| 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 | 48.1 | Very low | 53.9 | Low | 246 Ų | 246 | 133.1 Ų | 133.1 | 100% | 1.212 | 73% | 0.727 | S | S | * | * | 0 | 121.8 | 0 | -72.1 | 170.3 | 153.2 | 0 | 0 | 108.5 | |||||
| 2 | C | 47.2 | Very low | 53.8 | Low | 95 Ų | 95 | 131.5 Ų | 131.5 | 64% | 0.642 | 73% | 0.728 | S | S | * | * | trans | -80.5 | 128.3 | 179.7 | -89.3 | 0 | 0 | 0 | 0 | 110.7 | C4 | C2-C4 VanDerWaalsContact C-N 3.26Å; C2-C4 PolarHBondContact O-N 3.29Å | ||
| 3 | P | 57.2 | Low | 54.1 | Low | 108 Ų | 108 | 131.9 Ų | 131.9 | 70% | 0.701 | 74% | 0.74 | S | S | * | * | trans | -85.3 | 64.2 | -178.2 | 35.4 | -34.7 | 0 | 0 | 0 | 110.5 | ||||
| 4 | C | 55.4 | Low | 54.1 | Low | 14 Ų | 14 | 128.4 Ų | 128.4 | 10% | 0.095 | 74% | 0.736 | C | S | . | * | trans | -101.6 | 113.6 | 177.8 | -62.6 | 0 | 0 | 0 | 0 | 109.2 | C2 L6 H7 C16 C18 | C2-C4 VanDerWaalsContact C-N 3.26Å; C2-C4 PolarHBondContact O-N 3.29Å; C4-L6 PolarHBondContact O-N 2.88Å; C4-L6 VanDerWaalsContact O-N 3.09Å; C4-H7 PolarHBondContact O-N 2.94Å; C4-C16 VanDerWaalsContact SG-SG 3.65Å; C4-C18 HydrophobicContact CB-CB 4.37Å; C4-C18 WeakPolarHBondContact SG-CB 3.14Å | ||
| 5 | P | 58.8 | Low | 54.2 | Low | 122 Ų | 122 | 128 Ų | 128 | 79% | 0.792 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.1 | -14.6 | -176.3 | 23.7 | -32 | 0 | 0 | 0 | 113.7 | H7 | P5-H7 VanDerWaalsContact C-N 3.34Š|
| 6 | L | 55.3 | Low | 54.6 | Low | 146 Ų | 146 | 121.3 Ų | 121.3 | 76% | 0.764 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.6 | -20.3 | 177.5 | -81.7 | 151.9 | 0 | 0 | 0 | 113.9 | C4 | C4-L6 PolarHBondContact O-N 2.88Å; C4-L6 VanDerWaalsContact O-N 3.09Å |
| 7 | H | 53.8 | Low | 54.8 | Low | 117 Ų | 117 | 119.1 Ų | 119.1 | 54% | 0.542 | 70% | 0.699 | S | S | . | * | trans | -114.4 | 90.9 | 172.8 | -73.6 | -76.1 | 0 | 0 | 0 | 109.1 | C4 P5 G9 | C4-H7 PolarHBondContact O-N 2.94Å; P5-H7 VanDerWaalsContact C-N 3.34Å; H7-G9 PolarHBondContact O-N 2.82Å | ||
| 8 | R | 56.7 | Low | 55 | Low | 243 Ų | 243 | 114.8 Ų | 114.8 | 92% | 0.917 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -66.7 | 60.2 | 166.7 | -77.1 | -172.7 | 174.8 | 168 | -1.6 | 111.5 | R10 | R8-R10 VanDerWaalsContact C-N 3.28Å; R8-R10 PolarHBondContact O-N 3.42Å; R8-R10 VanDerWaalsContact O-N 3.1Å |
| 9 | G | 55.6 | Low | 54.9 | Low | 81 Ų | 81 | 110.4 Ų | 110.4 | 84% | 0.835 | 65% | 0.651 | S | S | * | * | S | Bend | trans | 64.7 | 18.1 | 168.5 | 0 | 0 | 0 | 0 | 0 | 116.9 | H7 | H7-G9 PolarHBondContact O-N 2.82Š|
| 10 | R | 50.6 | Low | 55.1 | Low | 232 Ų | 232 | 107.6 Ų | 107.6 | 88% | 0.875 | 64% | 0.641 | S | S | * | * | trans | -120.6 | 95.1 | -179.9 | -128.3 | 179.8 | -137.1 | -162.7 | 3.9 | 110.7 | R8 | R8-R10 VanDerWaalsContact C-N 3.28Å; R8-R10 PolarHBondContact O-N 3.42Å; R8-R10 VanDerWaalsContact O-N 3.1Å | ||
| 11 | G | 54.3 | Low | 55.3 | Low | 60 Ų | 60 | 104.4 Ų | 104.4 | 62% | 0.619 | 63% | 0.631 | S | S | * | * | S | Bend | trans | 151.3 | 144.1 | 169.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 12 | P | 52.8 | Low | 55.8 | Low | 114 Ų | 114 | 99.7 Ų | 99.7 | 74% | 0.74 | 60% | 0.599 | S | S | * | * | trans | -60.6 | 163.7 | 174.6 | 28.3 | -33.7 | 0 | 0 | 0 | 110.4 | A14 | P12-A14 PolarHBondContact O-N 3.48Š| ||
| 13 | P | 57.2 | Low | 56.4 | Low | 137 Ų | 137 | 100.3 Ų | 100.3 | 89% | 0.89 | 60% | 0.596 | S | S | * | * | trans | -72.9 | 61.6 | -173.9 | 33.5 | -37.1 | 0 | 0 | 0 | 111.7 | ||||
| 14 | A | 54.2 | Low | 56.6 | Low | 82 Ų | 82 | 96.9 Ų | 96.9 | 68% | 0.678 | 58% | 0.58 | S | S | * | * | trans | -66.3 | 131.3 | 159.3 | 0 | 0 | 0 | 0 | 0 | 107 | P12 C16 | P12-A14 PolarHBondContact O-N 3.48Å; A14-C16 PolarHBondContact O-N 3.1Å | ||
| 15 | V | 56.4 | Low | 56.9 | Low | 123 Ų | 123 | 102.1 Ų | 102.1 | 75% | 0.745 | 61% | 0.606 | S | S | * | * | trans | -48.3 | 106.8 | -176.9 | -174.6 | 0 | 0 | 0 | 0 | 109.3 | A17 | V15-A17 PolarHBondContact O-N 3.27Š| ||
| 16 | C | 59.4 | Low | 57.1 | Low | 21 Ų | 21 | 105.4 Ų | 105.4 | 14% | 0.142 | 60% | 0.603 | C | S | . | * | trans | -58.9 | 129.3 | -176.9 | -178 | 0 | 0 | 0 | 0 | 109.1 | C4 A14 C18 S19 A20 | C4-C16 VanDerWaalsContact SG-SG 3.65Å; A14-C16 PolarHBondContact O-N 3.1Å; C16-C18 PolarHBondContact O-N 3.29Å; C16-S19 PolarHBondContact O-N 3.32Å; C16-S19 PolarHBondContact O-OG 3.36Å; C16-A20 PolarHBondContact O-N 3.02Å | ||
| 17 | A | 58.5 | Low | 57.8 | Low | 83 Ų | 83 | 101.2 Ų | 101.2 | 69% | 0.686 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -53.7 | -27.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | V15 S19 A20 G21 | V15-A17 PolarHBondContact O-N 3.27Å; A17-S19 VanDerWaalsContact C-N 3.33Å; A17-S19 PolarHBondContact O-N 3.45Å; A17-A20 WeakPolarHBondContact O-CB 3.49Å; A17-A20 PolarHBondContact O-N 2.91Å; A17-G21 PolarHBondContact O-N 2.91Å |
| 18 | C | 57.9 | Low | 58.7 | Low | 42 Ų | 42 | 98.4 Ų | 98.4 | 28% | 0.284 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -65.4 | -29.6 | 173.9 | -57.7 | 0 | 0 | 0 | 0 | 113.9 | C4 C16 R22 | C4-C18 HydrophobicContact CB-CB 4.37Å; C4-C18 WeakPolarHBondContact SG-CB 3.14Å; C16-C18 PolarHBondContact O-N 3.29Å; C18-R22 PolarHBondContact O-N 3.41Å |
| 19 | S | 53.9 | Low | 59.7 | Low | 31 Ų | 31 | 89.3 Ų | 89.3 | 22% | 0.217 | 56% | 0.556 | C | S | . | * | H | α-helix | trans | -75.3 | -34.3 | 172.6 | 63.3 | 0 | 0 | 0 | 0 | 111.3 | C16 A17 G21 R22 L23 | C16-S19 PolarHBondContact O-N 3.32Å; C16-S19 PolarHBondContact O-OG 3.36Å; A17-S19 VanDerWaalsContact C-N 3.33Å; A17-S19 PolarHBondContact O-N 3.45Å; S19-G21 PolarHBondContact O-N 2.86Å; S19-R22 PolarHBondContact O-N 3.05Å; S19-L23 WeakPolarHBondContact O-CB 3.3Å; S19-L23 VanDerWaalsContact O-CG 3.3Å; S19-L23 WeakPolarHBondContact O-CG 3.41Å; S19-L23 PolarHBondContact O-N 3.31Å |
| 20 | A | 58.6 | Low | 60.9 | Low | 55 Ų | 55 | 88.2 Ų | 88.2 | 46% | 0.455 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.3 | -41.9 | 172 | 0 | 0 | 0 | 0 | 0 | 111.8 | C16 A17 L23 G24 | C16-A20 PolarHBondContact O-N 3.02Å; A17-A20 WeakPolarHBondContact O-CB 3.49Å; A17-A20 PolarHBondContact O-N 2.91Å; A20-L23 PolarHBondContact O-N 3.27Å; A20-G24 PolarHBondContact O-N 2.93Å |
| 21 | G | 59.2 | Low | 62.4 | Low | 40 Ų | 40 | 83.8 Ų | 83.8 | 41% | 0.412 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.3 | -42.9 | 174 | 0 | 0 | 0 | 0 | 0 | 113.4 | A17 S19 G24 L25 | A17-G21 PolarHBondContact O-N 2.91Å; S19-G21 PolarHBondContact O-N 2.86Å; G21-G24 PolarHBondContact O-N 3.32Å; G21-L25 PolarHBondContact O-N 2.87Å |
| 22 | R | 59.2 | Low | 63.9 | Low | 147 Ų | 147 | 85.3 Ų | 85.3 | 56% | 0.555 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -67.8 | -34.4 | 174.7 | -69.4 | -172.7 | -142.7 | -122.9 | 4.9 | 112.7 | C18 S19 L25 R26 | C18-R22 PolarHBondContact O-N 3.41Å; S19-R22 PolarHBondContact O-N 3.05Å; R22-L25 PolarHBondContact O-N 3.49Å; R22-R26 WeakPolarHBondContact O-CB 3.48Å; R22-R26 WeakPolarHBondContact O-CG 3.45Å; R22-R26 PolarHBondContact O-N 2.97Å |
| 23 | L | 58.7 | Low | 65.4 | Low | 108 Ų | 108 | 83.3 Ų | 83.3 | 57% | 0.565 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -66.8 | -39.4 | 173.7 | -76.6 | 163.5 | 0 | 0 | 0 | 111 | S19 A20 R26 S27 | S19-L23 WeakPolarHBondContact O-CB 3.3Å; S19-L23 VanDerWaalsContact O-CG 3.3Å; S19-L23 WeakPolarHBondContact O-CG 3.41Å; S19-L23 PolarHBondContact O-N 3.31Å; A20-L23 PolarHBondContact O-N 3.27Å; L23-R26 PolarHBondContact O-N 3.47Å; L23-S27 WeakPolarHBondContact O-CB 3.42Å; L23-S27 PolarHBondContact O-N 2.98Å; L23-S27 PolarHBondContact O-OG 3.17Å |
| 24 | G | 61.6 | Low | 66.8 | Low | 36 Ų | 36 | 78.8 Ų | 78.8 | 37% | 0.371 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.2 | -39.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | A20 G21 S27 S28 | A20-G24 PolarHBondContact O-N 2.93Å; G21-G24 PolarHBondContact O-N 3.32Å; G24-S27 WeakPolarHBondContact CA-OG 3.4Å; G24-S27 PolarHBondContact O-OG 2.99Å; G24-S28 WeakPolarHBondContact O-CB 3.4Å; G24-S28 PolarHBondContact O-N 2.92Å; G24-S28 PolarHBondContact O-OG 3.22Å |
| 25 | L | 61.4 | Low | 68.4 | Low | 124 Ų | 124 | 77.7 Ų | 77.7 | 65% | 0.649 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -68.5 | -38 | 172.4 | -87.5 | 146 | 0 | 0 | 0 | 112.5 | G21 R22 S28 A29 | G21-L25 PolarHBondContact O-N 2.87Å; R22-L25 PolarHBondContact O-N 3.49Å; L25-S28 PolarHBondContact O-OG 2.89Å; L25-A29 VanDerWaalsContact O-CB 3.25Å; L25-A29 WeakPolarHBondContact O-CB 3.41Å; L25-A29 PolarHBondContact O-N 3.44Å |
| 26 | R | 64.7 | Low | 70 | Confident | 192 Ų | 192 | 79.7 Ų | 79.7 | 73% | 0.725 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -69 | -39.3 | 174.4 | -82.1 | -177 | 165.2 | -174.6 | -4.1 | 111.7 | R22 L23 A30 | R22-R26 WeakPolarHBondContact O-CB 3.48Å; R22-R26 WeakPolarHBondContact O-CG 3.45Å; R22-R26 PolarHBondContact O-N 2.97Å; L23-R26 PolarHBondContact O-N 3.47Å; R26-A30 VanDerWaalsContact O-CB 3.23Å; R26-A30 WeakPolarHBondContact O-CB 3.43Å; R26-A30 PolarHBondContact O-N 3.42Å |
| 27 | S | 68.5 | Low | 71.6 | Confident | 58 Ų | 58 | 84 Ų | 84 | 41% | 0.406 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -68.4 | -40.9 | 177.4 | 65.6 | 0 | 0 | 0 | 0 | 111.1 | L23 G24 A30 Q31 | L23-S27 WeakPolarHBondContact O-CB 3.42Å; L23-S27 PolarHBondContact O-N 2.98Å; L23-S27 PolarHBondContact O-OG 3.17Å; G24-S27 WeakPolarHBondContact CA-OG 3.4Å; G24-S27 PolarHBondContact O-OG 2.99Å; S27-A30 PolarHBondContact O-N 3.22Å; S27-Q31 WeakPolarHBondContact O-CB 3.45Å; S27-Q31 VanDerWaalsContact O-CG 3.26Å; S27-Q31 WeakPolarHBondContact O-CG 3.43Å; S27-Q31 PolarHBondContact O-N 3.41Å |
| 28 | S | 73.5 | Confident | 73.2 | Confident | 57 Ų | 57 | 87.1 Ų | 87.1 | 40% | 0.399 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.8 | -41.9 | 175 | 69.9 | 0 | 0 | 0 | 0 | 112.2 | G24 L25 A30 Q31 L32 | G24-S28 WeakPolarHBondContact O-CB 3.4Å; G24-S28 PolarHBondContact O-N 2.92Å; G24-S28 PolarHBondContact O-OG 3.22Å; L25-S28 PolarHBondContact O-OG 2.89Å; S28-A30 PolarHBondContact O-N 3.15Å; S28-Q31 PolarHBondContact O-N 3.32Å; S28-L32 WeakPolarHBondContact O-CB 3.31Å; S28-L32 PolarHBondContact O-N 3.16Å |
| 29 | A | 77.3 | Confident | 74.7 | Confident | 52 Ų | 52 | 87.9 Ų | 87.9 | 43% | 0.43 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.5 | -38.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | L25 L32 T33 | L25-A29 VanDerWaalsContact O-CB 3.25Å; L25-A29 WeakPolarHBondContact O-CB 3.41Å; L25-A29 PolarHBondContact O-N 3.44Å; A29-L32 PolarHBondContact O-N 2.93Å; A29-T33 WeakPolarHBondContact O-CB 3.45Å; A29-T33 PolarHBondContact O-N 3.49Å; A29-T33 PolarHBondContact O-OG1 2.82Å |
| 30 | A | 80.4 | Confident | 76.5 | Confident | 59 Ų | 59 | 91 Ų | 91 | 49% | 0.488 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.3 | -42.2 | 175 | 0 | 0 | 0 | 0 | 0 | 111.5 | R26 S27 S28 T33 A34 | R26-A30 VanDerWaalsContact O-CB 3.23Å; R26-A30 WeakPolarHBondContact O-CB 3.43Å; R26-A30 PolarHBondContact O-N 3.42Å; S27-A30 PolarHBondContact O-N 3.22Å; S28-A30 PolarHBondContact O-N 3.15Å; A30-T33 PolarHBondContact O-N 2.91Å; A30-A34 VanDerWaalsContact O-CB 3.3Å; A30-A34 WeakPolarHBondContact O-CB 3.3Å; A30-A34 PolarHBondContact O-N 3.35Å |
| 31 | Q | 83 | Confident | 78 | Confident | 138 Ų | 138 | 90.1 Ų | 90.1 | 65% | 0.645 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63 | -42.9 | 174.9 | -75.6 | 172.8 | -14.7 | 0 | 0 | 111.8 | S27 S28 A34 A35 | S27-Q31 WeakPolarHBondContact O-CB 3.45Å; S27-Q31 VanDerWaalsContact O-CG 3.26Å; S27-Q31 WeakPolarHBondContact O-CG 3.43Å; S27-Q31 PolarHBondContact O-N 3.41Å; S28-Q31 PolarHBondContact O-N 3.32Å; Q31-A34 PolarHBondContact O-N 2.88Å; Q31-A35 WeakPolarHBondContact O-CB 3.26Å; Q31-A35 PolarHBondContact O-N 2.74Å |
| 32 | L | 85.7 | Confident | 79.5 | Confident | 92 Ų | 92 | 93.3 Ų | 93.3 | 48% | 0.482 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.9 | -40.9 | 177.7 | -173.7 | 139.1 | 0 | 0 | 0 | 111.7 | S28 A29 A35 R36 | S28-L32 WeakPolarHBondContact O-CB 3.31Å; S28-L32 PolarHBondContact O-N 3.16Å; A29-L32 PolarHBondContact O-N 2.93Å; L32-A35 PolarHBondContact O-N 3.47Å; L32-R36 VanDerWaalsContact CD2-CZ 3.46Å; L32-R36 WeakPolarHBondContact O-CG 3.5Å; L32-R36 PolarHBondContact O-N 3.19Å |
| 33 | T | 83.9 | Confident | 81 | Confident | 73 Ų | 73 | 90.2 Ų | 90.2 | 45% | 0.448 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.9 | -43.7 | 172.8 | -54.6 | 0 | 0 | 0 | 0 | 111.1 | A29 A30 A35 R36 L37 | A29-T33 WeakPolarHBondContact O-CB 3.45Å; A29-T33 PolarHBondContact O-N 3.49Å; A29-T33 PolarHBondContact O-OG1 2.82Å; A30-T33 PolarHBondContact O-N 2.91Å; T33-A35 VanDerWaalsContact C-N 3.32Å; T33-A35 PolarHBondContact O-N 3.05Å; T33-R36 PolarHBondContact O-N 3.15Å; T33-L37 HydrophobicContact CG2-CD1 4.27Å; T33-L37 WeakPolarHBondContact O-CG 3.41Å; T33-L37 PolarHBondContact O-N 3.06Å |
| 34 | A | 87.2 | Confident | 82.6 | Confident | 42 Ų | 42 | 89.9 Ų | 89.9 | 35% | 0.347 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.3 | -38.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | A30 Q31 L37 K38 | A30-A34 VanDerWaalsContact O-CB 3.3Å; A30-A34 WeakPolarHBondContact O-CB 3.3Å; A30-A34 PolarHBondContact O-N 3.35Å; Q31-A34 PolarHBondContact O-N 2.88Å; A34-L37 PolarHBondContact O-N 3.39Å; A34-K38 WeakPolarHBondContact O-CG 3.33Å; A34-K38 PolarHBondContact O-N 3.46Å |
| 35 | A | 87.9 | Confident | 83.9 | Confident | 59 Ų | 59 | 94.3 Ų | 94.3 | 49% | 0.488 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.3 | -42 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q31 L32 T33 K38 A39 | Q31-A35 WeakPolarHBondContact O-CB 3.26Å; Q31-A35 PolarHBondContact O-N 2.74Å; L32-A35 PolarHBondContact O-N 3.47Å; T33-A35 VanDerWaalsContact C-N 3.32Å; T33-A35 PolarHBondContact O-N 3.05Å; A35-K38 PolarHBondContact O-N 2.8Å; A35-A39 PolarHBondContact O-N 3.02Å |
| 36 | R | 90.3 | Very high | 85.1 | Confident | 165 Ų | 165 | 94.2 Ų | 94.2 | 62% | 0.623 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63 | -42.7 | 174.5 | -71.7 | 175.1 | 177.8 | -178.4 | -0.6 | 112.1 | L32 T33 A39 L40 | L32-R36 VanDerWaalsContact CD2-CZ 3.46Å; L32-R36 WeakPolarHBondContact O-CG 3.5Å; L32-R36 PolarHBondContact O-N 3.19Å; T33-R36 PolarHBondContact O-N 3.15Å; R36-A39 PolarHBondContact O-N 2.85Å; R36-L40 WeakPolarHBondContact O-CG 3.45Å; R36-L40 PolarHBondContact O-N 3.43Å |
| 37 | L | 92 | Very high | 86.2 | Confident | 111 Ų | 111 | 91.4 Ų | 91.4 | 58% | 0.581 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.4 | -38.7 | 176.9 | -69.6 | 174.7 | 0 | 0 | 0 | 112 | T33 A34 L40 G41 | T33-L37 HydrophobicContact CG2-CD1 4.27Å; T33-L37 WeakPolarHBondContact O-CG 3.41Å; T33-L37 PolarHBondContact O-N 3.06Å; A34-L37 PolarHBondContact O-N 3.39Å; L37-L40 PolarHBondContact O-N 3.3Å; L37-G41 PolarHBondContact O-N 3.48Å |
| 38 | K | 91.8 | Very high | 87 | Confident | 149 Ų | 149 | 91.3 Ų | 91.3 | 65% | 0.648 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -61.9 | -46.6 | 172.6 | -76.7 | 175.3 | -179.1 | 176.4 | 0 | 111.6 | A34 A35 L40 G41 D42 | A34-K38 WeakPolarHBondContact O-CG 3.33Å; A34-K38 PolarHBondContact O-N 3.46Å; A35-K38 PolarHBondContact O-N 2.8Å; K38-L40 VanDerWaalsContact C-N 3.32Å; K38-L40 PolarHBondContact O-N 3.44Å; K38-G41 CarbonylContact O-C 3.03Å; K38-G41 WeakPolarHBondContact O-CA 3.4Å; K38-G41 PolarHBondContact O-N 2.84Å; K38-D42 PolarHBondContact O-N 3.36Å |
| 39 | A | 89.3 | Confident | 87.6 | Confident | 57 Ų | 57 | 92.8 Ų | 92.8 | 47% | 0.471 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59 | -41.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | A35 R36 D42 E43 | A35-A39 PolarHBondContact O-N 3.02Å; R36-A39 PolarHBondContact O-N 2.85Å; A39-D42 PolarHBondContact O-N 3.47Å; A39-E43 WeakPolarHBondContact O-CB 3.36Å; A39-E43 PolarHBondContact O-N 3.39Å |
| 40 | L | 91.8 | Very high | 87.7 | Confident | 96 Ų | 96 | 98.2 Ų | 98.2 | 50% | 0.503 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.5 | -39.4 | 173.2 | -71.8 | 171.6 | 0 | 0 | 0 | 112.1 | R36 L37 K38 E43 L44 | R36-L40 WeakPolarHBondContact O-CG 3.45Å; R36-L40 PolarHBondContact O-N 3.43Å; L37-L40 PolarHBondContact O-N 3.3Å; K38-L40 VanDerWaalsContact C-N 3.32Å; K38-L40 PolarHBondContact O-N 3.44Å; L40-E43 PolarHBondContact O-N 3.37Å; L40-L44 WeakPolarHBondContact O-CB 3.47Å; L40-L44 VanDerWaalsContact O-CG 3.29Å; L40-L44 WeakPolarHBondContact O-CG 3.5Å; L40-L44 PolarHBondContact O-N 3.29Å |
| 41 | G | 90.7 | Very high | 87.8 | Confident | 38 Ų | 38 | 101.9 Ų | 101.9 | 39% | 0.392 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.7 | -44.9 | 174 | 0 | 0 | 0 | 0 | 0 | 112.6 | L37 K38 L44 H45 | L37-G41 PolarHBondContact O-N 3.48Å; K38-G41 CarbonylContact O-C 3.03Å; K38-G41 WeakPolarHBondContact O-CA 3.4Å; K38-G41 PolarHBondContact O-N 2.84Å; G41-L44 PolarHBondContact O-N 2.97Å; G41-H45 WeakPolarHBondContact O-CB 3.29Å; G41-H45 PolarHBondContact O-N 2.95Å |
| 42 | D | 91.4 | Very high | 87.5 | Confident | 106 Ų | 106 | 104 Ų | 104 | 57% | 0.567 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -66.2 | -40.8 | 178.2 | -69.3 | -31.4 | 0 | 0 | 0 | 111.6 | K38 A39 H45 Q46 | K38-D42 PolarHBondContact O-N 3.36Å; A39-D42 PolarHBondContact O-N 3.47Å; D42-H45 WeakPolarHBondContact O-CB 3.45Å; D42-H45 PolarHBondContact O-N 3.23Å; D42-Q46 WeakPolarHBondContact O-CG 3.43Å; D42-Q46 PolarHBondContact O-N 3.49Å |
| 43 | E | 90.9 | Very high | 87.1 | Confident | 82 Ų | 82 | 105.4 Ų | 105.4 | 38% | 0.383 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63 | -44.2 | 175.3 | -168.5 | -175.4 | 174.3 | 0 | 0 | 111.5 | A39 L40 H45 Q46 R47 | A39-E43 WeakPolarHBondContact O-CB 3.36Å; A39-E43 PolarHBondContact O-N 3.39Å; L40-E43 PolarHBondContact O-N 3.37Å; E43-H45 VanDerWaalsContact C-N 3.3Å; E43-H45 PolarHBondContact O-N 2.78Å; E43-Q46 PolarHBondContact O-N 3.32Å; E43-R47 WeakPolarHBondContact O-CB 3.19Å; E43-R47 WeakPolarHBondContact O-CG 3.29Å; E43-R47 PolarHBondContact O-N 3.1Å; E43-R47 IonicContact OE1-CZ 3.26Å; E43-R47 VanDerWaalsContact OE1-CZ 3.26Å; E43-R47 IonicContact OE1-NE 3.29Å; E43-R47 PolarHBondContact OE1-NE 3.33Å; E43-R47 IonicContact OE1-NH2 2.67Å; E43-R47 PolarHBondContact OE1-NH2 2.99Å |
| 44 | L | 91.3 | Very high | 86.6 | Confident | 101 Ų | 101 | 104.8 Ų | 104.8 | 53% | 0.529 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.1 | -37.6 | 174.8 | -73.6 | 173.9 | 0 | 0 | 0 | 111.8 | L40 G41 T48 | L40-L44 WeakPolarHBondContact O-CB 3.47Å; L40-L44 VanDerWaalsContact O-CG 3.29Å; L40-L44 WeakPolarHBondContact O-CG 3.5Å; L40-L44 PolarHBondContact O-N 3.29Å; G41-L44 PolarHBondContact O-N 2.97Å; L44-T48 VanDerWaalsContact O-CB 3.31Å; L44-T48 WeakPolarHBondContact O-CB 3.47Å; L44-T48 PolarHBondContact O-N 3.46Å; L44-T48 PolarHBondContact O-OG1 3.43Å |
| 45 | H | 89 | Confident | 85.5 | Confident | 130 Ų | 130 | 110.4 Ų | 110.4 | 60% | 0.602 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -63.5 | -48.8 | 175.5 | -171.6 | 83.4 | 0 | 0 | 0 | 111 | G41 D42 E43 R47 T48 M49 | G41-H45 WeakPolarHBondContact O-CB 3.29Å; G41-H45 PolarHBondContact O-N 2.95Å; D42-H45 WeakPolarHBondContact O-CB 3.45Å; D42-H45 PolarHBondContact O-N 3.23Å; E43-H45 VanDerWaalsContact C-N 3.3Å; E43-H45 PolarHBondContact O-N 2.78Å; H45-R47 PolarHBondContact O-N 3.5Å; H45-T48 CarbonylContact O-C 3.56Å; H45-T48 PolarHBondContact O-N 2.88Å; H45-T48 VanDerWaalsContact O-N 3.16Å; H45-M49 PolarHBondContact O-N 2.96Å |
| 46 | Q | 87.2 | Confident | 84.2 | Confident | 122 Ų | 122 | 112.4 Ų | 112.4 | 57% | 0.57 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -60.3 | -46.5 | 176.3 | -74.8 | -175.4 | -14.8 | 0 | 0 | 112.1 | D42 E43 T48 M49 W50 | D42-Q46 WeakPolarHBondContact O-CG 3.43Å; D42-Q46 PolarHBondContact O-N 3.49Å; E43-Q46 PolarHBondContact O-N 3.32Å; Q46-T48 VanDerWaalsContact C-N 3.25Å; Q46-T48 PolarHBondContact O-N 3.01Å; Q46-M49 WeakPolarHBondContact O-CB 3.44Å; Q46-M49 PolarHBondContact O-N 3.49Å; Q46-M49 VanDerWaalsContact O-N 3.15Å; Q46-W50 PolarHBondContact O-N 3.38Å |
| 47 | R | 87 | Confident | 82.7 | Confident | 132 Ų | 132 | 115.5 Ų | 115.5 | 50% | 0.498 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -59.3 | -38 | 175.4 | -73.2 | 178.8 | -178.2 | -166 | 2.7 | 111.9 | E43 H45 R51 | E43-R47 WeakPolarHBondContact O-CB 3.19Å; E43-R47 WeakPolarHBondContact O-CG 3.29Å; E43-R47 PolarHBondContact O-N 3.1Å; E43-R47 IonicContact OE1-CZ 3.26Å; E43-R47 VanDerWaalsContact OE1-CZ 3.26Å; E43-R47 IonicContact OE1-NE 3.29Å; E43-R47 PolarHBondContact OE1-NE 3.33Å; E43-R47 IonicContact OE1-NH2 2.67Å; E43-R47 PolarHBondContact OE1-NH2 2.99Å; H45-R47 PolarHBondContact O-N 3.5Å; R47-R51 WeakPolarHBondContact O-CB 3.45Å; R47-R51 WeakPolarHBondContact O-CG 3.4Å; R47-R51 PolarHBondContact O-N 3.29Å; R47-R51 PolarHBondContact O-NE 2.83Å |
| 48 | T | 86.1 | Confident | 81 | Confident | 57 Ų | 57 | 120.1 Ų | 120.1 | 35% | 0.35 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -70.1 | -40 | 176.7 | -58.4 | 0 | 0 | 0 | 0 | 111.2 | L44 H45 Q46 R51 R52 | L44-T48 VanDerWaalsContact O-CB 3.31Å; L44-T48 WeakPolarHBondContact O-CB 3.47Å; L44-T48 PolarHBondContact O-N 3.46Å; L44-T48 PolarHBondContact O-OG1 3.43Å; H45-T48 CarbonylContact O-C 3.56Å; H45-T48 PolarHBondContact O-N 2.88Å; H45-T48 VanDerWaalsContact O-N 3.16Å; Q46-T48 VanDerWaalsContact C-N 3.25Å; Q46-T48 PolarHBondContact O-N 3.01Å; T48-R51 PolarHBondContact O-N 2.89Å; T48-R52 WeakPolarHBondContact O-CG 3.29Å; T48-R52 PolarHBondContact O-N 3.34Å |
| 49 | M | 85.3 | Confident | 79.1 | Confident | 87 Ų | 87 | 117.6 Ų | 117.6 | 43% | 0.429 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -61.6 | -46.3 | 175.6 | -163.6 | -166 | -160.7 | 0 | 0 | 111.4 | H45 Q46 R52 R53 | H45-M49 PolarHBondContact O-N 2.96Å; Q46-M49 WeakPolarHBondContact O-CB 3.44Å; Q46-M49 PolarHBondContact O-N 3.49Å; Q46-M49 VanDerWaalsContact O-N 3.15Å; M49-R52 PolarHBondContact O-N 2.67Å; M49-R53 VanDerWaalsContact CE-NH2 3.27Å; M49-R53 WeakPolarHBondContact O-CG 3.26Å; M49-R53 PolarHBondContact O-N 2.84Å |
| 50 | W | 80.6 | Confident | 77.4 | Confident | 166 Ų | 166 | 119.2 Ų | 119.2 | 63% | 0.629 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -61.3 | -43.5 | 174.6 | -74.7 | 118.7 | 0 | 0 | 0 | 112.3 | Q46 R52 R53 A54 | Q46-W50 PolarHBondContact O-N 3.38Å; W50-R52 PolarHBondContact O-N 3.42Å; W50-R53 PolarHBondContact O-N 3.39Å; W50-A54 WeakPolarHBondContact O-CB 3.3Å; W50-A54 PolarHBondContact O-N 2.92Å |
| 51 | R | 81.2 | Confident | 75.7 | Confident | 137 Ų | 137 | 118.8 Ų | 118.8 | 52% | 0.517 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -62.3 | -40 | 174.9 | -80.9 | -173.1 | -86.2 | -149.4 | 1.6 | 112.7 | R47 T48 A54 R55 | R47-R51 WeakPolarHBondContact O-CB 3.45Å; R47-R51 WeakPolarHBondContact O-CG 3.4Å; R47-R51 PolarHBondContact O-N 3.29Å; R47-R51 PolarHBondContact O-NE 2.83Å; T48-R51 PolarHBondContact O-N 2.89Å; R51-A54 PolarHBondContact O-N 3.03Å; R51-R55 WeakPolarHBondContact O-CB 3.43Å; R51-R55 WeakPolarHBondContact O-CG 3.36Å; R51-R55 PolarHBondContact O-N 3.22Å |
| 52 | R | 77 | Confident | 74.1 | Confident | 181 Ų | 181 | 123.7 Ų | 123.7 | 68% | 0.683 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -65.5 | -43.3 | 175 | -74.2 | -175.5 | -168.6 | -130.7 | 6 | 111.6 | T48 M49 W50 A54 R55 S56 | T48-R52 WeakPolarHBondContact O-CG 3.29Å; T48-R52 PolarHBondContact O-N 3.34Å; M49-R52 PolarHBondContact O-N 2.67Å; W50-R52 PolarHBondContact O-N 3.42Å; R52-A54 VanDerWaalsContact C-N 3.34Å; R52-A54 PolarHBondContact O-N 3.35Å; R52-R55 CarbonylContact O-C 3.59Å; R52-R55 PolarHBondContact O-N 2.92Å; R52-S56 PolarHBondContact O-N 3.03Å |
| 53 | R | 78.2 | Confident | 72.1 | Confident | 122 Ų | 122 | 122 Ų | 122 | 46% | 0.46 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -62.8 | -38 | 174.2 | -74.5 | 178.9 | 177.9 | 169.6 | -2.2 | 112.5 | M49 W50 S56 R57 | M49-R53 VanDerWaalsContact CE-NH2 3.27Å; M49-R53 WeakPolarHBondContact O-CG 3.26Å; M49-R53 PolarHBondContact O-N 2.84Å; W50-R53 PolarHBondContact O-N 3.39Å; R53-S56 PolarHBondContact O-N 3.28Å; R53-S56 PolarHBondContact O-OG 3.45Å; R53-R57 PolarHBondContact O-N 3.08Å |
| 54 | A | 72.5 | Confident | 70.6 | Confident | 61 Ų | 61 | 122.5 Ų | 122.5 | 50% | 0.504 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -67.4 | -40.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | W50 R51 R52 R57 R58 | W50-A54 WeakPolarHBondContact O-CB 3.3Å; W50-A54 PolarHBondContact O-N 2.92Å; R51-A54 PolarHBondContact O-N 3.03Å; R52-A54 VanDerWaalsContact C-N 3.34Å; R52-A54 PolarHBondContact O-N 3.35Å; A54-R57 PolarHBondContact O-N 3.45Å; A54-R58 PolarHBondContact O-N 3.1Å |
| 55 | R | 64.6 | Low | 69.2 | Low | 160 Ų | 160 | 125.6 Ų | 125.6 | 60% | 0.604 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -68.7 | -31.3 | 173.4 | -74.5 | -177.3 | -164.3 | 169.9 | 2.8 | 113 | R51 R52 R57 R58 | R51-R55 WeakPolarHBondContact O-CB 3.43Å; R51-R55 WeakPolarHBondContact O-CG 3.36Å; R51-R55 PolarHBondContact O-N 3.22Å; R52-R55 CarbonylContact O-C 3.59Å; R52-R55 PolarHBondContact O-N 2.92Å; R55-R57 PolarHBondContact O-N 2.98Å; R55-R58 CarbonylContact O-C 3.57Å; R55-R58 PolarHBondContact O-N 3.47Å; R55-R58 VanDerWaalsContact O-N 3.1Å |
| 56 | S | 61 | Low | 68.1 | Low | 100 Ų | 100 | 121.8 Ų | 121.8 | 70% | 0.699 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -67.6 | -22.3 | 175.6 | 75.6 | 0 | 0 | 0 | 0 | 112.4 | R52 R53 | R52-S56 PolarHBondContact O-N 3.03Å; R53-S56 PolarHBondContact O-N 3.28Å; R53-S56 PolarHBondContact O-OG 3.45Å |
| 57 | R | 58.8 | Low | 67.4 | Low | 230 Ų | 230 | 122.6 Ų | 122.6 | 87% | 0.868 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -85.8 | -15.3 | 171.2 | -69.9 | -171.6 | -173.9 | -179.7 | 1.6 | 114.2 | R53 A54 R55 | R53-R57 PolarHBondContact O-N 3.08Å; A54-R57 PolarHBondContact O-N 3.45Å; R55-R57 PolarHBondContact O-N 2.98Å |
| 58 | R | 54.8 | Low | 67 | Low | 209 Ų | 209 | 122.6 Ų | 122.6 | 79% | 0.789 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -132.1 | 87.2 | 176.6 | -71.2 | -176.8 | -174 | 173.7 | 1.6 | 107.2 | A54 R55 P60 | A54-R58 PolarHBondContact O-N 3.1Å; R55-R58 CarbonylContact O-C 3.57Å; R55-R58 PolarHBondContact O-N 3.47Å; R55-R58 VanDerWaalsContact O-N 3.1Å; R58-P60 WeakPolarHBondContact O-CD 3.34Å |
| 59 | A | 53.1 | Low | 66.7 | Low | 96 Ų | 96 | 126.4 Ų | 126.4 | 79% | 0.793 | 66% | 0.656 | S | S | * | * | trans | -46.3 | 109.8 | 169.9 | 0 | 0 | 0 | 0 | 0 | 107.9 | A61 | A59-A61 PolarHBondContact O-N 2.96Š| ||
| 60 | P | 53.9 | Low | 66.6 | Low | 91 Ų | 91 | 126.7 Ų | 126.7 | 59% | 0.591 | 66% | 0.664 | S | S | * | * | trans | -75.4 | 120.6 | 176.2 | 23.4 | -15.6 | 0 | 0 | 0 | 105.3 | R58 | R58-P60 WeakPolarHBondContact O-CD 3.34Š| ||
| 61 | A | 55.3 | Low | 66.9 | Low | 87 Ų | 87 | 127.8 Ų | 127.8 | 72% | 0.719 | 67% | 0.668 | S | S | * | * | trans | -46.4 | 128.5 | 165.5 | 0 | 0 | 0 | 0 | 0 | 108.1 | A59 G63 | A59-A61 PolarHBondContact O-N 2.96Å; A61-G63 VanDerWaalsContact C-N 3.31Å; A61-G63 PolarHBondContact O-N 3.36Å | ||
| 62 | P | 55.9 | Low | 67.2 | Low | 141 Ų | 141 | 125 Ų | 125 | 92% | 0.916 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -71 | 93.5 | 177.8 | 30 | -30.5 | 0 | 0 | 0 | 106.4 | ||
| 63 | G | 51 | Low | 67.6 | Low | 70 Ų | 70 | 119.4 Ų | 119.4 | 72% | 0.722 | 65% | 0.651 | S | S | * | * | trans | -164.4 | 38.5 | -163.6 | 0 | 0 | 0 | 0 | 0 | 116.3 | A61 | A61-G63 VanDerWaalsContact C-N 3.31Å; A61-G63 PolarHBondContact O-N 3.36Å | ||
| 64 | A | 58.8 | Low | 68 | Low | 93 Ų | 93 | 115.8 Ų | 115.8 | 77% | 0.769 | 65% | 0.648 | S | S | * | * | trans | 175.5 | 93.4 | 153 | 0 | 0 | 0 | 0 | 0 | 108.2 | P66 | A64-P66 VanDerWaalsContact O-CD 3.3Å; A64-P66 WeakPolarHBondContact O-CD 3.39Å | ||
| 65 | L | 62.7 | Low | 68.8 | Low | 166 Ų | 166 | 114.7 Ų | 114.7 | 87% | 0.869 | 64% | 0.638 | S | S | * | * | trans | -71.4 | 118.9 | 159.1 | -76 | 165.3 | 0 | 0 | 0 | 106.2 | T67 | L65-T67 PolarHBondContact O-N 2.84Š| ||
| 66 | P | 66.1 | Low | 70.1 | Confident | 49 Ų | 49 | 110.2 Ų | 110.2 | 32% | 0.318 | 64% | 0.635 | S | S | . | * | trans | -60.8 | 107.6 | 174.2 | 21.7 | -29.2 | 0 | 0 | 0 | 108.6 | A64 Y68 W69 | A64-P66 VanDerWaalsContact O-CD 3.3Å; A64-P66 WeakPolarHBondContact O-CD 3.39Å; P66-Y68 HydrophobicContact CB-CD1 3.6Å; P66-Y68 HydrophobicContact CB-CE1 3.17Å; P66-Y68 HydrophobicContact CB-CE2 4.29Å; P66-Y68 HydrophobicContact CB-CG 4.32Å; P66-Y68 HydrophobicContact CG-CE1 4.43Å; P66-Y68 PolarHBondContact O-N 3.14Å; P66-W69 HydrophobicContact CB-CE3 4.1Å; P66-W69 HydrophobicContact CG-CB 4.43Å; P66-W69 HydrophobicContact CG-CD2 4.17Å; P66-W69 HydrophobicContact CG-CE3 3.7Å; P66-W69 HydrophobicContact CG-CG 4.5Å; P66-W69 HydrophobicContact CG-CZ3 4.34Å; P66-W69 WeakPolarHBondContact O-CB 3.38Å; P66-W69 PolarHBondContact O-N 3.37Å | ||
| 67 | T | 71 | Confident | 71.5 | Confident | 139 Ų | 139 | 112.4 Ų | 112.4 | 85% | 0.853 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.7 | -12.6 | -179.5 | 8.6 | 0 | 0 | 0 | 0 | 113.1 | L65 P70 | L65-T67 PolarHBondContact O-N 2.84Å; T67-P70 WeakPolarHBondContact O-CD 3.37Å |
| 68 | Y | 78.8 | Confident | 73 | Confident | 133 Ų | 133 | 106.1 Ų | 106.1 | 52% | 0.522 | 62% | 0.621 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.9 | -10.1 | 176.8 | 67.1 | -96.8 | 0 | 0 | 0 | 114 | P66 P70 W71 L72 | P66-Y68 HydrophobicContact CB-CD1 3.6Å; P66-Y68 HydrophobicContact CB-CE1 3.17Å; P66-Y68 HydrophobicContact CB-CE2 4.29Å; P66-Y68 HydrophobicContact CB-CG 4.32Å; P66-Y68 HydrophobicContact CG-CE1 4.43Å; P66-Y68 PolarHBondContact O-N 3.14Å; Y68-P70 VanDerWaalsContact C-CD 3.44Å; Y68-W71 PolarHBondContact O-N 3.23Å; Y68-W71 VanDerWaalsContact O-N 3.17Å; Y68-L72 HydrophobicContact CD2-CD1 4.26Å; Y68-L72 HydrophobicContact CE2-CD1 4.35Å; Y68-L72 PolarHBondContact O-N 3.4Å |
| 69 | W | 80.3 | Confident | 74.7 | Confident | 136 Ų | 136 | 99 Ų | 99 | 52% | 0.515 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -58.2 | -41.2 | -177.4 | -136.9 | -110.8 | 0 | 0 | 0 | 114.2 | P66 W71 L72 C73 | P66-W69 HydrophobicContact CB-CE3 4.1Å; P66-W69 HydrophobicContact CG-CB 4.43Å; P66-W69 HydrophobicContact CG-CD2 4.17Å; P66-W69 HydrophobicContact CG-CE3 3.7Å; P66-W69 HydrophobicContact CG-CG 4.5Å; P66-W69 HydrophobicContact CG-CZ3 4.34Å; P66-W69 WeakPolarHBondContact O-CB 3.38Å; P66-W69 PolarHBondContact O-N 3.37Å; W69-W71 VanDerWaalsContact C-N 3.31Å; W69-W71 PolarHBondContact O-N 2.91Å; W69-L72 PolarHBondContact O-N 2.89Å; W69-C73 PolarHBondContact O-N 3.48Å; W69-C73 PolarHBondContact O-SG 3.34Å |
| 70 | P | 82.1 | Confident | 76.5 | Confident | 94 Ų | 94 | 97.5 Ų | 97.5 | 61% | 0.61 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -60.1 | -42.3 | 176.2 | -22.1 | 33.4 | 0 | 0 | 0 | 112 | T67 Y68 C73 A74 | T67-P70 WeakPolarHBondContact O-CD 3.37Å; Y68-P70 VanDerWaalsContact C-CD 3.44Å; P70-C73 PolarHBondContact O-N 3.34Å; P70-A74 WeakPolarHBondContact O-CB 3.23Å; P70-A74 PolarHBondContact O-N 3.49Å |
| 71 | W | 86.9 | Confident | 78.2 | Confident | 188 Ų | 188 | 98.1 Ų | 98.1 | 71% | 0.712 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -65 | -40.8 | 177 | -178.8 | 85.8 | 0 | 0 | 0 | 111.6 | Y68 W69 C73 A74 A75 | Y68-W71 PolarHBondContact O-N 3.23Å; Y68-W71 VanDerWaalsContact O-N 3.17Å; W69-W71 VanDerWaalsContact C-N 3.31Å; W69-W71 PolarHBondContact O-N 2.91Å; W71-C73 PolarHBondContact O-N 2.87Å; W71-A74 PolarHBondContact O-N 2.79Å; W71-A75 VanDerWaalsContact O-CB 3.3Å; W71-A75 WeakPolarHBondContact O-CB 3.4Å; W71-A75 PolarHBondContact O-N 2.92Å |
| 72 | L | 88 | Confident | 79.9 | Confident | 79 Ų | 79 | 96.4 Ų | 96.4 | 41% | 0.414 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.9 | -41.9 | 178.5 | -156.2 | 112.9 | 0 | 0 | 0 | 111.9 | Y68 W69 A75 A76 | Y68-L72 HydrophobicContact CD2-CD1 4.26Å; Y68-L72 HydrophobicContact CE2-CD1 4.35Å; Y68-L72 PolarHBondContact O-N 3.4Å; W69-L72 PolarHBondContact O-N 2.89Å; L72-A75 PolarHBondContact O-N 2.96Å; L72-A76 PolarHBondContact O-N 2.88Å |
| 73 | C | 86.5 | Confident | 81.5 | Confident | 64 Ų | 64 | 92.8 Ų | 92.8 | 43% | 0.432 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -64.8 | -43.2 | 174.7 | -72.4 | 0 | 0 | 0 | 0 | 112 | W69 P70 W71 A76 Q77 | W69-C73 PolarHBondContact O-N 3.48Å; W69-C73 PolarHBondContact O-SG 3.34Å; P70-C73 PolarHBondContact O-N 3.34Å; W71-C73 PolarHBondContact O-N 2.87Å; C73-A76 PolarHBondContact O-N 2.79Å; C73-Q77 PolarHBondContact O-N 3.13Å; C73-Q77 VanDerWaalsContact O-N 3.15Å |
| 74 | A | 86.6 | Confident | 83.2 | Confident | 46 Ų | 46 | 96.3 Ų | 96.3 | 38% | 0.38 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.1 | -44.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | P70 W71 A76 Q77 V78 | P70-A74 WeakPolarHBondContact O-CB 3.23Å; P70-A74 PolarHBondContact O-N 3.49Å; W71-A74 PolarHBondContact O-N 2.79Å; A74-A76 VanDerWaalsContact C-N 3.33Å; A74-A76 PolarHBondContact O-N 3.41Å; A74-Q77 PolarHBondContact O-N 3.2Å; A74-V78 WeakPolarHBondContact O-CB 3.41Å; A74-V78 VanDerWaalsContact O-CG2 3.26Å; A74-V78 WeakPolarHBondContact O-CG2 3.43Å; A74-V78 PolarHBondContact O-N 3Å |
| 75 | A | 89.2 | Confident | 84.6 | Confident | 38 Ų | 38 | 96 Ų | 96 | 31% | 0.314 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -60.5 | -41.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | W71 L72 V78 A79 | W71-A75 VanDerWaalsContact O-CB 3.3Å; W71-A75 WeakPolarHBondContact O-CB 3.4Å; W71-A75 PolarHBondContact O-N 2.92Å; L72-A75 PolarHBondContact O-N 2.96Å; A75-V78 PolarHBondContact O-N 3.27Å; A75-A79 VanDerWaalsContact O-CB 3.29Å; A75-A79 WeakPolarHBondContact O-CB 3.3Å; A75-A79 PolarHBondContact O-N 2.87Å |
| 76 | A | 90.5 | Very high | 85.7 | Confident | 65 Ų | 65 | 94 Ų | 94 | 54% | 0.537 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.1 | -42.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L72 C73 A74 A80 | L72-A76 PolarHBondContact O-N 2.88Å; C73-A76 PolarHBondContact O-N 2.79Å; A74-A76 VanDerWaalsContact C-N 3.33Å; A74-A76 PolarHBondContact O-N 3.41Å; A76-A80 PolarHBondContact O-N 3.32Å |
| 77 | Q | 91.1 | Very high | 86.4 | Confident | 147 Ų | 147 | 94.3 Ų | 94.3 | 69% | 0.687 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -66.5 | -44.3 | 176.1 | -73 | 179.4 | 3.3 | 0 | 0 | 112 | C73 A74 A79 A80 L81 | C73-Q77 PolarHBondContact O-N 3.13Å; C73-Q77 VanDerWaalsContact O-N 3.15Å; A74-Q77 PolarHBondContact O-N 3.2Å; Q77-A79 VanDerWaalsContact C-N 3.34Å; Q77-A79 PolarHBondContact O-N 3.32Å; Q77-A80 PolarHBondContact O-N 3.34Å; Q77-L81 WeakPolarHBondContact O-CB 3.39Å; Q77-L81 PolarHBondContact O-N 3.46Å |
| 78 | V | 90.2 | Very high | 86.7 | Confident | 97 Ų | 97 | 94.3 Ų | 94.3 | 59% | 0.588 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63 | -40.1 | 177.9 | 172.3 | 0 | 0 | 0 | 0 | 111 | A74 A75 A80 L81 A82 | A74-V78 WeakPolarHBondContact O-CB 3.41Å; A74-V78 VanDerWaalsContact O-CG2 3.26Å; A74-V78 WeakPolarHBondContact O-CG2 3.43Å; A74-V78 PolarHBondContact O-N 3Å; A75-V78 PolarHBondContact O-N 3.27Å; V78-A80 PolarHBondContact O-N 3.28Å; V78-L81 PolarHBondContact O-N 2.95Å; V78-A82 WeakPolarHBondContact O-CB 3.25Å; V78-A82 PolarHBondContact O-N 3.45Å |
| 79 | A | 91.1 | Very high | 85.9 | Confident | 60 Ų | 60 | 97.8 Ų | 97.8 | 50% | 0.496 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.3 | -43.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A75 Q77 A82 A83 | A75-A79 VanDerWaalsContact O-CB 3.29Å; A75-A79 WeakPolarHBondContact O-CB 3.3Å; A75-A79 PolarHBondContact O-N 2.87Å; Q77-A79 VanDerWaalsContact C-N 3.34Å; Q77-A79 PolarHBondContact O-N 3.32Å; A79-A82 PolarHBondContact O-N 2.85Å; A79-A83 WeakPolarHBondContact O-CB 3.39Å; A79-A83 PolarHBondContact O-N 3.3Å |
| 80 | A | 90 | Very high | 84.8 | Confident | 65 Ų | 65 | 98.7 Ų | 98.7 | 54% | 0.537 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -64 | -42.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | A76 Q77 V78 A83 W84 | A76-A80 PolarHBondContact O-N 3.32Å; Q77-A80 PolarHBondContact O-N 3.34Å; V78-A80 PolarHBondContact O-N 3.28Å; A80-A83 PolarHBondContact O-N 2.98Å; A80-W84 PolarHBondContact O-N 2.85Å; A80-W84 VanDerWaalsContact O-N 3.1Å |
| 81 | L | 90.5 | Very high | 83.2 | Confident | 104 Ų | 104 | 103.9 Ų | 103.9 | 55% | 0.545 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -67.8 | -42.3 | 178.9 | -163.6 | 153.8 | 0 | 0 | 0 | 111.5 | Q77 V78 W84 L85 | Q77-L81 WeakPolarHBondContact O-CB 3.39Å; Q77-L81 PolarHBondContact O-N 3.46Å; V78-L81 PolarHBondContact O-N 2.95Å; L81-W84 PolarHBondContact O-N 3.28Å; L81-L85 HydrophobicContact CD2-CD1 3.44Å; L81-L85 VanDerWaalsContact CD2-CD1 3.44Å; L81-L85 HydrophobicContact CD2-CG 3.92Å; L81-L85 WeakPolarHBondContact O-CG 3.36Å; L81-L85 PolarHBondContact O-N 3.23Å |
| 82 | A | 89.7 | Confident | 83 | Confident | 50 Ų | 50 | 99.7 Ų | 99.7 | 41% | 0.413 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62.6 | -43.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | V78 A79 W84 L85 L86 | V78-A82 WeakPolarHBondContact O-CB 3.25Å; V78-A82 PolarHBondContact O-N 3.45Å; A79-A82 PolarHBondContact O-N 2.85Å; A82-W84 VanDerWaalsContact C-N 3.32Å; A82-W84 PolarHBondContact O-N 3.43Å; A82-L85 PolarHBondContact O-N 2.77Å; A82-L86 VanDerWaalsContact O-CB 3.29Å; A82-L86 WeakPolarHBondContact O-CB 3.41Å; A82-L86 PolarHBondContact O-N 3.09Å |
| 83 | A | 89.8 | Confident | 82.7 | Confident | 66 Ų | 66 | 100.8 Ų | 100.8 | 55% | 0.545 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -61 | -41.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | A79 A80 L86 G87 | A79-A83 WeakPolarHBondContact O-CB 3.39Å; A79-A83 PolarHBondContact O-N 3.3Å; A80-A83 PolarHBondContact O-N 2.98Å; A83-L86 PolarHBondContact O-N 3.49Å; A83-G87 PolarHBondContact O-N 3.05Å; A83-G87 VanDerWaalsContact O-N 3.08Å |
| 84 | W | 87.9 | Confident | 82.5 | Confident | 144 Ų | 144 | 102.8 Ų | 102.8 | 55% | 0.545 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -66.8 | -42.9 | 177 | -174.8 | 85.6 | 0 | 0 | 0 | 112.8 | A80 L81 A82 G87 R88 | A80-W84 PolarHBondContact O-N 2.85Å; A80-W84 VanDerWaalsContact O-N 3.1Å; L81-W84 PolarHBondContact O-N 3.28Å; A82-W84 VanDerWaalsContact C-N 3.32Å; A82-W84 PolarHBondContact O-N 3.43Å; W84-G87 PolarHBondContact O-N 2.8Å; W84-R88 VanDerWaalsContact CH2-NE 3.25Å; W84-R88 PolarHBondContact O-N 2.96Å; W84-R88 VanDerWaalsContact O-N 3.14Å |
| 85 | L | 88.3 | Confident | 82.3 | Confident | 85 Ų | 85 | 106.2 Ų | 106.2 | 45% | 0.445 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -65.3 | -38.5 | 174.9 | -75.4 | 178.7 | 0 | 0 | 0 | 112.3 | L81 A82 G87 R88 R89 | L81-L85 HydrophobicContact CD2-CD1 3.44Å; L81-L85 VanDerWaalsContact CD2-CD1 3.44Å; L81-L85 HydrophobicContact CD2-CG 3.92Å; L81-L85 WeakPolarHBondContact O-CG 3.36Å; L81-L85 PolarHBondContact O-N 3.23Å; A82-L85 PolarHBondContact O-N 2.77Å; L85-G87 VanDerWaalsContact C-N 3.31Å; L85-G87 PolarHBondContact O-N 3.25Å; L85-R88 CarbonylContact O-C 3.6Å; L85-R88 PolarHBondContact O-N 2.88Å; L85-R88 VanDerWaalsContact O-N 3.1Å; L85-R89 PolarHBondContact O-N 2.69Å |
| 86 | L | 86.1 | Confident | 81.8 | Confident | 125 Ų | 125 | 110.4 Ų | 110.4 | 65% | 0.654 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -63.1 | -40.3 | 177.1 | -162.9 | 76.4 | 0 | 0 | 0 | 111 | A82 A83 R88 R89 | A82-L86 VanDerWaalsContact O-CB 3.29Å; A82-L86 WeakPolarHBondContact O-CB 3.41Å; A82-L86 PolarHBondContact O-N 3.09Å; A83-L86 PolarHBondContact O-N 3.49Å; L86-R88 VanDerWaalsContact C-N 3.27Å; L86-R88 PolarHBondContact O-N 2.99Å; L86-R89 PolarHBondContact O-N 3.2Å |
| 87 | G | 80.8 | Confident | 81.2 | Confident | 56 Ų | 56 | 113.5 Ų | 113.5 | 58% | 0.577 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -64.3 | -30.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | A83 W84 L85 | A83-G87 PolarHBondContact O-N 3.05Å; A83-G87 VanDerWaalsContact O-N 3.08Å; W84-G87 PolarHBondContact O-N 2.8Å; L85-G87 VanDerWaalsContact C-N 3.31Å; L85-G87 PolarHBondContact O-N 3.25Å |
| 88 | R | 76.2 | Confident | 80.5 | Confident | 139 Ų | 139 | 111.1 Ų | 111.1 | 53% | 0.525 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -83.1 | -18.4 | 176.2 | -75.4 | -168.1 | 171.2 | -153.4 | -1.6 | 114.7 | W84 L85 L86 N90 L91 | W84-R88 VanDerWaalsContact CH2-NE 3.25Å; W84-R88 PolarHBondContact O-N 2.96Å; W84-R88 VanDerWaalsContact O-N 3.14Å; L85-R88 CarbonylContact O-C 3.6Å; L85-R88 PolarHBondContact O-N 2.88Å; L85-R88 VanDerWaalsContact O-N 3.1Å; L86-R88 VanDerWaalsContact C-N 3.27Å; L86-R88 PolarHBondContact O-N 2.99Å; R88-N90 PolarHBondContact O-N 3.1Å; R88-L91 PolarHBondContact O-N 2.77Å; R88-L91 VanDerWaalsContact O-N 3.13Å |
| 89 | R | 62 | Low | 79.8 | Confident | 205 Ų | 205 | 112.2 Ų | 112.2 | 77% | 0.774 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.4 | -5.3 | 177.2 | -86.2 | -178 | 154.4 | 172.8 | -5.5 | 114.2 | L85 L86 | L85-R89 PolarHBondContact O-N 2.69Å; L86-R89 PolarHBondContact O-N 3.2Å |
| 90 | N | 56.9 | Low | 78.9 | Confident | 155 Ų | 155 | 116.5 Ų | 116.5 | 83% | 0.829 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.1 | 17.3 | 170.7 | -82 | -14.9 | 0 | 0 | 0 | 113.3 | R88 | R88-N90 PolarHBondContact O-N 3.1Š|
| 91 | L | 48.3 | Very low | 77.9 | Confident | 204 Ų | 204 | 121.2 Ų | 121.2 | 100% | 1.068 | 63% | 0.629 | S | S | * | * | trans | -110.4 | 0 | 168.3 | -73.8 | 164.3 | 0 | 0 | 0 | 109.5 | R88 | R88-L91 PolarHBondContact O-N 2.77Å; R88-L91 VanDerWaalsContact O-N 3.13Å |
Retrieved 91 of 91 residues in 67.4 ms
(Link to these results)