| 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 | 56.8 | Low | 66.9 | Low | 247 Ų | 247 | 141.5 Ų | 141.5 | 100% | 1.217 | 75% | 0.753 | S | S | * | * | 0 | 85.4 | 0 | -60.9 | 173.2 | 80.8 | 0 | 0 | 108.5 | |||||
| 2 | S | 67 | Low | 68.1 | Low | 133 Ų | 133 | 135.4 Ų | 135.4 | 93% | 0.93 | 73% | 0.73 | S | S | * | * | trans | -161.4 | 122.6 | -179.8 | -160.5 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 3 | G | 69.6 | Low | 69.4 | Low | 67 Ų | 67 | 139.3 Ų | 139.3 | 69% | 0.691 | 73% | 0.728 | S | S | * | * | trans | 159.2 | -0.7 | -176.4 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 4 | R | 66.2 | Low | 70.6 | Confident | 242 Ų | 242 | 134.2 Ų | 134.2 | 91% | 0.913 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -84.8 | -16 | -177.1 | -69.4 | -176.6 | 171.6 | 178.2 | -2.8 | 115 | ||
| 5 | S | 64.8 | Low | 71.8 | Confident | 99 Ų | 99 | 134.5 Ų | 134.5 | 69% | 0.692 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -78 | -45.7 | -168.3 | -164.1 | 0 | 0 | 0 | 0 | 114.5 | R7 A8 | S5-R7 PolarHBondContact O-N 3.39Å; S5-R7 VanDerWaalsContact O-N 3.15Å; S5-A8 WeakPolarHBondContact O-CB 3.25Å; S5-A8 PolarHBondContact O-N 3.34Å |
| 6 | V | 64.2 | Low | 73.1 | Confident | 122 Ų | 122 | 130.1 Ų | 130.1 | 74% | 0.739 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -61.4 | -33.3 | -172.9 | -174.6 | 0 | 0 | 0 | 0 | 112.4 | A8 T10 | V6-A8 VanDerWaalsContact C-N 3.33Å; V6-A8 PolarHBondContact O-N 3.47Å; V6-T10 PolarHBondContact O-OG1 3.46Å |
| 7 | R | 63.4 | Low | 74.3 | Confident | 167 Ų | 167 | 126.9 Ų | 126.9 | 63% | 0.63 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -71.6 | -25.3 | 179.9 | -171.7 | 173.5 | -179.2 | 85.4 | -9.1 | 113.5 | S5 R11 | S5-R7 PolarHBondContact O-N 3.39Å; S5-R7 VanDerWaalsContact O-N 3.15Å; R7-R11 WeakPolarHBondContact O-CG 3.09Å |
| 8 | A | 70.6 | Confident | 75.4 | Confident | 63 Ų | 63 | 124.7 Ų | 124.7 | 52% | 0.521 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -72.6 | -39.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | S5 V6 S12 | S5-A8 WeakPolarHBondContact O-CB 3.25Å; S5-A8 PolarHBondContact O-N 3.34Å; V6-A8 VanDerWaalsContact C-N 3.33Å; V6-A8 PolarHBondContact O-N 3.47Å; A8-S12 PolarHBondContact O-N 2.99Å |
| 9 | E | 68.5 | Low | 76.5 | Confident | 155 Ų | 155 | 123.9 Ų | 123.9 | 72% | 0.724 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -70 | -42 | -178.1 | -169.1 | 172 | 87.6 | 0 | 0 | 112.7 | R11 S12 R13 | E9-R11 PolarHBondContact O-N 3.22Å; E9-S12 PolarHBondContact O-N 2.9Å; E9-S12 PolarHBondContact O-OG 3.13Å; E9-R13 PolarHBondContact O-N 3.45Å |
| 10 | T | 71.6 | Confident | 77.4 | Confident | 102 Ų | 102 | 123.7 Ų | 123.7 | 63% | 0.626 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -63.5 | -33.4 | 179.1 | -40.4 | 0 | 0 | 0 | 0 | 112.4 | V6 | V6-T10 PolarHBondContact O-OG1 3.46Å |
| 11 | R | 73.7 | Confident | 78.4 | Confident | 159 Ų | 159 | 121.6 Ų | 121.6 | 60% | 0.6 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -72.9 | -31.6 | 179.2 | -72.1 | 178.6 | 168.6 | -138.7 | -8.1 | 112.6 | R7 E9 | R7-R11 WeakPolarHBondContact O-CG 3.09Å; E9-R11 PolarHBondContact O-N 3.22Å |
| 12 | S | 81.5 | Confident | 80.2 | Confident | 69 Ų | 69 | 115.2 Ų | 115.2 | 48% | 0.483 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -72.5 | -36.4 | -179.3 | 67.5 | 0 | 0 | 0 | 0 | 111.8 | A8 E9 K15 D16 | A8-S12 PolarHBondContact O-N 2.99Å; E9-S12 PolarHBondContact O-N 2.9Å; E9-S12 PolarHBondContact O-OG 3.13Å; S12-K15 CarbonylContact O-C 3.51Å; S12-K15 PolarHBondContact O-N 3.43Å; S12-D16 WeakPolarHBondContact O-CB 3.39Å; S12-D16 PolarHBondContact O-N 3.48Å |
| 13 | R | 84.5 | Confident | 81.6 | Confident | 186 Ų | 186 | 110.9 Ų | 110.9 | 70% | 0.702 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -61.4 | -52.5 | 179.8 | -169.6 | 167.5 | -175.5 | 176 | 1.3 | 112.7 | E9 K15 D16 D17 | E9-R13 PolarHBondContact O-N 3.45Å; R13-K15 PolarHBondContact O-N 3.11Å; R13-D16 WeakPolarHBondContact O-CA 3.37Å; R13-D16 WeakPolarHBondContact O-CB 3.35Å; R13-D16 PolarHBondContact O-N 2.91Å; R13-D17 PolarHBondContact O-N 2.68Å |
| 14 | A | 86.6 | Confident | 82.7 | Confident | 68 Ų | 68 | 110 Ų | 110 | 56% | 0.562 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -57.3 | -37.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | D16 I18 | A14-D16 VanDerWaalsContact C-N 3.33Å; A14-I18 PolarHBondContact O-N 3.27Å |
| 15 | K | 88.2 | Confident | 84.1 | Confident | 138 Ų | 138 | 101.7 Ų | 101.7 | 60% | 0.6 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -76 | -16.3 | 175.5 | -175.8 | 162.8 | 173.4 | 157.8 | 0 | 113.5 | S12 R13 I18 K19 | S12-K15 CarbonylContact O-C 3.51Å; S12-K15 PolarHBondContact O-N 3.43Å; R13-K15 PolarHBondContact O-N 3.11Å; K15-I18 VanDerWaalsContact O-CG2 3.27Å; K15-I18 WeakPolarHBondContact O-CG2 3.5Å; K15-K19 WeakPolarHBondContact O-CG 3.47Å; K15-K19 PolarHBondContact O-NZ 3.43Å |
| 16 | D | 92.8 | Very high | 85.5 | Confident | 65 Ų | 65 | 102.4 Ų | 102.4 | 35% | 0.348 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -83.8 | -42.3 | 172.2 | -173.2 | -109.6 | 0 | 0 | 0 | 110.8 | S12 R13 A14 I18 K19 K20 | S12-D16 WeakPolarHBondContact O-CB 3.39Å; S12-D16 PolarHBondContact O-N 3.48Å; R13-D16 WeakPolarHBondContact O-CA 3.37Å; R13-D16 WeakPolarHBondContact O-CB 3.35Å; R13-D16 PolarHBondContact O-N 2.91Å; A14-D16 VanDerWaalsContact C-N 3.33Å; D16-I18 PolarHBondContact O-N 3.39Å; D16-K19 WeakPolarHBondContact O-CB 3.36Å; D16-K19 PolarHBondContact O-N 3.03Å; D16-K20 WeakPolarHBondContact O-CG 3.43Å; D16-K20 PolarHBondContact O-N 3.37Å; D16-K20 WeakPolarHBondContact OD1-CE 2.82Å; D16-K20 IonicContact OD1-NZ 2.72Å; D16-K20 PolarHBondContact OD1-NZ 2.95Å |
| 17 | D | 93.8 | Very high | 86.9 | Confident | 76 Ų | 76 | 103.5 Ų | 103.5 | 41% | 0.406 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -57.8 | -45.4 | 176 | -71.2 | -55.4 | 0 | 0 | 0 | 111.8 | R13 K19 K20 V21 | R13-D17 PolarHBondContact O-N 2.68Å; D17-K19 VanDerWaalsContact C-N 3.32Å; D17-K19 PolarHBondContact O-N 3.14Å; D17-K20 WeakPolarHBondContact O-CB 3.17Å; D17-K20 PolarHBondContact O-N 3.46Å; D17-V21 WeakPolarHBondContact O-CG2 3.33Å; D17-V21 PolarHBondContact O-N 3.45Å |
| 18 | I | 93.9 | Very high | 88.4 | Confident | 86 Ų | 86 | 100 Ų | 100 | 44% | 0.441 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.5 | -39.5 | 174.4 | -172.9 | 61.5 | 0 | 0 | 0 | 112.5 | A14 K15 D16 V21 M22 | A14-I18 PolarHBondContact O-N 3.27Å; K15-I18 VanDerWaalsContact O-CG2 3.27Å; K15-I18 WeakPolarHBondContact O-CG2 3.5Å; D16-I18 PolarHBondContact O-N 3.39Å; I18-V21 PolarHBondContact O-N 3.45Å; I18-M22 HydrophobicContact CD1-CE 4.04Å; I18-M22 VanDerWaalsContact O-CG 3.32Å; I18-M22 WeakPolarHBondContact O-CG 3.31Å; I18-M22 PolarHBondContact O-N 3.42Å |
| 19 | K | 95.3 | Very high | 89.5 | Confident | 111 Ų | 111 | 106.6 Ų | 106.6 | 48% | 0.483 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67.1 | -39.1 | 177.3 | -71.4 | -168.4 | -140 | 85.9 | 0 | 111.3 | K15 D16 D17 V21 M22 A23 | K15-K19 WeakPolarHBondContact O-CG 3.47Å; K15-K19 PolarHBondContact O-NZ 3.43Å; D16-K19 WeakPolarHBondContact O-CB 3.36Å; D16-K19 PolarHBondContact O-N 3.03Å; D17-K19 VanDerWaalsContact C-N 3.32Å; D17-K19 PolarHBondContact O-N 3.14Å; K19-V21 VanDerWaalsContact C-N 3.34Å; K19-M22 PolarHBondContact O-N 2.8Å; K19-A23 VanDerWaalsContact O-CB 3.32Å; K19-A23 WeakPolarHBondContact O-CB 3.36Å; K19-A23 PolarHBondContact O-N 3.43Å |
| 20 | K | 95.7 | Very high | 90.7 | Very high | 119 Ų | 119 | 102.9 Ų | 102.9 | 52% | 0.517 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.7 | -43.9 | 174.9 | -75.4 | 168.6 | 170.3 | 153 | 0 | 111.4 | D16 D17 A23 A24 | D16-K20 WeakPolarHBondContact O-CG 3.43Å; D16-K20 PolarHBondContact O-N 3.37Å; D16-K20 WeakPolarHBondContact OD1-CE 2.82Å; D16-K20 IonicContact OD1-NZ 2.72Å; D16-K20 PolarHBondContact OD1-NZ 2.95Å; D17-K20 WeakPolarHBondContact O-CB 3.17Å; D17-K20 PolarHBondContact O-N 3.46Å; K20-A23 PolarHBondContact O-N 3.44Å; K20-A24 WeakPolarHBondContact O-CB 3.39Å; K20-A24 PolarHBondContact O-N 3.46Å |
| 21 | V | 97.4 | Very high | 91.8 | Very high | 79 Ų | 79 | 102.8 Ų | 102.8 | 48% | 0.479 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.6 | -49.8 | 175.5 | 171.9 | 0 | 0 | 0 | 0 | 110.6 | D17 I18 K19 A23 A24 I25 | D17-V21 WeakPolarHBondContact O-CG2 3.33Å; D17-V21 PolarHBondContact O-N 3.45Å; I18-V21 PolarHBondContact O-N 3.45Å; K19-V21 VanDerWaalsContact C-N 3.34Å; V21-A23 VanDerWaalsContact C-N 3.34Å; V21-A23 PolarHBondContact O-N 2.78Å; V21-A24 PolarHBondContact O-N 3.23Å; V21-A24 VanDerWaalsContact O-N 3.14Å; V21-I25 HydrophobicContact CG1-CD1 3.76Å; V21-I25 HydrophobicContact CG1-CG1 4.38Å; V21-I25 VanDerWaalsContact O-CG1 3.29Å; V21-I25 WeakPolarHBondContact O-CG1 3.42Å; V21-I25 PolarHBondContact O-N 3.14Å |
| 22 | M | 95.7 | Very high | 92.8 | Very high | 113 Ų | 113 | 99 Ų | 99 | 56% | 0.557 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -58.8 | -44.9 | 178.2 | -68.7 | -62.4 | 177.6 | 0 | 0 | 112 | I18 K19 A24 I25 E26 | I18-M22 HydrophobicContact CD1-CE 4.04Å; I18-M22 VanDerWaalsContact O-CG 3.32Å; I18-M22 WeakPolarHBondContact O-CG 3.31Å; I18-M22 PolarHBondContact O-N 3.42Å; K19-M22 PolarHBondContact O-N 2.8Å; M22-A24 VanDerWaalsContact C-N 3.34Å; M22-A24 PolarHBondContact O-N 3.42Å; M22-I25 PolarHBondContact O-N 3.48Å; M22-E26 WeakPolarHBondContact O-CB 3.01Å; M22-E26 PolarHBondContact O-N 2.89Å |
| 23 | A | 94.7 | Very high | 93.5 | Very high | 43 Ų | 43 | 100.6 Ų | 100.6 | 36% | 0.355 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65 | -35.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | K19 K20 V21 K27 | K19-A23 VanDerWaalsContact O-CB 3.32Å; K19-A23 WeakPolarHBondContact O-CB 3.36Å; K19-A23 PolarHBondContact O-N 3.43Å; K20-A23 PolarHBondContact O-N 3.44Å; V21-A23 VanDerWaalsContact C-N 3.34Å; V21-A23 PolarHBondContact O-N 2.78Å; A23-K27 VanDerWaalsContact O-CG 3.31Å; A23-K27 WeakPolarHBondContact O-CG 3.42Å; A23-K27 PolarHBondContact O-N 2.82Å |
| 24 | A | 94.7 | Very high | 94 | Very high | 48 Ų | 48 | 96.5 Ų | 96.5 | 40% | 0.397 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -67.8 | -42.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | K20 V21 M22 E26 K27 V28 | K20-A24 WeakPolarHBondContact O-CB 3.39Å; K20-A24 PolarHBondContact O-N 3.46Å; V21-A24 PolarHBondContact O-N 3.23Å; V21-A24 VanDerWaalsContact O-N 3.14Å; M22-A24 VanDerWaalsContact C-N 3.34Å; M22-A24 PolarHBondContact O-N 3.42Å; A24-E26 VanDerWaalsContact C-N 3.33Å; A24-K27 WeakPolarHBondContact O-CB 2.94Å; A24-K27 PolarHBondContact O-N 3.11Å; A24-V28 PolarHBondContact O-N 3.17Å; A24-V28 VanDerWaalsContact O-N 3.12Å |
| 25 | I | 94.8 | Very high | 94.5 | Very high | 68 Ų | 68 | 99.2 Ų | 99.2 | 35% | 0.349 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.7 | -43.8 | 175.3 | -64.6 | 165.7 | 0 | 0 | 0 | 110.2 | V21 M22 K27 V28 R29 | V21-I25 HydrophobicContact CG1-CD1 3.76Å; V21-I25 HydrophobicContact CG1-CG1 4.38Å; V21-I25 VanDerWaalsContact O-CG1 3.29Å; V21-I25 WeakPolarHBondContact O-CG1 3.42Å; V21-I25 PolarHBondContact O-N 3.14Å; M22-I25 PolarHBondContact O-N 3.48Å; I25-K27 VanDerWaalsContact C-N 3.28Å; I25-K27 PolarHBondContact O-N 3.2Å; I25-V28 PolarHBondContact O-N 3.04Å; I25-V28 VanDerWaalsContact O-N 3.12Å; I25-R29 HydrophobicContact CG2-CG 4.42Å; I25-R29 WeakPolarHBondContact O-CG 3.12Å; I25-R29 PolarHBondContact O-N 2.93Å |
| 26 | E | 93.8 | Very high | 94.9 | Very high | 114 Ų | 114 | 95.6 Ų | 95.6 | 53% | 0.533 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -61.1 | -36.9 | 177.4 | -173.8 | 162.4 | -145.5 | 0 | 0 | 112.2 | M22 A24 R29 K30 | M22-E26 WeakPolarHBondContact O-CB 3.01Å; M22-E26 PolarHBondContact O-N 2.89Å; A24-E26 VanDerWaalsContact C-N 3.33Å; E26-R29 PolarHBondContact O-N 3.38Å; E26-K30 WeakPolarHBondContact O-CG 3.46Å; E26-K30 PolarHBondContact O-N 2.84Å |
| 27 | K | 92.7 | Very high | 95 | Very high | 145 Ų | 145 | 96 Ų | 96 | 63% | 0.63 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -60.9 | -46.5 | 171.4 | -71.8 | 169 | -174 | 175.9 | 0 | 112 | A23 A24 I25 R29 K30 W31 | A23-K27 VanDerWaalsContact O-CG 3.31Å; A23-K27 WeakPolarHBondContact O-CG 3.42Å; A23-K27 PolarHBondContact O-N 2.82Å; A24-K27 WeakPolarHBondContact O-CB 2.94Å; A24-K27 PolarHBondContact O-N 3.11Å; I25-K27 VanDerWaalsContact C-N 3.28Å; I25-K27 PolarHBondContact O-N 3.2Å; K27-R29 VanDerWaalsContact C-N 3.35Å; K27-K30 PolarHBondContact O-N 3.4Å; K27-W31 PolarHBondContact O-NE1 3.09Å |
| 28 | V | 95.1 | Very high | 95.1 | Very high | 92 Ų | 92 | 95.3 Ų | 95.3 | 56% | 0.558 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -66 | -38.1 | 179.9 | 176 | 0 | 0 | 0 | 0 | 111.4 | A24 I25 K30 W31 | A24-V28 PolarHBondContact O-N 3.17Å; A24-V28 VanDerWaalsContact O-N 3.12Å; I25-V28 PolarHBondContact O-N 3.04Å; I25-V28 VanDerWaalsContact O-N 3.12Å; V28-K30 PolarHBondContact O-N 2.87Å; V28-W31 WeakPolarHBondContact O-CB 3.43Å; V28-W31 PolarHBondContact O-N 3.35Å |
| 29 | R | 93.7 | Very high | 94.9 | Very high | 202 Ų | 202 | 94.3 Ų | 94.3 | 76% | 0.762 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -58.8 | -26.8 | 175.6 | -81.1 | -173.1 | 154.8 | 100.6 | 6.7 | 113.7 | I25 E26 K27 W31 | I25-R29 HydrophobicContact CG2-CG 4.42Å; I25-R29 WeakPolarHBondContact O-CG 3.12Å; I25-R29 PolarHBondContact O-N 2.93Å; E26-R29 PolarHBondContact O-N 3.38Å; K27-R29 VanDerWaalsContact C-N 3.35Å; R29-W31 VanDerWaalsContact C-N 3.34Å |
| 30 | K | 93.6 | Very high | 94.8 | Very high | 78 Ų | 78 | 97.6 Ų | 97.6 | 34% | 0.339 | 50% | 0.496 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | -6.5 | 178.4 | -69.2 | 171.8 | 169.2 | -164.9 | 0 | 113.2 | E26 K27 V28 E32 V51 D53 | E26-K30 WeakPolarHBondContact O-CG 3.46Å; E26-K30 PolarHBondContact O-N 2.84Å; K27-K30 PolarHBondContact O-N 3.4Å; V28-K30 PolarHBondContact O-N 2.87Å; K30-E32 PolarHBondContact O-N 3.23Å; K30-V51 WeakPolarHBondContact O-CB 3.48Å; K30-V51 WeakPolarHBondContact O-CG2 3.29Å; K30-D53 VanDerWaalsContact CD-OD2 3.24Å; K30-D53 WeakPolarHBondContact CD-OD2 3.36Å; K30-D53 VanDerWaalsContact CE-OD2 3.29Å; K30-D53 WeakPolarHBondContact CE-OD2 3.5Å; K30-D53 IonicContact NZ-OD2 2.66Å; K30-D53 PolarHBondContact NZ-OD2 2.61Å |
| 31 | W | 96 | Very high | 94.7 | Very high | 100 Ų | 100 | 95.4 Ų | 95.4 | 38% | 0.379 | 49% | 0.492 | S | S | . | . | trans | -62.7 | 139.9 | -178.6 | -73.1 | 26.6 | 0 | 0 | 0 | 110.7 | K27 V28 R29 W48 V49 P50 | K27-W31 PolarHBondContact O-NE1 3.09Å; V28-W31 WeakPolarHBondContact O-CB 3.43Å; V28-W31 PolarHBondContact O-N 3.35Å; R29-W31 VanDerWaalsContact C-N 3.34Å; W31-W48 HydrophobicContact CB-CB 4.39Å; W31-W48 HydrophobicContact CB-CE3 4.22Å; W31-W48 HydrophobicContact CE3-CB 3.68Å; W31-W48 VanDerWaalsContact CE3-O 3.23Å; W31-W48 HydrophobicContact CZ3-CB 4.43Å; W31-W48 WeakPolarHBondContact CZ3-O 3.32Å; W31-W48 VanDerWaalsContact O-CZ3 3.31Å; W31-W48 WeakPolarHBondContact O-CZ3 3.27Å; W31-V49 WeakPolarHBondContact CA-O 3.48Å; W31-P50 HydrophobicContact CD2-CG 4.31Å; W31-P50 HydrophobicContact CH2-CG 4.11Å; W31-P50 HydrophobicContact CZ2-CB 4.36Å; W31-P50 HydrophobicContact CZ2-CG 3.72Å | ||
| 32 | E | 94.8 | Very high | 94.5 | Very high | 78 Ų | 78 | 97.2 Ų | 97.2 | 36% | 0.364 | 51% | 0.509 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.2 | 140.1 | 179.9 | 64.9 | 179.3 | 179.8 | 0 | 0 | 110.7 | K30 K34 W48 V49 V51 | K30-E32 PolarHBondContact O-N 3.23Å; E32-K34 HydrophobicContact CG-CG 3.84Å; E32-K34 PolarHBondContact O-N 2.88Å; E32-K34 WeakPolarHBondContact OE1-CE 3.42Å; E32-K34 IonicContact OE1-NZ 3.74Å; E32-K34 WeakPolarHBondContact OE2-CE 3.34Å; E32-K34 IonicContact OE2-NZ 3.09Å; E32-K34 PolarHBondContact OE2-NZ 3.18Å; E32-K34 VanDerWaalsContact OE2-NZ 3.09Å; E32-W48 WeakPolarHBondContact O-CA 3.5Å; E32-V49 PolarHBondContact N-O 3.42Å; E32-V49 PolarHBondContact O-N 3.06Å; E32-V51 HydrophobicContact CB-CG2 3.5Å; E32-V51 HydrophobicContact CG-CG2 3.29Å |
| 33 | K | 96.3 | Very high | 94.5 | Very high | 103 Ų | 103 | 97.2 Ų | 97.2 | 45% | 0.448 | 51% | 0.51 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.4 | 111.3 | 175 | -177.3 | -177.6 | 168.6 | 82.4 | 0 | 108.9 | F46 W48 | K33-F46 HydrophobicContact CD-CB 4.47Å; K33-F46 HydrophobicContact CD-CD1 4.01Å; K33-F46 HydrophobicContact CD-CE1 4.28Å; K33-F46 HydrophobicContact CD-CG 4.23Å; K33-F46 VanDerWaalsContact CE-CD1 3.48Å; K33-F46 VanDerWaalsContact CE-CD2 3.48Å; K33-F46 HydrophobicContact CG-CB 4.03Å; K33-F46 HydrophobicContact CG-CD1 3.5Å; K33-F46 HydrophobicContact CG-CE1 4.06Å; K33-F46 HydrophobicContact CG-CG 3.98Å; K33-F46 VanDerWaalsContact NZ-CB 3.3Å; K33-W48 HydrophobicContact CB-CD2 4.17Å; K33-W48 HydrophobicContact CB-CE3 3.94Å; K33-W48 HydrophobicContact CB-CH2 4.02Å; K33-W48 HydrophobicContact CB-CZ2 4.23Å; K33-W48 HydrophobicContact CB-CZ3 3.87Å; K33-W48 HydrophobicContact CD-CZ2 4.46Å |
| 34 | K | 95.3 | Very high | 94.6 | Very high | 100 Ų | 100 | 102.2 Ų | 102.2 | 44% | 0.435 | 52% | 0.52 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.5 | 149.5 | 178.8 | -68.8 | -75 | 179.6 | 175.1 | 0 | 112 | E32 V36 F46 K47 V49 | E32-K34 HydrophobicContact CG-CG 3.84Å; E32-K34 PolarHBondContact O-N 2.88Å; E32-K34 WeakPolarHBondContact OE1-CE 3.42Å; E32-K34 IonicContact OE1-NZ 3.74Å; E32-K34 WeakPolarHBondContact OE2-CE 3.34Å; E32-K34 IonicContact OE2-NZ 3.09Å; E32-K34 PolarHBondContact OE2-NZ 3.18Å; E32-K34 VanDerWaalsContact OE2-NZ 3.09Å; K34-V36 PolarHBondContact O-N 3.02Å; K34-F46 CarbonylContact O-C 3.58Å; K34-F46 WeakPolarHBondContact O-CA 2.97Å; K34-K47 PolarHBondContact N-O 2.86Å; K34-K47 PolarHBondContact O-N 3.36Å; K34-V49 HydrophobicContact CB-CG2 4.22Å |
| 35 | W | 96.3 | Very high | 94.6 | Very high | 125 Ų | 125 | 103.7 Ų | 103.7 | 47% | 0.473 | 52% | 0.521 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.9 | 109.9 | 169.8 | -75.3 | 115.8 | 0 | 0 | 0 | 110.3 | R44 I45 F46 | W35-R44 HydrophobicContact CB-CB 4.28Å; W35-R44 VanDerWaalsContact CB-NH2 3.32Å; W35-R44 HydrophobicContact CD2-CB 4.47Å; W35-R44 HydrophobicContact CE3-CB 3.89Å; W35-R44 WeakPolarHBondContact CZ3-O 3.29Å; W35-R44 PolarHBondContact O-NH2 3.32Å; W35-R44 VanDerWaalsContact O-NH2 3.11Å; W35-I45 CarbonylContact C-O 3.54Å; W35-I45 WeakPolarHBondContact CA-O 3.24Å; W35-F46 AromaticContact CD1-CE1 3.55Å; W35-F46 AromaticContact CD1-CZ 3.93Å; W35-F46 AromaticContact CD2-CD1 3.78Å; W35-F46 HydrophobicContact CD2-CD1 3.78Å; W35-F46 HydrophobicContact CD2-CD2 4.09Å; W35-F46 AromaticContact CD2-CE1 3.73Å; W35-F46 HydrophobicContact CD2-CE1 3.73Å; W35-F46 HydrophobicContact CD2-CE2 4.06Å; W35-F46 AromaticContact CD2-CG 4Å; W35-F46 HydrophobicContact CD2-CG 4Å; W35-F46 AromaticContact CD2-CZ 3.9Å; W35-F46 HydrophobicContact CD2-CZ 3.9Å; W35-F46 AromaticContact CE2-CD1 3.89Å; W35-F46 AromaticContact CE2-CD2 3.79Å; W35-F46 AromaticContact CE2-CE1 3.41Å; W35-F46 VanDerWaalsContact CE2-CE1 3.41Å; W35-F46 AromaticContact CE2-CE2 3.31Å; W35-F46 AromaticContact CE2-CZ 3.11Å; W35-F46 HydrophobicContact CE3-CD1 4.2Å; W35-F46 HydrophobicContact CE3-CD2 4.04Å; W35-F46 HydrophobicContact CE3-CE2 4.39Å; W35-F46 AromaticContact CE3-CG 3.98Å; W35-F46 HydrophobicContact CE3-CG 3.98Å; W35-F46 HydrophobicContact CG-CD1 4.02Å; W35-F46 AromaticContact CG-CE1 3.86Å; W35-F46 HydrophobicContact CG-CE1 3.86Å; W35-F46 HydrophobicContact CG-CZ 4.37Å; W35-F46 AromaticContact CH2-CD2 3.4Å; W35-F46 HydrophobicContact CH2-CD2 3.4Å; W35-F46 VanDerWaalsContact CH2-CD2 3.4Å; W35-F46 AromaticContact CH2-CE2 3.37Å; W35-F46 HydrophobicContact CH2-CE2 3.37Å; W35-F46 HydrophobicContact CH2-CG 4.19Å; W35-F46 HydrophobicContact CH2-CZ 4.11Å; W35-F46 HydrophobicContact CZ2-CD1 4.43Å; W35-F46 AromaticContact CZ2-CD2 3.49Å; W35-F46 HydrophobicContact CZ2-CD2 3.49Å; W35-F46 VanDerWaalsContact CZ2-CD2 3.49Å; W35-F46 HydrophobicContact CZ2-CE1 4.01Å; W35-F46 AromaticContact CZ2-CE2 2.94Å; W35-F46 HydrophobicContact CZ2-CE2 2.94Å; W35-F46 HydrophobicContact CZ2-CG 4.23Å; W35-F46 AromaticContact CZ2-CZ 3.27Å; W35-F46 HydrophobicContact CZ2-CZ 3.27Å; W35-F46 AromaticContact CZ3-CD2 3.69Å; W35-F46 HydrophobicContact CZ3-CD2 3.69Å; W35-F46 HydrophobicContact CZ3-CE2 4.07Å; W35-F46 HydrophobicContact CZ3-CG 4.06Å; W35-F46 AromaticContact NE1-CE1 3.26Å; W35-F46 VanDerWaalsContact NE1-CE1 3.26Å; W35-F46 AromaticContact NE1-CE2 3.84Å; W35-F46 AromaticContact NE1-CZ 3.13Å |
| 36 | V | 95.5 | Very high | 94.7 | Very high | 62 Ų | 62 | 105 Ų | 105 | 38% | 0.376 | 52% | 0.524 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.2 | 134.8 | 177.3 | -177.9 | 0 | 0 | 0 | 0 | 109.1 | K34 R44 I45 K47 V49 | K34-V36 PolarHBondContact O-N 3.02Å; V36-R44 CarbonylContact O-C 3.54Å; V36-R44 WeakPolarHBondContact O-CA 3.41Å; V36-I45 PolarHBondContact N-O 3.08Å; V36-I45 PolarHBondContact O-N 3.17Å; V36-K47 HydrophobicContact CB-CB 4.47Å; V36-K47 HydrophobicContact CG2-CB 3.93Å; V36-V49 HydrophobicContact CG2-CG2 4.13Å |
| 37 | T | 96.4 | Very high | 94.9 | Very high | 75 Ų | 75 | 105.3 Ų | 105.3 | 46% | 0.46 | 52% | 0.523 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.5 | 139.2 | 176.9 | -53 | 0 | 0 | 0 | 0 | 110.7 | G39 T41 L43 | T37-G39 PolarHBondContact O-N 3.12Å; T37-T41 WeakPolarHBondContact CG2-O 3.32Å; T37-L43 WeakPolarHBondContact CA-O 3.45Å |
| 38 | V | 94.8 | Very high | 95.1 | Very high | 60 Ų | 60 | 105.6 Ų | 105.6 | 36% | 0.364 | 52% | 0.52 | S | S | . | . | trans | -90.3 | 103 | -178.8 | -175.8 | 0 | 0 | 0 | 0 | 109.8 | D40 T41 L43 I45 | V38-D40 PolarHBondContact O-N 3.12Å; V38-T41 WeakPolarHBondContact O-CB 3.31Å; V38-T41 PolarHBondContact O-N 3.48Å; V38-T41 VanDerWaalsContact O-N 3.14Å; V38-T41 PolarHBondContact O-OG1 3.26Å; V38-L43 PolarHBondContact N-O 2.93Å; V38-I45 HydrophobicContact CG2-CB 4.13Å; V38-I45 HydrophobicContact CG2-CD1 3.8Å; V38-I45 HydrophobicContact CG2-CG1 3.63Å; V38-I45 HydrophobicContact CG2-CG2 3.55Å | ||
| 39 | G | 90 | Very high | 95.1 | Very high | 65 Ų | 65 | 103.5 Ų | 103.5 | 67% | 0.67 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.5 | -135.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | T37 T41 | T37-G39 PolarHBondContact O-N 3.12Å; G39-T41 VanDerWaalsContact C-N 3.29Å; G39-T41 PolarHBondContact O-N 2.99Å |
| 40 | D | 93.7 | Very high | 95.2 | Very high | 181 Ų | 181 | 97.3 Ų | 97.3 | 97% | 0.968 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.1 | 15.5 | 179.3 | -52.2 | -46.8 | 0 | 0 | 0 | 113.4 | V38 | V38-D40 PolarHBondContact O-N 3.12Š|
| 41 | T | 93.5 | Very high | 95.1 | Very high | 72 Ų | 72 | 95.8 Ų | 95.8 | 44% | 0.442 | 49% | 0.491 | S | S | . | . | S | Bend | trans | -92.6 | 164.2 | 180 | 73.6 | 0 | 0 | 0 | 0 | 112.3 | T37 V38 G39 L43 | T37-T41 WeakPolarHBondContact CG2-O 3.32Å; V38-T41 WeakPolarHBondContact O-CB 3.31Å; V38-T41 PolarHBondContact O-N 3.48Å; V38-T41 VanDerWaalsContact O-N 3.14Å; V38-T41 PolarHBondContact O-OG1 3.26Å; G39-T41 VanDerWaalsContact C-N 3.29Å; G39-T41 PolarHBondContact O-N 2.99Å; T41-L43 PolarHBondContact O-N 3.42Å; T41-L43 PolarHBondContact OG1-N 2.83Å |
| 42 | S | 92.8 | Very high | 94.4 | Very high | 118 Ų | 118 | 96.4 Ų | 96.4 | 83% | 0.825 | 51% | 0.506 | S | S | * | . | S | Bend | trans | -78.8 | -3.1 | 171.7 | 60.4 | 0 | 0 | 0 | 0 | 113.8 | ||
| 43 | L | 96.2 | Very high | 93.1 | Very high | 113 Ų | 113 | 96.5 Ų | 96.5 | 59% | 0.592 | 51% | 0.509 | S | S | * | . | trans | -76.9 | 144.3 | -178.1 | -81 | 70 | 0 | 0 | 0 | 111 | T37 V38 T41 | T37-L43 WeakPolarHBondContact CA-O 3.45Å; V38-L43 PolarHBondContact N-O 2.93Å; T41-L43 PolarHBondContact O-N 3.42Å; T41-L43 PolarHBondContact OG1-N 2.83Å | ||
| 44 | R | 95.7 | Very high | 91.4 | Very high | 147 Ų | 147 | 96.3 Ų | 96.3 | 56% | 0.555 | 52% | 0.521 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 140.5 | 174 | -58.6 | 177 | 71.8 | -172.4 | 2.4 | 109.4 | W35 V36 | W35-R44 HydrophobicContact CB-CB 4.28Å; W35-R44 VanDerWaalsContact CB-NH2 3.32Å; W35-R44 HydrophobicContact CD2-CB 4.47Å; W35-R44 HydrophobicContact CE3-CB 3.89Å; W35-R44 WeakPolarHBondContact CZ3-O 3.29Å; W35-R44 PolarHBondContact O-NH2 3.32Å; W35-R44 VanDerWaalsContact O-NH2 3.11Å; V36-R44 CarbonylContact O-C 3.54Å; V36-R44 WeakPolarHBondContact O-CA 3.41Å |
| 45 | I | 96.7 | Very high | 89.6 | Confident | 80 Ų | 80 | 101.2 Ų | 101.2 | 41% | 0.41 | 54% | 0.542 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.1 | 149.1 | 175.7 | 58.5 | 172.1 | 0 | 0 | 0 | 110.5 | W35 V36 V38 K47 | W35-I45 CarbonylContact C-O 3.54Å; W35-I45 WeakPolarHBondContact CA-O 3.24Å; V36-I45 PolarHBondContact N-O 3.08Å; V36-I45 PolarHBondContact O-N 3.17Å; V38-I45 HydrophobicContact CG2-CB 4.13Å; V38-I45 HydrophobicContact CG2-CD1 3.8Å; V38-I45 HydrophobicContact CG2-CG1 3.63Å; V38-I45 HydrophobicContact CG2-CG2 3.55Å; I45-K47 PolarHBondContact O-N 2.82Å |
| 46 | F | 96.8 | Very high | 87.7 | Confident | 95 Ų | 95 | 101.5 Ų | 101.5 | 42% | 0.417 | 55% | 0.549 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75 | 122.5 | 169.7 | -79.3 | -65 | 0 | 0 | 0 | 110.6 | K33 K34 W35 | K33-F46 HydrophobicContact CD-CB 4.47Å; K33-F46 HydrophobicContact CD-CD1 4.01Å; K33-F46 HydrophobicContact CD-CE1 4.28Å; K33-F46 HydrophobicContact CD-CG 4.23Å; K33-F46 VanDerWaalsContact CE-CD1 3.48Å; K33-F46 VanDerWaalsContact CE-CD2 3.48Å; K33-F46 HydrophobicContact CG-CB 4.03Å; K33-F46 HydrophobicContact CG-CD1 3.5Å; K33-F46 HydrophobicContact CG-CE1 4.06Å; K33-F46 HydrophobicContact CG-CG 3.98Å; K33-F46 VanDerWaalsContact NZ-CB 3.3Å; K34-F46 CarbonylContact O-C 3.58Å; K34-F46 WeakPolarHBondContact O-CA 2.97Å; W35-F46 AromaticContact CD1-CE1 3.55Å; W35-F46 AromaticContact CD1-CZ 3.93Å; W35-F46 AromaticContact CD2-CD1 3.78Å; W35-F46 HydrophobicContact CD2-CD1 3.78Å; W35-F46 HydrophobicContact CD2-CD2 4.09Å; W35-F46 AromaticContact CD2-CE1 3.73Å; W35-F46 HydrophobicContact CD2-CE1 3.73Å; W35-F46 HydrophobicContact CD2-CE2 4.06Å; W35-F46 AromaticContact CD2-CG 4Å; W35-F46 HydrophobicContact CD2-CG 4Å; W35-F46 AromaticContact CD2-CZ 3.9Å; W35-F46 HydrophobicContact CD2-CZ 3.9Å; W35-F46 AromaticContact CE2-CD1 3.89Å; W35-F46 AromaticContact CE2-CD2 3.79Å; W35-F46 AromaticContact CE2-CE1 3.41Å; W35-F46 VanDerWaalsContact CE2-CE1 3.41Å; W35-F46 AromaticContact CE2-CE2 3.31Å; W35-F46 AromaticContact CE2-CZ 3.11Å; W35-F46 HydrophobicContact CE3-CD1 4.2Å; W35-F46 HydrophobicContact CE3-CD2 4.04Å; W35-F46 HydrophobicContact CE3-CE2 4.39Å; W35-F46 AromaticContact CE3-CG 3.98Å; W35-F46 HydrophobicContact CE3-CG 3.98Å; W35-F46 HydrophobicContact CG-CD1 4.02Å; W35-F46 AromaticContact CG-CE1 3.86Å; W35-F46 HydrophobicContact CG-CE1 3.86Å; W35-F46 HydrophobicContact CG-CZ 4.37Å; W35-F46 AromaticContact CH2-CD2 3.4Å; W35-F46 HydrophobicContact CH2-CD2 3.4Å; W35-F46 VanDerWaalsContact CH2-CD2 3.4Å; W35-F46 AromaticContact CH2-CE2 3.37Å; W35-F46 HydrophobicContact CH2-CE2 3.37Å; W35-F46 HydrophobicContact CH2-CG 4.19Å; W35-F46 HydrophobicContact CH2-CZ 4.11Å; W35-F46 HydrophobicContact CZ2-CD1 4.43Å; W35-F46 AromaticContact CZ2-CD2 3.49Å; W35-F46 HydrophobicContact CZ2-CD2 3.49Å; W35-F46 VanDerWaalsContact CZ2-CD2 3.49Å; W35-F46 HydrophobicContact CZ2-CE1 4.01Å; W35-F46 AromaticContact CZ2-CE2 2.94Å; W35-F46 HydrophobicContact CZ2-CE2 2.94Å; W35-F46 HydrophobicContact CZ2-CG 4.23Å; W35-F46 AromaticContact CZ2-CZ 3.27Å; W35-F46 HydrophobicContact CZ2-CZ 3.27Å; W35-F46 AromaticContact CZ3-CD2 3.69Å; W35-F46 HydrophobicContact CZ3-CD2 3.69Å; W35-F46 HydrophobicContact CZ3-CE2 4.07Å; W35-F46 HydrophobicContact CZ3-CG 4.06Å; W35-F46 AromaticContact NE1-CE1 3.26Å; W35-F46 VanDerWaalsContact NE1-CE1 3.26Å; W35-F46 AromaticContact NE1-CE2 3.84Å; W35-F46 AromaticContact NE1-CZ 3.13Å |
| 47 | K | 96.3 | Very high | 85.5 | Confident | 121 Ų | 121 | 108.1 Ų | 108.1 | 53% | 0.526 | 57% | 0.573 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -123.1 | 139.2 | 171 | -175.8 | 69.6 | 74.5 | 177.1 | 0 | 108.7 | K34 V36 I45 V49 | K34-K47 PolarHBondContact N-O 2.86Å; K34-K47 PolarHBondContact O-N 3.36Å; V36-K47 HydrophobicContact CB-CB 4.47Å; V36-K47 HydrophobicContact CG2-CB 3.93Å; I45-K47 PolarHBondContact O-N 2.82Å; K47-V49 HydrophobicContact CB-CG2 4.41Å; K47-V49 HydrophobicContact CG-CG2 4.39Å; K47-V49 PolarHBondContact O-N 3.29Å |
| 48 | W | 97.2 | Very high | 83.2 | Confident | 150 Ų | 150 | 114 Ų | 114 | 57% | 0.568 | 60% | 0.595 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -75.8 | 112.4 | 167.4 | -68.2 | 102.9 | 0 | 0 | 0 | 108.1 | W31 E32 K33 | W31-W48 HydrophobicContact CB-CB 4.39Å; W31-W48 HydrophobicContact CB-CE3 4.22Å; W31-W48 HydrophobicContact CE3-CB 3.68Å; W31-W48 VanDerWaalsContact CE3-O 3.23Å; W31-W48 HydrophobicContact CZ3-CB 4.43Å; W31-W48 WeakPolarHBondContact CZ3-O 3.32Å; W31-W48 VanDerWaalsContact O-CZ3 3.31Å; W31-W48 WeakPolarHBondContact O-CZ3 3.27Å; E32-W48 WeakPolarHBondContact O-CA 3.5Å; K33-W48 HydrophobicContact CB-CD2 4.17Å; K33-W48 HydrophobicContact CB-CE3 3.94Å; K33-W48 HydrophobicContact CB-CH2 4.02Å; K33-W48 HydrophobicContact CB-CZ2 4.23Å; K33-W48 HydrophobicContact CB-CZ3 3.87Å; K33-W48 HydrophobicContact CD-CZ2 4.46Å |
| 49 | V | 95 | Very high | 81.2 | Confident | 48 Ų | 48 | 120.1 Ų | 120.1 | 29% | 0.291 | 62% | 0.616 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -104 | 135.2 | -176.9 | -176.9 | 0 | 0 | 0 | 0 | 108.2 | W31 E32 K34 V36 K47 V51 | W31-V49 WeakPolarHBondContact CA-O 3.48Å; E32-V49 PolarHBondContact N-O 3.42Å; E32-V49 PolarHBondContact O-N 3.06Å; K34-V49 HydrophobicContact CB-CG2 4.22Å; V36-V49 HydrophobicContact CG2-CG2 4.13Å; K47-V49 HydrophobicContact CB-CG2 4.41Å; K47-V49 HydrophobicContact CG-CG2 4.39Å; K47-V49 PolarHBondContact O-N 3.29Å; V49-V51 PolarHBondContact O-N 2.93Å |
| 50 | P | 95.4 | Very high | 79.1 | Confident | 73 Ų | 73 | 121.9 Ų | 121.9 | 47% | 0.474 | 62% | 0.619 | S | S | . | * | P | Polyproline II helix | trans | -57.7 | 123.5 | 175.2 | -20.3 | 29.5 | 0 | 0 | 0 | 111.2 | W31 | W31-P50 HydrophobicContact CD2-CG 4.31Å; W31-P50 HydrophobicContact CH2-CG 4.11Å; W31-P50 HydrophobicContact CZ2-CB 4.36Å; W31-P50 HydrophobicContact CZ2-CG 3.72Å |
| 51 | V | 92.1 | Very high | 76.9 | Confident | 46 Ų | 46 | 123.1 Ų | 123.1 | 28% | 0.279 | 62% | 0.615 | S | S | . | * | P | Polyproline II helix | trans | -86.5 | 117 | 169.4 | -179 | 0 | 0 | 0 | 0 | 108.2 | K30 E32 V49 | K30-V51 WeakPolarHBondContact O-CB 3.48Å; K30-V51 WeakPolarHBondContact O-CG2 3.29Å; E32-V51 HydrophobicContact CB-CG2 3.5Å; E32-V51 HydrophobicContact CG-CG2 3.29Å; V49-V51 PolarHBondContact O-N 2.93Å |
| 52 | T | 80.7 | Confident | 74.4 | Confident | 113 Ų | 113 | 124.6 Ų | 124.6 | 69% | 0.693 | 63% | 0.629 | S | S | * | * | trans | -89.5 | 111.1 | 166.1 | 55.8 | 0 | 0 | 0 | 0 | 108.2 | S54 | T52-S54 VanDerWaalsContact C-N 3.27Å; T52-S54 PolarHBondContact O-N 3.24Å | ||
| 53 | D | 68.8 | Low | 71.9 | Confident | 79 Ų | 79 | 127.4 Ų | 127.4 | 42% | 0.422 | 64% | 0.635 | S | S | . | * | trans | -64.8 | 89.4 | 168 | -66.5 | -57.5 | 0 | 0 | 0 | 109.2 | K30 K55 | K30-D53 VanDerWaalsContact CD-OD2 3.24Å; K30-D53 WeakPolarHBondContact CD-OD2 3.36Å; K30-D53 VanDerWaalsContact CE-OD2 3.29Å; K30-D53 WeakPolarHBondContact CE-OD2 3.5Å; K30-D53 IonicContact NZ-OD2 2.66Å; K30-D53 PolarHBondContact NZ-OD2 2.61Å; D53-K55 PolarHBondContact O-N 2.97Å; D53-K55 VanDerWaalsContact O-N 3.1Å | ||
| 54 | S | 60.8 | Low | 69.2 | Low | 100 Ų | 100 | 126.8 Ų | 126.8 | 70% | 0.699 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.5 | 9.2 | 174.6 | -70.6 | 0 | 0 | 0 | 0 | 113 | T52 | T52-S54 VanDerWaalsContact C-N 3.27Å; T52-S54 PolarHBondContact O-N 3.24Å |
| 55 | K | 57.1 | Low | 66.3 | Low | 203 Ų | 203 | 125 Ų | 125 | 88% | 0.883 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.6 | -4.5 | -174.4 | -73.4 | -72.3 | -174.1 | 175.3 | 0 | 115.7 | D53 | D53-K55 PolarHBondContact O-N 2.97Å; D53-K55 VanDerWaalsContact O-N 3.1Å |
| 56 | E | 56.9 | Low | 63.6 | Low | 131 Ų | 131 | 125.8 Ų | 125.8 | 61% | 0.612 | 67% | 0.668 | S | S | * | * | trans | -102.2 | 3.4 | 179.5 | -151.6 | -178.7 | 90.6 | 0 | 0 | 114.4 | E58 | E56-E58 PolarHBondContact O-N 2.89Š| ||
| 57 | K | 49.5 | Very low | 60.9 | Low | 201 Ų | 201 | 125.7 Ų | 125.7 | 87% | 0.874 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.3 | 5.7 | -173.9 | -91.5 | -169.7 | 172.3 | -179.9 | 0 | 116.6 | ||
| 58 | E | 47.6 | Very low | 58.5 | Low | 198 Ų | 198 | 131 Ų | 131 | 93% | 0.925 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.4 | 2.5 | 179.2 | -76.2 | -161.9 | 111.2 | 0 | 0 | 116.3 | E56 | E56-E58 PolarHBondContact O-N 2.89Š|
| 59 | K | 51.7 | Low | 55.9 | Low | 188 Ų | 188 | 132.3 Ų | 132.3 | 82% | 0.817 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -134.8 | 3.1 | -175.6 | -136.2 | 168.8 | 178.3 | 177 | 0 | 118.8 | K61 | K59-K61 PolarHBondContact O-N 3.38Š|
| 60 | S | 47.7 | Very low | 54.1 | Low | 103 Ų | 103 | 134.2 Ų | 134.2 | 72% | 0.72 | 73% | 0.728 | S | S | * | * | trans | -103.5 | 62 | -173.5 | -53.9 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 61 | K | 45.9 | Very low | 51.4 | Low | 207 Ų | 207 | 138.7 Ų | 138.7 | 90% | 0.9 | 75% | 0.748 | S | S | * | * | trans | -129.2 | 44.3 | 168.4 | -168.3 | 152.6 | -179.2 | 161.7 | 0 | 112.7 | K59 | K59-K61 PolarHBondContact O-N 3.38Š| ||
| 62 | S | 42.1 | Very low | 49 | Very low | 103 Ų | 103 | 140.1 Ų | 140.1 | 72% | 0.72 | 77% | 0.771 | S | S | * | * | trans | -131.9 | 61.3 | 174.1 | 56.6 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 63 | N | 38.6 | Very low | 47.3 | Very low | 177 Ų | 177 | 144.6 Ų | 144.6 | 95% | 0.947 | 78% | 0.782 | S | S | * | * | trans | -102.2 | 78.1 | 151.2 | -97.9 | -6.6 | 0 | 0 | 0 | 107.9 | ||||
| 64 | S | 39.7 | Very low | 46.7 | Very low | 100 Ų | 100 | 146.6 Ų | 146.6 | 70% | 0.699 | 80% | 0.799 | S | S | * | * | trans | -157.2 | 102.9 | 167.1 | -175.3 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 65 | S | 36.3 | Very low | 45.8 | Very low | 108 Ų | 108 | 147.4 Ų | 147.4 | 76% | 0.755 | 80% | 0.804 | S | S | * | * | trans | 23.1 | 113 | 146.4 | 61.2 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 66 | A | 39.2 | Very low | 45.5 | Very low | 98 Ų | 98 | 145.2 Ų | 145.2 | 81% | 0.81 | 80% | 0.802 | S | S | * | * | 165.2 | 119.3 | 129.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 67 | A | 39.8 | Very low | 44.8 | Very low | 93 Ų | 93 | 142.8 Ų | 142.8 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | trans | 52.5 | 133.8 | 130.6 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 68 | R | 46.2 | Very low | 44.7 | Very low | 231 Ų | 231 | 138.5 Ų | 138.5 | 87% | 0.872 | 80% | 0.8 | S | S | * | * | trans | 101.1 | 91.2 | 150.5 | -59.2 | -68.6 | -140.1 | 179.4 | 6.5 | 118 | ||||
| 69 | E | 43.7 | Very low | 44.6 | Very low | 178 Ų | 178 | 132.7 Ų | 132.7 | 83% | 0.832 | 79% | 0.786 | S | S | * | * | 45.6 | 150.9 | 119 | -79.1 | -67.6 | 95.6 | 0 | 0 | 122.7 | |||||
| 70 | P | 55.3 | Low | 44.4 | Very low | 89 Ų | 89 | 131 Ų | 131 | 58% | 0.578 | 79% | 0.786 | S | S | * | * | trans | -90.4 | 166.2 | -152.7 | 39.4 | -38.7 | 0 | 0 | 0 | 112.4 | ||||
| 71 | N | 39.1 | Very low | 44.3 | Very low | 167 Ų | 167 | 131.3 Ų | 131.3 | 89% | 0.893 | 79% | 0.788 | S | S | * | * | trans | 164 | 124.2 | 143.4 | -82.7 | 0.8 | 0 | 0 | 0 | 109.6 | ||||
| 72 | G | 43.1 | Very low | 44.5 | Very low | 75 Ų | 75 | 126.7 Ų | 126.7 | 77% | 0.773 | 78% | 0.782 | S | S | * | * | trans | 160.5 | 69.5 | 169 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 73 | F | 45.2 | Very low | 45.2 | Very low | 208 Ų | 208 | 129.2 Ų | 129.2 | 91% | 0.912 | 79% | 0.787 | S | S | * | * | trans | -76 | 140.7 | 155.3 | -84.1 | -89.7 | 0 | 0 | 0 | 109.1 | ||||
| 74 | P | 55.2 | Low | 46.2 | Very low | 120 Ų | 120 | 126.2 Ų | 126.2 | 78% | 0.779 | 77% | 0.77 | S | S | * | * | trans | -106.8 | 109.1 | 142.4 | 31.2 | -22.7 | 0 | 0 | 0 | 108.8 | D76 | P74-D76 PolarHBondContact O-N 3.34Š| ||
| 75 | S | 41.5 | Very low | 47.4 | Very low | 117 Ų | 117 | 130 Ų | 130 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | trans | -77.3 | 104.9 | 155.7 | 173.3 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 76 | D | 51.9 | Low | 48.5 | Very low | 157 Ų | 157 | 133 Ų | 133 | 84% | 0.84 | 78% | 0.783 | S | S | * | * | trans | -122.2 | 138.1 | 159.4 | -142.2 | -46.4 | 0 | 0 | 0 | 109.4 | P74 | P74-D76 PolarHBondContact O-N 3.34Š| ||
| 77 | A | 42.2 | Very low | 49.7 | Very low | 81 Ų | 81 | 136.7 Ų | 136.7 | 67% | 0.669 | 78% | 0.782 | S | S | * | * | trans | -89.1 | -173.1 | -163.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 78 | S | 47.1 | Very low | 50.8 | Low | 111 Ų | 111 | 140.4 Ų | 140.4 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | trans | 93.8 | 91.9 | 160.8 | -145.5 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 79 | A | 44.6 | Very low | 52 | Low | 76 Ų | 76 | 132.9 Ų | 132.9 | 63% | 0.628 | 76% | 0.76 | S | S | * | * | 44.1 | 109.6 | 119.3 | 0 | 0 | 0 | 0 | 0 | 116 | |||||
| 80 | N | 48.8 | Very low | 53.2 | Low | 151 Ų | 151 | 133.1 Ų | 133.1 | 81% | 0.807 | 76% | 0.761 | S | S | * | * | trans | -176.9 | 82.6 | 134.5 | -78.8 | -45.6 | 0 | 0 | 0 | 107.4 | ||||
| 81 | S | 44 | Very low | 53.6 | Low | 110 Ų | 110 | 134.9 Ų | 134.9 | 77% | 0.769 | 77% | 0.766 | S | S | * | * | trans | -61.9 | 137 | 157.9 | 60.5 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 82 | S | 51.8 | Low | 54.5 | Low | 110 Ų | 110 | 129.8 Ų | 129.8 | 77% | 0.769 | 74% | 0.743 | S | S | * | * | S | Bend | trans | 102.3 | 29.3 | 159.4 | -49.8 | 0 | 0 | 0 | 0 | 121.1 | ||
| 83 | L | 55.4 | Low | 55.6 | Low | 157 Ų | 157 | 134.3 Ų | 134.3 | 82% | 0.822 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -127.1 | 5.1 | 179 | -74.5 | -179 | 0 | 0 | 0 | 120.5 | ||
| 84 | L | 61.2 | Low | 56.5 | Low | 113 Ų | 113 | 132.5 Ų | 132.5 | 59% | 0.592 | 74% | 0.744 | S | S | * | * | trans | -157.9 | 62.9 | -177.1 | -128 | 178.3 | 0 | 0 | 0 | 117.4 | E86 F87 | L84-E86 HydrophobicContact CD2-CB 4.27Å; L84-F87 HydrophobicContact CD1-CE2 4.17Å; L84-F87 HydrophobicContact CD2-CD2 3.76Å; L84-F87 HydrophobicContact CD2-CE2 3.4Å; L84-F87 VanDerWaalsContact CD2-CE2 3.4Å; L84-F87 HydrophobicContact CD2-CZ 4.09Å; L84-F87 HydrophobicContact CG-CE2 4.39Å | ||
| 85 | L | 64.2 | Low | 57.1 | Low | 181 Ų | 181 | 131.5 Ų | 131.5 | 95% | 0.948 | 74% | 0.74 | S | S | * | * | trans | -90 | 18.3 | 159.7 | -76.6 | 97 | 0 | 0 | 0 | 112.8 | F87 | L85-F87 VanDerWaalsContact C-N 3.34Å; L85-F87 PolarHBondContact O-N 3.26Å | ||
| 86 | E | 59.9 | Low | 58.5 | Low | 169 Ų | 169 | 130.5 Ų | 130.5 | 79% | 0.79 | 73% | 0.733 | S | S | * | * | trans | -93.2 | 64.6 | 177.1 | -162.8 | 176.6 | 132.8 | 0 | 0 | 111.2 | L84 | L84-E86 HydrophobicContact CD2-CB 4.27Š| ||
| 87 | F | 64.6 | Low | 59.1 | Low | 177 Ų | 177 | 129.6 Ų | 129.6 | 78% | 0.776 | 73% | 0.733 | S | S | * | * | trans | -129.3 | 64.9 | 157.3 | -69.9 | -74.2 | 0 | 0 | 0 | 107.1 | L84 L85 D89 | L84-F87 HydrophobicContact CD1-CE2 4.17Å; L84-F87 HydrophobicContact CD2-CD2 3.76Å; L84-F87 HydrophobicContact CD2-CE2 3.4Å; L84-F87 VanDerWaalsContact CD2-CE2 3.4Å; L84-F87 HydrophobicContact CD2-CZ 4.09Å; L84-F87 HydrophobicContact CG-CE2 4.39Å; L85-F87 VanDerWaalsContact C-N 3.34Å; L85-F87 PolarHBondContact O-N 3.26Å; F87-D89 PolarHBondContact O-N 3.2Å; F87-D89 VanDerWaalsContact O-N 3.13Å | ||
| 88 | Q | 62.9 | Low | 60.1 | Low | 170 Ų | 170 | 130 Ų | 130 | 79% | 0.794 | 73% | 0.731 | S | S | * | * | trans | -75.3 | 97.7 | 167 | -165.7 | 172.3 | 92.2 | 0 | 0 | 106.6 | E90 | Q88-E90 PolarHBondContact O-N 2.97Š| ||
| 89 | D | 69.4 | Low | 60.3 | Low | 74 Ų | 74 | 132 Ų | 132 | 40% | 0.396 | 73% | 0.732 | S | S | . | * | trans | -70.1 | 108.5 | 178.7 | 175.7 | -137.1 | 0 | 0 | 0 | 110.2 | F87 N91 S92 | F87-D89 PolarHBondContact O-N 3.2Å; F87-D89 VanDerWaalsContact O-N 3.13Å; D89-N91 PolarHBondContact O-N 2.9Å; D89-N91 VanDerWaalsContact OD1-CG 3.32Å; D89-N91 PolarHBondContact OD1-ND2 3.37Å; D89-N91 PolarHBondContact OD2-ND2 3.14Å; D89-S92 WeakPolarHBondContact O-CB 3.42Å; D89-S92 PolarHBondContact O-N 3.39Å; D89-S92 PolarHBondContact OD1-N 3.36Å; D89-S92 PolarHBondContact OD1-OG 2.88Å | ||
| 90 | E | 69.8 | Low | 61.2 | Low | 183 Ų | 183 | 134.6 Ų | 134.6 | 86% | 0.855 | 74% | 0.74 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.8 | 6.1 | 179.2 | -63.6 | -89.9 | 82.8 | 0 | 0 | 113.4 | Q88 | Q88-E90 PolarHBondContact O-N 2.97Š|
| 91 | N | 64.2 | Low | 61.5 | Low | 125 Ų | 125 | 136.9 Ų | 136.9 | 67% | 0.668 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116 | 0.9 | 172.5 | 91.4 | 86.7 | 0 | 0 | 0 | 114.6 | D89 N93 | D89-N91 PolarHBondContact O-N 2.9Å; D89-N91 VanDerWaalsContact OD1-CG 3.32Å; D89-N91 PolarHBondContact OD1-ND2 3.37Å; D89-N91 PolarHBondContact OD2-ND2 3.14Å; N91-N93 PolarHBondContact O-N 3.44Å |
| 92 | S | 58.4 | Low | 61.7 | Low | 61 Ų | 61 | 140.4 Ų | 140.4 | 43% | 0.427 | 74% | 0.744 | S | S | . | * | trans | -78.6 | 116 | -174.1 | -96.4 | 0 | 0 | 0 | 0 | 113.2 | D89 Q94 | D89-S92 WeakPolarHBondContact O-CB 3.42Å; D89-S92 PolarHBondContact O-N 3.39Å; D89-S92 PolarHBondContact OD1-N 3.36Å; D89-S92 PolarHBondContact OD1-OG 2.88Å; S92-Q94 PolarHBondContact O-N 3.29Å | ||
| 93 | N | 65.2 | Low | 61.8 | Low | 169 Ų | 169 | 143.1 Ų | 143.1 | 90% | 0.904 | 75% | 0.749 | S | S | * | * | trans | -68.3 | 54.5 | 160.8 | -68.8 | -72.9 | 0 | 0 | 0 | 111.1 | N91 S95 | N91-N93 PolarHBondContact O-N 3.44Å; N93-S95 PolarHBondContact O-N 3.45Å; N93-S95 VanDerWaalsContact O-N 3.08Å | ||
| 94 | Q | 64.9 | Low | 61.8 | Low | 170 Ų | 170 | 144.1 Ų | 144.1 | 79% | 0.794 | 75% | 0.746 | S | S | * | * | trans | -78.8 | 90.5 | 169.9 | -80.4 | -157.4 | 42.4 | 0 | 0 | 108.9 | S92 S96 | S92-Q94 PolarHBondContact O-N 3.29Å; Q94-S96 PolarHBondContact O-N 3.07Å; Q94-S96 VanDerWaalsContact O-N 3.17Å | ||
| 95 | S | 67 | Low | 61.5 | Low | 100 Ų | 100 | 144.5 Ų | 144.5 | 70% | 0.699 | 75% | 0.753 | S | S | * | * | trans | -68.4 | 107.4 | 154.9 | 72 | 0 | 0 | 0 | 0 | 107.4 | N93 V97 | N93-S95 PolarHBondContact O-N 3.45Å; N93-S95 VanDerWaalsContact O-N 3.08Å; S95-V97 PolarHBondContact O-N 2.72Å | ||
| 96 | S | 70.7 | Confident | 60.9 | Low | 96 Ų | 96 | 143.4 Ų | 143.4 | 67% | 0.671 | 75% | 0.748 | S | S | * | * | trans | -61.8 | 111.5 | 163.6 | 179.9 | 0 | 0 | 0 | 0 | 108.2 | Q94 S98 | Q94-S96 PolarHBondContact O-N 3.07Å; Q94-S96 VanDerWaalsContact O-N 3.17Å; S96-S98 PolarHBondContact O-N 2.87Å; S96-S98 PolarHBondContact OG-OG 2.66Å | ||
| 97 | V | 65.8 | Low | 60.1 | Low | 138 Ų | 138 | 140.4 Ų | 140.4 | 84% | 0.836 | 75% | 0.746 | S | S | * | * | trans | -73.7 | 83.3 | 169.5 | -70.1 | 0 | 0 | 0 | 0 | 108.4 | S95 | S95-V97 PolarHBondContact O-N 2.72Š| ||
| 98 | S | 61.3 | Low | 59.3 | Low | 89 Ų | 89 | 137.1 Ų | 137.1 | 62% | 0.622 | 75% | 0.745 | S | S | * | * | trans | -77.5 | 141.2 | 167.5 | -56.9 | 0 | 0 | 0 | 0 | 109.7 | S96 | S96-S98 PolarHBondContact O-N 2.87Å; S96-S98 PolarHBondContact OG-OG 2.66Å | ||
| 99 | D | 53 | Low | 58.6 | Low | 152 Ų | 152 | 135.4 Ų | 135.4 | 81% | 0.813 | 75% | 0.746 | S | S | * | * | trans | 71.9 | 96.4 | 165.2 | -75.8 | -60.7 | 0 | 0 | 0 | 120.6 | ||||
| 100 | V | 62.7 | Low | 57.6 | Low | 131 Ų | 131 | 139.3 Ų | 139.3 | 79% | 0.794 | 77% | 0.767 | S | S | * | * | trans | -140 | 89.5 | 144.2 | 172.9 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 101 | Y | 54.4 | Low | 56.3 | Low | 199 Ų | 199 | 135 Ų | 135 | 78% | 0.78 | 76% | 0.757 | S | S | * | * | trans | 57.4 | 108.6 | 154.3 | -53 | -86.5 | 0 | 0 | 0 | 119.9 | L103 | Y101-L103 PolarHBondContact O-N 3.44Š| ||
| 102 | Q | 48.4 | Very low | 55 | Low | 185 Ų | 185 | 134.3 Ų | 134.3 | 86% | 0.864 | 76% | 0.762 | S | S | * | * | trans | -51.2 | 85.1 | 140.4 | -67.7 | -87.2 | 78.3 | 0 | 0 | 109 | K104 | Q102-K104 VanDerWaalsContact C-N 3.31Å; Q102-K104 PolarHBondContact O-N 3.1Å | ||
| 103 | L | 53.8 | Low | 54.7 | Low | 167 Ų | 167 | 137 Ų | 137 | 87% | 0.874 | 78% | 0.778 | S | S | * | * | trans | -68.7 | 99.8 | 167.8 | -176.3 | 61.7 | 0 | 0 | 0 | 106.7 | Y101 V105 | Y101-L103 PolarHBondContact O-N 3.44Å; L103-V105 PolarHBondContact O-N 3.13Å | ||
| 104 | K | 56 | Low | 53.6 | Low | 177 Ų | 177 | 134 Ų | 134 | 77% | 0.77 | 77% | 0.771 | S | S | * | * | trans | -48.3 | 128.7 | 179.6 | -62.6 | 173.8 | -85.2 | -167.9 | 0 | 109.6 | Q102 D106 | Q102-K104 VanDerWaalsContact C-N 3.31Å; Q102-K104 PolarHBondContact O-N 3.1Å; K104-D106 PolarHBondContact O-N 3.18Å | ||
| 105 | V | 55 | Low | 53.2 | Low | 121 Ų | 121 | 132.1 Ų | 132.1 | 73% | 0.733 | 77% | 0.773 | S | S | * | * | trans | -38.2 | 122.5 | 165.5 | 155.9 | 0 | 0 | 0 | 0 | 110.9 | L103 | L103-V105 PolarHBondContact O-N 3.13Š| ||
| 106 | D | 52.3 | Low | 52.4 | Low | 159 Ų | 159 | 136.6 Ų | 136.6 | 85% | 0.85 | 78% | 0.783 | S | S | * | * | trans | -139.7 | 101.1 | 148.7 | -80.4 | -52 | 0 | 0 | 0 | 107.9 | K104 | K104-D106 PolarHBondContact O-N 3.18Š| ||
| 107 | S | 42.8 | Very low | 51 | Low | 106 Ų | 106 | 140.6 Ų | 140.6 | 74% | 0.741 | 79% | 0.791 | S | S | * | * | trans | -65 | 124.5 | 169 | -63.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 108 | S | 48.1 | Very low | 50 | Low | 108 Ų | 108 | 139.1 Ų | 139.1 | 76% | 0.755 | 79% | 0.786 | S | S | * | * | trans | 172.9 | 113.3 | 137.4 | -77.6 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 109 | T | 47 | Very low | 49.4 | Very low | 134 Ų | 134 | 143.5 Ų | 143.5 | 82% | 0.822 | 80% | 0.797 | S | S | * | * | trans | 33.5 | 120.6 | 138.4 | 52.3 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 110 | N | 48 | Very low | 49 | Very low | 155 Ų | 155 | 141.9 Ų | 141.9 | 83% | 0.829 | 80% | 0.798 | S | S | * | * | 109.7 | 132.8 | 129.6 | -153.6 | 37 | 0 | 0 | 0 | 118.8 | |||||
| 111 | S | 43.6 | Very low | 48.6 | Very low | 92 Ų | 92 | 143.2 Ų | 143.2 | 64% | 0.643 | 80% | 0.8 | S | S | * | * | trans | 84.4 | 99.1 | 155.5 | -61.4 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 112 | S | 37.4 | Very low | 48 | Very low | 112 Ų | 112 | 139.6 Ų | 139.6 | 78% | 0.783 | 80% | 0.803 | S | S | * | * | trans | -60.6 | 146.5 | 152.9 | 175 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 113 | P | 52.5 | Low | 48.5 | Very low | 116 Ų | 116 | 137 Ų | 137 | 75% | 0.753 | 80% | 0.802 | S | S | * | * | -138.4 | 143.5 | 126.4 | 33.9 | -19.4 | 0 | 0 | 0 | 113.8 | |||||
| 114 | S | 41.4 | Very low | 48.1 | Very low | 108 Ų | 108 | 132.9 Ų | 132.9 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 139.4 | 170.5 | -72 | 0 | 0 | 0 | 0 | 112.4 | ||
| 115 | P | 56 | Low | 47.7 | Very low | 129 Ų | 129 | 132.9 Ų | 132.9 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -83.2 | 125.6 | 167.5 | 30 | -28.3 | 0 | 0 | 0 | 111.3 | ||
| 116 | Q | 49.5 | Very low | 47.4 | Very low | 195 Ų | 195 | 134.1 Ų | 134.1 | 91% | 0.911 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 160.1 | 171.3 | -76.4 | 178.3 | -86.4 | 0 | 0 | 112.2 | ||
| 117 | Q | 43.2 | Very low | 47.5 | Very low | 180 Ų | 180 | 131 Ų | 131 | 84% | 0.841 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 158.9 | -177.1 | -56.8 | 168.4 | 1.8 | 0 | 0 | 113 | ||
| 118 | S | 44.5 | Very low | 47.9 | Very low | 106 Ų | 106 | 133.4 Ų | 133.4 | 74% | 0.741 | 80% | 0.799 | S | S | * | * | trans | 78.6 | 130.9 | 168.7 | -20.3 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 119 | E | 48.4 | Very low | 48.2 | Very low | 181 Ų | 181 | 137.4 Ų | 137.4 | 85% | 0.846 | 80% | 0.803 | S | S | * | * | -153.4 | 147.5 | 59.1 | -71.3 | 170.9 | 94.9 | 0 | 0 | 111.3 | |||||
| 120 | S | 43.9 | Very low | 48.5 | Very low | 119 Ų | 119 | 142.4 Ų | 142.4 | 83% | 0.832 | 81% | 0.807 | S | S | * | * | trans | -64.1 | 125.9 | 170.7 | 48 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 121 | L | 54.8 | Low | 49 | Very low | 158 Ų | 158 | 141 Ų | 141 | 83% | 0.827 | 80% | 0.804 | S | S | * | * | trans | -131.4 | 109.4 | 166 | -64.2 | 172.4 | 0 | 0 | 0 | 108.4 | P123 | L121-P123 WeakPolarHBondContact O-CD 3.49Š| ||
| 122 | S | 41.3 | Very low | 49.4 | Very low | 123 Ų | 123 | 143.9 Ų | 143.9 | 86% | 0.86 | 81% | 0.812 | S | S | * | * | trans | -82 | 123.8 | 160 | -80.8 | 0 | 0 | 0 | 0 | 108.3 | A124 | S122-A124 PolarHBondContact O-N 3.29Š| ||
| 123 | P | 58.1 | Low | 50.7 | Low | 130 Ų | 130 | 146 Ų | 146 | 84% | 0.844 | 81% | 0.814 | S | S | * | * | trans | -80.8 | 105 | 168.6 | -15.4 | 32.3 | 0 | 0 | 0 | 110.1 | L121 | L121-P123 WeakPolarHBondContact O-CD 3.49Š| ||
| 124 | A | 45.5 | Very low | 51.1 | Low | 82 Ų | 82 | 145.3 Ų | 145.3 | 68% | 0.678 | 81% | 0.813 | S | S | * | * | trans | -77.3 | 125.9 | 160.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | S122 | S122-A124 PolarHBondContact O-N 3.29Š| ||
| 125 | H | 47.6 | Very low | 52.3 | Low | 176 Ų | 176 | 147.6 Ų | 147.6 | 82% | 0.815 | 81% | 0.811 | S | S | * | * | trans | 14.9 | 119 | 156.3 | -44.3 | -77.4 | 0 | 0 | 0 | 118.6 | ||||
| 126 | T | 50.6 | Low | 53 | Low | 147 Ų | 147 | 146.1 Ų | 146.1 | 90% | 0.902 | 80% | 0.802 | S | S | * | * | -166.7 | 156.7 | 129.2 | 40.8 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 127 | S | 53.9 | Low | 54 | Low | 95 Ų | 95 | 143 Ų | 143 | 66% | 0.664 | 80% | 0.799 | S | S | * | * | trans | 93.6 | 88.6 | 166.8 | 133.6 | 0 | 0 | 0 | 0 | 116.5 | F129 | S127-F129 PolarHBondContact O-N 3.41Š| ||
| 128 | D | 50.1 | Low | 55.2 | Low | 156 Ų | 156 | 137.6 Ų | 137.6 | 83% | 0.834 | 78% | 0.778 | S | S | * | * | trans | -56.7 | 110.6 | 150.4 | -70.2 | -83.4 | 0 | 0 | 0 | 111.1 | ||||
| 129 | F | 54.3 | Low | 56.2 | Low | 191 Ų | 191 | 141.2 Ų | 141.2 | 84% | 0.838 | 79% | 0.788 | S | S | * | * | trans | -134.8 | 107.7 | 152.6 | -84 | -83.7 | 0 | 0 | 0 | 107.8 | S127 T131 | S127-F129 PolarHBondContact O-N 3.41Å; F129-T131 PolarHBondContact O-N 3.36Å | ||
| 130 | R | 53.3 | Low | 57 | Low | 239 Ų | 239 | 136.2 Ų | 136.2 | 90% | 0.902 | 79% | 0.785 | S | S | * | * | trans | -73.7 | 116.8 | 171.9 | -68.4 | -93.1 | -92.8 | 175.2 | -7.1 | 108 | ||||
| 131 | T | 58.8 | Low | 57.8 | Low | 126 Ų | 126 | 137.2 Ų | 137.2 | 77% | 0.773 | 78% | 0.777 | S | S | * | * | trans | -159.6 | 111.3 | 151 | -67.1 | 0 | 0 | 0 | 0 | 107 | F129 D133 | F129-T131 PolarHBondContact O-N 3.36Å; T131-D133 PolarHBondContact O-N 2.96Å | ||
| 132 | D | 52.4 | Low | 58 | Low | 153 Ų | 153 | 138.8 Ų | 138.8 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | 40.2 | 67.8 | 143.9 | -148.6 | -110.1 | 0 | 0 | 0 | 115.8 | ||||
| 133 | D | 64.8 | Low | 58.7 | Low | 155 Ų | 155 | 140 Ų | 140 | 83% | 0.829 | 78% | 0.775 | S | S | * | * | trans | -108.7 | 116.9 | 163.4 | -169.1 | 49.9 | 0 | 0 | 0 | 108.2 | T131 Q135 | T131-D133 PolarHBondContact O-N 2.96Å; D133-Q135 PolarHBondContact O-N 2.89Å | ||
| 134 | S | 61.7 | Low | 58.6 | Low | 103 Ų | 103 | 140.8 Ų | 140.8 | 72% | 0.72 | 77% | 0.771 | S | S | * | * | trans | -67.2 | 88 | -173.5 | -66.1 | 0 | 0 | 0 | 0 | 110.1 | P136 | S134-P136 WeakPolarHBondContact O-CD 3.41Š| ||
| 135 | Q | 66.6 | Low | 59.1 | Low | 155 Ų | 155 | 145.1 Ų | 145.1 | 72% | 0.724 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 122.8 | 169.8 | -170.7 | 177.8 | -15.4 | 0 | 0 | 109 | D133 | D133-Q135 PolarHBondContact O-N 2.89Š|
| 136 | P | 69.6 | Low | 59.3 | Low | 99 Ų | 99 | 144 Ų | 144 | 64% | 0.643 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 146.7 | 173.9 | 27 | -33.3 | 0 | 0 | 0 | 109.7 | S134 T138 | S134-P136 WeakPolarHBondContact O-CD 3.41Å; P136-T138 PolarHBondContact O-N 3.4Å |
| 137 | P | 70.9 | Confident | 59.7 | Low | 129 Ų | 129 | 142.8 Ų | 142.8 | 84% | 0.838 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 126.1 | 178.4 | 24.9 | -33.3 | 0 | 0 | 0 | 109.1 | L139 | P137-L139 PolarHBondContact O-N 3.06Š|
| 138 | T | 67.8 | Low | 59.2 | Low | 67 Ų | 67 | 142.5 Ų | 142.5 | 41% | 0.411 | 77% | 0.765 | S | S | . | * | trans | -68 | 106.3 | 173.5 | 50.5 | 0 | 0 | 0 | 0 | 108.5 | P136 G140 Q141 | P136-T138 PolarHBondContact O-N 3.4Å; T138-G140 PolarHBondContact O-N 2.93Å; T138-G140 VanDerWaalsContact O-N 3.14Å; T138-Q141 WeakPolarHBondContact OG1-CG 3.4Å; T138-Q141 PolarHBondContact OG1-NE2 2.9Å | ||
| 139 | L | 65.7 | Low | 59.3 | Low | 182 Ų | 182 | 142.8 Ų | 142.8 | 95% | 0.953 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.9 | 114.3 | 165.1 | -172.8 | 91.8 | 0 | 0 | 0 | 108.9 | P137 | P137-L139 PolarHBondContact O-N 3.06Š|
| 140 | G | 65.5 | Low | 58.9 | Low | 76 Ų | 76 | 139.1 Ų | 139.1 | 78% | 0.784 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 117.7 | 7.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 117 | T138 E142 | T138-G140 PolarHBondContact O-N 2.93Å; T138-G140 VanDerWaalsContact O-N 3.14Å; G140-E142 PolarHBondContact O-N 3.2Å |
| 141 | Q | 60.8 | Low | 58.3 | Low | 140 Ų | 140 | 134.1 Ų | 134.1 | 65% | 0.654 | 76% | 0.763 | S | S | * | * | trans | -95.7 | 65.5 | 168.5 | -59.2 | -169.7 | 25 | 0 | 0 | 110.4 | T138 I143 | T138-Q141 WeakPolarHBondContact OG1-CG 3.4Å; T138-Q141 PolarHBondContact OG1-NE2 2.9Å; Q141-I143 PolarHBondContact O-N 2.87Å | ||
| 142 | E | 59.2 | Low | 58 | Low | 190 Ų | 190 | 133.6 Ų | 133.6 | 89% | 0.888 | 77% | 0.765 | S | S | * | * | trans | -75.5 | 104.9 | 159.6 | -66.9 | -143.5 | 106.8 | 0 | 0 | 107.1 | G140 L144 | G140-E142 PolarHBondContact O-N 3.2Å; E142-L144 PolarHBondContact O-N 3.05Å | ||
| 143 | I | 55 | Low | 58 | Low | 149 Ų | 149 | 135.4 Ų | 135.4 | 76% | 0.764 | 77% | 0.768 | S | S | * | * | trans | -66.6 | 100 | 168.7 | -62.3 | 160.3 | 0 | 0 | 0 | 105.4 | Q141 E145 | Q141-I143 PolarHBondContact O-N 2.87Å; I143-E145 PolarHBondContact O-N 2.95Å | ||
| 144 | L | 57.4 | Low | 57.6 | Low | 147 Ų | 147 | 134.5 Ų | 134.5 | 77% | 0.77 | 77% | 0.768 | S | S | * | * | trans | -72.2 | 80.2 | 170.4 | -161.5 | 173.1 | 0 | 0 | 0 | 107.2 | E142 E146 | E142-L144 PolarHBondContact O-N 3.05Å; L144-E146 HydrophobicContact CD2-CB 3.79Å; L144-E146 PolarHBondContact O-N 3.23Å | ||
| 145 | E | 55.2 | Low | 57.1 | Low | 173 Ų | 173 | 134 Ų | 134 | 81% | 0.808 | 77% | 0.77 | S | S | * | * | trans | -82.2 | 103.4 | 160.4 | -173.9 | 169 | 94.7 | 0 | 0 | 106.7 | I143 P147 | I143-E145 PolarHBondContact O-N 2.95Å; E145-P147 VanDerWaalsContact O-CD 3.25Å; E145-P147 WeakPolarHBondContact O-CD 3.48Å | ||
| 146 | E | 53 | Low | 57 | Low | 153 Ų | 153 | 134.2 Ų | 134.2 | 72% | 0.715 | 78% | 0.776 | S | S | * | * | trans | -78.4 | 110.6 | 177.8 | 177.1 | 176.6 | 85.9 | 0 | 0 | 109.9 | L144 S148 | L144-E146 HydrophobicContact CD2-CB 3.79Å; L144-E146 PolarHBondContact O-N 3.23Å; E146-S148 PolarHBondContact O-N 3.35Å | ||
| 147 | P | 57.6 | Low | 57.1 | Low | 120 Ų | 120 | 136.6 Ų | 136.6 | 78% | 0.779 | 78% | 0.779 | S | S | * | * | trans | -81.9 | 114.6 | 165 | 0.6 | 20.3 | 0 | 0 | 0 | 107.4 | E145 | E145-P147 VanDerWaalsContact O-CD 3.25Å; E145-P147 WeakPolarHBondContact O-CD 3.48Å | ||
| 148 | S | 43.6 | Very low | 57.2 | Low | 89 Ų | 89 | 135.1 Ų | 135.1 | 62% | 0.622 | 77% | 0.769 | S | S | * | * | trans | -66.8 | 155.5 | 173.7 | 2.8 | 0 | 0 | 0 | 0 | 110.9 | E146 | E146-S148 PolarHBondContact O-N 3.35Š| ||
| 149 | L | 52.5 | Low | 57.2 | Low | 162 Ų | 162 | 137.9 Ų | 137.9 | 85% | 0.848 | 79% | 0.788 | S | S | * | * | trans | 93.7 | 149.3 | 162.1 | -42.4 | -175.2 | 0 | 0 | 0 | 117.1 | ||||
| 150 | P | 45.8 | Very low | 57 | Low | 114 Ų | 114 | 134.2 Ų | 134.2 | 74% | 0.74 | 77% | 0.773 | S | S | * | * | -128.6 | 154.9 | -60.1 | 32.6 | -17.1 | 0 | 0 | 0 | 111.2 | S152 | P150-S152 PolarHBondContact O-N 3.21Š| |||
| 151 | S | 40.1 | Very low | 56.7 | Low | 135 Ų | 135 | 138.9 Ų | 138.9 | 94% | 0.944 | 78% | 0.779 | S | S | * | * | trans | -55 | 119.2 | 173.1 | -55.7 | 0 | 0 | 0 | 0 | 112 | ||||
| 152 | S | 52.1 | Low | 56.4 | Low | 115 Ų | 115 | 137.7 Ų | 137.7 | 80% | 0.804 | 78% | 0.782 | S | S | * | * | trans | -132.3 | 110.1 | 161.5 | -169.9 | 0 | 0 | 0 | 0 | 108.9 | P150 V154 | P150-S152 PolarHBondContact O-N 3.21Å; S152-V154 PolarHBondContact O-N 3.36Å | ||
| 153 | E | 53.3 | Low | 56.4 | Low | 190 Ų | 190 | 138.5 Ų | 138.5 | 89% | 0.888 | 78% | 0.783 | S | S | * | * | trans | -49.3 | 115.3 | 165.9 | 173.3 | 175 | 79.5 | 0 | 0 | 112.3 | ||||
| 154 | V | 56.8 | Low | 56.7 | Low | 137 Ų | 137 | 139.3 Ų | 139.3 | 83% | 0.83 | 78% | 0.783 | S | S | * | * | trans | -155.9 | 132.8 | 151.6 | 165.1 | 0 | 0 | 0 | 0 | 107.1 | S152 | S152-V154 PolarHBondContact O-N 3.36Š| ||
| 155 | A | 51.6 | Low | 56.7 | Low | 93 Ų | 93 | 140.1 Ų | 140.1 | 77% | 0.769 | 78% | 0.783 | S | S | * | * | trans | -49.4 | 140.6 | -172.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 156 | D | 63.9 | Low | 57.1 | Low | 159 Ų | 159 | 137 Ų | 137 | 85% | 0.85 | 78% | 0.778 | S | S | * | * | trans | -133.5 | 90.1 | 154.3 | -156.2 | -107.6 | 0 | 0 | 0 | 107.1 | ||||
| 157 | E | 71.9 | Confident | 57.2 | Low | 148 Ų | 148 | 134.4 Ų | 134.4 | 69% | 0.692 | 77% | 0.772 | S | S | * | * | trans | -71.6 | 133.6 | 168.6 | -175.6 | -172.3 | 111.3 | 0 | 0 | 107.7 | ||||
| 158 | P | 72.5 | Confident | 56.6 | Low | 98 Ų | 98 | 134.3 Ų | 134.3 | 64% | 0.636 | 77% | 0.772 | S | S | * | * | trans | -61.8 | 141.2 | 177.4 | 27.5 | -34.9 | 0 | 0 | 0 | 109.8 | T160 | P158-T160 PolarHBondContact O-N 3.26Š| ||
| 159 | P | 67.8 | Low | 57 | Low | 125 Ų | 125 | 137.9 Ų | 137.9 | 81% | 0.812 | 78% | 0.783 | S | S | * | * | trans | -60.1 | 113.9 | -178.9 | 24.6 | -32.8 | 0 | 0 | 0 | 110.3 | L161 | P159-L161 PolarHBondContact O-N 2.95Å; P159-L161 VanDerWaalsContact O-N 3.13Å | ||
| 160 | T | 61.8 | Low | 56.6 | Low | 105 Ų | 105 | 138.6 Ų | 138.6 | 64% | 0.644 | 78% | 0.782 | S | S | * | * | trans | -72.4 | 98.4 | 170.3 | 11.1 | 0 | 0 | 0 | 0 | 108.4 | P158 T162 | P158-T160 PolarHBondContact O-N 3.26Å; T160-T162 VanDerWaalsContact C-N 3.32Å; T160-T162 PolarHBondContact O-N 3.26Å | ||
| 161 | L | 59.9 | Low | 56.4 | Low | 174 Ų | 174 | 138.7 Ų | 138.7 | 91% | 0.911 | 78% | 0.78 | S | S | * | * | trans | -70.2 | 91.5 | 173 | -124 | 167.5 | 0 | 0 | 0 | 109.1 | P159 | P159-L161 PolarHBondContact O-N 2.95Å; P159-L161 VanDerWaalsContact O-N 3.13Å | ||
| 162 | T | 52.9 | Low | 56.5 | Low | 115 Ų | 115 | 140.7 Ų | 140.7 | 71% | 0.706 | 78% | 0.775 | S | S | * | * | trans | -91.8 | 152.1 | 170.1 | 43.2 | 0 | 0 | 0 | 0 | 109.5 | T160 | T160-T162 VanDerWaalsContact C-N 3.32Å; T160-T162 PolarHBondContact O-N 3.26Å | ||
| 163 | K | 60.5 | Low | 55.8 | Low | 208 Ų | 208 | 141.3 Ų | 141.3 | 90% | 0.904 | 77% | 0.774 | S | S | * | * | trans | 91.2 | 104.5 | 174.7 | -154.3 | 166.6 | -178.6 | 163.1 | 0 | 113 | ||||
| 164 | E | 61.4 | Low | 55.4 | Low | 166 Ų | 166 | 138.6 Ų | 138.6 | 78% | 0.776 | 77% | 0.769 | S | S | * | * | -155.9 | 129.4 | 64.1 | -177.5 | -161.7 | 111 | 0 | 0 | 110.8 | |||||
| 165 | E | 57.6 | Low | 54.7 | Low | 164 Ų | 164 | 140.2 Ų | 140.2 | 77% | 0.766 | 77% | 0.768 | S | S | * | * | trans | -94.8 | 118.2 | 167.6 | 173.5 | -167.4 | 111.7 | 0 | 0 | 107.8 | ||||
| 166 | P | 63 | Low | 54.4 | Low | 107 Ų | 107 | 144.4 Ų | 144.4 | 70% | 0.695 | 77% | 0.772 | S | S | * | * | trans | -84.5 | 114.6 | 165.4 | 28.4 | -28.1 | 0 | 0 | 0 | 110.3 | ||||
| 167 | V | 55 | Low | 53.6 | Low | 99 Ų | 99 | 145.3 Ų | 145.3 | 60% | 0.6 | 77% | 0.771 | S | S | * | * | trans | -44.2 | 137.8 | 170.7 | 169.2 | 0 | 0 | 0 | 0 | 112.8 | L169 | V167-L169 HydrophobicContact CG1-CD2 4.38Å; V167-L169 HydrophobicContact CG1-CG 4.49Å; V167-L169 PolarHBondContact O-N 3.45Å | ||
| 168 | P | 45.4 | Very low | 52.2 | Low | 118 Ų | 118 | 146.9 Ų | 146.9 | 77% | 0.766 | 78% | 0.778 | S | S | * | * | trans | -79.9 | 115.8 | 170.9 | 31 | -28.7 | 0 | 0 | 0 | 109.8 | ||||
| 169 | L | 51.8 | Low | 51.1 | Low | 163 Ų | 163 | 149 Ų | 149 | 85% | 0.853 | 78% | 0.784 | S | S | * | * | trans | -97.3 | 100.2 | 165.8 | -70.4 | 178.7 | 0 | 0 | 0 | 109.1 | V167 | V167-L169 HydrophobicContact CG1-CD2 4.38Å; V167-L169 HydrophobicContact CG1-CG 4.49Å; V167-L169 PolarHBondContact O-N 3.45Å | ||
| 170 | E | 43.7 | Very low | 50.1 | Low | 177 Ų | 177 | 148 Ų | 148 | 83% | 0.827 | 78% | 0.781 | S | S | * | * | trans | -48.7 | 145.9 | 152.5 | -61.6 | -171.7 | 95.2 | 0 | 0 | 109.6 | ||||
| 171 | T | 41.4 | Very low | 49.1 | Very low | 116 Ų | 116 | 146.8 Ų | 146.8 | 71% | 0.712 | 79% | 0.788 | S | S | * | * | trans | 171.6 | 107.4 | 139.3 | -75.3 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 172 | Q | 41.7 | Very low | 48.6 | Very low | 177 Ų | 177 | 143.1 Ų | 143.1 | 83% | 0.827 | 78% | 0.783 | S | S | * | * | trans | 83.9 | 91 | 142.2 | -61.1 | -179.2 | 120.2 | 0 | 0 | 120.2 | ||||
| 173 | V | 38.3 | Very low | 49.1 | Very low | 129 Ų | 129 | 143.1 Ų | 143.1 | 78% | 0.782 | 79% | 0.785 | S | S | * | * | -11.5 | 116 | 126.7 | -161 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 174 | V | 44 | Very low | 49.4 | Very low | 132 Ų | 132 | 139.2 Ų | 139.2 | 80% | 0.8 | 78% | 0.781 | S | S | * | * | trans | -154.8 | 119.1 | 133.3 | 163.8 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 175 | E | 43 | Very low | 49.6 | Very low | 172 Ų | 172 | 139.4 Ų | 139.4 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | trans | -72.1 | 136.7 | 168.6 | -58.2 | 170.7 | 107.4 | 0 | 0 | 108.8 | ||||
| 176 | E | 45.4 | Very low | 50.1 | Low | 180 Ų | 180 | 141.6 Ų | 141.6 | 84% | 0.841 | 79% | 0.794 | S | S | * | * | trans | 171.8 | 94.6 | 155.7 | -97.1 | 164.5 | -177.4 | 0 | 0 | 106 | ||||
| 177 | E | 46 | Very low | 50.4 | Low | 179 Ų | 179 | 148 Ų | 148 | 84% | 0.836 | 80% | 0.804 | S | S | * | * | 86.1 | 135.3 | 97.3 | -150.1 | -177.4 | 117.5 | 0 | 0 | 112.4 | |||||
| 178 | E | 42.2 | Very low | 50.8 | Low | 180 Ų | 180 | 153 Ų | 153 | 84% | 0.841 | 82% | 0.818 | S | S | * | * | trans | -18.4 | 133.4 | -179.9 | -76.6 | 168.2 | 52.1 | 0 | 0 | 118.4 | ||||
| 179 | D | 49.7 | Very low | 51.6 | Low | 143 Ų | 143 | 152.7 Ų | 152.7 | 77% | 0.765 | 82% | 0.817 | S | S | * | * | 158.1 | 134.7 | 119 | -173.9 | 41.3 | 0 | 0 | 0 | 111.6 | |||||
| 180 | S | 47.1 | Very low | 52.4 | Low | 105 Ų | 105 | 151.4 Ų | 151.4 | 73% | 0.734 | 82% | 0.816 | S | S | * | * | trans | 47.3 | 116.8 | 153.5 | -68.3 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 181 | G | 41.2 | Very low | 53.5 | Low | 78 Ų | 78 | 150.4 Ų | 150.4 | 80% | 0.804 | 82% | 0.816 | S | S | * | * | trans | 166.1 | 83.5 | 153.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 182 | A | 49.7 | Very low | 54.5 | Low | 98 Ų | 98 | 152.1 Ų | 152.1 | 81% | 0.81 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 140.4 | 165.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 183 | P | 63.3 | Low | 55.3 | Low | 115 Ų | 115 | 148.8 Ų | 148.8 | 75% | 0.747 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 149.8 | -177.1 | 31.3 | -34.2 | 0 | 0 | 0 | 112 | ||
| 184 | P | 67.1 | Low | 56.4 | Low | 126 Ų | 126 | 149.1 Ų | 149.1 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 132.7 | -172.5 | 29.1 | -33.8 | 0 | 0 | 0 | 112.7 | K186 | P184-K186 PolarHBondContact O-N 2.86Š|
| 185 | L | 64.9 | Low | 57.4 | Low | 169 Ų | 169 | 148.6 Ų | 148.6 | 89% | 0.885 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 121.5 | 170.9 | -72.6 | 165 | 0 | 0 | 0 | 110.4 | R187 | L185-R187 PolarHBondContact O-N 3.38Š|
| 186 | K | 68.6 | Low | 58.5 | Low | 211 Ų | 211 | 146 Ų | 146 | 92% | 0.917 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 117.8 | 176.9 | -66.1 | 177.8 | 178.6 | -178.5 | 0 | 110 | P184 F188 | P184-K186 PolarHBondContact O-N 2.86Å; K186-F188 PolarHBondContact O-N 3.36Å |
| 187 | R | 68.6 | Low | 59.3 | Low | 241 Ų | 241 | 146.5 Ų | 146.5 | 91% | 0.909 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 121 | 171.2 | -59.9 | -179.4 | -165.8 | 126.9 | 3 | 108.7 | L185 | L185-R187 PolarHBondContact O-N 3.38Š|
| 188 | F | 64 | Low | 60.2 | Low | 204 Ų | 204 | 144 Ų | 144 | 90% | 0.895 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 128.2 | 166.5 | -159.7 | -97 | 0 | 0 | 0 | 108 | K186 | K186-F188 PolarHBondContact O-N 3.36Š|
| 189 | C | 62.1 | Low | 61.1 | Low | 111 Ų | 111 | 140.2 Ų | 140.2 | 75% | 0.75 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 131.9 | 178 | -73.5 | 0 | 0 | 0 | 0 | 110 | D191 | C189-D191 PolarHBondContact O-N 2.79Š|
| 190 | V | 67.7 | Low | 61.9 | Low | 137 Ų | 137 | 139.1 Ų | 139.1 | 83% | 0.83 | 81% | 0.81 | S | S | * | * | trans | -73.7 | 113.5 | 161.2 | 131.3 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 191 | D | 67.9 | Low | 62.7 | Low | 156 Ų | 156 | 143.3 Ų | 143.3 | 83% | 0.834 | 82% | 0.818 | S | S | * | * | trans | -81.9 | 114.4 | 169.3 | -166.5 | -102.8 | 0 | 0 | 0 | 107.6 | C189 | C189-D191 PolarHBondContact O-N 2.79Š| ||
| 192 | Q | 62.4 | Low | 63.6 | Low | 151 Ų | 151 | 149.1 Ų | 149.1 | 71% | 0.706 | 85% | 0.846 | S | S | * | * | trans | -87 | 137.4 | 175 | -114.7 | -134.9 | 87.7 | 0 | 0 | 109.1 | T194 | Q192-T194 PolarHBondContact O-N 3.04Å; Q192-T194 VanDerWaalsContact O-N 3.11Å | ||
| 193 | P | 58.4 | Low | 64.3 | Low | 107 Ų | 107 | 151.7 Ų | 151.7 | 70% | 0.695 | 85% | 0.848 | S | S | * | * | trans | -72.5 | 109.8 | -176.5 | 29.6 | -32.8 | 0 | 0 | 0 | 110.5 | ||||
| 194 | T | 61.3 | Low | 64.4 | Low | 137 Ų | 137 | 153.6 Ų | 153.6 | 84% | 0.84 | 85% | 0.853 | S | S | * | * | trans | -86.2 | 116.8 | 169 | -62.5 | 0 | 0 | 0 | 0 | 109.5 | Q192 | Q192-T194 PolarHBondContact O-N 3.04Å; Q192-T194 VanDerWaalsContact O-N 3.11Å | ||
| 195 | V | 64.7 | Low | 64.3 | Low | 121 Ų | 121 | 155.1 Ų | 155.1 | 73% | 0.733 | 86% | 0.855 | S | S | * | * | trans | -68.5 | 129.1 | 176.1 | -154.9 | 0 | 0 | 0 | 0 | 109.6 | Q197 | V195-Q197 PolarHBondContact O-N 3.15Š| ||
| 196 | P | 66 | Low | 64.2 | Low | 116 Ų | 116 | 154.3 Ų | 154.3 | 75% | 0.753 | 85% | 0.853 | S | S | * | * | trans | -79.8 | 111.6 | 170.4 | 29.3 | -28.4 | 0 | 0 | 0 | 109.4 | T198 | P196-T198 PolarHBondContact O-N 3.41Š| ||
| 197 | Q | 62.7 | Low | 63.9 | Low | 191 Ų | 191 | 150.8 Ų | 150.8 | 89% | 0.893 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -69 | 120.5 | 164.4 | -73.4 | -172.9 | 11.1 | 0 | 0 | 108.8 | V195 A199 | V195-Q197 PolarHBondContact O-N 3.15Å; Q197-A199 PolarHBondContact O-N 3.46Å |
| 198 | T | 64.4 | Low | 63.6 | Low | 127 Ų | 127 | 144.7 Ų | 144.7 | 78% | 0.779 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 120.5 | 171 | 46.8 | 0 | 0 | 0 | 0 | 109.8 | P196 | P196-T198 PolarHBondContact O-N 3.41Š|
| 199 | A | 61.2 | Low | 63.6 | Low | 101 Ų | 101 | 140.5 Ų | 140.5 | 84% | 0.835 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 131.1 | 167.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | Q197 | Q197-A199 PolarHBondContact O-N 3.46Š|
| 200 | S | 67.9 | Low | 63.7 | Low | 119 Ų | 119 | 142.8 Ų | 142.8 | 83% | 0.832 | 85% | 0.849 | S | S | * | * | trans | -117.2 | 113.6 | 161.7 | -67.2 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 201 | E | 63 | Low | 63.4 | Low | 193 Ų | 193 | 143.3 Ų | 143.3 | 90% | 0.902 | 85% | 0.85 | S | S | * | * | trans | -130.6 | 96.6 | 168 | -170.4 | 173.5 | 94.9 | 0 | 0 | 107.3 | ||||
| 202 | S | 61 | Low | 63 | Low | 200 Ų | 200 | 142.1 Ų | 142.1 | 100% | 1.399 | 85% | 0.852 | S | S | * | * | trans | -172.1 | 0 | 155.3 | -81.5 | 0 | 0 | 0 | 0 | 108.9 |
Retrieved 202 of 202 residues in 38.4 ms
(Link to these results)