| 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 | 60.3 | Low | 80.8 | Confident | 178 Ų | 178 | 106.5 Ų | 106.5 | 88% | 0.877 | 58% | 0.583 | S | S | * | * | 0 | 110.1 | 0 | -93.5 | 172.5 | 68.5 | 0 | 0 | 106.9 | A6 L9 | M1-A6 HydrophobicContact CE-CB 4.35Å; M1-L9 HydrophobicContact CE-CD1 4.43Å | |||
| 2 | D | 80.7 | Confident | 81.5 | Confident | 122 Ų | 122 | 105.7 Ų | 105.7 | 65% | 0.652 | 58% | 0.577 | S | S | * | * | trans | -74.8 | 146.7 | 178.1 | -56.7 | -37.8 | 0 | 0 | 0 | 109.2 | R4 Q5 A6 | D2-R4 PolarHBondContact O-N 2.81Å; D2-R4 VanDerWaalsContact O-N 3.09Å; D2-Q5 WeakPolarHBondContact O-CA 3.28Å; D2-Q5 WeakPolarHBondContact O-CB 3.44Å; D2-Q5 PolarHBondContact O-N 3.47Å; D2-A6 PolarHBondContact O-N 2.82Å | ||
| 3 | S | 73.5 | Confident | 81.7 | Confident | 102 Ų | 102 | 104.6 Ų | 104.6 | 71% | 0.713 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -56.1 | -31.2 | -176.7 | 55.2 | 0 | 0 | 0 | 0 | 112.9 | A6 A7 | S3-A6 PolarHBondContact O-N 3.36Å; S3-A7 WeakPolarHBondContact O-CB 3.43Å; S3-A7 PolarHBondContact O-N 3.5Å |
| 4 | R | 80.3 | Confident | 82 | Confident | 215 Ų | 215 | 105.4 Ų | 105.4 | 81% | 0.811 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -64 | -39.4 | 174.1 | -67.3 | -176.4 | 174.6 | -167.5 | -2 | 112.8 | D2 A7 A8 | D2-R4 PolarHBondContact O-N 2.81Å; D2-R4 VanDerWaalsContact O-N 3.09Å; R4-A7 PolarHBondContact O-N 3.26Å; R4-A8 WeakPolarHBondContact O-CB 3.44Å; R4-A8 PolarHBondContact O-N 3.3Å |
| 5 | Q | 77.8 | Confident | 82 | Confident | 107 Ų | 107 | 105.4 Ų | 105.4 | 50% | 0.5 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -70.1 | -39.7 | 178.6 | -164.2 | 177 | 24.6 | 0 | 0 | 110.7 | D2 A8 L9 | D2-Q5 WeakPolarHBondContact O-CA 3.28Å; D2-Q5 WeakPolarHBondContact O-CB 3.44Å; D2-Q5 PolarHBondContact O-N 3.47Å; Q5-A8 PolarHBondContact O-N 3.49Å; Q5-L9 WeakPolarHBondContact O-CG 3.25Å; Q5-L9 PolarHBondContact O-N 3.12Å |
| 6 | A | 80.8 | Confident | 81.7 | Confident | 35 Ų | 35 | 105 Ų | 105 | 29% | 0.289 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63.9 | -42.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | M1 D2 S3 L9 L10 | M1-A6 HydrophobicContact CE-CB 4.35Å; D2-A6 PolarHBondContact O-N 2.82Å; S3-A6 PolarHBondContact O-N 3.36Å; A6-L9 PolarHBondContact O-N 2.69Å; A6-L10 PolarHBondContact O-N 3.39Å |
| 7 | A | 85.4 | Confident | 80.7 | Confident | 52 Ų | 52 | 106.5 Ų | 106.5 | 43% | 0.43 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -63.1 | -42.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | S3 R4 L9 L10 V11 | S3-A7 WeakPolarHBondContact O-CB 3.43Å; S3-A7 PolarHBondContact O-N 3.5Å; R4-A7 PolarHBondContact O-N 3.26Å; A7-L9 VanDerWaalsContact C-N 3.35Å; A7-L9 PolarHBondContact O-N 3.22Å; A7-L10 PolarHBondContact O-N 3.28Å; A7-V11 WeakPolarHBondContact O-CG2 3.46Å; A7-V11 PolarHBondContact O-N 3.47Å |
| 8 | A | 86.2 | Confident | 79.5 | Confident | 61 Ų | 61 | 109.7 Ų | 109.7 | 50% | 0.504 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -62.3 | -41.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | R4 Q5 V11 L12 | R4-A8 WeakPolarHBondContact O-CB 3.44Å; R4-A8 PolarHBondContact O-N 3.3Å; Q5-A8 PolarHBondContact O-N 3.49Å; A8-V11 PolarHBondContact O-N 3.31Å; A8-L12 WeakPolarHBondContact O-CB 3.27Å; A8-L12 PolarHBondContact O-N 3Å |
| 9 | L | 88.8 | Confident | 78.2 | Confident | 94 Ų | 94 | 106.8 Ų | 106.8 | 49% | 0.492 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66.6 | -39.2 | 176.9 | -70.2 | 172.9 | 0 | 0 | 0 | 112.4 | M1 Q5 A6 A7 L12 L13 | M1-L9 HydrophobicContact CE-CD1 4.43Å; Q5-L9 WeakPolarHBondContact O-CG 3.25Å; Q5-L9 PolarHBondContact O-N 3.12Å; A6-L9 PolarHBondContact O-N 2.69Å; A7-L9 VanDerWaalsContact C-N 3.35Å; A7-L9 PolarHBondContact O-N 3.22Å; L9-L12 PolarHBondContact O-N 2.92Å; L9-L13 WeakPolarHBondContact O-CB 3.4Å; L9-L13 PolarHBondContact O-N 3Å |
| 10 | L | 87 | Confident | 77 | Confident | 118 Ų | 118 | 107.6 Ų | 107.6 | 62% | 0.618 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -64.1 | -43.4 | 175.5 | -80.3 | 167.9 | 0 | 0 | 0 | 112.1 | A6 A7 L13 L14 | A6-L10 PolarHBondContact O-N 3.39Å; A7-L10 PolarHBondContact O-N 3.28Å; L10-L13 PolarHBondContact O-N 3.4Å; L10-L14 PolarHBondContact O-N 3.39Å |
| 11 | V | 87.8 | Confident | 75.5 | Confident | 87 Ų | 87 | 107.1 Ų | 107.1 | 53% | 0.527 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -63.2 | -46.7 | 176.1 | 171.5 | 0 | 0 | 0 | 0 | 110.4 | A7 A8 L13 L14 L15 | A7-V11 WeakPolarHBondContact O-CG2 3.46Å; A7-V11 PolarHBondContact O-N 3.47Å; A8-V11 PolarHBondContact O-N 3.31Å; V11-L13 VanDerWaalsContact C-N 3.31Å; V11-L13 PolarHBondContact O-N 2.9Å; V11-L14 PolarHBondContact O-N 3.38Å; V11-L15 HydrophobicContact CG1-CD1 3.64Å; V11-L15 WeakPolarHBondContact O-CD1 3.36Å; V11-L15 PolarHBondContact O-N 3.41Å |
| 12 | L | 88.9 | Confident | 75 | Confident | 97 Ų | 97 | 107.5 Ų | 107.5 | 51% | 0.508 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -58.7 | -43.2 | 177.8 | -178.7 | 63.3 | 0 | 0 | 0 | 112 | A8 L9 L14 L15 I16 | A8-L12 WeakPolarHBondContact O-CB 3.27Å; A8-L12 PolarHBondContact O-N 3Å; L9-L12 PolarHBondContact O-N 2.92Å; L12-L14 VanDerWaalsContact C-N 3.34Å; L12-L14 PolarHBondContact O-N 3.5Å; L12-L15 PolarHBondContact O-N 3.33Å; L12-I16 HydrophobicContact CD1-CD1 4.25Å; L12-I16 HydrophobicContact CG-CD1 4Å; L12-I16 VanDerWaalsContact O-CG1 3.29Å; L12-I16 WeakPolarHBondContact O-CG1 3.36Å; L12-I16 PolarHBondContact O-N 3.11Å; L12-I16 VanDerWaalsContact O-N 3.1Å |
| 13 | L | 85.3 | Confident | 73.1 | Confident | 92 Ų | 92 | 104.8 Ų | 104.8 | 48% | 0.482 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -64.3 | -39.6 | 178.7 | -168.3 | 65.1 | 0 | 0 | 0 | 111.8 | L9 L10 V11 I16 D17 | L9-L13 WeakPolarHBondContact O-CB 3.4Å; L9-L13 PolarHBondContact O-N 3Å; L10-L13 PolarHBondContact O-N 3.4Å; V11-L13 VanDerWaalsContact C-N 3.31Å; V11-L13 PolarHBondContact O-N 2.9Å; L13-I16 PolarHBondContact O-N 2.86Å; L13-D17 PolarHBondContact O-N 3.02Å; L13-D17 VanDerWaalsContact O-N 3.1Å |
| 14 | L | 84.8 | Confident | 72.2 | Confident | 115 Ų | 115 | 106.6 Ų | 106.6 | 60% | 0.602 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -65.5 | -38.5 | 176.8 | -169.8 | 68.3 | 0 | 0 | 0 | 112.2 | L10 V11 L12 D17 Q18 | L10-L14 PolarHBondContact O-N 3.39Å; V11-L14 PolarHBondContact O-N 3.38Å; L12-L14 VanDerWaalsContact C-N 3.34Å; L12-L14 PolarHBondContact O-N 3.5Å; L14-D17 PolarHBondContact O-N 3.45Å; L14-Q18 PolarHBondContact O-N 3.06Å |
| 15 | L | 82.9 | Confident | 70.1 | Confident | 106 Ų | 106 | 99.6 Ų | 99.6 | 56% | 0.555 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -66.8 | -37.2 | 176 | -90.5 | 81.6 | 0 | 0 | 0 | 112.3 | V11 L12 Q18 G19 | V11-L15 HydrophobicContact CG1-CD1 3.64Å; V11-L15 WeakPolarHBondContact O-CD1 3.36Å; V11-L15 PolarHBondContact O-N 3.41Å; L12-L15 PolarHBondContact O-N 3.33Å; L15-Q18 PolarHBondContact O-N 3.47Å; L15-G19 PolarHBondContact O-N 3.33Å |
| 16 | I | 77.1 | Confident | 68.2 | Low | 99 Ų | 99 | 98.5 Ų | 98.5 | 51% | 0.508 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -68.6 | -40.1 | 178.7 | -66.1 | 164.3 | 0 | 0 | 0 | 110.6 | L12 L13 Q18 G19 | L12-I16 HydrophobicContact CD1-CD1 4.25Å; L12-I16 HydrophobicContact CG-CD1 4Å; L12-I16 VanDerWaalsContact O-CG1 3.29Å; L12-I16 WeakPolarHBondContact O-CG1 3.36Å; L12-I16 PolarHBondContact O-N 3.11Å; L12-I16 VanDerWaalsContact O-N 3.1Å; L13-I16 PolarHBondContact O-N 2.86Å; I16-Q18 VanDerWaalsContact C-N 3.28Å; I16-Q18 PolarHBondContact O-N 3.01Å; I16-G19 PolarHBondContact O-N 3.48Å |
| 17 | D | 63.6 | Low | 66.6 | Low | 131 Ų | 131 | 106.2 Ų | 106.2 | 70% | 0.701 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -64.4 | -32.9 | 177.6 | -160.9 | 42.1 | 0 | 0 | 0 | 112.1 | L13 L14 | L13-D17 PolarHBondContact O-N 3.02Å; L13-D17 VanDerWaalsContact O-N 3.1Å; L14-D17 PolarHBondContact O-N 3.45Å |
| 18 | Q | 60.1 | Low | 64.3 | Low | 163 Ų | 163 | 112.5 Ų | 112.5 | 76% | 0.762 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -78.7 | -20.6 | 178.6 | -164.2 | 169.8 | 9.6 | 0 | 0 | 113.8 | L14 L15 I16 | L14-Q18 PolarHBondContact O-N 3.06Å; L15-Q18 PolarHBondContact O-N 3.47Å; I16-Q18 VanDerWaalsContact C-N 3.28Å; I16-Q18 PolarHBondContact O-N 3.01Å |
| 19 | G | 54.2 | Low | 62.2 | Low | 56 Ų | 56 | 115.9 Ų | 115.9 | 58% | 0.577 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -90.8 | -7.9 | -173.4 | 0 | 0 | 0 | 0 | 0 | 116 | L15 I16 | L15-G19 PolarHBondContact O-N 3.33Å; I16-G19 PolarHBondContact O-N 3.48Å |
| 20 | C | 54.7 | Low | 59.8 | Low | 121 Ų | 121 | 119.2 Ų | 119.2 | 82% | 0.818 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.9 | 31.9 | -172.5 | -90.5 | 0 | 0 | 0 | 0 | 114.5 | ||
| 21 | A | 46.1 | Very low | 57.7 | Low | 98 Ų | 98 | 121.7 Ų | 121.7 | 81% | 0.81 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.9 | 18.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 22 | E | 48.6 | Very low | 55.3 | Low | 187 Ų | 187 | 125.3 Ų | 125.3 | 87% | 0.874 | 73% | 0.726 | S | S | * | * | trans | -106.7 | 79.5 | 174.8 | -158.9 | 134.7 | -167.5 | 0 | 0 | 110.3 | ||||
| 23 | G | 41.5 | Very low | 53.3 | Low | 65 Ų | 65 | 126.3 Ų | 126.3 | 67% | 0.67 | 74% | 0.738 | S | S | * | * | trans | -87.4 | 129.8 | 166 | 0 | 0 | 0 | 0 | 0 | 109.9 | G25 | G23-G25 PolarHBondContact O-N 3.1Š| ||
| 24 | P | 53.7 | Low | 50.9 | Low | 139 Ų | 139 | 126.7 Ų | 126.7 | 90% | 0.903 | 75% | 0.754 | S | S | * | * | trans | -82.1 | 111.2 | 179 | 31.9 | -29.1 | 0 | 0 | 0 | 109.1 | ||||
| 25 | G | 37.6 | Very low | 49.1 | Very low | 69 Ų | 69 | 130.4 Ų | 130.4 | 71% | 0.711 | 77% | 0.768 | S | S | * | * | trans | -142.6 | 99.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | G23 Q27 | G23-G25 PolarHBondContact O-N 3.1Å; G25-Q27 PolarHBondContact O-N 2.95Å | ||
| 26 | G | 37.9 | Very low | 47 | Very low | 84 Ų | 84 | 134 Ų | 134 | 87% | 0.866 | 78% | 0.783 | S | S | * | * | trans | -57.8 | 131 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113 | Q28 | G26-Q28 PolarHBondContact O-N 3.45Š| ||
| 27 | Q | 46.8 | Very low | 45.6 | Very low | 197 Ų | 197 | 136.8 Ų | 136.8 | 92% | 0.921 | 80% | 0.798 | S | S | * | * | trans | -68.7 | 110.2 | 158.9 | -88 | 176.8 | -14.7 | 0 | 0 | 108.4 | G25 | G25-Q27 PolarHBondContact O-N 2.95Š| ||
| 28 | Q | 37.6 | Very low | 44.6 | Very low | 184 Ų | 184 | 135.5 Ų | 135.5 | 86% | 0.86 | 80% | 0.8 | S | S | * | * | trans | -135.4 | 137.6 | 153.3 | -105.5 | 172.7 | 22.6 | 0 | 0 | 108.8 | G26 | G26-Q28 PolarHBondContact O-N 3.45Š| ||
| 29 | D | 40.7 | Very low | 43.8 | Very low | 131 Ų | 131 | 135.7 Ų | 135.7 | 70% | 0.701 | 80% | 0.801 | S | S | * | * | trans | -64.3 | 155.8 | -164.5 | -52.1 | -77.7 | 0 | 0 | 0 | 113.8 | ||||
| 30 | H | 38.9 | Very low | 43.4 | Very low | 164 Ų | 164 | 138.9 Ų | 138.9 | 76% | 0.759 | 81% | 0.811 | S | S | * | * | 147 | 102.5 | 128.9 | -70.8 | -56.6 | 0 | 0 | 0 | 113.1 | |||||
| 31 | Q | 43 | Very low | 43.3 | Very low | 171 Ų | 171 | 139.8 Ų | 139.8 | 80% | 0.799 | 81% | 0.807 | S | S | * | * | 58.2 | 112.7 | 124.4 | -80.1 | -178.2 | -14 | 0 | 0 | 121.3 | |||||
| 32 | L | 37.1 | Very low | 43.6 | Very low | 163 Ų | 163 | 139 Ų | 139 | 85% | 0.853 | 79% | 0.794 | S | S | * | * | trans | 125.9 | 144.4 | 130.4 | -69 | -177.8 | 0 | 0 | 0 | 117.1 | ||||
| 33 | P | 47.2 | Very low | 43.7 | Very low | 118 Ų | 118 | 135.2 Ų | 135.2 | 77% | 0.766 | 79% | 0.785 | S | S | * | * | trans | -96.1 | 139.6 | -164 | 37.3 | -29 | 0 | 0 | 0 | 111.5 | ||||
| 34 | A | 35.1 | Very low | 44.3 | Very low | 100 Ų | 100 | 138.3 Ų | 138.3 | 83% | 0.826 | 78% | 0.783 | S | S | * | * | trans | -148.6 | 135.3 | 162.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 35 | E | 46.8 | Very low | 44.1 | Very low | 192 Ų | 192 | 139 Ų | 139 | 90% | 0.897 | 78% | 0.778 | S | S | * | * | trans | -24.4 | 130.8 | 164.5 | -68 | 176.4 | 82.9 | 0 | 0 | 114.2 | ||||
| 36 | E | 38.6 | Very low | 44.7 | Very low | 183 Ų | 183 | 139.4 Ų | 139.4 | 86% | 0.855 | 78% | 0.775 | S | S | * | * | -157.1 | 126.8 | 118.4 | -126.8 | 178.1 | 138.2 | 0 | 0 | 111.1 | S38 | E36-S38 PolarHBondContact O-N 3.2Š| |||
| 37 | D | 48.9 | Very low | 45.5 | Very low | 156 Ų | 156 | 141.4 Ų | 141.4 | 83% | 0.834 | 76% | 0.762 | S | S | * | * | trans | -42.4 | 111 | 162.2 | -172.4 | 22.2 | 0 | 0 | 0 | 111.5 | ||||
| 38 | S | 42.4 | Very low | 46.1 | Very low | 105 Ų | 105 | 136.3 Ų | 136.3 | 73% | 0.734 | 75% | 0.745 | S | S | * | * | trans | -151.3 | 103.9 | 168.8 | -77.1 | 0 | 0 | 0 | 0 | 109.2 | E36 | E36-S38 PolarHBondContact O-N 3.2Š| ||
| 39 | E | 43 | Very low | 47.3 | Very low | 166 Ų | 166 | 131.7 Ų | 131.7 | 78% | 0.776 | 73% | 0.733 | S | S | * | * | trans | -0.9 | 124.5 | 150.6 | -164.1 | -180 | 135.7 | 0 | 0 | 114.7 | L41 | E39-L41 PolarHBondContact O-N 3.38Š| ||
| 40 | P | 44.5 | Very low | 48.6 | Very low | 124 Ų | 124 | 126.8 Ų | 126.8 | 81% | 0.805 | 71% | 0.713 | S | S | * | * | trans | -67.4 | 98.2 | 179.6 | 21.4 | -23.9 | 0 | 0 | 0 | 110 | ||||
| 41 | L | 54.3 | Low | 50.5 | Low | 139 Ų | 139 | 121.8 Ų | 121.8 | 73% | 0.728 | 70% | 0.696 | S | S | * | * | trans | -47.6 | 128.4 | 167.2 | -78.9 | 158.6 | 0 | 0 | 0 | 108.9 | E39 | E39-L41 PolarHBondContact O-N 3.38Š| ||
| 42 | P | 51.6 | Low | 52.3 | Low | 82 Ų | 82 | 118 Ų | 118 | 53% | 0.532 | 68% | 0.681 | S | S | . | * | trans | -61.7 | 145.1 | 179.8 | 24.8 | -32.1 | 0 | 0 | 0 | 109.4 | Q44 | P42-Q44 WeakPolarHBondContact O-CG 3.04Å; P42-Q44 PolarHBondContact O-N 3.28Å | ||
| 43 | P | 49.5 | Very low | 54.2 | Low | 107 Ų | 107 | 115 Ų | 115 | 70% | 0.695 | 67% | 0.666 | S | S | * | * | trans | -64.5 | 97.2 | -178.9 | 25.7 | -33.2 | 0 | 0 | 0 | 110.1 | N45 | P43-N45 PolarHBondContact O-N 3.44Å; P43-N45 VanDerWaalsContact O-N 3.12Å | ||
| 44 | Q | 55.3 | Low | 55.8 | Low | 131 Ų | 131 | 117.6 Ų | 117.6 | 61% | 0.612 | 66% | 0.66 | S | S | * | * | G | 310 helix | trans | -65.9 | -10.8 | -178.4 | -66.1 | -179.5 | 57.4 | 0 | 0 | 113 | P42 A46 | P42-Q44 WeakPolarHBondContact O-CG 3.04Å; P42-Q44 PolarHBondContact O-N 3.28Å; Q44-A46 PolarHBondContact O-N 3.1Å |
| 45 | N | 48.5 | Very low | 57.9 | Low | 152 Ų | 152 | 121.2 Ų | 121.2 | 81% | 0.813 | 65% | 0.653 | S | S | * | * | G | 310 helix | trans | -86.3 | -2.7 | -173.8 | -70.2 | -18.6 | 0 | 0 | 0 | 115.3 | P43 | P43-N45 PolarHBondContact O-N 3.44Å; P43-N45 VanDerWaalsContact O-N 3.12Å |
| 46 | A | 50.2 | Low | 59.5 | Low | 78 Ų | 78 | 115.8 Ų | 115.8 | 65% | 0.645 | 63% | 0.63 | S | S | * | * | G | 310 helix | trans | -101.7 | -6.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q44 | Q44-A46 PolarHBondContact O-N 3.1Š|
| 47 | Q | 55 | Low | 61.5 | Low | 127 Ų | 127 | 111.8 Ų | 111.8 | 59% | 0.593 | 61% | 0.614 | S | S | * | * | S | Bend | trans | -100.2 | -3.7 | -169 | -76.7 | 172.5 | 6 | 0 | 0 | 114.5 | S51 | Q47-S51 VanDerWaalsContact O-CB 3.28Å; Q47-S51 WeakPolarHBondContact O-CB 3.29Å; Q47-S51 PolarHBondContact O-N 3.35Å; Q47-S51 PolarHBondContact O-OG 2.95Å |
| 48 | T | 60 | Low | 62.9 | Low | 90 Ų | 90 | 111 Ų | 111 | 55% | 0.552 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -78.1 | -45.2 | -174.3 | 48.9 | 0 | 0 | 0 | 0 | 112.6 | S51 L52 | T48-S51 PolarHBondContact O-OG 3.43Å; T48-L52 WeakPolarHBondContact O-CB 3.31Å; T48-L52 PolarHBondContact O-N 2.92Å; T48-L52 VanDerWaalsContact O-N 3.11Å |
| 49 | S | 61.7 | Low | 64.4 | Low | 87 Ų | 87 | 109.5 Ų | 109.5 | 61% | 0.608 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -70.6 | -43 | -177.4 | 59.5 | 0 | 0 | 0 | 0 | 112.8 | L52 L53 | S49-L52 PolarHBondContact O-N 3.03Å; S49-L53 WeakPolarHBondContact O-CB 3.48Å; S49-L53 PolarHBondContact O-N 3.31Å |
| 50 | G | 70 | Confident | 65.6 | Low | 27 Ų | 27 | 108 Ų | 108 | 28% | 0.278 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -71.9 | -26.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | R54 | G50-R54 WeakPolarHBondContact O-CB 3.37Å; G50-R54 VanDerWaalsContact O-CG 3.27Å; G50-R54 WeakPolarHBondContact O-CG 3.47Å; G50-R54 PolarHBondContact O-N 2.88Å; G50-R54 PolarHBondContact O-NE 3.04Å |
| 51 | S | 77.1 | Confident | 66.8 | Low | 60 Ų | 60 | 109.1 Ų | 109.1 | 42% | 0.42 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -78.9 | -40 | 173.9 | 56.5 | 0 | 0 | 0 | 0 | 111.5 | Q47 T48 R54 Y55 | Q47-S51 VanDerWaalsContact O-CB 3.28Å; Q47-S51 WeakPolarHBondContact O-CB 3.29Å; Q47-S51 PolarHBondContact O-N 3.35Å; Q47-S51 PolarHBondContact O-OG 2.95Å; T48-S51 PolarHBondContact O-OG 3.43Å; S51-R54 PolarHBondContact O-N 2.86Å; S51-Y55 WeakPolarHBondContact O-CB 3.28Å; S51-Y55 PolarHBondContact O-N 3.45Å |
| 52 | L | 80.5 | Confident | 67.1 | Low | 90 Ų | 90 | 110.3 Ų | 110.3 | 47% | 0.471 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -65.5 | -42.2 | 176 | -174.6 | 143.7 | 0 | 0 | 0 | 112.4 | T48 S49 R54 Y55 L56 | T48-L52 WeakPolarHBondContact O-CB 3.31Å; T48-L52 PolarHBondContact O-N 2.92Å; T48-L52 VanDerWaalsContact O-N 3.11Å; S49-L52 PolarHBondContact O-N 3.03Å; L52-R54 VanDerWaalsContact C-N 3.33Å; L52-R54 PolarHBondContact O-N 2.83Å; L52-Y55 PolarHBondContact O-N 3.29Å; L52-L56 HydrophobicContact CD2-CD1 3.61Å; L52-L56 HydrophobicContact CD2-CG 4.33Å; L52-L56 WeakPolarHBondContact O-CB 3.43Å; L52-L56 PolarHBondContact O-N 3.01Å |
| 53 | L | 79.1 | Confident | 67.3 | Low | 102 Ų | 102 | 113 Ų | 113 | 53% | 0.534 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -60.4 | -44.1 | 173.8 | 178.5 | 64.4 | 0 | 0 | 0 | 111.4 | S49 L56 L57 | S49-L53 WeakPolarHBondContact O-CB 3.48Å; S49-L53 PolarHBondContact O-N 3.31Å; L53-L56 PolarHBondContact O-N 3.38Å; L53-L57 HydrophobicContact CD1-CD1 4.29Å; L53-L57 HydrophobicContact CD1-CG 4.33Å; L53-L57 HydrophobicContact CG-CD1 4.06Å; L53-L57 WeakPolarHBondContact O-CB 3.46Å; L53-L57 VanDerWaalsContact O-CG 3.25Å; L53-L57 WeakPolarHBondContact O-CG 3.31Å; L53-L57 PolarHBondContact O-N 3.3Å |
| 54 | R | 79.5 | Confident | 67.6 | Low | 171 Ų | 171 | 111.7 Ų | 111.7 | 65% | 0.645 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -63.4 | -42.3 | 176.5 | -79.5 | -176.2 | -84.2 | -179.2 | -5.2 | 111.8 | G50 S51 L52 L57 Q58 | G50-R54 WeakPolarHBondContact O-CB 3.37Å; G50-R54 VanDerWaalsContact O-CG 3.27Å; G50-R54 WeakPolarHBondContact O-CG 3.47Å; G50-R54 PolarHBondContact O-N 2.88Å; G50-R54 PolarHBondContact O-NE 3.04Å; S51-R54 PolarHBondContact O-N 2.86Å; L52-R54 VanDerWaalsContact C-N 3.33Å; L52-R54 PolarHBondContact O-N 2.83Å; R54-L57 PolarHBondContact O-N 3.03Å; R54-Q58 VanDerWaalsContact O-CB 3.31Å; R54-Q58 WeakPolarHBondContact O-CB 3.32Å; R54-Q58 PolarHBondContact O-N 3.18Å |
| 55 | Y | 79.8 | Confident | 67.6 | Low | 176 Ų | 176 | 114.4 Ų | 114.4 | 69% | 0.69 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -63 | -42.8 | 176 | -171.5 | -95 | 0 | 0 | 0 | 112.1 | S51 L52 Q58 A59 | S51-Y55 WeakPolarHBondContact O-CB 3.28Å; S51-Y55 PolarHBondContact O-N 3.45Å; L52-Y55 PolarHBondContact O-N 3.29Å; Y55-Q58 PolarHBondContact O-N 3.06Å; Y55-A59 VanDerWaalsContact O-CB 3.28Å; Y55-A59 WeakPolarHBondContact O-CB 3.38Å; Y55-A59 PolarHBondContact O-N 3.49Å |
| 56 | L | 79.8 | Confident | 68.1 | Low | 79 Ų | 79 | 111.1 Ų | 111.1 | 41% | 0.414 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -64.3 | -45 | 174.8 | -80.7 | 172.5 | 0 | 0 | 0 | 112.3 | L52 L53 Q58 A59 M60 | L52-L56 HydrophobicContact CD2-CD1 3.61Å; L52-L56 HydrophobicContact CD2-CG 4.33Å; L52-L56 WeakPolarHBondContact O-CB 3.43Å; L52-L56 PolarHBondContact O-N 3.01Å; L53-L56 PolarHBondContact O-N 3.38Å; L56-Q58 VanDerWaalsContact C-N 3.3Å; L56-Q58 PolarHBondContact O-N 3.39Å; L56-A59 PolarHBondContact O-N 3.09Å; L56-M60 WeakPolarHBondContact O-CB 3.43Å; L56-M60 VanDerWaalsContact O-CG 3.31Å; L56-M60 WeakPolarHBondContact O-CG 3.47Å; L56-M60 PolarHBondContact O-N 2.99Å |
| 57 | L | 81 | Confident | 68.6 | Low | 99 Ų | 99 | 117.3 Ų | 117.3 | 52% | 0.518 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -60.9 | -42 | 177 | -73.2 | 171.4 | 0 | 0 | 0 | 111.3 | L53 R54 M60 E61 | L53-L57 HydrophobicContact CD1-CD1 4.29Å; L53-L57 HydrophobicContact CD1-CG 4.33Å; L53-L57 HydrophobicContact CG-CD1 4.06Å; L53-L57 WeakPolarHBondContact O-CB 3.46Å; L53-L57 VanDerWaalsContact O-CG 3.25Å; L53-L57 WeakPolarHBondContact O-CG 3.31Å; L53-L57 PolarHBondContact O-N 3.3Å; R54-L57 PolarHBondContact O-N 3.03Å; L57-M60 PolarHBondContact O-N 3.36Å; L57-E61 PolarHBondContact O-N 3.42Å |
| 58 | Q | 78.7 | Confident | 68.9 | Low | 140 Ų | 140 | 113.8 Ų | 113.8 | 65% | 0.654 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -69.3 | -37.8 | 176.7 | -171.8 | 161.4 | 0.3 | 0 | 0 | 112.5 | R54 Y55 L56 M60 E61 | R54-Q58 VanDerWaalsContact O-CB 3.31Å; R54-Q58 WeakPolarHBondContact O-CB 3.32Å; R54-Q58 PolarHBondContact O-N 3.18Å; Y55-Q58 PolarHBondContact O-N 3.06Å; L56-Q58 VanDerWaalsContact C-N 3.3Å; L56-Q58 PolarHBondContact O-N 3.39Å; Q58-M60 VanDerWaalsContact C-N 3.28Å; Q58-M60 PolarHBondContact O-N 2.73Å; Q58-E61 VanDerWaalsContact O-CB 3.27Å; Q58-E61 WeakPolarHBondContact O-CB 3.27Å; Q58-E61 PolarHBondContact O-N 3.39Å; Q58-E61 VanDerWaalsContact O-N 3.16Å |
| 59 | A | 73.4 | Confident | 68.8 | Low | 72 Ų | 72 | 116.4 Ų | 116.4 | 60% | 0.595 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -67.8 | -29.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y55 L56 E61 | Y55-A59 VanDerWaalsContact O-CB 3.28Å; Y55-A59 WeakPolarHBondContact O-CB 3.38Å; Y55-A59 PolarHBondContact O-N 3.49Å; L56-A59 PolarHBondContact O-N 3.09Å; A59-E61 VanDerWaalsContact C-N 3.33Å |
| 60 | M | 67.4 | Low | 68.9 | Low | 135 Ų | 135 | 119.7 Ų | 119.7 | 67% | 0.665 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -80.2 | -14.4 | 172.8 | -71.5 | -145.6 | -57 | 0 | 0 | 113.4 | L56 L57 Q58 R62 | L56-M60 WeakPolarHBondContact O-CB 3.43Å; L56-M60 VanDerWaalsContact O-CG 3.31Å; L56-M60 WeakPolarHBondContact O-CG 3.47Å; L56-M60 PolarHBondContact O-N 2.99Å; L57-M60 PolarHBondContact O-N 3.36Å; Q58-M60 VanDerWaalsContact C-N 3.28Å; Q58-M60 PolarHBondContact O-N 2.73Å; M60-R62 VanDerWaalsContact C-N 3.32Å; M60-R62 PolarHBondContact O-N 3.36Å |
| 61 | E | 71 | Confident | 68.7 | Low | 147 Ų | 147 | 127.3 Ų | 127.3 | 69% | 0.687 | 65% | 0.648 | S | S | * | * | trans | -70.2 | 88.8 | 174.9 | -160 | 175.4 | -175 | 0 | 0 | 109.3 | L57 Q58 A59 | L57-E61 PolarHBondContact O-N 3.42Å; Q58-E61 VanDerWaalsContact O-CB 3.27Å; Q58-E61 WeakPolarHBondContact O-CB 3.27Å; Q58-E61 PolarHBondContact O-N 3.39Å; Q58-E61 VanDerWaalsContact O-N 3.16Å; A59-E61 VanDerWaalsContact C-N 3.33Å | ||
| 62 | R | 60.9 | Low | 68.2 | Low | 164 Ų | 164 | 130 Ų | 130 | 62% | 0.619 | 65% | 0.654 | S | S | * | * | trans | -74.1 | 126.4 | 177.4 | -67.2 | -173.7 | -178 | -175.7 | -0.9 | 109.6 | M60 G64 R65 | M60-R62 VanDerWaalsContact C-N 3.32Å; M60-R62 PolarHBondContact O-N 3.36Å; R62-G64 PolarHBondContact O-N 3.33Å; R62-R65 PolarHBondContact O-N 2.97Å | ||
| 63 | P | 54.9 | Low | 67.6 | Low | 140 Ų | 140 | 130.9 Ų | 130.9 | 91% | 0.909 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.5 | 109.2 | 171.5 | -13.5 | 26.3 | 0 | 0 | 0 | 108.4 | ||
| 64 | G | 55.8 | Low | 67.3 | Low | 79 Ų | 79 | 134.3 Ų | 134.3 | 81% | 0.814 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 125.2 | -1.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 116 | R62 S66 | R62-G64 PolarHBondContact O-N 3.33Å; G64-S66 PolarHBondContact O-N 2.89Å |
| 65 | R | 54.5 | Low | 66.6 | Low | 187 Ų | 187 | 135.4 Ų | 135.4 | 71% | 0.706 | 68% | 0.682 | S | S | * | * | trans | -89.6 | 91.4 | 166.8 | -75.9 | -173.9 | 155 | 164.1 | -6.6 | 110.3 | R62 Q67 | R62-R65 PolarHBondContact O-N 2.97Å; R65-Q67 PolarHBondContact O-N 3.16Å | ||
| 66 | S | 60.1 | Low | 65.9 | Low | 84 Ų | 84 | 137.1 Ų | 137.1 | 59% | 0.587 | 69% | 0.694 | S | S | * | * | trans | -48.2 | 130.5 | 161.2 | 168.6 | 0 | 0 | 0 | 0 | 109.7 | G64 A68 | G64-S66 PolarHBondContact O-N 2.89Å; S66-A68 WeakPolarHBondContact CB-O 3.34Å; S66-A68 PolarHBondContact O-N 3.45Å; S66-A68 PolarHBondContact OG-O 2.88Å | ||
| 67 | Q | 60 | Low | 65.3 | Low | 208 Ų | 208 | 135 Ų | 135 | 97% | 0.972 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -69 | 1 | -178.2 | -163.1 | 174.5 | -16 | 0 | 0 | 113.7 | R65 | R65-Q67 PolarHBondContact O-N 3.16Š|
| 68 | A | 61.2 | Low | 64.5 | Low | 53 Ų | 53 | 137.1 Ų | 137.1 | 44% | 0.438 | 69% | 0.693 | S | S | . | * | S | Bend | trans | -141.9 | 158 | 167.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | S66 | S66-A68 WeakPolarHBondContact CB-O 3.34Å; S66-A68 PolarHBondContact O-N 3.45Å; S66-A68 PolarHBondContact OG-O 2.88Å |
| 69 | F | 59.1 | Low | 63.3 | Low | 144 Ų | 144 | 137.1 Ų | 137.1 | 63% | 0.632 | 70% | 0.697 | S | S | * | * | trans | 90.5 | 64.4 | 178.5 | -42.1 | -62.4 | 0 | 0 | 0 | 115.3 | F71 Q72 | F69-F71 VanDerWaalsContact C-N 3.3Å; F69-Q72 HydrophobicContact CB-CG 4.33Å; F69-Q72 HydrophobicContact CD1-CG 3.74Å; F69-Q72 VanDerWaalsContact CD1-NE2 3.33Å; F69-Q72 HydrophobicContact CE1-CG 4.48Å; F69-Q72 HydrophobicContact CG-CG 4.26Å | ||
| 70 | L | 63.8 | Low | 62.5 | Low | 156 Ų | 156 | 140.3 Ų | 140.3 | 82% | 0.817 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -72.8 | -21.3 | 158.8 | -77 | 171.7 | 0 | 0 | 0 | 113.1 | ||
| 71 | F | 64.1 | Low | 61.9 | Low | 187 Ų | 187 | 136.8 Ų | 136.8 | 82% | 0.82 | 69% | 0.689 | S | S | * | * | trans | -151 | 80.4 | 179.9 | -60.9 | -78.4 | 0 | 0 | 0 | 111.5 | F69 P73 | F69-F71 VanDerWaalsContact C-N 3.3Å; F71-P73 WeakPolarHBondContact O-CD 3.49Å | ||
| 72 | Q | 66.7 | Low | 61.4 | Low | 117 Ų | 117 | 132.8 Ų | 132.8 | 55% | 0.547 | 69% | 0.687 | S | S | . | * | trans | -95.9 | 101.1 | 147.3 | -68.8 | -168.1 | -13.5 | 0 | 0 | 106 | F69 Q74 | F69-Q72 HydrophobicContact CB-CG 4.33Å; F69-Q72 HydrophobicContact CD1-CG 3.74Å; F69-Q72 VanDerWaalsContact CD1-NE2 3.33Å; F69-Q72 HydrophobicContact CE1-CG 4.48Å; F69-Q72 HydrophobicContact CG-CG 4.26Å; Q72-Q74 PolarHBondContact O-N 2.86Å | ||
| 73 | P | 69.6 | Low | 61.2 | Low | 109 Ų | 109 | 131.4 Ų | 131.4 | 71% | 0.708 | 70% | 0.702 | S | S | * | * | trans | -53.5 | 135 | 171.8 | 21.6 | -30.4 | 0 | 0 | 0 | 107.8 | F71 R75 | F71-P73 WeakPolarHBondContact O-CD 3.49Å; P73-R75 PolarHBondContact O-N 3.29Å | ||
| 74 | Q | 71.2 | Confident | 61.2 | Low | 173 Ų | 173 | 132.6 Ų | 132.6 | 81% | 0.808 | 69% | 0.689 | S | S | * | * | trans | -32.6 | 104.8 | 179.7 | 177.9 | 65.6 | 24.6 | 0 | 0 | 110 | Q72 F76 | Q72-Q74 PolarHBondContact O-N 2.86Å; Q74-F76 VanDerWaalsContact C-N 3.33Å; Q74-F76 PolarHBondContact O-N 3.14Å | ||
| 75 | R | 65.2 | Low | 61.5 | Low | 194 Ų | 194 | 131.2 Ų | 131.2 | 73% | 0.732 | 67% | 0.667 | S | S | * | * | trans | -70.3 | 95.5 | -178.8 | -86.9 | -175.8 | 159.6 | -117.8 | -0.7 | 107.8 | P73 G77 | P73-R75 PolarHBondContact O-N 3.29Å; R75-G77 PolarHBondContact O-N 2.97Å | ||
| 76 | F | 66.4 | Low | 61.6 | Low | 212 Ų | 212 | 129 Ų | 129 | 93% | 0.93 | 67% | 0.669 | S | S | * | * | trans | -72.5 | 84.2 | 167.9 | -152.2 | -92.8 | 0 | 0 | 0 | 108 | Q74 | Q74-F76 VanDerWaalsContact C-N 3.33Å; Q74-F76 PolarHBondContact O-N 3.14Å | ||
| 77 | G | 67.1 | Low | 61.5 | Low | 36 Ų | 36 | 132.2 Ų | 132.2 | 37% | 0.371 | 68% | 0.675 | S | S | . | * | S | Bend | trans | -171 | 100.2 | -173 | 0 | 0 | 0 | 0 | 0 | 112.9 | R75 N79 | R75-G77 PolarHBondContact O-N 2.97Å; G77-N79 PolarHBondContact O-N 3.39Å; G77-N79 PolarHBondContact O-OD1 3.21Å |
| 78 | R | 62.3 | Low | 61.3 | Low | 142 Ų | 142 | 128 Ų | 128 | 54% | 0.536 | 65% | 0.65 | S | S | . | * | S | Bend | trans | 49.9 | 3.1 | 148.3 | -51.2 | -177.3 | 94.8 | 126.3 | 13.7 | 120.8 | T80 R81 R88 | R78-T80 VanDerWaalsContact C-N 3.25Å; R78-T80 PolarHBondContact O-N 2.98Å; R78-R81 WeakPolarHBondContact O-CB 3.44Å; R78-R81 PolarHBondContact O-N 3.17Å; R78-R88 VanDerWaalsContact NH2-NH2 3.1Å |
| 79 | N | 54.7 | Low | 61.1 | Low | 140 Ų | 140 | 133 Ų | 133 | 75% | 0.749 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | -11.7 | 179.9 | -49.5 | -19.8 | 0 | 0 | 0 | 112.7 | G77 | G77-N79 PolarHBondContact O-N 3.39Å; G77-N79 PolarHBondContact O-OD1 3.21Å |
| 80 | T | 56.6 | Low | 61 | Low | 140 Ų | 140 | 129.4 Ų | 129.4 | 86% | 0.859 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.2 | 15.8 | 176.7 | 56.5 | 0 | 0 | 0 | 0 | 112.8 | R78 G82 | R78-T80 VanDerWaalsContact C-N 3.25Å; R78-T80 PolarHBondContact O-N 2.98Å; T80-G82 VanDerWaalsContact C-N 3.29Å; T80-G82 PolarHBondContact O-N 3.17Å |
| 81 | R | 54.7 | Low | 60.6 | Low | 61 Ų | 61 | 128.4 Ų | 128.4 | 23% | 0.23 | 66% | 0.664 | C | S | . | * | trans | -76.4 | 83.1 | -178 | -165.5 | 179.3 | -123.3 | -129 | 4.9 | 109.6 | R78 W84 S85 | R78-R81 WeakPolarHBondContact O-CB 3.44Å; R78-R81 PolarHBondContact O-N 3.17Å; R81-W84 VanDerWaalsContact CD-CB 3.49Å; R81-W84 HydrophobicContact CG-CB 3.33Å; R81-W84 HydrophobicContact CG-CE3 4.34Å; R81-W84 HydrophobicContact CG-CG 4.21Å; R81-W84 VanDerWaalsContact NE-CB 3.29Å; R81-W84 VanDerWaalsContact NE-CG 3.26Å; R81-W84 VanDerWaalsContact NH1-CB 3.31Å; R81-W84 PolarHBondContact NH1-O 2.91Å; R81-S85 PolarHBondContact NH1-O 3.17Å | ||
| 82 | G | 59.5 | Low | 60.2 | Low | 63 Ų | 63 | 128.5 Ų | 128.5 | 65% | 0.649 | 66% | 0.659 | S | S | * | * | trans | -47.7 | 143.2 | 149.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | T80 W84 | T80-G82 VanDerWaalsContact C-N 3.29Å; T80-G82 PolarHBondContact O-N 3.17Å; G82-W84 PolarHBondContact O-N 3.28Å | ||
| 83 | S | 57 | Low | 59.6 | Low | 134 Ų | 134 | 126.6 Ų | 126.6 | 94% | 0.937 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -17.5 | 94.3 | -175.1 | -172.6 | 0 | 0 | 0 | 0 | 113.4 | ||
| 84 | W | 55.6 | Low | 58.9 | Low | 165 Ų | 165 | 122.6 Ų | 122.6 | 63% | 0.625 | 64% | 0.642 | S | S | * | * | trans | -118.6 | 112.5 | 172.4 | -179.5 | -30.1 | 0 | 0 | 0 | 105.8 | R81 G82 | R81-W84 VanDerWaalsContact CD-CB 3.49Å; R81-W84 HydrophobicContact CG-CB 3.33Å; R81-W84 HydrophobicContact CG-CE3 4.34Å; R81-W84 HydrophobicContact CG-CG 4.21Å; R81-W84 VanDerWaalsContact NE-CB 3.29Å; R81-W84 VanDerWaalsContact NE-CG 3.26Å; R81-W84 VanDerWaalsContact NH1-CB 3.31Å; R81-W84 PolarHBondContact NH1-O 2.91Å; G82-W84 PolarHBondContact O-N 3.28Å | ||
| 85 | S | 62.5 | Low | 58.3 | Low | 50 Ų | 50 | 121.9 Ų | 121.9 | 35% | 0.35 | 64% | 0.638 | S | S | . | * | trans | -38.8 | 142.6 | 175.9 | 63.4 | 0 | 0 | 0 | 0 | 113.7 | R81 E87 | R81-S85 PolarHBondContact NH1-O 3.17Å; S85-E87 VanDerWaalsContact CB-CD 3.43Å; S85-E87 WeakPolarHBondContact CB-OE1 3.08Å; S85-E87 WeakPolarHBondContact CB-OE2 3.28Å; S85-E87 PolarHBondContact O-N 3.45Å; S85-E87 PolarHBondContact OG-OE2 3.5Å | ||
| 86 | N | 55.5 | Low | 57.9 | Low | 140 Ų | 140 | 115.6 Ų | 115.6 | 75% | 0.749 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -80 | 21.1 | 177.9 | -82 | -51.5 | 0 | 0 | 0 | 112.4 | R88 | N86-R88 PolarHBondContact O-N 3.47Š|
| 87 | E | 58.2 | Low | 57.4 | Low | 152 Ų | 152 | 111.6 Ų | 111.6 | 71% | 0.71 | 62% | 0.621 | S | S | * | * | trans | -68.9 | 29.2 | 165.5 | -61.9 | 97.7 | -135.1 | 0 | 0 | 112.5 | S85 L89 | S85-E87 VanDerWaalsContact CB-CD 3.43Å; S85-E87 WeakPolarHBondContact CB-OE1 3.08Å; S85-E87 WeakPolarHBondContact CB-OE2 3.28Å; S85-E87 PolarHBondContact O-N 3.45Å; S85-E87 PolarHBondContact OG-OE2 3.5Å; E87-L89 VanDerWaalsContact C-N 3.3Å; E87-L89 PolarHBondContact O-N 3.43Å | ||
| 88 | R | 56.2 | Low | 56.8 | Low | 120 Ų | 120 | 114.1 Ų | 114.1 | 45% | 0.453 | 63% | 0.626 | S | S | . | * | trans | -61.3 | 102 | 162.2 | -67.1 | -176.8 | -163.2 | -168.9 | 5.4 | 106.3 | R78 N86 S90 | R78-R88 VanDerWaalsContact NH2-NH2 3.1Å; N86-R88 PolarHBondContact O-N 3.47Å; R88-S90 PolarHBondContact O-N 3.49Å | ||
| 89 | L | 58.1 | Low | 56.5 | Low | 158 Ų | 158 | 111.6 Ų | 111.6 | 83% | 0.827 | 63% | 0.631 | S | S | * | * | trans | -24.3 | 109.4 | 160.7 | -61.8 | 168.9 | 0 | 0 | 0 | 109.7 | E87 | E87-L89 VanDerWaalsContact C-N 3.3Å; E87-L89 PolarHBondContact O-N 3.43Å | ||
| 90 | S | 55.8 | Low | 56.6 | Low | 68 Ų | 68 | 111.5 Ų | 111.5 | 48% | 0.476 | 63% | 0.626 | S | S | . | * | trans | -53.5 | 134.1 | 175.1 | 171.7 | 0 | 0 | 0 | 0 | 108.3 | R88 R92 A93 | R88-S90 PolarHBondContact O-N 3.49Å; S90-R92 PolarHBondContact O-N 3.5Å; S90-R92 WeakPolarHBondContact OG-CB 3.4Å; S90-R92 PolarHBondContact OG-N 2.84Å; S90-R92 VanDerWaalsContact OG-N 3.14Å; S90-A93 WeakPolarHBondContact O-CB 3.43Å; S90-A93 PolarHBondContact O-N 2.91Å | ||
| 91 | P | 55.9 | Low | 56.9 | Low | 136 Ų | 136 | 112.7 Ų | 112.7 | 88% | 0.883 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.5 | -9.9 | 172.7 | 26.4 | -32.3 | 0 | 0 | 0 | 112 | ||
| 92 | R | 55.2 | Low | 57 | Low | 189 Ų | 189 | 120.1 Ų | 120.1 | 71% | 0.713 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92 | 13.6 | 171.9 | -159.3 | 126.9 | -164 | 171.1 | 5.4 | 114.4 | S90 E95 | S90-R92 PolarHBondContact O-N 3.5Å; S90-R92 WeakPolarHBondContact OG-CB 3.4Å; S90-R92 PolarHBondContact OG-N 2.84Å; S90-R92 VanDerWaalsContact OG-N 3.14Å; R92-E95 IonicContact NE-OE2 3.91Å |
| 93 | A | 53.3 | Low | 57 | Low | 76 Ų | 76 | 121 Ų | 121 | 63% | 0.628 | 64% | 0.644 | S | S | * | * | S | Bend | trans | -87.7 | 14.3 | 166.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | S90 | S90-A93 WeakPolarHBondContact O-CB 3.43Å; S90-A93 PolarHBondContact O-N 2.91Å |
| 94 | G | 56.3 | Low | 57.2 | Low | 25 Ų | 25 | 121.8 Ų | 121.8 | 26% | 0.258 | 64% | 0.637 | S | S | . | * | trans | -97.9 | 8.5 | -171.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | N98 | G94-N98 WeakPolarHBondContact CA-ND2 3.49Å; G94-N98 PolarHBondContact O-ND2 2.77Å | ||
| 95 | E | 57.5 | Low | 57.8 | Low | 158 Ų | 158 | 117.2 Ų | 117.2 | 74% | 0.738 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -87 | -6.2 | -174.6 | -115 | 148.7 | 178.2 | 0 | 0 | 114.1 | R92 | R92-E95 IonicContact NE-OE2 3.91Š|
| 96 | G | 57.7 | Low | 58.2 | Low | 62 Ų | 62 | 118.6 Ų | 118.6 | 64% | 0.639 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -108.5 | -41.3 | -176.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 97 | L | 55.5 | Low | 58.8 | Low | 128 Ų | 128 | 117.3 Ų | 117.3 | 67% | 0.67 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -121.3 | -13.8 | -164.2 | -57.9 | 176 | 0 | 0 | 0 | 114.2 | S99 Q100 | L97-S99 VanDerWaalsContact C-N 3.32Å; L97-S99 PolarHBondContact O-N 2.89Å; L97-Q100 PolarHBondContact O-N 3.48Å |
| 98 | N | 54.1 | Low | 59.7 | Low | 89 Ų | 89 | 118.7 Ų | 118.7 | 48% | 0.476 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -80.2 | -16.7 | -175.7 | -57.3 | -4 | 0 | 0 | 0 | 112.6 | G94 Q100 F101 | G94-N98 WeakPolarHBondContact CA-ND2 3.49Å; G94-N98 PolarHBondContact O-ND2 2.77Å; N98-Q100 VanDerWaalsContact C-N 3.28Å; N98-F101 PolarHBondContact O-N 2.87Å |
| 99 | S | 56 | Low | 60.5 | Low | 90 Ų | 90 | 123.4 Ų | 123.4 | 63% | 0.629 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -65.5 | -32.9 | 173.4 | 179.8 | 0 | 0 | 0 | 0 | 111.7 | L97 W102 S103 | L97-S99 VanDerWaalsContact C-N 3.32Å; L97-S99 PolarHBondContact O-N 2.89Å; S99-W102 PolarHBondContact O-N 3.02Å; S99-S103 PolarHBondContact O-N 3.23Å; S99-S103 PolarHBondContact O-OG 2.78Å |
| 100 | Q | 58.3 | Low | 61.2 | Low | 138 Ų | 138 | 125.6 Ų | 125.6 | 65% | 0.645 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -70.5 | -33.3 | 179.1 | -104.8 | 166.5 | 1.3 | 0 | 0 | 113 | L97 N98 W102 S103 L104 | L97-Q100 PolarHBondContact O-N 3.48Å; N98-Q100 VanDerWaalsContact C-N 3.28Å; Q100-W102 VanDerWaalsContact C-N 3.34Å; Q100-W102 PolarHBondContact O-N 3.41Å; Q100-S103 PolarHBondContact O-N 2.87Å; Q100-L104 WeakPolarHBondContact O-CG 3.37Å; Q100-L104 PolarHBondContact O-N 3.46Å |
| 101 | F | 61.9 | Low | 62 | Low | 164 Ų | 164 | 125.6 Ų | 125.6 | 72% | 0.719 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -62 | -40.5 | 177.1 | -105.5 | -85.1 | 0 | 0 | 0 | 112.6 | N98 S103 | N98-F101 PolarHBondContact O-N 2.87Å; F101-S103 VanDerWaalsContact C-N 3.32Å |
| 102 | W | 56.2 | Low | 62.5 | Low | 217 Ų | 217 | 128.5 Ų | 128.5 | 82% | 0.822 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -77.6 | -18.6 | 177.4 | -67.5 | 106.2 | 0 | 0 | 0 | 113.4 | S99 Q100 | S99-W102 PolarHBondContact O-N 3.02Å; Q100-W102 VanDerWaalsContact C-N 3.34Å; Q100-W102 PolarHBondContact O-N 3.41Å |
| 103 | S | 59.7 | Low | 62.8 | Low | 83 Ų | 83 | 133 Ų | 133 | 58% | 0.58 | 71% | 0.709 | S | S | * | * | H | α-helix | trans | -81.5 | -20.3 | 176.6 | -58.4 | 0 | 0 | 0 | 0 | 113.3 | S99 Q100 F101 A105 | S99-S103 PolarHBondContact O-N 3.23Å; S99-S103 PolarHBondContact O-OG 2.78Å; Q100-S103 PolarHBondContact O-N 2.87Å; F101-S103 VanDerWaalsContact C-N 3.32Å; S103-A105 VanDerWaalsContact C-N 3.35Å |
| 104 | L | 60.8 | Low | 63.2 | Low | 150 Ų | 150 | 135.9 Ų | 135.9 | 79% | 0.785 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -80 | -16.7 | 175.5 | -68.3 | 174.5 | 0 | 0 | 0 | 113.3 | Q100 A106 | Q100-L104 WeakPolarHBondContact O-CG 3.37Å; Q100-L104 PolarHBondContact O-N 3.46Å; L104-A106 PolarHBondContact O-N 2.92Å; L104-A106 VanDerWaalsContact O-N 3.17Å |
| 105 | A | 69.4 | Low | 63.6 | Low | 69 Ų | 69 | 141.7 Ų | 141.7 | 57% | 0.57 | 74% | 0.737 | S | S | * | * | trans | -86.4 | 41.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | S103 P107 | S103-A105 VanDerWaalsContact C-N 3.35Å; A105-P107 VanDerWaalsContact O-CD 3.28Å; A105-P107 WeakPolarHBondContact O-CD 2.97Å | ||
| 106 | A | 70.1 | Confident | 63.9 | Low | 78 Ų | 78 | 140.8 Ų | 140.8 | 65% | 0.645 | 74% | 0.737 | S | S | * | * | trans | -66 | 120.7 | 169.4 | 0 | 0 | 0 | 0 | 0 | 108.2 | L104 Q108 | L104-A106 PolarHBondContact O-N 2.92Å; L104-A106 VanDerWaalsContact O-N 3.17Å; A106-Q108 PolarHBondContact O-N 2.86Å; A106-Q108 VanDerWaalsContact O-N 3.17Å | ||
| 107 | P | 69 | Low | 64.3 | Low | 114 Ų | 114 | 145.4 Ų | 145.4 | 74% | 0.74 | 74% | 0.743 | S | S | * | * | trans | -59.2 | 123.5 | 179.6 | -23.3 | 33.6 | 0 | 0 | 0 | 110.3 | A105 R109 | A105-P107 VanDerWaalsContact O-CD 3.28Å; A105-P107 WeakPolarHBondContact O-CD 2.97Å; P107-R109 PolarHBondContact O-N 3.2Å | ||
| 108 | Q | 76.3 | Confident | 64.8 | Low | 180 Ų | 180 | 146.5 Ų | 146.5 | 84% | 0.841 | 75% | 0.748 | S | S | * | * | trans | -56.1 | 108.8 | 174.1 | -178.5 | 69.2 | 17.4 | 0 | 0 | 108.8 | A106 F110 | A106-Q108 PolarHBondContact O-N 2.86Å; A106-Q108 VanDerWaalsContact O-N 3.17Å; Q108-F110 PolarHBondContact O-N 2.89Å | ||
| 109 | R | 72.4 | Confident | 65.6 | Low | 220 Ų | 220 | 150.3 Ų | 150.3 | 83% | 0.83 | 77% | 0.766 | S | S | * | * | trans | -80 | 102.8 | 178.5 | -74.8 | -175 | 153 | -127 | -4.7 | 109.5 | P107 G111 | P107-R109 PolarHBondContact O-N 3.2Å; R109-G111 PolarHBondContact O-N 2.54Å | ||
| 110 | F | 72.8 | Confident | 66.2 | Low | 204 Ų | 204 | 154.6 Ų | 154.6 | 90% | 0.895 | 78% | 0.775 | S | S | * | * | trans | -73.5 | 117.8 | 168 | -152.7 | -98.5 | 0 | 0 | 0 | 109.2 | Q108 | Q108-F110 PolarHBondContact O-N 2.89Š| ||
| 111 | G | 73.6 | Confident | 66.9 | Low | 67 Ų | 67 | 155.9 Ų | 155.9 | 69% | 0.691 | 79% | 0.785 | S | S | * | * | trans | 48.8 | 111.8 | 160.4 | 0 | 0 | 0 | 0 | 0 | 119 | R109 | R109-G111 PolarHBondContact O-N 2.54Š| ||
| 112 | K | 66.3 | Low | 67.3 | Low | 198 Ų | 198 | 155.3 Ų | 155.3 | 86% | 0.861 | 79% | 0.791 | S | S | * | * | trans | -85.8 | 141.5 | 142.3 | -91 | -169.8 | 165.6 | -172.7 | 0 | 108 | ||||
| 113 | K | 60.6 | Low | 68.3 | Low | 283 Ų | 283 | 149.6 Ų | 149.6 | 100% | 1.23 | 79% | 0.788 | S | S | * | * | trans | -50 | 0 | -178 | -55.9 | -172.7 | 179.1 | -172.4 | 0 | 113.1 |
Retrieved 113 of 113 residues in 116.1 ms
(Link to these results)