| 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 | 45.9 | Very low | 50 | Low | 236 Ų | 236 | 141.6 Ų | 141.6 | 100% | 1.163 | 84% | 0.841 | S | S | * | * | 0 | 99.3 | 0 | -82.8 | 151.2 | 72.4 | 0 | 0 | 105.5 | |||||
| 2 | N | 43.4 | Very low | 49.9 | Very low | 148 Ų | 148 | 139.6 Ų | 139.6 | 79% | 0.791 | 84% | 0.839 | S | S | * | * | trans | -117.7 | 158.8 | -173.1 | -41.7 | -8.7 | 0 | 0 | 0 | 106.1 | ||||
| 3 | S | 48.4 | Very low | 50 | Low | 112 Ų | 112 | 137.2 Ų | 137.2 | 78% | 0.783 | 83% | 0.833 | S | S | * | * | trans | 92.5 | 131.7 | -178 | -49.5 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 4 | D | 44.3 | Very low | 50.6 | Low | 144 Ų | 144 | 133.9 Ų | 133.9 | 77% | 0.77 | 82% | 0.815 | S | S | * | * | cis | -152.1 | 133.9 | 12.8 | -103.5 | -49.4 | 0 | 0 | 0 | 109.1 | ||||
| 5 | S | 52.2 | Low | 50.5 | Low | 124 Ų | 124 | 133.3 Ų | 133.3 | 87% | 0.867 | 81% | 0.806 | S | S | * | * | trans | -113.3 | 102 | 163.9 | -71.9 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 6 | S | 61.2 | Low | 50.7 | Low | 111 Ų | 111 | 132.8 Ų | 132.8 | 78% | 0.776 | 79% | 0.794 | S | S | * | * | trans | -90.8 | 123.5 | 171.3 | -71.9 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 7 | P | 55 | Low | 50.5 | Low | 117 Ų | 117 | 132.4 Ų | 132.4 | 76% | 0.76 | 79% | 0.787 | S | S | * | * | trans | -78.9 | 132 | 173 | 30.8 | -29.9 | 0 | 0 | 0 | 110.3 | S9 | P7-S9 PolarHBondContact O-N 3.41Š| ||
| 8 | S | 47.2 | Very low | 50.4 | Low | 114 Ų | 114 | 128.8 Ų | 128.8 | 80% | 0.797 | 78% | 0.782 | S | S | * | * | trans | -45.5 | 117.6 | 170.8 | -178.7 | 0 | 0 | 0 | 0 | 111.7 | R10 | S8-R10 PolarHBondContact O-N 3.36Š| ||
| 9 | S | 50.8 | Low | 50.5 | Low | 119 Ų | 119 | 128.7 Ų | 128.7 | 83% | 0.832 | 77% | 0.774 | S | S | * | * | trans | -65 | 97.7 | 171.5 | -52.3 | 0 | 0 | 0 | 0 | 109.3 | P7 A11 | P7-S9 PolarHBondContact O-N 3.41Å; S9-A11 PolarHBondContact O-N 3.5Å | ||
| 10 | R | 52.3 | Low | 51.1 | Low | 232 Ų | 232 | 128.4 Ų | 128.4 | 88% | 0.875 | 76% | 0.762 | S | S | * | * | trans | -56.9 | 122.2 | 164.2 | -80.6 | 176.2 | 149.1 | -177.2 | -6.6 | 108.3 | S8 S12 | S8-R10 PolarHBondContact O-N 3.36Å; R10-S12 PolarHBondContact O-N 3.41Å; R10-S12 VanDerWaalsContact O-N 3.1Å | ||
| 11 | A | 49.4 | Very low | 51.6 | Low | 101 Ų | 101 | 125.9 Ų | 125.9 | 84% | 0.835 | 74% | 0.744 | S | S | * | * | trans | -55 | 114 | 169.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | S9 S13 | S9-A11 PolarHBondContact O-N 3.5Å; A11-S13 PolarHBondContact O-N 3.23Å; A11-S13 VanDerWaalsContact O-N 3.1Å | ||
| 12 | S | 49.4 | Very low | 52.8 | Low | 117 Ų | 117 | 118.9 Ų | 118.9 | 82% | 0.818 | 72% | 0.717 | S | S | * | * | trans | -58.7 | 114.4 | 171.2 | -64.8 | 0 | 0 | 0 | 0 | 108.8 | R10 | R10-S12 PolarHBondContact O-N 3.41Å; R10-S12 VanDerWaalsContact O-N 3.1Å | ||
| 13 | S | 51.2 | Low | 53.9 | Low | 109 Ų | 109 | 117.7 Ų | 117.7 | 76% | 0.762 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 125.4 | 167.9 | -168.7 | 0 | 0 | 0 | 0 | 108 | A11 D15 | A11-S13 PolarHBondContact O-N 3.23Å; A11-S13 VanDerWaalsContact O-N 3.1Å; S13-D15 PolarHBondContact O-N 3.24Å |
| 14 | P | 57.8 | Low | 54.8 | Low | 90 Ų | 90 | 122.2 Ų | 122.2 | 58% | 0.584 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 123 | 174.4 | 23.2 | -28.6 | 0 | 0 | 0 | 108.5 | M16 | P14-M16 HydrophobicContact CB-CE 4.12Å; P14-M16 HydrophobicContact CG-CE 3.86Å; P14-M16 WeakPolarHBondContact O-CE 3.41Å; P14-M16 PolarHBondContact O-N 3.27Å |
| 15 | D | 48.5 | Very low | 56 | Low | 125 Ų | 125 | 119.4 Ų | 119.4 | 67% | 0.668 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -48.1 | 117.9 | 169.2 | -177.9 | 34.5 | 0 | 0 | 0 | 110 | S13 D17 | S13-D15 PolarHBondContact O-N 3.24Å; D15-D17 VanDerWaalsContact C-N 3.28Å |
| 16 | M | 53.7 | Low | 57 | Low | 125 Ų | 125 | 113.7 Ų | 113.7 | 62% | 0.616 | 65% | 0.645 | S | S | * | * | trans | -84.8 | -2.6 | -176.7 | -73.7 | -70.2 | 114.4 | 0 | 0 | 112.5 | P14 G18 M19 | P14-M16 HydrophobicContact CB-CE 4.12Å; P14-M16 HydrophobicContact CG-CE 3.86Å; P14-M16 WeakPolarHBondContact O-CE 3.41Å; P14-M16 PolarHBondContact O-N 3.27Å; M16-G18 PolarHBondContact O-N 3.23Å; M16-G18 VanDerWaalsContact O-N 3.14Å; M16-M19 PolarHBondContact O-N 2.97Å | ||
| 17 | D | 48.6 | Very low | 57.5 | Low | 126 Ų | 126 | 112.1 Ų | 112.1 | 67% | 0.674 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.8 | -11.8 | -172.1 | -76.9 | -27.7 | 0 | 0 | 0 | 114.1 | D15 | D15-D17 VanDerWaalsContact C-N 3.28Š|
| 18 | G | 48.9 | Very low | 58.5 | Low | 68 Ų | 68 | 113.3 Ų | 113.3 | 70% | 0.701 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.7 | -9.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | M16 F20 | M16-G18 PolarHBondContact O-N 3.23Å; M16-G18 VanDerWaalsContact O-N 3.14Å; G18-F20 PolarHBondContact O-N 3.36Å |
| 19 | M | 51.4 | Low | 59.6 | Low | 128 Ų | 128 | 110.9 Ų | 110.9 | 63% | 0.631 | 60% | 0.595 | S | S | * | * | trans | -97.8 | 24.3 | -172.6 | -73.9 | -60 | -53.8 | 0 | 0 | 114 | M16 L21 | M16-M19 PolarHBondContact O-N 2.97Å; M19-L21 PolarHBondContact O-N 3.1Å | ||
| 20 | F | 62.4 | Low | 60.6 | Low | 122 Ų | 122 | 106.5 Ų | 106.5 | 54% | 0.535 | 56% | 0.562 | S | S | . | * | trans | -71.9 | 97.7 | 168.9 | -87.6 | -88.8 | 0 | 0 | 0 | 109.6 | G18 E60 | G18-F20 PolarHBondContact O-N 3.36Å; F20-E60 WeakPolarHBondContact CE1-OE1 3.2Å; F20-E60 VanDerWaalsContact CZ-OE1 3.32Å; F20-E60 WeakPolarHBondContact CZ-OE1 3.32Å | ||
| 21 | L | 62.2 | Low | 61.6 | Low | 75 Ų | 75 | 100.4 Ų | 100.4 | 39% | 0.393 | 54% | 0.543 | S | S | . | . | trans | -45.8 | 131.8 | 160.6 | -72.5 | 171 | 0 | 0 | 0 | 108.1 | M19 R23 L25 V26 | M19-L21 PolarHBondContact O-N 3.1Å; L21-R23 PolarHBondContact O-N 3.06Å; L21-R23 VanDerWaalsContact O-N 3.1Å; L21-L25 HydrophobicContact CD2-CD2 3.94Å; L21-V26 HydrophobicContact CB-CG2 3.96Å | ||
| 22 | P | 70.8 | Confident | 62.7 | Low | 89 Ų | 89 | 98 Ų | 98 | 58% | 0.578 | 52% | 0.524 | S | S | * | . | trans | -51.2 | 126 | -176.1 | -27.4 | 32.9 | 0 | 0 | 0 | 109.7 | R24 L25 V26 | P22-R24 CarbonylContact O-C 3.51Å; P22-R24 PolarHBondContact O-N 3.43Å; P22-L25 WeakPolarHBondContact O-CB 3.3Å; P22-L25 PolarHBondContact O-N 3.35Å; P22-V26 PolarHBondContact O-N 2.83Å | ||
| 23 | R | 65.6 | Low | 63.6 | Low | 124 Ų | 124 | 94.3 Ų | 94.3 | 47% | 0.468 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -45 | -25.8 | -179.3 | -86.9 | 179.9 | 151.7 | -160.4 | -7.8 | 113.2 | L21 R27 E57 | L21-R23 PolarHBondContact O-N 3.06Å; L21-R23 VanDerWaalsContact O-N 3.1Å; R23-R27 WeakPolarHBondContact O-CB 3.31Å; R23-R27 PolarHBondContact O-N 2.88Å; R23-R27 VanDerWaalsContact O-N 3.16Å; R23-E57 IonicContact CZ-OE1 3.81Å; R23-E57 IonicContact CZ-OE2 2.71Å; R23-E57 IonicContact NH1-OE1 3.74Å; R23-E57 PolarHBondContact NH1-OE1 3.45Å; R23-E57 IonicContact NH1-OE2 3.83Å; R23-E57 IonicContact NH2-OE1 2.87Å; R23-E57 PolarHBondContact NH2-OE1 3.43Å; R23-E57 IonicContact NH2-OE2 3.46Å; R23-E57 PolarHBondContact NH2-OE2 2.95Å |
| 24 | R | 67.4 | Low | 64.4 | Low | 207 Ų | 207 | 96.2 Ų | 96.2 | 78% | 0.781 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -67.4 | -45.6 | 172.7 | -65.7 | -172.7 | -177.2 | -172.9 | 2.5 | 114 | P22 R27 H28 | P22-R24 CarbonylContact O-C 3.51Å; P22-R24 PolarHBondContact O-N 3.43Å; R24-R27 PolarHBondContact O-N 2.96Å; R24-H28 PolarHBondContact O-N 3.29Å |
| 25 | L | 71.1 | Confident | 64.8 | Low | 84 Ų | 84 | 102.1 Ų | 102.1 | 44% | 0.44 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64 | -44.3 | 178.8 | -169 | 82 | 0 | 0 | 0 | 110.4 | L21 P22 R27 H28 L29 | L21-L25 HydrophobicContact CD2-CD2 3.94Å; P22-L25 WeakPolarHBondContact O-CB 3.3Å; P22-L25 PolarHBondContact O-N 3.35Å; L25-R27 VanDerWaalsContact C-N 3.33Å; L25-R27 PolarHBondContact O-N 3.49Å; L25-H28 WeakPolarHBondContact O-CB 3.36Å; L25-H28 PolarHBondContact O-N 3.32Å; L25-H28 VanDerWaalsContact O-N 3.14Å; L25-L29 HydrophobicContact CD2-CD1 4.46Å; L25-L29 HydrophobicContact CG-CD1 4.32Å; L25-L29 WeakPolarHBondContact O-CG 3.49Å; L25-L29 PolarHBondContact O-N 3.1Å |
| 26 | V | 71.7 | Confident | 65.6 | Low | 4 Ų | 4 | 99.4 Ų | 99.4 | 2% | 0.024 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -57 | -47.7 | 175.5 | -176 | 0 | 0 | 0 | 0 | 111 | L21 P22 H28 L29 L30 V58 M63 L66 | L21-V26 HydrophobicContact CB-CG2 3.96Å; P22-V26 PolarHBondContact O-N 2.83Å; V26-H28 VanDerWaalsContact C-N 3.32Å; V26-H28 PolarHBondContact O-N 2.74Å; V26-L29 PolarHBondContact O-N 2.93Å; V26-L30 HydrophobicContact CG1-CD1 4.07Å; V26-L30 WeakPolarHBondContact O-CG 3.4Å; V26-L30 PolarHBondContact O-N 2.98Å; V26-V58 HydrophobicContact CG1-CG1 4.15Å; V26-V58 HydrophobicContact CG1-CG2 4.12Å; V26-M63 HydrophobicContact CB-CE 3.78Å; V26-M63 HydrophobicContact CG1-CE 3.33Å; V26-M63 HydrophobicContact CG2-CE 3.06Å; V26-L66 HydrophobicContact CG1-CD2 3.75Å |
| 27 | R | 72.6 | Confident | 66 | Low | 78 Ų | 78 | 97.2 Ų | 97.2 | 29% | 0.294 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.6 | -40.2 | 177.8 | -171.7 | 176.9 | -69.4 | 146.8 | -0.2 | 111.6 | R23 R24 L25 L30 H31 V56 | R23-R27 WeakPolarHBondContact O-CB 3.31Å; R23-R27 PolarHBondContact O-N 2.88Å; R23-R27 VanDerWaalsContact O-N 3.16Å; R24-R27 PolarHBondContact O-N 2.96Å; L25-R27 VanDerWaalsContact C-N 3.33Å; L25-R27 PolarHBondContact O-N 3.49Å; R27-L30 PolarHBondContact O-N 3.21Å; R27-H31 PolarHBondContact O-CD2 2.98Å; R27-H31 PolarHBondContact O-N 2.84Å; R27-V56 PolarHBondContact NH2-O 2.96Å |
| 28 | H | 75.1 | Confident | 66.7 | Low | 143 Ų | 143 | 93.9 Ų | 93.9 | 66% | 0.662 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61.7 | -45 | 173.6 | -89 | -141.8 | 0 | 0 | 0 | 112 | R24 L25 V26 H31 A32 | R24-H28 PolarHBondContact O-N 3.29Å; L25-H28 WeakPolarHBondContact O-CB 3.36Å; L25-H28 PolarHBondContact O-N 3.32Å; L25-H28 VanDerWaalsContact O-N 3.14Å; V26-H28 VanDerWaalsContact C-N 3.32Å; V26-H28 PolarHBondContact O-N 2.74Å; H28-H31 PolarHBondContact O-N 2.93Å; H28-A32 WeakPolarHBondContact O-CB 3.49Å; H28-A32 PolarHBondContact O-N 3.07Å |
| 29 | L | 72 | Confident | 66.8 | Low | 62 Ų | 62 | 95.6 Ų | 95.6 | 33% | 0.325 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.7 | -42.6 | 177.6 | -67.7 | 170.5 | 0 | 0 | 0 | 111.5 | L25 V26 H31 A32 E33 L66 I70 | L25-L29 HydrophobicContact CD2-CD1 4.46Å; L25-L29 HydrophobicContact CG-CD1 4.32Å; L25-L29 WeakPolarHBondContact O-CG 3.49Å; L25-L29 PolarHBondContact O-N 3.1Å; V26-L29 PolarHBondContact O-N 2.93Å; L29-H31 PolarHBondContact O-N 3.25Å; L29-A32 PolarHBondContact O-N 3.21Å; L29-E33 WeakPolarHBondContact O-CB 3.32Å; L29-E33 WeakPolarHBondContact O-CG 3.45Å; L29-E33 PolarHBondContact O-N 2.99Å; L29-L66 HydrophobicContact CB-CD1 4.48Å; L29-L66 HydrophobicContact CB-CD2 4.25Å; L29-I70 HydrophobicContact CD1-CD1 3.97Å |
| 30 | L | 70.1 | Confident | 66.9 | Low | 28 Ų | 28 | 99 Ų | 99 | 15% | 0.147 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -64.5 | -36.3 | 174.8 | -70.6 | 169.7 | 0 | 0 | 0 | 113.1 | V26 R27 R34 V58 L66 | V26-L30 HydrophobicContact CG1-CD1 4.07Å; V26-L30 WeakPolarHBondContact O-CG 3.4Å; V26-L30 PolarHBondContact O-N 2.98Å; R27-L30 PolarHBondContact O-N 3.21Å; L30-R34 WeakPolarHBondContact O-CB 3.49Å; L30-R34 WeakPolarHBondContact O-CG 3.48Å; L30-R34 PolarHBondContact O-N 3.17Å; L30-V58 HydrophobicContact CD1-CG1 4.5Å; L30-V58 HydrophobicContact CD1-CG2 3.9Å; L30-L66 HydrophobicContact CD2-CB 4.39Å; L30-L66 HydrophobicContact CD2-CD1 3.86Å; L30-L66 HydrophobicContact CD2-CD2 4.08Å; L30-L66 HydrophobicContact CD2-CG 4.33Å; L30-L66 HydrophobicContact CG-CD1 4.4Å; L30-L66 HydrophobicContact CG-CD2 3.99Å |
| 31 | H | 74 | Confident | 66.1 | Low | 103 Ų | 103 | 99.9 Ų | 99.9 | 48% | 0.477 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -69.5 | -37.9 | 172.9 | -83.2 | -66.9 | 0 | 0 | 0 | 112 | R27 H28 L29 R34 R35 | R27-H31 PolarHBondContact O-CD2 2.98Å; R27-H31 PolarHBondContact O-N 2.84Å; H28-H31 PolarHBondContact O-N 2.93Å; L29-H31 PolarHBondContact O-N 3.25Å; H31-R34 PolarHBondContact O-N 3.02Å; H31-R35 WeakPolarHBondContact O-CG 3.47Å; H31-R35 PolarHBondContact O-N 3.17Å |
| 32 | A | 72.1 | Confident | 65.7 | Low | 51 Ų | 51 | 104.7 Ų | 104.7 | 42% | 0.421 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.3 | -41.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | H28 L29 R35 A36 | H28-A32 WeakPolarHBondContact O-CB 3.49Å; H28-A32 PolarHBondContact O-N 3.07Å; L29-A32 PolarHBondContact O-N 3.21Å; A32-R35 PolarHBondContact O-N 3.46Å; A32-A36 WeakPolarHBondContact O-CB 3.29Å; A32-A36 PolarHBondContact O-N 2.93Å |
| 33 | E | 68.3 | Low | 64.7 | Low | 39 Ų | 39 | 111.6 Ų | 111.6 | 18% | 0.182 | 54% | 0.536 | C | S | . | . | H | α-helix | trans | -62.8 | -45.3 | 173.5 | -75 | -64 | 157.5 | 0 | 0 | 111.9 | L29 R35 A36 A37 L66 R73 | L29-E33 WeakPolarHBondContact O-CB 3.32Å; L29-E33 WeakPolarHBondContact O-CG 3.45Å; L29-E33 PolarHBondContact O-N 2.99Å; E33-R35 VanDerWaalsContact C-N 3.27Å; E33-R35 PolarHBondContact O-N 3.33Å; E33-A36 PolarHBondContact O-N 3.5Å; E33-A36 VanDerWaalsContact O-N 3.07Å; E33-A37 WeakPolarHBondContact O-CB 3.5Å; E33-A37 PolarHBondContact O-N 2.81Å; E33-L66 HydrophobicContact CG-CD1 4.1Å; E33-R73 IonicContact OE1-CZ 2.81Å; E33-R73 IonicContact OE1-NE 3.33Å; E33-R73 PolarHBondContact OE1-NE 3.2Å; E33-R73 IonicContact OE1-NH1 2.92Å; E33-R73 IonicContact OE1-NH2 3.6Å; E33-R73 PolarHBondContact OE1-NH2 3.4Å; E33-R73 IonicContact OE2-CZ 3.78Å; E33-R73 IonicContact OE2-NH2 3.79Å; E33-R73 PolarHBondContact OE2-NH2 3.11Å |
| 34 | R | 67.8 | Low | 63.6 | Low | 150 Ų | 150 | 117.5 Ų | 117.5 | 57% | 0.566 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -62 | -33.4 | 175.7 | -83.1 | -176.8 | -101.6 | -120.5 | -0.4 | 113 | L30 H31 A38 | L30-R34 WeakPolarHBondContact O-CB 3.49Å; L30-R34 WeakPolarHBondContact O-CG 3.48Å; L30-R34 PolarHBondContact O-N 3.17Å; H31-R34 PolarHBondContact O-N 3.02Å; R34-A38 PolarHBondContact O-N 3.33Å |
| 35 | R | 67.5 | Low | 62.8 | Low | 214 Ų | 214 | 119.9 Ų | 119.9 | 81% | 0.808 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -71.5 | -35.7 | 172.2 | -76.5 | -179.7 | 172.4 | -165.3 | -2 | 112.4 | H31 A32 E33 | H31-R35 WeakPolarHBondContact O-CG 3.47Å; H31-R35 PolarHBondContact O-N 3.17Å; A32-R35 PolarHBondContact O-N 3.46Å; E33-R35 VanDerWaalsContact C-N 3.27Å; E33-R35 PolarHBondContact O-N 3.33Å |
| 36 | A | 65.6 | Low | 61.7 | Low | 67 Ų | 67 | 119.9 Ų | 119.9 | 55% | 0.554 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -73.6 | -31.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113 | A32 E33 | A32-A36 WeakPolarHBondContact O-CB 3.29Å; A32-A36 PolarHBondContact O-N 2.93Å; E33-A36 PolarHBondContact O-N 3.5Å; E33-A36 VanDerWaalsContact O-N 3.07Å |
| 37 | A | 61.8 | Low | 60.5 | Low | 79 Ų | 79 | 125.2 Ų | 125.2 | 65% | 0.653 | 61% | 0.614 | S | S | * | * | S | Bend | trans | -88.5 | -6.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | E33 P39 | E33-A37 WeakPolarHBondContact O-CB 3.5Å; E33-A37 PolarHBondContact O-N 2.81Å; A37-P39 WeakPolarHBondContact O-CD 3.5Å |
| 38 | A | 63.2 | Low | 59.4 | Low | 56 Ų | 56 | 126.6 Ų | 126.6 | 46% | 0.463 | 64% | 0.643 | S | S | . | * | S | Bend | trans | -66.3 | 121 | 177 | 0 | 0 | 0 | 0 | 0 | 109.4 | R34 K40 | R34-A38 PolarHBondContact O-N 3.33Å; A38-K40 PolarHBondContact O-N 2.9Å |
| 39 | P | 50 | Low | 58 | Low | 105 Ų | 105 | 130.8 Ų | 130.8 | 68% | 0.682 | 65% | 0.653 | S | S | * | * | trans | -61.5 | 136.9 | 175.2 | 24.9 | -30.6 | 0 | 0 | 0 | 108.8 | A37 D41 | A37-P39 WeakPolarHBondContact O-CD 3.5Å; P39-D41 PolarHBondContact O-N 2.78Å | ||
| 40 | K | 54.6 | Low | 56.5 | Low | 199 Ų | 199 | 132.7 Ų | 132.7 | 87% | 0.865 | 67% | 0.671 | S | S | * | * | trans | -74.1 | 60 | 176.1 | -67.3 | -175.7 | 178.8 | 179.4 | 0 | 110.5 | A38 H42 | A38-K40 PolarHBondContact O-N 2.9Å; K40-H42 PolarHBondContact O-N 2.93Å | ||
| 41 | D | 44.9 | Very low | 55.4 | Low | 140 Ų | 140 | 135.3 Ų | 135.3 | 75% | 0.749 | 71% | 0.705 | S | S | * | * | trans | -87.7 | 96.5 | 169.7 | -91.5 | -33 | 0 | 0 | 0 | 109.7 | P39 R43 | P39-D41 PolarHBondContact O-N 2.78Å; D41-R43 PolarHBondContact O-N 2.98Å | ||
| 42 | H | 54.7 | Low | 53.8 | Low | 177 Ų | 177 | 140.7 Ų | 140.7 | 82% | 0.819 | 72% | 0.721 | S | S | * | * | trans | -72.3 | 81.3 | 165.4 | -70 | -3.7 | 0 | 0 | 0 | 109.7 | K40 | K40-H42 PolarHBondContact O-N 2.93Š| ||
| 43 | R | 48.8 | Very low | 52.9 | Low | 234 Ų | 234 | 147.1 Ų | 147.1 | 88% | 0.883 | 74% | 0.74 | S | S | * | * | trans | 155.8 | 99.6 | 145.9 | -89.7 | 177 | -177.2 | -119.4 | 3 | 109.9 | D41 | D41-R43 PolarHBondContact O-N 2.98Š| ||
| 44 | R | 42.4 | Very low | 52 | Low | 247 Ų | 247 | 150 Ų | 150 | 93% | 0.932 | 76% | 0.76 | S | S | * | * | trans | -172.8 | 112.3 | 131.9 | -98.9 | 161.4 | -159.6 | -81.4 | 3 | 108.2 | A46 | R44-A46 PolarHBondContact O-N 3.17Å; R44-A46 VanDerWaalsContact O-N 3.1Å | ||
| 45 | R | 50.8 | Low | 51.2 | Low | 257 Ų | 257 | 152.5 Ų | 152.5 | 97% | 0.97 | 77% | 0.769 | S | S | * | * | trans | -65.9 | 101.4 | 174.2 | -175.7 | 177.3 | -178.9 | -152.4 | 1.5 | 108.1 | ||||
| 46 | A | 48.5 | Very low | 51 | Low | 85 Ų | 85 | 145.2 Ų | 145.2 | 70% | 0.702 | 75% | 0.748 | S | S | * | * | trans | -87.1 | 143.2 | 168.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | R44 | R44-A46 PolarHBondContact O-N 3.17Å; R44-A46 VanDerWaalsContact O-N 3.1Å | ||
| 47 | P | 46.1 | Very low | 50.9 | Low | 115 Ų | 115 | 147.8 Ų | 147.8 | 75% | 0.747 | 75% | 0.749 | S | S | * | * | trans | -75.4 | 138.2 | -170.8 | 30.6 | -32.8 | 0 | 0 | 0 | 111.1 | R49 | P47-R49 PolarHBondContact O-N 3.3Š| ||
| 48 | A | 49.3 | Very low | 51.5 | Low | 108 Ų | 108 | 145 Ų | 145 | 89% | 0.893 | 72% | 0.724 | S | S | * | * | trans | -58.3 | 107.9 | 170 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 49 | R | 44.8 | Very low | 52.6 | Low | 231 Ų | 231 | 145.8 Ų | 145.8 | 87% | 0.872 | 72% | 0.723 | S | S | * | * | trans | -108.7 | 111.7 | 163.6 | -77 | -178.2 | 84.5 | 176.8 | 5.3 | 109.4 | P47 | P47-R49 PolarHBondContact O-N 3.3Š| ||
| 50 | S | 40.3 | Very low | 54.4 | Low | 101 Ų | 101 | 146.4 Ų | 146.4 | 71% | 0.706 | 72% | 0.717 | S | S | * | * | trans | 45.9 | 104.6 | 133 | 178.9 | 0 | 0 | 0 | 0 | 116.3 | R52 | S50-R52 PolarHBondContact O-N 3.39Š| ||
| 51 | G | 46.8 | Very low | 56.1 | Low | 84 Ų | 84 | 142 Ų | 142 | 87% | 0.866 | 70% | 0.699 | S | S | * | * | trans | -61.9 | 95.6 | 167.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 52 | R | 41.5 | Very low | 58.2 | Low | 215 Ų | 215 | 138.9 Ų | 138.9 | 81% | 0.811 | 68% | 0.68 | S | S | * | * | trans | -85.2 | 113.1 | 143 | -78 | -179.7 | -147.9 | -172.9 | 4.8 | 106.6 | S50 V54 | S50-R52 PolarHBondContact O-N 3.39Å; R52-V54 HydrophobicContact CB-CG2 4.13Å; R52-V54 PolarHBondContact O-N 2.86Å | ||
| 53 | K | 52.8 | Low | 59.7 | Low | 187 Ų | 187 | 131.1 Ų | 131.1 | 81% | 0.813 | 65% | 0.645 | S | S | * | * | trans | -66.5 | 74 | 162.9 | -169.5 | 177.5 | -174.9 | -178 | 0 | 107.1 | R55 | K53-R55 VanDerWaalsContact C-N 3.34Å; K53-R55 PolarHBondContact O-N 3.5Å | ||
| 54 | V | 49.7 | Very low | 61.7 | Low | 100 Ų | 100 | 126.3 Ų | 126.3 | 61% | 0.606 | 63% | 0.627 | S | S | * | * | trans | -59.9 | 106.5 | 166.9 | 178.5 | 0 | 0 | 0 | 0 | 104.1 | R52 V56 | R52-V54 HydrophobicContact CB-CG2 4.13Å; R52-V54 PolarHBondContact O-N 2.86Å; V54-V56 HydrophobicContact CB-CG2 4.33Å; V54-V56 HydrophobicContact CG1-CG2 3.81Å; V54-V56 PolarHBondContact O-N 3.27Å | ||
| 55 | R | 51.7 | Low | 64.1 | Low | 202 Ų | 202 | 118.4 Ų | 118.4 | 76% | 0.762 | 60% | 0.601 | S | S | * | * | trans | -63.9 | 86 | 163 | -80.2 | -179.9 | 150.1 | 167.7 | -6.1 | 104.8 | K53 E57 | K53-R55 VanDerWaalsContact C-N 3.34Å; K53-R55 PolarHBondContact O-N 3.5Å; R55-E57 VanDerWaalsContact C-N 3.26Å; R55-E57 PolarHBondContact O-N 3.45Å | ||
| 56 | V | 62.3 | Low | 66.1 | Low | 61 Ų | 61 | 106.4 Ų | 106.4 | 37% | 0.37 | 56% | 0.556 | S | S | . | * | trans | -65.1 | 100.1 | 167.3 | -178 | 0 | 0 | 0 | 0 | 104.4 | R27 V54 V58 | R27-V56 PolarHBondContact NH2-O 2.96Å; V54-V56 HydrophobicContact CB-CG2 4.33Å; V54-V56 HydrophobicContact CG1-CG2 3.81Å; V54-V56 PolarHBondContact O-N 3.27Å; V56-V58 PolarHBondContact O-N 3.18Å; V56-V58 VanDerWaalsContact O-N 3.17Å | ||
| 57 | E | 64.8 | Low | 68.3 | Low | 120 Ų | 120 | 108.3 Ų | 108.3 | 56% | 0.561 | 55% | 0.545 | S | S | * | . | trans | -58.2 | 102.6 | 158.7 | -67.9 | -88 | 127.6 | 0 | 0 | 104.9 | R23 R55 T59 | R23-E57 IonicContact CZ-OE1 3.81Å; R23-E57 IonicContact CZ-OE2 2.71Å; R23-E57 IonicContact NH1-OE1 3.74Å; R23-E57 PolarHBondContact NH1-OE1 3.45Å; R23-E57 IonicContact NH1-OE2 3.83Å; R23-E57 IonicContact NH2-OE1 2.87Å; R23-E57 PolarHBondContact NH2-OE1 3.43Å; R23-E57 IonicContact NH2-OE2 3.46Å; R23-E57 PolarHBondContact NH2-OE2 2.95Å; R55-E57 VanDerWaalsContact C-N 3.26Å; R55-E57 PolarHBondContact O-N 3.45Å; E57-T59 PolarHBondContact O-N 3.37Å | ||
| 58 | V | 72.8 | Confident | 70.6 | Confident | 21 Ų | 21 | 106.6 Ų | 106.6 | 13% | 0.127 | 53% | 0.529 | C | S | . | . | trans | -66.1 | 116.8 | 174.7 | 177.2 | 0 | 0 | 0 | 0 | 106 | V26 L30 V56 E62 M63 | V26-V58 HydrophobicContact CG1-CG1 4.15Å; V26-V58 HydrophobicContact CG1-CG2 4.12Å; L30-V58 HydrophobicContact CD1-CG1 4.5Å; L30-V58 HydrophobicContact CD1-CG2 3.9Å; V56-V58 PolarHBondContact O-N 3.18Å; V56-V58 VanDerWaalsContact O-N 3.17Å; V58-E62 WeakPolarHBondContact CA-OE2 3.38Å; V58-E62 HydrophobicContact CG1-CB 3.85Å; V58-M63 HydrophobicContact CG1-CB 4.39Å; V58-M63 HydrophobicContact CG1-CG 4.09Å | ||
| 59 | T | 87.3 | Confident | 72.8 | Confident | 73 Ų | 73 | 107.2 Ų | 107.2 | 45% | 0.448 | 51% | 0.512 | S | S | . | . | trans | -71.1 | 155.6 | 177.4 | 64.3 | 0 | 0 | 0 | 0 | 109.7 | E57 E61 E62 M63 | E57-T59 PolarHBondContact O-N 3.37Å; T59-E61 PolarHBondContact O-N 2.71Å; T59-E62 WeakPolarHBondContact O-CB 3.41Å; T59-E62 PolarHBondContact O-N 3.23Å; T59-E62 VanDerWaalsContact O-N 3.1Å; T59-E62 VanDerWaalsContact OG1-CG 3.32Å; T59-E62 WeakPolarHBondContact OG1-CG 3.46Å; T59-E62 PolarHBondContact OG1-N 2.87Å; T59-M63 PolarHBondContact O-N 2.89Å | ||
| 60 | E | 88 | Confident | 75.2 | Confident | 117 Ų | 117 | 99.1 Ų | 99.1 | 55% | 0.547 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -55.5 | -35.7 | 176.6 | -72.9 | -56.8 | 124.9 | 0 | 0 | 112.1 | F20 M63 Y64 | F20-E60 WeakPolarHBondContact CE1-OE1 3.2Å; F20-E60 VanDerWaalsContact CZ-OE1 3.32Å; F20-E60 WeakPolarHBondContact CZ-OE1 3.32Å; E60-M63 WeakPolarHBondContact O-CB 3.49Å; E60-M63 PolarHBondContact O-N 2.83Å; E60-Y64 PolarHBondContact O-N 3.31Å |
| 61 | E | 90.1 | Very high | 78 | Confident | 107 Ų | 107 | 98.3 Ų | 98.3 | 50% | 0.5 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.5 | -44.9 | 175.9 | -176.6 | 54.1 | -144.9 | 0 | 0 | 112.4 | T59 M63 Y64 Q65 | T59-E61 PolarHBondContact O-N 2.71Å; E61-M63 PolarHBondContact O-N 3.46Å; E61-Y64 PolarHBondContact O-N 2.92Å; E61-Q65 VanDerWaalsContact O-CG 3.3Å; E61-Q65 WeakPolarHBondContact O-CG 3.42Å; E61-Q65 PolarHBondContact O-N 3.46Å; E61-Q65 PolarHBondContact OE1-NE2 2.98Å |
| 62 | E | 88 | Confident | 80.4 | Confident | 75 Ų | 75 | 95.6 Ų | 95.6 | 35% | 0.35 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.5 | -34.6 | 173.3 | -75.2 | 178.6 | 176.3 | 0 | 0 | 111.7 | V58 T59 L66 | V58-E62 WeakPolarHBondContact CA-OE2 3.38Å; V58-E62 HydrophobicContact CG1-CB 3.85Å; T59-E62 WeakPolarHBondContact O-CB 3.41Å; T59-E62 PolarHBondContact O-N 3.23Å; T59-E62 VanDerWaalsContact O-N 3.1Å; T59-E62 VanDerWaalsContact OG1-CG 3.32Å; T59-E62 WeakPolarHBondContact OG1-CG 3.46Å; T59-E62 PolarHBondContact OG1-N 2.87Å; E62-L66 WeakPolarHBondContact O-CB 3.47Å; E62-L66 PolarHBondContact O-N 3.22Å |
| 63 | M | 87.8 | Confident | 83.1 | Confident | 14 Ų | 14 | 91.4 Ų | 91.4 | 7% | 0.069 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -65.2 | -49.2 | 175.8 | -121.7 | -59.4 | 161.7 | 0 | 0 | 111.7 | V26 V58 T59 E60 E61 Q65 L66 R67 | V26-M63 HydrophobicContact CB-CE 3.78Å; V26-M63 HydrophobicContact CG1-CE 3.33Å; V26-M63 HydrophobicContact CG2-CE 3.06Å; V58-M63 HydrophobicContact CG1-CB 4.39Å; V58-M63 HydrophobicContact CG1-CG 4.09Å; T59-M63 PolarHBondContact O-N 2.89Å; E60-M63 WeakPolarHBondContact O-CB 3.49Å; E60-M63 PolarHBondContact O-N 2.83Å; E61-M63 PolarHBondContact O-N 3.46Å; M63-Q65 PolarHBondContact O-N 3.22Å; M63-L66 WeakPolarHBondContact O-CB 3.38Å; M63-L66 PolarHBondContact O-N 3.43Å; M63-R67 WeakPolarHBondContact O-CG 3.35Å; M63-R67 PolarHBondContact O-N 2.87Å; M63-R67 HydrophobicContact SD-CG 4.5Å |
| 64 | Y | 90.1 | Very high | 85.3 | Confident | 132 Ų | 132 | 86.8 Ų | 86.8 | 52% | 0.518 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -59 | -47.1 | 176.5 | 177 | -107.1 | 0 | 0 | 0 | 111.5 | E60 E61 L66 R67 L68 | E60-Y64 PolarHBondContact O-N 3.31Å; E61-Y64 PolarHBondContact O-N 2.92Å; Y64-L66 VanDerWaalsContact C-N 3.31Å; Y64-L66 PolarHBondContact O-N 3.46Å; Y64-R67 WeakPolarHBondContact O-CB 3.43Å; Y64-R67 PolarHBondContact O-N 2.87Å; Y64-L68 HydrophobicContact CD1-CD1 3.93Å; Y64-L68 HydrophobicContact CD1-CG 4.48Å; Y64-L68 HydrophobicContact CE1-CD1 3.32Å; Y64-L68 HydrophobicContact CE1-CG 4.07Å; Y64-L68 HydrophobicContact CE2-CD1 4.43Å; Y64-L68 HydrophobicContact CE2-CG 4.36Å; Y64-L68 PolarHBondContact O-N 2.95Å |
| 65 | Q | 92.3 | Very high | 87.6 | Confident | 81 Ų | 81 | 89.5 Ų | 89.5 | 38% | 0.379 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -61.8 | -37.6 | 176.7 | -69.4 | 176.4 | 20.4 | 0 | 0 | 112.6 | E61 M63 L68 K69 | E61-Q65 VanDerWaalsContact O-CG 3.3Å; E61-Q65 WeakPolarHBondContact O-CG 3.42Å; E61-Q65 PolarHBondContact O-N 3.46Å; E61-Q65 PolarHBondContact OE1-NE2 2.98Å; M63-Q65 PolarHBondContact O-N 3.22Å; Q65-L68 PolarHBondContact O-N 3.14Å; Q65-K69 WeakPolarHBondContact O-CB 3.42Å; Q65-K69 VanDerWaalsContact O-CG 3.31Å; Q65-K69 WeakPolarHBondContact O-CG 3.4Å; Q65-K69 PolarHBondContact O-N 3.41Å |
| 66 | L | 92.3 | Very high | 89.8 | Confident | 6 Ų | 6 | 86.7 Ų | 86.7 | 3% | 0.031 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -64.7 | -44.2 | 174.9 | -177.6 | 62.9 | 0 | 0 | 0 | 111.4 | V26 L29 L30 E33 E62 M63 Y64 L68 K69 I70 | V26-L66 HydrophobicContact CG1-CD2 3.75Å; L29-L66 HydrophobicContact CB-CD1 4.48Å; L29-L66 HydrophobicContact CB-CD2 4.25Å; L30-L66 HydrophobicContact CD2-CB 4.39Å; L30-L66 HydrophobicContact CD2-CD1 3.86Å; L30-L66 HydrophobicContact CD2-CD2 4.08Å; L30-L66 HydrophobicContact CD2-CG 4.33Å; L30-L66 HydrophobicContact CG-CD1 4.4Å; L30-L66 HydrophobicContact CG-CD2 3.99Å; E33-L66 HydrophobicContact CG-CD1 4.1Å; E62-L66 WeakPolarHBondContact O-CB 3.47Å; E62-L66 PolarHBondContact O-N 3.22Å; M63-L66 WeakPolarHBondContact O-CB 3.38Å; M63-L66 PolarHBondContact O-N 3.43Å; Y64-L66 VanDerWaalsContact C-N 3.31Å; Y64-L66 PolarHBondContact O-N 3.46Å; L66-L68 VanDerWaalsContact C-N 3.33Å; L66-L68 PolarHBondContact O-N 3.34Å; L66-K69 PolarHBondContact O-N 3.22Å; L66-I70 HydrophobicContact CD1-CD1 4.04Å; L66-I70 HydrophobicContact CD1-CG1 4.27Å; L66-I70 HydrophobicContact CD2-CD1 4.46Å; L66-I70 HydrophobicContact CG-CD1 3.82Å; L66-I70 HydrophobicContact CG-CG1 4.45Å; L66-I70 WeakPolarHBondContact O-CB 3.43Å; L66-I70 VanDerWaalsContact O-CG1 3.29Å; L66-I70 WeakPolarHBondContact O-CG1 3.46Å; L66-I70 PolarHBondContact O-N 3.1Å |
| 67 | R | 94.8 | Very high | 91.5 | Very high | 125 Ų | 125 | 91.5 Ų | 91.5 | 47% | 0.472 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -58.8 | -45.2 | 175.2 | -67.4 | 178.8 | -164.7 | -160.3 | 6.7 | 111 | M63 Y64 K69 I70 N71 | M63-R67 WeakPolarHBondContact O-CG 3.35Å; M63-R67 PolarHBondContact O-N 2.87Å; M63-R67 HydrophobicContact SD-CG 4.5Å; Y64-R67 WeakPolarHBondContact O-CB 3.43Å; Y64-R67 PolarHBondContact O-N 2.87Å; R67-K69 PolarHBondContact O-N 3.43Å; R67-I70 PolarHBondContact O-N 3.28Å; R67-N71 VanDerWaalsContact O-CB 3.32Å; R67-N71 WeakPolarHBondContact O-CB 3.48Å; R67-N71 PolarHBondContact O-N 3.45Å; R67-N71 PolarHBondContact O-ND2 2.94Å |
| 68 | L | 96.1 | Very high | 93.2 | Very high | 79 Ų | 79 | 89.9 Ų | 89.9 | 41% | 0.414 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -61.1 | -44.1 | 176.6 | -73.1 | -179.7 | 0 | 0 | 0 | 112.6 | Y64 Q65 L66 N71 G72 | Y64-L68 HydrophobicContact CD1-CD1 3.93Å; Y64-L68 HydrophobicContact CD1-CG 4.48Å; Y64-L68 HydrophobicContact CE1-CD1 3.32Å; Y64-L68 HydrophobicContact CE1-CG 4.07Å; Y64-L68 HydrophobicContact CE2-CD1 4.43Å; Y64-L68 HydrophobicContact CE2-CG 4.36Å; Y64-L68 PolarHBondContact O-N 2.95Å; Q65-L68 PolarHBondContact O-N 3.14Å; L66-L68 VanDerWaalsContact C-N 3.33Å; L66-L68 PolarHBondContact O-N 3.34Å; L68-N71 PolarHBondContact O-N 3.16Å; L68-G72 PolarHBondContact O-N 2.9Å |
| 69 | K | 94.8 | Very high | 94.4 | Very high | 120 Ų | 120 | 94.1 Ų | 94.1 | 52% | 0.522 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -62.7 | -46.1 | 177.2 | -75.8 | 171.4 | -177.7 | 168.5 | 0 | 112 | Q65 L66 R67 G72 R73 | Q65-K69 WeakPolarHBondContact O-CB 3.42Å; Q65-K69 VanDerWaalsContact O-CG 3.31Å; Q65-K69 WeakPolarHBondContact O-CG 3.4Å; Q65-K69 PolarHBondContact O-N 3.41Å; L66-K69 PolarHBondContact O-N 3.22Å; R67-K69 PolarHBondContact O-N 3.43Å; K69-G72 PolarHBondContact O-N 3.36Å; K69-R73 PolarHBondContact O-N 3.26Å |
| 70 | I | 95.7 | Very high | 94.9 | Very high | 61 Ų | 61 | 94.6 Ų | 94.6 | 31% | 0.313 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -61.4 | -47.9 | 177.1 | -69.1 | 168.8 | 0 | 0 | 0 | 110.3 | L29 L66 R67 G72 R73 E74 | L29-I70 HydrophobicContact CD1-CD1 3.97Å; L66-I70 HydrophobicContact CD1-CD1 4.04Å; L66-I70 HydrophobicContact CD1-CG1 4.27Å; L66-I70 HydrophobicContact CD2-CD1 4.46Å; L66-I70 HydrophobicContact CG-CD1 3.82Å; L66-I70 HydrophobicContact CG-CG1 4.45Å; L66-I70 WeakPolarHBondContact O-CB 3.43Å; L66-I70 VanDerWaalsContact O-CG1 3.29Å; L66-I70 WeakPolarHBondContact O-CG1 3.46Å; L66-I70 PolarHBondContact O-N 3.1Å; R67-I70 PolarHBondContact O-N 3.28Å; I70-G72 VanDerWaalsContact C-N 3.31Å; I70-G72 PolarHBondContact O-N 2.93Å; I70-R73 WeakPolarHBondContact O-CB 3.47Å; I70-R73 PolarHBondContact O-N 3.31Å; I70-E74 PolarHBondContact O-N 3.43Å |
| 71 | N | 97.6 | Very high | 95.4 | Very high | 84 Ų | 84 | 93.4 Ų | 93.4 | 45% | 0.449 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -62.8 | -38.2 | 178.3 | -71.7 | -15.2 | 0 | 0 | 0 | 112 | R67 L68 E74 R75 | R67-N71 VanDerWaalsContact O-CB 3.32Å; R67-N71 WeakPolarHBondContact O-CB 3.48Å; R67-N71 PolarHBondContact O-N 3.45Å; R67-N71 PolarHBondContact O-ND2 2.94Å; L68-N71 PolarHBondContact O-N 3.16Å; N71-E74 PolarHBondContact O-N 3.01Å; N71-R75 WeakPolarHBondContact O-CG 3.43Å; N71-R75 PolarHBondContact O-N 2.95Å |
| 72 | G | 98.3 | Very high | 95.8 | Very high | 27 Ų | 27 | 90.5 Ų | 90.5 | 28% | 0.278 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -61.3 | -44.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | L68 K69 I70 R75 K76 | L68-G72 PolarHBondContact O-N 2.9Å; K69-G72 PolarHBondContact O-N 3.36Å; I70-G72 VanDerWaalsContact C-N 3.31Å; I70-G72 PolarHBondContact O-N 2.93Å; G72-R75 PolarHBondContact O-N 3.37Å; G72-K76 PolarHBondContact O-N 3.26Å; G72-K76 VanDerWaalsContact O-N 3.11Å |
| 73 | R | 98.1 | Very high | 96.3 | Very high | 128 Ų | 128 | 91.4 Ų | 91.4 | 48% | 0.483 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -63.6 | -44.2 | 176.6 | -173.4 | -174 | -65.8 | -154.9 | -7.4 | 112.2 | E33 K69 I70 K76 R77 | E33-R73 IonicContact OE1-CZ 2.81Å; E33-R73 IonicContact OE1-NE 3.33Å; E33-R73 PolarHBondContact OE1-NE 3.2Å; E33-R73 IonicContact OE1-NH1 2.92Å; E33-R73 IonicContact OE1-NH2 3.6Å; E33-R73 PolarHBondContact OE1-NH2 3.4Å; E33-R73 IonicContact OE2-CZ 3.78Å; E33-R73 IonicContact OE2-NH2 3.79Å; E33-R73 PolarHBondContact OE2-NH2 3.11Å; K69-R73 PolarHBondContact O-N 3.26Å; I70-R73 WeakPolarHBondContact O-CB 3.47Å; I70-R73 PolarHBondContact O-N 3.31Å; R73-K76 WeakPolarHBondContact O-CB 3.34Å; R73-K76 PolarHBondContact O-N 2.98Å; R73-R77 PolarHBondContact O-N 3.1Å |
| 74 | E | 98.1 | Very high | 96.8 | Very high | 90 Ų | 90 | 93.9 Ų | 93.9 | 42% | 0.421 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -66.5 | -38.1 | 179.1 | -173.4 | 57.8 | -157.2 | 0 | 0 | 111.8 | I70 N71 K76 R77 M78 | I70-E74 PolarHBondContact O-N 3.43Å; N71-E74 PolarHBondContact O-N 3.01Å; E74-K76 VanDerWaalsContact C-N 3.3Å; E74-K76 PolarHBondContact O-N 3Å; E74-R77 PolarHBondContact O-N 2.88Å; E74-R77 IonicContact OE1-NH1 3.47Å; E74-R77 PolarHBondContact OE1-NH1 3.46Å; E74-R77 WeakPolarHBondContact OE2-CD 3.32Å; E74-R77 IonicContact OE2-NH1 2.67Å; E74-M78 WeakPolarHBondContact O-CB 3.4Å; E74-M78 PolarHBondContact O-N 3.14Å |
| 75 | R | 98.7 | Very high | 97.2 | Very high | 156 Ų | 156 | 88.6 Ų | 88.6 | 59% | 0.589 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -57.8 | -44.2 | 171.7 | -77 | -169 | -64 | -91.2 | 4.7 | 111.7 | N71 G72 M78 H79 | N71-R75 WeakPolarHBondContact O-CG 3.43Å; N71-R75 PolarHBondContact O-N 2.95Å; G72-R75 PolarHBondContact O-N 3.37Å; R75-M78 PolarHBondContact O-N 2.91Å; R75-H79 WeakPolarHBondContact O-CB 3.43Å; R75-H79 PolarHBondContact O-N 3.42Å |
| 76 | K | 98.5 | Very high | 97.5 | Very high | 143 Ų | 143 | 87 Ų | 87 | 62% | 0.622 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -61.8 | -48.5 | 175.8 | -175.4 | 172.4 | -178.9 | 171.8 | 0 | 111.6 | G72 R73 E74 M78 H79 D80 | G72-K76 PolarHBondContact O-N 3.26Å; G72-K76 VanDerWaalsContact O-N 3.11Å; R73-K76 WeakPolarHBondContact O-CB 3.34Å; R73-K76 PolarHBondContact O-N 2.98Å; E74-K76 VanDerWaalsContact C-N 3.3Å; E74-K76 PolarHBondContact O-N 3Å; K76-M78 VanDerWaalsContact C-N 3.28Å; K76-M78 PolarHBondContact O-N 3.3Å; K76-H79 WeakPolarHBondContact O-CB 3.49Å; K76-H79 PolarHBondContact O-N 2.98Å; K76-H79 VanDerWaalsContact O-N 3.14Å; K76-D80 PolarHBondContact O-N 2.74Å |
| 77 | R | 98.6 | Very high | 97.7 | Very high | 163 Ų | 163 | 88.1 Ų | 88.1 | 62% | 0.615 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -55.6 | -43.4 | 175.9 | -178.9 | -172.6 | 174.5 | -115.4 | -0.6 | 112.2 | R73 E74 D80 L81 | R73-R77 PolarHBondContact O-N 3.1Å; E74-R77 PolarHBondContact O-N 2.88Å; E74-R77 IonicContact OE1-NH1 3.47Å; E74-R77 PolarHBondContact OE1-NH1 3.46Å; E74-R77 WeakPolarHBondContact OE2-CD 3.32Å; E74-R77 IonicContact OE2-NH1 2.67Å; R77-D80 PolarHBondContact O-N 2.77Å; R77-L81 PolarHBondContact O-N 3.09Å |
| 78 | M | 98.7 | Very high | 97.9 | Very high | 85 Ų | 85 | 84.5 Ų | 84.5 | 42% | 0.419 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -69.9 | -35.4 | 180 | -161.4 | -77 | -57 | 0 | 0 | 111.6 | E74 R75 K76 N82 | E74-M78 WeakPolarHBondContact O-CB 3.4Å; E74-M78 PolarHBondContact O-N 3.14Å; R75-M78 PolarHBondContact O-N 2.91Å; K76-M78 VanDerWaalsContact C-N 3.28Å; K76-M78 PolarHBondContact O-N 3.3Å; M78-N82 VanDerWaalsContact O-CG 3.26Å; M78-N82 PolarHBondContact O-N 3Å; M78-N82 PolarHBondContact O-ND2 2.9Å; M78-N82 PolarHBondContact SD-ND2 3.04Å |
| 79 | H | 98.7 | Very high | 97.9 | Very high | 110 Ų | 110 | 82.6 Ų | 82.6 | 51% | 0.509 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -62.3 | -49.3 | 171.3 | -173.6 | 70.4 | 0 | 0 | 0 | 111.4 | R75 K76 L81 N82 L83 | R75-H79 WeakPolarHBondContact O-CB 3.43Å; R75-H79 PolarHBondContact O-N 3.42Å; K76-H79 WeakPolarHBondContact O-CB 3.49Å; K76-H79 PolarHBondContact O-N 2.98Å; K76-H79 VanDerWaalsContact O-N 3.14Å; H79-L81 VanDerWaalsContact C-N 3.3Å; H79-L81 PolarHBondContact O-N 3.38Å; H79-N82 WeakPolarHBondContact O-CB 3.34Å; H79-N82 PolarHBondContact O-N 3.12Å; H79-L83 WeakPolarHBondContact O-CG 3.32Å; H79-L83 PolarHBondContact O-N 3.1Å |
| 80 | D | 98.5 | Very high | 98 | Very high | 83 Ų | 83 | 83.9 Ų | 83.9 | 44% | 0.444 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -59.7 | -41.1 | 178.1 | -63.6 | -12.4 | 0 | 0 | 0 | 111.6 | K76 R77 N82 L83 A84 | K76-D80 PolarHBondContact O-N 2.74Å; R77-D80 PolarHBondContact O-N 2.77Å; D80-N82 PolarHBondContact O-N 2.87Å; D80-L83 PolarHBondContact O-N 3.37Å; D80-A84 PolarHBondContact O-N 3.44Å |
| 81 | L | 98.5 | Very high | 98 | Very high | 93 Ų | 93 | 85.4 Ų | 85.4 | 49% | 0.487 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -61.3 | -42.8 | 173.4 | 174.6 | 62.8 | 0 | 0 | 0 | 112.1 | R77 H79 L83 A84 M85 | R77-L81 PolarHBondContact O-N 3.09Å; H79-L81 VanDerWaalsContact C-N 3.3Å; H79-L81 PolarHBondContact O-N 3.38Å; L81-L83 VanDerWaalsContact C-N 3.34Å; L81-A84 PolarHBondContact O-N 3.31Å; L81-M85 WeakPolarHBondContact O-CG 3.23Å; L81-M85 PolarHBondContact O-N 2.88Å |
| 82 | N | 98.4 | Very high | 98 | Very high | 46 Ų | 46 | 81.8 Ų | 81.8 | 25% | 0.246 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -67.8 | -35.6 | 178.1 | -72.1 | -19.1 | 0 | 0 | 0 | 111.8 | M78 H79 D80 M85 D86 K105 | M78-N82 VanDerWaalsContact O-CG 3.26Å; M78-N82 PolarHBondContact O-N 3Å; M78-N82 PolarHBondContact O-ND2 2.9Å; M78-N82 PolarHBondContact SD-ND2 3.04Å; H79-N82 WeakPolarHBondContact O-CB 3.34Å; H79-N82 PolarHBondContact O-N 3.12Å; D80-N82 PolarHBondContact O-N 2.87Å; N82-M85 PolarHBondContact O-N 3.42Å; N82-D86 PolarHBondContact O-N 3.3Å; N82-K105 WeakPolarHBondContact OD1-CE 3.37Å; N82-K105 PolarHBondContact OD1-NZ 3.46Å |
| 83 | L | 98.4 | Very high | 97.7 | Very high | 93 Ų | 93 | 84 Ų | 84 | 49% | 0.487 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -61.3 | -45.8 | 172.8 | -68.6 | 177 | 0 | 0 | 0 | 110.9 | H79 D80 L81 M85 D86 G87 | H79-L83 WeakPolarHBondContact O-CG 3.32Å; H79-L83 PolarHBondContact O-N 3.1Å; D80-L83 PolarHBondContact O-N 3.37Å; L81-L83 VanDerWaalsContact C-N 3.34Å; L83-M85 VanDerWaalsContact C-N 3.33Å; L83-M85 PolarHBondContact O-N 3.01Å; L83-D86 PolarHBondContact O-N 3.48Å; L83-G87 PolarHBondContact O-N 3.36Å |
| 84 | A | 98.6 | Very high | 97.5 | Very high | 66 Ų | 66 | 83.6 Ų | 83.6 | 55% | 0.545 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.3 | -39.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | D80 L81 D86 G87 L88 | D80-A84 PolarHBondContact O-N 3.44Å; L81-A84 PolarHBondContact O-N 3.31Å; A84-D86 VanDerWaalsContact C-N 3.33Å; A84-D86 PolarHBondContact O-N 3.03Å; A84-G87 PolarHBondContact O-N 3.14Å; A84-L88 PolarHBondContact O-N 3.17Å |
| 85 | M | 98.5 | Very high | 96.9 | Very high | 21 Ų | 21 | 82 Ų | 82 | 10% | 0.103 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -66 | -33 | 174.8 | -78.6 | -62.3 | -56.2 | 0 | 0 | 113 | L81 N82 L83 R89 K105 T108 L109 | L81-M85 WeakPolarHBondContact O-CG 3.23Å; L81-M85 PolarHBondContact O-N 2.88Å; N82-M85 PolarHBondContact O-N 3.42Å; L83-M85 VanDerWaalsContact C-N 3.33Å; L83-M85 PolarHBondContact O-N 3.01Å; M85-R89 WeakPolarHBondContact O-CG 3.46Å; M85-R89 PolarHBondContact O-N 3.01Å; M85-R89 PolarHBondContact O-NH1 3.36Å; M85-K105 HydrophobicContact CE-CB 4.25Å; M85-K105 HydrophobicContact CE-CG 4.36Å; M85-T108 HydrophobicContact CE-CG2 4.02Å; M85-L109 HydrophobicContact CE-CD2 4.22Å; M85-L109 HydrophobicContact CE-CG 4.21Å; M85-L109 HydrophobicContact SD-CD2 4.08Å |
| 86 | D | 96.9 | Very high | 96.5 | Very high | 49 Ų | 49 | 80.3 Ų | 80.3 | 26% | 0.262 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -73.1 | -42.4 | 174.5 | -83.4 | -0.1 | 0 | 0 | 0 | 110.7 | N82 L83 A84 L88 R89 E90 K102 | N82-D86 PolarHBondContact O-N 3.3Å; L83-D86 PolarHBondContact O-N 3.48Å; A84-D86 VanDerWaalsContact C-N 3.33Å; A84-D86 PolarHBondContact O-N 3.03Å; D86-L88 VanDerWaalsContact C-N 3.26Å; D86-L88 PolarHBondContact O-N 2.98Å; D86-R89 WeakPolarHBondContact O-CA 3.38Å; D86-R89 WeakPolarHBondContact O-CB 3.17Å; D86-R89 PolarHBondContact O-N 2.87Å; D86-R89 IonicContact OD1-CZ 2.88Å; D86-R89 IonicContact OD1-NH1 3.09Å; D86-R89 PolarHBondContact OD1-NH1 3.47Å; D86-E90 PolarHBondContact O-N 3.14Å; D86-K102 IonicContact OD1-NZ 2.9Å; D86-K102 IonicContact OD2-NZ 3.96Å; D86-K102 PolarHBondContact OD2-NZ 3.33Å |
| 87 | G | 97.3 | Very high | 95.9 | Very high | 29 Ų | 29 | 75.3 Ų | 75.3 | 30% | 0.299 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -58.9 | -35.9 | 171.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | L83 A84 R89 E90 | L83-G87 PolarHBondContact O-N 3.36Å; A84-G87 PolarHBondContact O-N 3.14Å; G87-R89 VanDerWaalsContact C-N 3.31Å; G87-R89 PolarHBondContact O-N 2.92Å; G87-E90 PolarHBondContact O-N 2.07Å |
| 88 | L | 98.3 | Very high | 95.3 | Very high | 49 Ų | 49 | 74.8 Ų | 74.8 | 26% | 0.257 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.8 | -36.8 | 171.7 | -178.9 | 62.2 | 0 | 0 | 0 | 112.2 | A84 D86 E90 V91 M92 T108 L109 A112 | A84-L88 PolarHBondContact O-N 3.17Å; D86-L88 VanDerWaalsContact C-N 3.26Å; D86-L88 PolarHBondContact O-N 2.98Å; L88-E90 VanDerWaalsContact C-N 3.3Å; L88-E90 PolarHBondContact O-N 3.43Å; L88-V91 HydrophobicContact CD1-CG2 4.19Å; L88-V91 WeakPolarHBondContact O-CG2 3.18Å; L88-V91 PolarHBondContact O-N 3.15Å; L88-M92 HydrophobicContact CD1-CE 3.64Å; L88-M92 HydrophobicContact CG-CE 4.24Å; L88-M92 WeakPolarHBondContact O-CG 3.47Å; L88-T108 HydrophobicContact CB-CG2 4.5Å; L88-T108 HydrophobicContact CD2-CG2 3.88Å; L88-T108 HydrophobicContact CG-CG2 3.99Å; L88-L109 HydrophobicContact CD2-CD2 4.14Å; L88-A112 HydrophobicContact CD1-CB 4.19Å; L88-A112 HydrophobicContact CD2-CB 4.17Å |
| 89 | R | 97.4 | Very high | 94.9 | Very high | 39 Ų | 39 | 76.4 Ų | 76.4 | 15% | 0.147 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -67.9 | -30.9 | 179.1 | -70.6 | 176.5 | -175.3 | 93.4 | -14.9 | 112.5 | M85 D86 G87 V91 M92 H96 L103 T108 | M85-R89 WeakPolarHBondContact O-CG 3.46Å; M85-R89 PolarHBondContact O-N 3.01Å; M85-R89 PolarHBondContact O-NH1 3.36Å; D86-R89 WeakPolarHBondContact O-CA 3.38Å; D86-R89 WeakPolarHBondContact O-CB 3.17Å; D86-R89 PolarHBondContact O-N 2.87Å; D86-R89 IonicContact OD1-CZ 2.88Å; D86-R89 IonicContact OD1-NH1 3.09Å; D86-R89 PolarHBondContact OD1-NH1 3.47Å; G87-R89 VanDerWaalsContact C-N 3.31Å; G87-R89 PolarHBondContact O-N 2.92Å; R89-V91 PolarHBondContact O-N 3.48Å; R89-M92 PolarHBondContact O-N 3.23Å; R89-H96 PolarHBondContact O-CE1 2.97Å; R89-L103 PolarHBondContact NE-O 3.37Å; R89-L103 PolarHBondContact NH2-O 3.46Å; R89-T108 HydrophobicContact CG-CG2 3.64Å; R89-T108 PolarHBondContact NE-OG1 3Å |
| 90 | E | 95.9 | Very high | 94.6 | Very high | 146 Ų | 146 | 73.8 Ų | 73.8 | 68% | 0.682 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -64.4 | -25.8 | 178.8 | -66.9 | 173.2 | -178 | 0 | 0 | 112.6 | D86 G87 L88 | D86-E90 PolarHBondContact O-N 3.14Å; G87-E90 PolarHBondContact O-N 2.07Å; L88-E90 VanDerWaalsContact C-N 3.3Å; L88-E90 PolarHBondContact O-N 3.43Å |
| 91 | V | 96.3 | Very high | 94.3 | Very high | 94 Ų | 94 | 80.4 Ų | 80.4 | 57% | 0.57 | 45% | 0.451 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.9 | 0.5 | -180 | -58.6 | 0 | 0 | 0 | 0 | 113.7 | L88 R89 | L88-V91 HydrophobicContact CD1-CG2 4.19Å; L88-V91 WeakPolarHBondContact O-CG2 3.18Å; L88-V91 PolarHBondContact O-N 3.15Å; R89-V91 PolarHBondContact O-N 3.48Å |
| 92 | M | 97.1 | Very high | 94.1 | Very high | 8 Ų | 8 | 83 Ų | 83 | 4% | 0.039 | 46% | 0.458 | C | S | . | . | S | Bend | trans | -77.3 | 138.8 | 178 | -71.3 | -58.1 | 94.1 | 0 | 0 | 111.2 | L88 R89 Y94 H96 T108 L111 A112 Y115 | L88-M92 HydrophobicContact CD1-CE 3.64Å; L88-M92 HydrophobicContact CG-CE 4.24Å; L88-M92 WeakPolarHBondContact O-CG 3.47Å; R89-M92 PolarHBondContact O-N 3.23Å; M92-Y94 PolarHBondContact O-N 3.11Å; M92-H96 PolarHBondContact O-CE1 3.13Å; M92-H96 VanDerWaalsContact O-CE1 3.24Å; M92-H96 PolarHBondContact O-NE2 3.43Å; M92-H96 VanDerWaalsContact O-NE2 3.08Å; M92-T108 HydrophobicContact CG-CG2 4.39Å; M92-L111 HydrophobicContact CB-CD2 3.94Å; M92-L111 HydrophobicContact CG-CD2 4.2Å; M92-L111 HydrophobicContact SD-CB 4.31Å; M92-L111 HydrophobicContact SD-CD2 4.35Å; M92-L111 HydrophobicContact SD-CG 4.06Å; M92-A112 HydrophobicContact CE-CB 3.88Å; M92-A112 WeakPolarHBondContact SD-CA 3.34Å; M92-A112 HydrophobicContact SD-CB 3.7Å; M92-Y115 HydrophobicContact CE-CD1 4.18Å |
| 93 | P | 93.4 | Very high | 94 | Very high | 73 Ų | 73 | 82.6 Ų | 82.6 | 47% | 0.474 | 46% | 0.456 | S | S | . | . | S | Bend | trans | -75.3 | 75.7 | 176.2 | 33.1 | -35.9 | 0 | 0 | 0 | 109.9 | Y115 | P93-Y115 HydrophobicContact CB-CE2 4.4Å; P93-Y115 VanDerWaalsContact CD-CD1 3.49Å; P93-Y115 HydrophobicContact CG-CD1 4.03Å; P93-Y115 HydrophobicContact CG-CD2 3.74Å; P93-Y115 HydrophobicContact CG-CE1 4.16Å; P93-Y115 HydrophobicContact CG-CE2 3.88Å; P93-Y115 HydrophobicContact CG-CG 3.81Å |
| 94 | Y | 92.4 | Very high | 94 | Very high | 120 Ų | 120 | 81.2 Ų | 81.2 | 47% | 0.471 | 45% | 0.454 | S | S | . | . | S | Bend | trans | -142.4 | 165.4 | 178.4 | -172.2 | -109.4 | 0 | 0 | 0 | 110.2 | M92 H96 V100 L103 | M92-Y94 PolarHBondContact O-N 3.11Å; Y94-H96 PolarHBondContact O-CD2 3.24Å; Y94-H96 PolarHBondContact O-N 3.48Å; Y94-H96 PolarHBondContact O-NE2 2.95Å; Y94-V100 HydrophobicContact CE1-CG1 3.83Å; Y94-L103 HydrophobicContact CD1-CD1 4.21Å; Y94-L103 HydrophobicContact CD1-CD2 4.21Å; Y94-L103 HydrophobicContact CD1-CG 4.19Å; Y94-L103 HydrophobicContact CE1-CD2 3.99Å; Y94-L103 HydrophobicContact CE1-CG 4.37Å; Y94-L103 HydrophobicContact CG-CD1 4.3Å |
| 95 | A | 86.6 | Confident | 94 | Very high | 57 Ų | 57 | 82.7 Ų | 82.7 | 47% | 0.471 | 45% | 0.448 | S | S | . | . | trans | -60.2 | 122.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | V100 | A95-V100 HydrophobicContact CB-CG1 4.2Å; A95-V100 HydrophobicContact CB-CG2 4.19Å; A95-V100 WeakPolarHBondContact O-CG1 3.43Å | ||
| 96 | H | 89.7 | Confident | 94 | Very high | 120 Ų | 120 | 87 Ų | 87 | 56% | 0.556 | 47% | 0.471 | S | S | * | . | trans | -105.9 | 131.9 | 172.1 | -55.6 | -52.6 | 0 | 0 | 0 | 109.1 | R89 M92 Y94 | R89-H96 PolarHBondContact O-CE1 2.97Å; M92-H96 PolarHBondContact O-CE1 3.13Å; M92-H96 VanDerWaalsContact O-CE1 3.24Å; M92-H96 PolarHBondContact O-NE2 3.43Å; M92-H96 VanDerWaalsContact O-NE2 3.08Å; Y94-H96 PolarHBondContact O-CD2 3.24Å; Y94-H96 PolarHBondContact O-N 3.48Å; Y94-H96 PolarHBondContact O-NE2 2.95Å | ||
| 97 | G | 86.4 | Confident | 94 | Very high | 37 Ų | 37 | 86.4 Ų | 86.4 | 38% | 0.381 | 47% | 0.472 | S | S | . | . | S | Bend | trans | 175.9 | 155 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | S99 V100 | G97-S99 PolarHBondContact O-N 3.27Å; G97-S99 VanDerWaalsContact O-N 3.13Å; G97-V100 PolarHBondContact O-N 3.23Å |
| 98 | P | 85.7 | Confident | 94.1 | Very high | 152 Ų | 152 | 85 Ų | 85 | 99% | 0.987 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.8 | -21.1 | -178.6 | 25.5 | -34 | 0 | 0 | 0 | 112.9 | ||
| 99 | S | 89.9 | Confident | 94.1 | Very high | 119 Ų | 119 | 87 Ų | 87 | 83% | 0.832 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.7 | -7.5 | 175.8 | -171.1 | 0 | 0 | 0 | 0 | 113.9 | G97 | G97-S99 PolarHBondContact O-N 3.27Å; G97-S99 VanDerWaalsContact O-N 3.13Å |
| 100 | V | 91.6 | Very high | 94.1 | Very high | 56 Ų | 56 | 89.6 Ų | 89.6 | 34% | 0.339 | 49% | 0.485 | S | S | . | . | S | Bend | trans | -90.8 | 132.1 | -176.5 | -175.8 | 0 | 0 | 0 | 0 | 109.8 | Y94 A95 G97 | Y94-V100 HydrophobicContact CE1-CG1 3.83Å; A95-V100 HydrophobicContact CB-CG1 4.2Å; A95-V100 HydrophobicContact CB-CG2 4.19Å; A95-V100 WeakPolarHBondContact O-CG1 3.43Å; G97-V100 PolarHBondContact O-N 3.23Å |
| 101 | R | 93.9 | Very high | 94.2 | Very high | 221 Ų | 221 | 85 Ų | 85 | 83% | 0.834 | 47% | 0.465 | S | S | * | . | P | Polyproline II helix | trans | -67.5 | 135 | -179.9 | -168.9 | -176.5 | -66.5 | 126 | -1.8 | 110.6 | ||
| 102 | K | 94.1 | Very high | 94.3 | Very high | 147 Ų | 147 | 81.1 Ų | 81.1 | 64% | 0.639 | 44% | 0.442 | S | S | * | . | P | Polyproline II helix | trans | -59.9 | 136.6 | 172.5 | -69.6 | -170.8 | 172.8 | -169.2 | 0 | 111.1 | D86 | D86-K102 IonicContact OD1-NZ 2.9Å; D86-K102 IonicContact OD2-NZ 3.96Å; D86-K102 PolarHBondContact OD2-NZ 3.33Å |
| 103 | L | 95.4 | Very high | 94.4 | Very high | 38 Ų | 38 | 88 Ų | 88 | 20% | 0.199 | 47% | 0.468 | C | S | . | . | P | Polyproline II helix | trans | -64.4 | 146.1 | 171.3 | -62.9 | 176.3 | 0 | 0 | 0 | 111.2 | R89 Y94 A107 L111 | R89-L103 PolarHBondContact NE-O 3.37Å; R89-L103 PolarHBondContact NH2-O 3.46Å; Y94-L103 HydrophobicContact CD1-CD1 4.21Å; Y94-L103 HydrophobicContact CD1-CD2 4.21Å; Y94-L103 HydrophobicContact CD1-CG 4.19Å; Y94-L103 HydrophobicContact CE1-CD2 3.99Å; Y94-L103 HydrophobicContact CE1-CG 4.37Å; Y94-L103 HydrophobicContact CG-CD1 4.3Å; L103-A107 HydrophobicContact CB-CB 4.43Å; L103-L111 HydrophobicContact CD1-CD2 3.82Å |
| 104 | S | 97.9 | Very high | 94.7 | Very high | 64 Ų | 64 | 88.4 Ų | 88.4 | 45% | 0.448 | 47% | 0.466 | S | S | . | . | P | Polyproline II helix | trans | -65.3 | 162.6 | 172.7 | 74.9 | 0 | 0 | 0 | 0 | 111.2 | I106 A107 T108 | S104-I106 VanDerWaalsContact C-N 3.34Å; S104-I106 PolarHBondContact O-N 3.33Å; S104-I106 WeakPolarHBondContact OG-CG2 3.44Å; S104-A107 PolarHBondContact O-N 3.21Å; S104-A107 VanDerWaalsContact OG-CB 3.26Å; S104-A107 WeakPolarHBondContact OG-CB 3.49Å; S104-A107 PolarHBondContact OG-N 2.67Å; S104-T108 WeakPolarHBondContact O-CB 3.45Å; S104-T108 PolarHBondContact O-N 3.3Å; S104-T108 PolarHBondContact O-OG1 3.5Å |
| 105 | K | 98.3 | Very high | 95 | Very high | 98 Ų | 98 | 86.6 Ų | 86.6 | 43% | 0.426 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -57.9 | -46.7 | 179.1 | -68.9 | -174.9 | 175.1 | -173.8 | 0 | 111.5 | N82 M85 T108 L109 | N82-K105 WeakPolarHBondContact OD1-CE 3.37Å; N82-K105 PolarHBondContact OD1-NZ 3.46Å; M85-K105 HydrophobicContact CE-CB 4.25Å; M85-K105 HydrophobicContact CE-CG 4.36Å; K105-T108 PolarHBondContact O-N 3.36Å; K105-L109 WeakPolarHBondContact O-CG 3.37Å; K105-L109 PolarHBondContact O-N 3.43Å; K105-L109 VanDerWaalsContact O-N 3.13Å |
| 106 | I | 98.5 | Very high | 95.5 | Very high | 112 Ų | 112 | 89 Ų | 89 | 57% | 0.574 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -66.1 | -42.6 | 179.4 | -172.9 | 60.7 | 0 | 0 | 0 | 112 | S104 T108 L109 L110 | S104-I106 VanDerWaalsContact C-N 3.34Å; S104-I106 PolarHBondContact O-N 3.33Å; S104-I106 WeakPolarHBondContact OG-CG2 3.44Å; I106-T108 VanDerWaalsContact C-N 3.32Å; I106-T108 PolarHBondContact O-N 3.3Å; I106-L109 PolarHBondContact O-N 2.92Å; I106-L110 HydrophobicContact CD1-CD1 4.48Å; I106-L110 HydrophobicContact CD1-CG 4.38Å; I106-L110 HydrophobicContact CG1-CD1 4.11Å; I106-L110 HydrophobicContact CG1-CG 4.45Å; I106-L110 WeakPolarHBondContact O-CG 3.33Å; I106-L110 PolarHBondContact O-N 3.34Å |
| 107 | A | 98 | Very high | 95.9 | Very high | 35 Ų | 35 | 87.7 Ų | 87.7 | 29% | 0.289 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.2 | -41 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | L103 S104 L110 L111 | L103-A107 HydrophobicContact CB-CB 4.43Å; S104-A107 PolarHBondContact O-N 3.21Å; S104-A107 VanDerWaalsContact OG-CB 3.26Å; S104-A107 WeakPolarHBondContact OG-CB 3.49Å; S104-A107 PolarHBondContact OG-N 2.67Å; A107-L110 PolarHBondContact O-N 2.91Å; A107-L111 WeakPolarHBondContact O-CB 3.33Å; A107-L111 PolarHBondContact O-N 3.19Å |
| 108 | T | 98.4 | Very high | 96.5 | Very high | 0 Ų | 0 | 91.9 Ų | 91.9 | 0% | 0 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -61 | -46.3 | 177 | -51.5 | 0 | 0 | 0 | 0 | 111.1 | M85 L88 R89 M92 S104 K105 I106 L111 A112 | M85-T108 HydrophobicContact CE-CG2 4.02Å; L88-T108 HydrophobicContact CB-CG2 4.5Å; L88-T108 HydrophobicContact CD2-CG2 3.88Å; L88-T108 HydrophobicContact CG-CG2 3.99Å; R89-T108 HydrophobicContact CG-CG2 3.64Å; R89-T108 PolarHBondContact NE-OG1 3Å; M92-T108 HydrophobicContact CG-CG2 4.39Å; S104-T108 WeakPolarHBondContact O-CB 3.45Å; S104-T108 PolarHBondContact O-N 3.3Å; S104-T108 PolarHBondContact O-OG1 3.5Å; K105-T108 PolarHBondContact O-N 3.36Å; I106-T108 VanDerWaalsContact C-N 3.32Å; I106-T108 PolarHBondContact O-N 3.3Å; T108-L111 PolarHBondContact O-N 2.88Å; T108-A112 WeakPolarHBondContact O-CB 3.26Å; T108-A112 PolarHBondContact O-N 2.95Å |
| 109 | L | 98.7 | Very high | 97.1 | Very high | 90 Ų | 90 | 88.3 Ų | 88.3 | 47% | 0.471 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -67.1 | -39.5 | 180 | -66.2 | 176.7 | 0 | 0 | 0 | 112.7 | M85 L88 K105 I106 A112 R113 | M85-L109 HydrophobicContact CE-CD2 4.22Å; M85-L109 HydrophobicContact CE-CG 4.21Å; M85-L109 HydrophobicContact SD-CD2 4.08Å; L88-L109 HydrophobicContact CD2-CD2 4.14Å; K105-L109 WeakPolarHBondContact O-CG 3.37Å; K105-L109 PolarHBondContact O-N 3.43Å; K105-L109 VanDerWaalsContact O-N 3.13Å; I106-L109 PolarHBondContact O-N 2.92Å; L109-A112 PolarHBondContact O-N 2.94Å; L109-R113 PolarHBondContact O-N 3.08Å |
| 110 | L | 98.4 | Very high | 97.5 | Very high | 94 Ų | 94 | 85.9 Ų | 85.9 | 49% | 0.492 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -64 | -45.5 | 175.4 | -72.4 | 173.2 | 0 | 0 | 0 | 111.6 | I106 A107 R113 N114 | I106-L110 HydrophobicContact CD1-CD1 4.48Å; I106-L110 HydrophobicContact CD1-CG 4.38Å; I106-L110 HydrophobicContact CG1-CD1 4.11Å; I106-L110 HydrophobicContact CG1-CG 4.45Å; I106-L110 WeakPolarHBondContact O-CG 3.33Å; I106-L110 PolarHBondContact O-N 3.34Å; A107-L110 PolarHBondContact O-N 2.91Å; L110-R113 PolarHBondContact O-N 3.22Å; L110-N114 PolarHBondContact O-N 3.08Å; L110-N114 VanDerWaalsContact O-N 3.08Å |
| 111 | L | 98.3 | Very high | 97.8 | Very high | 50 Ų | 50 | 87 Ų | 87 | 26% | 0.262 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.6 | -43.8 | 177.3 | -175 | 59.3 | 0 | 0 | 0 | 111.1 | M92 L103 A107 T108 R113 N114 Y115 | M92-L111 HydrophobicContact CB-CD2 3.94Å; M92-L111 HydrophobicContact CG-CD2 4.2Å; M92-L111 HydrophobicContact SD-CB 4.31Å; M92-L111 HydrophobicContact SD-CD2 4.35Å; M92-L111 HydrophobicContact SD-CG 4.06Å; L103-L111 HydrophobicContact CD1-CD2 3.82Å; A107-L111 WeakPolarHBondContact O-CB 3.33Å; A107-L111 PolarHBondContact O-N 3.19Å; T108-L111 PolarHBondContact O-N 2.88Å; L111-R113 PolarHBondContact O-N 3.18Å; L111-N114 PolarHBondContact O-N 3.1Å; L111-Y115 VanDerWaalsContact O-CB 3.3Å; L111-Y115 WeakPolarHBondContact O-CB 3.46Å; L111-Y115 PolarHBondContact O-N 3.22Å |
| 112 | A | 98.7 | Very high | 98 | Very high | 12 Ų | 12 | 79 Ų | 79 | 10% | 0.099 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -59.7 | -45.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L88 M92 T108 L109 N114 Y115 I116 | L88-A112 HydrophobicContact CD1-CB 4.19Å; L88-A112 HydrophobicContact CD2-CB 4.17Å; M92-A112 HydrophobicContact CE-CB 3.88Å; M92-A112 WeakPolarHBondContact SD-CA 3.34Å; M92-A112 HydrophobicContact SD-CB 3.7Å; T108-A112 WeakPolarHBondContact O-CB 3.26Å; T108-A112 PolarHBondContact O-N 2.95Å; L109-A112 PolarHBondContact O-N 2.94Å; A112-N114 PolarHBondContact O-N 2.82Å; A112-Y115 PolarHBondContact O-N 3.24Å; A112-I116 WeakPolarHBondContact O-CG1 3.4Å; A112-I116 PolarHBondContact O-N 3.42Å |
| 113 | R | 98.6 | Very high | 98.2 | Very high | 153 Ų | 153 | 76.4 Ų | 76.4 | 58% | 0.577 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -57.8 | -49.6 | 176 | -179.4 | -174.5 | 179.3 | -79.5 | -2.1 | 111.3 | L109 L110 L111 Y115 I116 L117 | L109-R113 PolarHBondContact O-N 3.08Å; L110-R113 PolarHBondContact O-N 3.22Å; L111-R113 PolarHBondContact O-N 3.18Å; R113-Y115 VanDerWaalsContact C-N 3.29Å; R113-Y115 PolarHBondContact O-N 3.02Å; R113-I116 PolarHBondContact O-N 2.93Å; R113-L117 WeakPolarHBondContact O-CG 3.35Å; R113-L117 PolarHBondContact O-N 3.37Å |
| 114 | N | 98.4 | Very high | 98.3 | Very high | 82 Ų | 82 | 78.4 Ų | 78.4 | 44% | 0.439 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -66.6 | -35.6 | -178.5 | -68.7 | -14.2 | 0 | 0 | 0 | 111.5 | L110 L111 A112 L117 M118 | L110-N114 PolarHBondContact O-N 3.08Å; L110-N114 VanDerWaalsContact O-N 3.08Å; L111-N114 PolarHBondContact O-N 3.1Å; A112-N114 PolarHBondContact O-N 2.82Å; N114-L117 PolarHBondContact O-N 2.79Å; N114-M118 PolarHBondContact O-N 3.13Å |
| 115 | Y | 98.6 | Very high | 98.3 | Very high | 81 Ų | 81 | 79.2 Ų | 79.2 | 32% | 0.318 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -66.3 | -43.3 | 177.8 | -174.1 | -146 | 0 | 0 | 0 | 111.9 | M92 P93 L111 A112 R113 L117 M118 L119 | M92-Y115 HydrophobicContact CE-CD1 4.18Å; P93-Y115 HydrophobicContact CB-CE2 4.4Å; P93-Y115 VanDerWaalsContact CD-CD1 3.49Å; P93-Y115 HydrophobicContact CG-CD1 4.03Å; P93-Y115 HydrophobicContact CG-CD2 3.74Å; P93-Y115 HydrophobicContact CG-CE1 4.16Å; P93-Y115 HydrophobicContact CG-CE2 3.88Å; P93-Y115 HydrophobicContact CG-CG 3.81Å; L111-Y115 VanDerWaalsContact O-CB 3.3Å; L111-Y115 WeakPolarHBondContact O-CB 3.46Å; L111-Y115 PolarHBondContact O-N 3.22Å; A112-Y115 PolarHBondContact O-N 3.24Å; R113-Y115 VanDerWaalsContact C-N 3.29Å; R113-Y115 PolarHBondContact O-N 3.02Å; Y115-L117 VanDerWaalsContact C-N 3.32Å; Y115-L117 PolarHBondContact O-N 2.97Å; Y115-M118 PolarHBondContact O-N 2.74Å; Y115-L119 HydrophobicContact CD1-CD1 4.2Å; Y115-L119 HydrophobicContact CD2-CD1 4.04Å; Y115-L119 HydrophobicContact CD2-CD2 4.42Å; Y115-L119 HydrophobicContact CD2-CG 3.86Å; Y115-L119 HydrophobicContact CE1-CD1 3.9Å; Y115-L119 HydrophobicContact CE2-CD1 3.72Å; Y115-L119 HydrophobicContact CE2-CD2 3.69Å; Y115-L119 HydrophobicContact CE2-CG 3.58Å; Y115-L119 HydrophobicContact CG-CD1 4.27Å; Y115-L119 WeakPolarHBondContact O-CG 3.34Å; Y115-L119 PolarHBondContact O-N 3.33Å |
| 116 | I | 98.6 | Very high | 98.3 | Very high | 108 Ų | 108 | 79.5 Ų | 79.5 | 55% | 0.554 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -56.8 | -46.8 | 173.2 | -68 | 165.3 | 0 | 0 | 0 | 110.5 | A112 R113 M118 L119 T120 | A112-I116 WeakPolarHBondContact O-CG1 3.4Å; A112-I116 PolarHBondContact O-N 3.42Å; R113-I116 PolarHBondContact O-N 2.93Å; I116-M118 PolarHBondContact O-N 2.93Å; I116-L119 PolarHBondContact O-N 3.41Å; I116-T120 PolarHBondContact O-N 3.43Å; I116-T120 PolarHBondContact O-OG1 3.19Å |
| 117 | L | 98.5 | Very high | 98.1 | Very high | 92 Ų | 92 | 80.5 Ų | 80.5 | 48% | 0.482 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -61.3 | -44.2 | 179.2 | -68.7 | 175.1 | 0 | 0 | 0 | 112.7 | R113 N114 Y115 T120 S121 | R113-L117 WeakPolarHBondContact O-CG 3.35Å; R113-L117 PolarHBondContact O-N 3.37Å; N114-L117 PolarHBondContact O-N 2.79Å; Y115-L117 VanDerWaalsContact C-N 3.32Å; Y115-L117 PolarHBondContact O-N 2.97Å; L117-T120 PolarHBondContact O-N 3.43Å; L117-S121 PolarHBondContact O-N 2.99Å |
| 118 | M | 98.4 | Very high | 98 | Very high | 126 Ų | 126 | 84.3 Ų | 84.3 | 62% | 0.621 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -60 | -46.1 | 176.1 | -87.2 | -73.2 | -60.8 | 0 | 0 | 112.1 | N114 Y115 I116 S121 S122 | N114-M118 PolarHBondContact O-N 3.13Å; Y115-M118 PolarHBondContact O-N 2.74Å; I116-M118 PolarHBondContact O-N 2.93Å; M118-S121 PolarHBondContact O-N 3.43Å; M118-S122 WeakPolarHBondContact O-CB 3.3Å; M118-S122 PolarHBondContact O-N 3.31Å; M118-S122 PolarHBondContact O-OG 3.4Å |
| 119 | L | 98.4 | Very high | 97.9 | Very high | 77 Ų | 77 | 87.8 Ų | 87.8 | 40% | 0.403 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -64.1 | -43.9 | 178.1 | -71 | 175.3 | 0 | 0 | 0 | 111.3 | Y115 I116 S122 L123 | Y115-L119 HydrophobicContact CD1-CD1 4.2Å; Y115-L119 HydrophobicContact CD2-CD1 4.04Å; Y115-L119 HydrophobicContact CD2-CD2 4.42Å; Y115-L119 HydrophobicContact CD2-CG 3.86Å; Y115-L119 HydrophobicContact CE1-CD1 3.9Å; Y115-L119 HydrophobicContact CE2-CD1 3.72Å; Y115-L119 HydrophobicContact CE2-CD2 3.69Å; Y115-L119 HydrophobicContact CE2-CG 3.58Å; Y115-L119 HydrophobicContact CG-CD1 4.27Å; Y115-L119 WeakPolarHBondContact O-CG 3.34Å; Y115-L119 PolarHBondContact O-N 3.33Å; I116-L119 PolarHBondContact O-N 3.41Å; L119-S122 PolarHBondContact O-N 3.42Å; L119-L123 WeakPolarHBondContact O-CB 3.34Å; L119-L123 VanDerWaalsContact O-CG 3.31Å; L119-L123 WeakPolarHBondContact O-CG 3.31Å; L119-L123 PolarHBondContact O-N 2.92Å |
| 120 | T | 98.4 | Very high | 97.7 | Very high | 67 Ų | 67 | 87.1 Ų | 87.1 | 41% | 0.411 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -59.6 | -49.3 | 176.3 | -59.1 | 0 | 0 | 0 | 0 | 111.4 | I116 L117 S122 L123 D124 | I116-T120 PolarHBondContact O-N 3.43Å; I116-T120 PolarHBondContact O-OG1 3.19Å; L117-T120 PolarHBondContact O-N 3.43Å; T120-S122 VanDerWaalsContact C-N 3.28Å; T120-S122 PolarHBondContact O-N 2.97Å; T120-L123 PolarHBondContact O-N 3.29Å; T120-D124 PolarHBondContact O-N 2.82Å |
| 121 | S | 98.1 | Very high | 97.5 | Very high | 79 Ų | 79 | 84.6 Ų | 84.6 | 55% | 0.552 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -59.8 | -39.4 | 177.4 | -172.9 | 0 | 0 | 0 | 0 | 112.2 | L117 M118 D124 E125 | L117-S121 PolarHBondContact O-N 2.99Å; M118-S121 PolarHBondContact O-N 3.43Å; S121-D124 PolarHBondContact O-N 3.46Å; S121-E125 WeakPolarHBondContact O-CB 3.36Å; S121-E125 PolarHBondContact O-N 3.45Å |
| 122 | S | 98.3 | Very high | 97.1 | Very high | 54 Ų | 54 | 86.8 Ų | 86.8 | 38% | 0.378 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -67.7 | -39.7 | 178 | -58.2 | 0 | 0 | 0 | 0 | 111.8 | M118 L119 T120 M126 | M118-S122 WeakPolarHBondContact O-CB 3.3Å; M118-S122 PolarHBondContact O-N 3.31Å; M118-S122 PolarHBondContact O-OG 3.4Å; L119-S122 PolarHBondContact O-N 3.42Å; T120-S122 VanDerWaalsContact C-N 3.28Å; T120-S122 PolarHBondContact O-N 2.97Å; S122-M126 WeakPolarHBondContact O-CE 3.46Å; S122-M126 WeakPolarHBondContact O-CG 3.42Å; S122-M126 PolarHBondContact O-N 3.28Å |
| 123 | L | 98.3 | Very high | 96.8 | Very high | 92 Ų | 92 | 92.3 Ų | 92.3 | 48% | 0.482 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.9 | -41.2 | 176 | -74 | 172.9 | 0 | 0 | 0 | 111.8 | L119 T120 M126 K127 | L119-L123 WeakPolarHBondContact O-CB 3.34Å; L119-L123 VanDerWaalsContact O-CG 3.31Å; L119-L123 WeakPolarHBondContact O-CG 3.31Å; L119-L123 PolarHBondContact O-N 2.92Å; T120-L123 PolarHBondContact O-N 3.29Å; L123-M126 HydrophobicContact CD2-CE 3.84Å; L123-M126 PolarHBondContact O-N 3.47Å; L123-K127 VanDerWaalsContact O-CG 3.27Å; L123-K127 WeakPolarHBondContact O-CG 3.34Å; L123-K127 PolarHBondContact O-N 3.27Å |
| 124 | D | 97.4 | Very high | 96.1 | Very high | 80 Ų | 80 | 94.4 Ų | 94.4 | 43% | 0.428 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -70.3 | -38 | -179.7 | -67.5 | -24.9 | 0 | 0 | 0 | 112.1 | T120 S121 K127 R128 | T120-D124 PolarHBondContact O-N 2.82Å; S121-D124 PolarHBondContact O-N 3.46Å; D124-K127 PolarHBondContact O-N 3.01Å; D124-K127 IonicContact OD1-NZ 2.89Å; D124-K127 PolarHBondContact OD1-NZ 3.34Å; D124-R128 PolarHBondContact O-N 3.26Å |
| 125 | E | 97.5 | Very high | 94.8 | Very high | 82 Ų | 82 | 93.6 Ų | 93.6 | 38% | 0.383 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.2 | -44.3 | 172.6 | -179.9 | 57.6 | -165.3 | 0 | 0 | 111.8 | S121 K127 R128 L129 | S121-E125 WeakPolarHBondContact O-CB 3.36Å; S121-E125 PolarHBondContact O-N 3.45Å; E125-K127 VanDerWaalsContact C-N 3.31Å; E125-K127 PolarHBondContact O-N 2.82Å; E125-R128 WeakPolarHBondContact O-CB 3.27Å; E125-R128 PolarHBondContact O-N 3.32Å; E125-R128 VanDerWaalsContact O-N 3.15Å; E125-R128 IonicContact OE1-CZ 3.47Å; E125-R128 IonicContact OE1-NE 3.47Å; E125-R128 PolarHBondContact OE1-NE 3.38Å; E125-R128 IonicContact OE1-NH2 2.67Å; E125-R128 PolarHBondContact OE1-NH2 3.02Å; E125-R128 IonicContact OE2-CZ 3.69Å; E125-R128 IonicContact OE2-NE 2.92Å; E125-R128 PolarHBondContact OE2-NE 3.46Å; E125-R128 IonicContact OE2-NH2 3.59Å; E125-L129 HydrophobicContact CG-CD1 4.27Å; E125-L129 WeakPolarHBondContact O-CG 3.27Å; E125-L129 PolarHBondContact O-N 3.46Å |
| 126 | M | 97.4 | Very high | 92.9 | Very high | 104 Ų | 104 | 91.5 Ų | 91.5 | 51% | 0.512 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.8 | -39.6 | 174.7 | -75.4 | -172.6 | -70.8 | 0 | 0 | 112 | S122 L123 R128 L129 V130 | S122-M126 WeakPolarHBondContact O-CE 3.46Å; S122-M126 WeakPolarHBondContact O-CG 3.42Å; S122-M126 PolarHBondContact O-N 3.28Å; L123-M126 HydrophobicContact CD2-CE 3.84Å; L123-M126 PolarHBondContact O-N 3.47Å; M126-R128 VanDerWaalsContact C-N 3.35Å; M126-L129 PolarHBondContact O-N 2.91Å; M126-V130 WeakPolarHBondContact O-CB 3.48Å; M126-V130 WeakPolarHBondContact O-CG2 3.38Å; M126-V130 PolarHBondContact O-N 3.08Å |
| 127 | K | 95.6 | Very high | 90.8 | Very high | 132 Ų | 132 | 95 Ų | 95 | 57% | 0.574 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.4 | -40.1 | 174.6 | -71.4 | 170.1 | -159.6 | 156 | 0 | 112 | L123 D124 E125 G131 | L123-K127 VanDerWaalsContact O-CG 3.27Å; L123-K127 WeakPolarHBondContact O-CG 3.34Å; L123-K127 PolarHBondContact O-N 3.27Å; D124-K127 PolarHBondContact O-N 3.01Å; D124-K127 IonicContact OD1-NZ 2.89Å; D124-K127 PolarHBondContact OD1-NZ 3.34Å; E125-K127 VanDerWaalsContact C-N 3.31Å; E125-K127 PolarHBondContact O-N 2.82Å; K127-G131 PolarHBondContact O-N 2.96Å |
| 128 | R | 95.8 | Very high | 88.7 | Confident | 116 Ų | 116 | 99.6 Ų | 99.6 | 44% | 0.438 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.7 | -51 | 176 | -173.3 | -172.5 | 71.2 | 83.4 | 1.2 | 110.7 | D124 E125 M126 V130 G131 E132 | D124-R128 PolarHBondContact O-N 3.26Å; E125-R128 WeakPolarHBondContact O-CB 3.27Å; E125-R128 PolarHBondContact O-N 3.32Å; E125-R128 VanDerWaalsContact O-N 3.15Å; E125-R128 IonicContact OE1-CZ 3.47Å; E125-R128 IonicContact OE1-NE 3.47Å; E125-R128 PolarHBondContact OE1-NE 3.38Å; E125-R128 IonicContact OE1-NH2 2.67Å; E125-R128 PolarHBondContact OE1-NH2 3.02Å; E125-R128 IonicContact OE2-CZ 3.69Å; E125-R128 IonicContact OE2-NE 2.92Å; E125-R128 PolarHBondContact OE2-NE 3.46Å; E125-R128 IonicContact OE2-NH2 3.59Å; M126-R128 VanDerWaalsContact C-N 3.35Å; R128-V130 PolarHBondContact O-N 3.18Å; R128-G131 WeakPolarHBondContact O-CA 3.2Å; R128-G131 PolarHBondContact O-N 3.46Å; R128-G131 VanDerWaalsContact O-N 3.15Å; R128-E132 IonicContact CZ-OE1 3.59Å; R128-E132 IonicContact CZ-OE2 3.93Å; R128-E132 IonicContact NH1-OE1 2.57Å; R128-E132 PolarHBondContact NH1-OE1 2.91Å; R128-E132 IonicContact NH1-OE2 3.17Å; R128-E132 PolarHBondContact NH1-OE2 3.38Å; R128-E132 VanDerWaalsContact NH1-OE2 3.17Å; R128-E132 WeakPolarHBondContact O-CG 3.37Å; R128-E132 PolarHBondContact O-N 2.97Å |
| 129 | L | 95.4 | Very high | 86.7 | Confident | 72 Ų | 72 | 98.6 Ų | 98.6 | 38% | 0.377 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.9 | -42.5 | 179.1 | -66.5 | 173.6 | 0 | 0 | 0 | 112.3 | E125 M126 E132 I133 | E125-L129 HydrophobicContact CG-CD1 4.27Å; E125-L129 WeakPolarHBondContact O-CG 3.27Å; E125-L129 PolarHBondContact O-N 3.46Å; M126-L129 PolarHBondContact O-N 2.91Å; L129-E132 PolarHBondContact O-N 3.32Å; L129-I133 VanDerWaalsContact O-CG1 3.31Å; L129-I133 WeakPolarHBondContact O-CG1 3.36Å; L129-I133 PolarHBondContact O-N 3.31Å |
| 130 | V | 94.9 | Very high | 84.6 | Confident | 76 Ų | 76 | 99 Ų | 99 | 46% | 0.461 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.5 | -43.8 | 173.7 | 170.8 | 0 | 0 | 0 | 0 | 110.2 | M126 R128 E132 I133 Y134 | M126-V130 WeakPolarHBondContact O-CB 3.48Å; M126-V130 WeakPolarHBondContact O-CG2 3.38Å; M126-V130 PolarHBondContact O-N 3.08Å; R128-V130 PolarHBondContact O-N 3.18Å; V130-E132 VanDerWaalsContact C-N 3.25Å; V130-E132 PolarHBondContact O-N 3.2Å; V130-I133 PolarHBondContact O-N 3.31Å; V130-Y134 HydrophobicContact CG1-CD2 3.59Å; V130-Y134 HydrophobicContact CG1-CE2 3.89Å; V130-Y134 VanDerWaalsContact O-CD2 3.27Å; V130-Y134 WeakPolarHBondContact O-CD2 3.31Å; V130-Y134 PolarHBondContact O-N 2.92Å |
| 131 | G | 93.1 | Very high | 82.1 | Confident | 41 Ų | 41 | 105.7 Ų | 105.7 | 42% | 0.423 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -57.9 | -37 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | K127 R128 G135 | K127-G131 PolarHBondContact O-N 2.96Å; R128-G131 WeakPolarHBondContact O-CA 3.2Å; R128-G131 PolarHBondContact O-N 3.46Å; R128-G131 VanDerWaalsContact O-N 3.15Å; G131-G135 VanDerWaalsContact O-CA 3.23Å; G131-G135 WeakPolarHBondContact O-CA 3.43Å; G131-G135 PolarHBondContact O-N 2.98Å |
| 132 | E | 91.7 | Very high | 79.6 | Confident | 97 Ų | 97 | 110.2 Ų | 110.2 | 45% | 0.453 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -69.2 | -41.9 | 175.8 | -74.5 | 167.6 | -173 | 0 | 0 | 112.4 | R128 L129 V130 G136 | R128-E132 IonicContact CZ-OE1 3.59Å; R128-E132 IonicContact CZ-OE2 3.93Å; R128-E132 IonicContact NH1-OE1 2.57Å; R128-E132 PolarHBondContact NH1-OE1 2.91Å; R128-E132 IonicContact NH1-OE2 3.17Å; R128-E132 PolarHBondContact NH1-OE2 3.38Å; R128-E132 VanDerWaalsContact NH1-OE2 3.17Å; R128-E132 WeakPolarHBondContact O-CG 3.37Å; R128-E132 PolarHBondContact O-N 2.97Å; L129-E132 PolarHBondContact O-N 3.32Å; V130-E132 VanDerWaalsContact C-N 3.25Å; V130-E132 PolarHBondContact O-N 3.2Å; E132-G136 WeakPolarHBondContact O-CA 3.48Å; E132-G136 PolarHBondContact O-N 3.46Å |
| 133 | I | 91.4 | Very high | 76.9 | Confident | 127 Ų | 127 | 113.7 Ų | 113.7 | 65% | 0.651 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -68.4 | -42.1 | 179 | -66.3 | 165.6 | 0 | 0 | 0 | 111.4 | L129 V130 | L129-I133 VanDerWaalsContact O-CG1 3.31Å; L129-I133 WeakPolarHBondContact O-CG1 3.36Å; L129-I133 PolarHBondContact O-N 3.31Å; V130-I133 PolarHBondContact O-N 3.31Å |
| 134 | Y | 84.7 | Confident | 74.5 | Confident | 197 Ų | 197 | 112.1 Ų | 112.1 | 77% | 0.773 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -93.9 | -21.1 | -174.4 | -72.1 | -87.3 | 0 | 0 | 0 | 114.1 | V130 | V130-Y134 HydrophobicContact CG1-CD2 3.59Å; V130-Y134 HydrophobicContact CG1-CE2 3.89Å; V130-Y134 VanDerWaalsContact O-CD2 3.27Å; V130-Y134 WeakPolarHBondContact O-CD2 3.31Å; V130-Y134 PolarHBondContact O-N 2.92Å |
| 135 | G | 70.9 | Confident | 71.8 | Confident | 65 Ų | 65 | 114.8 Ų | 114.8 | 67% | 0.67 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -108.6 | 2.9 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | G131 | G131-G135 VanDerWaalsContact O-CA 3.23Å; G131-G135 WeakPolarHBondContact O-CA 3.43Å; G131-G135 PolarHBondContact O-N 2.98Å |
| 136 | G | 58.9 | Low | 69.3 | Low | 37 Ų | 37 | 117.5 Ų | 117.5 | 38% | 0.381 | 65% | 0.654 | S | S | . | * | trans | -135.9 | 39.2 | -160.1 | 0 | 0 | 0 | 0 | 0 | 117.4 | E132 H138 | E132-G136 WeakPolarHBondContact O-CA 3.48Å; E132-G136 PolarHBondContact O-N 3.46Å; G136-H138 VanDerWaalsContact C-N 3.27Å | ||
| 137 | Q | 54.6 | Low | 66.8 | Low | 183 Ų | 183 | 116.3 Ų | 116.3 | 86% | 0.855 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -90.3 | 22.9 | 162 | -117.8 | 162.5 | -6 | 0 | 0 | 113 | ||
| 138 | H | 53.4 | Low | 64.2 | Low | 187 Ų | 187 | 119.5 Ų | 119.5 | 87% | 0.866 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -128.7 | 20.7 | -175.3 | -76 | -83.9 | 0 | 0 | 0 | 116 | G136 | G136-H138 VanDerWaalsContact C-N 3.27Š|
| 139 | S | 57.5 | Low | 61.6 | Low | 105 Ų | 105 | 118.8 Ų | 118.8 | 73% | 0.734 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -137.7 | 9.5 | 173.8 | 54.3 | 0 | 0 | 0 | 0 | 115.3 | F141 | S139-F141 PolarHBondContact O-N 3.44Š|
| 140 | A | 53.9 | Low | 58.8 | Low | 87 Ų | 87 | 120.6 Ų | 120.6 | 72% | 0.719 | 72% | 0.721 | S | S | * | * | trans | -91.1 | 16.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 141 | F | 44.3 | Very low | 56 | Low | 206 Ų | 206 | 120.5 Ų | 120.5 | 90% | 0.904 | 74% | 0.736 | S | S | * | * | trans | -121.6 | 68.9 | 168.5 | -73.8 | -81.2 | 0 | 0 | 0 | 110.7 | S139 | S139-F141 PolarHBondContact O-N 3.44Š| ||
| 142 | H | 47 | Very low | 53.7 | Low | 175 Ų | 175 | 125.7 Ų | 125.7 | 81% | 0.81 | 76% | 0.76 | S | S | * | * | trans | -137.4 | 62.2 | 148.2 | -132.3 | -60.2 | 0 | 0 | 0 | 109.2 | ||||
| 143 | C | 41.7 | Very low | 51 | Low | 126 Ų | 126 | 124.5 Ų | 124.5 | 85% | 0.851 | 77% | 0.774 | S | S | * | * | trans | -86.6 | 124.7 | 158.7 | -175.3 | 0 | 0 | 0 | 0 | 108 | ||||
| 144 | G | 47.7 | Very low | 48.4 | Very low | 59 Ų | 59 | 121.3 Ų | 121.3 | 61% | 0.608 | 77% | 0.772 | S | S | * | * | trans | 74.4 | 110.4 | 149.2 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 145 | T | 40.5 | Very low | 46.2 | Very low | 136 Ų | 136 | 121.2 Ų | 121.2 | 83% | 0.834 | 78% | 0.779 | S | S | * | * | trans | -151.7 | 106.8 | 137.4 | -6.4 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 146 | V | 45.6 | Very low | 44.5 | Very low | 139 Ų | 139 | 124 Ų | 124 | 84% | 0.842 | 79% | 0.788 | S | S | * | * | trans | -69.6 | 134.5 | 162.1 | -109.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 147 | A | 44 | Very low | 43.3 | Very low | 79 Ų | 79 | 127.1 Ų | 127.1 | 65% | 0.653 | 81% | 0.81 | S | S | * | * | trans | 50.1 | 133.4 | 150 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 148 | H | 40.2 | Very low | 42.5 | Very low | 200 Ų | 200 | 124.5 Ų | 124.5 | 93% | 0.926 | 81% | 0.806 | S | S | * | * | -178.7 | 140.7 | 112.1 | -89.6 | -69.9 | 0 | 0 | 0 | 110.8 | |||||
| 149 | A | 41.5 | Very low | 41.8 | Very low | 100 Ų | 100 | 121.7 Ų | 121.7 | 83% | 0.826 | 80% | 0.804 | S | S | * | * | trans | -92.1 | 150.6 | -172 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 150 | A | 38 | Very low | 40.6 | Very low | 110 Ų | 110 | 121.3 Ų | 121.3 | 91% | 0.909 | 81% | 0.808 | S | S | * | * | trans | 174.7 | 131.4 | 136 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 151 | G | 36.4 | Very low | 39.8 | Very low | 75 Ų | 75 | 122.2 Ų | 122.2 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | trans | 144.5 | 68.4 | 162.7 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 152 | T | 43.6 | Very low | 39.2 | Very low | 149 Ų | 149 | 116.7 Ų | 116.7 | 91% | 0.914 | 81% | 0.807 | S | S | * | * | trans | 0.7 | 132.2 | 159.4 | 57.3 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 153 | G | 34.5 | Very low | 38.6 | Very low | 73 Ų | 73 | 113 Ų | 113 | 75% | 0.753 | 81% | 0.807 | S | S | * | * | trans | 146.8 | 72.3 | 139.2 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 154 | G | 37.8 | Very low | 38.2 | Very low | 60 Ų | 60 | 111.6 Ų | 111.6 | 62% | 0.619 | 81% | 0.805 | S | S | * | * | trans | 90.7 | 138.1 | 135.8 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 155 | H | 37.6 | Very low | 37.3 | Very low | 195 Ų | 195 | 113.1 Ų | 113.1 | 90% | 0.903 | 81% | 0.812 | S | S | * | * | trans | 76 | 125.9 | 158.5 | 37.2 | -79.6 | 0 | 0 | 0 | 120.7 | ||||
| 156 | S | 36 | Very low | 37 | Very low | 124 Ų | 124 | 111.4 Ų | 111.4 | 87% | 0.867 | 81% | 0.811 | S | S | * | * | trans | -84 | 141.4 | -159.2 | -45.4 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 157 | A | 33.8 | Very low | 36.3 | Very low | 101 Ų | 101 | 109.6 Ų | 109.6 | 84% | 0.835 | 81% | 0.811 | S | S | * | * | trans | -165 | 124.6 | 135.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 158 | V | 36.5 | Very low | 35.6 | Very low | 129 Ų | 129 | 110.4 Ų | 110.4 | 78% | 0.782 | 82% | 0.817 | S | S | * | * | trans | -71.4 | 145.9 | -179.8 | 176 | 0 | 0 | 0 | 0 | 110.1 | A160 | V158-A160 HydrophobicContact CG1-CB 4.22Å; V158-A160 VanDerWaalsContact CG1-N 3.29Å | ||
| 159 | P | 40.1 | Very low | 35.2 | Very low | 128 Ų | 128 | 105.7 Ų | 105.7 | 83% | 0.831 | 81% | 0.813 | S | S | * | * | -129 | 132.4 | 108.8 | 33.6 | -23.9 | 0 | 0 | 0 | 111.9 | A161 | P159-A161 PolarHBondContact O-N 3.45Š| |||
| 160 | A | 31.2 | Very low | 34.7 | Very low | 97 Ų | 97 | 105.6 Ų | 105.6 | 80% | 0.802 | 81% | 0.812 | S | S | * | * | trans | -76.7 | 110.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | V158 | V158-A160 HydrophobicContact CG1-CB 4.22Å; V158-A160 VanDerWaalsContact CG1-N 3.29Å | ||
| 161 | A | 36.9 | Very low | 34.3 | Very low | 105 Ų | 105 | 104.4 Ų | 104.4 | 87% | 0.868 | 80% | 0.803 | S | S | * | * | trans | -135.4 | 104.3 | 149.4 | 0 | 0 | 0 | 0 | 0 | 107 | P159 | P159-A161 PolarHBondContact O-N 3.45Š| ||
| 162 | A | 33.5 | Very low | 34.1 | Very low | 90 Ų | 90 | 109.3 Ų | 109.3 | 74% | 0.744 | 81% | 0.805 | S | S | * | * | trans | -127.4 | 120.3 | 160.4 | 0 | 0 | 0 | 0 | 0 | 104.7 | ||||
| 163 | A | 33.2 | Very low | 33.6 | Very low | 97 Ų | 97 | 110.1 Ų | 110.1 | 80% | 0.802 | 80% | 0.798 | S | S | * | * | 51.4 | 128.8 | 70 | 0 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 164 | A | 33.7 | Very low | 34 | Very low | 98 Ų | 98 | 112.9 Ų | 112.9 | 81% | 0.81 | 80% | 0.8 | S | S | * | * | cis | -171.7 | 170.5 | 6.5 | 0 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 165 | A | 29.1 | Very low | 34 | Very low | 91 Ų | 91 | 118 Ų | 118 | 75% | 0.752 | 81% | 0.808 | S | S | * | * | trans | 155.6 | 103.5 | 141.4 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 166 | A | 32.9 | Very low | 34.9 | Very low | 100 Ų | 100 | 113.5 Ų | 113.5 | 83% | 0.826 | 80% | 0.796 | S | S | * | * | 53.1 | 97.3 | 73.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 167 | A | 31.1 | Very low | 34.9 | Very low | 101 Ų | 101 | 115.8 Ų | 115.8 | 84% | 0.835 | 80% | 0.797 | S | S | * | * | 162.6 | 152.8 | 106.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 168 | A | 30.7 | Very low | 35.5 | Very low | 95 Ų | 95 | 119.2 Ų | 119.2 | 79% | 0.785 | 80% | 0.801 | S | S | * | * | trans | 84.6 | 99 | 155.5 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 169 | A | 31.8 | Very low | 35.3 | Very low | 101 Ų | 101 | 116.8 Ų | 116.8 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | 30.3 | 119.1 | 121.2 | 0 | 0 | 0 | 0 | 0 | 119.1 | |||||
| 170 | A | 29.8 | Very low | 35 | Very low | 98 Ų | 98 | 114.7 Ų | 114.7 | 81% | 0.81 | 80% | 0.803 | S | S | * | * | 164 | 146.2 | 113.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 171 | A | 30.8 | Very low | 35.2 | Very low | 86 Ų | 86 | 114.9 Ų | 114.9 | 71% | 0.711 | 81% | 0.805 | S | S | * | * | trans | 69.7 | 116.4 | 147.4 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 172 | H | 31.1 | Very low | 35.6 | Very low | 177 Ų | 177 | 117.8 Ų | 117.8 | 82% | 0.819 | 81% | 0.805 | S | S | * | * | 61 | 114.1 | 127.2 | -81.6 | 41.1 | 0 | 0 | 0 | 117.7 | |||||
| 173 | Q | 33.7 | Very low | 35.8 | Very low | 166 Ų | 166 | 119.9 Ų | 119.9 | 78% | 0.776 | 81% | 0.809 | S | S | * | * | 171.9 | 126.1 | 94.6 | -80.1 | -141.7 | 24.6 | 0 | 0 | 111.8 | |||||
| 174 | V | 43.3 | Very low | 35.9 | Very low | 132 Ų | 132 | 120.5 Ų | 120.5 | 80% | 0.8 | 81% | 0.807 | S | S | * | * | trans | -54.8 | 133.7 | 153 | -94.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 175 | H | 37.4 | Very low | 36.1 | Very low | 167 Ų | 167 | 121.1 Ų | 121.1 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | trans | -152 | 131 | 141.9 | -126 | -86.3 | 0 | 0 | 0 | 113.2 | ||||
| 176 | P | 55.8 | Low | 36.4 | Very low | 100 Ų | 100 | 123.9 Ų | 123.9 | 65% | 0.649 | 81% | 0.813 | S | S | * | * | trans | -88.3 | 154.3 | 169.5 | 36.4 | -32.6 | 0 | 0 | 0 | 110.4 | ||||
| 177 | L | 36.3 | Very low | 36.6 | Very low | 172 Ų | 172 | 124.1 Ų | 124.1 | 90% | 0.901 | 81% | 0.809 | S | S | * | * | trans | -142.8 | 92.1 | 163.4 | -100.5 | 155.7 | 0 | 0 | 0 | 110.1 | ||||
| 178 | L | 47.1 | Very low | 37.1 | Very low | 174 Ų | 174 | 124.4 Ų | 124.4 | 91% | 0.911 | 81% | 0.805 | S | S | * | * | trans | -72 | 140.5 | 145.8 | -83.2 | 151.4 | 0 | 0 | 0 | 108 | ||||
| 179 | G | 31.9 | Very low | 37.3 | Very low | 78 Ų | 78 | 126.6 Ų | 126.6 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | 158.4 | 99.8 | 155 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 180 | G | 33.2 | Very low | 37.8 | Very low | 83 Ų | 83 | 130.2 Ų | 130.2 | 86% | 0.856 | 81% | 0.813 | S | S | * | * | trans | 99.6 | 146.7 | 143.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 181 | A | 36.2 | Very low | 38.1 | Very low | 102 Ų | 102 | 131.4 Ų | 131.4 | 84% | 0.843 | 82% | 0.816 | S | S | * | * | cis | -161.1 | 157.4 | -14 | 0 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 182 | L | 44.5 | Very low | 38.6 | Very low | 166 Ų | 166 | 133.1 Ų | 133.1 | 87% | 0.869 | 82% | 0.822 | S | S | * | * | trans | -63 | 142.5 | 172.5 | -60.6 | 155.3 | 0 | 0 | 0 | 110.6 | ||||
| 183 | T | 37.3 | Very low | 39 | Very low | 134 Ų | 134 | 129.5 Ų | 129.5 | 82% | 0.822 | 82% | 0.823 | S | S | * | * | 178.7 | 109.1 | 123.8 | 46.7 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 184 | S | 36.6 | Very low | 39.4 | Very low | 110 Ų | 110 | 129.8 Ų | 129.8 | 77% | 0.769 | 83% | 0.829 | S | S | * | * | 42.9 | 122.4 | 125.7 | -51.9 | 0 | 0 | 0 | 0 | 123.9 | |||||
| 185 | S | 38.1 | Very low | 39.5 | Very low | 111 Ų | 111 | 129.7 Ų | 129.7 | 78% | 0.776 | 83% | 0.831 | S | S | * | * | 79.9 | 117.6 | 129.2 | -55.5 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 186 | T | 35.9 | Very low | 39.3 | Very low | 148 Ų | 148 | 125.4 Ų | 125.4 | 91% | 0.908 | 83% | 0.832 | S | S | * | * | -166.2 | 156.7 | 120.7 | 20.9 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 187 | S | 36.2 | Very low | 38.5 | Very low | 105 Ų | 105 | 129.1 Ų | 129.1 | 73% | 0.734 | 85% | 0.845 | S | S | * | * | trans | -87.6 | 155.8 | -155.1 | -50.5 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 188 | S | 41 | Very low | 38.8 | Very low | 107 Ų | 107 | 127.5 Ų | 127.5 | 75% | 0.748 | 84% | 0.843 | S | S | * | * | trans | 58.5 | 123.2 | 139.7 | 51.9 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 189 | T | 36 | Very low | 38.4 | Very low | 141 Ų | 141 | 124.5 Ų | 124.5 | 87% | 0.865 | 84% | 0.836 | S | S | * | * | -166.9 | 127.7 | 115.3 | 23.3 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 190 | L | 41.5 | Very low | 38.7 | Very low | 178 Ų | 178 | 128.1 Ų | 128.1 | 93% | 0.932 | 84% | 0.835 | S | S | * | * | trans | -82.5 | 126 | 171.8 | -71.4 | 156.5 | 0 | 0 | 0 | 108.3 | ||||
| 191 | S | 35.4 | Very low | 38.8 | Very low | 123 Ų | 123 | 135.1 Ų | 135.1 | 86% | 0.86 | 84% | 0.836 | S | S | * | * | trans | -127 | 106.9 | 165.4 | -76.9 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 192 | S | 41.9 | Very low | 39.2 | Very low | 122 Ų | 122 | 133.8 Ų | 133.8 | 85% | 0.853 | 83% | 0.825 | S | S | * | * | trans | -66.4 | 131.4 | 166.3 | 36.5 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 193 | A | 39.2 | Very low | 39.4 | Very low | 101 Ų | 101 | 131.9 Ų | 131.9 | 84% | 0.835 | 82% | 0.823 | S | S | * | * | trans | -149 | 102.2 | 158.3 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 194 | L | 43.6 | Very low | 39.9 | Very low | 172 Ų | 172 | 133.5 Ų | 133.5 | 90% | 0.901 | 82% | 0.821 | S | S | * | * | trans | -111.3 | 128.5 | 164.5 | -86.8 | 157.6 | 0 | 0 | 0 | 107 | ||||
| 195 | P | 43.8 | Very low | 39.9 | Very low | 130 Ų | 130 | 134.6 Ų | 134.6 | 84% | 0.844 | 82% | 0.823 | S | S | * | * | trans | -93.7 | 116.7 | 164.3 | 30.2 | -24.8 | 0 | 0 | 0 | 111.4 | ||||
| 196 | G | 34 | Very low | 40.1 | Very low | 76 Ų | 76 | 136.2 Ų | 136.2 | 78% | 0.784 | 82% | 0.822 | S | S | * | * | 81.6 | 99 | 124.1 | 0 | 0 | 0 | 0 | 0 | 119.1 | |||||
| 197 | L | 38.7 | Very low | 40.1 | Very low | 178 Ų | 178 | 137.5 Ų | 137.5 | 93% | 0.932 | 82% | 0.82 | S | S | * | * | trans | -79.8 | 128.4 | 155 | -75.1 | 162.5 | 0 | 0 | 0 | 109.8 | ||||
| 198 | T | 42.5 | Very low | 40.5 | Very low | 138 Ų | 138 | 142.3 Ų | 142.3 | 85% | 0.847 | 83% | 0.827 | S | S | * | * | trans | -120.9 | 111.5 | 153.2 | 52.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 199 | S | 38.4 | Very low | 40.1 | Very low | 112 Ų | 112 | 140.5 Ų | 140.5 | 78% | 0.783 | 83% | 0.825 | S | S | * | * | trans | -74.4 | 127.5 | 162.6 | 172.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 200 | I | 39.2 | Very low | 40.6 | Very low | 153 Ų | 153 | 139.6 Ų | 139.6 | 79% | 0.785 | 83% | 0.825 | S | S | * | * | trans | -160.1 | 111.8 | 151.8 | -82.4 | 126.4 | 0 | 0 | 0 | 109.1 | ||||
| 201 | R | 35.4 | Very low | 40.7 | Very low | 231 Ų | 231 | 137.1 Ų | 137.1 | 87% | 0.872 | 82% | 0.82 | S | S | * | * | trans | 61.3 | 122.1 | 130.8 | -156.2 | 160.5 | -170.4 | 147.5 | 0.4 | 121.6 | ||||
| 202 | A | 44.3 | Very low | 40.8 | Very low | 74 Ų | 74 | 135.8 Ų | 135.8 | 61% | 0.612 | 82% | 0.816 | S | S | * | * | trans | -69.3 | 148.3 | 160.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 203 | P | 49 | Very low | 40.7 | Very low | 125 Ų | 125 | 134.7 Ų | 134.7 | 81% | 0.812 | 81% | 0.814 | S | S | * | * | trans | -112.4 | 125.6 | 152.1 | 32.7 | -22.4 | 0 | 0 | 0 | 111.4 | ||||
| 204 | H | 46.5 | Very low | 41.1 | Very low | 169 Ų | 169 | 135.3 Ų | 135.3 | 78% | 0.782 | 81% | 0.81 | S | S | * | * | trans | -80.6 | 133.9 | 154.7 | -48.7 | -95.2 | 0 | 0 | 0 | 107.6 | ||||
| 205 | T | 36.8 | Very low | 41.2 | Very low | 132 Ų | 132 | 132.5 Ų | 132.5 | 81% | 0.81 | 80% | 0.802 | S | S | * | * | 157.1 | 114.3 | 126.1 | 46.3 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 206 | L | 42.3 | Very low | 41.3 | Very low | 146 Ų | 146 | 131.4 Ų | 131.4 | 76% | 0.764 | 80% | 0.803 | S | S | * | * | 57 | 97.7 | 118.5 | -130.8 | 153.8 | 0 | 0 | 0 | 118.4 | |||||
| 207 | M | 36.9 | Very low | 41.7 | Very low | 175 Ų | 175 | 135.2 Ų | 135.2 | 86% | 0.862 | 81% | 0.805 | S | S | * | * | trans | -154.6 | 150.9 | 138.6 | -98.5 | -57.7 | 108.6 | 0 | 0 | 111.4 | ||||
| 208 | K | 44.7 | Very low | 41.9 | Very low | 206 Ų | 206 | 135.8 Ų | 135.8 | 90% | 0.896 | 80% | 0.803 | S | S | * | * | trans | -87.3 | 136.9 | -158.3 | -179 | 154.8 | 175.9 | 169.1 | 0 | 112.1 | ||||
| 209 | G | 33.1 | Very low | 42.1 | Very low | 68 Ų | 68 | 137.7 Ų | 137.7 | 70% | 0.701 | 81% | 0.807 | S | S | * | * | trans | -174.6 | 103.9 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 210 | S | 45.3 | Very low | 42.3 | Very low | 122 Ų | 122 | 135.5 Ų | 135.5 | 85% | 0.853 | 80% | 0.802 | S | S | * | * | trans | -66.8 | 144.7 | 164.7 | -64.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 211 | P | 43.1 | Very low | 43 | Very low | 127 Ų | 127 | 134 Ų | 134 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | -135.2 | 167.6 | 120.5 | 27.4 | -9.7 | 0 | 0 | 0 | 113.7 | |||||
| 212 | A | 37.8 | Very low | 43.8 | Very low | 95 Ų | 95 | 125.5 Ų | 125.5 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | -45.4 | 145.3 | -164.4 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 213 | A | 40.9 | Very low | 44.1 | Very low | 99 Ų | 99 | 130.5 Ų | 130.5 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 134.1 | 167.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 214 | P | 46.6 | Very low | 44.6 | Very low | 113 Ų | 113 | 130.8 Ų | 130.8 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 151.5 | 157.7 | 32.7 | -28.1 | 0 | 0 | 0 | 110 | ||
| 215 | P | 45.5 | Very low | 45.2 | Very low | 114 Ų | 114 | 126.8 Ų | 126.8 | 74% | 0.74 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 140.8 | -173 | 29.2 | -33.2 | 0 | 0 | 0 | 111 | L217 | P215-L217 PolarHBondContact O-N 3.48Å; P215-L217 VanDerWaalsContact O-N 3.12Å |
| 216 | A | 45.4 | Very low | 45.9 | Very low | 106 Ų | 106 | 132.5 Ų | 132.5 | 88% | 0.876 | 78% | 0.776 | S | S | * | * | trans | -62.4 | 109.6 | 170.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 217 | L | 43.1 | Very low | 46.7 | Very low | 157 Ų | 157 | 130 Ų | 130 | 82% | 0.822 | 78% | 0.777 | S | S | * | * | trans | -108.5 | 134.6 | 164.3 | -71.5 | 179.8 | 0 | 0 | 0 | 110.3 | P215 | P215-L217 PolarHBondContact O-N 3.48Å; P215-L217 VanDerWaalsContact O-N 3.12Å | ||
| 218 | Q | 42.3 | Very low | 48.1 | Very low | 189 Ų | 189 | 123.7 Ų | 123.7 | 88% | 0.883 | 76% | 0.757 | S | S | * | * | trans | -56.1 | 142.1 | -164.6 | -86.3 | 151 | -70 | 0 | 0 | 115 | G220 | Q218-G220 PolarHBondContact O-N 2.96Å; Q218-G220 VanDerWaalsContact O-N 3.1Å | ||
| 219 | L | 47.5 | Very low | 49.2 | Very low | 179 Ų | 179 | 119.3 Ų | 119.3 | 94% | 0.937 | 74% | 0.743 | S | S | * | * | trans | -49.6 | 99.3 | 169.3 | -170.8 | 68.5 | 0 | 0 | 0 | 112.5 | ||||
| 220 | G | 42 | Very low | 50.8 | Low | 65 Ų | 65 | 121.4 Ų | 121.4 | 67% | 0.67 | 74% | 0.743 | S | S | * | * | trans | -101.7 | 124.3 | 162.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | Q218 G222 | Q218-G220 PolarHBondContact O-N 2.96Å; Q218-G220 VanDerWaalsContact O-N 3.1Å; G220-G222 PolarHBondContact O-N 3.18Å | ||
| 221 | S | 54.2 | Low | 51.8 | Low | 123 Ų | 123 | 117.3 Ų | 117.3 | 86% | 0.86 | 71% | 0.714 | S | S | * | * | trans | -73.4 | 90.1 | 179.7 | -167.2 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 222 | G | 53.2 | Low | 52.8 | Low | 51 Ų | 51 | 117 Ų | 117 | 53% | 0.526 | 71% | 0.713 | S | S | . | * | trans | -151.1 | 134.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | G220 Q224 | G220-G222 PolarHBondContact O-N 3.18Å; G222-Q224 PolarHBondContact O-N 2.88Å; G222-Q224 VanDerWaalsContact O-N 3.09Å | ||
| 223 | F | 50.9 | Low | 54.2 | Low | 180 Ų | 180 | 114.4 Ų | 114.4 | 79% | 0.789 | 69% | 0.688 | S | S | * | * | trans | -74.5 | 99.2 | 179.1 | -149.1 | -94.5 | 0 | 0 | 0 | 108.7 | H225 | F223-H225 PolarHBondContact O-N 2.96Š| ||
| 224 | Q | 58 | Low | 55.1 | Low | 131 Ų | 131 | 115.7 Ų | 115.7 | 61% | 0.612 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 122.9 | 176.4 | -65.4 | -82.2 | 57.8 | 0 | 0 | 109 | G222 | G222-Q224 PolarHBondContact O-N 2.88Å; G222-Q224 VanDerWaalsContact O-N 3.09Å |
| 225 | H | 59.3 | Low | 56.3 | Low | 85 Ų | 85 | 118 Ų | 118 | 39% | 0.394 | 69% | 0.69 | S | S | . | * | P | Polyproline II helix | trans | -94.1 | 168.7 | 166.8 | 68.4 | -93.7 | 0 | 0 | 0 | 110.4 | F223 A227 G228 L229 | F223-H225 PolarHBondContact O-N 2.96Å; H225-A227 PolarHBondContact O-N 2.92Å; H225-G228 PolarHBondContact O-N 3Å; H225-G228 VanDerWaalsContact O-N 3.08Å; H225-L229 PolarHBondContact CE1-O 3.4Å |
| 226 | W | 52.1 | Low | 57.3 | Low | 251 Ų | 251 | 115.2 Ų | 115.2 | 95% | 0.951 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -46.8 | 122.9 | -176.4 | -53.6 | 90.3 | 0 | 0 | 0 | 111.1 | ||
| 227 | A | 59.8 | Low | 58.1 | Low | 94 Ų | 94 | 116.4 Ų | 116.4 | 78% | 0.777 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 92.7 | 2.1 | -176 | 0 | 0 | 0 | 0 | 0 | 118.4 | H225 L229 | H225-A227 PolarHBondContact O-N 2.92Å; A227-L229 VanDerWaalsContact C-N 3.26Å; A227-L229 PolarHBondContact O-N 2.82Å |
| 228 | G | 65.4 | Low | 59.4 | Low | 43 Ų | 43 | 114.1 Ų | 114.1 | 44% | 0.443 | 65% | 0.653 | S | S | . | * | S | Bend | trans | 71.1 | 16.6 | 166.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | H225 | H225-G228 PolarHBondContact O-N 3Å; H225-G228 VanDerWaalsContact O-N 3.08Å |
| 229 | L | 67.9 | Low | 60.1 | Low | 114 Ų | 114 | 110 Ų | 110 | 60% | 0.597 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -93.3 | 143.8 | 173.3 | -65.5 | 170.1 | 0 | 0 | 0 | 110.5 | H225 A227 C231 | H225-L229 PolarHBondContact CE1-O 3.4Å; A227-L229 VanDerWaalsContact C-N 3.26Å; A227-L229 PolarHBondContact O-N 2.82Å; L229-C231 PolarHBondContact O-N 2.88Å |
| 230 | P | 65.9 | Low | 60.7 | Low | 111 Ų | 111 | 106.9 Ų | 106.9 | 72% | 0.721 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -65 | 134.1 | -180 | 25.6 | -32.7 | 0 | 0 | 0 | 111.4 | ||
| 231 | C | 66.6 | Low | 61.4 | Low | 36 Ų | 36 | 109 Ų | 109 | 24% | 0.243 | 64% | 0.635 | C | S | . | * | P | Polyproline II helix | trans | -63.5 | 129.2 | 176.7 | -171 | 0 | 0 | 0 | 0 | 110.2 | L229 C233 C236 | L229-C231 PolarHBondContact O-N 2.88Å; C231-C233 WeakPolarHBondContact CB-SG 3.42Å; C231-C233 PolarHBondContact O-N 2.67Å; C231-C233 VanDerWaalsContact O-N 3.15Å; C231-C233 WeakPolarHBondContact SG-CB 3.49Å; C231-C233 PolarHBondContact SG-N 3.47Å; C231-C233 VanDerWaalsContact SG-N 3.43Å; C231-C233 CovalentContact SG-SG 2.07Å; C231-C233 PolarHBondContact SG-SG 3.28Å; C231-C236 HydrophobicContact CB-CB 3.87Å |
| 232 | P | 64.8 | Low | 61.6 | Low | 121 Ų | 121 | 108.6 Ų | 108.6 | 79% | 0.786 | 63% | 0.629 | S | S | * | * | trans | -75.8 | 5.9 | 175.1 | 32.3 | -36.1 | 0 | 0 | 0 | 113.2 | ||||
| 233 | C | 67.7 | Low | 61.6 | Low | 40 Ų | 40 | 114.6 Ų | 114.6 | 27% | 0.27 | 64% | 0.644 | S | S | . | * | trans | -83.9 | 131.6 | -176.4 | 56 | 0 | 0 | 0 | 0 | 111.7 | C231 I235 C236 Q237 | C231-C233 WeakPolarHBondContact CB-SG 3.42Å; C231-C233 PolarHBondContact O-N 2.67Å; C231-C233 VanDerWaalsContact O-N 3.15Å; C231-C233 WeakPolarHBondContact SG-CB 3.49Å; C231-C233 PolarHBondContact SG-N 3.47Å; C231-C233 VanDerWaalsContact SG-N 3.43Å; C231-C233 CovalentContact SG-SG 2.07Å; C231-C233 PolarHBondContact SG-SG 3.28Å; C233-I235 PolarHBondContact O-N 3.26Å; C233-C236 PolarHBondContact O-N 3.03Å; C233-C236 WeakPolarHBondContact SG-CB 3.23Å; C233-C236 PolarHBondContact SG-SG 2.96Å; C233-Q237 PolarHBondContact O-N 2.91Å | ||
| 234 | T | 59.8 | Low | 61.9 | Low | 127 Ų | 127 | 113.3 Ų | 113.3 | 78% | 0.779 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.7 | -14.3 | 176.8 | 45.1 | 0 | 0 | 0 | 0 | 114.2 | ||
| 235 | I | 70.1 | Confident | 61.6 | Low | 160 Ų | 160 | 112.4 Ų | 112.4 | 82% | 0.821 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80 | -30 | 176.6 | -62 | 161.1 | 0 | 0 | 0 | 111.7 | C233 | C233-I235 PolarHBondContact O-N 3.26Š|
| 236 | C | 67.1 | Low | 61.2 | Low | 56 Ų | 56 | 116.1 Ų | 116.1 | 38% | 0.378 | 67% | 0.67 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -101 | -11.1 | -178.7 | -66.5 | 0 | 0 | 0 | 0 | 113.3 | C231 C233 V238 | C231-C236 HydrophobicContact CB-CB 3.87Å; C233-C236 PolarHBondContact O-N 3.03Å; C233-C236 WeakPolarHBondContact SG-CB 3.23Å; C233-C236 PolarHBondContact SG-SG 2.96Å; C236-V238 PolarHBondContact O-N 3.15Å |
| 237 | Q | 62.7 | Low | 61 | Low | 132 Ų | 132 | 109.9 Ų | 109.9 | 62% | 0.617 | 66% | 0.659 | S | S | * | * | trans | -84.2 | 109.8 | 179.1 | -156.6 | 149.9 | 24.2 | 0 | 0 | 109.9 | C233 | C233-Q237 PolarHBondContact O-N 2.91Š| ||
| 238 | V | 70.6 | Confident | 60.6 | Low | 108 Ų | 108 | 110.5 Ų | 110.5 | 66% | 0.655 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 124.1 | 172.8 | 177.9 | 0 | 0 | 0 | 0 | 107.9 | C236 | C236-V238 PolarHBondContact O-N 3.15Š|
| 239 | P | 57.5 | Low | 59.8 | Low | 104 Ų | 104 | 114.7 Ų | 114.7 | 68% | 0.675 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 139.9 | 178.3 | 23.9 | -31.5 | 0 | 0 | 0 | 110.3 | ||
| 240 | P | 60.1 | Low | 58.6 | Low | 113 Ų | 113 | 112.7 Ų | 112.7 | 73% | 0.734 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 140.4 | 178.8 | 25.7 | -32.8 | 0 | 0 | 0 | 110.2 | ||
| 241 | P | 55.1 | Low | 57.6 | Low | 109 Ų | 109 | 116.1 Ų | 116.1 | 71% | 0.708 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -65 | 144 | 178.4 | 26.3 | -32.7 | 0 | 0 | 0 | 110.6 | H243 | P241-H243 PolarHBondContact O-N 3.15Š|
| 242 | P | 58.9 | Low | 56.7 | Low | 114 Ų | 114 | 120.5 Ų | 120.5 | 74% | 0.74 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 130.1 | 177.7 | 26.3 | -32.9 | 0 | 0 | 0 | 110.2 | I244 | P242-I244 PolarHBondContact O-N 2.97Š|
| 243 | H | 53 | Low | 55.9 | Low | 178 Ų | 178 | 125 Ų | 125 | 82% | 0.824 | 72% | 0.721 | S | S | * | * | trans | -68.3 | 111.2 | 175.2 | 5.6 | -84.8 | 0 | 0 | 0 | 108.9 | P241 | P241-H243 PolarHBondContact O-N 3.15Š| ||
| 244 | I | 56.8 | Low | 54.7 | Low | 153 Ų | 153 | 131 Ų | 131 | 79% | 0.785 | 75% | 0.749 | S | S | * | * | trans | -87.4 | 117.1 | 167.6 | -7.4 | 173.8 | 0 | 0 | 0 | 106.7 | P242 I246 | P242-I244 PolarHBondContact O-N 2.97Å; I244-I246 PolarHBondContact O-N 3.07Å | ||
| 245 | P | 51.5 | Low | 54 | Low | 111 Ų | 111 | 130.3 Ų | 130.3 | 72% | 0.721 | 75% | 0.745 | S | S | * | * | trans | -68.6 | 121.1 | 175 | 26.6 | -30.6 | 0 | 0 | 0 | 109.2 | T247 | P245-T247 PolarHBondContact O-N 2.92Š| ||
| 246 | I | 51.3 | Low | 52.6 | Low | 163 Ų | 163 | 126.4 Ų | 126.4 | 84% | 0.836 | 74% | 0.743 | S | S | * | * | trans | -80.8 | 97.5 | 172.6 | -52.1 | 172.5 | 0 | 0 | 0 | 106.6 | I244 S248 | I244-I246 PolarHBondContact O-N 3.07Å; I246-S248 PolarHBondContact O-N 3.17Å | ||
| 247 | T | 47.8 | Very low | 51.4 | Low | 120 Ų | 120 | 133.4 Ų | 133.4 | 74% | 0.736 | 77% | 0.771 | S | S | * | * | trans | -77 | 101.4 | 169.7 | -27 | 0 | 0 | 0 | 0 | 108.1 | P245 T249 | P245-T247 PolarHBondContact O-N 2.92Å; T247-T249 PolarHBondContact O-N 2.8Å | ||
| 248 | S | 52.8 | Low | 50.4 | Low | 108 Ų | 108 | 130.6 Ų | 130.6 | 76% | 0.755 | 78% | 0.777 | S | S | * | * | trans | -84.6 | 99.2 | 169 | 68.1 | 0 | 0 | 0 | 0 | 109.6 | I246 | I246-S248 PolarHBondContact O-N 3.17Š| ||
| 249 | T | 46.8 | Very low | 49.1 | Very low | 131 Ų | 131 | 135 Ų | 135 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | -145.2 | 111.6 | 165.7 | 29.7 | 0 | 0 | 0 | 0 | 110.5 | T247 | T247-T249 PolarHBondContact O-N 2.8Š| ||
| 250 | G | 42.8 | Very low | 48.5 | Very low | 71 Ų | 71 | 137.6 Ų | 137.6 | 73% | 0.732 | 80% | 0.796 | S | S | * | * | trans | 97.7 | 81.3 | 143.4 | 0 | 0 | 0 | 0 | 0 | 118.1 | T252 | G250-T252 PolarHBondContact O-N 2.57Š| ||
| 251 | L | 46.4 | Very low | 47.6 | Very low | 184 Ų | 184 | 135.5 Ų | 135.5 | 96% | 0.963 | 80% | 0.795 | S | S | * | * | trans | -79 | 94.8 | 148 | -77.3 | 170.3 | 0 | 0 | 0 | 108.1 | R253 | L251-R253 PolarHBondContact O-N 3.35Š| ||
| 252 | T | 47.1 | Very low | 47.4 | Very low | 128 Ų | 128 | 138.4 Ų | 138.4 | 79% | 0.785 | 80% | 0.803 | S | S | * | * | trans | -88.3 | 103.9 | 164.2 | 35.8 | 0 | 0 | 0 | 0 | 109.7 | G250 L254 | G250-T252 PolarHBondContact O-N 2.57Å; T252-L254 PolarHBondContact O-N 3.48Å | ||
| 253 | R | 47.8 | Very low | 46.8 | Very low | 216 Ų | 216 | 145.9 Ų | 145.9 | 82% | 0.815 | 82% | 0.824 | S | S | * | * | trans | -56.3 | 116.6 | 162.2 | -176.5 | -175.3 | -175.4 | -147.1 | 2.1 | 109.3 | L251 | L251-R253 PolarHBondContact O-N 3.35Š| ||
| 254 | L | 42.2 | Very low | 46.5 | Very low | 166 Ų | 166 | 144.3 Ų | 144.3 | 87% | 0.869 | 82% | 0.824 | S | S | * | * | trans | -109.9 | 101.3 | 163.5 | -69.8 | 178.1 | 0 | 0 | 0 | 108.8 | T252 | T252-L254 PolarHBondContact O-N 3.48Š| ||
| 255 | T | 45.2 | Very low | 46 | Very low | 112 Ų | 112 | 143.8 Ų | 143.8 | 69% | 0.687 | 83% | 0.826 | S | S | * | * | trans | -72.7 | 132.1 | 154.7 | 39.5 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 256 | G | 41.8 | Very low | 45.7 | Very low | 77 Ų | 77 | 145.7 Ų | 145.7 | 79% | 0.794 | 83% | 0.832 | S | S | * | * | trans | -168.4 | 101.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 257 | E | 41 | Very low | 45.3 | Very low | 203 Ų | 203 | 144.6 Ų | 144.6 | 95% | 0.949 | 83% | 0.832 | S | S | * | * | trans | -66.8 | 159.8 | 174.6 | -56.4 | -153.6 | 132.1 | 0 | 0 | 112.7 | ||||
| 258 | G | 41.1 | Very low | 45.2 | Very low | 73 Ų | 73 | 146.2 Ų | 146.2 | 75% | 0.753 | 84% | 0.838 | S | S | * | * | trans | 149.5 | 99.5 | 152.3 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 259 | K | 44.2 | Very low | 44.7 | Very low | 201 Ų | 201 | 148.7 Ų | 148.7 | 87% | 0.874 | 84% | 0.844 | S | S | * | * | 102.5 | 113.8 | 120 | -153 | 164.5 | -177.3 | 173.8 | 0 | 118.2 | |||||
| 260 | D | 44.6 | Very low | 44.5 | Very low | 159 Ų | 159 | 150 Ų | 150 | 85% | 0.85 | 85% | 0.846 | S | S | * | * | trans | -44.4 | 154.9 | 161.5 | -49.9 | -85.6 | 0 | 0 | 0 | 114.7 | ||||
| 261 | G | 41.9 | Very low | 44.6 | Very low | 69 Ų | 69 | 156.1 Ų | 156.1 | 71% | 0.711 | 86% | 0.855 | S | S | * | * | trans | 141.8 | 95.5 | 149.9 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 262 | L | 51 | Low | 44.5 | Very low | 169 Ų | 169 | 153.8 Ų | 153.8 | 89% | 0.885 | 85% | 0.846 | S | S | * | * | 58.3 | 103.4 | 123.9 | -154 | 79.3 | 0 | 0 | 0 | 118.5 | |||||
| 263 | K | 46.2 | Very low | 44.3 | Very low | 272 Ų | 272 | 156.1 Ų | 156.1 | 100% | 1.183 | 85% | 0.852 | S | S | * | * | -178.5 | 0 | 99.4 | -132.6 | 165.6 | -178.1 | 175.8 | 0 | 111.3 |
Retrieved 263 of 263 residues in 84.7 ms
(Link to these results)