| 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 | 34 | Very low | 55.2 | Low | 239 Ų | 239 | 137.8 Ų | 137.8 | 100% | 1.177 | 72% | 0.72 | S | S | * | * | 0 | 150.1 | 0 | -84.6 | -168.9 | 170.2 | 0 | 0 | 108.8 | |||||
| 2 | S | 43.5 | Very low | 56.7 | Low | 107 Ų | 107 | 134.3 Ų | 134.3 | 75% | 0.748 | 71% | 0.708 | S | S | * | * | trans | 60.6 | 107.4 | 161.2 | 56.2 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 3 | N | 49.4 | Very low | 58.2 | Low | 154 Ų | 154 | 133.2 Ų | 133.2 | 82% | 0.824 | 70% | 0.702 | S | S | * | * | trans | -168.9 | 39.3 | 136.7 | -92.2 | -13.5 | 0 | 0 | 0 | 112.5 | T5 | N3-T5 PolarHBondContact O-N 3.47Š| ||
| 4 | I | 49.7 | Very low | 59.3 | Low | 155 Ų | 155 | 128.2 Ų | 128.2 | 80% | 0.795 | 68% | 0.676 | S | S | * | * | trans | -86.5 | 77.8 | 159.9 | -74.7 | 167.1 | 0 | 0 | 0 | 106.2 | R6 | I4-R6 VanDerWaalsContact C-N 3.33Å; I4-R6 HydrophobicContact CG2-CG 3.98Å; I4-R6 PolarHBondContact O-N 3.03Å; I4-R6 VanDerWaalsContact O-N 3.08Å | ||
| 5 | T | 54 | Low | 60.5 | Low | 105 Ų | 105 | 131.1 Ų | 131.1 | 64% | 0.644 | 68% | 0.68 | S | S | * | * | trans | -73 | 99.1 | 165.3 | -28.6 | 0 | 0 | 0 | 0 | 105.5 | N3 D9 | N3-T5 PolarHBondContact O-N 3.47Å; T5-D9 WeakPolarHBondContact CG2-OD2 3.26Å | ||
| 6 | R | 53.2 | Low | 61.4 | Low | 189 Ų | 189 | 128.4 Ų | 128.4 | 71% | 0.713 | 68% | 0.683 | S | S | * | * | trans | -57.3 | 141.7 | -171.2 | -74.1 | 172.5 | -97.8 | 166.7 | -4.3 | 109.4 | I4 C8 D9 | I4-R6 VanDerWaalsContact C-N 3.33Å; I4-R6 HydrophobicContact CG2-CG 3.98Å; I4-R6 PolarHBondContact O-N 3.03Å; I4-R6 VanDerWaalsContact O-N 3.08Å; R6-C8 PolarHBondContact O-N 2.99Å; R6-D9 PolarHBondContact O-N 3Å | ||
| 7 | K | 61.7 | Low | 62.6 | Low | 197 Ų | 197 | 126.6 Ų | 126.6 | 86% | 0.857 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -45.6 | -9.6 | 174.9 | -72.8 | 178.5 | 171.5 | -179.4 | 0 | 116 | D9 | K7-D9 VanDerWaalsContact C-N 3.26Å; K7-D9 PolarHBondContact O-N 2.92Å |
| 8 | C | 55.9 | Low | 62.8 | Low | 88 Ų | 88 | 123.1 Ų | 123.1 | 60% | 0.595 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | -16.4 | 178.3 | -53.6 | 0 | 0 | 0 | 0 | 114.5 | R6 | R6-C8 PolarHBondContact O-N 2.99Š|
| 9 | D | 65.6 | Low | 63.4 | Low | 85 Ų | 85 | 123.3 Ų | 123.3 | 46% | 0.455 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -79.4 | -20.5 | -178.4 | -77.7 | -17.8 | 0 | 0 | 0 | 114.2 | T5 R6 K7 V12 L13 | T5-D9 WeakPolarHBondContact CG2-OD2 3.26Å; R6-D9 PolarHBondContact O-N 3Å; K7-D9 VanDerWaalsContact C-N 3.26Å; K7-D9 PolarHBondContact O-N 2.92Å; D9-V12 PolarHBondContact O-N 2.83Å; D9-L13 HydrophobicContact CB-CD1 4.45Å; D9-L13 WeakPolarHBondContact O-CB 3.16Å; D9-L13 WeakPolarHBondContact O-CD1 3.38Å; D9-L13 WeakPolarHBondContact O-CG 3.49Å; D9-L13 PolarHBondContact O-N 2.57Å |
| 10 | V | 70.2 | Confident | 63.6 | Low | 85 Ų | 85 | 126.7 Ų | 126.7 | 52% | 0.515 | 68% | 0.683 | S | S | . | * | H | α-helix | trans | -66.4 | -46.7 | -175.3 | 177.5 | 0 | 0 | 0 | 0 | 110.6 | V12 L13 L14 | V10-V12 VanDerWaalsContact C-N 3.33Å; V10-V12 PolarHBondContact O-N 2.94Å; V10-L13 PolarHBondContact O-N 2.76Å; V10-L14 HydrophobicContact CG1-CD1 3.5Å; V10-L14 VanDerWaalsContact CG1-CD1 3.5Å; V10-L14 WeakPolarHBondContact O-CB 3.38Å; V10-L14 WeakPolarHBondContact O-CD1 3.08Å; V10-L14 PolarHBondContact O-N 3.15Å |
| 11 | D | 70 | Confident | 63.7 | Low | 112 Ų | 112 | 122.4 Ų | 122.4 | 60% | 0.599 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -68.4 | -32.6 | -178.4 | -65.6 | -24.4 | 0 | 0 | 0 | 112.9 | K15 | D11-K15 WeakPolarHBondContact O-CB 3.47Å; D11-K15 WeakPolarHBondContact O-CG 3.27Å; D11-K15 PolarHBondContact O-N 2.98Å |
| 12 | V | 72.8 | Confident | 64.9 | Low | 95 Ų | 95 | 119.2 Ų | 119.2 | 58% | 0.576 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -69.5 | -44.3 | 175.2 | 179.9 | 0 | 0 | 0 | 0 | 110.1 | D9 V10 K15 A16 | D9-V12 PolarHBondContact O-N 2.83Å; V10-V12 VanDerWaalsContact C-N 3.33Å; V10-V12 PolarHBondContact O-N 2.94Å; V12-K15 PolarHBondContact O-N 3.02Å; V12-A16 WeakPolarHBondContact O-CB 3.32Å; V12-A16 PolarHBondContact O-N 2.81Å |
| 13 | L | 77 | Confident | 65.3 | Low | 120 Ų | 120 | 118.5 Ų | 118.5 | 63% | 0.628 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -62.6 | -41.8 | 175.7 | -73.5 | 167.3 | 0 | 0 | 0 | 111.9 | D9 V10 A16 S17 | D9-L13 HydrophobicContact CB-CD1 4.45Å; D9-L13 WeakPolarHBondContact O-CB 3.16Å; D9-L13 WeakPolarHBondContact O-CD1 3.38Å; D9-L13 WeakPolarHBondContact O-CG 3.49Å; D9-L13 PolarHBondContact O-N 2.57Å; V10-L13 PolarHBondContact O-N 2.76Å; L13-A16 PolarHBondContact O-N 2.75Å; L13-S17 VanDerWaalsContact O-CB 3.28Å; L13-S17 WeakPolarHBondContact O-CB 3.44Å; L13-S17 PolarHBondContact O-N 3.15Å |
| 14 | L | 73.4 | Confident | 65.1 | Low | 64 Ų | 64 | 120.5 Ų | 120.5 | 34% | 0.335 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -63.8 | -44 | 176.2 | -91.6 | 134.5 | 0 | 0 | 0 | 111.9 | V10 S17 F19 | V10-L14 HydrophobicContact CG1-CD1 3.5Å; V10-L14 VanDerWaalsContact CG1-CD1 3.5Å; V10-L14 WeakPolarHBondContact O-CB 3.38Å; V10-L14 WeakPolarHBondContact O-CD1 3.08Å; V10-L14 PolarHBondContact O-N 3.15Å; L14-S17 WeakPolarHBondContact O-CB 3.4Å; L14-S17 PolarHBondContact O-N 3.48Å; L14-F19 HydrophobicContact CB-CB 4.43Å; L14-F19 HydrophobicContact CD2-CB 3.78Å; L14-F19 HydrophobicContact CD2-CD1 3.25Å; L14-F19 HydrophobicContact CD2-CD2 4.16Å; L14-F19 HydrophobicContact CD2-CE1 3.76Å; L14-F19 HydrophobicContact CD2-CG 3.47Å; L14-F19 VanDerWaalsContact CD2-CG 3.47Å; L14-F19 HydrophobicContact CD2-CZ 4.4Å; L14-F19 VanDerWaalsContact O-CB 3.26Å; L14-F19 WeakPolarHBondContact O-CB 3.35Å; L14-F19 PolarHBondContact O-N 2.82Å; L14-F19 VanDerWaalsContact O-N 3.1Å |
| 15 | K | 76.5 | Confident | 64.8 | Low | 171 Ų | 171 | 118.1 Ų | 118.1 | 74% | 0.743 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -65.6 | -41.6 | 175.5 | -75.7 | -177.3 | -178.6 | 179.9 | 0 | 112.4 | D11 V12 S17 G18 | D11-K15 WeakPolarHBondContact O-CB 3.47Å; D11-K15 WeakPolarHBondContact O-CG 3.27Å; D11-K15 PolarHBondContact O-N 2.98Å; V12-K15 PolarHBondContact O-N 3.02Å; K15-S17 VanDerWaalsContact C-N 3.29Å; K15-S17 PolarHBondContact O-N 2.84Å; K15-G18 PolarHBondContact O-N 3.16Å; K15-G18 VanDerWaalsContact O-N 3.13Å |
| 16 | A | 76.2 | Confident | 64.3 | Low | 88 Ų | 88 | 122.3 Ų | 122.3 | 73% | 0.727 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -65.6 | -32.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | V12 L13 G18 | V12-A16 WeakPolarHBondContact O-CB 3.32Å; V12-A16 PolarHBondContact O-N 2.81Å; L13-A16 PolarHBondContact O-N 2.75Å; A16-G18 PolarHBondContact O-N 2.67Å; A16-G18 VanDerWaalsContact O-N 3.16Å |
| 17 | S | 80.5 | Confident | 64 | Low | 98 Ų | 98 | 118.1 Ų | 118.1 | 69% | 0.685 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.6 | -4 | 173.8 | -179.7 | 0 | 0 | 0 | 0 | 113.6 | L13 L14 K15 F19 | L13-S17 VanDerWaalsContact O-CB 3.28Å; L13-S17 WeakPolarHBondContact O-CB 3.44Å; L13-S17 PolarHBondContact O-N 3.15Å; L14-S17 WeakPolarHBondContact O-CB 3.4Å; L14-S17 PolarHBondContact O-N 3.48Å; K15-S17 VanDerWaalsContact C-N 3.29Å; K15-S17 PolarHBondContact O-N 2.84Å; S17-F19 PolarHBondContact O-N 3.49Å |
| 18 | G | 67.7 | Low | 63.2 | Low | 63 Ų | 63 | 115.5 Ų | 115.5 | 65% | 0.649 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 68.9 | 19.7 | -173.5 | 0 | 0 | 0 | 0 | 0 | 113 | K15 A16 K20 | K15-G18 PolarHBondContact O-N 3.16Å; K15-G18 VanDerWaalsContact O-N 3.13Å; A16-G18 PolarHBondContact O-N 2.67Å; A16-G18 VanDerWaalsContact O-N 3.16Å; G18-K20 VanDerWaalsContact C-N 3.32Å; G18-K20 PolarHBondContact O-N 3.05Å |
| 19 | F | 73.2 | Confident | 62.6 | Low | 128 Ų | 128 | 120.1 Ų | 120.1 | 56% | 0.561 | 67% | 0.672 | S | S | * | * | trans | -69 | 93.6 | 174.1 | -174 | -100.2 | 0 | 0 | 0 | 108.8 | L14 S17 G21 | L14-F19 HydrophobicContact CB-CB 4.43Å; L14-F19 HydrophobicContact CD2-CB 3.78Å; L14-F19 HydrophobicContact CD2-CD1 3.25Å; L14-F19 HydrophobicContact CD2-CD2 4.16Å; L14-F19 HydrophobicContact CD2-CE1 3.76Å; L14-F19 HydrophobicContact CD2-CG 3.47Å; L14-F19 VanDerWaalsContact CD2-CG 3.47Å; L14-F19 HydrophobicContact CD2-CZ 4.4Å; L14-F19 VanDerWaalsContact O-CB 3.26Å; L14-F19 WeakPolarHBondContact O-CB 3.35Å; L14-F19 PolarHBondContact O-N 2.82Å; L14-F19 VanDerWaalsContact O-N 3.1Å; S17-F19 PolarHBondContact O-N 3.49Å; F19-G21 VanDerWaalsContact C-N 3.27Å; F19-G21 PolarHBondContact O-N 3.22Å | ||
| 20 | K | 68.4 | Low | 61.8 | Low | 191 Ų | 191 | 124.4 Ų | 124.4 | 83% | 0.83 | 69% | 0.689 | S | S | * | * | trans | -73.7 | 92.3 | 167 | -148.5 | 158.1 | -174.7 | 177.2 | 0 | 105.4 | G18 | G18-K20 VanDerWaalsContact C-N 3.32Å; G18-K20 PolarHBondContact O-N 3.05Å | ||
| 21 | G | 64 | Low | 60.9 | Low | 36 Ų | 36 | 128 Ų | 128 | 37% | 0.371 | 71% | 0.705 | S | S | . | * | trans | -47.6 | 150.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | F19 S23 | F19-G21 VanDerWaalsContact C-N 3.27Å; F19-G21 PolarHBondContact O-N 3.22Å; G21-S23 PolarHBondContact O-N 2.94Å | ||
| 22 | L | 59.4 | Low | 60.3 | Low | 172 Ų | 172 | 128.5 Ų | 128.5 | 90% | 0.901 | 71% | 0.712 | S | S | * | * | trans | -63 | 79.6 | 179.2 | -58.7 | 172.1 | 0 | 0 | 0 | 108.8 | E24 | L22-E24 PolarHBondContact O-N 3.29Š| ||
| 23 | S | 52.4 | Low | 59.5 | Low | 92 Ų | 92 | 128 Ų | 128 | 64% | 0.643 | 72% | 0.718 | S | S | * | * | trans | -61.2 | 119.5 | 161.6 | 47.6 | 0 | 0 | 0 | 0 | 105.5 | G21 S25 | G21-S23 PolarHBondContact O-N 2.94Å; S23-S25 PolarHBondContact O-N 2.94Å | ||
| 24 | E | 46.1 | Very low | 58 | Low | 196 Ų | 196 | 131.6 Ų | 131.6 | 92% | 0.916 | 73% | 0.732 | S | S | * | * | trans | -58.7 | 86.8 | 177.1 | -63.1 | 173.8 | 160.5 | 0 | 0 | 108.6 | L22 E26 | L22-E24 PolarHBondContact O-N 3.29Å; E24-E26 PolarHBondContact O-N 3.3Å | ||
| 25 | S | 42.7 | Very low | 56.5 | Low | 106 Ų | 106 | 135.6 Ų | 135.6 | 74% | 0.741 | 75% | 0.753 | S | S | * | * | trans | -82 | 94.3 | 163.8 | 48.9 | 0 | 0 | 0 | 0 | 106.8 | S23 S27 | S23-S25 PolarHBondContact O-N 2.94Å; S25-S27 PolarHBondContact O-N 2.87Å | ||
| 26 | E | 44.1 | Very low | 55 | Low | 193 Ų | 193 | 133.8 Ų | 133.8 | 90% | 0.902 | 75% | 0.752 | S | S | * | * | trans | -48.2 | 110.3 | 150.8 | 178.5 | -176.3 | 167.6 | 0 | 0 | 108.1 | E24 | E24-E26 PolarHBondContact O-N 3.3Š| ||
| 27 | S | 45.5 | Very low | 53.9 | Low | 100 Ų | 100 | 137 Ų | 137 | 70% | 0.699 | 75% | 0.751 | S | S | * | * | trans | -163.1 | 115.1 | 162.1 | -141.8 | 0 | 0 | 0 | 0 | 111.6 | S25 | S25-S27 PolarHBondContact O-N 2.87Š| ||
| 28 | D | 44.9 | Very low | 52 | Low | 142 Ų | 142 | 137.6 Ų | 137.6 | 76% | 0.759 | 75% | 0.751 | S | S | * | * | trans | 52.9 | 106.9 | 149.8 | -70.3 | -35.1 | 0 | 0 | 0 | 120.2 | E30 | D28-E30 PolarHBondContact O-N 2.66Š| ||
| 29 | E | 43.8 | Very low | 50.6 | Low | 186 Ų | 186 | 139.7 Ų | 139.7 | 87% | 0.869 | 76% | 0.762 | S | S | * | * | trans | -57.2 | 120.4 | 152.7 | -22.7 | -69.1 | 150 | 0 | 0 | 109.4 | ||||
| 30 | E | 48.5 | Very low | 49.1 | Very low | 175 Ų | 175 | 139.6 Ų | 139.6 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | -94.4 | 112.5 | 160.7 | -73.4 | -163.9 | 171.1 | 0 | 0 | 109.2 | D28 V32 | D28-E30 PolarHBondContact O-N 2.66Å; E30-V32 PolarHBondContact O-N 2.74Å | ||
| 31 | D | 50.8 | Low | 47.6 | Very low | 160 Ų | 160 | 135.7 Ų | 135.7 | 86% | 0.856 | 77% | 0.774 | S | S | * | * | trans | -71.2 | 110.6 | 166.8 | -176.3 | 25 | 0 | 0 | 0 | 108.8 | ||||
| 32 | V | 59.4 | Low | 46.5 | Very low | 123 Ų | 123 | 138.9 Ų | 138.9 | 75% | 0.745 | 80% | 0.797 | S | S | * | * | trans | -120.4 | 115.2 | 171.1 | -176.2 | 0 | 0 | 0 | 0 | 108.4 | E30 | E30-V32 PolarHBondContact O-N 2.74Š| ||
| 33 | A | 54.7 | Low | 45.6 | Very low | 85 Ų | 85 | 134.1 Ų | 134.1 | 70% | 0.702 | 79% | 0.789 | S | S | * | * | trans | -54.2 | 148.8 | -174 | 0 | 0 | 0 | 0 | 0 | 114.6 | D35 | A33-D35 PolarHBondContact O-N 3.06Š| ||
| 34 | E | 45 | Very low | 44.7 | Very low | 194 Ų | 194 | 137.2 Ų | 137.2 | 91% | 0.907 | 79% | 0.794 | S | S | * | * | trans | -65.5 | 118.6 | 168.9 | -56 | -152 | 164 | 0 | 0 | 110.3 | ||||
| 35 | D | 42.9 | Very low | 44.2 | Very low | 148 Ų | 148 | 136.1 Ų | 136.1 | 79% | 0.791 | 79% | 0.786 | S | S | * | * | trans | -92.3 | 99.4 | 165.9 | -117.9 | -12 | 0 | 0 | 0 | 108.5 | A33 H37 | A33-D35 PolarHBondContact O-N 3.06Å; D35-H37 PolarHBondContact O-N 2.72Å | ||
| 36 | D | 43.9 | Very low | 43.8 | Very low | 133 Ų | 133 | 136.1 Ų | 136.1 | 71% | 0.711 | 79% | 0.786 | S | S | * | * | trans | -70 | 107.3 | 166.8 | 177.6 | 25.5 | 0 | 0 | 0 | 109.6 | ||||
| 37 | H | 54.1 | Low | 43.4 | Very low | 156 Ų | 156 | 134.1 Ų | 134.1 | 72% | 0.722 | 78% | 0.781 | S | S | * | * | trans | -137.2 | 86.9 | 160.9 | -77.7 | -42.5 | 0 | 0 | 0 | 111.3 | D35 | D35-H37 PolarHBondContact O-N 2.72Š| ||
| 38 | T | 39.9 | Very low | 43.8 | Very low | 111 Ų | 111 | 135.5 Ų | 135.5 | 68% | 0.681 | 79% | 0.786 | S | S | * | * | 45.1 | 116.1 | 126.9 | 42.9 | 0 | 0 | 0 | 0 | 119.2 | S40 | T38-S40 PolarHBondContact O-N 2.92Š| |||
| 39 | A | 39.8 | Very low | 43.6 | Very low | 107 Ų | 107 | 135.5 Ų | 135.5 | 88% | 0.884 | 79% | 0.786 | S | S | * | * | trans | -50.3 | 122.9 | 164.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 40 | S | 40.7 | Very low | 43.7 | Very low | 125 Ų | 125 | 133.9 Ų | 133.9 | 87% | 0.874 | 78% | 0.778 | S | S | * | * | trans | -93.7 | 110.4 | 162.7 | -171.6 | 0 | 0 | 0 | 0 | 109.4 | T38 | T38-S40 PolarHBondContact O-N 2.92Š| ||
| 41 | S | 36.1 | Very low | 43.5 | Very low | 110 Ų | 110 | 131.6 Ų | 131.6 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | trans | -82.3 | 129.2 | 165.8 | 146.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 42 | A | 41.9 | Very low | 43 | Very low | 102 Ų | 102 | 131.5 Ų | 131.5 | 84% | 0.843 | 77% | 0.771 | S | S | * | * | 161.7 | 141.3 | 129.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 43 | G | 39.5 | Very low | 42 | Very low | 72 Ų | 72 | 132.4 Ų | 132.4 | 74% | 0.742 | 77% | 0.771 | S | S | * | * | trans | 115.4 | 83.9 | 154.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 44 | E | 33.8 | Very low | 41.3 | Very low | 157 Ų | 157 | 133.7 Ų | 133.7 | 73% | 0.734 | 78% | 0.775 | S | S | * | * | 65.6 | 109.2 | 93.5 | -89 | -161.3 | 125 | 0 | 0 | 117.2 | |||||
| 45 | K | 35.6 | Very low | 41 | Very low | 174 Ų | 174 | 132.7 Ų | 132.7 | 76% | 0.757 | 77% | 0.77 | S | S | * | * | trans | 59.7 | 116.1 | 133.1 | -59.6 | 178.8 | -177.5 | 151.9 | 0 | 121.2 | ||||
| 46 | S | 33.8 | Very low | 41.1 | Very low | 105 Ų | 105 | 131.4 Ų | 131.4 | 73% | 0.734 | 77% | 0.769 | S | S | * | * | 166.6 | 109.4 | 119.2 | 40.8 | 0 | 0 | 0 | 0 | 106.9 | |||||
| 47 | D | 36.4 | Very low | 40.8 | Very low | 151 Ų | 151 | 134.3 Ų | 134.3 | 81% | 0.807 | 78% | 0.776 | S | S | * | * | 42.5 | 83.5 | 88.6 | -146.7 | 16.2 | 0 | 0 | 0 | 112.7 | |||||
| 48 | T | 53.8 | Low | 40.2 | Very low | 130 Ų | 130 | 133.9 Ų | 133.9 | 80% | 0.798 | 78% | 0.778 | S | S | * | * | trans | -143 | 111 | 159.6 | -57.1 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 49 | D | 42 | Very low | 40 | Very low | 141 Ų | 141 | 132.4 Ų | 132.4 | 75% | 0.754 | 79% | 0.785 | S | S | * | * | trans | -50.7 | 136 | -176.9 | -71 | -60.6 | 0 | 0 | 0 | 113.9 | P51 | D49-P51 WeakPolarHBondContact O-CD 3.48Š| ||
| 50 | E | 45.7 | Very low | 40.1 | Very low | 153 Ų | 153 | 136 Ų | 136 | 72% | 0.715 | 78% | 0.781 | S | S | * | * | trans | -48.6 | 121.9 | 162.6 | -68.8 | -81.6 | 149.9 | 0 | 0 | 112.2 | F52 | E50-F52 HydrophobicContact CB-CD2 3.87Å; E50-F52 HydrophobicContact CB-CE2 4.23Å; E50-F52 PolarHBondContact O-N 3.31Å | ||
| 51 | P | 42.7 | Very low | 40.1 | Very low | 127 Ų | 127 | 136.7 Ų | 136.7 | 83% | 0.825 | 78% | 0.775 | S | S | * | * | trans | -74.9 | 88.7 | 150.7 | 29.8 | -29.5 | 0 | 0 | 0 | 108.5 | D49 L53 | D49-P51 WeakPolarHBondContact O-CD 3.48Å; P51-L53 PolarHBondContact O-N 3.43Å | ||
| 52 | F | 40.4 | Very low | 40.6 | Very low | 158 Ų | 158 | 138.5 Ų | 138.5 | 69% | 0.693 | 78% | 0.776 | S | S | * | * | trans | -51.1 | 131.5 | 156.3 | -99.6 | -98.3 | 0 | 0 | 0 | 110.3 | E50 | E50-F52 HydrophobicContact CB-CD2 3.87Å; E50-F52 HydrophobicContact CB-CE2 4.23Å; E50-F52 PolarHBondContact O-N 3.31Å | ||
| 53 | L | 39.7 | Very low | 40.9 | Very low | 142 Ų | 142 | 139.5 Ų | 139.5 | 74% | 0.743 | 77% | 0.767 | S | S | * | * | trans | 78.7 | 108.1 | 147.8 | -53.8 | 162.6 | 0 | 0 | 0 | 117.6 | P51 | P51-L53 PolarHBondContact O-N 3.43Š| ||
| 54 | S | 40.7 | Very low | 41.8 | Very low | 112 Ų | 112 | 144.2 Ų | 144.2 | 78% | 0.783 | 77% | 0.77 | S | S | * | * | -164.3 | 109 | 102.5 | 39.6 | 0 | 0 | 0 | 0 | 111.3 | P56 | S54-P56 VanDerWaalsContact O-CD 3.26Å; S54-P56 WeakPolarHBondContact O-CD 3.39Å | |||
| 55 | H | 37 | Very low | 43.1 | Very low | 173 Ų | 173 | 145.9 Ų | 145.9 | 80% | 0.801 | 78% | 0.775 | S | S | * | * | trans | -60.6 | 121.3 | 155.9 | -83.6 | -88.2 | 0 | 0 | 0 | 108.9 | K57 | H55-K57 VanDerWaalsContact C-N 3.29Å; H55-K57 PolarHBondContact O-N 2.94Å | ||
| 56 | P | 46.3 | Very low | 44.3 | Very low | 121 Ų | 121 | 142.4 Ų | 142.4 | 79% | 0.786 | 76% | 0.764 | S | S | * | * | trans | -71.9 | 94.8 | 155.4 | 28.3 | -27.9 | 0 | 0 | 0 | 107.5 | S54 N58 | S54-P56 VanDerWaalsContact O-CD 3.26Å; S54-P56 WeakPolarHBondContact O-CD 3.39Å; P56-N58 VanDerWaalsContact C-N 3.25Å; P56-N58 PolarHBondContact O-N 3.45Å | ||
| 57 | K | 37.4 | Very low | 45.6 | Very low | 194 Ų | 194 | 141 Ų | 141 | 84% | 0.843 | 75% | 0.753 | S | S | * | * | trans | -60.9 | 95.2 | 152.3 | -78.8 | -166.7 | 176.2 | -175.4 | 0 | 107.1 | H55 | H55-K57 VanDerWaalsContact C-N 3.29Å; H55-K57 PolarHBondContact O-N 2.94Å | ||
| 58 | N | 40.8 | Very low | 47.1 | Very low | 146 Ų | 146 | 138.6 Ų | 138.6 | 78% | 0.781 | 75% | 0.748 | S | S | * | * | trans | -124.1 | 93.5 | 155.5 | -93.8 | -5.7 | 0 | 0 | 0 | 106.8 | P56 K60 | P56-N58 VanDerWaalsContact C-N 3.25Å; P56-N58 PolarHBondContact O-N 3.45Å; N58-K60 PolarHBondContact O-N 3.14Å | ||
| 59 | G | 36.5 | Very low | 47.9 | Very low | 80 Ų | 80 | 140.2 Ų | 140.2 | 83% | 0.825 | 75% | 0.747 | S | S | * | * | trans | -65 | 89.2 | 166.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 60 | K | 40.6 | Very low | 49.3 | Very low | 182 Ų | 182 | 139 Ų | 139 | 79% | 0.791 | 74% | 0.736 | S | S | * | * | trans | -93.9 | 116.3 | 145 | -71.4 | -174.8 | 175.1 | -178.5 | 0 | 104.2 | N58 D62 | N58-K60 PolarHBondContact O-N 3.14Å; K60-D62 VanDerWaalsContact C-N 3.26Å; K60-D62 PolarHBondContact O-N 3.35Å | ||
| 61 | D | 40.9 | Very low | 50.7 | Low | 140 Ų | 140 | 138.4 Ų | 138.4 | 75% | 0.749 | 73% | 0.731 | S | S | * | * | trans | -41.1 | 102.5 | 157.8 | -61.2 | -56.4 | 0 | 0 | 0 | 106.6 | D63 | D61-D63 PolarHBondContact O-N 3.29Š| ||
| 62 | D | 47 | Very low | 52.5 | Low | 149 Ų | 149 | 137.3 Ų | 137.3 | 80% | 0.797 | 72% | 0.719 | S | S | * | * | trans | -66.2 | 74.4 | 153.9 | -103.7 | -22.5 | 0 | 0 | 0 | 103.3 | K60 E64 | K60-D62 VanDerWaalsContact C-N 3.26Å; K60-D62 PolarHBondContact O-N 3.35Å; D62-E64 PolarHBondContact O-N 3.01Å | ||
| 63 | D | 49.4 | Very low | 54.6 | Low | 123 Ų | 123 | 132.8 Ų | 132.8 | 66% | 0.658 | 71% | 0.706 | S | S | * | * | trans | -55.7 | 87.1 | 146.7 | -77.7 | -32.8 | 0 | 0 | 0 | 102.9 | D61 F65 | D61-D63 PolarHBondContact O-N 3.29Å; D63-F65 PolarHBondContact O-N 3.48Å | ||
| 64 | E | 58.2 | Low | 56.6 | Low | 170 Ų | 170 | 131 Ų | 131 | 79% | 0.794 | 70% | 0.697 | S | S | * | * | trans | -48.4 | 95.4 | 170.9 | -76.4 | 177.9 | 167.5 | 0 | 0 | 104.7 | D62 I66 | D62-E64 PolarHBondContact O-N 3.01Å; E64-I66 PolarHBondContact O-N 3Å | ||
| 65 | F | 59.6 | Low | 58.7 | Low | 193 Ų | 193 | 128.6 Ų | 128.6 | 85% | 0.846 | 68% | 0.678 | S | S | * | * | trans | -68.2 | 91.5 | -179.3 | -117.5 | -93 | 0 | 0 | 0 | 103.5 | D63 C67 | D63-F65 PolarHBondContact O-N 3.48Å; F65-C67 PolarHBondContact O-N 3.49Å | ||
| 66 | I | 60.6 | Low | 61 | Low | 100 Ų | 100 | 124.4 Ų | 124.4 | 51% | 0.513 | 66% | 0.66 | S | S | . | * | trans | -52.2 | 114.2 | 173.8 | -63.3 | 173.1 | 0 | 0 | 0 | 104.8 | E64 S68 E70 K71 | E64-I66 PolarHBondContact O-N 3Å; I66-S68 PolarHBondContact O-N 2.88Å; I66-E70 HydrophobicContact CG2-CB 3.8Å; I66-K71 HydrophobicContact CG2-CB 4.19Å | ||
| 67 | C | 61 | Low | 62.6 | Low | 77 Ų | 77 | 123.1 Ų | 123.1 | 52% | 0.52 | 65% | 0.645 | S | S | . | * | trans | -53.6 | 138.2 | -178.4 | -111.9 | 0 | 0 | 0 | 0 | 107.8 | F65 E69 E70 K71 | F65-C67 PolarHBondContact O-N 3.49Å; C67-E69 PolarHBondContact O-N 3.37Å; C67-E70 HydrophobicContact CB-CB 4.39Å; C67-E70 HydrophobicContact CB-CG 4.14Å; C67-E70 WeakPolarHBondContact O-CA 3.27Å; C67-E70 WeakPolarHBondContact O-CB 3.49Å; C67-E70 PolarHBondContact O-N 2.97Å; C67-K71 PolarHBondContact O-N 3.05Å | ||
| 68 | S | 68.6 | Low | 64.9 | Low | 99 Ų | 99 | 115.9 Ų | 115.9 | 69% | 0.692 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -52.2 | -33.2 | -178.1 | -56.5 | 0 | 0 | 0 | 0 | 112.3 | I66 K71 D72 | I66-S68 PolarHBondContact O-N 2.88Å; S68-K71 PolarHBondContact O-N 2.69Å; S68-D72 PolarHBondContact O-N 3.36Å |
| 69 | E | 70.7 | Confident | 66.9 | Low | 165 Ų | 165 | 117.1 Ų | 117.1 | 77% | 0.771 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -66.9 | -36.2 | 173.8 | -67.9 | 177 | 168.6 | 0 | 0 | 113.7 | C67 S73 | C67-E69 PolarHBondContact O-N 3.37Å; E69-S73 PolarHBondContact O-N 2.91Å; E69-S73 VanDerWaalsContact O-N 3.13Å |
| 70 | E | 71.5 | Confident | 69 | Low | 115 Ų | 115 | 120.8 Ų | 120.8 | 54% | 0.537 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -71.7 | -34.6 | 175 | -70.5 | -175.7 | 146.8 | 0 | 0 | 111.6 | I66 C67 D72 S73 L74 | I66-E70 HydrophobicContact CG2-CB 3.8Å; C67-E70 HydrophobicContact CB-CB 4.39Å; C67-E70 HydrophobicContact CB-CG 4.14Å; C67-E70 WeakPolarHBondContact O-CA 3.27Å; C67-E70 WeakPolarHBondContact O-CB 3.49Å; C67-E70 PolarHBondContact O-N 2.97Å; E70-D72 VanDerWaalsContact C-N 3.33Å; E70-D72 PolarHBondContact O-N 2.92Å; E70-S73 WeakPolarHBondContact O-CB 3.39Å; E70-S73 PolarHBondContact O-N 2.98Å; E70-L74 WeakPolarHBondContact O-CB 3.44Å; E70-L74 WeakPolarHBondContact O-CD1 3.46Å; E70-L74 PolarHBondContact O-N 3.44Å |
| 71 | K | 75.5 | Confident | 70.8 | Confident | 140 Ų | 140 | 118.5 Ų | 118.5 | 61% | 0.609 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -62.6 | -40.9 | 174.8 | -170.8 | 179 | -179.8 | 177.5 | 0 | 111.6 | I66 C67 S68 T75 | I66-K71 HydrophobicContact CG2-CB 4.19Å; C67-K71 PolarHBondContact O-N 3.05Å; S68-K71 PolarHBondContact O-N 2.69Å; K71-T75 WeakPolarHBondContact O-CB 3.47Å; K71-T75 PolarHBondContact O-N 3.48Å; K71-T75 PolarHBondContact O-OG1 3.42Å |
| 72 | D | 79.7 | Confident | 72.5 | Confident | 105 Ų | 105 | 118 Ų | 118 | 56% | 0.561 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -65.1 | -43.6 | 174.5 | -75.9 | -12.2 | 0 | 0 | 0 | 111.1 | S68 E70 T75 I76 | S68-D72 PolarHBondContact O-N 3.36Å; E70-D72 VanDerWaalsContact C-N 3.33Å; E70-D72 PolarHBondContact O-N 2.92Å; D72-T75 PolarHBondContact O-N 3.33Å; D72-I76 WeakPolarHBondContact O-CD1 3.42Å; D72-I76 VanDerWaalsContact O-CG1 3.23Å; D72-I76 WeakPolarHBondContact O-CG1 3.43Å; D72-I76 PolarHBondContact O-N 3.28Å |
| 73 | S | 84 | Confident | 74 | Confident | 62 Ų | 62 | 117 Ų | 117 | 43% | 0.434 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -59.7 | -47.8 | 176.4 | -171.1 | 0 | 0 | 0 | 0 | 112.5 | E69 E70 T75 I76 M77 | E69-S73 PolarHBondContact O-N 2.91Å; E69-S73 VanDerWaalsContact O-N 3.13Å; E70-S73 WeakPolarHBondContact O-CB 3.39Å; E70-S73 PolarHBondContact O-N 2.98Å; S73-T75 VanDerWaalsContact C-N 3.34Å; S73-T75 PolarHBondContact O-N 2.99Å; S73-I76 PolarHBondContact O-N 3.05Å; S73-M77 WeakPolarHBondContact O-CG 3.17Å; S73-M77 PolarHBondContact O-N 2.99Å |
| 74 | L | 82.3 | Confident | 75.1 | Confident | 104 Ų | 104 | 118.7 Ų | 118.7 | 55% | 0.545 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -60.7 | -41.7 | 175.2 | -99.2 | 122.5 | 0 | 0 | 0 | 112.1 | E70 I76 M77 A78 | E70-L74 WeakPolarHBondContact O-CB 3.44Å; E70-L74 WeakPolarHBondContact O-CD1 3.46Å; E70-L74 PolarHBondContact O-N 3.44Å; L74-I76 PolarHBondContact O-N 2.91Å; L74-M77 HydrophobicContact CG-CE 4.16Å; L74-M77 PolarHBondContact O-N 3.14Å; L74-A78 WeakPolarHBondContact O-CB 3.45Å; L74-A78 PolarHBondContact O-N 3.23Å |
| 75 | T | 84.5 | Confident | 75.6 | Confident | 63 Ų | 63 | 120.8 Ų | 120.8 | 39% | 0.387 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -64.4 | -40.6 | 177.8 | -57.2 | 0 | 0 | 0 | 0 | 111.5 | K71 D72 S73 R79 | K71-T75 WeakPolarHBondContact O-CB 3.47Å; K71-T75 PolarHBondContact O-N 3.48Å; K71-T75 PolarHBondContact O-OG1 3.42Å; D72-T75 PolarHBondContact O-N 3.33Å; S73-T75 VanDerWaalsContact C-N 3.34Å; S73-T75 PolarHBondContact O-N 2.99Å; T75-R79 WeakPolarHBondContact O-CG 3.48Å; T75-R79 PolarHBondContact O-N 3.49Å; T75-R79 VanDerWaalsContact O-N 3.08Å |
| 76 | I | 85 | Confident | 75.7 | Confident | 84 Ų | 84 | 120 Ų | 120 | 43% | 0.431 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -64.8 | -43 | 175.3 | -68.1 | 163.4 | 0 | 0 | 0 | 110.6 | D72 S73 L74 R79 R80 | D72-I76 WeakPolarHBondContact O-CD1 3.42Å; D72-I76 VanDerWaalsContact O-CG1 3.23Å; D72-I76 WeakPolarHBondContact O-CG1 3.43Å; D72-I76 PolarHBondContact O-N 3.28Å; S73-I76 PolarHBondContact O-N 3.05Å; L74-I76 PolarHBondContact O-N 2.91Å; I76-R79 PolarHBondContact O-N 3.48Å; I76-R80 WeakPolarHBondContact O-CG 3.37Å; I76-R80 PolarHBondContact O-N 3.13Å |
| 77 | M | 81.4 | Confident | 76 | Confident | 95 Ų | 95 | 120.4 Ų | 120.4 | 47% | 0.468 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -63.9 | -44.2 | 177.9 | -74.1 | -172.2 | -69.7 | 0 | 0 | 112 | S73 L74 R79 R80 M81 | S73-M77 WeakPolarHBondContact O-CG 3.17Å; S73-M77 PolarHBondContact O-N 2.99Å; L74-M77 HydrophobicContact CG-CE 4.16Å; L74-M77 PolarHBondContact O-N 3.14Å; M77-R79 PolarHBondContact O-N 2.97Å; M77-R80 PolarHBondContact O-N 3.08Å; M77-M81 WeakPolarHBondContact O-CG 3.37Å; M77-M81 PolarHBondContact O-N 3.29Å |
| 78 | A | 84.5 | Confident | 76 | Confident | 42 Ų | 42 | 125 Ų | 125 | 35% | 0.347 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -59.5 | -47.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | L74 R80 M81 D82 | L74-A78 WeakPolarHBondContact O-CB 3.45Å; L74-A78 PolarHBondContact O-N 3.23Å; A78-R80 VanDerWaalsContact C-N 3.35Å; A78-R80 PolarHBondContact O-N 2.79Å; A78-M81 PolarHBondContact O-N 2.73Å; A78-M81 VanDerWaalsContact O-N 3.16Å; A78-D82 PolarHBondContact O-N 3.25Å |
| 79 | R | 82.5 | Confident | 75.6 | Confident | 172 Ų | 172 | 128.6 Ų | 128.6 | 65% | 0.649 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -59.1 | -43.5 | 174.6 | -74.8 | -178.3 | -176.9 | -177.2 | 2.6 | 112.7 | T75 I76 M77 M81 D82 D83 | T75-R79 WeakPolarHBondContact O-CG 3.48Å; T75-R79 PolarHBondContact O-N 3.49Å; T75-R79 VanDerWaalsContact O-N 3.08Å; I76-R79 PolarHBondContact O-N 3.48Å; M77-R79 PolarHBondContact O-N 2.97Å; R79-M81 VanDerWaalsContact C-N 3.31Å; R79-M81 PolarHBondContact O-N 3.49Å; R79-D82 PolarHBondContact O-N 3.5Å; R79-D83 VanDerWaalsContact O-CG 3.28Å; R79-D83 PolarHBondContact O-N 2.91Å |
| 80 | R | 81.9 | Confident | 74.9 | Confident | 157 Ų | 157 | 129.1 Ų | 129.1 | 59% | 0.592 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -62.7 | -39.4 | 176.8 | -74.9 | 178.1 | -177.6 | 178.7 | 3.2 | 111.8 | I76 M77 A78 D83 F84 | I76-R80 WeakPolarHBondContact O-CG 3.37Å; I76-R80 PolarHBondContact O-N 3.13Å; M77-R80 PolarHBondContact O-N 3.08Å; A78-R80 VanDerWaalsContact C-N 3.35Å; A78-R80 PolarHBondContact O-N 2.79Å; R80-D83 PolarHBondContact O-N 3.45Å; R80-F84 WeakPolarHBondContact O-CD2 3.49Å; R80-F84 PolarHBondContact O-N 3.25Å; R80-F84 VanDerWaalsContact O-N 3.11Å |
| 81 | M | 77.6 | Confident | 74.4 | Confident | 133 Ų | 133 | 127 Ų | 127 | 66% | 0.655 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -65.9 | -37.6 | 175.3 | -70.3 | -165.9 | -56.8 | 0 | 0 | 112.1 | M77 A78 R79 F84 | M77-M81 WeakPolarHBondContact O-CG 3.37Å; M77-M81 PolarHBondContact O-N 3.29Å; A78-M81 PolarHBondContact O-N 2.73Å; A78-M81 VanDerWaalsContact O-N 3.16Å; R79-M81 VanDerWaalsContact C-N 3.31Å; R79-M81 PolarHBondContact O-N 3.49Å; M81-F84 WeakPolarHBondContact O-CB 3.46Å; M81-F84 PolarHBondContact O-N 3.16Å |
| 82 | D | 76.2 | Confident | 73.4 | Confident | 129 Ų | 129 | 125.1 Ų | 125.1 | 69% | 0.69 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -67.7 | -34.8 | 173.8 | -71.1 | -20.3 | 0 | 0 | 0 | 112.2 | A78 R79 F84 | A78-D82 PolarHBondContact O-N 3.25Å; R79-D82 PolarHBondContact O-N 3.5Å; D82-F84 PolarHBondContact O-N 3.41Å |
| 83 | D | 79.9 | Confident | 72.3 | Confident | 130 Ų | 130 | 129.5 Ų | 129.5 | 70% | 0.695 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -65.8 | -28.2 | 173.1 | -69.3 | -26.6 | 0 | 0 | 0 | 111.9 | R79 R80 R85 | R79-D83 VanDerWaalsContact O-CG 3.28Å; R79-D83 PolarHBondContact O-N 2.91Å; R80-D83 PolarHBondContact O-N 3.45Å; D83-R85 PolarHBondContact O-N 3.47Å |
| 84 | F | 72.5 | Confident | 71 | Confident | 157 Ų | 157 | 129 Ų | 129 | 69% | 0.689 | 63% | 0.632 | S | S | * | * | trans | -73.3 | 75 | 165.9 | -74.6 | -75.1 | 0 | 0 | 0 | 109.4 | R80 M81 D82 F86 | R80-F84 WeakPolarHBondContact O-CD2 3.49Å; R80-F84 PolarHBondContact O-N 3.25Å; R80-F84 VanDerWaalsContact O-N 3.11Å; M81-F84 WeakPolarHBondContact O-CB 3.46Å; M81-F84 PolarHBondContact O-N 3.16Å; D82-F84 PolarHBondContact O-N 3.41Å; F84-F86 VanDerWaalsContact C-N 3.34Å; F84-F86 PolarHBondContact O-N 3.23Å | ||
| 85 | R | 68 | Low | 69.8 | Low | 215 Ų | 215 | 127.2 Ų | 127.2 | 81% | 0.811 | 63% | 0.632 | S | S | * | * | trans | -61.2 | 105.8 | 157.1 | -59.1 | -174.1 | 93.6 | -178.3 | 5.3 | 105.8 | D83 D87 | D83-R85 PolarHBondContact O-N 3.47Å; R85-D87 PolarHBondContact O-N 2.95Å | ||
| 86 | F | 62.6 | Low | 68.1 | Low | 177 Ų | 177 | 133 Ų | 133 | 78% | 0.776 | 65% | 0.654 | S | S | * | * | trans | -57.4 | 109.4 | 161.6 | -107.5 | -93.8 | 0 | 0 | 0 | 105.4 | F84 E88 | F84-F86 VanDerWaalsContact C-N 3.34Å; F84-F86 PolarHBondContact O-N 3.23Å; F86-E88 PolarHBondContact O-N 3.47Å | ||
| 87 | D | 67 | Low | 66.6 | Low | 107 Ų | 107 | 134.1 Ų | 134.1 | 57% | 0.572 | 67% | 0.67 | S | S | * | * | trans | -61.3 | 96.6 | 165 | -73.8 | -25.6 | 0 | 0 | 0 | 105.5 | R85 E89 F90 | R85-D87 PolarHBondContact O-N 2.95Å; D87-E89 PolarHBondContact O-N 3.38Å; D87-F90 HydrophobicContact CB-CD2 3.97Å; D87-F90 PolarHBondContact O-N 2.85Å | ||
| 88 | E | 59.5 | Low | 65.2 | Low | 173 Ų | 173 | 140.5 Ų | 140.5 | 81% | 0.808 | 69% | 0.689 | S | S | * | * | G | 310 helix | trans | -55.4 | -25.3 | -179.6 | -168.7 | 168.7 | -172.3 | 0 | 0 | 110.5 | F86 F90 S91 | F86-E88 PolarHBondContact O-N 3.47Å; E88-F90 VanDerWaalsContact C-N 3.3Å; E88-F90 PolarHBondContact O-N 3.16Å; E88-S91 PolarHBondContact O-N 3.02Å |
| 89 | E | 61.6 | Low | 63.6 | Low | 175 Ų | 175 | 146.6 Ų | 146.6 | 82% | 0.818 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -64.4 | -24.6 | 174.2 | -62.7 | -176.8 | -177 | 0 | 0 | 114.4 | D87 | D87-E89 PolarHBondContact O-N 3.38Š|
| 90 | F | 56.1 | Low | 62 | Low | 176 Ų | 176 | 144.1 Ų | 144.1 | 77% | 0.772 | 72% | 0.719 | S | S | * | * | G | 310 helix | trans | -93.7 | -6.7 | 175.5 | -82.4 | -83 | 0 | 0 | 0 | 113.5 | D87 E88 T92 | D87-F90 HydrophobicContact CB-CD2 3.97Å; D87-F90 PolarHBondContact O-N 2.85Å; E88-F90 VanDerWaalsContact C-N 3.3Å; E88-F90 PolarHBondContact O-N 3.16Å; F90-T92 VanDerWaalsContact C-N 3.27Å; F90-T92 PolarHBondContact O-N 3.36Å; F90-T92 VanDerWaalsContact O-N 3.15Å |
| 91 | S | 60 | Low | 60.6 | Low | 72 Ų | 72 | 138.8 Ų | 138.8 | 50% | 0.503 | 71% | 0.713 | S | S | . | * | trans | -89.3 | 51.2 | 178.6 | -155.9 | 0 | 0 | 0 | 0 | 112.4 | E88 | E88-S91 PolarHBondContact O-N 3.02Š| ||
| 92 | T | 55.3 | Low | 59.4 | Low | 100 Ų | 100 | 137.6 Ų | 137.6 | 61% | 0.613 | 72% | 0.718 | S | S | * | * | trans | -88 | -13 | 176.8 | 54.2 | 0 | 0 | 0 | 0 | 113.4 | F90 G94 A95 | F90-T92 VanDerWaalsContact C-N 3.27Å; F90-T92 PolarHBondContact O-N 3.36Å; F90-T92 VanDerWaalsContact O-N 3.15Å; T92-G94 PolarHBondContact O-N 2.96Å; T92-G94 VanDerWaalsContact O-N 3.16Å; T92-A95 PolarHBondContact O-N 2.96Å | ||
| 93 | E | 56.4 | Low | 58.5 | Low | 197 Ų | 197 | 139.8 Ų | 139.8 | 92% | 0.921 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.3 | -1.8 | -179.3 | -70.9 | -169.8 | 160.2 | 0 | 0 | 114.6 | ||
| 94 | G | 57.1 | Low | 57.4 | Low | 52 Ų | 52 | 140 Ų | 140 | 54% | 0.536 | 72% | 0.722 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -102.8 | -14.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 116 | T92 H96 | T92-G94 PolarHBondContact O-N 2.96Å; T92-G94 VanDerWaalsContact O-N 3.16Å; G94-H96 PolarHBondContact O-N 3.35Å |
| 95 | A | 55.8 | Low | 56.8 | Low | 66 Ų | 66 | 143.7 Ų | 143.7 | 55% | 0.545 | 73% | 0.731 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -73 | -25.4 | -167.3 | 0 | 0 | 0 | 0 | 0 | 114 | T92 | T92-A95 PolarHBondContact O-N 2.96Š|
| 96 | H | 48.8 | Very low | 56.8 | Low | 183 Ų | 183 | 137.8 Ų | 137.8 | 85% | 0.847 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.9 | 6.1 | -170.1 | -67 | -53.2 | 0 | 0 | 0 | 116 | G94 | G94-H96 PolarHBondContact O-N 3.35Š|
| 97 | S | 53.5 | Low | 57.8 | Low | 109 Ų | 109 | 136.9 Ų | 136.9 | 76% | 0.762 | 73% | 0.726 | S | S | * | * | trans | -103.1 | 16.1 | 171.9 | -155.1 | 0 | 0 | 0 | 0 | 113.5 | Q99 | S97-Q99 PolarHBondContact O-N 3.32Š| ||
| 98 | R | 51.8 | Low | 58.6 | Low | 228 Ų | 228 | 136.5 Ų | 136.5 | 86% | 0.86 | 72% | 0.723 | S | S | * | * | trans | -82.6 | 53.5 | 161.2 | -69.2 | -176.6 | 166.2 | -172.5 | -2.3 | 109.4 | S100 | R98-S100 PolarHBondContact O-N 3.39Š| ||
| 99 | Q | 51.3 | Low | 60.1 | Low | 170 Ų | 170 | 132.6 Ų | 132.6 | 79% | 0.794 | 71% | 0.707 | S | S | * | * | trans | -61.8 | 114.5 | 158.4 | -106.2 | -178.1 | -7.1 | 0 | 0 | 105.6 | S97 G101 | S97-Q99 PolarHBondContact O-N 3.32Å; Q99-G101 PolarHBondContact O-N 3.04Å | ||
| 100 | S | 49.7 | Very low | 61.6 | Low | 121 Ų | 121 | 132.1 Ų | 132.1 | 85% | 0.846 | 70% | 0.699 | S | S | * | * | trans | -61.1 | 54.6 | 171.6 | 53.4 | 0 | 0 | 0 | 0 | 111.4 | R98 S102 | R98-S100 PolarHBondContact O-N 3.39Å; S100-S102 PolarHBondContact O-N 3.05Å; S100-S102 VanDerWaalsContact O-N 3.15Å | ||
| 101 | G | 51 | Low | 63.5 | Low | 44 Ų | 44 | 129 Ų | 129 | 45% | 0.454 | 69% | 0.687 | S | S | . | * | trans | -60.5 | 114.8 | 153.3 | 0 | 0 | 0 | 0 | 0 | 105.2 | Q99 F103 | Q99-G101 PolarHBondContact O-N 3.04Å; G101-F103 VanDerWaalsContact O-CD2 3.27Å; G101-F103 WeakPolarHBondContact O-CD2 3.42Å; G101-F103 PolarHBondContact O-N 3.42Å | ||
| 102 | S | 54.3 | Low | 65.2 | Low | 109 Ų | 109 | 131.5 Ų | 131.5 | 76% | 0.762 | 69% | 0.689 | S | S | * | * | trans | -55.4 | 77.3 | 149.4 | 164.5 | 0 | 0 | 0 | 0 | 106.1 | S100 I104 | S100-S102 PolarHBondContact O-N 3.05Å; S100-S102 VanDerWaalsContact O-N 3.15Å; S102-I104 PolarHBondContact O-N 2.9Å | ||
| 103 | F | 56.4 | Low | 67.2 | Low | 174 Ų | 174 | 130.7 Ų | 130.7 | 76% | 0.763 | 68% | 0.68 | S | S | * | * | trans | -62.4 | 90.9 | 158.3 | -68.3 | -82.3 | 0 | 0 | 0 | 102 | G101 R105 | G101-F103 VanDerWaalsContact O-CD2 3.27Å; G101-F103 WeakPolarHBondContact O-CD2 3.42Å; G101-F103 PolarHBondContact O-N 3.42Å; F103-R105 VanDerWaalsContact C-N 3.32Å; F103-R105 PolarHBondContact O-N 2.96Å | ||
| 104 | I | 57 | Low | 69.1 | Low | 136 Ų | 136 | 129.3 Ų | 129.3 | 70% | 0.697 | 67% | 0.666 | S | S | * | * | trans | -33.3 | 116.3 | 142.9 | -64.2 | 167.1 | 0 | 0 | 0 | 102.5 | S102 S106 | S102-I104 PolarHBondContact O-N 2.9Å; I104-S106 PolarHBondContact O-N 2.93Å | ||
| 105 | R | 59.3 | Low | 71 | Confident | 234 Ų | 234 | 134.9 Ų | 134.9 | 88% | 0.883 | 67% | 0.671 | S | S | * | * | trans | -51 | 89.6 | 169.3 | -82.9 | 171.4 | 134.6 | -173.4 | -4.1 | 104.1 | F103 D107 | F103-R105 VanDerWaalsContact C-N 3.32Å; F103-R105 PolarHBondContact O-N 2.96Å; R105-D107 PolarHBondContact O-N 3.28Å; R105-D107 VanDerWaalsContact O-N 3.15Å | ||
| 106 | S | 68.2 | Low | 72.9 | Confident | 90 Ų | 90 | 136.5 Ų | 136.5 | 63% | 0.629 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 123.3 | 173.1 | 32.5 | 0 | 0 | 0 | 0 | 101.6 | I104 I108 | I104-S106 PolarHBondContact O-N 2.93Å; S106-I108 PolarHBondContact O-N 2.91Å |
| 107 | D | 82.9 | Confident | 75.2 | Confident | 159 Ų | 159 | 132.1 Ų | 132.1 | 85% | 0.85 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -47.8 | 121.3 | 177.3 | -70.3 | -39.8 | 0 | 0 | 0 | 107.1 | R105 D109 | R105-D107 PolarHBondContact O-N 3.28Å; R105-D107 VanDerWaalsContact O-N 3.15Å; D107-D109 PolarHBondContact O-N 3.45Å |
| 108 | I | 85.6 | Confident | 77.4 | Confident | 99 Ų | 99 | 134.2 Ų | 134.2 | 51% | 0.508 | 65% | 0.65 | S | S | . | * | P | Polyproline II helix | trans | -60.4 | 117 | 180 | -66.4 | 173.8 | 0 | 0 | 0 | 105.7 | S106 Y110 I113 | S106-I108 PolarHBondContact O-N 2.91Å; I108-Y110 HydrophobicContact CB-CD2 4.21Å; I108-Y110 HydrophobicContact CB-CE2 3.8Å; I108-Y110 HydrophobicContact CG2-CD1 4.18Å; I108-Y110 HydrophobicContact CG2-CD2 4.14Å; I108-Y110 HydrophobicContact CG2-CE1 4.01Å; I108-Y110 HydrophobicContact CG2-CE2 3.97Å; I108-Y110 HydrophobicContact CG2-CG 4.25Å; I108-Y110 WeakPolarHBondContact O-CD2 3.31Å; I108-Y110 PolarHBondContact O-N 3.24Å; I108-I113 HydrophobicContact CG2-CD1 3.47Å; I108-I113 VanDerWaalsContact CG2-CD1 3.47Å |
| 109 | D | 91 | Very high | 79.5 | Confident | 91 Ų | 91 | 127.7 Ų | 127.7 | 49% | 0.487 | 63% | 0.633 | S | S | . | * | trans | -73.7 | 82.5 | 176.8 | -174.8 | -11.2 | 0 | 0 | 0 | 109.2 | D107 E111 K112 I113 | D107-D109 PolarHBondContact O-N 3.45Å; D109-E111 PolarHBondContact O-N 3.11Å; D109-E111 WeakPolarHBondContact OD1-CB 3.44Å; D109-E111 PolarHBondContact OD1-N 2.89Å; D109-E111 VanDerWaalsContact OD1-N 3.16Å; D109-K112 HydrophobicContact CB-CB 4.01Å; D109-K112 VanDerWaalsContact CG-CB 3.4Å; D109-K112 PolarHBondContact O-N 3.35Å; D109-K112 PolarHBondContact OD1-N 3.43Å; D109-K112 WeakPolarHBondContact OD2-CB 3.34Å; D109-I113 WeakPolarHBondContact O-CG1 3.46Å; D109-I113 PolarHBondContact O-N 3.23Å | ||
| 110 | Y | 92.7 | Very high | 81.8 | Confident | 164 Ų | 164 | 122.7 Ų | 122.7 | 64% | 0.643 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -61 | -27.3 | 178 | -73.1 | -77.8 | 0 | 0 | 0 | 112.1 | I108 I113 R114 | I108-Y110 HydrophobicContact CB-CD2 4.21Å; I108-Y110 HydrophobicContact CB-CE2 3.8Å; I108-Y110 HydrophobicContact CG2-CD1 4.18Å; I108-Y110 HydrophobicContact CG2-CD2 4.14Å; I108-Y110 HydrophobicContact CG2-CE1 4.01Å; I108-Y110 HydrophobicContact CG2-CE2 3.97Å; I108-Y110 HydrophobicContact CG2-CG 4.25Å; I108-Y110 WeakPolarHBondContact O-CD2 3.31Å; I108-Y110 PolarHBondContact O-N 3.24Å; Y110-I113 PolarHBondContact O-N 2.87Å; Y110-R114 WeakPolarHBondContact O-CB 3.44Å; Y110-R114 PolarHBondContact O-N 2.8Å |
| 111 | E | 95.6 | Very high | 84.1 | Confident | 110 Ų | 110 | 121.8 Ų | 121.8 | 51% | 0.514 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -70.2 | -41.5 | 176.3 | -76.1 | -57.8 | 142.4 | 0 | 0 | 111.5 | D109 R114 R115 | D109-E111 PolarHBondContact O-N 3.11Å; D109-E111 WeakPolarHBondContact OD1-CB 3.44Å; D109-E111 PolarHBondContact OD1-N 2.89Å; D109-E111 VanDerWaalsContact OD1-N 3.16Å; E111-R114 PolarHBondContact O-N 3.05Å; E111-R114 IonicContact OE1-NH1 3.65Å; E111-R115 WeakPolarHBondContact O-CB 3.23Å; E111-R115 PolarHBondContact O-N 3.2Å |
| 112 | K | 96.3 | Very high | 86.3 | Confident | 126 Ų | 126 | 122.5 Ų | 122.5 | 55% | 0.548 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -63.6 | -45.2 | 172.1 | -175.4 | 177.5 | -177.4 | -179.1 | 0 | 111.6 | D109 R115 I116 | D109-K112 HydrophobicContact CB-CB 4.01Å; D109-K112 VanDerWaalsContact CG-CB 3.4Å; D109-K112 PolarHBondContact O-N 3.35Å; D109-K112 PolarHBondContact OD1-N 3.43Å; D109-K112 WeakPolarHBondContact OD2-CB 3.34Å; K112-R115 PolarHBondContact O-N 3.36Å; K112-I116 HydrophobicContact CG-CD1 4.04Å; K112-I116 VanDerWaalsContact O-CG1 3.27Å; K112-I116 WeakPolarHBondContact O-CG1 3.03Å; K112-I116 PolarHBondContact O-N 3.15Å |
| 113 | I | 95.6 | Very high | 88.4 | Confident | 82 Ų | 82 | 125 Ų | 125 | 42% | 0.421 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -60.4 | -48.1 | 176.8 | -66.2 | 172.6 | 0 | 0 | 0 | 110.5 | I108 D109 Y110 R115 I116 V117 | I108-I113 HydrophobicContact CG2-CD1 3.47Å; I108-I113 VanDerWaalsContact CG2-CD1 3.47Å; D109-I113 WeakPolarHBondContact O-CG1 3.46Å; D109-I113 PolarHBondContact O-N 3.23Å; Y110-I113 PolarHBondContact O-N 2.87Å; I113-R115 VanDerWaalsContact C-N 3.31Å; I113-R115 PolarHBondContact O-N 2.94Å; I113-I116 PolarHBondContact O-N 2.96Å; I113-I116 VanDerWaalsContact O-N 3.14Å; I113-V117 HydrophobicContact CG2-CG2 4.37Å; I113-V117 WeakPolarHBondContact O-CG2 3.42Å; I113-V117 PolarHBondContact O-N 3.05Å |
| 114 | R | 96.6 | Very high | 90.4 | Very high | 168 Ų | 168 | 122.5 Ų | 122.5 | 63% | 0.634 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -57.2 | -43.2 | 177.3 | -180 | -177.8 | -78.5 | -172.2 | -7 | 111.7 | Y110 E111 V117 K118 | Y110-R114 WeakPolarHBondContact O-CB 3.44Å; Y110-R114 PolarHBondContact O-N 2.8Å; E111-R114 PolarHBondContact O-N 3.05Å; E111-R114 IonicContact OE1-NH1 3.65Å; R114-V117 PolarHBondContact O-N 2.62Å; R114-K118 WeakPolarHBondContact O-CB 3.49Å; R114-K118 PolarHBondContact O-N 2.89Å |
| 115 | R | 97 | Very high | 92.3 | Very high | 169 Ų | 169 | 120 Ų | 120 | 64% | 0.638 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -62.7 | -43.5 | 176.2 | -170 | -174.9 | -55.8 | 174.7 | 4.5 | 112 | E111 K112 I113 K118 N119 | E111-R115 WeakPolarHBondContact O-CB 3.23Å; E111-R115 PolarHBondContact O-N 3.2Å; K112-R115 PolarHBondContact O-N 3.36Å; I113-R115 VanDerWaalsContact C-N 3.31Å; I113-R115 PolarHBondContact O-N 2.94Å; R115-K118 PolarHBondContact O-N 3.3Å; R115-N119 WeakPolarHBondContact O-CB 3.34Å; R115-N119 VanDerWaalsContact O-CG 3.28Å; R115-N119 PolarHBondContact O-N 3.1Å |
| 116 | I | 96.8 | Very high | 94.2 | Very high | 101 Ų | 101 | 117.3 Ų | 117.3 | 52% | 0.518 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -61.3 | -49.3 | 177.7 | -69.3 | 164.8 | 0 | 0 | 0 | 110.2 | K112 I113 K118 N119 D120 | K112-I116 HydrophobicContact CG-CD1 4.04Å; K112-I116 VanDerWaalsContact O-CG1 3.27Å; K112-I116 WeakPolarHBondContact O-CG1 3.03Å; K112-I116 PolarHBondContact O-N 3.15Å; I113-I116 PolarHBondContact O-N 2.96Å; I113-I116 VanDerWaalsContact O-N 3.14Å; I116-K118 PolarHBondContact O-N 3.44Å; I116-N119 PolarHBondContact O-N 2.94Å; I116-D120 WeakPolarHBondContact O-CB 3.39Å; I116-D120 PolarHBondContact O-N 3.16Å |
| 117 | V | 97.5 | Very high | 95.6 | Very high | 90 Ų | 90 | 119.3 Ų | 119.3 | 55% | 0.545 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -62.4 | -44.5 | -179.9 | 173.7 | 0 | 0 | 0 | 0 | 111.3 | I113 R114 N119 D120 L121 | I113-V117 HydrophobicContact CG2-CG2 4.37Å; I113-V117 WeakPolarHBondContact O-CG2 3.42Å; I113-V117 PolarHBondContact O-N 3.05Å; R114-V117 PolarHBondContact O-N 2.62Å; V117-N119 VanDerWaalsContact C-N 3.34Å; V117-N119 PolarHBondContact O-N 3.42Å; V117-D120 PolarHBondContact O-N 2.87Å; V117-L121 WeakPolarHBondContact O-CB 3.42Å; V117-L121 PolarHBondContact O-N 2.92Å |
| 118 | K | 98.1 | Very high | 96.3 | Very high | 153 Ų | 153 | 119.5 Ų | 119.5 | 67% | 0.665 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -59.6 | -44.8 | 177 | -173.8 | 178.2 | 179.9 | -180 | 0 | 111.7 | R114 R115 I116 L121 A122 | R114-K118 WeakPolarHBondContact O-CB 3.49Å; R114-K118 PolarHBondContact O-N 2.89Å; R115-K118 PolarHBondContact O-N 3.3Å; I116-K118 PolarHBondContact O-N 3.44Å; K118-L121 PolarHBondContact O-N 3.32Å; K118-A122 WeakPolarHBondContact O-CB 3.41Å; K118-A122 PolarHBondContact O-N 3.5Å |
| 119 | N | 97.5 | Very high | 96.9 | Very high | 91 Ų | 91 | 120.5 Ų | 120.5 | 49% | 0.487 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -68.9 | -37.5 | 178.9 | -73.6 | -11.4 | 0 | 0 | 0 | 112.5 | R115 I116 V117 A122 R123 | R115-N119 WeakPolarHBondContact O-CB 3.34Å; R115-N119 VanDerWaalsContact O-CG 3.28Å; R115-N119 PolarHBondContact O-N 3.1Å; I116-N119 PolarHBondContact O-N 2.94Å; V117-N119 VanDerWaalsContact C-N 3.34Å; V117-N119 PolarHBondContact O-N 3.42Å; N119-A122 PolarHBondContact O-N 3.29Å; N119-R123 WeakPolarHBondContact O-CB 3.4Å; N119-R123 PolarHBondContact O-N 3.45Å |
| 120 | D | 98 | Very high | 97.2 | Very high | 65 Ų | 65 | 120.9 Ų | 120.9 | 35% | 0.348 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -65.1 | -43.1 | 175.5 | -175.4 | 57.4 | 0 | 0 | 0 | 111.6 | I116 V117 R123 K124 | I116-D120 WeakPolarHBondContact O-CB 3.39Å; I116-D120 PolarHBondContact O-N 3.16Å; V117-D120 PolarHBondContact O-N 2.87Å; D120-R123 WeakPolarHBondContact O-CB 3.35Å; D120-R123 PolarHBondContact O-N 3.35Å; D120-K124 WeakPolarHBondContact O-CG 3.41Å; D120-K124 PolarHBondContact O-N 3.28Å; D120-K124 WeakPolarHBondContact OD2-CE 3.28Å; D120-K124 IonicContact OD2-NZ 2.69Å; D120-K124 PolarHBondContact OD2-NZ 3.01Å |
| 121 | L | 98.3 | Very high | 97.4 | Very high | 103 Ų | 103 | 121 Ų | 121 | 54% | 0.539 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.2 | -48 | 174.8 | -178.1 | 60.8 | 0 | 0 | 0 | 111.5 | V117 K118 R123 K124 M125 | V117-L121 WeakPolarHBondContact O-CB 3.42Å; V117-L121 PolarHBondContact O-N 2.92Å; K118-L121 PolarHBondContact O-N 3.32Å; L121-R123 VanDerWaalsContact C-N 3.28Å; L121-R123 PolarHBondContact O-N 2.88Å; L121-K124 PolarHBondContact O-N 3.36Å; L121-K124 VanDerWaalsContact O-N 3.14Å; L121-M125 HydrophobicContact CD1-CG 4.3Å; L121-M125 WeakPolarHBondContact O-CG 3.31Å; L121-M125 PolarHBondContact O-N 3.05Å |
| 122 | A | 97.9 | Very high | 97.4 | Very high | 59 Ų | 59 | 119 Ų | 119 | 49% | 0.488 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -57.8 | -41.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | K118 N119 M125 R126 | K118-A122 WeakPolarHBondContact O-CB 3.41Å; K118-A122 PolarHBondContact O-N 3.5Å; N119-A122 PolarHBondContact O-N 3.29Å; A122-M125 PolarHBondContact O-N 3.32Å; A122-R126 WeakPolarHBondContact O-CB 3.4Å; A122-R126 PolarHBondContact O-N 2.88Å |
| 123 | R | 98.1 | Very high | 97.4 | Very high | 160 Ų | 160 | 115.8 Ų | 115.8 | 60% | 0.604 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -62.8 | -43.8 | 175.8 | -171.5 | -169.5 | -53.4 | -121.2 | 0.8 | 112.1 | N119 D120 L121 K127 | N119-R123 WeakPolarHBondContact O-CB 3.4Å; N119-R123 PolarHBondContact O-N 3.45Å; D120-R123 WeakPolarHBondContact O-CB 3.35Å; D120-R123 PolarHBondContact O-N 3.35Å; L121-R123 VanDerWaalsContact C-N 3.28Å; L121-R123 PolarHBondContact O-N 2.88Å; R123-K127 WeakPolarHBondContact O-CG 3.39Å; R123-K127 PolarHBondContact O-N 3.44Å |
| 124 | K | 98.2 | Very high | 97.5 | Very high | 122 Ų | 122 | 119 Ų | 119 | 53% | 0.53 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64.8 | -42.5 | 178.1 | -77.8 | 171.5 | 174.5 | 161.9 | 0 | 111.8 | D120 L121 K127 R128 | D120-K124 WeakPolarHBondContact O-CG 3.41Å; D120-K124 PolarHBondContact O-N 3.28Å; D120-K124 WeakPolarHBondContact OD2-CE 3.28Å; D120-K124 IonicContact OD2-NZ 2.69Å; D120-K124 PolarHBondContact OD2-NZ 3.01Å; L121-K124 PolarHBondContact O-N 3.36Å; L121-K124 VanDerWaalsContact O-N 3.14Å; K124-K127 PolarHBondContact O-N 3.42Å; K124-R128 PolarHBondContact O-N 3.4Å |
| 125 | M | 98 | Very high | 97.4 | Very high | 84 Ų | 84 | 113.6 Ų | 113.6 | 41% | 0.414 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.6 | -46.9 | 176.7 | -68.5 | -56.4 | -69.6 | 0 | 0 | 111.5 | L121 A122 K127 R128 E129 | L121-M125 HydrophobicContact CD1-CG 4.3Å; L121-M125 WeakPolarHBondContact O-CG 3.31Å; L121-M125 PolarHBondContact O-N 3.05Å; A122-M125 PolarHBondContact O-N 3.32Å; M125-K127 VanDerWaalsContact C-N 3.33Å; M125-K127 PolarHBondContact O-N 2.95Å; M125-R128 WeakPolarHBondContact O-CA 3.28Å; M125-R128 VanDerWaalsContact O-CB 3.31Å; M125-R128 WeakPolarHBondContact O-CB 3.46Å; M125-R128 PolarHBondContact O-N 3.05Å; M125-E129 PolarHBondContact O-N 2.84Å |
| 126 | R | 97.8 | Very high | 97.3 | Very high | 177 Ų | 177 | 108.7 Ų | 108.7 | 67% | 0.668 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -58.8 | -41.6 | 175.1 | -171.2 | 171.4 | -177.7 | 176.5 | 0.5 | 112.7 | A122 R128 E129 I130 | A122-R126 WeakPolarHBondContact O-CB 3.4Å; A122-R126 PolarHBondContact O-N 2.88Å; R126-R128 VanDerWaalsContact C-N 3.28Å; R126-R128 PolarHBondContact O-N 3.46Å; R126-E129 PolarHBondContact O-N 3.18Å; R126-I130 HydrophobicContact CG-CD1 4.2Å; R126-I130 WeakPolarHBondContact O-CG1 3.44Å; R126-I130 PolarHBondContact O-N 2.93Å |
| 127 | K | 98 | Very high | 97.2 | Very high | 132 Ų | 132 | 106.8 Ų | 106.8 | 57% | 0.574 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64 | -31.3 | 174 | -78.1 | -174.1 | 177.3 | -173.4 | 0 | 113 | R123 K124 M125 R131 | R123-K127 WeakPolarHBondContact O-CG 3.39Å; R123-K127 PolarHBondContact O-N 3.44Å; K124-K127 PolarHBondContact O-N 3.42Å; M125-K127 VanDerWaalsContact C-N 3.33Å; M125-K127 PolarHBondContact O-N 2.95Å; K127-R131 WeakPolarHBondContact O-CG 3.49Å; K127-R131 PolarHBondContact O-N 3.32Å; K127-R131 PolarHBondContact O-NE 3.42Å; K127-R131 VanDerWaalsContact O-NE 3.16Å |
| 128 | R | 97.7 | Very high | 96.9 | Very high | 164 Ų | 164 | 106.6 Ų | 106.6 | 62% | 0.619 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -70.5 | -44.8 | 175.3 | -176.4 | -178 | 179.3 | 174 | 0.5 | 110.7 | K124 M125 R126 R131 S132 | K124-R128 PolarHBondContact O-N 3.4Å; M125-R128 WeakPolarHBondContact O-CA 3.28Å; M125-R128 VanDerWaalsContact O-CB 3.31Å; M125-R128 WeakPolarHBondContact O-CB 3.46Å; M125-R128 PolarHBondContact O-N 3.05Å; R126-R128 VanDerWaalsContact C-N 3.28Å; R126-R128 PolarHBondContact O-N 3.46Å; R128-R131 PolarHBondContact O-N 3.45Å; R128-S132 PolarHBondContact O-N 2.95Å |
| 129 | E | 97.2 | Very high | 96.5 | Very high | 119 Ų | 119 | 107 Ų | 107 | 56% | 0.556 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -59.3 | -48.3 | 177.2 | -70.9 | 163 | -168.5 | 0 | 0 | 111.8 | M125 R126 R131 S132 A133 | M125-E129 PolarHBondContact O-N 2.84Å; R126-E129 PolarHBondContact O-N 3.18Å; E129-R131 VanDerWaalsContact C-N 3.31Å; E129-R131 PolarHBondContact O-N 3.19Å; E129-S132 WeakPolarHBondContact O-CB 3.05Å; E129-S132 PolarHBondContact O-N 3.34Å; E129-S132 VanDerWaalsContact O-N 3.1Å; E129-A133 PolarHBondContact O-N 2.86Å |
| 130 | I | 97.3 | Very high | 96.1 | Very high | 100 Ų | 100 | 109.5 Ų | 109.5 | 51% | 0.513 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -58.7 | -43.7 | 177.7 | -67.2 | 166.1 | 0 | 0 | 0 | 111.2 | R126 S132 A133 K134 | R126-I130 HydrophobicContact CG-CD1 4.2Å; R126-I130 WeakPolarHBondContact O-CG1 3.44Å; R126-I130 PolarHBondContact O-N 2.93Å; I130-S132 VanDerWaalsContact C-N 3.34Å; I130-S132 PolarHBondContact O-N 2.91Å; I130-A133 PolarHBondContact O-N 2.92Å; I130-K134 WeakPolarHBondContact O-CB 3.41Å; I130-K134 PolarHBondContact O-N 3.27Å |
| 131 | R | 97.3 | Very high | 95.6 | Very high | 165 Ų | 165 | 110.4 Ų | 110.4 | 62% | 0.623 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.1 | -40.1 | 176.8 | -78 | -177.6 | -67.6 | 149 | -2.9 | 112 | K127 R128 E129 K134 A135 | K127-R131 WeakPolarHBondContact O-CG 3.49Å; K127-R131 PolarHBondContact O-N 3.32Å; K127-R131 PolarHBondContact O-NE 3.42Å; K127-R131 VanDerWaalsContact O-NE 3.16Å; R128-R131 PolarHBondContact O-N 3.45Å; E129-R131 VanDerWaalsContact C-N 3.31Å; E129-R131 PolarHBondContact O-N 3.19Å; R131-K134 PolarHBondContact O-N 3.25Å; R131-A135 WeakPolarHBondContact O-CB 3.34Å; R131-A135 PolarHBondContact O-N 3.11Å |
| 132 | S | 96.6 | Very high | 94.9 | Very high | 70 Ų | 70 | 109.1 Ų | 109.1 | 49% | 0.49 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.5 | -49.2 | 175.8 | -167.9 | 0 | 0 | 0 | 0 | 111.1 | R128 E129 I130 K134 A135 E136 | R128-S132 PolarHBondContact O-N 2.95Å; E129-S132 WeakPolarHBondContact O-CB 3.05Å; E129-S132 PolarHBondContact O-N 3.34Å; E129-S132 VanDerWaalsContact O-N 3.1Å; I130-S132 VanDerWaalsContact C-N 3.34Å; I130-S132 PolarHBondContact O-N 2.91Å; S132-K134 VanDerWaalsContact C-N 3.35Å; S132-K134 PolarHBondContact O-N 2.89Å; S132-A135 PolarHBondContact O-N 2.99Å; S132-E136 WeakPolarHBondContact O-CB 3.35Å; S132-E136 PolarHBondContact O-N 3.47Å |
| 133 | A | 96.7 | Very high | 94.2 | Very high | 57 Ų | 57 | 109.3 Ų | 109.3 | 47% | 0.471 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.8 | -41.7 | 178 | 0 | 0 | 0 | 0 | 0 | 111.9 | E129 I130 E136 C137 | E129-A133 PolarHBondContact O-N 2.86Å; I130-A133 PolarHBondContact O-N 2.92Å; A133-E136 PolarHBondContact O-N 3.25Å; A133-C137 VanDerWaalsContact O-CB 3.28Å; A133-C137 WeakPolarHBondContact O-CB 3.43Å; A133-C137 PolarHBondContact O-N 2.66Å |
| 134 | K | 96.7 | Very high | 93.4 | Very high | 151 Ų | 151 | 106.9 Ų | 106.9 | 66% | 0.657 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.8 | -48.4 | 175.9 | -174.5 | 173 | -178.6 | 173.3 | 0 | 111.4 | I130 R131 S132 E136 C137 T138 | I130-K134 WeakPolarHBondContact O-CB 3.41Å; I130-K134 PolarHBondContact O-N 3.27Å; R131-K134 PolarHBondContact O-N 3.25Å; S132-K134 VanDerWaalsContact C-N 3.35Å; S132-K134 PolarHBondContact O-N 2.89Å; K134-E136 VanDerWaalsContact C-N 3.33Å; K134-E136 PolarHBondContact O-N 2.99Å; K134-C137 PolarHBondContact O-N 3.22Å; K134-T138 PolarHBondContact O-N 3.44Å; K134-T138 PolarHBondContact O-OG1 2.98Å; K134-T138 VanDerWaalsContact O-OG1 3.05Å |
| 135 | A | 95.5 | Very high | 92.3 | Very high | 53 Ų | 53 | 103 Ų | 103 | 44% | 0.438 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.1 | -41.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | R131 S132 T138 R139 | R131-A135 WeakPolarHBondContact O-CB 3.34Å; R131-A135 PolarHBondContact O-N 3.11Å; S132-A135 PolarHBondContact O-N 2.99Å; A135-T138 PolarHBondContact O-N 3.29Å; A135-R139 WeakPolarHBondContact O-CG 3.43Å; A135-R139 PolarHBondContact O-N 3.48Å |
| 136 | E | 94.6 | Very high | 91.4 | Very high | 66 Ų | 66 | 101.6 Ų | 101.6 | 31% | 0.308 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 176.3 | -172.7 | 179.7 | 168.4 | 0 | 0 | 112.5 | S132 A133 K134 R139 R140 | S132-E136 WeakPolarHBondContact O-CB 3.35Å; S132-E136 PolarHBondContact O-N 3.47Å; A133-E136 PolarHBondContact O-N 3.25Å; K134-E136 VanDerWaalsContact C-N 3.33Å; K134-E136 PolarHBondContact O-N 2.99Å; E136-R139 PolarHBondContact O-N 2.98Å; E136-R140 PolarHBondContact O-N 3.47Å; E136-R140 IonicContact OE1-CZ 3.07Å; E136-R140 IonicContact OE1-NH1 3.05Å; E136-R140 PolarHBondContact OE1-NH1 3.27Å; E136-R140 IonicContact OE1-NH2 2.62Å; E136-R140 PolarHBondContact OE1-NH2 2.99Å |
| 137 | C | 94.1 | Very high | 90.5 | Very high | 61 Ų | 61 | 98.4 Ų | 98.4 | 41% | 0.412 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.2 | -45.6 | 174.7 | -175.5 | 0 | 0 | 0 | 0 | 111.5 | A133 K134 R139 R140 N141 | A133-C137 VanDerWaalsContact O-CB 3.28Å; A133-C137 WeakPolarHBondContact O-CB 3.43Å; A133-C137 PolarHBondContact O-N 2.66Å; K134-C137 PolarHBondContact O-N 3.22Å; C137-R139 VanDerWaalsContact C-N 3.34Å; C137-R139 PolarHBondContact O-N 3.28Å; C137-R140 PolarHBondContact O-N 3.36Å; C137-N141 WeakPolarHBondContact O-CB 3.4Å; C137-N141 PolarHBondContact O-N 3.37Å |
| 138 | T | 91.2 | Very high | 89.7 | Confident | 86 Ų | 86 | 99 Ų | 99 | 53% | 0.528 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.1 | -42.2 | 176.3 | -58.6 | 0 | 0 | 0 | 0 | 111.9 | K134 A135 N141 A142 | K134-T138 PolarHBondContact O-N 3.44Å; K134-T138 PolarHBondContact O-OG1 2.98Å; K134-T138 VanDerWaalsContact O-OG1 3.05Å; A135-T138 PolarHBondContact O-N 3.29Å; T138-N141 PolarHBondContact O-N 3.36Å; T138-A142 WeakPolarHBondContact O-CB 3.13Å; T138-A142 PolarHBondContact O-N 3.38Å |
| 139 | R | 90.1 | Very high | 88.7 | Confident | 163 Ų | 163 | 95.7 Ų | 95.7 | 62% | 0.615 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60 | -48.7 | 175.5 | -72.3 | -174.8 | -55.6 | -152 | 2.1 | 111.8 | A135 E136 C137 N141 A142 T143 | A135-R139 WeakPolarHBondContact O-CG 3.43Å; A135-R139 PolarHBondContact O-N 3.48Å; E136-R139 PolarHBondContact O-N 2.98Å; C137-R139 VanDerWaalsContact C-N 3.34Å; C137-R139 PolarHBondContact O-N 3.28Å; R139-N141 VanDerWaalsContact C-N 3.34Å; R139-N141 PolarHBondContact O-N 3.28Å; R139-A142 PolarHBondContact O-N 3.06Å; R139-T143 PolarHBondContact O-N 3.26Å |
| 140 | R | 87.7 | Confident | 87.8 | Confident | 143 Ų | 143 | 95.8 Ų | 95.8 | 54% | 0.54 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.4 | -41.9 | 177.4 | -71.2 | -175.9 | 177.5 | 125.7 | 3.5 | 112 | E136 C137 A142 T143 K144 | E136-R140 PolarHBondContact O-N 3.47Å; E136-R140 IonicContact OE1-CZ 3.07Å; E136-R140 IonicContact OE1-NH1 3.05Å; E136-R140 PolarHBondContact OE1-NH1 3.27Å; E136-R140 IonicContact OE1-NH2 2.62Å; E136-R140 PolarHBondContact OE1-NH2 2.99Å; C137-R140 PolarHBondContact O-N 3.36Å; R140-A142 VanDerWaalsContact C-N 3.33Å; R140-A142 PolarHBondContact O-N 3.49Å; R140-T143 PolarHBondContact O-N 3.4Å; R140-T143 PolarHBondContact O-OG1 3.11Å; R140-K144 VanDerWaalsContact O-CG 3.28Å; R140-K144 WeakPolarHBondContact O-CG 3.38Å; R140-K144 PolarHBondContact O-N 2.97Å |
| 141 | N | 87.4 | Confident | 87.3 | Confident | 84 Ų | 84 | 97.6 Ų | 97.6 | 45% | 0.449 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -69.2 | -32.7 | -179.4 | -72 | -15.1 | 0 | 0 | 0 | 112.4 | C137 T138 R139 K144 | C137-N141 WeakPolarHBondContact O-CB 3.4Å; C137-N141 PolarHBondContact O-N 3.37Å; T138-N141 PolarHBondContact O-N 3.36Å; R139-N141 VanDerWaalsContact C-N 3.34Å; R139-N141 PolarHBondContact O-N 3.28Å; N141-K144 PolarHBondContact OD1-NZ 3Å |
| 142 | A | 85.5 | Confident | 86.7 | Confident | 76 Ų | 76 | 96.3 Ų | 96.3 | 63% | 0.628 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.7 | -37.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | T138 R139 R140 | T138-A142 WeakPolarHBondContact O-CB 3.13Å; T138-A142 PolarHBondContact O-N 3.38Å; R139-A142 PolarHBondContact O-N 3.06Å; R140-A142 VanDerWaalsContact C-N 3.33Å; R140-A142 PolarHBondContact O-N 3.49Å |
| 143 | T | 82.2 | Confident | 86.1 | Confident | 63 Ų | 63 | 98.1 Ų | 98.1 | 39% | 0.387 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -83.2 | -27.5 | -178.8 | 65.3 | 0 | 0 | 0 | 0 | 113.8 | R139 R140 G145 A146 E147 | R139-T143 PolarHBondContact O-N 3.26Å; R140-T143 PolarHBondContact O-N 3.4Å; R140-T143 PolarHBondContact O-OG1 3.11Å; T143-G145 PolarHBondContact O-N 2.88Å; T143-G145 VanDerWaalsContact O-N 3.11Å; T143-A146 PolarHBondContact O-N 3.21Å; T143-E147 VanDerWaalsContact CB-OE1 3.31Å; T143-E147 WeakPolarHBondContact CB-OE1 3.21Å; T143-E147 WeakPolarHBondContact O-CG 3.44Å; T143-E147 PolarHBondContact O-N 3.27Å; T143-E147 PolarHBondContact OG1-OE1 3.22Å |
| 144 | K | 81.2 | Confident | 85.6 | Confident | 109 Ų | 109 | 97.4 Ų | 97.4 | 47% | 0.474 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -52.2 | -36.8 | 178.8 | -84.1 | 173.6 | -171.3 | 170.9 | 0 | 113.8 | R140 N141 K148 | R140-K144 VanDerWaalsContact O-CG 3.28Å; R140-K144 WeakPolarHBondContact O-CG 3.38Å; R140-K144 PolarHBondContact O-N 2.97Å; N141-K144 PolarHBondContact OD1-NZ 3Å; K144-K148 WeakPolarHBondContact O-CG 3.43Å; K144-K148 PolarHBondContact O-N 3.08Å |
| 145 | G | 76.4 | Confident | 85 | Confident | 40 Ų | 40 | 95.2 Ų | 95.2 | 41% | 0.412 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.6 | -44.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | T143 K148 N149 | T143-G145 PolarHBondContact O-N 2.88Å; T143-G145 VanDerWaalsContact O-N 3.11Å; G145-K148 PolarHBondContact O-N 3.33Å; G145-N149 PolarHBondContact O-N 3.35Å |
| 146 | A | 78 | Confident | 84.5 | Confident | 55 Ų | 55 | 96.3 Ų | 96.3 | 46% | 0.455 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.2 | -41.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112 | T143 K148 N149 L150 | T143-A146 PolarHBondContact O-N 3.21Å; A146-K148 VanDerWaalsContact C-N 3.35Å; A146-K148 PolarHBondContact O-N 3.31Å; A146-N149 PolarHBondContact O-N 2.79Å; A146-L150 WeakPolarHBondContact O-CB 3.36Å; A146-L150 WeakPolarHBondContact O-CG 3.47Å; A146-L150 PolarHBondContact O-N 3.26Å |
| 147 | E | 79.5 | Confident | 84 | Confident | 110 Ų | 110 | 101.3 Ų | 101.3 | 51% | 0.514 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.5 | -40.3 | 177.5 | -71.9 | 166.8 | -151.4 | 0 | 0 | 112.2 | T143 K151 | T143-E147 VanDerWaalsContact CB-OE1 3.31Å; T143-E147 WeakPolarHBondContact CB-OE1 3.21Å; T143-E147 WeakPolarHBondContact O-CG 3.44Å; T143-E147 PolarHBondContact O-N 3.27Å; T143-E147 PolarHBondContact OG1-OE1 3.22Å; E147-K151 WeakPolarHBondContact O-CB 3.49Å; E147-K151 PolarHBondContact O-N 2.98Å |
| 148 | K | 80.2 | Confident | 83.3 | Confident | 144 Ų | 144 | 106.5 Ų | 106.5 | 63% | 0.626 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -64.3 | -39.6 | 176.3 | -76.9 | 179.5 | -179.5 | -173.9 | 0 | 112.4 | K144 G145 A146 K152 | K144-K148 WeakPolarHBondContact O-CG 3.43Å; K144-K148 PolarHBondContact O-N 3.08Å; G145-K148 PolarHBondContact O-N 3.33Å; A146-K148 VanDerWaalsContact C-N 3.35Å; A146-K148 PolarHBondContact O-N 3.31Å; K148-K152 WeakPolarHBondContact O-CG 3.35Å; K148-K152 PolarHBondContact O-N 3.47Å |
| 149 | N | 76.4 | Confident | 82.3 | Confident | 95 Ų | 95 | 112 Ų | 112 | 51% | 0.508 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -71.6 | -45.4 | 178.7 | -68.1 | -16.6 | 0 | 0 | 0 | 110.9 | G145 A146 K151 K152 D153 | G145-N149 PolarHBondContact O-N 3.35Å; A146-N149 PolarHBondContact O-N 2.79Å; N149-K151 PolarHBondContact O-N 3.28Å; N149-K152 PolarHBondContact O-N 3.41Å; N149-K152 VanDerWaalsContact O-N 3.11Å; N149-D153 VanDerWaalsContact O-CG 3.31Å; N149-D153 PolarHBondContact O-N 2.88Å |
| 150 | L | 80.3 | Confident | 81.9 | Confident | 120 Ų | 120 | 109.5 Ų | 109.5 | 63% | 0.628 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -56.4 | -39 | 174.6 | -76.4 | 167.2 | 0 | 0 | 0 | 112.4 | A146 A154 | A146-L150 WeakPolarHBondContact O-CB 3.36Å; A146-L150 WeakPolarHBondContact O-CG 3.47Å; A146-L150 PolarHBondContact O-N 3.26Å; L150-A154 WeakPolarHBondContact O-CB 3.39Å; L150-A154 PolarHBondContact O-N 2.71Å |
| 151 | K | 86.3 | Confident | 81.5 | Confident | 138 Ų | 138 | 107.7 Ų | 107.7 | 60% | 0.6 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -66 | -43.8 | 176.7 | -172.2 | 174.9 | 177.8 | -177.6 | 0 | 112.4 | E147 N149 A154 E155 | E147-K151 WeakPolarHBondContact O-CB 3.49Å; E147-K151 PolarHBondContact O-N 2.98Å; N149-K151 PolarHBondContact O-N 3.28Å; K151-A154 PolarHBondContact O-N 3.35Å; K151-E155 WeakPolarHBondContact CE-OE1 3.46Å; K151-E155 WeakPolarHBondContact O-CG 3.28Å; K151-E155 PolarHBondContact O-N 3.34Å |
| 152 | K | 84.3 | Confident | 81.2 | Confident | 138 Ų | 138 | 109 Ų | 109 | 60% | 0.6 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -64.6 | -41.7 | 176.2 | -71.9 | 179.5 | 179.1 | -174 | 0 | 112.1 | K148 N149 A154 E155 A156 | K148-K152 WeakPolarHBondContact O-CG 3.35Å; K148-K152 PolarHBondContact O-N 3.47Å; N149-K152 PolarHBondContact O-N 3.41Å; N149-K152 VanDerWaalsContact O-N 3.11Å; K152-A154 VanDerWaalsContact C-N 3.31Å; K152-A154 PolarHBondContact O-N 3.45Å; K152-E155 PolarHBondContact O-N 2.89Å; K152-A156 WeakPolarHBondContact O-CB 3.26Å; K152-A156 PolarHBondContact O-N 3.16Å |
| 153 | D | 83 | Confident | 81 | Confident | 109 Ų | 109 | 110.9 Ų | 110.9 | 58% | 0.583 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -66 | -36.3 | 178.5 | -67.9 | -14 | 0 | 0 | 0 | 111.3 | N149 F157 | N149-D153 VanDerWaalsContact O-CG 3.31Å; N149-D153 PolarHBondContact O-N 2.88Å; D153-F157 PolarHBondContact O-N 2.89Å |
| 154 | A | 86 | Confident | 80.9 | Confident | 42 Ų | 42 | 113.9 Ų | 113.9 | 35% | 0.347 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -66.5 | -47.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | L150 K151 K152 A156 F157 F158 | L150-A154 WeakPolarHBondContact O-CB 3.39Å; L150-A154 PolarHBondContact O-N 2.71Å; K151-A154 PolarHBondContact O-N 3.35Å; K152-A154 VanDerWaalsContact C-N 3.31Å; K152-A154 PolarHBondContact O-N 3.45Å; A154-A156 VanDerWaalsContact C-N 3.28Å; A154-A156 PolarHBondContact O-N 3.42Å; A154-F157 PolarHBondContact O-N 3.13Å; A154-F158 HydrophobicContact CB-CE2 4.44Å; A154-F158 WeakPolarHBondContact O-CD2 3.33Å; A154-F158 PolarHBondContact O-N 3.01Å |
| 155 | E | 85.5 | Confident | 80.9 | Confident | 105 Ų | 105 | 114.3 Ų | 114.3 | 49% | 0.491 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -57.3 | -41.8 | 176.3 | -73.6 | 168.9 | -172.1 | 0 | 0 | 111.4 | K151 K152 F157 F158 D159 | K151-E155 WeakPolarHBondContact CE-OE1 3.46Å; K151-E155 WeakPolarHBondContact O-CG 3.28Å; K151-E155 PolarHBondContact O-N 3.34Å; K152-E155 PolarHBondContact O-N 2.89Å; E155-F157 VanDerWaalsContact C-N 3.25Å; E155-F157 PolarHBondContact O-N 3.37Å; E155-F158 PolarHBondContact O-N 3.1Å; E155-D159 PolarHBondContact O-N 2.86Å |
| 156 | A | 85.5 | Confident | 81.2 | Confident | 76 Ų | 76 | 119.6 Ų | 119.6 | 63% | 0.628 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -69.3 | -15.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115 | K152 A154 | K152-A156 WeakPolarHBondContact O-CB 3.26Å; K152-A156 PolarHBondContact O-N 3.16Å; A154-A156 VanDerWaalsContact C-N 3.28Å; A154-A156 PolarHBondContact O-N 3.42Å |
| 157 | F | 82.7 | Confident | 81.4 | Confident | 170 Ų | 170 | 124.5 Ų | 124.5 | 75% | 0.746 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -92.8 | -22.9 | 177.6 | -171 | -93 | 0 | 0 | 0 | 112.9 | D153 A154 E155 | D153-F157 PolarHBondContact O-N 2.89Å; A154-F157 PolarHBondContact O-N 3.13Å; E155-F157 VanDerWaalsContact C-N 3.25Å; E155-F157 PolarHBondContact O-N 3.37Å |
| 158 | F | 80.9 | Confident | 81.6 | Confident | 171 Ų | 171 | 125.8 Ų | 125.8 | 75% | 0.75 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -97.2 | -10.5 | -178.8 | -67.8 | -68.5 | 0 | 0 | 0 | 114.1 | A154 E155 | A154-F158 HydrophobicContact CB-CE2 4.44Å; A154-F158 WeakPolarHBondContact O-CD2 3.33Å; A154-F158 PolarHBondContact O-N 3.01Å; E155-F158 PolarHBondContact O-N 3.1Å |
| 159 | D | 68.3 | Low | 81.7 | Confident | 201 Ų | 201 | 124.1 Ų | 124.1 | 100% | 1.075 | 63% | 0.632 | S | S | * | * | trans | -89.9 | 0 | 167 | -79.6 | -12.3 | 0 | 0 | 0 | 111.6 | E155 | E155-D159 PolarHBondContact O-N 2.86Š|
Retrieved 159 of 159 residues in 164.5 ms
(Link to these results)