | L | 42.4 | Very low | 39.6 | Very low | 143 Ų | 143 | 144.4 Ų | 144.4 | 75% | 0.749 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -98.9 | 3.1 | -173.1 | -94 | 156.8 | 0 | 0 | 0 | 115.8 | ||
| 356 | L | 42.3 | Very low | 39.9 | Very low | 156 Ų | 156 | 146.9 Ų | 146.9 | 82% | 0.817 | 78% | 0.781 | S | S | * | * | trans | -137.6 | 24.6 | -178 | -84.6 | 114.3 | 0 | 0 | 0 | 115.3 | P358 | L356-P358 WeakPolarHBondContact O-CD 3.24Š| ||
| 357 | Q | 38.6 | Very low | 39.7 | Very low | 172 Ų | 172 | 146.3 Ų | 146.3 | 80% | 0.804 | 78% | 0.782 | S | S | * | * | trans | -85.3 | 122 | 166.9 | -78.4 | -161.6 | 14.9 | 0 | 0 | 111.6 | ||||
| 358 | P | 38.9 | Very low | 39.6 | Very low | 105 Ų | 105 | 146 Ų | 146 | 68% | 0.682 | 79% | 0.785 | S | S | * | * | trans | -70.3 | 134.8 | 179.8 | 28 | -31.2 | 0 | 0 | 0 | 110.6 | L356 Y360 | L356-P358 WeakPolarHBondContact O-CD 3.24Å; P358-Y360 PolarHBondContact O-N 3.22Å | ||
| 359 | I | 36.9 | Very low | 39.6 | Very low | 160 Ų | 160 | 147.6 Ų | 147.6 | 82% | 0.821 | 80% | 0.795 | S | S | * | * | trans | -53.5 | 109.1 | 171.5 | -60.3 | 163.7 | 0 | 0 | 0 | 108.9 | ||||
| 360 | Y | 36.1 | Very low | 39.8 | Very low | 215 Ų | 215 | 141.6 Ų | 141.6 | 84% | 0.843 | 79% | 0.787 | S | S | * | * | trans | -116.7 | 106.8 | 158 | -103.9 | -90 | 0 | 0 | 0 | 108.4 | P358 N362 | P358-Y360 PolarHBondContact O-N 3.22Å; Y360-N362 PolarHBondContact O-N 2.93Å | ||
| 361 | M | 37.5 | Very low | 39.8 | Very low | 172 Ų | 172 | 143.3 Ų | 143.3 | 85% | 0.847 | 80% | 0.796 | S | S | * | * | trans | -60.6 | 127.7 | 161.5 | -76.4 | -164.2 | 158.8 | 0 | 0 | 109 | ||||
| 362 | N | 34.4 | Very low | 39.7 | Very low | 156 Ų | 156 | 145 Ų | 145 | 83% | 0.834 | 80% | 0.804 | S | S | * | * | trans | -148.9 | 110 | 138.8 | -149.6 | 28 | 0 | 0 | 0 | 110.3 | Y360 | Y360-N362 PolarHBondContact O-N 2.93Š| ||
| 363 | S | 36.6 | Very low | 39.8 | Very low | 99 Ų | 99 | 142 Ų | 142 | 69% | 0.692 | 80% | 0.797 | S | S | * | * | trans | -59.1 | 135.3 | 171.3 | 33.4 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 364 | S | 39.9 | Very low | 39.6 | Very low | 112 Ų | 112 | 138.4 Ų | 138.4 | 78% | 0.783 | 79% | 0.792 | S | S | * | * | trans | -169.3 | 121.3 | 146.3 | -78.2 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 365 | S | 37.4 | Very low | 39.6 | Very low | 107 Ų | 107 | 135.5 Ų | 135.5 | 75% | 0.748 | 79% | 0.789 | S | S | * | * | trans | 70.1 | 93.2 | 144.3 | 36.6 | 0 | 0 | 0 | 0 | 122 | ||||
| 366 | L | 39.4 | Very low | 39.3 | Very low | 169 Ų | 169 | 134.8 Ų | 134.8 | 89% | 0.885 | 79% | 0.793 | S | S | * | * | 28.1 | 117.1 | 113.9 | -67.3 | 155 | 0 | 0 | 0 | 118.7 | |||||
| 367 | S | 36.9 | Very low | 39.2 | Very low | 113 Ų | 113 | 132.7 Ų | 132.7 | 79% | 0.79 | 79% | 0.791 | S | S | * | * | -170 | 127.2 | 123.3 | -85 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 368 | S | 38.4 | Very low | 39 | Very low | 109 Ų | 109 | 131 Ų | 131 | 76% | 0.762 | 79% | 0.793 | S | S | * | * | trans | 45.6 | 120.1 | 144 | 68.7 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 369 | S | 40.2 | Very low | 38.7 | Very low | 119 Ų | 119 | 132.5 Ų | 132.5 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | cis | -165.1 | 148.9 | 48.6 | -67.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 370 | A | 42.2 | Very low | 38.4 | Very low | 95 Ų | 95 | 130.3 Ų | 130.3 | 79% | 0.785 | 79% | 0.794 | S | S | * | * | trans | -69.3 | 158.6 | -172.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 371 | P | 44.4 | Very low | 38.2 | Very low | 122 Ų | 122 | 124.7 Ų | 124.7 | 79% | 0.792 | 79% | 0.792 | S | S | * | * | trans | -90.4 | 152.7 | -176.7 | 35.8 | -32.4 | 0 | 0 | 0 | 112.8 | ||||
| 372 | Q | 42.5 | Very low | 38.2 | Very low | 189 Ų | 189 | 125.7 Ų | 125.7 | 88% | 0.883 | 79% | 0.792 | S | S | * | * | trans | -112.7 | 119.1 | 168.7 | -172.9 | -179.3 | -19.1 | 0 | 0 | 109.9 | ||||
| 373 | P | 39.3 | Very low | 38.3 | Very low | 109 Ų | 109 | 125.5 Ų | 125.5 | 71% | 0.708 | 79% | 0.79 | S | S | * | * | trans | -122.3 | 133.1 | 167.6 | 35.2 | -22.1 | 0 | 0 | 0 | 112.3 | ||||
| 374 | S | 43.3 | Very low | 38.5 | Very low | 106 Ų | 106 | 126.5 Ų | 126.5 | 74% | 0.741 | 79% | 0.794 | S | S | * | * | trans | -174.7 | 160.1 | 156.9 | -2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 375 | P | 44.2 | Very low | 38.7 | Very low | 117 Ų | 117 | 127.9 Ų | 127.9 | 76% | 0.76 | 80% | 0.797 | S | S | * | * | -124.5 | 179.8 | -52 | 35 | -15.7 | 0 | 0 | 0 | 110.5 | |||||
| 376 | P | 37 | Very low | 38.7 | Very low | 129 Ų | 129 | 125.4 Ų | 125.4 | 84% | 0.838 | 79% | 0.789 | S | S | * | * | trans | -89.1 | 143.9 | -158.3 | 35.4 | -31.3 | 0 | 0 | 0 | 113.6 | ||||
| 377 | S | 39 | Very low | 38.7 | Very low | 111 Ų | 111 | 125 Ų | 125 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | -135.8 | 121.8 | 168.6 | -68.9 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 378 | T | 35.4 | Very low | 39 | Very low | 138 Ų | 138 | 126.5 Ų | 126.5 | 85% | 0.847 | 78% | 0.784 | S | S | * | * | trans | 67.8 | 98.7 | 158 | 6.1 | 0 | 0 | 0 | 0 | 118.8 | T380 | T378-T380 PolarHBondContact O-N 3.39Š| ||
| 379 | T | 32.1 | Very low | 38.9 | Very low | 135 Ų | 135 | 126.5 Ų | 126.5 | 83% | 0.828 | 78% | 0.783 | S | S | * | * | trans | -56.3 | 121.2 | 157.3 | -50.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 380 | T | 31.4 | Very low | 38.8 | Very low | 115 Ų | 115 | 126.9 Ų | 126.9 | 71% | 0.706 | 78% | 0.78 | S | S | * | * | trans | -140.1 | 103 | 146.1 | -65.2 | 0 | 0 | 0 | 0 | 106.4 | T378 K382 | T378-T380 PolarHBondContact O-N 3.39Å; T380-K382 HydrophobicContact CG2-CG 4.44Å; T380-K382 PolarHBondContact O-N 3.36Å | ||
| 381 | A | 30.9 | Very low | 39.2 | Very low | 97 Ų | 97 | 128.5 Ų | 128.5 | 80% | 0.802 | 78% | 0.78 | S | S | * | * | trans | -67.4 | 112.9 | 165.1 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 382 | K | 37.8 | Very low | 38.9 | Very low | 192 Ų | 192 | 126.7 Ų | 126.7 | 84% | 0.835 | 76% | 0.764 | S | S | * | * | trans | -110.2 | 123.9 | 158.2 | -96.3 | 178.5 | 176.7 | 178.4 | 0 | 107.5 | T380 | T380-K382 HydrophobicContact CG2-CG 4.44Å; T380-K382 PolarHBondContact O-N 3.36Å | ||
| 383 | L | 35.6 | Very low | 39.5 | Very low | 152 Ų | 152 | 123.1 Ų | 123.1 | 80% | 0.796 | 76% | 0.757 | S | S | * | * | trans | -47.5 | 157.1 | -178.9 | -73.3 | 136.1 | 0 | 0 | 0 | 112.9 | V385 | L383-V385 PolarHBondContact O-N 3.48Š| ||
| 384 | P | 41.1 | Very low | 39.9 | Very low | 120 Ų | 120 | 127.5 Ų | 127.5 | 78% | 0.779 | 76% | 0.761 | S | S | * | * | trans | -59.5 | 116.8 | 166.9 | 26.8 | -31.5 | 0 | 0 | 0 | 107.8 | G386 | P384-G386 PolarHBondContact O-N 2.78Š| ||
| 385 | V | 43.8 | Very low | 39.8 | Very low | 141 Ų | 141 | 134.1 Ų | 134.1 | 86% | 0.855 | 78% | 0.777 | S | S | * | * | trans | -67.4 | 103.9 | 171.9 | 175.1 | 0 | 0 | 0 | 0 | 106.2 | L383 I387 | L383-V385 PolarHBondContact O-N 3.48Å; V385-I387 PolarHBondContact O-N 3.25Å | ||
| 386 | G | 37.9 | Very low | 39.6 | Very low | 56 Ų | 56 | 135 Ų | 135 | 58% | 0.577 | 78% | 0.777 | S | S | * | * | trans | -59.5 | 131.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | P384 I388 | P384-G386 PolarHBondContact O-N 2.78Å; G386-I388 PolarHBondContact O-N 2.88Å; G386-I388 VanDerWaalsContact O-N 3.1Å | ||
| 387 | I | 39.5 | Very low | 39.7 | Very low | 160 Ų | 160 | 135.3 Ų | 135.3 | 82% | 0.821 | 77% | 0.774 | S | S | * | * | trans | -69.7 | 106.6 | 166.5 | -61.6 | 173.8 | 0 | 0 | 0 | 106 | V385 C389 | V385-I387 PolarHBondContact O-N 3.25Å; I387-C389 PolarHBondContact O-N 3.35Å | ||
| 388 | I | 43.2 | Very low | 39.7 | Very low | 144 Ų | 144 | 136.6 Ų | 136.6 | 74% | 0.738 | 77% | 0.774 | S | S | * | * | trans | -73.5 | 111 | 170.4 | -63.4 | 171.3 | 0 | 0 | 0 | 106.3 | G386 T390 | G386-I388 PolarHBondContact O-N 2.88Å; G386-I388 VanDerWaalsContact O-N 3.1Å; I388-T390 HydrophobicContact CG2-CG2 4.15Å; I388-T390 PolarHBondContact O-N 3.44Å | ||
| 389 | C | 36 | Very low | 40 | Very low | 110 Ų | 110 | 136.5 Ų | 136.5 | 74% | 0.743 | 77% | 0.77 | S | S | * | * | trans | -74.8 | 101.9 | 163.6 | -65.1 | 0 | 0 | 0 | 0 | 108.3 | I387 V391 | I387-C389 PolarHBondContact O-N 3.35Å; C389-V391 PolarHBondContact O-N 2.94Å | ||
| 390 | T | 38.9 | Very low | 40.5 | Very low | 126 Ų | 126 | 136.6 Ų | 136.6 | 77% | 0.773 | 77% | 0.766 | S | S | * | * | trans | -78 | 102.4 | 162.4 | 42.3 | 0 | 0 | 0 | 0 | 108.5 | I388 N392 | I388-T390 HydrophobicContact CG2-CG2 4.15Å; I388-T390 PolarHBondContact O-N 3.44Å; T390-N392 PolarHBondContact O-N 3.31Å | ||
| 391 | V | 49.8 | Very low | 41.1 | Very low | 129 Ų | 129 | 138.1 Ų | 138.1 | 78% | 0.782 | 77% | 0.77 | S | S | * | * | trans | -70.2 | 121.6 | 163.1 | -170.1 | 0 | 0 | 0 | 0 | 106.5 | C389 P393 | C389-V391 PolarHBondContact O-N 2.94Å; V391-P393 VanDerWaalsContact O-CD 3.3Å; V391-P393 WeakPolarHBondContact O-CD 3.23Å | ||
| 392 | N | 38.8 | Very low | 41.8 | Very low | 85 Ų | 85 | 141 Ų | 141 | 46% | 0.455 | 77% | 0.768 | S | S | . | * | trans | -65.6 | 120.4 | 174.4 | -167.5 | -12.9 | 0 | 0 | 0 | 108.4 | T390 Y394 F395 | T390-N392 PolarHBondContact O-N 3.31Å; N392-Y394 PolarHBondContact O-N 3.15Å; N392-Y394 VanDerWaalsContact O-N 3.1Å; N392-Y394 PolarHBondContact OD1-N 3.33Å; N392-F395 WeakPolarHBondContact ND2-CD2 3.25Å | ||
| 393 | P | 54.8 | Low | 42.1 | Very low | 114 Ų | 114 | 137.1 Ų | 137.1 | 74% | 0.74 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | 7.1 | 176.4 | 29.2 | -32.7 | 0 | 0 | 0 | 113.5 | V391 | V391-P393 VanDerWaalsContact O-CD 3.3Å; V391-P393 WeakPolarHBondContact O-CD 3.23Å |
| 394 | Y | 47 | Very low | 42.7 | Very low | 200 Ų | 200 | 135.8 Ų | 135.8 | 78% | 0.784 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.4 | 19.2 | -176.8 | -69.6 | -76.3 | 0 | 0 | 0 | 115.4 | N392 | N392-Y394 PolarHBondContact O-N 3.15Å; N392-Y394 VanDerWaalsContact O-N 3.1Å; N392-Y394 PolarHBondContact OD1-N 3.33Å |
| 395 | F | 41.2 | Very low | 42.8 | Very low | 245 Ų | 245 | 137.3 Ų | 137.3 | 100% | 1.075 | 76% | 0.758 | S | S | * | * | trans | -135.6 | 0 | 168.6 | -76.3 | -78.6 | 0 | 0 | 0 | 113 | N392 | N392-F395 WeakPolarHBondContact ND2-CD2 3.25Š|
Retrieved 395 of 395 residues in 145.3 ms
(Link to these results)