| 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 | 44.5 | Very low | 55.7 | Low | 233 Ų | 233 | 95.5 Ų | 95.5 | 100% | 1.148 | 61% | 0.611 | S | S | * | * | 0 | 5.3 | 0 | -75.4 | -173.7 | 150 | 0 | 0 | 115.1 | |||||
| 2 | A | 43.3 | Very low | 57.3 | Low | 86 Ų | 86 | 90.4 Ų | 90.4 | 71% | 0.711 | 59% | 0.589 | S | S | * | * | trans | -89.3 | -15.4 | -176.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 3 | G | 44.8 | Very low | 58.7 | Low | 51 Ų | 51 | 92.9 Ų | 92.9 | 53% | 0.526 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -78 | -35.2 | -174.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | V5 S6 L7 | G3-V5 PolarHBondContact O-N 3.13Å; G3-S6 PolarHBondContact O-N 2.93Å; G3-L7 PolarHBondContact O-N 3.35Å |
| 4 | A | 47.8 | Very low | 59.8 | Low | 76 Ų | 76 | 95.2 Ų | 95.2 | 63% | 0.628 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -71.4 | -32.7 | -175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | S6 L8 | A4-S6 VanDerWaalsContact C-N 3.33Å; A4-L8 PolarHBondContact O-N 3.34Å |
| 5 | V | 49.2 | Very low | 60.5 | Low | 113 Ų | 113 | 95.2 Ų | 95.2 | 69% | 0.685 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -70.1 | -34.6 | 176.5 | -173.9 | 0 | 0 | 0 | 0 | 110.7 | G3 G9 | G3-V5 PolarHBondContact O-N 3.13Å; V5-G9 PolarHBondContact O-N 3.37Å; V5-G9 VanDerWaalsContact O-N 3.1Å |
| 6 | S | 57 | Low | 61.1 | Low | 75 Ų | 75 | 95 Ų | 95 | 52% | 0.524 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -68.4 | -43.1 | 178.2 | -171.6 | 0 | 0 | 0 | 0 | 111.9 | G3 A4 L8 G9 V10 | G3-S6 PolarHBondContact O-N 2.93Å; A4-S6 VanDerWaalsContact C-N 3.33Å; S6-L8 PolarHBondContact O-N 2.94Å; S6-G9 PolarHBondContact O-N 3.35Å; S6-V10 VanDerWaalsContact O-CG2 3.28Å; S6-V10 WeakPolarHBondContact O-CG2 3.47Å; S6-V10 PolarHBondContact O-N 3.12Å |
| 7 | L | 57.5 | Low | 61.2 | Low | 97 Ų | 97 | 93.8 Ų | 93.8 | 51% | 0.508 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -63.6 | -41.5 | 177.6 | -78.2 | 163.6 | 0 | 0 | 0 | 112.6 | G3 G9 V10 V11 | G3-L7 PolarHBondContact O-N 3.35Å; L7-G9 VanDerWaalsContact C-N 3.32Å; L7-G9 PolarHBondContact O-N 3.21Å; L7-V10 PolarHBondContact O-N 3.5Å; L7-V11 WeakPolarHBondContact O-CB 3.09Å; L7-V11 VanDerWaalsContact O-CG2 3.24Å; L7-V11 WeakPolarHBondContact O-CG2 3.39Å; L7-V11 PolarHBondContact O-N 2.95Å |
| 8 | L | 59.8 | Low | 61.2 | Low | 123 Ų | 123 | 92 Ų | 92 | 64% | 0.644 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -65.5 | -38.3 | 176.7 | -157.7 | 76.4 | 0 | 0 | 0 | 111.5 | A4 S6 G12 | A4-L8 PolarHBondContact O-N 3.34Å; S6-L8 PolarHBondContact O-N 2.94Å; L8-G12 PolarHBondContact O-N 3Å |
| 9 | G | 68.4 | Low | 60.8 | Low | 36 Ų | 36 | 93.1 Ų | 93.1 | 37% | 0.371 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -65.3 | -43.2 | 174 | 0 | 0 | 0 | 0 | 0 | 112.9 | V5 S6 L7 G12 L13 | V5-G9 PolarHBondContact O-N 3.37Å; V5-G9 VanDerWaalsContact O-N 3.1Å; S6-G9 PolarHBondContact O-N 3.35Å; L7-G9 VanDerWaalsContact C-N 3.32Å; L7-G9 PolarHBondContact O-N 3.21Å; G9-G12 PolarHBondContact O-N 2.99Å; G9-L13 WeakPolarHBondContact O-CB 3.33Å; G9-L13 WeakPolarHBondContact O-CD1 3.4Å; G9-L13 PolarHBondContact O-N 3.47Å |
| 10 | V | 69.9 | Low | 60.8 | Low | 83 Ų | 83 | 92.3 Ų | 92.3 | 50% | 0.503 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -66.9 | -43.5 | 177.7 | 172.6 | 0 | 0 | 0 | 0 | 110.9 | S6 L7 L13 L14 | S6-V10 VanDerWaalsContact O-CG2 3.28Å; S6-V10 WeakPolarHBondContact O-CG2 3.47Å; S6-V10 PolarHBondContact O-N 3.12Å; L7-V10 PolarHBondContact O-N 3.5Å; V10-L13 PolarHBondContact O-N 3.44Å; V10-L14 WeakPolarHBondContact O-CB 3.44Å; V10-L14 PolarHBondContact O-N 2.82Å |
| 11 | V | 70.5 | Confident | 60.4 | Low | 78 Ų | 78 | 90.2 Ų | 90.2 | 47% | 0.473 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.5 | -41.3 | 175.6 | 171 | 0 | 0 | 0 | 0 | 110.9 | L7 L14 L15 | L7-V11 WeakPolarHBondContact O-CB 3.09Å; L7-V11 VanDerWaalsContact O-CG2 3.24Å; L7-V11 WeakPolarHBondContact O-CG2 3.39Å; L7-V11 PolarHBondContact O-N 2.95Å; V11-L14 PolarHBondContact O-N 3.47Å; V11-L15 HydrophobicContact CG1-CD1 3.81Å; V11-L15 WeakPolarHBondContact O-CB 3.49Å; V11-L15 PolarHBondContact O-N 2.86Å |
| 12 | G | 75.3 | Confident | 60.7 | Low | 34 Ų | 34 | 84.8 Ų | 84.8 | 35% | 0.351 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -60.9 | -45.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | L8 G9 L15 V16 | L8-G12 PolarHBondContact O-N 3Å; G9-G12 PolarHBondContact O-N 2.99Å; G12-L15 PolarHBondContact O-N 3.43Å; G12-V16 WeakPolarHBondContact O-CB 3.13Å; G12-V16 WeakPolarHBondContact O-CG2 3.48Å; G12-V16 PolarHBondContact O-N 3.29Å |
| 13 | L | 74.8 | Confident | 60.7 | Low | 123 Ų | 123 | 87.3 Ų | 87.3 | 64% | 0.644 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64 | -39.6 | 174.6 | -104.3 | 85.6 | 0 | 0 | 0 | 112.1 | G9 V10 V16 S17 | G9-L13 WeakPolarHBondContact O-CB 3.33Å; G9-L13 WeakPolarHBondContact O-CD1 3.4Å; G9-L13 PolarHBondContact O-N 3.47Å; V10-L13 PolarHBondContact O-N 3.44Å; L13-V16 PolarHBondContact O-N 2.82Å; L13-S17 VanDerWaalsContact O-CB 3.23Å; L13-S17 WeakPolarHBondContact O-CB 3.46Å; L13-S17 PolarHBondContact O-N 3.17Å; L13-S17 PolarHBondContact O-OG 3.45Å |
| 14 | L | 74.4 | Confident | 60.7 | Low | 125 Ų | 125 | 86.8 Ų | 86.8 | 65% | 0.654 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -66.7 | -40.8 | 179.7 | -151.6 | 104.2 | 0 | 0 | 0 | 111 | V10 V11 S17 A18 | V10-L14 WeakPolarHBondContact O-CB 3.44Å; V10-L14 PolarHBondContact O-N 2.82Å; V11-L14 PolarHBondContact O-N 3.47Å; L14-S17 PolarHBondContact O-N 3.28Å; L14-A18 VanDerWaalsContact O-CB 3.26Å; L14-A18 WeakPolarHBondContact O-CB 3.29Å; L14-A18 PolarHBondContact O-N 3.45Å |
| 15 | L | 70.4 | Confident | 60.7 | Low | 95 Ų | 95 | 90.7 Ų | 90.7 | 50% | 0.497 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.2 | -45.6 | 174.6 | -101.1 | 137.7 | 0 | 0 | 0 | 112.1 | V11 G12 S17 A18 L19 | V11-L15 HydrophobicContact CG1-CD1 3.81Å; V11-L15 WeakPolarHBondContact O-CB 3.49Å; V11-L15 PolarHBondContact O-N 2.86Å; G12-L15 PolarHBondContact O-N 3.43Å; L15-S17 VanDerWaalsContact C-N 3.35Å; L15-A18 PolarHBondContact O-N 3.06Å; L15-L19 WeakPolarHBondContact O-CB 3.45Å; L15-L19 WeakPolarHBondContact O-CD1 3.43Å; L15-L19 PolarHBondContact O-N 3.26Å |
| 16 | V | 69.8 | Low | 60.6 | Low | 92 Ų | 92 | 96.5 Ų | 96.5 | 56% | 0.558 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -63 | -42.5 | 175.4 | 163.5 | 0 | 0 | 0 | 0 | 110.9 | G12 L13 L19 S20 | G12-V16 WeakPolarHBondContact O-CB 3.13Å; G12-V16 WeakPolarHBondContact O-CG2 3.48Å; G12-V16 PolarHBondContact O-N 3.29Å; L13-V16 PolarHBondContact O-N 2.82Å; V16-L19 PolarHBondContact O-N 3.26Å; V16-S20 WeakPolarHBondContact O-CB 3.28Å; V16-S20 PolarHBondContact O-N 3.48Å; V16-S20 PolarHBondContact O-OG 2.97Å |
| 17 | S | 62.7 | Low | 59.8 | Low | 75 Ų | 75 | 96.7 Ų | 96.7 | 52% | 0.524 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -68.5 | -36.9 | 178.9 | -57.2 | 0 | 0 | 0 | 0 | 112.3 | L13 L14 L15 S20 G21 | L13-S17 VanDerWaalsContact O-CB 3.23Å; L13-S17 WeakPolarHBondContact O-CB 3.46Å; L13-S17 PolarHBondContact O-N 3.17Å; L13-S17 PolarHBondContact O-OG 3.45Å; L14-S17 PolarHBondContact O-N 3.28Å; L15-S17 VanDerWaalsContact C-N 3.35Å; S17-S20 PolarHBondContact O-N 3.38Å; S17-G21 PolarHBondContact O-N 3Å |
| 18 | A | 61.4 | Low | 59.4 | Low | 61 Ų | 61 | 98.8 Ų | 98.8 | 50% | 0.504 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -68.5 | -39.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L14 L15 G21 V22 | L14-A18 VanDerWaalsContact O-CB 3.26Å; L14-A18 WeakPolarHBondContact O-CB 3.29Å; L14-A18 PolarHBondContact O-N 3.45Å; L15-A18 PolarHBondContact O-N 3.06Å; A18-G21 PolarHBondContact O-N 2.83Å; A18-V22 WeakPolarHBondContact O-CB 3.45Å; A18-V22 PolarHBondContact O-N 2.8Å |
| 19 | L | 54 | Low | 58.7 | Low | 113 Ų | 113 | 98.1 Ų | 98.1 | 59% | 0.592 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -64.8 | -43.3 | 172.8 | -104.8 | 72.5 | 0 | 0 | 0 | 111.7 | L15 V16 G21 V22 L23 | L15-L19 WeakPolarHBondContact O-CB 3.45Å; L15-L19 WeakPolarHBondContact O-CD1 3.43Å; L15-L19 PolarHBondContact O-N 3.26Å; V16-L19 PolarHBondContact O-N 3.26Å; L19-G21 VanDerWaalsContact C-N 3.34Å; L19-V22 PolarHBondContact O-N 3.29Å; L19-L23 WeakPolarHBondContact O-CB 3.46Å; L19-L23 PolarHBondContact O-N 2.99Å |
| 20 | S | 60.3 | Low | 57.7 | Low | 76 Ų | 76 | 103 Ų | 103 | 53% | 0.531 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -68.8 | -31 | 175.1 | -72.7 | 0 | 0 | 0 | 0 | 112.7 | V16 S17 G24 | V16-S20 WeakPolarHBondContact O-CB 3.28Å; V16-S20 PolarHBondContact O-N 3.48Å; V16-S20 PolarHBondContact O-OG 2.97Å; S17-S20 PolarHBondContact O-N 3.38Å; S20-G24 WeakPolarHBondContact O-CA 3.33Å; S20-G24 PolarHBondContact O-N 2.89Å |
| 21 | G | 52 | Low | 56.6 | Low | 49 Ų | 49 | 107.4 Ų | 107.4 | 51% | 0.505 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -69.8 | -38.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | S17 A18 L19 | S17-G21 PolarHBondContact O-N 3Å; A18-G21 PolarHBondContact O-N 2.83Å; L19-G21 VanDerWaalsContact C-N 3.34Å |
| 22 | V | 52.2 | Low | 55.4 | Low | 120 Ų | 120 | 115 Ų | 115 | 73% | 0.727 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -76.9 | -28.5 | 177.6 | 103.8 | 0 | 0 | 0 | 0 | 112.8 | A18 L19 | A18-V22 WeakPolarHBondContact O-CB 3.45Å; A18-V22 PolarHBondContact O-N 2.8Å; L19-V22 PolarHBondContact O-N 3.29Å |
| 23 | L | 43.1 | Very low | 54 | Low | 138 Ų | 138 | 118 Ų | 118 | 72% | 0.723 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -90.9 | -26.1 | 177.2 | -158.9 | 68.9 | 0 | 0 | 0 | 112.6 | L19 | L19-L23 WeakPolarHBondContact O-CB 3.46Å; L19-L23 PolarHBondContact O-N 2.99Å |
| 24 | G | 45.2 | Very low | 52 | Low | 40 Ų | 40 | 120.8 Ų | 120.8 | 41% | 0.412 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -78 | -23.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | S20 R26 A27 | S20-G24 WeakPolarHBondContact O-CA 3.33Å; S20-G24 PolarHBondContact O-N 2.89Å; G24-R26 PolarHBondContact O-N 2.74Å; G24-A27 PolarHBondContact O-N 3.4Å; G24-A27 VanDerWaalsContact O-N 3.09Å |
| 25 | D | 46.7 | Very low | 51 | Low | 159 Ų | 159 | 119.9 Ų | 119.9 | 85% | 0.85 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.5 | -3 | 175.4 | -140.3 | 19.5 | 0 | 0 | 0 | 112.9 | ||
| 26 | R | 47.1 | Very low | 49.6 | Very low | 235 Ų | 235 | 119.1 Ų | 119.1 | 89% | 0.887 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.9 | -3.5 | 172.4 | -110.6 | -172.2 | 174.8 | 139.3 | 0 | 115.1 | G24 N28 | G24-R26 PolarHBondContact O-N 2.74Å; R26-N28 PolarHBondContact O-N 3.38Å |
| 27 | A | 40.7 | Very low | 48.2 | Very low | 79 Ų | 79 | 122.5 Ų | 122.5 | 65% | 0.653 | 71% | 0.712 | S | S | * | * | trans | -99.7 | 56.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | G24 | G24-A27 PolarHBondContact O-N 3.4Å; G24-A27 VanDerWaalsContact O-N 3.09Å | ||
| 28 | N | 48 | Very low | 47 | Very low | 140 Ų | 140 | 123.6 Ų | 123.6 | 75% | 0.749 | 73% | 0.725 | S | S | * | * | trans | -143.8 | 84.7 | 156.7 | -174.6 | 7.9 | 0 | 0 | 0 | 110.7 | R26 | R26-N28 PolarHBondContact O-N 3.38Š| ||
| 29 | P | 45.7 | Very low | 46.1 | Very low | 109 Ų | 109 | 125.3 Ų | 125.3 | 71% | 0.708 | 74% | 0.74 | S | S | * | * | trans | -97.5 | 126.3 | 152 | 30.5 | -16.9 | 0 | 0 | 0 | 109.5 | ||||
| 30 | D | 47 | Very low | 45.4 | Very low | 138 Ų | 138 | 128.4 Ų | 128.4 | 74% | 0.738 | 75% | 0.751 | S | S | * | * | trans | 65.7 | 88.1 | 157.2 | -80.9 | -32.4 | 0 | 0 | 0 | 119.2 | ||||
| 31 | L | 47.1 | Very low | 44.8 | Very low | 177 Ų | 177 | 130.4 Ų | 130.4 | 93% | 0.927 | 76% | 0.762 | S | S | * | * | trans | -119.6 | 50.8 | 133.5 | -136.8 | 102.9 | 0 | 0 | 0 | 110.8 | ||||
| 32 | R | 44.8 | Very low | 43.8 | Very low | 236 Ų | 236 | 131.7 Ų | 131.7 | 89% | 0.891 | 78% | 0.775 | S | S | * | * | trans | -96.8 | 79.4 | 168 | -154.6 | -172.8 | -150.5 | -156.2 | 7.6 | 109.8 | ||||
| 33 | A | 46 | Very low | 43.5 | Very low | 97 Ų | 97 | 132.5 Ų | 132.5 | 80% | 0.802 | 79% | 0.786 | S | S | * | * | trans | -135.5 | 78.9 | 162 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 34 | H | 34.6 | Very low | 43.1 | Very low | 183 Ų | 183 | 129.5 Ų | 129.5 | 85% | 0.847 | 79% | 0.789 | S | S | * | * | trans | -148.2 | 138.5 | 155 | -145.2 | 54.6 | 0 | 0 | 0 | 111.1 | ||||
| 35 | P | 52.1 | Low | 43.2 | Very low | 105 Ų | 105 | 132.3 Ų | 132.3 | 68% | 0.682 | 81% | 0.808 | S | S | * | * | trans | -90.2 | 157.6 | -139 | 35 | -34.4 | 0 | 0 | 0 | 113.6 | ||||
| 36 | G | 40.9 | Very low | 42.7 | Very low | 80 Ų | 80 | 131.2 Ų | 131.2 | 83% | 0.825 | 81% | 0.807 | S | S | * | * | trans | -66.3 | 144.7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 37 | N | 40.9 | Very low | 42.3 | Very low | 162 Ų | 162 | 126.4 Ų | 126.4 | 87% | 0.866 | 80% | 0.795 | S | S | * | * | trans | -171.3 | 117.5 | 136.2 | -163.7 | -4.8 | 0 | 0 | 0 | 108.7 | ||||
| 38 | A | 37.9 | Very low | 42.7 | Very low | 98 Ų | 98 | 128.8 Ų | 128.8 | 81% | 0.81 | 80% | 0.804 | S | S | * | * | trans | -176 | 125.1 | 142.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 39 | A | 41.8 | Very low | 42.5 | Very low | 98 Ų | 98 | 131.6 Ų | 131.6 | 81% | 0.81 | 80% | 0.804 | S | S | * | * | trans | -56.5 | 151.8 | -179 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 40 | H | 39.3 | Very low | 42.9 | Very low | 178 Ų | 178 | 138.1 Ų | 138.1 | 82% | 0.824 | 81% | 0.814 | S | S | * | * | trans | -58.1 | 167.6 | 153.7 | -133.8 | 61.2 | 0 | 0 | 0 | 110.5 | ||||
| 41 | P | 48.1 | Very low | 43 | Very low | 117 Ų | 117 | 142.6 Ų | 142.6 | 76% | 0.76 | 82% | 0.821 | S | S | * | * | cis | -142.9 | 175.6 | 18 | 41.1 | -20.9 | 0 | 0 | 0 | 115.7 | ||||
| 42 | G | 31.7 | Very low | 43.4 | Very low | 76 Ų | 76 | 139.7 Ų | 139.7 | 78% | 0.784 | 81% | 0.812 | S | S | * | * | trans | 175 | 85.4 | 167.6 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 43 | S | 44.8 | Very low | 43.5 | Very low | 137 Ų | 137 | 133.8 Ų | 133.8 | 96% | 0.958 | 81% | 0.805 | S | S | * | * | trans | -77 | 132.1 | 170.6 | 179.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 44 | G | 35 | Very low | 43.7 | Very low | 76 Ų | 76 | 135.8 Ų | 135.8 | 78% | 0.784 | 80% | 0.801 | S | S | * | * | trans | -170.5 | 113.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 45 | A | 46.7 | Very low | 44.2 | Very low | 98 Ų | 98 | 135.1 Ų | 135.1 | 81% | 0.81 | 80% | 0.796 | S | S | * | * | trans | -77.5 | 149.7 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 46 | T | 36.4 | Very low | 43.9 | Very low | 137 Ų | 137 | 135.2 Ų | 135.2 | 84% | 0.84 | 79% | 0.791 | S | S | * | * | trans | 145.9 | 105 | 135.8 | -56.9 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 47 | E | 39.2 | Very low | 44.2 | Very low | 133 Ų | 133 | 137 Ų | 137 | 62% | 0.621 | 78% | 0.778 | S | S | * | * | 173.6 | 118.2 | 126.6 | -159.9 | 179.8 | 151 | 0 | 0 | 110.5 | R49 | E47-R49 VanDerWaalsContact C-N 3.35Å; E47-R49 HydrophobicContact CG-CB 4.37Å; E47-R49 PolarHBondContact O-N 2.86Å; E47-R49 WeakPolarHBondContact OE1-CD 3.44Å; E47-R49 IonicContact OE1-NH1 3.81Å | |||
| 48 | P | 48.7 | Very low | 44.4 | Very low | 130 Ų | 130 | 139.5 Ų | 139.5 | 84% | 0.844 | 78% | 0.775 | S | S | * | * | trans | -87.9 | 73.2 | 171.7 | 34.3 | -29.1 | 0 | 0 | 0 | 109.6 | R50 | P48-R50 PolarHBondContact O-N 3.35Å; P48-R50 VanDerWaalsContact O-N 3.15Å | ||
| 49 | R | 44.4 | Very low | 44.8 | Very low | 199 Ų | 199 | 141.6 Ų | 141.6 | 75% | 0.751 | 77% | 0.768 | S | S | * | * | trans | -82.5 | 97.6 | 178.4 | -157.5 | 171.5 | -174.2 | 152.4 | -4.5 | 110.3 | E47 R51 | E47-R49 VanDerWaalsContact C-N 3.35Å; E47-R49 HydrophobicContact CG-CB 4.37Å; E47-R49 PolarHBondContact O-N 2.86Å; E47-R49 WeakPolarHBondContact OE1-CD 3.44Å; E47-R49 IonicContact OE1-NH1 3.81Å; R49-R51 PolarHBondContact O-N 2.93Å; R49-R51 VanDerWaalsContact O-N 3.11Å | ||
| 50 | R | 53.8 | Low | 44.9 | Very low | 246 Ų | 246 | 146.2 Ų | 146.2 | 93% | 0.928 | 76% | 0.764 | S | S | * | * | trans | -31.4 | 111.7 | 166.1 | -80.4 | -178.7 | 175.6 | 151.2 | -2.4 | 111.5 | P48 | P48-R50 PolarHBondContact O-N 3.35Å; P48-R50 VanDerWaalsContact O-N 3.15Å | ||
| 51 | R | 49.8 | Very low | 45.2 | Very low | 231 Ų | 231 | 142.3 Ų | 142.3 | 87% | 0.872 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -101.5 | 135.4 | 157.2 | -72.7 | -171.4 | -167.4 | 180 | 4.6 | 108.5 | R49 | R49-R51 PolarHBondContact O-N 2.93Å; R49-R51 VanDerWaalsContact O-N 3.11Å |
| 52 | P | 53.9 | Low | 45.2 | Very low | 116 Ų | 116 | 147.5 Ų | 147.5 | 75% | 0.753 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 156 | -177.5 | 20.5 | -28.3 | 0 | 0 | 0 | 112.4 | ||
| 53 | P | 46.8 | Very low | 45.9 | Very low | 113 Ų | 113 | 147.4 Ų | 147.4 | 73% | 0.734 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 141.4 | -164.1 | 26.9 | -33.1 | 0 | 0 | 0 | 111.8 | K55 | P53-K55 PolarHBondContact O-N 2.88Š|
| 54 | L | 51.7 | Low | 46.2 | Very low | 139 Ų | 139 | 144.3 Ų | 144.3 | 73% | 0.728 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.3 | 31.2 | 173.8 | -117.5 | 95.4 | 0 | 0 | 0 | 114.6 | ||
| 55 | K | 44.8 | Very low | 47.1 | Very low | 168 Ų | 168 | 144.9 Ų | 144.9 | 73% | 0.73 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.5 | -25.9 | -171.1 | -148.3 | 165.8 | 179.3 | -178.1 | 0 | 113.3 | P53 | P53-K55 PolarHBondContact O-N 2.88Š|
| 56 | D | 46.2 | Very low | 47.6 | Very low | 107 Ų | 107 | 145.3 Ų | 145.3 | 57% | 0.572 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | -12.1 | 176.1 | -76.4 | -5.2 | 0 | 0 | 0 | 114.2 | R58 E59 R60 | D56-R58 VanDerWaalsContact C-N 3.34Å; D56-E59 PolarHBondContact O-N 2.95Å; D56-R60 PolarHBondContact O-N 3.26Å |
| 57 | Q | 46.3 | Very low | 48.9 | Very low | 118 Ų | 118 | 142.8 Ų | 142.8 | 55% | 0.551 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -70.7 | -34.7 | 179.3 | -167.4 | -178.3 | 88.5 | 0 | 0 | 111 | E59 R60 T61 | Q57-E59 VanDerWaalsContact C-N 3.26Å; Q57-E59 PolarHBondContact O-N 2.97Å; Q57-R60 PolarHBondContact O-N 3.49Å; Q57-T61 HydrophobicContact CG-CG2 4.29Å; Q57-T61 WeakPolarHBondContact O-CG2 3.36Å; Q57-T61 PolarHBondContact O-N 3.43Å; Q57-T61 PolarHBondContact O-OG1 3.24Å |
| 58 | R | 45.1 | Very low | 49.9 | Very low | 215 Ų | 215 | 143.7 Ų | 143.7 | 81% | 0.811 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -67.9 | -26.3 | 178.3 | -160.3 | 177.5 | -157.6 | -144.3 | 4.5 | 112.7 | D56 T61 | D56-R58 VanDerWaalsContact C-N 3.34Å; R58-T61 WeakPolarHBondContact CA-OG1 3.43Å; R58-T61 PolarHBondContact O-OG1 3.41Å |
| 59 | E | 45.5 | Very low | 50.7 | Low | 141 Ų | 141 | 139.7 Ų | 139.7 | 66% | 0.659 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -83.4 | -36.9 | 172.7 | -74.8 | 175.9 | 154.3 | 0 | 0 | 111.6 | D56 Q57 R62 A63 | D56-E59 PolarHBondContact O-N 2.95Å; Q57-E59 VanDerWaalsContact C-N 3.26Å; Q57-E59 PolarHBondContact O-N 2.97Å; E59-R62 PolarHBondContact O-N 3.43Å; E59-A63 PolarHBondContact O-N 2.67Å |
| 60 | R | 45.5 | Very low | 52.1 | Low | 195 Ų | 195 | 131.7 Ų | 131.7 | 74% | 0.736 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -71.2 | -26.9 | 173.3 | -77.6 | -173.1 | -174.6 | -179.7 | 2.6 | 114.7 | D56 Q57 R62 A63 G64 | D56-R60 PolarHBondContact O-N 3.26Å; Q57-R60 PolarHBondContact O-N 3.49Å; R60-R62 VanDerWaalsContact C-N 3.27Å; R60-A63 PolarHBondContact O-N 2.91Å; R60-G64 PolarHBondContact O-N 2.95Å |
| 61 | T | 45.9 | Very low | 53.2 | Low | 97 Ų | 97 | 123.9 Ų | 123.9 | 60% | 0.595 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77 | -15.1 | 173 | 51.2 | 0 | 0 | 0 | 0 | 112.8 | Q57 R58 | Q57-T61 HydrophobicContact CG-CG2 4.29Å; Q57-T61 WeakPolarHBondContact O-CG2 3.36Å; Q57-T61 PolarHBondContact O-N 3.43Å; Q57-T61 PolarHBondContact O-OG1 3.24Å; R58-T61 WeakPolarHBondContact CA-OG1 3.43Å; R58-T61 PolarHBondContact O-OG1 3.41Å |
| 62 | R | 46.4 | Very low | 54.1 | Low | 226 Ų | 226 | 120.8 Ų | 120.8 | 85% | 0.853 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91 | -16.1 | 170.5 | -151.7 | 178.2 | -158.2 | -167.5 | 4.3 | 112.8 | E59 R60 | E59-R62 PolarHBondContact O-N 3.43Å; R60-R62 VanDerWaalsContact C-N 3.27Å |
| 63 | A | 46.6 | Very low | 55.2 | Low | 74 Ų | 74 | 119.5 Ų | 119.5 | 61% | 0.612 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -87.3 | -11.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | E59 R60 | E59-A63 PolarHBondContact O-N 2.67Å; R60-A63 PolarHBondContact O-N 2.91Å |
| 64 | G | 51.7 | Low | 56.6 | Low | 71 Ų | 71 | 116.8 Ų | 116.8 | 73% | 0.732 | 62% | 0.615 | S | S | * | * | S | Bend | trans | -94.5 | -10.1 | -170.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | R60 | R60-G64 PolarHBondContact O-N 2.95Š|
| 65 | S | 53.8 | Low | 57.8 | Low | 88 Ų | 88 | 112.5 Ų | 112.5 | 62% | 0.615 | 60% | 0.6 | S | S | * | * | trans | -115.8 | 74.8 | 172.6 | 68.4 | 0 | 0 | 0 | 0 | 108.4 | P67 | S65-P67 WeakPolarHBondContact O-CD 3.43Š| ||
| 66 | L | 56.4 | Low | 59.5 | Low | 107 Ų | 107 | 107.5 Ų | 107.5 | 56% | 0.56 | 58% | 0.583 | S | S | * | * | trans | -51.4 | 110.7 | 156.5 | -87.7 | 144.4 | 0 | 0 | 0 | 105.1 | L68 A70 L71 | L66-L68 PolarHBondContact O-N 3.02Å; L66-A70 HydrophobicContact CD2-CB 4.28Å; L66-L71 HydrophobicContact CB-CD1 4.3Å; L66-L71 HydrophobicContact CB-CD2 3.67Å; L66-L71 HydrophobicContact CB-CG 3.79Å; L66-L71 HydrophobicContact CD1-CD2 3.93Å; L66-L71 HydrophobicContact CD2-CD2 4.32Å; L66-L71 HydrophobicContact CG-CD2 4.18Å | ||
| 67 | P | 64.9 | Low | 61.2 | Low | 85 Ų | 85 | 105.2 Ų | 105.2 | 55% | 0.552 | 58% | 0.579 | S | S | * | * | trans | -55.2 | 140.1 | -176.1 | 18.6 | -27 | 0 | 0 | 0 | 106.7 | S65 G69 A70 L71 | S65-P67 WeakPolarHBondContact O-CD 3.43Å; P67-G69 CarbonylContact O-C 3.52Å; P67-G69 PolarHBondContact O-N 3.02Å; P67-A70 HydrophobicContact CG-CB 3.6Å; P67-A70 WeakPolarHBondContact O-CA 3.43Å; P67-A70 WeakPolarHBondContact O-CB 3.42Å; P67-A70 PolarHBondContact O-N 2.81Å; P67-L71 PolarHBondContact O-N 2.75Å; P67-L71 VanDerWaalsContact O-N 3.08Å | ||
| 68 | L | 60 | Low | 62.8 | Low | 151 Ų | 151 | 102.3 Ų | 102.3 | 79% | 0.791 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -51.9 | -30 | -177.4 | -166.6 | 66 | 0 | 0 | 0 | 111.4 | L66 L71 Y72 | L66-L68 PolarHBondContact O-N 3.02Å; L68-L71 PolarHBondContact O-N 3.19Å; L68-Y72 WeakPolarHBondContact O-CB 3.43Å; L68-Y72 PolarHBondContact O-N 3.41Å |
| 69 | G | 65.6 | Low | 64.3 | Low | 46 Ų | 46 | 97.6 Ų | 97.6 | 47% | 0.474 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -64.6 | -38.5 | 169.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | P67 Y72 T73 | P67-G69 CarbonylContact O-C 3.52Å; P67-G69 PolarHBondContact O-N 3.02Å; G69-Y72 PolarHBondContact O-N 3.39Å; G69-T73 WeakPolarHBondContact O-CG2 3.35Å; G69-T73 PolarHBondContact O-N 3.4Å; G69-T73 PolarHBondContact O-OG1 3.26Å |
| 70 | A | 74.4 | Confident | 66 | Low | 31 Ų | 31 | 94.6 Ų | 94.6 | 26% | 0.256 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -69.8 | -34.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | L66 P67 Y72 T73 A74 | L66-A70 HydrophobicContact CD2-CB 4.28Å; P67-A70 HydrophobicContact CG-CB 3.6Å; P67-A70 WeakPolarHBondContact O-CA 3.43Å; P67-A70 WeakPolarHBondContact O-CB 3.42Å; P67-A70 PolarHBondContact O-N 2.81Å; A70-Y72 VanDerWaalsContact C-N 3.33Å; A70-T73 VanDerWaalsContact CA-OG1 3.32Å; A70-T73 WeakPolarHBondContact CA-OG1 3.36Å; A70-T73 PolarHBondContact O-OG1 3.04Å; A70-T73 VanDerWaalsContact O-OG1 3.07Å; A70-A74 WeakPolarHBondContact O-CB 3.44Å; A70-A74 PolarHBondContact O-N 2.9Å |
| 71 | L | 75.3 | Confident | 67.7 | Low | 83 Ų | 83 | 90.4 Ų | 90.4 | 44% | 0.435 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -66.4 | -39.3 | 171.7 | -65.8 | 176.8 | 0 | 0 | 0 | 110.8 | L66 P67 L68 A75 | L66-L71 HydrophobicContact CB-CD1 4.3Å; L66-L71 HydrophobicContact CB-CD2 3.67Å; L66-L71 HydrophobicContact CB-CG 3.79Å; L66-L71 HydrophobicContact CD1-CD2 3.93Å; L66-L71 HydrophobicContact CD2-CD2 4.32Å; L66-L71 HydrophobicContact CG-CD2 4.18Å; P67-L71 PolarHBondContact O-N 2.75Å; P67-L71 VanDerWaalsContact O-N 3.08Å; L68-L71 PolarHBondContact O-N 3.19Å; L71-A75 VanDerWaalsContact O-CB 3.29Å; L71-A75 WeakPolarHBondContact O-CB 3.44Å; L71-A75 PolarHBondContact O-N 3.36Å |
| 72 | Y | 70.3 | Confident | 69 | Low | 166 Ų | 166 | 90.9 Ų | 90.9 | 65% | 0.651 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65.1 | -46.7 | 175.3 | -177.4 | -100.2 | 0 | 0 | 0 | 112.2 | L68 G69 A70 A74 A75 V76 | L68-Y72 WeakPolarHBondContact O-CB 3.43Å; L68-Y72 PolarHBondContact O-N 3.41Å; G69-Y72 PolarHBondContact O-N 3.39Å; A70-Y72 VanDerWaalsContact C-N 3.33Å; Y72-A74 PolarHBondContact O-N 3.4Å; Y72-A75 PolarHBondContact O-N 2.96Å; Y72-V76 HydrophobicContact CD1-CG2 4.3Å; Y72-V76 HydrophobicContact CE1-CG2 3.93Å; Y72-V76 HydrophobicContact CE2-CG2 4.28Å; Y72-V76 WeakPolarHBondContact O-CG2 3.34Å; Y72-V76 PolarHBondContact O-N 3.17Å |
| 73 | T | 76 | Confident | 70.4 | Confident | 88 Ų | 88 | 84.7 Ų | 84.7 | 54% | 0.54 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.8 | -38.8 | 176.8 | 52.1 | 0 | 0 | 0 | 0 | 112 | G69 A70 V76 A77 | G69-T73 WeakPolarHBondContact O-CG2 3.35Å; G69-T73 PolarHBondContact O-N 3.4Å; G69-T73 PolarHBondContact O-OG1 3.26Å; A70-T73 VanDerWaalsContact CA-OG1 3.32Å; A70-T73 WeakPolarHBondContact CA-OG1 3.36Å; A70-T73 PolarHBondContact O-OG1 3.04Å; A70-T73 VanDerWaalsContact O-OG1 3.07Å; T73-V76 PolarHBondContact O-N 3.42Å; T73-A77 WeakPolarHBondContact O-CB 3.32Å; T73-A77 PolarHBondContact O-N 3.49Å |
| 74 | A | 76.3 | Confident | 71.4 | Confident | 56 Ų | 56 | 84.9 Ų | 84.9 | 46% | 0.463 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.4 | -40.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | A70 Y72 A77 A78 | A70-A74 WeakPolarHBondContact O-CB 3.44Å; A70-A74 PolarHBondContact O-N 2.9Å; Y72-A74 PolarHBondContact O-N 3.4Å; A74-A77 PolarHBondContact O-N 3.04Å; A74-A78 WeakPolarHBondContact O-CB 3.33Å; A74-A78 PolarHBondContact O-N 2.9Å |
| 75 | A | 76.7 | Confident | 72.2 | Confident | 49 Ų | 49 | 85 Ų | 85 | 41% | 0.405 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67.1 | -43.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L71 Y72 A78 F79 | L71-A75 VanDerWaalsContact O-CB 3.29Å; L71-A75 WeakPolarHBondContact O-CB 3.44Å; L71-A75 PolarHBondContact O-N 3.36Å; Y72-A75 PolarHBondContact O-N 2.96Å; A75-A78 PolarHBondContact O-N 2.67Å; A75-F79 VanDerWaalsContact O-CB 3.27Å; A75-F79 WeakPolarHBondContact O-CB 3.34Å; A75-F79 PolarHBondContact O-N 3.15Å |
| 76 | V | 80.3 | Confident | 72.6 | Confident | 64 Ų | 64 | 83.1 Ų | 83.1 | 39% | 0.388 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64.8 | -44.3 | 175 | 174.2 | 0 | 0 | 0 | 0 | 110.6 | Y72 T73 F79 V80 | Y72-V76 HydrophobicContact CD1-CG2 4.3Å; Y72-V76 HydrophobicContact CE1-CG2 3.93Å; Y72-V76 HydrophobicContact CE2-CG2 4.28Å; Y72-V76 WeakPolarHBondContact O-CG2 3.34Å; Y72-V76 PolarHBondContact O-N 3.17Å; T73-V76 PolarHBondContact O-N 3.42Å; V76-F79 PolarHBondContact O-N 2.68Å; V76-V80 HydrophobicContact CG1-CG2 4.35Å; V76-V80 WeakPolarHBondContact O-CB 3.46Å; V76-V80 VanDerWaalsContact O-CG2 3.27Å; V76-V80 WeakPolarHBondContact O-CG2 3.41Å; V76-V80 PolarHBondContact O-N 3.49Å |
| 77 | A | 81.8 | Confident | 72.5 | Confident | 58 Ų | 58 | 79.2 Ų | 79.2 | 48% | 0.479 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -62.3 | -43.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | T73 A74 L81 | T73-A77 WeakPolarHBondContact O-CB 3.32Å; T73-A77 PolarHBondContact O-N 3.49Å; A74-A77 PolarHBondContact O-N 3.04Å; A77-L81 WeakPolarHBondContact O-CB 2.78Å; A77-L81 PolarHBondContact O-N 3.47Å |
| 78 | A | 80.1 | Confident | 72 | Confident | 58 Ų | 58 | 81.2 Ų | 81.2 | 48% | 0.479 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -66 | -37.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A74 A75 Y82 | A74-A78 WeakPolarHBondContact O-CB 3.33Å; A74-A78 PolarHBondContact O-N 2.9Å; A75-A78 PolarHBondContact O-N 2.67Å; A78-Y82 WeakPolarHBondContact O-CB 3.46Å; A78-Y82 PolarHBondContact O-N 3.07Å |
| 79 | F | 77.3 | Confident | 71.6 | Confident | 115 Ų | 115 | 79 Ų | 79 | 50% | 0.504 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -67.7 | -45.3 | 176.7 | 179.4 | -98.8 | 0 | 0 | 0 | 112.1 | A75 V76 Y82 K83 | A75-F79 VanDerWaalsContact O-CB 3.27Å; A75-F79 WeakPolarHBondContact O-CB 3.34Å; A75-F79 PolarHBondContact O-N 3.15Å; V76-F79 PolarHBondContact O-N 2.68Å; F79-Y82 PolarHBondContact O-N 2.69Å; F79-K83 HydrophobicContact CE1-CG 4.12Å; F79-K83 HydrophobicContact CE2-CG 4.46Å; F79-K83 HydrophobicContact CZ-CG 4.09Å; F79-K83 WeakPolarHBondContact O-CB 3.42Å; F79-K83 WeakPolarHBondContact O-CG 3.45Å; F79-K83 PolarHBondContact O-N 2.75Å |
| 80 | V | 81.6 | Confident | 70.9 | Confident | 78 Ų | 78 | 82 Ų | 82 | 47% | 0.473 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -64.4 | -45.1 | 175.3 | 174 | 0 | 0 | 0 | 0 | 109.9 | V76 Y82 K83 C84 | V76-V80 HydrophobicContact CG1-CG2 4.35Å; V76-V80 WeakPolarHBondContact O-CB 3.46Å; V76-V80 VanDerWaalsContact O-CG2 3.27Å; V76-V80 WeakPolarHBondContact O-CG2 3.41Å; V76-V80 PolarHBondContact O-N 3.49Å; V80-Y82 VanDerWaalsContact C-N 3.34Å; V80-Y82 PolarHBondContact O-N 3.09Å; V80-K83 PolarHBondContact O-N 3.48Å; V80-K83 VanDerWaalsContact O-N 3.15Å; V80-C84 WeakPolarHBondContact O-CB 3.3Å; V80-C84 PolarHBondContact O-N 2.61Å; V80-C84 PolarHBondContact O-SG 3.07Å; V80-C84 VanDerWaalsContact O-SG 3.33Å |
| 81 | L | 81.4 | Confident | 69.6 | Low | 108 Ų | 108 | 84.1 Ų | 84.1 | 57% | 0.565 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -62.3 | -41.3 | 176.7 | -167 | 63.7 | 0 | 0 | 0 | 110.9 | A77 K83 C84 L85 | A77-L81 WeakPolarHBondContact O-CB 2.78Å; A77-L81 PolarHBondContact O-N 3.47Å; L81-K83 PolarHBondContact O-N 2.8Å; L81-C84 CarbonylContact O-C 3.58Å; L81-C84 PolarHBondContact O-N 3.06Å; L81-L85 HydrophobicContact CD1-CD1 3.78Å; L81-L85 HydrophobicContact CD2-CD1 4.48Å; L81-L85 HydrophobicContact CG-CD1 3.56Å; L81-L85 WeakPolarHBondContact O-CB 3.44Å; L81-L85 WeakPolarHBondContact O-CD1 3.06Å; L81-L85 PolarHBondContact O-N 2.87Å |
| 82 | Y | 73.1 | Confident | 68.4 | Low | 107 Ų | 107 | 83 Ų | 83 | 42% | 0.42 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -64.5 | -35.5 | 173.7 | 175.3 | -116.5 | 0 | 0 | 0 | 113.1 | A78 F79 V80 Q86 | A78-Y82 WeakPolarHBondContact O-CB 3.46Å; A78-Y82 PolarHBondContact O-N 3.07Å; F79-Y82 PolarHBondContact O-N 2.69Å; V80-Y82 VanDerWaalsContact C-N 3.34Å; V80-Y82 PolarHBondContact O-N 3.09Å; Y82-Q86 HydrophobicContact CE2-CG 4.1Å; Y82-Q86 VanDerWaalsContact CZ-CD 3.4Å; Y82-Q86 WeakPolarHBondContact O-CB 3.44Å; Y82-Q86 PolarHBondContact O-N 2.87Å; Y82-Q86 PolarHBondContact O-NE2 3.37Å; Y82-Q86 PolarHBondContact OH-OE1 2.94Å |
| 83 | K | 74.7 | Confident | 67.3 | Low | 96 Ų | 96 | 80.7 Ų | 80.7 | 42% | 0.417 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -73.1 | -36.8 | 174.3 | -77.1 | -72.5 | 148.7 | -159.4 | 0 | 112.1 | F79 V80 L81 G87 | F79-K83 HydrophobicContact CE1-CG 4.12Å; F79-K83 HydrophobicContact CE2-CG 4.46Å; F79-K83 HydrophobicContact CZ-CG 4.09Å; F79-K83 WeakPolarHBondContact O-CB 3.42Å; F79-K83 WeakPolarHBondContact O-CG 3.45Å; F79-K83 PolarHBondContact O-N 2.75Å; V80-K83 PolarHBondContact O-N 3.48Å; V80-K83 VanDerWaalsContact O-N 3.15Å; L81-K83 PolarHBondContact O-N 2.8Å; K83-G87 PolarHBondContact O-N 2.86Å |
| 84 | C | 67.7 | Low | 66.1 | Low | 78 Ų | 78 | 81.4 Ų | 81.4 | 53% | 0.527 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -67.6 | -37.5 | 171.2 | -71.2 | 0 | 0 | 0 | 0 | 112 | V80 L81 G87 K88 | V80-C84 WeakPolarHBondContact O-CB 3.3Å; V80-C84 PolarHBondContact O-N 2.61Å; V80-C84 PolarHBondContact O-SG 3.07Å; V80-C84 VanDerWaalsContact O-SG 3.33Å; L81-C84 CarbonylContact O-C 3.58Å; L81-C84 PolarHBondContact O-N 3.06Å; C84-G87 CarbonylContact O-C 3.59Å; C84-G87 PolarHBondContact O-N 2.8Å; C84-K88 VanDerWaalsContact O-CB 3.26Å; C84-K88 WeakPolarHBondContact O-CB 3.34Å; C84-K88 PolarHBondContact O-N 3.16Å |
| 85 | L | 68.6 | Low | 64.6 | Low | 74 Ų | 74 | 85.1 Ų | 85.1 | 39% | 0.387 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -73.7 | -39.8 | 176.1 | -91.9 | 100.4 | 0 | 0 | 0 | 112.4 | L81 G87 K88 D89 | L81-L85 HydrophobicContact CD1-CD1 3.78Å; L81-L85 HydrophobicContact CD2-CD1 4.48Å; L81-L85 HydrophobicContact CG-CD1 3.56Å; L81-L85 WeakPolarHBondContact O-CB 3.44Å; L81-L85 WeakPolarHBondContact O-CD1 3.06Å; L81-L85 PolarHBondContact O-N 2.87Å; L85-G87 VanDerWaalsContact C-N 3.3Å; L85-G87 PolarHBondContact O-N 3.33Å; L85-K88 CarbonylContact O-C 3.49Å; L85-K88 WeakPolarHBondContact O-CA 3.01Å; L85-K88 PolarHBondContact O-N 2.98Å; L85-K88 VanDerWaalsContact O-N 3.07Å; L85-D89 PolarHBondContact O-N 2.78Å |
| 86 | Q | 62.3 | Low | 63.4 | Low | 48 Ų | 48 | 90.9 Ų | 90.9 | 22% | 0.224 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -55 | -52.5 | 168 | -91.2 | 166.1 | 113.5 | 0 | 0 | 109.1 | Y82 K88 D89 E90 | Y82-Q86 HydrophobicContact CE2-CG 4.1Å; Y82-Q86 VanDerWaalsContact CZ-CD 3.4Å; Y82-Q86 WeakPolarHBondContact O-CB 3.44Å; Y82-Q86 PolarHBondContact O-N 2.87Å; Y82-Q86 PolarHBondContact O-NE2 3.37Å; Y82-Q86 PolarHBondContact OH-OE1 2.94Å; Q86-K88 PolarHBondContact O-N 2.93Å; Q86-K88 VanDerWaalsContact O-N 3.16Å; Q86-D89 PolarHBondContact O-N 3.32Å; Q86-E90 VanDerWaalsContact C-CD 3.48Å; Q86-E90 WeakPolarHBondContact CB-OE1 3.28Å; Q86-E90 WeakPolarHBondContact O-CG 3.34Å; Q86-E90 PolarHBondContact O-N 3.47Å |
| 87 | G | 55 | Low | 61.9 | Low | 24 Ų | 24 | 95.3 Ų | 95.3 | 25% | 0.247 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -55.3 | -34.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | K83 C84 L85 E90 T91 | K83-G87 PolarHBondContact O-N 2.86Å; C84-G87 CarbonylContact O-C 3.59Å; C84-G87 PolarHBondContact O-N 2.8Å; L85-G87 VanDerWaalsContact C-N 3.3Å; L85-G87 PolarHBondContact O-N 3.33Å; G87-E90 WeakPolarHBondContact CA-OE1 3.07Å; G87-E90 PolarHBondContact N-OE1 3.15Å; G87-T91 WeakPolarHBondContact O-CB 3.43Å; G87-T91 WeakPolarHBondContact O-CG2 3.47Å; G87-T91 PolarHBondContact O-N 3.49Å; G87-T91 PolarHBondContact O-OG1 2.86Å |
| 88 | K | 53.4 | Low | 60.3 | Low | 127 Ų | 127 | 94 Ų | 94 | 55% | 0.552 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -77.9 | -32 | 177.6 | -160.7 | 174.5 | 68.2 | 165.1 | 0 | 113.8 | C84 L85 Q86 T91 A92 | C84-K88 VanDerWaalsContact O-CB 3.26Å; C84-K88 WeakPolarHBondContact O-CB 3.34Å; C84-K88 PolarHBondContact O-N 3.16Å; L85-K88 CarbonylContact O-C 3.49Å; L85-K88 WeakPolarHBondContact O-CA 3.01Å; L85-K88 PolarHBondContact O-N 2.98Å; L85-K88 VanDerWaalsContact O-N 3.07Å; Q86-K88 PolarHBondContact O-N 2.93Å; Q86-K88 VanDerWaalsContact O-N 3.16Å; K88-T91 VanDerWaalsContact CA-OG1 3.28Å; K88-T91 WeakPolarHBondContact CA-OG1 3.46Å; K88-T91 CarbonylContact O-C 3.57Å; K88-T91 PolarHBondContact O-OG1 2.84Å; K88-A92 WeakPolarHBondContact O-CA 3.11Å; K88-A92 WeakPolarHBondContact O-CB 3.19Å; K88-A92 PolarHBondContact O-N 3.03Å |
| 89 | D | 52.2 | Low | 58.7 | Low | 106 Ų | 106 | 94.4 Ų | 94.4 | 57% | 0.567 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -81.4 | -34.3 | 175.4 | -77.7 | -29.3 | 0 | 0 | 0 | 111.2 | L85 Q86 A92 V93 | L85-D89 PolarHBondContact O-N 2.78Å; Q86-D89 PolarHBondContact O-N 3.32Å; D89-A92 PolarHBondContact O-N 3.43Å; D89-V93 WeakPolarHBondContact O-CB 3.12Å; D89-V93 WeakPolarHBondContact O-CG2 3.32Å; D89-V93 PolarHBondContact O-N 2.79Å; D89-V93 VanDerWaalsContact O-N 3.09Å |
| 90 | E | 50.5 | Low | 57.5 | Low | 107 Ų | 107 | 96.9 Ų | 96.9 | 50% | 0.5 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -74.5 | -27.4 | 170.1 | 60.7 | -140.3 | 145.8 | 0 | 0 | 112.3 | Q86 G87 L94 | Q86-E90 VanDerWaalsContact C-CD 3.48Å; Q86-E90 WeakPolarHBondContact CB-OE1 3.28Å; Q86-E90 WeakPolarHBondContact O-CG 3.34Å; Q86-E90 PolarHBondContact O-N 3.47Å; G87-E90 WeakPolarHBondContact CA-OE1 3.07Å; G87-E90 PolarHBondContact N-OE1 3.15Å; E90-L94 WeakPolarHBondContact O-CB 3.41Å; E90-L94 WeakPolarHBondContact O-CD1 3.26Å; E90-L94 WeakPolarHBondContact O-CG 3.02Å; E90-L94 PolarHBondContact O-N 3.36Å |
| 91 | T | 47 | Very low | 56.3 | Low | 76 Ų | 76 | 100.5 Ų | 100.5 | 47% | 0.466 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -84.4 | -23.5 | 165.7 | 56.6 | 0 | 0 | 0 | 0 | 114 | G87 K88 V93 H95 | G87-T91 WeakPolarHBondContact O-CB 3.43Å; G87-T91 WeakPolarHBondContact O-CG2 3.47Å; G87-T91 PolarHBondContact O-N 3.49Å; G87-T91 PolarHBondContact O-OG1 2.86Å; K88-T91 VanDerWaalsContact CA-OG1 3.28Å; K88-T91 WeakPolarHBondContact CA-OG1 3.46Å; K88-T91 CarbonylContact O-C 3.57Å; K88-T91 PolarHBondContact O-OG1 2.84Å; T91-V93 VanDerWaalsContact C-N 3.33Å; T91-H95 VanDerWaalsContact O-CA 3.3Å; T91-H95 WeakPolarHBondContact O-CA 3.38Å; T91-H95 WeakPolarHBondContact O-CB 3.34Å; T91-H95 PolarHBondContact O-N 2.83Å |
| 92 | A | 50.5 | Low | 54.9 | Low | 60 Ų | 60 | 101.9 Ų | 101.9 | 50% | 0.496 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -70.7 | -36.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | K88 D89 | K88-A92 WeakPolarHBondContact O-CA 3.11Å; K88-A92 WeakPolarHBondContact O-CB 3.19Å; K88-A92 PolarHBondContact O-N 3.03Å; D89-A92 PolarHBondContact O-N 3.43Å |
| 93 | V | 47.6 | Very low | 54.1 | Low | 117 Ų | 117 | 99.2 Ų | 99.2 | 71% | 0.709 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -80.4 | -32.2 | 173.9 | 178.6 | 0 | 0 | 0 | 0 | 112.1 | D89 T91 | D89-V93 WeakPolarHBondContact O-CB 3.12Å; D89-V93 WeakPolarHBondContact O-CG2 3.32Å; D89-V93 PolarHBondContact O-N 2.79Å; D89-V93 VanDerWaalsContact O-N 3.09Å; T91-V93 VanDerWaalsContact C-N 3.33Å |
| 94 | L | 49.4 | Very low | 53.2 | Low | 104 Ų | 104 | 99.7 Ų | 99.7 | 55% | 0.545 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -89.1 | -23.8 | 176.2 | -71.5 | 168.2 | 0 | 0 | 0 | 115.3 | E90 E96 E97 A98 | E90-L94 WeakPolarHBondContact O-CB 3.41Å; E90-L94 WeakPolarHBondContact O-CD1 3.26Å; E90-L94 WeakPolarHBondContact O-CG 3.02Å; E90-L94 PolarHBondContact O-N 3.36Å; L94-E96 VanDerWaalsContact C-N 3.3Å; L94-E96 PolarHBondContact O-N 3.49Å; L94-E97 CarbonylContact O-C 3.57Å; L94-E97 PolarHBondContact O-N 2.91Å; L94-E97 VanDerWaalsContact O-N 3.17Å; L94-A98 WeakPolarHBondContact O-CA 3.04Å; L94-A98 WeakPolarHBondContact O-CB 3.36Å; L94-A98 PolarHBondContact O-N 2.85Å |
| 95 | H | 45.2 | Very low | 52.8 | Low | 133 Ų | 133 | 102 Ų | 102 | 62% | 0.616 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -74.1 | -25.3 | -178.3 | -177.5 | -90.8 | 0 | 0 | 0 | 111.7 | T91 E97 S99 | T91-H95 VanDerWaalsContact O-CA 3.3Å; T91-H95 WeakPolarHBondContact O-CA 3.38Å; T91-H95 WeakPolarHBondContact O-CB 3.34Å; T91-H95 PolarHBondContact O-N 2.83Å; H95-E97 PolarHBondContact O-N 3.29Å; H95-S99 WeakPolarHBondContact O-CB 3.14Å; H95-S99 PolarHBondContact O-N 3.5Å; H95-S99 PolarHBondContact O-OG 2.88Å |
| 96 | E | 51.2 | Low | 52.5 | Low | 171 Ų | 171 | 101.5 Ų | 101.5 | 80% | 0.799 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.4 | -28.4 | 169.8 | -155.6 | 174.8 | 108.9 | 0 | 0 | 111.6 | L94 | L94-E96 VanDerWaalsContact C-N 3.3Å; L94-E96 PolarHBondContact O-N 3.49Å |
| 97 | E | 48.8 | Very low | 52.9 | Low | 157 Ų | 157 | 104.9 Ų | 104.9 | 73% | 0.734 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -107.3 | -29 | 177.1 | -75.1 | -143.7 | 134.8 | 0 | 0 | 115.9 | L94 H95 | L94-E97 CarbonylContact O-C 3.57Å; L94-E97 PolarHBondContact O-N 2.91Å; L94-E97 VanDerWaalsContact O-N 3.17Å; H95-E97 PolarHBondContact O-N 3.29Å |
| 98 | A | 48.5 | Very low | 53.9 | Low | 29 Ų | 29 | 110.5 Ų | 110.5 | 24% | 0.24 | 57% | 0.568 | C | S | . | * | H | α-helix | trans | -89.5 | -15.6 | -172.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | L94 K100 Q101 Q102 | L94-A98 WeakPolarHBondContact O-CA 3.04Å; L94-A98 WeakPolarHBondContact O-CB 3.36Å; L94-A98 PolarHBondContact O-N 2.85Å; A98-K100 PolarHBondContact O-N 3.17Å; A98-Q101 PolarHBondContact O-N 3.45Å; A98-Q101 VanDerWaalsContact O-N 3.15Å; A98-Q102 WeakPolarHBondContact O-CB 3.1Å; A98-Q102 PolarHBondContact O-N 2.84Å |
| 99 | S | 46.3 | Very low | 55 | Low | 67 Ų | 67 | 109.6 Ų | 109.6 | 47% | 0.469 | 57% | 0.566 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -62.9 | -8.1 | 173.2 | 60.2 | 0 | 0 | 0 | 0 | 113.7 | H95 | H95-S99 WeakPolarHBondContact O-CB 3.14Å; H95-S99 PolarHBondContact O-N 3.5Å; H95-S99 PolarHBondContact O-OG 2.88Å |
| 100 | K | 53.6 | Low | 56.4 | Low | 168 Ų | 168 | 110 Ų | 110 | 73% | 0.73 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.9 | -21.1 | 173.3 | -65.6 | -169.1 | 179.2 | -166.2 | 0 | 115.2 | A98 | A98-K100 PolarHBondContact O-N 3.17Š|
| 101 | Q | 54.3 | Low | 58 | Low | 154 Ų | 154 | 107.8 Ų | 107.8 | 72% | 0.72 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.2 | -27.9 | -174.1 | -62.6 | -161.5 | 13.9 | 0 | 0 | 114.7 | A98 P103 | A98-Q101 PolarHBondContact O-N 3.45Å; A98-Q101 VanDerWaalsContact O-N 3.15Å; Q101-P103 VanDerWaalsContact C-CD 3.46Å |
| 102 | Q | 53.2 | Low | 59.9 | Low | 137 Ų | 137 | 110.5 Ų | 110.5 | 64% | 0.64 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -67 | -31.3 | 174.4 | -142.2 | 163.9 | 19.8 | 0 | 0 | 115.3 | A98 L104 S106 | A98-Q102 WeakPolarHBondContact O-CB 3.1Å; A98-Q102 PolarHBondContact O-N 2.84Å; Q102-L104 VanDerWaalsContact C-N 3.32Å; Q102-L104 PolarHBondContact O-N 2.83Å; Q102-S106 PolarHBondContact O-N 3.07Å; Q102-S106 PolarHBondContact O-OG 3.44Å |
| 103 | P | 55.5 | Low | 61.7 | Low | 51 Ų | 51 | 112.7 Ų | 112.7 | 33% | 0.331 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -63 | -38.4 | 176.3 | 21.5 | -31.5 | 0 | 0 | 0 | 112.1 | Q101 Q105 S106 E107 | Q101-P103 VanDerWaalsContact C-CD 3.46Å; P103-Q105 PolarHBondContact O-N 2.74Å; P103-S106 WeakPolarHBondContact CA-OG 3.44Å; P103-S106 PolarHBondContact O-N 3.38Å; P103-S106 PolarHBondContact O-OG 3.43Å; P103-E107 WeakPolarHBondContact O-CB 3.47Å; P103-E107 WeakPolarHBondContact O-CG 3.18Å; P103-E107 PolarHBondContact O-N 3.01Å |
| 104 | L | 56.1 | Low | 63.5 | Low | 106 Ų | 106 | 111.3 Ų | 111.3 | 56% | 0.555 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -65 | -39 | -176.6 | -63.2 | 176.7 | 0 | 0 | 0 | 113.1 | Q102 Q108 | Q102-L104 VanDerWaalsContact C-N 3.32Å; Q102-L104 PolarHBondContact O-N 2.83Å; L104-Q108 WeakPolarHBondContact O-CB 3.18Å; L104-Q108 WeakPolarHBondContact O-CG 3.27Å; L104-Q108 PolarHBondContact O-N 3.25Å |
| 105 | Q | 59.3 | Low | 65.4 | Low | 125 Ų | 125 | 112.3 Ų | 112.3 | 58% | 0.584 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -71.3 | -36.9 | 177 | -160.4 | -178.4 | 16.1 | 0 | 0 | 111.3 | P103 Q109 | P103-Q105 PolarHBondContact O-N 2.74Å; Q105-Q109 WeakPolarHBondContact O-CG 3.47Å; Q105-Q109 PolarHBondContact O-N 3.21Å |
| 106 | S | 62.9 | Low | 67.6 | Low | 64 Ų | 64 | 111.2 Ų | 111.2 | 45% | 0.448 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -69.8 | -36.5 | 175.9 | 70.8 | 0 | 0 | 0 | 0 | 112.8 | Q102 P103 Q109 L110 | Q102-S106 PolarHBondContact O-N 3.07Å; Q102-S106 PolarHBondContact O-OG 3.44Å; P103-S106 WeakPolarHBondContact CA-OG 3.44Å; P103-S106 PolarHBondContact O-N 3.38Å; P103-S106 PolarHBondContact O-OG 3.43Å; S106-Q109 PolarHBondContact O-N 2.99Å; S106-L110 WeakPolarHBondContact O-CB 3.4Å; S106-L110 PolarHBondContact O-N 3.44Å |
| 107 | E | 71.6 | Confident | 69.5 | Low | 120 Ų | 120 | 108.7 Ų | 108.7 | 56% | 0.561 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -69.6 | -39.4 | 175.5 | -75.8 | -173.4 | 111.7 | 0 | 0 | 111.7 | P103 L110 A111 | P103-E107 WeakPolarHBondContact O-CB 3.47Å; P103-E107 WeakPolarHBondContact O-CG 3.18Å; P103-E107 PolarHBondContact O-N 3.01Å; E107-L110 PolarHBondContact O-N 3.36Å; E107-A111 WeakPolarHBondContact O-CB 3.35Å; E107-A111 PolarHBondContact O-N 3.26Å |
| 108 | Q | 75.8 | Confident | 71.4 | Confident | 141 Ų | 141 | 103.7 Ų | 103.7 | 66% | 0.659 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63.1 | -41.5 | 172.6 | -77.9 | -178.9 | -12.8 | 0 | 0 | 112.1 | L104 A111 Q112 | L104-Q108 WeakPolarHBondContact O-CB 3.18Å; L104-Q108 WeakPolarHBondContact O-CG 3.27Å; L104-Q108 PolarHBondContact O-N 3.25Å; Q108-A111 PolarHBondContact O-N 2.91Å; Q108-Q112 WeakPolarHBondContact O-CB 3.32Å; Q108-Q112 PolarHBondContact O-N 3.29Å |
| 109 | Q | 76.1 | Confident | 73.3 | Confident | 109 Ų | 109 | 108.1 Ų | 108.1 | 51% | 0.509 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -64.4 | -39.4 | 174.2 | -76.1 | 177.3 | -8.9 | 0 | 0 | 112 | Q105 S106 Q112 L113 | Q105-Q109 WeakPolarHBondContact O-CG 3.47Å; Q105-Q109 PolarHBondContact O-N 3.21Å; S106-Q109 PolarHBondContact O-N 2.99Å; Q109-Q112 PolarHBondContact O-N 3.44Å; Q109-L113 WeakPolarHBondContact O-CB 3.44Å; Q109-L113 WeakPolarHBondContact O-CG 3.19Å; Q109-L113 PolarHBondContact O-N 3.08Å |
| 110 | L | 80.9 | Confident | 75.2 | Confident | 115 Ų | 115 | 108.1 Ų | 108.1 | 60% | 0.602 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.4 | -42.8 | 175.9 | -165.7 | 92.8 | 0 | 0 | 0 | 111.6 | S106 E107 Q112 L113 T114 | S106-L110 WeakPolarHBondContact O-CB 3.4Å; S106-L110 PolarHBondContact O-N 3.44Å; E107-L110 PolarHBondContact O-N 3.36Å; L110-Q112 VanDerWaalsContact C-N 3.34Å; L110-L113 PolarHBondContact O-N 3.26Å; L110-T114 WeakPolarHBondContact O-CB 3.29Å; L110-T114 PolarHBondContact O-N 2.89Å; L110-T114 PolarHBondContact O-OG1 2.88Å |
| 111 | A | 83.6 | Confident | 77 | Confident | 59 Ų | 59 | 106.4 Ų | 106.4 | 49% | 0.488 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -62.9 | -42.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | E107 Q108 T114 Q115 | E107-A111 WeakPolarHBondContact O-CB 3.35Å; E107-A111 PolarHBondContact O-N 3.26Å; Q108-A111 PolarHBondContact O-N 2.91Å; A111-T114 PolarHBondContact O-N 3.47Å; A111-Q115 WeakPolarHBondContact O-CB 3.27Å; A111-Q115 PolarHBondContact O-N 3.24Å |
| 112 | Q | 87 | Confident | 78.5 | Confident | 134 Ų | 134 | 106 Ų | 106 | 63% | 0.626 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -64 | -43.1 | 176.6 | -168.3 | 178.5 | -1.9 | 0 | 0 | 111.9 | Q108 Q109 L110 Q115 Q116 | Q108-Q112 WeakPolarHBondContact O-CB 3.32Å; Q108-Q112 PolarHBondContact O-N 3.29Å; Q109-Q112 PolarHBondContact O-N 3.44Å; L110-Q112 VanDerWaalsContact C-N 3.34Å; Q112-Q115 PolarHBondContact O-N 3.36Å; Q112-Q116 WeakPolarHBondContact O-CB 3.13Å; Q112-Q116 PolarHBondContact O-N 3.11Å |
| 113 | L | 88.5 | Confident | 80.2 | Confident | 106 Ų | 106 | 105.2 Ų | 105.2 | 56% | 0.555 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -65.1 | -40.9 | 175.3 | -74.5 | 172.2 | 0 | 0 | 0 | 111.9 | Q109 L110 Q115 Q116 L117 | Q109-L113 WeakPolarHBondContact O-CB 3.44Å; Q109-L113 WeakPolarHBondContact O-CG 3.19Å; Q109-L113 PolarHBondContact O-N 3.08Å; L110-L113 PolarHBondContact O-N 3.26Å; L113-Q115 VanDerWaalsContact C-N 3.34Å; L113-Q115 PolarHBondContact O-N 2.69Å; L113-Q116 PolarHBondContact O-N 2.95Å; L113-L117 WeakPolarHBondContact O-CB 3.36Å; L113-L117 PolarHBondContact O-N 2.94Å |
| 114 | T | 86.8 | Confident | 81.7 | Confident | 87 Ų | 87 | 107.6 Ų | 107.6 | 53% | 0.534 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -63.5 | -42.2 | 177.5 | -56.5 | 0 | 0 | 0 | 0 | 111 | L110 A111 L117 A118 | L110-T114 WeakPolarHBondContact O-CB 3.29Å; L110-T114 PolarHBondContact O-N 2.89Å; L110-T114 PolarHBondContact O-OG1 2.88Å; A111-T114 PolarHBondContact O-N 3.47Å; T114-L117 WeakPolarHBondContact O-CB 3.43Å; T114-L117 PolarHBondContact O-N 3.49Å; T114-A118 PolarHBondContact O-N 2.89Å |
| 115 | Q | 89.2 | Confident | 83.2 | Confident | 125 Ų | 125 | 107.4 Ų | 107.4 | 58% | 0.584 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -64.9 | -41 | 175.1 | -174.1 | 176.8 | -12.9 | 0 | 0 | 111.7 | A111 Q112 L113 L117 A118 Q119 | A111-Q115 WeakPolarHBondContact O-CB 3.27Å; A111-Q115 PolarHBondContact O-N 3.24Å; Q112-Q115 PolarHBondContact O-N 3.36Å; L113-Q115 VanDerWaalsContact C-N 3.34Å; L113-Q115 PolarHBondContact O-N 2.69Å; Q115-L117 VanDerWaalsContact C-N 3.26Å; Q115-L117 PolarHBondContact O-N 3.32Å; Q115-A118 PolarHBondContact O-N 3.37Å; Q115-Q119 WeakPolarHBondContact O-CG 3.48Å; Q115-Q119 PolarHBondContact O-N 3.15Å |
| 116 | Q | 89.9 | Confident | 84.5 | Confident | 111 Ų | 111 | 105.8 Ų | 105.8 | 52% | 0.519 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63 | -36.5 | 174.8 | -167.2 | -175.5 | -42.1 | 0 | 0 | 111.3 | Q112 L113 Q119 T120 | Q112-Q116 WeakPolarHBondContact O-CB 3.13Å; Q112-Q116 PolarHBondContact O-N 3.11Å; L113-Q116 PolarHBondContact O-N 2.95Å; Q116-Q119 PolarHBondContact O-N 3.49Å; Q116-T120 WeakPolarHBondContact O-CB 3.39Å; Q116-T120 PolarHBondContact O-N 2.85Å; Q116-T120 PolarHBondContact O-OG1 3.47Å |
| 117 | L | 91.1 | Very high | 85.6 | Confident | 117 Ų | 117 | 106.1 Ų | 106.1 | 61% | 0.613 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -66.1 | -45.7 | 177.2 | -140.2 | 153.3 | 0 | 0 | 0 | 111.3 | L113 T114 Q115 Q119 T120 E121 | L113-L117 WeakPolarHBondContact O-CB 3.36Å; L113-L117 PolarHBondContact O-N 2.94Å; T114-L117 WeakPolarHBondContact O-CB 3.43Å; T114-L117 PolarHBondContact O-N 3.49Å; Q115-L117 VanDerWaalsContact C-N 3.26Å; Q115-L117 PolarHBondContact O-N 3.32Å; L117-Q119 VanDerWaalsContact C-N 3.35Å; L117-Q119 PolarHBondContact O-N 3.24Å; L117-T120 PolarHBondContact O-N 3.32Å; L117-E121 WeakPolarHBondContact O-CB 3.47Å; L117-E121 PolarHBondContact O-N 2.86Å |
| 118 | A | 89.4 | Confident | 86 | Confident | 52 Ų | 52 | 106.4 Ų | 106.4 | 43% | 0.43 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.2 | -39.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | T114 Q115 T120 E121 Q122 | T114-A118 PolarHBondContact O-N 2.89Å; Q115-A118 PolarHBondContact O-N 3.37Å; A118-T120 VanDerWaalsContact C-N 3.34Å; A118-E121 PolarHBondContact O-N 3.42Å; A118-Q122 WeakPolarHBondContact O-CB 3.34Å; A118-Q122 PolarHBondContact O-N 2.91Å |
| 119 | Q | 88.4 | Confident | 86.3 | Confident | 123 Ų | 123 | 102.6 Ų | 102.6 | 58% | 0.575 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63.9 | -40.1 | 173.8 | -76.6 | -175.7 | -25.3 | 0 | 0 | 112.1 | Q115 Q116 L117 Q122 H123 | Q115-Q119 WeakPolarHBondContact O-CG 3.48Å; Q115-Q119 PolarHBondContact O-N 3.15Å; Q116-Q119 PolarHBondContact O-N 3.49Å; L117-Q119 VanDerWaalsContact C-N 3.35Å; L117-Q119 PolarHBondContact O-N 3.24Å; Q119-Q122 PolarHBondContact O-N 3.44Å; Q119-H123 WeakPolarHBondContact O-CB 3.24Å; Q119-H123 PolarHBondContact O-N 3.19Å |
| 120 | T | 86.9 | Confident | 86.2 | Confident | 67 Ų | 67 | 103 Ų | 103 | 41% | 0.411 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -69.5 | -39.9 | 178.7 | -49.7 | 0 | 0 | 0 | 0 | 110.8 | Q116 L117 A118 H123 L124 | Q116-T120 WeakPolarHBondContact O-CB 3.39Å; Q116-T120 PolarHBondContact O-N 2.85Å; Q116-T120 PolarHBondContact O-OG1 3.47Å; L117-T120 PolarHBondContact O-N 3.32Å; A118-T120 VanDerWaalsContact C-N 3.34Å; T120-H123 PolarHBondContact O-N 3.25Å; T120-L124 HydrophobicContact CG2-CD1 4.34Å; T120-L124 WeakPolarHBondContact O-CB 3.26Å; T120-L124 VanDerWaalsContact O-CG 3.29Å; T120-L124 WeakPolarHBondContact O-CG 3.32Å; T120-L124 PolarHBondContact O-N 2.84Å |
| 121 | E | 89.8 | Confident | 85.9 | Confident | 132 Ų | 132 | 101.7 Ų | 101.7 | 62% | 0.617 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -60 | -46.9 | 174 | -176.2 | -178.7 | 168.9 | 0 | 0 | 111.2 | L117 A118 H123 L124 N125 | L117-E121 WeakPolarHBondContact O-CB 3.47Å; L117-E121 PolarHBondContact O-N 2.86Å; A118-E121 PolarHBondContact O-N 3.42Å; E121-H123 VanDerWaalsContact C-N 3.32Å; E121-H123 PolarHBondContact O-N 3.46Å; E121-L124 PolarHBondContact O-N 3.47Å; E121-N125 WeakPolarHBondContact O-CB 3.23Å; E121-N125 PolarHBondContact O-N 3.35Å |
| 122 | Q | 86.3 | Confident | 85.3 | Confident | 146 Ų | 146 | 104 Ų | 104 | 68% | 0.682 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -66.9 | -35.4 | 178.5 | -166 | 172 | -7.9 | 0 | 0 | 112.1 | A118 Q119 N125 N126 | A118-Q122 WeakPolarHBondContact O-CB 3.34Å; A118-Q122 PolarHBondContact O-N 2.91Å; Q119-Q122 PolarHBondContact O-N 3.44Å; Q122-N125 PolarHBondContact O-N 2.85Å; Q122-N126 WeakPolarHBondContact O-CB 3.4Å; Q122-N126 PolarHBondContact O-N 2.88Å |
| 123 | H | 88.6 | Confident | 84.4 | Confident | 120 Ų | 120 | 101.8 Ų | 101.8 | 56% | 0.556 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64.5 | -44.2 | 173.8 | -174.6 | 61.4 | 0 | 0 | 0 | 111.8 | Q119 T120 E121 N126 L127 | Q119-H123 WeakPolarHBondContact O-CB 3.24Å; Q119-H123 PolarHBondContact O-N 3.19Å; T120-H123 PolarHBondContact O-N 3.25Å; E121-H123 VanDerWaalsContact C-N 3.32Å; E121-H123 PolarHBondContact O-N 3.46Å; H123-N126 PolarHBondContact O-N 3.1Å; H123-L127 WeakPolarHBondContact O-CG 3.28Å; H123-L127 PolarHBondContact O-N 3.3Å |
| 124 | L | 87.5 | Confident | 83.1 | Confident | 101 Ų | 101 | 102.9 Ų | 102.9 | 53% | 0.529 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.8 | -39.9 | 175.2 | -71.6 | 174.1 | 0 | 0 | 0 | 112.1 | T120 E121 N126 L127 M128 | T120-L124 HydrophobicContact CG2-CD1 4.34Å; T120-L124 WeakPolarHBondContact O-CB 3.26Å; T120-L124 VanDerWaalsContact O-CG 3.29Å; T120-L124 WeakPolarHBondContact O-CG 3.32Å; T120-L124 PolarHBondContact O-N 2.84Å; E121-L124 PolarHBondContact O-N 3.47Å; L124-N126 VanDerWaalsContact C-N 3.3Å; L124-N126 PolarHBondContact O-N 3.41Å; L124-L127 HydrophobicContact CD2-CD1 4.49Å; L124-L127 PolarHBondContact O-N 2.71Å; L124-M128 WeakPolarHBondContact O-CB 3.21Å; L124-M128 PolarHBondContact O-N 2.83Å |
| 125 | N | 87.8 | Confident | 81.8 | Confident | 102 Ų | 102 | 106.6 Ų | 106.6 | 55% | 0.545 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.3 | -37.6 | 177.2 | -168 | 23.8 | 0 | 0 | 0 | 111.4 | E121 Q122 M128 A129 | E121-N125 WeakPolarHBondContact O-CB 3.23Å; E121-N125 PolarHBondContact O-N 3.35Å; Q122-N125 PolarHBondContact O-N 2.85Å; N125-M128 PolarHBondContact O-N 3.4Å; N125-A129 WeakPolarHBondContact O-CB 3.5Å; N125-A129 PolarHBondContact O-N 2.95Å |
| 126 | N | 85.7 | Confident | 80.4 | Confident | 91 Ų | 91 | 109.1 Ų | 109.1 | 49% | 0.487 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -66.4 | -42.5 | 174.4 | -161.1 | -63.1 | 0 | 0 | 0 | 111.8 | Q122 H123 L124 M128 A129 Q130 | Q122-N126 WeakPolarHBondContact O-CB 3.4Å; Q122-N126 PolarHBondContact O-N 2.88Å; H123-N126 PolarHBondContact O-N 3.1Å; L124-N126 VanDerWaalsContact C-N 3.3Å; L124-N126 PolarHBondContact O-N 3.41Å; N126-M128 VanDerWaalsContact C-N 3.32Å; N126-M128 PolarHBondContact O-N 2.92Å; N126-A129 PolarHBondContact O-N 3.49Å; N126-Q130 WeakPolarHBondContact O-CG 3.38Å; N126-Q130 PolarHBondContact O-N 2.78Å; N126-Q130 PolarHBondContact OD1-NE2 3.29Å |
| 127 | L | 86.6 | Confident | 78.6 | Confident | 70 Ų | 70 | 118 Ų | 118 | 37% | 0.366 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -62.2 | -39.9 | 173.5 | -71.8 | 169.4 | 0 | 0 | 0 | 111.8 | H123 L124 Q130 L131 | H123-L127 WeakPolarHBondContact O-CG 3.28Å; H123-L127 PolarHBondContact O-N 3.3Å; L124-L127 HydrophobicContact CD2-CD1 4.49Å; L124-L127 PolarHBondContact O-N 2.71Å; L127-Q130 PolarHBondContact O-N 2.73Å; L127-L131 WeakPolarHBondContact O-CB 3.46Å; L127-L131 VanDerWaalsContact O-CG 3.28Å; L127-L131 WeakPolarHBondContact O-CG 3.48Å; L127-L131 PolarHBondContact O-N 2.95Å |
| 128 | M | 80.9 | Confident | 77.9 | Confident | 126 Ų | 126 | 118 Ų | 118 | 62% | 0.621 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -62.1 | -47 | 175.8 | -171 | -177.9 | -60.2 | 0 | 0 | 111.3 | L124 N125 N126 Q130 L131 D132 | L124-M128 WeakPolarHBondContact O-CB 3.21Å; L124-M128 PolarHBondContact O-N 2.83Å; N125-M128 PolarHBondContact O-N 3.4Å; N126-M128 VanDerWaalsContact C-N 3.32Å; N126-M128 PolarHBondContact O-N 2.92Å; M128-Q130 VanDerWaalsContact C-N 3.26Å; M128-Q130 PolarHBondContact O-N 3.38Å; M128-L131 PolarHBondContact O-N 2.92Å; M128-L131 VanDerWaalsContact O-N 3.13Å; M128-D132 PolarHBondContact O-N 3.36Å |
| 129 | A | 81 | Confident | 77.3 | Confident | 62 Ų | 62 | 121.5 Ų | 121.5 | 51% | 0.512 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -65.3 | -26.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | N125 N126 P133 | N125-A129 WeakPolarHBondContact O-CB 3.5Å; N125-A129 PolarHBondContact O-N 2.95Å; N126-A129 PolarHBondContact O-N 3.49Å; A129-P133 WeakPolarHBondContact O-CD 3.17Å |
| 130 | Q | 73.8 | Confident | 76.7 | Confident | 117 Ų | 117 | 121.4 Ų | 121.4 | 55% | 0.547 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -79 | -28 | 173 | -73.2 | -179.8 | 26 | 0 | 0 | 113.1 | N126 L127 M128 P133 | N126-Q130 WeakPolarHBondContact O-CG 3.38Å; N126-Q130 PolarHBondContact O-N 2.78Å; N126-Q130 PolarHBondContact OD1-NE2 3.29Å; L127-Q130 PolarHBondContact O-N 2.73Å; M128-Q130 VanDerWaalsContact C-N 3.26Å; M128-Q130 PolarHBondContact O-N 3.38Å; Q130-P133 WeakPolarHBondContact O-CD 3.38Å; Q130-P133 WeakPolarHBondContact O-CG 3.45Å |
| 131 | L | 74.8 | Confident | 76.1 | Confident | 88 Ų | 88 | 124.6 Ų | 124.6 | 46% | 0.461 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -81 | -32.4 | 177 | -74.8 | 167.8 | 0 | 0 | 0 | 112 | L127 M128 L134 F135 | L127-L131 WeakPolarHBondContact O-CB 3.46Å; L127-L131 VanDerWaalsContact O-CG 3.28Å; L127-L131 WeakPolarHBondContact O-CG 3.48Å; L127-L131 PolarHBondContact O-N 2.95Å; M128-L131 PolarHBondContact O-N 2.92Å; M128-L131 VanDerWaalsContact O-N 3.13Å; L131-L134 HydrophobicContact CD2-CD1 4.29Å; L131-L134 WeakPolarHBondContact O-CB 3.45Å; L131-L134 PolarHBondContact O-N 2.83Å; L131-F135 HydrophobicContact CB-CE2 4.09Å; L131-F135 WeakPolarHBondContact O-CD2 3.4Å; L131-F135 PolarHBondContact O-N 3.09Å |
| 132 | D | 71.2 | Confident | 75.3 | Confident | 107 Ų | 107 | 124.1 Ų | 124.1 | 57% | 0.572 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -48.6 | -49.2 | 177.9 | -155.7 | 36.5 | 0 | 0 | 0 | 114 | M128 L134 F135 | M128-D132 PolarHBondContact O-N 3.36Å; D132-L134 VanDerWaalsContact C-N 3.25Å; D132-L134 PolarHBondContact O-N 3.05Å; D132-F135 PolarHBondContact O-N 3.42Å; D132-F135 VanDerWaalsContact O-N 3.12Å |
| 133 | P | 68 | Low | 74.5 | Confident | 87 Ų | 87 | 122.7 Ų | 122.7 | 57% | 0.565 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -71.1 | -10.5 | 177 | 27 | -35.4 | 0 | 0 | 0 | 115.2 | A129 Q130 | A129-P133 WeakPolarHBondContact O-CD 3.17Å; Q130-P133 WeakPolarHBondContact O-CD 3.38Å; Q130-P133 WeakPolarHBondContact O-CG 3.45Å |
| 134 | L | 61 | Low | 73.5 | Confident | 130 Ų | 130 | 122.9 Ų | 122.9 | 68% | 0.681 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -83.8 | -16.6 | 171.9 | -69.3 | 173.9 | 0 | 0 | 0 | 112.5 | L131 D132 | L131-L134 HydrophobicContact CD2-CD1 4.29Å; L131-L134 WeakPolarHBondContact O-CB 3.45Å; L131-L134 PolarHBondContact O-N 2.83Å; D132-L134 VanDerWaalsContact C-N 3.25Å; D132-L134 PolarHBondContact O-N 3.05Å |
| 135 | F | 61.1 | Low | 72.5 | Confident | 165 Ų | 165 | 124.5 Ų | 124.5 | 72% | 0.724 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -95.9 | -9.9 | 179.9 | -70.1 | -73 | 0 | 0 | 0 | 114 | L131 D132 | L131-F135 HydrophobicContact CB-CE2 4.09Å; L131-F135 WeakPolarHBondContact O-CD2 3.4Å; L131-F135 PolarHBondContact O-N 3.09Å; D132-F135 PolarHBondContact O-N 3.42Å; D132-F135 VanDerWaalsContact O-N 3.12Å |
| 136 | E | 59.4 | Low | 71.2 | Confident | 178 Ų | 178 | 126.4 Ų | 126.4 | 83% | 0.832 | 62% | 0.624 | S | S | * | * | trans | -89.5 | 9.3 | 179.2 | -77.8 | -155.5 | 149 | 0 | 0 | 115.5 | ||||
| 137 | R | 50.9 | Low | 69.9 | Low | 296 Ų | 296 | 129.6 Ų | 129.6 | 100% | 1.117 | 64% | 0.636 | S | S | * | * | trans | -115.6 | 0 | -179.5 | -155 | -171 | -162.2 | 99.7 | 1.4 | 112.7 |
Retrieved 137 of 137 residues in 21.2 ms
(Link to these results)