| 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 | 40.6 | Very low | 39.1 | Very low | 251 Ų | 251 | 150.8 Ų | 150.8 | 100% | 1.236 | 86% | 0.864 | S | S | * | * | 0 | 82.3 | 0 | -58 | -82.9 | -167.2 | 0 | 0 | 105 | |||||
| 2 | G | 39.1 | Very low | 39 | Very low | 72 Ų | 72 | 154.5 Ų | 154.5 | 74% | 0.742 | 86% | 0.863 | S | S | * | * | 98.9 | 95.3 | 71.3 | 0 | 0 | 0 | 0 | 0 | 107.4 | |||||
| 3 | N | 42.9 | Very low | 38.8 | Very low | 141 Ų | 141 | 156.2 Ų | 156.2 | 75% | 0.754 | 86% | 0.859 | S | S | * | * | 60.9 | 133.7 | 96.3 | -117.2 | 52.8 | 0 | 0 | 0 | 110.9 | |||||
| 4 | E | 42.4 | Very low | 38.3 | Very low | 164 Ų | 164 | 153 Ų | 153 | 77% | 0.766 | 85% | 0.854 | S | S | * | * | -171.2 | 134.8 | 50.1 | -48.9 | -169.9 | 123.7 | 0 | 0 | 106.6 | |||||
| 5 | Q | 43.2 | Very low | 38 | Very low | 180 Ų | 180 | 152 Ų | 152 | 84% | 0.841 | 85% | 0.846 | S | S | * | * | 78.4 | 127.6 | 73.4 | -159.9 | 174 | -0.2 | 0 | 0 | 116.6 | |||||
| 6 | S | 43.4 | Very low | 38 | Very low | 125 Ų | 125 | 155.6 Ų | 155.6 | 87% | 0.874 | 84% | 0.844 | S | S | * | * | trans | 138.5 | 129 | 141.9 | -113.2 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 7 | G | 32.9 | Very low | 37.8 | Very low | 77 Ų | 77 | 152.6 Ų | 152.6 | 79% | 0.794 | 84% | 0.838 | S | S | * | * | cis | 172.5 | 123.8 | 0 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 8 | D | 36.2 | Very low | 37.7 | Very low | 165 Ų | 165 | 150.8 Ų | 150.8 | 88% | 0.882 | 83% | 0.833 | S | S | * | * | trans | -76.5 | 148.2 | 177.5 | -107.9 | -39.6 | 0 | 0 | 0 | 111.8 | ||||
| 9 | A | 38.1 | Very low | 37.9 | Very low | 101 Ų | 101 | 147.5 Ų | 147.5 | 84% | 0.835 | 83% | 0.827 | S | S | * | * | trans | -131.4 | 89.8 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 10 | E | 36.2 | Very low | 38 | Very low | 187 Ų | 187 | 144.8 Ų | 144.8 | 87% | 0.874 | 82% | 0.824 | S | S | * | * | trans | -78.1 | 125 | 162.3 | -94.2 | 177.7 | 95.6 | 0 | 0 | 110.1 | K12 | E10-K12 PolarHBondContact O-N 3.39Š| ||
| 11 | H | 35 | Very low | 38.4 | Very low | 196 Ų | 196 | 144 Ų | 144 | 91% | 0.907 | 82% | 0.822 | S | S | * | * | trans | -87.4 | 101.4 | 177.6 | -132.9 | -16 | 0 | 0 | 0 | 109.7 | ||||
| 12 | K | 38.1 | Very low | 38.7 | Very low | 195 Ų | 195 | 137.5 Ų | 137.5 | 85% | 0.848 | 80% | 0.799 | S | S | * | * | trans | -90 | 119.9 | 174.8 | -150.4 | 170.9 | -175.1 | 177.2 | 0 | 109.8 | E10 S14 | E10-K12 PolarHBondContact O-N 3.39Å; K12-S14 PolarHBondContact O-N 2.98Å | ||
| 13 | H | 36.1 | Very low | 38.9 | Very low | 176 Ų | 176 | 139.2 Ų | 139.2 | 82% | 0.815 | 80% | 0.799 | S | S | * | * | trans | -56.4 | 126.1 | 171 | -100.8 | -115 | 0 | 0 | 0 | 110.5 | ||||
| 14 | S | 32.7 | Very low | 39.4 | Very low | 112 Ų | 112 | 138.4 Ų | 138.4 | 78% | 0.783 | 80% | 0.801 | S | S | * | * | trans | -99.7 | 98.6 | 175.4 | 176.5 | 0 | 0 | 0 | 0 | 108.9 | K12 Y16 | K12-S14 PolarHBondContact O-N 2.98Å; S14-Y16 PolarHBondContact O-N 2.87Å | ||
| 15 | D | 33.6 | Very low | 39.9 | Very low | 138 Ų | 138 | 135 Ų | 135 | 74% | 0.738 | 80% | 0.801 | S | S | * | * | trans | -70.5 | 112.5 | 168.7 | -69.9 | -46 | 0 | 0 | 0 | 109.7 | S17 | D15-S17 VanDerWaalsContact C-N 3.29Å; D15-S17 PolarHBondContact O-N 3.25Å | ||
| 16 | Y | 36.9 | Very low | 40.4 | Very low | 209 Ų | 209 | 137.8 Ų | 137.8 | 82% | 0.82 | 80% | 0.804 | S | S | * | * | trans | -75 | 82.7 | 173.2 | -165.6 | -92 | 0 | 0 | 0 | 109.2 | S14 | S14-Y16 PolarHBondContact O-N 2.87Š| ||
| 17 | S | 34.8 | Very low | 41.3 | Very low | 106 Ų | 106 | 141 Ų | 141 | 74% | 0.741 | 81% | 0.805 | S | S | * | * | trans | -84.6 | 110.1 | 165.5 | -73 | 0 | 0 | 0 | 0 | 109.2 | D15 A19 | D15-S17 VanDerWaalsContact C-N 3.29Å; D15-S17 PolarHBondContact O-N 3.25Å; S17-A19 VanDerWaalsContact C-N 3.27Å; S17-A19 PolarHBondContact O-N 3.47Å | ||
| 18 | T | 37.2 | Very low | 42.7 | Very low | 120 Ų | 120 | 146.6 Ų | 146.6 | 74% | 0.736 | 81% | 0.808 | S | S | * | * | trans | -66.8 | 84.3 | 170.2 | -57 | 0 | 0 | 0 | 0 | 109.6 | A20 | T18-A20 PolarHBondContact O-N 2.62Š| ||
| 19 | A | 40.7 | Very low | 44.1 | Very low | 87 Ų | 87 | 142.9 Ų | 142.9 | 72% | 0.719 | 80% | 0.8 | S | S | * | * | trans | -79.2 | 109.9 | 167.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | S17 V21 | S17-A19 VanDerWaalsContact C-N 3.27Å; S17-A19 PolarHBondContact O-N 3.47Å; A19-V21 PolarHBondContact O-N 3.37Å | ||
| 20 | A | 40.7 | Very low | 45.7 | Very low | 94 Ų | 94 | 145.8 Ų | 145.8 | 78% | 0.777 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 118.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | T18 P22 | T18-A20 PolarHBondContact O-N 2.62Å; A20-P22 WeakPolarHBondContact O-CD 3.37Å |
| 21 | V | 46 | Very low | 46.8 | Very low | 128 Ų | 128 | 144.8 Ų | 144.8 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 121.5 | 172.2 | -174.9 | 0 | 0 | 0 | 0 | 107.9 | A19 S23 | A19-V21 PolarHBondContact O-N 3.37Å; V21-S23 PolarHBondContact O-N 3.2Å; V21-S23 VanDerWaalsContact O-N 3.15Å |
| 22 | P | 46.4 | Very low | 48.1 | Very low | 115 Ų | 115 | 142.9 Ų | 142.9 | 75% | 0.747 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 118.6 | 173.3 | 25.6 | -29.7 | 0 | 0 | 0 | 108.4 | A20 | A20-P22 WeakPolarHBondContact O-CD 3.37Š|
| 23 | S | 43.8 | Very low | 49.3 | Very low | 108 Ų | 108 | 139.6 Ų | 139.6 | 76% | 0.755 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 140 | 173.9 | -65.5 | 0 | 0 | 0 | 0 | 110.1 | V21 A25 | V21-S23 PolarHBondContact O-N 3.2Å; V21-S23 VanDerWaalsContact O-N 3.15Å; S23-A25 PolarHBondContact O-N 2.79Å |
| 24 | P | 53.8 | Low | 50.7 | Low | 123 Ų | 123 | 136.8 Ų | 136.8 | 80% | 0.799 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 129.9 | 179.1 | 22.7 | -30.8 | 0 | 0 | 0 | 109.4 | R26 | P24-R26 PolarHBondContact O-N 2.79Å; P24-R26 VanDerWaalsContact O-N 3.11Å |
| 25 | A | 52.4 | Low | 52.2 | Low | 93 Ų | 93 | 137.3 Ų | 137.3 | 77% | 0.769 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -48.1 | 120.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | S23 Q27 | S23-A25 PolarHBondContact O-N 2.79Å; A25-Q27 PolarHBondContact O-N 3.16Å |
| 26 | R | 53.2 | Low | 53.8 | Low | 239 Ų | 239 | 136 Ų | 136 | 90% | 0.902 | 76% | 0.764 | S | S | * | * | trans | -53.3 | 108.7 | 174.2 | -70.2 | -174.6 | 178.6 | -156.5 | 0.6 | 107.8 | P24 K28 | P24-R26 PolarHBondContact O-N 2.79Å; P24-R26 VanDerWaalsContact O-N 3.11Å; R26-K28 PolarHBondContact O-N 2.93Å | ||
| 27 | Q | 61.6 | Low | 55 | Low | 192 Ų | 192 | 132.1 Ų | 132.1 | 90% | 0.897 | 76% | 0.762 | S | S | * | * | trans | -56.5 | 114.2 | 166.9 | -78.3 | 176.3 | -21.6 | 0 | 0 | 106.7 | A25 A29 | A25-Q27 PolarHBondContact O-N 3.16Å; Q27-A29 PolarHBondContact O-N 3.16Å | ||
| 28 | K | 63.9 | Low | 56.4 | Low | 195 Ų | 195 | 130.9 Ų | 130.9 | 85% | 0.848 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 118.1 | 173.5 | -69.3 | -177.5 | 178.3 | -177.4 | 0 | 106.6 | R26 K30 | R26-K28 PolarHBondContact O-N 2.93Å; K28-K30 PolarHBondContact O-N 3.07Å |
| 29 | A | 64.1 | Low | 57.3 | Low | 86 Ų | 86 | 134 Ų | 134 | 71% | 0.711 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 133.7 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | Q27 | Q27-A29 PolarHBondContact O-N 3.16Š|
| 30 | K | 73.3 | Confident | 58 | Low | 162 Ų | 162 | 132.8 Ų | 132.8 | 70% | 0.704 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -87.9 | 154.2 | 174.5 | -68.1 | -176.2 | 178.5 | -177.6 | 0 | 108.9 | K28 D32 D33 | K28-K30 PolarHBondContact O-N 3.07Å; K30-D32 PolarHBondContact O-N 3.02Å; K30-D32 VanDerWaalsContact O-N 3.08Å; K30-D33 VanDerWaalsContact O-CB 3.31Å; K30-D33 WeakPolarHBondContact O-CB 3.28Å; K30-D33 PolarHBondContact O-N 3.31Å |
| 31 | M | 57.9 | Low | 58.8 | Low | 166 Ų | 166 | 134.7 Ų | 134.7 | 82% | 0.818 | 76% | 0.763 | S | S | * | * | G | 310 helix | trans | -55.7 | -28.4 | -177.9 | -85 | 179 | 76.9 | 0 | 0 | 113.5 | D33 I34 | M31-D33 PolarHBondContact O-N 3.26Å; M31-I34 PolarHBondContact O-N 2.82Å |
| 32 | D | 63.1 | Low | 59.3 | Low | 156 Ų | 156 | 137.6 Ų | 137.6 | 83% | 0.834 | 77% | 0.768 | S | S | * | * | G | 310 helix | trans | -73.1 | -9.4 | 179.2 | -54.4 | -49.4 | 0 | 0 | 0 | 114 | K30 I34 | K30-D32 PolarHBondContact O-N 3.02Å; K30-D32 VanDerWaalsContact O-N 3.08Å; D32-I34 VanDerWaalsContact C-N 3.31Å |
| 33 | D | 63.7 | Low | 59.6 | Low | 126 Ų | 126 | 135.2 Ų | 135.2 | 67% | 0.674 | 75% | 0.754 | S | S | * | * | G | 310 helix | trans | -89.7 | 1.6 | 177.3 | -146.5 | 16.4 | 0 | 0 | 0 | 112.1 | K30 M31 V35 | K30-D33 VanDerWaalsContact O-CB 3.31Å; K30-D33 WeakPolarHBondContact O-CB 3.28Å; K30-D33 PolarHBondContact O-N 3.31Å; M31-D33 PolarHBondContact O-N 3.26Å; D33-V35 PolarHBondContact O-N 2.84Å |
| 34 | I | 65.5 | Low | 60.1 | Low | 117 Ų | 117 | 138.8 Ų | 138.8 | 60% | 0.6 | 76% | 0.764 | S | S | * | * | trans | -87.3 | 96.4 | 176.2 | -55.7 | 174.9 | 0 | 0 | 0 | 108.9 | M31 D32 V36 | M31-I34 PolarHBondContact O-N 2.82Å; D32-I34 VanDerWaalsContact C-N 3.31Å; I34-V36 HydrophobicContact CG2-CG2 4.32Å; I34-V36 PolarHBondContact O-N 3.14Å | ||
| 35 | V | 64.1 | Low | 60.3 | Low | 123 Ų | 123 | 142.6 Ų | 142.6 | 75% | 0.745 | 76% | 0.762 | S | S | * | * | trans | -76.2 | 106.5 | 165.9 | -178.3 | 0 | 0 | 0 | 0 | 108.4 | D33 V37 | D33-V35 PolarHBondContact O-N 2.84Å; V35-V37 HydrophobicContact CG1-CG2 3.96Å; V35-V37 PolarHBondContact O-N 3.06Å | ||
| 36 | V | 66.9 | Low | 60.6 | Low | 112 Ų | 112 | 143.1 Ų | 143.1 | 68% | 0.679 | 75% | 0.752 | S | S | * | * | trans | -72.2 | 93.2 | 170.7 | -178.4 | 0 | 0 | 0 | 0 | 108.3 | I34 A38 | I34-V36 HydrophobicContact CG2-CG2 4.32Å; I34-V36 PolarHBondContact O-N 3.14Å; V36-A38 PolarHBondContact O-N 3.35Å; V36-A38 VanDerWaalsContact O-N 3.14Å | ||
| 37 | V | 61.7 | Low | 61.2 | Low | 126 Ų | 126 | 137.9 Ų | 137.9 | 76% | 0.764 | 74% | 0.741 | S | S | * | * | trans | -76.9 | 99.6 | 171.9 | -178 | 0 | 0 | 0 | 0 | 108 | V35 | V35-V37 HydrophobicContact CG1-CG2 3.96Å; V35-V37 PolarHBondContact O-N 3.06Å | ||
| 38 | A | 64.3 | Low | 61.4 | Low | 80 Ų | 80 | 134.1 Ų | 134.1 | 66% | 0.661 | 72% | 0.722 | S | S | * | * | trans | 52.4 | 125.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | V36 G40 | V36-A38 PolarHBondContact O-N 3.35Å; V36-A38 VanDerWaalsContact O-N 3.14Å; A38-G40 PolarHBondContact O-N 3.32Å | ||
| 39 | Q | 56.1 | Low | 61.8 | Low | 185 Ų | 185 | 130.3 Ų | 130.3 | 86% | 0.864 | 71% | 0.711 | S | S | * | * | trans | -57.4 | 106.7 | 164.3 | -72.9 | 178.3 | -12.5 | 0 | 0 | 108.1 | T41 | Q39-T41 PolarHBondContact O-N 3.38Š| ||
| 40 | G | 56 | Low | 62.6 | Low | 63 Ų | 63 | 129.3 Ų | 129.3 | 65% | 0.649 | 69% | 0.694 | S | S | * | * | trans | -55.9 | 125.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | A38 Q42 | A38-G40 PolarHBondContact O-N 3.32Å; G40-Q42 VanDerWaalsContact C-N 3.33Å; G40-Q42 PolarHBondContact O-N 3.11Å | ||
| 41 | T | 57.8 | Low | 63.1 | Low | 134 Ų | 134 | 125.5 Ų | 125.5 | 82% | 0.822 | 69% | 0.686 | S | S | * | * | trans | -56.5 | 99.2 | 174.6 | 41.6 | 0 | 0 | 0 | 0 | 108.3 | Q39 S43 | Q39-T41 PolarHBondContact O-N 3.38Å; T41-S43 PolarHBondContact O-N 3.05Å | ||
| 42 | Q | 54.9 | Low | 64.2 | Low | 189 Ų | 189 | 122.2 Ų | 122.2 | 88% | 0.883 | 67% | 0.672 | S | S | * | * | trans | -70.4 | 66.2 | 164.9 | -66.4 | -172.8 | 37.3 | 0 | 0 | 107.7 | G40 L44 | G40-Q42 VanDerWaalsContact C-N 3.33Å; G40-Q42 PolarHBondContact O-N 3.11Å; Q42-L44 PolarHBondContact O-N 3.1Å | ||
| 43 | S | 53.9 | Low | 65.1 | Low | 65 Ų | 65 | 116.9 Ų | 116.9 | 46% | 0.455 | 65% | 0.645 | S | S | . | * | trans | -65.6 | 125.9 | 152.8 | 66.5 | 0 | 0 | 0 | 0 | 104.8 | T41 R45 | T41-S43 PolarHBondContact O-N 3.05Å; S43-R45 PolarHBondContact O-N 2.99Å; S43-R45 WeakPolarHBondContact OG-CG 3.45Å; S43-R45 PolarHBondContact OG-NE 3.13Å | ||
| 44 | L | 53.8 | Low | 66.2 | Low | 183 Ų | 183 | 114 Ų | 114 | 96% | 0.958 | 63% | 0.629 | S | S | * | * | trans | -55.6 | 69.5 | 168.4 | -69.8 | 111.9 | 0 | 0 | 0 | 110.5 | Q42 N46 | Q42-L44 PolarHBondContact O-N 3.1Å; L44-N46 PolarHBondContact O-N 3.41Å | ||
| 45 | R | 57.4 | Low | 67.1 | Low | 203 Ų | 203 | 114.4 Ų | 114.4 | 77% | 0.766 | 63% | 0.626 | S | S | * | * | trans | -76.5 | 110.8 | 166.7 | -69.6 | -174.2 | -174.1 | -163.4 | -1 | 103.9 | S43 I47 | S43-R45 PolarHBondContact O-N 2.99Å; S43-R45 WeakPolarHBondContact OG-CG 3.45Å; S43-R45 PolarHBondContact OG-NE 3.13Å; R45-I47 PolarHBondContact O-N 3.26Å | ||
| 46 | N | 60.3 | Low | 67.9 | Low | 104 Ų | 104 | 114.2 Ų | 114.2 | 56% | 0.556 | 62% | 0.62 | S | S | * | * | trans | -45.8 | 107.4 | 166.4 | -171.9 | -21.8 | 0 | 0 | 0 | 106.9 | L44 H48 N49 | L44-N46 PolarHBondContact O-N 3.41Å; N46-H48 PolarHBondContact O-N 3.48Å; N46-H48 WeakPolarHBondContact OD1-CB 3.42Å; N46-H48 PolarHBondContact OD1-N 3.34Å; N46-N49 PolarHBondContact O-N 3.33Å | ||
| 47 | I | 64.8 | Low | 68.5 | Low | 129 Ų | 129 | 114.8 Ų | 114.8 | 66% | 0.662 | 62% | 0.615 | S | S | * | * | G | 310 helix | trans | -56.4 | -24.7 | -170.5 | -65.2 | 165 | 0 | 0 | 0 | 110.5 | R45 N49 D50 V53 | R45-I47 PolarHBondContact O-N 3.26Å; I47-N49 PolarHBondContact O-N 3.29Å; I47-D50 WeakPolarHBondContact O-CB 3.34Å; I47-D50 PolarHBondContact O-N 3.37Å; I47-V53 HydrophobicContact CG2-CG2 4.3Å |
| 48 | H | 65.7 | Low | 69.5 | Low | 112 Ų | 112 | 115.9 Ų | 115.9 | 52% | 0.519 | 61% | 0.612 | S | S | . | * | G | 310 helix | trans | -67 | -18.1 | 175.8 | -155.4 | -64.5 | 0 | 0 | 0 | 114.4 | N46 | N46-H48 PolarHBondContact O-N 3.48Å; N46-H48 WeakPolarHBondContact OD1-CB 3.42Å; N46-H48 PolarHBondContact OD1-N 3.34Å |
| 49 | N | 72.6 | Confident | 70.4 | Confident | 115 Ų | 115 | 116.6 Ų | 116.6 | 62% | 0.615 | 60% | 0.604 | S | S | * | * | G | 310 helix | trans | -101.7 | 5.2 | 178.4 | -67.6 | -22.2 | 0 | 0 | 0 | 112.6 | N46 I47 | N46-N49 PolarHBondContact O-N 3.33Å; I47-N49 PolarHBondContact O-N 3.29Å |
| 50 | D | 81.6 | Confident | 71.4 | Confident | 66 Ų | 66 | 112.1 Ų | 112.1 | 35% | 0.353 | 59% | 0.591 | S | S | . | * | trans | -70 | 123 | 174.3 | -170.4 | -41.9 | 0 | 0 | 0 | 109.3 | I47 D52 V53 I54 | I47-D50 WeakPolarHBondContact O-CB 3.34Å; I47-D50 PolarHBondContact O-N 3.37Å; D50-D52 PolarHBondContact O-N 3.35Å; D50-D52 VanDerWaalsContact O-N 3.16Å; D50-D52 PolarHBondContact OD1-N 3.1Å; D50-V53 HydrophobicContact CB-CB 4.06Å; D50-V53 HydrophobicContact CB-CG2 3.76Å; D50-V53 PolarHBondContact O-N 2.97Å; D50-I54 WeakPolarHBondContact O-CG1 3.5Å; D50-I54 PolarHBondContact O-N 3.08Å | ||
| 51 | P | 83.1 | Confident | 72.2 | Confident | 81 Ų | 81 | 115.7 Ų | 115.7 | 53% | 0.526 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -57.7 | -29.1 | -177.9 | 23.1 | -34 | 0 | 0 | 0 | 113.4 | K55 | P51-K55 VanDerWaalsContact O-CG 3.28Å; P51-K55 WeakPolarHBondContact O-CG 3.49Å; P51-K55 PolarHBondContact O-N 3.39Å; P51-K55 VanDerWaalsContact O-N 3.16Å |
| 52 | D | 80.2 | Confident | 72.7 | Confident | 98 Ų | 98 | 118 Ų | 118 | 52% | 0.524 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -79.2 | -32 | 179.2 | -66.5 | -24.6 | 0 | 0 | 0 | 111.5 | D50 K55 L56 | D50-D52 PolarHBondContact O-N 3.35Å; D50-D52 VanDerWaalsContact O-N 3.16Å; D50-D52 PolarHBondContact OD1-N 3.1Å; D52-K55 IonicContact OD1-NZ 3.84Å; D52-L56 WeakPolarHBondContact O-CB 3.49Å; D52-L56 WeakPolarHBondContact O-CD1 3.25Å; D52-L56 VanDerWaalsContact O-CG 3.25Å; D52-L56 WeakPolarHBondContact O-CG 3.47Å; D52-L56 PolarHBondContact O-N 3.15Å |
| 53 | V | 83.2 | Confident | 73.3 | Confident | 43 Ų | 43 | 115.7 Ų | 115.7 | 26% | 0.261 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -69.2 | -38.9 | 173.4 | 178.1 | 0 | 0 | 0 | 0 | 111.2 | I47 D50 L56 Q57 | I47-V53 HydrophobicContact CG2-CG2 4.3Å; D50-V53 HydrophobicContact CB-CB 4.06Å; D50-V53 HydrophobicContact CB-CG2 3.76Å; D50-V53 PolarHBondContact O-N 2.97Å; V53-L56 PolarHBondContact O-N 3Å; V53-Q57 PolarHBondContact O-N 2.76Å; V53-Q57 VanDerWaalsContact O-N 3.1Å |
| 54 | I | 85.8 | Confident | 73.7 | Confident | 67 Ų | 67 | 115.3 Ų | 115.3 | 34% | 0.344 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -63.7 | -47.4 | 175.5 | -65.9 | 167.3 | 0 | 0 | 0 | 110.4 | D50 L56 Q57 E58 | D50-I54 WeakPolarHBondContact O-CG1 3.5Å; D50-I54 PolarHBondContact O-N 3.08Å; I54-L56 VanDerWaalsContact C-N 3.27Å; I54-L56 PolarHBondContact O-N 3.31Å; I54-Q57 WeakPolarHBondContact O-CB 3.38Å; I54-Q57 PolarHBondContact O-N 3.33Å; I54-E58 PolarHBondContact O-N 3.25Å; I54-E58 VanDerWaalsContact O-N 3.11Å |
| 55 | K | 84.4 | Confident | 74.1 | Confident | 125 Ų | 125 | 115.5 Ų | 115.5 | 54% | 0.543 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -60.2 | -36.2 | 176.2 | -73.8 | 171.2 | -171.7 | 167.3 | 0 | 112.9 | P51 D52 Q57 E58 I59 | P51-K55 VanDerWaalsContact O-CG 3.28Å; P51-K55 WeakPolarHBondContact O-CG 3.49Å; P51-K55 PolarHBondContact O-N 3.39Å; P51-K55 VanDerWaalsContact O-N 3.16Å; D52-K55 IonicContact OD1-NZ 3.84Å; K55-Q57 VanDerWaalsContact C-N 3.33Å; K55-E58 PolarHBondContact O-N 3.24Å; K55-I59 WeakPolarHBondContact O-CG1 3.32Å |
| 56 | L | 81.6 | Confident | 74.2 | Confident | 118 Ų | 118 | 111 Ų | 111 | 62% | 0.618 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -66.7 | -33.8 | 175.3 | -76.2 | 165.8 | 0 | 0 | 0 | 112.4 | D52 V53 I54 I59 | D52-L56 WeakPolarHBondContact O-CB 3.49Å; D52-L56 WeakPolarHBondContact O-CD1 3.25Å; D52-L56 VanDerWaalsContact O-CG 3.25Å; D52-L56 WeakPolarHBondContact O-CG 3.47Å; D52-L56 PolarHBondContact O-N 3.15Å; V53-L56 PolarHBondContact O-N 3Å; I54-L56 VanDerWaalsContact C-N 3.27Å; I54-L56 PolarHBondContact O-N 3.31Å; L56-I59 HydrophobicContact CD2-CD1 3.97Å; L56-I59 PolarHBondContact O-N 3.01Å |
| 57 | Q | 79.3 | Confident | 74.3 | Confident | 124 Ų | 124 | 110.4 Ų | 110.4 | 58% | 0.579 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -72.9 | -27.6 | 175.1 | -74.9 | -177.1 | 3.1 | 0 | 0 | 113.3 | V53 I54 K55 I59 | V53-Q57 PolarHBondContact O-N 2.76Å; V53-Q57 VanDerWaalsContact O-N 3.1Å; I54-Q57 WeakPolarHBondContact O-CB 3.38Å; I54-Q57 PolarHBondContact O-N 3.33Å; K55-Q57 VanDerWaalsContact C-N 3.33Å; Q57-I59 PolarHBondContact O-N 2.91Å |
| 58 | E | 83.9 | Confident | 74 | Confident | 149 Ų | 149 | 107.3 Ų | 107.3 | 70% | 0.696 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.4 | -13.3 | 176 | -70.2 | 179.1 | 169.9 | 0 | 0 | 113.2 | I54 K55 P60 | I54-E58 PolarHBondContact O-N 3.25Å; I54-E58 VanDerWaalsContact O-N 3.11Å; K55-E58 PolarHBondContact O-N 3.24Å; E58-P60 WeakPolarHBondContact O-CD 3.34Å |
| 59 | I | 82.2 | Confident | 73.4 | Confident | 96 Ų | 96 | 106.7 Ų | 106.7 | 49% | 0.492 | 57% | 0.573 | S | S | . | * | S | Bend | trans | -66.9 | 120.8 | 177.5 | -58.4 | 178 | 0 | 0 | 0 | 109 | K55 L56 Q57 T61 | K55-I59 WeakPolarHBondContact O-CG1 3.32Å; L56-I59 HydrophobicContact CD2-CD1 3.97Å; L56-I59 PolarHBondContact O-N 3.01Å; Q57-I59 PolarHBondContact O-N 2.91Å; I59-T61 PolarHBondContact O-N 3.14Å; I59-T61 VanDerWaalsContact O-N 3.13Å |
| 60 | P | 76.3 | Confident | 72.5 | Confident | 90 Ų | 90 | 107.7 Ų | 107.7 | 58% | 0.584 | 58% | 0.577 | S | S | * | * | P | Polyproline II helix | trans | -57 | 121.8 | 175.9 | -21.9 | 32.1 | 0 | 0 | 0 | 110.1 | E58 F62 | E58-P60 WeakPolarHBondContact O-CD 3.34Å; P60-F62 HydrophobicContact CB-CE2 4.39Å; P60-F62 HydrophobicContact CB-CZ 4.3Å; P60-F62 WeakPolarHBondContact O-CD2 3.31Å; P60-F62 WeakPolarHBondContact O-CE2 3.44Å; P60-F62 PolarHBondContact O-N 3.25Å |
| 61 | T | 74.2 | Confident | 71.2 | Confident | 139 Ų | 139 | 110.7 Ų | 110.7 | 85% | 0.853 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 117.9 | 176.4 | 54.2 | 0 | 0 | 0 | 0 | 108.9 | I59 | I59-T61 PolarHBondContact O-N 3.14Å; I59-T61 VanDerWaalsContact O-N 3.13Å |
| 62 | F | 68.6 | Low | 69.7 | Low | 181 Ų | 181 | 110.2 Ų | 110.2 | 79% | 0.794 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 131.5 | 173.7 | -61.5 | -82.7 | 0 | 0 | 0 | 108.9 | P60 | P60-F62 HydrophobicContact CB-CE2 4.39Å; P60-F62 HydrophobicContact CB-CZ 4.3Å; P60-F62 WeakPolarHBondContact O-CD2 3.31Å; P60-F62 WeakPolarHBondContact O-CE2 3.44Å; P60-F62 PolarHBondContact O-N 3.25Å |
| 63 | Q | 65.6 | Low | 68.3 | Low | 141 Ų | 141 | 113.7 Ų | 113.7 | 66% | 0.659 | 63% | 0.626 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 134.4 | 169.7 | -69.6 | -172.4 | -14 | 0 | 0 | 108.4 | L65 | Q63-L65 PolarHBondContact O-N 2.96Š|
| 64 | P | 63.5 | Low | 66.5 | Low | 58 Ų | 58 | 118.9 Ų | 118.9 | 38% | 0.377 | 66% | 0.658 | S | S | . | * | P | Polyproline II helix | trans | -56.6 | 135.5 | 174.1 | 25.9 | -35.7 | 0 | 0 | 0 | 109 | L66 L70 | P64-L66 PolarHBondContact O-N 2.82Å; P64-L66 VanDerWaalsContact O-N 3.15Å; P64-L70 HydrophobicContact CB-CD1 3.82Å; P64-L70 HydrophobicContact CG-CD1 3.87Å |
| 65 | L | 62.7 | Low | 64.7 | Low | 186 Ų | 186 | 119.2 Ų | 119.2 | 97% | 0.974 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -54.7 | -34.2 | 177.2 | -66.3 | 169.6 | 0 | 0 | 0 | 111.1 | Q63 | Q63-L65 PolarHBondContact O-N 2.96Š|
| 66 | L | 59.6 | Low | 63 | Low | 110 Ų | 110 | 119.2 Ų | 119.2 | 58% | 0.576 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -102.3 | 91.3 | 172.9 | -68.7 | 158.8 | 0 | 0 | 0 | 109.6 | P64 G68 V69 L81 | P64-L66 PolarHBondContact O-N 2.82Å; P64-L66 VanDerWaalsContact O-N 3.15Å; L66-G68 PolarHBondContact O-N 3.11Å; L66-V69 HydrophobicContact CB-CG2 3.94Å; L66-L81 HydrophobicContact CD2-CD2 4.05Å |
| 67 | K | 60.8 | Low | 61.4 | Low | 90 Ų | 90 | 116.8 Ų | 116.8 | 39% | 0.391 | 67% | 0.672 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -66.2 | 121.1 | 171.8 | -63.1 | 179.6 | 179.5 | -177.9 | 0 | 108.5 | V79 | K67-V79 HydrophobicContact CB-CB 4.31Å; K67-V79 HydrophobicContact CB-CG1 4.09Å; K67-V79 HydrophobicContact CB-CG2 4.15Å; K67-V79 HydrophobicContact CD-CG1 4.38Å; K67-V79 HydrophobicContact CD-CG2 3.94Å |
| 68 | G | 58.3 | Low | 59.9 | Low | 64 Ų | 64 | 117.8 Ų | 117.8 | 66% | 0.66 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 114.6 | -4.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | L66 | L66-G68 PolarHBondContact O-N 3.11Š|
| 69 | V | 55 | Low | 58.3 | Low | 100 Ų | 100 | 113.9 Ų | 113.9 | 61% | 0.606 | 67% | 0.673 | S | S | * | * | trans | -94.4 | -16.6 | 178 | -169.3 | 0 | 0 | 0 | 0 | 112.5 | L66 S71 | L66-V69 HydrophobicContact CB-CG2 3.94Å; V69-S71 PolarHBondContact O-N 3.25Å | ||
| 70 | L | 53.8 | Low | 56.9 | Low | 136 Ų | 136 | 114.6 Ų | 114.6 | 71% | 0.712 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -88.5 | 96.5 | 175.6 | -78.4 | 158.8 | 0 | 0 | 0 | 109.8 | P64 G72 | P64-L70 HydrophobicContact CB-CD1 3.82Å; P64-L70 HydrophobicContact CG-CD1 3.87Å; L70-G72 PolarHBondContact O-N 3.3Å |
| 71 | S | 52.3 | Low | 56 | Low | 128 Ų | 128 | 114.6 Ų | 114.6 | 90% | 0.895 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.1 | 116.8 | 175.2 | -53.1 | 0 | 0 | 0 | 0 | 111.6 | V69 | V69-S71 PolarHBondContact O-N 3.25Š|
| 72 | G | 53.2 | Low | 55.5 | Low | 72 Ų | 72 | 117.1 Ų | 117.1 | 74% | 0.742 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 157.7 | -16.4 | 167.2 | 0 | 0 | 0 | 0 | 0 | 117.5 | L70 | L70-G72 PolarHBondContact O-N 3.3Š|
| 73 | Q | 49.5 | Very low | 55.6 | Low | 171 Ų | 171 | 119.3 Ų | 119.3 | 80% | 0.799 | 69% | 0.685 | S | S | * | * | trans | -102.2 | 112.2 | 176.6 | -65.8 | -162 | 2 | 0 | 0 | 111.2 | S75 | Q73-S75 PolarHBondContact O-N 2.76Å; Q73-S75 VanDerWaalsContact O-N 3.1Å | ||
| 74 | T | 46.2 | Very low | 56 | Low | 152 Ų | 152 | 119.5 Ų | 119.5 | 93% | 0.933 | 69% | 0.69 | S | S | * | * | trans | -77.8 | 26.8 | 179.1 | 51.1 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 75 | S | 48.8 | Very low | 57.1 | Low | 74 Ų | 74 | 120.3 Ų | 120.3 | 52% | 0.517 | 69% | 0.691 | S | S | . | * | S | Bend | trans | -95.2 | 132.2 | 168.3 | 65.6 | 0 | 0 | 0 | 0 | 108.5 | Q73 S77 | Q73-S75 PolarHBondContact O-N 2.76Å; Q73-S75 VanDerWaalsContact O-N 3.1Å; S75-S77 PolarHBondContact O-N 3.15Å |
| 76 | P | 47 | Very low | 58.4 | Low | 124 Ų | 124 | 116.2 Ų | 116.2 | 81% | 0.805 | 68% | 0.676 | S | S | * | * | trans | -66.1 | 91.7 | 173.2 | 26.3 | -30.2 | 0 | 0 | 0 | 107.3 | T78 | P76-T78 PolarHBondContact O-N 3.13Š| ||
| 77 | S | 47.8 | Very low | 60.1 | Low | 67 Ų | 67 | 113.9 Ų | 113.9 | 47% | 0.469 | 67% | 0.672 | S | S | . | * | trans | -64.4 | 108.3 | 172.8 | 61.1 | 0 | 0 | 0 | 0 | 106.9 | S75 V79 | S75-S77 PolarHBondContact O-N 3.15Å; S77-V79 PolarHBondContact O-N 3.23Å | ||
| 78 | T | 49.4 | Very low | 61.6 | Low | 146 Ų | 146 | 115.9 Ų | 115.9 | 90% | 0.896 | 68% | 0.683 | S | S | * | * | trans | -67.3 | 34.3 | 167.5 | 39.6 | 0 | 0 | 0 | 0 | 111.8 | P76 C80 | P76-T78 PolarHBondContact O-N 3.13Å; T78-C80 PolarHBondContact O-N 3.08Å | ||
| 79 | V | 49.5 | Very low | 63.3 | Low | 66 Ų | 66 | 116 Ų | 116 | 40% | 0.4 | 67% | 0.671 | S | S | . | * | trans | -88.9 | 93 | 172.9 | -172.9 | 0 | 0 | 0 | 0 | 106 | K67 S77 L81 | K67-V79 HydrophobicContact CB-CB 4.31Å; K67-V79 HydrophobicContact CB-CG1 4.09Å; K67-V79 HydrophobicContact CB-CG2 4.15Å; K67-V79 HydrophobicContact CD-CG1 4.38Å; K67-V79 HydrophobicContact CD-CG2 3.94Å; S77-V79 PolarHBondContact O-N 3.23Å; V79-L81 PolarHBondContact O-N 3Å | ||
| 80 | C | 53.7 | Low | 65.3 | Low | 111 Ų | 111 | 116.4 Ų | 116.4 | 75% | 0.75 | 67% | 0.669 | S | S | * | * | trans | -56.6 | 105 | 161.6 | -169.6 | 0 | 0 | 0 | 0 | 106.4 | T78 E82 | T78-C80 PolarHBondContact O-N 3.08Å; C80-E82 PolarHBondContact O-N 3.13Å; C80-E82 VanDerWaalsContact O-N 3.14Å | ||
| 81 | L | 56.6 | Low | 67.3 | Low | 90 Ų | 90 | 116.1 Ų | 116.1 | 47% | 0.471 | 66% | 0.664 | S | S | . | * | trans | -55.5 | 122.1 | 162.9 | -75.6 | 168.5 | 0 | 0 | 0 | 105.6 | L66 V79 R83 | L66-L81 HydrophobicContact CD2-CD2 4.05Å; V79-L81 PolarHBondContact O-N 3Å; L81-R83 VanDerWaalsContact C-N 3.31Å; L81-R83 PolarHBondContact O-N 3.18Å | ||
| 82 | E | 64.2 | Low | 69.5 | Low | 192 Ų | 192 | 115.6 Ų | 115.6 | 90% | 0.897 | 65% | 0.65 | S | S | * | * | trans | -56.5 | 99.6 | 179.6 | -151.9 | 171.7 | -156.7 | 0 | 0 | 107 | C80 L84 | C80-E82 PolarHBondContact O-N 3.13Å; C80-E82 VanDerWaalsContact O-N 3.14Å; E82-L84 PolarHBondContact O-N 3.07Å | ||
| 83 | R | 70.6 | Confident | 71.6 | Confident | 227 Ų | 227 | 115.5 Ų | 115.5 | 86% | 0.857 | 64% | 0.638 | S | S | * | * | trans | -67.2 | 128.1 | -177.5 | -81.3 | -176.1 | 144.5 | 158.1 | -4.4 | 106.2 | L81 D85 | L81-R83 VanDerWaalsContact C-N 3.31Å; L81-R83 PolarHBondContact O-N 3.18Å; R83-D85 PolarHBondContact O-N 2.87Å; R83-D85 VanDerWaalsContact O-N 3.13Å | ||
| 84 | L | 74.3 | Confident | 73.9 | Confident | 146 Ų | 146 | 111.2 Ų | 111.2 | 76% | 0.764 | 62% | 0.619 | S | S | * | * | trans | -51.2 | 124.4 | 168.3 | -70.6 | 170.4 | 0 | 0 | 0 | 108 | E82 P86 V89 | E82-L84 PolarHBondContact O-N 3.07Å; L84-P86 WeakPolarHBondContact O-CD 3.42Å; L84-P86 VanDerWaalsContact O-N 3.13Å; L84-V89 HydrophobicContact CB-CG2 4.21Å | ||
| 85 | D | 86.5 | Confident | 76.4 | Confident | 74 Ų | 74 | 112.7 Ų | 112.7 | 40% | 0.396 | 61% | 0.608 | S | S | . | * | trans | -61.4 | 112.4 | 177.5 | 176.9 | 4.5 | 0 | 0 | 0 | 108.8 | R83 A87 Q88 V89 | R83-D85 PolarHBondContact O-N 2.87Å; R83-D85 VanDerWaalsContact O-N 3.13Å; D85-A87 PolarHBondContact O-N 3.44Å; D85-A87 VanDerWaalsContact O-N 3.13Å; D85-A87 WeakPolarHBondContact OD1-CB 3.39Å; D85-A87 PolarHBondContact OD1-N 3.45Å; D85-Q88 HydrophobicContact CB-CB 4.22Å; D85-Q88 HydrophobicContact CB-CG 4.18Å; D85-Q88 PolarHBondContact O-N 2.93Å; D85-Q88 VanDerWaalsContact O-N 3.08Å; D85-Q88 WeakPolarHBondContact OD2-CG 3.15Å; D85-Q88 PolarHBondContact OD2-NE2 3.02Å; D85-V89 PolarHBondContact O-N 3.33Å | ||
| 86 | P | 90.3 | Very high | 78.8 | Confident | 101 Ų | 101 | 115.9 Ų | 115.9 | 66% | 0.656 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -58.4 | -28.9 | -177.4 | -23.7 | 34.9 | 0 | 0 | 0 | 112.6 | L84 L90 | L84-P86 WeakPolarHBondContact O-CD 3.42Å; L84-P86 VanDerWaalsContact O-N 3.13Å; P86-L90 WeakPolarHBondContact O-CB 3.45Å; P86-L90 PolarHBondContact O-N 3.29Å |
| 87 | A | 93.6 | Very high | 81.3 | Confident | 60 Ų | 60 | 116.3 Ų | 116.3 | 50% | 0.496 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -67.3 | -42.2 | 178 | 0 | 0 | 0 | 0 | 0 | 111.6 | D85 L90 Q91 | D85-A87 PolarHBondContact O-N 3.44Å; D85-A87 VanDerWaalsContact O-N 3.13Å; D85-A87 WeakPolarHBondContact OD1-CB 3.39Å; D85-A87 PolarHBondContact OD1-N 3.45Å; A87-L90 PolarHBondContact O-N 2.98Å; A87-Q91 WeakPolarHBondContact O-CB 3.46Å; A87-Q91 PolarHBondContact O-N 3.41Å |
| 88 | Q | 93.1 | Very high | 83.7 | Confident | 133 Ų | 133 | 117 Ų | 117 | 62% | 0.621 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -68.2 | -38.7 | 177.7 | -73.3 | -179 | 60.1 | 0 | 0 | 112.2 | D85 Q91 L92 | D85-Q88 HydrophobicContact CB-CB 4.22Å; D85-Q88 HydrophobicContact CB-CG 4.18Å; D85-Q88 PolarHBondContact O-N 2.93Å; D85-Q88 VanDerWaalsContact O-N 3.08Å; D85-Q88 WeakPolarHBondContact OD2-CG 3.15Å; D85-Q88 PolarHBondContact OD2-NE2 3.02Å; Q88-Q91 PolarHBondContact O-N 3.46Å; Q88-L92 PolarHBondContact O-N 2.96Å |
| 89 | V | 94.6 | Very high | 86 | Confident | 66 Ų | 66 | 115 Ų | 115 | 40% | 0.4 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -64.5 | -43.5 | 175.1 | 178.4 | 0 | 0 | 0 | 0 | 110.7 | L84 D85 Q91 L92 C93 | L84-V89 HydrophobicContact CB-CG2 4.21Å; D85-V89 PolarHBondContact O-N 3.33Å; V89-Q91 VanDerWaalsContact C-N 3.34Å; V89-Q91 PolarHBondContact O-N 3.35Å; V89-L92 WeakPolarHBondContact O-CB 3.38Å; V89-L92 PolarHBondContact O-N 2.98Å; V89-C93 PolarHBondContact O-N 2.9Å; V89-C93 PolarHBondContact O-SG 3.14Å; V89-C93 VanDerWaalsContact O-SG 3.34Å |
| 90 | L | 96.3 | Very high | 88.4 | Confident | 109 Ų | 109 | 115.9 Ų | 115.9 | 57% | 0.571 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -60.5 | -44.3 | 175.3 | 178.2 | 61.9 | 0 | 0 | 0 | 111.5 | P86 A87 L92 C93 I94 | P86-L90 WeakPolarHBondContact O-CB 3.45Å; P86-L90 PolarHBondContact O-N 3.29Å; A87-L90 PolarHBondContact O-N 2.98Å; L90-L92 VanDerWaalsContact C-N 3.3Å; L90-L92 PolarHBondContact O-N 3.4Å; L90-C93 WeakPolarHBondContact O-CB 3.41Å; L90-C93 PolarHBondContact O-N 3.29Å; L90-C93 VanDerWaalsContact O-N 3.14Å; L90-I94 HydrophobicContact CD1-CD1 4.25Å; L90-I94 HydrophobicContact CD1-CG1 4.4Å; L90-I94 HydrophobicContact CG-CD1 4Å; L90-I94 WeakPolarHBondContact O-CG1 3.45Å; L90-I94 PolarHBondContact O-N 3.19Å |
| 91 | Q | 96.9 | Very high | 90.5 | Very high | 129 Ų | 129 | 115.9 Ų | 115.9 | 60% | 0.603 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -64.2 | -35.6 | 179.2 | -170.9 | 162.6 | -6.3 | 0 | 0 | 112.4 | A87 Q88 V89 R95 | A87-Q91 WeakPolarHBondContact O-CB 3.46Å; A87-Q91 PolarHBondContact O-N 3.41Å; Q88-Q91 PolarHBondContact O-N 3.46Å; V89-Q91 VanDerWaalsContact C-N 3.34Å; V89-Q91 PolarHBondContact O-N 3.35Å; Q91-R95 WeakPolarHBondContact O-CG 3.42Å; Q91-R95 PolarHBondContact O-N 3.3Å |
| 92 | L | 97.1 | Very high | 92.5 | Very high | 118 Ų | 118 | 117.2 Ų | 117.2 | 62% | 0.618 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -62.2 | -46.5 | 170.9 | 179.1 | 64.1 | 0 | 0 | 0 | 111.4 | Q88 V89 L90 I94 R95 Y96 | Q88-L92 PolarHBondContact O-N 2.96Å; V89-L92 WeakPolarHBondContact O-CB 3.38Å; V89-L92 PolarHBondContact O-N 2.98Å; L90-L92 VanDerWaalsContact C-N 3.3Å; L90-L92 PolarHBondContact O-N 3.4Å; L92-I94 VanDerWaalsContact C-N 3.34Å; L92-I94 PolarHBondContact O-N 3.34Å; L92-R95 PolarHBondContact O-N 3.31Å; L92-Y96 WeakPolarHBondContact O-CB 3.45Å; L92-Y96 PolarHBondContact O-N 2.95Å |
| 93 | C | 98.2 | Very high | 94.1 | Very high | 70 Ų | 70 | 110.7 Ų | 110.7 | 47% | 0.473 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -59.7 | -43.7 | 177.8 | -68.8 | 0 | 0 | 0 | 0 | 112.1 | V89 L90 Y96 Q97 | V89-C93 PolarHBondContact O-N 2.9Å; V89-C93 PolarHBondContact O-SG 3.14Å; V89-C93 VanDerWaalsContact O-SG 3.34Å; L90-C93 WeakPolarHBondContact O-CB 3.41Å; L90-C93 PolarHBondContact O-N 3.29Å; L90-C93 VanDerWaalsContact O-N 3.14Å; C93-Y96 PolarHBondContact O-N 3.08Å; C93-Q97 WeakPolarHBondContact O-CB 3.49Å; C93-Q97 PolarHBondContact O-N 3.43Å |
| 94 | I | 98.3 | Very high | 95.5 | Very high | 81 Ų | 81 | 102.7 Ų | 102.7 | 42% | 0.415 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.2 | -48.5 | 178 | -67.5 | 167.6 | 0 | 0 | 0 | 110.4 | L90 L92 Y96 Q97 D98 | L90-I94 HydrophobicContact CD1-CD1 4.25Å; L90-I94 HydrophobicContact CD1-CG1 4.4Å; L90-I94 HydrophobicContact CG-CD1 4Å; L90-I94 WeakPolarHBondContact O-CG1 3.45Å; L90-I94 PolarHBondContact O-N 3.19Å; L92-I94 VanDerWaalsContact C-N 3.34Å; L92-I94 PolarHBondContact O-N 3.34Å; I94-Y96 VanDerWaalsContact C-N 3.26Å; I94-Y96 PolarHBondContact O-N 3.06Å; I94-Q97 WeakPolarHBondContact O-CB 3.4Å; I94-Q97 PolarHBondContact O-N 3.35Å; I94-D98 PolarHBondContact O-N 2.87Å |
| 95 | R | 98.5 | Very high | 96.6 | Very high | 182 Ų | 182 | 101 Ų | 101 | 69% | 0.687 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -59.2 | -39 | 176.8 | -79.8 | -170.9 | 56.1 | 151 | 0.2 | 112.9 | Q91 L92 H99 | Q91-R95 WeakPolarHBondContact O-CG 3.42Å; Q91-R95 PolarHBondContact O-N 3.3Å; L92-R95 PolarHBondContact O-N 3.31Å; R95-H99 WeakPolarHBondContact O-CB 3.35Å; R95-H99 PolarHBondContact O-N 3.28Å; R95-H99 VanDerWaalsContact O-N 3.08Å |
| 96 | Y | 98.5 | Very high | 97.2 | Very high | 142 Ų | 142 | 100 Ų | 100 | 56% | 0.557 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -69.8 | -40.9 | 178.7 | -174.3 | -116 | 0 | 0 | 0 | 111.5 | L92 C93 I94 H99 L100 | L92-Y96 WeakPolarHBondContact O-CB 3.45Å; L92-Y96 PolarHBondContact O-N 2.95Å; C93-Y96 PolarHBondContact O-N 3.08Å; I94-Y96 VanDerWaalsContact C-N 3.26Å; I94-Y96 PolarHBondContact O-N 3.06Å; Y96-H99 PolarHBondContact O-N 2.94Å; Y96-L100 HydrophobicContact CD1-CD1 3.87Å; Y96-L100 HydrophobicContact CD1-CG 4.35Å; Y96-L100 HydrophobicContact CE1-CD1 3.38Å; Y96-L100 HydrophobicContact CE1-CG 3.99Å; Y96-L100 HydrophobicContact CE2-CD1 4.46Å; Y96-L100 HydrophobicContact CE2-CD2 4.29Å; Y96-L100 HydrophobicContact CE2-CG 4.19Å; Y96-L100 WeakPolarHBondContact O-CG 3.38Å; Y96-L100 PolarHBondContact O-N 2.95Å |
| 97 | Q | 98.5 | Very high | 97.6 | Very high | 132 Ų | 132 | 98.9 Ų | 98.9 | 62% | 0.617 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -58.3 | -47.6 | 173.1 | 179.2 | -177.5 | -33.3 | 0 | 0 | 111.3 | C93 I94 H99 L100 H101 | C93-Q97 WeakPolarHBondContact O-CB 3.49Å; C93-Q97 PolarHBondContact O-N 3.43Å; I94-Q97 WeakPolarHBondContact O-CB 3.4Å; I94-Q97 PolarHBondContact O-N 3.35Å; Q97-H99 VanDerWaalsContact C-N 3.31Å; Q97-H99 PolarHBondContact O-N 3.43Å; Q97-L100 PolarHBondContact O-N 3.41Å; Q97-H101 WeakPolarHBondContact O-CB 3.43Å; Q97-H101 PolarHBondContact O-N 2.88Å |
| 98 | D | 98.6 | Very high | 97.9 | Very high | 81 Ų | 81 | 98 Ų | 98 | 43% | 0.433 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.8 | -41.8 | 178.3 | -69.5 | -20.2 | 0 | 0 | 0 | 111.5 | I94 H101 Q102 | I94-D98 PolarHBondContact O-N 2.87Å; D98-H101 PolarHBondContact O-N 2.94Å; D98-Q102 WeakPolarHBondContact O-CG 3.45Å; D98-Q102 PolarHBondContact O-N 3.38Å |
| 99 | H | 98.6 | Very high | 98.1 | Very high | 105 Ų | 105 | 98.7 Ų | 98.7 | 49% | 0.486 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.4 | -45.1 | 177.6 | -175.9 | 55.2 | 0 | 0 | 0 | 112.2 | R95 Y96 Q97 H101 Q102 C103 | R95-H99 WeakPolarHBondContact O-CB 3.35Å; R95-H99 PolarHBondContact O-N 3.28Å; R95-H99 VanDerWaalsContact O-N 3.08Å; Y96-H99 PolarHBondContact O-N 2.94Å; Q97-H99 VanDerWaalsContact C-N 3.31Å; Q97-H99 PolarHBondContact O-N 3.43Å; H99-H101 VanDerWaalsContact C-N 3.27Å; H99-H101 PolarHBondContact O-N 3.31Å; H99-Q102 PolarHBondContact O-N 2.99Å; H99-C103 PolarHBondContact O-N 3.41Å; H99-C103 PolarHBondContact O-SG 3.49Å; H99-C103 VanDerWaalsContact O-SG 3.35Å |
| 100 | L | 98.7 | Very high | 98.3 | Very high | 85 Ų | 85 | 100.4 Ų | 100.4 | 45% | 0.445 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.7 | -37.8 | 175.5 | -73.6 | -178.5 | 0 | 0 | 0 | 111.8 | Y96 Q97 C103 A104 | Y96-L100 HydrophobicContact CD1-CD1 3.87Å; Y96-L100 HydrophobicContact CD1-CG 4.35Å; Y96-L100 HydrophobicContact CE1-CD1 3.38Å; Y96-L100 HydrophobicContact CE1-CG 3.99Å; Y96-L100 HydrophobicContact CE2-CD1 4.46Å; Y96-L100 HydrophobicContact CE2-CD2 4.29Å; Y96-L100 HydrophobicContact CE2-CG 4.19Å; Y96-L100 WeakPolarHBondContact O-CG 3.38Å; Y96-L100 PolarHBondContact O-N 2.95Å; Q97-L100 PolarHBondContact O-N 3.41Å; L100-C103 PolarHBondContact O-N 3.01Å; L100-A104 WeakPolarHBondContact O-CB 3.42Å; L100-A104 PolarHBondContact O-N 3.35Å |
| 101 | H | 98.6 | Very high | 98.4 | Very high | 110 Ų | 110 | 100.8 Ų | 100.8 | 51% | 0.509 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.4 | -49.3 | 176.1 | -172.1 | 64.5 | 0 | 0 | 0 | 111.5 | Q97 D98 H99 C103 A104 E105 | Q97-H101 WeakPolarHBondContact O-CB 3.43Å; Q97-H101 PolarHBondContact O-N 2.88Å; D98-H101 PolarHBondContact O-N 2.94Å; H99-H101 VanDerWaalsContact C-N 3.27Å; H99-H101 PolarHBondContact O-N 3.31Å; H101-C103 VanDerWaalsContact C-N 3.32Å; H101-C103 PolarHBondContact O-N 3.39Å; H101-A104 WeakPolarHBondContact O-CB 3.39Å; H101-A104 PolarHBondContact O-N 3.31Å; H101-A104 VanDerWaalsContact O-N 3.12Å; H101-E105 IonicContact NE2-OE1 3.4Å; H101-E105 PolarHBondContact NE2-OE1 3.32Å; H101-E105 WeakPolarHBondContact O-CG 3.25Å; H101-E105 PolarHBondContact O-N 2.92Å |
| 102 | Q | 98.7 | Very high | 98.5 | Very high | 118 Ų | 118 | 99.4 Ų | 99.4 | 55% | 0.551 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -59.5 | -42.1 | 176.5 | -70.5 | 169.8 | 27.3 | 0 | 0 | 112.4 | D98 H99 A104 E105 A106 | D98-Q102 WeakPolarHBondContact O-CG 3.45Å; D98-Q102 PolarHBondContact O-N 3.38Å; H99-Q102 PolarHBondContact O-N 2.99Å; Q102-A104 VanDerWaalsContact C-N 3.35Å; Q102-E105 PolarHBondContact O-N 2.91Å; Q102-A106 WeakPolarHBondContact O-CB 3.38Å; Q102-A106 PolarHBondContact O-N 3.34Å |
| 103 | C | 98.7 | Very high | 98.6 | Very high | 56 Ų | 56 | 95 Ų | 95 | 38% | 0.378 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.6 | -43.5 | 175.3 | -73.1 | 0 | 0 | 0 | 0 | 111.6 | H99 L100 H101 A106 V107 | H99-C103 PolarHBondContact O-N 3.41Å; H99-C103 PolarHBondContact O-SG 3.49Å; H99-C103 VanDerWaalsContact O-SG 3.35Å; L100-C103 PolarHBondContact O-N 3.01Å; H101-C103 VanDerWaalsContact C-N 3.32Å; H101-C103 PolarHBondContact O-N 3.39Å; C103-A106 PolarHBondContact O-N 3.43Å; C103-V107 VanDerWaalsContact O-CG2 3.3Å; C103-V107 WeakPolarHBondContact O-CG2 3.48Å; C103-V107 PolarHBondContact O-N 3.05Å |
| 104 | A | 98.7 | Very high | 98.6 | Very high | 58 Ų | 58 | 95.9 Ų | 95.9 | 48% | 0.479 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -64.2 | -41.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112 | L100 H101 Q102 V107 A108 | L100-A104 WeakPolarHBondContact O-CB 3.42Å; L100-A104 PolarHBondContact O-N 3.35Å; H101-A104 WeakPolarHBondContact O-CB 3.39Å; H101-A104 PolarHBondContact O-N 3.31Å; H101-A104 VanDerWaalsContact O-N 3.12Å; Q102-A104 VanDerWaalsContact C-N 3.35Å; A104-V107 PolarHBondContact O-N 3.03Å; A104-A108 WeakPolarHBondContact O-CB 3.3Å; A104-A108 PolarHBondContact O-N 2.91Å |
| 105 | E | 98.6 | Very high | 98.6 | Very high | 111 Ų | 111 | 95.2 Ų | 95.2 | 52% | 0.519 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.7 | -45 | 176.7 | -72.5 | -170.8 | 137.6 | 0 | 0 | 112.2 | H101 Q102 V107 A108 F109 | H101-E105 IonicContact NE2-OE1 3.4Å; H101-E105 PolarHBondContact NE2-OE1 3.32Å; H101-E105 WeakPolarHBondContact O-CG 3.25Å; H101-E105 PolarHBondContact O-N 2.92Å; Q102-E105 PolarHBondContact O-N 2.91Å; E105-V107 PolarHBondContact O-N 3.3Å; E105-A108 PolarHBondContact O-N 3.12Å; E105-F109 WeakPolarHBondContact O-CB 3.43Å; E105-F109 PolarHBondContact O-N 3.24Å |
| 106 | A | 98.6 | Very high | 98.7 | Very high | 54 Ų | 54 | 93.9 Ų | 93.9 | 45% | 0.446 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61 | -45.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q102 C103 A108 F109 D110 | Q102-A106 WeakPolarHBondContact O-CB 3.38Å; Q102-A106 PolarHBondContact O-N 3.34Å; C103-A106 PolarHBondContact O-N 3.43Å; A106-A108 PolarHBondContact O-N 3.4Å; A106-F109 PolarHBondContact O-N 3.49Å; A106-D110 PolarHBondContact O-N 3.47Å |
| 107 | V | 98.8 | Very high | 98.7 | Very high | 76 Ų | 76 | 94.4 Ų | 94.4 | 46% | 0.461 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62 | -45.1 | 176.5 | 170.3 | 0 | 0 | 0 | 0 | 111.1 | C103 A104 E105 F109 D110 Q111 | C103-V107 VanDerWaalsContact O-CG2 3.3Å; C103-V107 WeakPolarHBondContact O-CG2 3.48Å; C103-V107 PolarHBondContact O-N 3.05Å; A104-V107 PolarHBondContact O-N 3.03Å; E105-V107 PolarHBondContact O-N 3.3Å; V107-F109 VanDerWaalsContact C-N 3.31Å; V107-F109 PolarHBondContact O-N 3.47Å; V107-D110 PolarHBondContact O-N 2.97Å; V107-Q111 HydrophobicContact CG1-CG 4.23Å; V107-Q111 VanDerWaalsContact CG1-NE2 3.33Å; V107-Q111 WeakPolarHBondContact O-CB 3.33Å; V107-Q111 VanDerWaalsContact O-CG 3.25Å; V107-Q111 WeakPolarHBondContact O-CG 3.47Å; V107-Q111 PolarHBondContact O-N 3.38Å |
| 108 | A | 98.7 | Very high | 98.7 | Very high | 42 Ų | 42 | 91.6 Ų | 91.6 | 35% | 0.347 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.7 | -39.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | A104 E105 A106 N112 | A104-A108 WeakPolarHBondContact O-CB 3.3Å; A104-A108 PolarHBondContact O-N 2.91Å; E105-A108 PolarHBondContact O-N 3.12Å; A106-A108 PolarHBondContact O-N 3.4Å; A108-N112 WeakPolarHBondContact O-CB 3.45Å; A108-N112 VanDerWaalsContact O-CG 3.28Å; A108-N112 PolarHBondContact O-N 2.98Å; A108-N112 PolarHBondContact O-ND2 2.86Å |
| 109 | F | 98.7 | Very high | 98.7 | Very high | 148 Ų | 148 | 94.1 Ų | 94.1 | 65% | 0.649 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.4 | -49.6 | 175.5 | 180 | -93.7 | 0 | 0 | 0 | 111.7 | E105 A106 V107 N112 A113 | E105-F109 WeakPolarHBondContact O-CB 3.43Å; E105-F109 PolarHBondContact O-N 3.24Å; A106-F109 PolarHBondContact O-N 3.49Å; V107-F109 VanDerWaalsContact C-N 3.31Å; V107-F109 PolarHBondContact O-N 3.47Å; F109-N112 PolarHBondContact O-N 2.9Å; F109-A113 PolarHBondContact O-N 3.23Å |
| 110 | D | 98.6 | Very high | 98.7 | Very high | 101 Ų | 101 | 96.4 Ų | 96.4 | 54% | 0.54 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.9 | -40.6 | -179.3 | -77.3 | -18.4 | 0 | 0 | 0 | 112.3 | A106 V107 N112 A113 L114 | A106-D110 PolarHBondContact O-N 3.47Å; V107-D110 PolarHBondContact O-N 2.97Å; D110-N112 VanDerWaalsContact C-N 3.35Å; D110-N112 PolarHBondContact O-N 3.48Å; D110-A113 PolarHBondContact O-N 3.28Å; D110-L114 WeakPolarHBondContact O-CB 3.35Å; D110-L114 PolarHBondContact O-N 2.88Å |
| 111 | Q | 98.8 | Very high | 98.7 | Very high | 118 Ų | 118 | 97.8 Ų | 97.8 | 55% | 0.551 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.4 | -45 | 174.3 | -75 | 177.7 | 0.6 | 0 | 0 | 111.2 | V107 A113 L114 V115 | V107-Q111 HydrophobicContact CG1-CG 4.23Å; V107-Q111 VanDerWaalsContact CG1-NE2 3.33Å; V107-Q111 WeakPolarHBondContact O-CB 3.33Å; V107-Q111 VanDerWaalsContact O-CG 3.25Å; V107-Q111 WeakPolarHBondContact O-CG 3.47Å; V107-Q111 PolarHBondContact O-N 3.38Å; Q111-A113 VanDerWaalsContact C-N 3.32Å; Q111-A113 PolarHBondContact O-N 2.88Å; Q111-L114 PolarHBondContact O-N 2.91Å; Q111-V115 WeakPolarHBondContact O-CB 3.37Å; Q111-V115 VanDerWaalsContact O-CG2 3.26Å; Q111-V115 WeakPolarHBondContact O-CG2 3.26Å; Q111-V115 PolarHBondContact O-N 3.02Å |
| 112 | N | 98.6 | Very high | 98.7 | Very high | 100 Ų | 100 | 96.7 Ų | 96.7 | 54% | 0.535 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.7 | -38.6 | 176.4 | -78.6 | -46.3 | 0 | 0 | 0 | 112.2 | A108 F109 D110 K116 | A108-N112 WeakPolarHBondContact O-CB 3.45Å; A108-N112 VanDerWaalsContact O-CG 3.28Å; A108-N112 PolarHBondContact O-N 2.98Å; A108-N112 PolarHBondContact O-ND2 2.86Å; F109-N112 PolarHBondContact O-N 2.9Å; D110-N112 VanDerWaalsContact C-N 3.35Å; D110-N112 PolarHBondContact O-N 3.48Å; N112-K116 WeakPolarHBondContact O-CG 3.49Å; N112-K116 PolarHBondContact O-N 2.98Å; N112-K116 VanDerWaalsContact O-N 3.17Å |
| 113 | A | 98.6 | Very high | 98.7 | Very high | 25 Ų | 25 | 96.5 Ų | 96.5 | 21% | 0.207 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -65.9 | -41.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | F109 D110 Q111 K116 R117 | F109-A113 PolarHBondContact O-N 3.23Å; D110-A113 PolarHBondContact O-N 3.28Å; Q111-A113 VanDerWaalsContact C-N 3.32Å; Q111-A113 PolarHBondContact O-N 2.88Å; A113-K116 PolarHBondContact O-N 3.03Å; A113-R117 PolarHBondContact O-N 3.49Å; A113-R117 VanDerWaalsContact O-N 3.16Å |
| 114 | L | 98.8 | Very high | 98.7 | Very high | 88 Ų | 88 | 96.7 Ų | 96.7 | 46% | 0.461 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.6 | -46.7 | 176.6 | -176.4 | 65.4 | 0 | 0 | 0 | 111.5 | D110 Q111 K116 R117 I118 | D110-L114 WeakPolarHBondContact O-CB 3.35Å; D110-L114 PolarHBondContact O-N 2.88Å; Q111-L114 PolarHBondContact O-N 2.91Å; L114-K116 VanDerWaalsContact C-N 3.28Å; L114-K116 PolarHBondContact O-N 3.42Å; L114-R117 PolarHBondContact O-N 3.16Å; L114-I118 HydrophobicContact CD1-CD1 4.48Å; L114-I118 HydrophobicContact CG-CD1 3.98Å; L114-I118 HydrophobicContact CG-CG1 4.48Å; L114-I118 WeakPolarHBondContact O-CG1 3.43Å; L114-I118 PolarHBondContact O-N 3.41Å |
| 115 | V | 98.8 | Very high | 98.7 | Very high | 67 Ų | 67 | 98.1 Ų | 98.1 | 41% | 0.406 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -56.5 | -42.2 | 177.1 | 168.3 | 0 | 0 | 0 | 0 | 111.2 | Q111 R117 I118 K119 | Q111-V115 WeakPolarHBondContact O-CB 3.37Å; Q111-V115 VanDerWaalsContact O-CG2 3.26Å; Q111-V115 WeakPolarHBondContact O-CG2 3.26Å; Q111-V115 PolarHBondContact O-N 3.02Å; V115-R117 PolarHBondContact O-N 3.31Å; V115-I118 PolarHBondContact O-N 3.05Å; V115-K119 HydrophobicContact CG1-CD 4.42Å; V115-K119 WeakPolarHBondContact O-CG 3.35Å; V115-K119 PolarHBondContact O-N 3.24Å |
| 116 | K | 98.7 | Very high | 98.7 | Very high | 154 Ų | 154 | 99.1 Ų | 99.1 | 67% | 0.67 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.7 | -40.6 | 175.7 | -72.5 | 172.2 | -175.9 | 176.2 | 0 | 112.3 | N112 A113 L114 K120 | N112-K116 WeakPolarHBondContact O-CG 3.49Å; N112-K116 PolarHBondContact O-N 2.98Å; N112-K116 VanDerWaalsContact O-N 3.17Å; A113-K116 PolarHBondContact O-N 3.03Å; L114-K116 VanDerWaalsContact C-N 3.28Å; L114-K116 PolarHBondContact O-N 3.42Å; K116-K120 PolarHBondContact O-N 2.83Å; K116-K120 VanDerWaalsContact O-N 3.14Å |
| 117 | R | 98.7 | Very high | 98.7 | Very high | 154 Ų | 154 | 99 Ų | 99 | 58% | 0.581 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -67.3 | -41.8 | 177.4 | -71.8 | -172 | -124.7 | 110.2 | 0.3 | 112.1 | A113 L114 V115 K120 M121 | A113-R117 PolarHBondContact O-N 3.49Å; A113-R117 VanDerWaalsContact O-N 3.16Å; L114-R117 PolarHBondContact O-N 3.16Å; V115-R117 PolarHBondContact O-N 3.31Å; R117-K120 PolarHBondContact O-N 3.4Å; R117-M121 PolarHBondContact O-N 3.17Å |
| 118 | I | 98.8 | Very high | 98.7 | Very high | 73 Ų | 73 | 100.6 Ų | 100.6 | 37% | 0.374 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -58.2 | -51.7 | 175.6 | -68.4 | 168.5 | 0 | 0 | 0 | 109.8 | L114 V115 K120 M121 D122 | L114-I118 HydrophobicContact CD1-CD1 4.48Å; L114-I118 HydrophobicContact CG-CD1 3.98Å; L114-I118 HydrophobicContact CG-CG1 4.48Å; L114-I118 WeakPolarHBondContact O-CG1 3.43Å; L114-I118 PolarHBondContact O-N 3.41Å; V115-I118 PolarHBondContact O-N 3.05Å; I118-K120 VanDerWaalsContact C-N 3.27Å; I118-K120 PolarHBondContact O-N 2.97Å; I118-M121 WeakPolarHBondContact O-CA 3.38Å; I118-M121 WeakPolarHBondContact O-CB 3.45Å; I118-M121 PolarHBondContact O-N 3.14Å; I118-D122 PolarHBondContact O-N 3.2Å |
| 119 | K | 98.8 | Very high | 98.7 | Very high | 134 Ų | 134 | 104.9 Ų | 104.9 | 58% | 0.583 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -56.2 | -39.6 | 177.6 | -70.7 | -179 | -176.3 | -172.8 | 0 | 113 | V115 D122 L123 | V115-K119 HydrophobicContact CG1-CD 4.42Å; V115-K119 WeakPolarHBondContact O-CG 3.35Å; V115-K119 PolarHBondContact O-N 3.24Å; K119-D122 PolarHBondContact O-N 3.2Å; K119-L123 WeakPolarHBondContact O-CG 3.39Å; K119-L123 PolarHBondContact O-N 3.4Å; K119-L123 VanDerWaalsContact O-N 3.14Å |
| 120 | K | 98.5 | Very high | 98.7 | Very high | 153 Ų | 153 | 101.5 Ų | 101.5 | 67% | 0.665 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -66 | -39.3 | 176.6 | -174.3 | 179.5 | 178.5 | -178.7 | 0 | 112 | K116 R117 I118 S124 | K116-K120 PolarHBondContact O-N 2.83Å; K116-K120 VanDerWaalsContact O-N 3.14Å; R117-K120 PolarHBondContact O-N 3.4Å; I118-K120 VanDerWaalsContact C-N 3.27Å; I118-K120 PolarHBondContact O-N 2.97Å; K120-S124 PolarHBondContact O-N 3.14Å; K120-S124 VanDerWaalsContact O-N 3.14Å; K120-S124 PolarHBondContact O-OG 3.01Å |
| 121 | M | 98.7 | Very high | 98.7 | Very high | 114 Ų | 114 | 101.6 Ų | 101.6 | 56% | 0.562 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -65.3 | -44.9 | 175.9 | -174.3 | 172.1 | 65.1 | 0 | 0 | 110.8 | R117 I118 L123 S124 V125 | R117-M121 PolarHBondContact O-N 3.17Å; I118-M121 WeakPolarHBondContact O-CA 3.38Å; I118-M121 WeakPolarHBondContact O-CB 3.45Å; I118-M121 PolarHBondContact O-N 3.14Å; M121-L123 VanDerWaalsContact C-N 3.35Å; M121-L123 PolarHBondContact O-N 3.14Å; M121-S124 WeakPolarHBondContact O-CA 3.42Å; M121-S124 WeakPolarHBondContact O-CB 3.36Å; M121-S124 PolarHBondContact O-N 2.92Å; M121-V125 WeakPolarHBondContact O-CG2 3.48Å; M121-V125 PolarHBondContact O-N 3.46Å |
| 122 | D | 98.7 | Very high | 98.6 | Very high | 86 Ų | 86 | 100.6 Ų | 100.6 | 46% | 0.46 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -57 | -47.5 | 177.8 | -63.3 | -25.3 | 0 | 0 | 0 | 111.5 | I118 K119 S124 V125 E126 | I118-D122 PolarHBondContact O-N 3.2Å; K119-D122 PolarHBondContact O-N 3.2Å; D122-S124 VanDerWaalsContact C-N 3.27Å; D122-S124 PolarHBondContact O-N 2.88Å; D122-V125 PolarHBondContact O-N 3.33Å; D122-E126 PolarHBondContact O-N 2.89Å |
| 123 | L | 98.6 | Very high | 98.6 | Very high | 115 Ų | 115 | 99.5 Ų | 99.5 | 60% | 0.602 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.2 | -36.9 | 175.2 | -69.8 | 172.3 | 0 | 0 | 0 | 112.6 | K119 M121 A127 | K119-L123 WeakPolarHBondContact O-CG 3.39Å; K119-L123 PolarHBondContact O-N 3.4Å; K119-L123 VanDerWaalsContact O-N 3.14Å; M121-L123 VanDerWaalsContact C-N 3.35Å; M121-L123 PolarHBondContact O-N 3.14Å; L123-A127 WeakPolarHBondContact O-CB 3.48Å; L123-A127 PolarHBondContact O-N 3.46Å |
| 124 | S | 98.6 | Very high | 98.6 | Very high | 60 Ų | 60 | 102.1 Ų | 102.1 | 42% | 0.42 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -69.6 | -39.6 | 178.4 | -55.7 | 0 | 0 | 0 | 0 | 111.3 | K120 M121 D122 A127 L128 | K120-S124 PolarHBondContact O-N 3.14Å; K120-S124 VanDerWaalsContact O-N 3.14Å; K120-S124 PolarHBondContact O-OG 3.01Å; M121-S124 WeakPolarHBondContact O-CA 3.42Å; M121-S124 WeakPolarHBondContact O-CB 3.36Å; M121-S124 PolarHBondContact O-N 2.92Å; D122-S124 VanDerWaalsContact C-N 3.27Å; D122-S124 PolarHBondContact O-N 2.88Å; S124-A127 PolarHBondContact O-N 3.46Å; S124-L128 WeakPolarHBondContact O-CG 3.33Å; S124-L128 PolarHBondContact O-N 2.88Å |
| 125 | V | 98.7 | Very high | 98.6 | Very high | 88 Ų | 88 | 104 Ų | 104 | 53% | 0.533 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.8 | -44.5 | 174.9 | 171.6 | 0 | 0 | 0 | 0 | 110.5 | M121 D122 A127 L128 F129 | M121-V125 WeakPolarHBondContact O-CG2 3.48Å; M121-V125 PolarHBondContact O-N 3.46Å; D122-V125 PolarHBondContact O-N 3.33Å; V125-A127 PolarHBondContact O-N 2.9Å; V125-L128 PolarHBondContact O-N 3.25Å; V125-F129 WeakPolarHBondContact O-CB 3.35Å; V125-F129 PolarHBondContact O-N 3.31Å |
| 126 | E | 98.6 | Very high | 98.6 | Very high | 132 Ų | 132 | 107.3 Ų | 107.3 | 62% | 0.617 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.9 | -44.1 | 177.4 | -173.6 | 173.5 | -166 | 0 | 0 | 111.9 | D122 F129 S130 | D122-E126 PolarHBondContact O-N 2.89Å; E126-F129 PolarHBondContact O-N 3.48Å; E126-S130 PolarHBondContact O-N 3.02Å |
| 127 | A | 98.6 | Very high | 98.6 | Very high | 52 Ų | 52 | 105.3 Ų | 105.3 | 43% | 0.43 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.3 | -46.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | L123 S124 V125 F129 S130 I131 | L123-A127 WeakPolarHBondContact O-CB 3.48Å; L123-A127 PolarHBondContact O-N 3.46Å; S124-A127 PolarHBondContact O-N 3.46Å; V125-A127 PolarHBondContact O-N 2.9Å; A127-F129 VanDerWaalsContact C-N 3.33Å; A127-F129 PolarHBondContact O-N 2.94Å; A127-S130 PolarHBondContact O-N 2.95Å; A127-I131 VanDerWaalsContact O-CG1 3.29Å; A127-I131 WeakPolarHBondContact O-CG1 3.37Å; A127-I131 PolarHBondContact O-N 2.9Å |
| 128 | L | 98.6 | Very high | 98.6 | Very high | 108 Ų | 108 | 104.3 Ų | 104.3 | 57% | 0.565 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60.8 | -43.2 | 176.5 | -74.5 | 172.7 | 0 | 0 | 0 | 111.7 | S124 V125 S130 I131 M132 | S124-L128 WeakPolarHBondContact O-CG 3.33Å; S124-L128 PolarHBondContact O-N 2.88Å; V125-L128 PolarHBondContact O-N 3.25Å; L128-S130 PolarHBondContact O-N 3.46Å; L128-I131 PolarHBondContact O-N 3.32Å; L128-M132 WeakPolarHBondContact O-CG 3.46Å; L128-M132 PolarHBondContact O-N 2.86Å |
| 129 | F | 98.6 | Very high | 98.6 | Very high | 133 Ų | 133 | 106.7 Ų | 106.7 | 58% | 0.583 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -60.8 | -45.3 | 178 | -174.6 | -106.3 | 0 | 0 | 0 | 111.5 | V125 E126 A127 I131 M132 Q133 | V125-F129 WeakPolarHBondContact O-CB 3.35Å; V125-F129 PolarHBondContact O-N 3.31Å; E126-F129 PolarHBondContact O-N 3.48Å; A127-F129 VanDerWaalsContact C-N 3.33Å; A127-F129 PolarHBondContact O-N 2.94Å; F129-I131 PolarHBondContact O-N 3.29Å; F129-M132 PolarHBondContact O-N 3.47Å; F129-Q133 WeakPolarHBondContact O-CB 3.44Å; F129-Q133 PolarHBondContact O-N 3.04Å |
| 130 | S | 98.6 | Very high | 98.5 | Very high | 77 Ų | 77 | 102.7 Ų | 102.7 | 54% | 0.538 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -58.4 | -46.3 | 175.9 | -176.9 | 0 | 0 | 0 | 0 | 112.3 | E126 A127 L128 M132 Q133 E134 | E126-S130 PolarHBondContact O-N 3.02Å; A127-S130 PolarHBondContact O-N 2.95Å; L128-S130 PolarHBondContact O-N 3.46Å; S130-M132 PolarHBondContact O-N 3.48Å; S130-Q133 PolarHBondContact O-N 3.4Å; S130-E134 PolarHBondContact O-N 3Å |
| 131 | I | 98.5 | Very high | 98.5 | Very high | 103 Ų | 103 | 101.7 Ų | 101.7 | 53% | 0.528 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.5 | -44.3 | 177.2 | -64.3 | 164.2 | 0 | 0 | 0 | 110.9 | A127 L128 F129 Q133 E134 R135 | A127-I131 VanDerWaalsContact O-CG1 3.29Å; A127-I131 WeakPolarHBondContact O-CG1 3.37Å; A127-I131 PolarHBondContact O-N 2.9Å; L128-I131 PolarHBondContact O-N 3.32Å; F129-I131 PolarHBondContact O-N 3.29Å; I131-Q133 VanDerWaalsContact C-N 3.33Å; I131-Q133 PolarHBondContact O-N 2.87Å; I131-E134 PolarHBondContact O-N 3.26Å; I131-R135 WeakPolarHBondContact O-CB 3.49Å; I131-R135 PolarHBondContact O-N 3.43Å |
| 132 | M | 98.6 | Very high | 98.5 | Very high | 96 Ų | 96 | 102 Ų | 102 | 47% | 0.473 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64 | -39.5 | 178.4 | -70.9 | -57.6 | 100.2 | 0 | 0 | 111.9 | L128 F129 S130 R135 Q136 | L128-M132 WeakPolarHBondContact O-CG 3.46Å; L128-M132 PolarHBondContact O-N 2.86Å; F129-M132 PolarHBondContact O-N 3.47Å; S130-M132 PolarHBondContact O-N 3.48Å; M132-R135 PolarHBondContact O-N 3.04Å; M132-Q136 WeakPolarHBondContact O-CB 3.29Å; M132-Q136 PolarHBondContact O-N 3.07Å |
| 133 | Q | 98.7 | Very high | 98.5 | Very high | 77 Ų | 77 | 100.7 Ų | 100.7 | 36% | 0.36 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.6 | -41.4 | 179 | -143 | -174 | 97.3 | 0 | 0 | 111.8 | F129 S130 I131 Q136 K137 | F129-Q133 WeakPolarHBondContact O-CB 3.44Å; F129-Q133 PolarHBondContact O-N 3.04Å; S130-Q133 PolarHBondContact O-N 3.4Å; I131-Q133 VanDerWaalsContact C-N 3.33Å; I131-Q133 PolarHBondContact O-N 2.87Å; Q133-Q136 PolarHBondContact O-N 3.34Å; Q133-K137 WeakPolarHBondContact O-CG 3.44Å; Q133-K137 PolarHBondContact O-N 3.38Å |
| 134 | E | 98.3 | Very high | 98.5 | Very high | 80 Ų | 80 | 100.6 Ų | 100.6 | 37% | 0.374 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.4 | -42.2 | 174.4 | 178 | 55.9 | -158.3 | 0 | 0 | 111.5 | S130 I131 Q136 K137 R138 | S130-E134 PolarHBondContact O-N 3Å; I131-E134 PolarHBondContact O-N 3.26Å; E134-Q136 PolarHBondContact O-N 2.93Å; E134-K137 PolarHBondContact O-N 3.3Å; E134-R138 WeakPolarHBondContact O-CG 3.37Å; E134-R138 PolarHBondContact O-N 3Å; E134-R138 VanDerWaalsContact O-N 3.07Å; E134-R138 IonicContact OE1-CZ 3.37Å; E134-R138 IonicContact OE1-NE 2.83Å; E134-R138 PolarHBondContact OE1-NE 3.36Å; E134-R138 IonicContact OE1-NH2 3.04Å; E134-R138 PolarHBondContact OE1-NH2 3.39Å |
| 135 | R | 98.4 | Very high | 98.4 | Very high | 127 Ų | 127 | 103.3 Ų | 103.3 | 48% | 0.479 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.3 | -43.8 | 175.3 | -172.2 | 176.6 | -178.7 | -170.1 | -2 | 111.8 | I131 M132 R138 Y139 | I131-R135 WeakPolarHBondContact O-CB 3.49Å; I131-R135 PolarHBondContact O-N 3.43Å; M132-R135 PolarHBondContact O-N 3.04Å; R135-R138 PolarHBondContact O-N 3.49Å; R135-Y139 HydrophobicContact CG-CD2 4.02Å; R135-Y139 HydrophobicContact CG-CE2 3.53Å; R135-Y139 VanDerWaalsContact CZ-OH 3.31Å; R135-Y139 VanDerWaalsContact NE-CE2 3.26Å; R135-Y139 PolarHBondContact NE-OH 2.99Å; R135-Y139 PolarHBondContact NH2-OH 3.45Å; R135-Y139 PolarHBondContact O-N 3.26Å |
| 136 | Q | 98.6 | Very high | 98.2 | Very high | 137 Ų | 137 | 103.6 Ų | 103.6 | 64% | 0.64 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.7 | -46.3 | 176.1 | -176.6 | -177.5 | 2.3 | 0 | 0 | 111.6 | M132 Q133 E134 R138 Y139 A140 | M132-Q136 WeakPolarHBondContact O-CB 3.29Å; M132-Q136 PolarHBondContact O-N 3.07Å; Q133-Q136 PolarHBondContact O-N 3.34Å; E134-Q136 PolarHBondContact O-N 2.93Å; Q136-R138 VanDerWaalsContact C-N 3.3Å; Q136-R138 PolarHBondContact O-N 3.03Å; Q136-Y139 PolarHBondContact O-N 3.05Å; Q136-A140 PolarHBondContact O-N 3.23Å |
| 137 | K | 98.5 | Very high | 98.2 | Very high | 112 Ų | 112 | 102.8 Ų | 102.8 | 49% | 0.487 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -58.7 | -41.1 | 176.5 | -73.4 | 174.4 | -173.3 | 171.2 | 0 | 112 | Q133 E134 K141 | Q133-K137 WeakPolarHBondContact O-CG 3.44Å; Q133-K137 PolarHBondContact O-N 3.38Å; E134-K137 PolarHBondContact O-N 3.3Å; K137-K141 WeakPolarHBondContact O-CG 3.4Å; K137-K141 PolarHBondContact O-N 3.22Å |
| 138 | R | 98.3 | Very high | 98 | Very high | 133 Ų | 133 | 106.6 Ų | 106.6 | 50% | 0.502 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.9 | -43.9 | 176.3 | -69.1 | 176.6 | -170 | -175.2 | 1.7 | 112.1 | E134 R135 Q136 K141 Y142 | E134-R138 WeakPolarHBondContact O-CG 3.37Å; E134-R138 PolarHBondContact O-N 3Å; E134-R138 VanDerWaalsContact O-N 3.07Å; E134-R138 IonicContact OE1-CZ 3.37Å; E134-R138 IonicContact OE1-NE 2.83Å; E134-R138 PolarHBondContact OE1-NE 3.36Å; E134-R138 IonicContact OE1-NH2 3.04Å; E134-R138 PolarHBondContact OE1-NH2 3.39Å; R135-R138 PolarHBondContact O-N 3.49Å; Q136-R138 VanDerWaalsContact C-N 3.3Å; Q136-R138 PolarHBondContact O-N 3.03Å; R138-K141 WeakPolarHBondContact O-CB 3.39Å; R138-K141 PolarHBondContact O-N 3.48Å; R138-Y142 HydrophobicContact CB-CE2 4.44Å; R138-Y142 PolarHBondContact O-N 3.06Å |
| 139 | Y | 98.4 | Very high | 97.8 | Very high | 123 Ų | 123 | 104.4 Ų | 104.4 | 48% | 0.482 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.8 | -37 | 177.9 | -68.6 | -24.1 | 0 | 0 | 0 | 113.3 | R135 Q136 K141 Y142 A143 | R135-Y139 HydrophobicContact CG-CD2 4.02Å; R135-Y139 HydrophobicContact CG-CE2 3.53Å; R135-Y139 VanDerWaalsContact CZ-OH 3.31Å; R135-Y139 VanDerWaalsContact NE-CE2 3.26Å; R135-Y139 PolarHBondContact NE-OH 2.99Å; R135-Y139 PolarHBondContact NH2-OH 3.45Å; R135-Y139 PolarHBondContact O-N 3.26Å; Q136-Y139 PolarHBondContact O-N 3.05Å; Y139-K141 VanDerWaalsContact C-N 3.34Å; Y139-K141 PolarHBondContact O-N 3.04Å; Y139-Y142 AromaticContact CD1-CD2 3.87Å; Y139-Y142 HydrophobicContact CD1-CD2 3.87Å; Y139-Y142 HydrophobicContact CD1-CE2 4.21Å; Y139-Y142 HydrophobicContact CE1-CD2 4.44Å; Y139-Y142 HydrophobicContact CE1-CE2 4.48Å; Y139-Y142 PolarHBondContact O-N 3.07Å; Y139-A143 PolarHBondContact O-N 3.38Å |
| 140 | A | 98.5 | Very high | 97.6 | Very high | 51 Ų | 51 | 101.2 Ų | 101.2 | 42% | 0.421 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -58.5 | -46.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q136 Y142 A143 E144 | Q136-A140 PolarHBondContact O-N 3.23Å; A140-Y142 VanDerWaalsContact C-N 3.34Å; A140-Y142 PolarHBondContact O-N 3.32Å; A140-A143 WeakPolarHBondContact O-CB 3.43Å; A140-A143 PolarHBondContact O-N 2.96Å; A140-E144 WeakPolarHBondContact O-CG 3.48Å; A140-E144 PolarHBondContact O-N 3.21Å |
| 141 | K | 98.4 | Very high | 97.5 | Very high | 132 Ų | 132 | 102 Ų | 102 | 57% | 0.574 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61.1 | -39.4 | 175.9 | -69.5 | 176.7 | -179.6 | -179.3 | 0 | 112.9 | K137 R138 Y139 E144 Q145 | K137-K141 WeakPolarHBondContact O-CG 3.4Å; K137-K141 PolarHBondContact O-N 3.22Å; R138-K141 WeakPolarHBondContact O-CB 3.39Å; R138-K141 PolarHBondContact O-N 3.48Å; Y139-K141 VanDerWaalsContact C-N 3.34Å; Y139-K141 PolarHBondContact O-N 3.04Å; K141-E144 PolarHBondContact O-N 3.46Å; K141-Q145 WeakPolarHBondContact O-CG 3.42Å; K141-Q145 PolarHBondContact O-N 2.83Å; K141-Q145 VanDerWaalsContact O-N 3.08Å |
| 142 | Y | 97.9 | Very high | 97.2 | Very high | 121 Ų | 121 | 102.9 Ų | 102.9 | 48% | 0.475 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.4 | -39.5 | 176.2 | -62.4 | -29.5 | 0 | 0 | 0 | 112.2 | R138 Y139 A140 E144 Q145 I146 | R138-Y142 HydrophobicContact CB-CE2 4.44Å; R138-Y142 PolarHBondContact O-N 3.06Å; Y139-Y142 AromaticContact CD1-CD2 3.87Å; Y139-Y142 HydrophobicContact CD1-CD2 3.87Å; Y139-Y142 HydrophobicContact CD1-CE2 4.21Å; Y139-Y142 HydrophobicContact CE1-CD2 4.44Å; Y139-Y142 HydrophobicContact CE1-CE2 4.48Å; Y139-Y142 PolarHBondContact O-N 3.07Å; A140-Y142 VanDerWaalsContact C-N 3.34Å; A140-Y142 PolarHBondContact O-N 3.32Å; Y142-E144 VanDerWaalsContact C-N 3.32Å; Y142-E144 PolarHBondContact O-N 3.35Å; Y142-Q145 PolarHBondContact O-N 3.42Å; Y142-I146 WeakPolarHBondContact O-CG1 3.5Å; Y142-I146 PolarHBondContact O-N 2.95Å |
| 143 | A | 98.1 | Very high | 96.8 | Very high | 58 Ų | 58 | 98.8 Ų | 98.8 | 48% | 0.479 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -59.9 | -43.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y139 A140 Q145 I146 Q147 | Y139-A143 PolarHBondContact O-N 3.38Å; A140-A143 WeakPolarHBondContact O-CB 3.43Å; A140-A143 PolarHBondContact O-N 2.96Å; A143-Q145 VanDerWaalsContact C-N 3.34Å; A143-Q145 PolarHBondContact O-N 2.94Å; A143-I146 PolarHBondContact O-N 3.46Å; A143-Q147 WeakPolarHBondContact O-CB 3.5Å; A143-Q147 PolarHBondContact O-N 3.19Å |
| 144 | E | 98.2 | Very high | 96.4 | Very high | 113 Ų | 113 | 100.4 Ų | 100.4 | 53% | 0.528 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -60 | -41.3 | 174.1 | -70.7 | 174.3 | -169.2 | 0 | 0 | 112.5 | A140 K141 Y142 Q147 K148 | A140-E144 WeakPolarHBondContact O-CG 3.48Å; A140-E144 PolarHBondContact O-N 3.21Å; K141-E144 PolarHBondContact O-N 3.46Å; Y142-E144 VanDerWaalsContact C-N 3.32Å; Y142-E144 PolarHBondContact O-N 3.35Å; E144-Q147 PolarHBondContact O-N 3.22Å; E144-K148 WeakPolarHBondContact O-CG 3.39Å; E144-K148 PolarHBondContact O-N 3.25Å |
| 145 | Q | 97.1 | Very high | 96.1 | Very high | 116 Ų | 116 | 101 Ų | 101 | 54% | 0.542 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -65.5 | -44.2 | 177.7 | -73.4 | 176.5 | -1.5 | 0 | 0 | 112.1 | K141 Y142 A143 Q147 K148 V149 | K141-Q145 WeakPolarHBondContact O-CG 3.42Å; K141-Q145 PolarHBondContact O-N 2.83Å; K141-Q145 VanDerWaalsContact O-N 3.08Å; Y142-Q145 PolarHBondContact O-N 3.42Å; A143-Q145 VanDerWaalsContact C-N 3.34Å; A143-Q145 PolarHBondContact O-N 2.94Å; Q145-Q147 VanDerWaalsContact C-N 3.27Å; Q145-Q147 PolarHBondContact O-N 2.93Å; Q145-K148 WeakPolarHBondContact O-CB 3.43Å; Q145-K148 PolarHBondContact O-N 3.08Å; Q145-V149 WeakPolarHBondContact O-CG2 3.21Å; Q145-V149 PolarHBondContact O-N 2.93Å |
| 146 | I | 95.1 | Very high | 95.6 | Very high | 95 Ų | 95 | 98 Ų | 98 | 49% | 0.487 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -61.2 | -40.6 | 176.2 | -68.6 | 167.4 | 0 | 0 | 0 | 110.2 | Y142 A143 K148 V149 N150 | Y142-I146 WeakPolarHBondContact O-CG1 3.5Å; Y142-I146 PolarHBondContact O-N 2.95Å; A143-I146 PolarHBondContact O-N 3.46Å; I146-K148 PolarHBondContact O-N 3.45Å; I146-V149 PolarHBondContact O-N 3.04Å; I146-N150 PolarHBondContact O-N 3.43Å |
| 147 | Q | 97.3 | Very high | 95 | Very high | 115 Ų | 115 | 98.9 Ų | 98.9 | 54% | 0.537 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -59.8 | -44.8 | 175.6 | -174.7 | 175.4 | -11 | 0 | 0 | 111.8 | A143 E144 Q145 V149 N150 E151 | A143-Q147 WeakPolarHBondContact O-CB 3.5Å; A143-Q147 PolarHBondContact O-N 3.19Å; E144-Q147 PolarHBondContact O-N 3.22Å; Q145-Q147 VanDerWaalsContact C-N 3.27Å; Q145-Q147 PolarHBondContact O-N 2.93Å; Q147-V149 VanDerWaalsContact C-N 3.33Å; Q147-V149 PolarHBondContact O-N 3.31Å; Q147-N150 WeakPolarHBondContact O-CB 3.42Å; Q147-N150 PolarHBondContact O-N 3.22Å; Q147-N150 VanDerWaalsContact O-N 3.15Å; Q147-E151 WeakPolarHBondContact O-CG 3.44Å; Q147-E151 PolarHBondContact O-N 3.4Å |
| 148 | K | 96.3 | Very high | 94.7 | Very high | 131 Ų | 131 | 102.3 Ų | 102.3 | 57% | 0.57 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -60.9 | -39.6 | 174.9 | -71.4 | 176.1 | -178.7 | 177.1 | 0 | 112.8 | E144 Q145 I146 N150 E151 M152 | E144-K148 WeakPolarHBondContact O-CG 3.39Å; E144-K148 PolarHBondContact O-N 3.25Å; Q145-K148 WeakPolarHBondContact O-CB 3.43Å; Q145-K148 PolarHBondContact O-N 3.08Å; I146-K148 PolarHBondContact O-N 3.45Å; K148-N150 VanDerWaalsContact C-N 3.33Å; K148-E151 PolarHBondContact O-N 3.48Å; K148-M152 WeakPolarHBondContact O-CB 3.47Å; K148-M152 PolarHBondContact O-N 3.19Å |
| 149 | V | 94.1 | Very high | 94.4 | Very high | 62 Ų | 62 | 100.3 Ų | 100.3 | 38% | 0.376 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.2 | -41.9 | 175.1 | 172.7 | 0 | 0 | 0 | 0 | 110.7 | Q145 I146 Q147 M152 S153 | Q145-V149 WeakPolarHBondContact O-CG2 3.21Å; Q145-V149 PolarHBondContact O-N 2.93Å; I146-V149 PolarHBondContact O-N 3.04Å; Q147-V149 VanDerWaalsContact C-N 3.33Å; Q147-V149 PolarHBondContact O-N 3.31Å; V149-M152 PolarHBondContact O-N 2.83Å; V149-S153 WeakPolarHBondContact O-CB 3.45Å; V149-S153 PolarHBondContact O-N 2.97Å |
| 150 | N | 93.2 | Very high | 93.7 | Very high | 66 Ų | 66 | 96.9 Ų | 96.9 | 35% | 0.353 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -63.1 | -44 | 176.2 | -75.9 | -22.5 | 0 | 0 | 0 | 112 | I146 Q147 K148 M152 S153 M154 | I146-N150 PolarHBondContact O-N 3.43Å; Q147-N150 WeakPolarHBondContact O-CB 3.42Å; Q147-N150 PolarHBondContact O-N 3.22Å; Q147-N150 VanDerWaalsContact O-N 3.15Å; K148-N150 VanDerWaalsContact C-N 3.33Å; N150-M152 PolarHBondContact O-N 2.9Å; N150-S153 WeakPolarHBondContact O-CB 3.46Å; N150-S153 PolarHBondContact O-N 3.12Å; N150-M154 HydrophobicContact CB-CE 4.49Å; N150-M154 WeakPolarHBondContact O-CG 3.47Å; N150-M154 PolarHBondContact O-N 3.39Å |
| 151 | E | 96.1 | Very high | 93.2 | Very high | 95 Ų | 95 | 99.9 Ų | 99.9 | 44% | 0.444 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -58.6 | -46.6 | 174.5 | -71.8 | 169.3 | -171.2 | 0 | 0 | 111.6 | Q147 K148 S153 M154 I155 | Q147-E151 WeakPolarHBondContact O-CG 3.44Å; Q147-E151 PolarHBondContact O-N 3.4Å; K148-E151 PolarHBondContact O-N 3.48Å; E151-S153 VanDerWaalsContact C-N 3.32Å; E151-S153 PolarHBondContact O-N 2.96Å; E151-M154 WeakPolarHBondContact O-CB 3.36Å; E151-M154 PolarHBondContact O-N 3.36Å; E151-M154 VanDerWaalsContact O-N 3.15Å; E151-I155 WeakPolarHBondContact O-CG1 3.33Å; E151-I155 PolarHBondContact O-N 3.44Å |
| 152 | M | 92.5 | Very high | 92.8 | Very high | 121 Ų | 121 | 94.9 Ų | 94.9 | 60% | 0.596 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -60.8 | -41.9 | 176.2 | -169.6 | -177.8 | -60.2 | 0 | 0 | 111.6 | K148 V149 N150 M154 I155 L156 | K148-M152 WeakPolarHBondContact O-CB 3.47Å; K148-M152 PolarHBondContact O-N 3.19Å; V149-M152 PolarHBondContact O-N 2.83Å; N150-M152 PolarHBondContact O-N 2.9Å; M152-M154 VanDerWaalsContact C-N 3.31Å; M152-M154 PolarHBondContact O-N 3.31Å; M152-I155 PolarHBondContact O-N 2.99Å; M152-L156 HydrophobicContact CG-CD1 4.36Å; M152-L156 WeakPolarHBondContact O-CG 3.44Å; M152-L156 PolarHBondContact O-N 3.42Å |
| 153 | S | 90.3 | Very high | 92.3 | Very high | 10 Ų | 10 | 90.8 Ų | 90.8 | 7% | 0.07 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -61.4 | -39.8 | 175.3 | -160.7 | 0 | 0 | 0 | 0 | 112 | V149 N150 E151 L156 R157 Y195 | V149-S153 WeakPolarHBondContact O-CB 3.45Å; V149-S153 PolarHBondContact O-N 2.97Å; N150-S153 WeakPolarHBondContact O-CB 3.46Å; N150-S153 PolarHBondContact O-N 3.12Å; E151-S153 VanDerWaalsContact C-N 3.32Å; E151-S153 PolarHBondContact O-N 2.96Å; S153-L156 PolarHBondContact O-N 3.37Å; S153-R157 WeakPolarHBondContact O-CG 3.48Å; S153-R157 PolarHBondContact O-N 3.41Å; S153-Y195 WeakPolarHBondContact CA-OH 3.41Å; S153-Y195 PolarHBondContact OG-OH 3.35Å; S153-Y195 VanDerWaalsContact OG-OH 3.12Å |
| 154 | M | 91.3 | Very high | 91.7 | Very high | 110 Ų | 110 | 92.6 Ų | 92.6 | 54% | 0.542 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -64.6 | -42.5 | 175.1 | -68.6 | -177.6 | -146.6 | 0 | 0 | 112.2 | N150 E151 M152 R157 R158 | N150-M154 HydrophobicContact CB-CE 4.49Å; N150-M154 WeakPolarHBondContact O-CG 3.47Å; N150-M154 PolarHBondContact O-N 3.39Å; E151-M154 WeakPolarHBondContact O-CB 3.36Å; E151-M154 PolarHBondContact O-N 3.36Å; E151-M154 VanDerWaalsContact O-N 3.15Å; M152-M154 VanDerWaalsContact C-N 3.31Å; M152-M154 PolarHBondContact O-N 3.31Å; M154-R157 PolarHBondContact O-N 3.49Å; M154-R158 PolarHBondContact O-N 3.15Å; M154-R158 VanDerWaalsContact O-N 3.07Å |
| 155 | I | 92 | Very high | 91.5 | Very high | 93 Ų | 93 | 93.4 Ų | 93.4 | 48% | 0.477 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61.9 | -47.8 | 176.1 | -66.5 | 167.3 | 0 | 0 | 0 | 110.2 | E151 M152 R157 R158 I159 | E151-I155 WeakPolarHBondContact O-CG1 3.33Å; E151-I155 PolarHBondContact O-N 3.44Å; M152-I155 PolarHBondContact O-N 2.99Å; I155-R157 VanDerWaalsContact C-N 3.3Å; I155-R157 PolarHBondContact O-N 2.93Å; I155-R158 WeakPolarHBondContact O-CB 3.38Å; I155-R158 PolarHBondContact O-N 3.41Å; I155-I159 HydrophobicContact CG2-CD1 3.96Å; I155-I159 HydrophobicContact CG2-CG1 4.5Å; I155-I159 WeakPolarHBondContact O-CG1 3.47Å; I155-I159 PolarHBondContact O-N 3.02Å |
| 156 | L | 87.7 | Confident | 91.2 | Very high | 65 Ų | 65 | 91.8 Ų | 91.8 | 34% | 0.34 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -60.3 | -39.6 | 178.3 | -74.2 | 173.4 | 0 | 0 | 0 | 112.1 | M152 S153 R158 I159 Q160 Y195 | M152-L156 HydrophobicContact CG-CD1 4.36Å; M152-L156 WeakPolarHBondContact O-CG 3.44Å; M152-L156 PolarHBondContact O-N 3.42Å; S153-L156 PolarHBondContact O-N 3.37Å; L156-R158 VanDerWaalsContact C-N 3.35Å; L156-R158 PolarHBondContact O-N 3.22Å; L156-I159 PolarHBondContact O-N 2.88Å; L156-Q160 PolarHBondContact O-N 2.96Å; L156-Y195 HydrophobicContact CB-CE1 4.47Å; L156-Y195 HydrophobicContact CD1-CD2 4.22Å; L156-Y195 HydrophobicContact CD1-CE1 3.97Å; L156-Y195 HydrophobicContact CD1-CE2 3.57Å; L156-Y195 VanDerWaalsContact CD1-CZ 3.42Å |
| 157 | R | 86.5 | Confident | 91 | Very high | 155 Ų | 155 | 88.8 Ų | 88.8 | 59% | 0.585 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -61.3 | -41 | 173.1 | -75.2 | 179.1 | -169.5 | -176.8 | 2.7 | 112.3 | S153 M154 I155 Q160 M161 | S153-R157 WeakPolarHBondContact O-CG 3.48Å; S153-R157 PolarHBondContact O-N 3.41Å; M154-R157 PolarHBondContact O-N 3.49Å; I155-R157 VanDerWaalsContact C-N 3.3Å; I155-R157 PolarHBondContact O-N 2.93Å; R157-Q160 PolarHBondContact O-N 3.39Å; R157-M161 WeakPolarHBondContact O-CG 3.47Å; R157-M161 PolarHBondContact O-N 3.34Å |
| 158 | R | 92.4 | Very high | 90.6 | Very high | 184 Ų | 184 | 86.4 Ų | 86.4 | 69% | 0.694 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -63.9 | -42.7 | 175.7 | -71.2 | 178.7 | -174.9 | 162.1 | 2.5 | 111.9 | M154 I155 L156 Q160 M161 G162 | M154-R158 PolarHBondContact O-N 3.15Å; M154-R158 VanDerWaalsContact O-N 3.07Å; I155-R158 WeakPolarHBondContact O-CB 3.38Å; I155-R158 PolarHBondContact O-N 3.41Å; L156-R158 VanDerWaalsContact C-N 3.35Å; L156-R158 PolarHBondContact O-N 3.22Å; R158-Q160 VanDerWaalsContact C-N 3.34Å; R158-M161 PolarHBondContact O-N 3.07Å; R158-G162 PolarHBondContact O-N 2.95Å |
| 159 | I | 90.2 | Very high | 90.4 | Very high | 90 Ų | 90 | 85.3 Ų | 85.3 | 46% | 0.462 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -60.6 | -46.9 | 175.7 | -66.9 | 168.6 | 0 | 0 | 0 | 110 | I155 L156 M161 G162 I163 | I155-I159 HydrophobicContact CG2-CD1 3.96Å; I155-I159 HydrophobicContact CG2-CG1 4.5Å; I155-I159 WeakPolarHBondContact O-CG1 3.47Å; I155-I159 PolarHBondContact O-N 3.02Å; L156-I159 PolarHBondContact O-N 2.88Å; I159-M161 VanDerWaalsContact C-N 3.34Å; I159-M161 PolarHBondContact O-N 3.07Å; I159-G162 PolarHBondContact O-N 2.97Å; I159-G162 VanDerWaalsContact O-N 3.09Å; I159-I163 HydrophobicContact CG2-CD1 3.77Å; I159-I163 HydrophobicContact CG2-CG1 4.45Å; I159-I163 WeakPolarHBondContact O-CG1 3.43Å; I159-I163 PolarHBondContact O-N 2.69Å |
| 160 | Q | 84.4 | Confident | 90.3 | Very high | 52 Ų | 52 | 86.3 Ų | 86.3 | 24% | 0.243 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -56.8 | -47.6 | 176.2 | -175.3 | 62.5 | 43.4 | 0 | 0 | 111.5 | L156 R157 R158 G162 I163 D164 | L156-Q160 PolarHBondContact O-N 2.96Å; R157-Q160 PolarHBondContact O-N 3.39Å; R158-Q160 VanDerWaalsContact C-N 3.34Å; Q160-G162 VanDerWaalsContact C-N 3.28Å; Q160-G162 PolarHBondContact O-N 3.2Å; Q160-I163 WeakPolarHBondContact O-CB 3.49Å; Q160-I163 PolarHBondContact O-N 3.07Å; Q160-I163 VanDerWaalsContact O-N 3.15Å; Q160-D164 PolarHBondContact NE2-OD1 2.84Å; Q160-D164 PolarHBondContact O-N 3.12Å |
| 161 | M | 88.6 | Confident | 90.1 | Very high | 114 Ų | 114 | 87.3 Ų | 87.3 | 56% | 0.562 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -58.7 | -40.2 | 176 | -72.2 | 179.2 | 65.1 | 0 | 0 | 112.2 | R157 R158 I159 D164 Q165 | R157-M161 WeakPolarHBondContact O-CG 3.47Å; R157-M161 PolarHBondContact O-N 3.34Å; R158-M161 PolarHBondContact O-N 3.07Å; I159-M161 VanDerWaalsContact C-N 3.34Å; I159-M161 PolarHBondContact O-N 3.07Å; M161-D164 PolarHBondContact O-N 2.81Å; M161-Q165 VanDerWaalsContact O-CG 3.26Å; M161-Q165 WeakPolarHBondContact O-CG 3.45Å; M161-Q165 PolarHBondContact O-N 3.42Å |
| 162 | G | 89.9 | Confident | 89.9 | Confident | 27 Ų | 27 | 91.4 Ų | 91.4 | 28% | 0.278 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.6 | -39 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113 | R158 I159 Q160 Q165 T166 | R158-G162 PolarHBondContact O-N 2.95Å; I159-G162 PolarHBondContact O-N 2.97Å; I159-G162 VanDerWaalsContact O-N 3.09Å; Q160-G162 VanDerWaalsContact C-N 3.28Å; Q160-G162 PolarHBondContact O-N 3.2Å; G162-Q165 PolarHBondContact O-N 3.15Å; G162-T166 WeakPolarHBondContact O-CB 3.36Å; G162-T166 PolarHBondContact O-N 3.15Å; G162-T166 PolarHBondContact O-OG1 3.38Å |
| 163 | I | 86.8 | Confident | 89.9 | Confident | 35 Ų | 35 | 91.1 Ų | 91.1 | 18% | 0.179 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -64.6 | -49.6 | 173.8 | -66.6 | 158.3 | 0 | 0 | 0 | 110.1 | I159 Q160 Q165 T166 V167 M188 | I159-I163 HydrophobicContact CG2-CD1 3.77Å; I159-I163 HydrophobicContact CG2-CG1 4.45Å; I159-I163 WeakPolarHBondContact O-CG1 3.43Å; I159-I163 PolarHBondContact O-N 2.69Å; Q160-I163 WeakPolarHBondContact O-CB 3.49Å; Q160-I163 PolarHBondContact O-N 3.07Å; Q160-I163 VanDerWaalsContact O-N 3.15Å; I163-Q165 PolarHBondContact O-N 3.35Å; I163-Q165 VanDerWaalsContact O-N 3.16Å; I163-T166 PolarHBondContact O-N 2.89Å; I163-V167 HydrophobicContact CG2-CG2 3.75Å; I163-V167 WeakPolarHBondContact O-CG2 3.46Å; I163-V167 PolarHBondContact O-N 3.37Å; I163-M188 HydrophobicContact CD1-CE 3.51Å; I163-M188 HydrophobicContact CD1-SD 3.61Å; I163-M188 HydrophobicContact CG1-CE 3.95Å; I163-M188 HydrophobicContact CG2-CE 4.05Å |
| 164 | D | 86.4 | Confident | 90 | Very high | 96 Ų | 96 | 91.7 Ų | 91.7 | 51% | 0.513 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -58.4 | -30.3 | 179.8 | -66.2 | -20.3 | 0 | 0 | 0 | 111.8 | Q160 M161 P168 | Q160-D164 PolarHBondContact NE2-OD1 2.84Å; Q160-D164 PolarHBondContact O-N 3.12Å; M161-D164 PolarHBondContact O-N 2.81Å; D164-P168 WeakPolarHBondContact O-CD 3.46Å |
| 165 | Q | 92.7 | Very high | 90 | Very high | 129 Ų | 129 | 91.1 Ų | 91.1 | 60% | 0.603 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -77.9 | -36.8 | 173 | -71.5 | 171.8 | 4.3 | 0 | 0 | 113.5 | M161 G162 I163 P168 | M161-Q165 VanDerWaalsContact O-CG 3.26Å; M161-Q165 WeakPolarHBondContact O-CG 3.45Å; M161-Q165 PolarHBondContact O-N 3.42Å; G162-Q165 PolarHBondContact O-N 3.15Å; I163-Q165 PolarHBondContact O-N 3.35Å; I163-Q165 VanDerWaalsContact O-N 3.16Å; Q165-P168 WeakPolarHBondContact O-CG 3.4Å |
| 166 | T | 91.9 | Very high | 90 | Very high | 83 Ų | 83 | 93.6 Ų | 93.6 | 51% | 0.509 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -84.6 | -36.8 | -172.1 | -54.1 | 0 | 0 | 0 | 0 | 112.9 | G162 I163 L169 M170 | G162-T166 WeakPolarHBondContact O-CB 3.36Å; G162-T166 PolarHBondContact O-N 3.15Å; G162-T166 PolarHBondContact O-OG1 3.38Å; I163-T166 PolarHBondContact O-N 2.89Å; T166-L169 WeakPolarHBondContact O-CB 3.43Å; T166-L169 PolarHBondContact O-N 3.26Å; T166-L169 VanDerWaalsContact O-N 3.13Å; T166-M170 PolarHBondContact O-N 3.16Å |
| 167 | V | 89.8 | Confident | 90.1 | Very high | 32 Ų | 32 | 93.4 Ų | 93.4 | 19% | 0.194 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -52.1 | -51.6 | 179.4 | 169.8 | 0 | 0 | 0 | 0 | 113.1 | I163 L169 M170 E171 F186 | I163-V167 HydrophobicContact CG2-CG2 3.75Å; I163-V167 WeakPolarHBondContact O-CG2 3.46Å; I163-V167 PolarHBondContact O-N 3.37Å; V167-L169 VanDerWaalsContact C-N 3.26Å; V167-L169 PolarHBondContact O-N 3.31Å; V167-M170 PolarHBondContact O-N 3.47Å; V167-M170 VanDerWaalsContact O-N 3.12Å; V167-E171 HydrophobicContact CG1-CG 4.42Å; V167-E171 PolarHBondContact O-N 2.92Å; V167-F186 HydrophobicContact CG2-CD1 3.87Å; V167-F186 HydrophobicContact CG2-CE1 4.15Å |
| 168 | P | 89.5 | Confident | 90.4 | Very high | 64 Ų | 64 | 89.6 Ų | 89.6 | 42% | 0.416 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -65.3 | -29.3 | -179.3 | 25.1 | -35.1 | 0 | 0 | 0 | 112.9 | D164 Q165 R172 | D164-P168 WeakPolarHBondContact O-CD 3.46Å; Q165-P168 WeakPolarHBondContact O-CG 3.4Å; P168-R172 WeakPolarHBondContact O-CB 3.49Å; P168-R172 PolarHBondContact O-N 2.91Å |
| 169 | L | 93 | Very high | 90.1 | Very high | 108 Ų | 108 | 88.6 Ų | 88.6 | 57% | 0.565 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -67.7 | -41.6 | 174.4 | -61.4 | 176.7 | 0 | 0 | 0 | 111 | T166 V167 R172 L173 | T166-L169 WeakPolarHBondContact O-CB 3.43Å; T166-L169 PolarHBondContact O-N 3.26Å; T166-L169 VanDerWaalsContact O-N 3.13Å; V167-L169 VanDerWaalsContact C-N 3.26Å; V167-L169 PolarHBondContact O-N 3.31Å; L169-R172 WeakPolarHBondContact O-CB 3.4Å; L169-R172 PolarHBondContact O-N 2.75Å; L169-L173 WeakPolarHBondContact O-CG 3.4Å; L169-L173 PolarHBondContact O-N 3.44Å |
| 170 | M | 90.6 | Very high | 90 | Very high | 84 Ų | 84 | 89.6 Ų | 89.6 | 41% | 0.414 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -67.5 | -42.1 | 176.9 | -168.1 | 174.4 | 70.5 | 0 | 0 | 111.9 | T166 V167 R172 L173 N174 F186 | T166-M170 PolarHBondContact O-N 3.16Å; V167-M170 PolarHBondContact O-N 3.47Å; V167-M170 VanDerWaalsContact O-N 3.12Å; M170-R172 VanDerWaalsContact C-N 3.31Å; M170-R172 PolarHBondContact O-N 2.99Å; M170-L173 PolarHBondContact O-N 3.09Å; M170-N174 WeakPolarHBondContact O-CB 3.47Å; M170-N174 PolarHBondContact O-N 2.96Å; M170-F186 HydrophobicContact CE-CB 3.15Å; M170-F186 HydrophobicContact CE-CD1 4.24Å; M170-F186 HydrophobicContact CE-CD2 3.92Å; M170-F186 HydrophobicContact CE-CG 3.53Å |
| 171 | E | 88.9 | Confident | 90.3 | Very high | 87 Ų | 87 | 92.8 Ų | 92.8 | 41% | 0.407 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.1 | -41.8 | 172.8 | -72.7 | 178.5 | 170.9 | 0 | 0 | 111.6 | V167 N174 N175 | V167-E171 HydrophobicContact CG1-CG 4.42Å; V167-E171 PolarHBondContact O-N 2.92Å; E171-N174 PolarHBondContact O-N 3.43Å; E171-N175 VanDerWaalsContact O-CG 3.26Å; E171-N175 PolarHBondContact O-N 3.05Å; E171-N175 PolarHBondContact O-ND2 2.92Å; E171-N175 VanDerWaalsContact O-ND2 3.16Å |
| 172 | R | 92 | Very high | 90.4 | Very high | 181 Ų | 181 | 92.6 Ų | 92.6 | 68% | 0.683 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -60.5 | -46.6 | 175.3 | -177.8 | 178.4 | 179.9 | 170.4 | 1.3 | 112 | P168 L169 M170 N174 N175 M176 | P168-R172 WeakPolarHBondContact O-CB 3.49Å; P168-R172 PolarHBondContact O-N 2.91Å; L169-R172 WeakPolarHBondContact O-CB 3.4Å; L169-R172 PolarHBondContact O-N 2.75Å; M170-R172 VanDerWaalsContact C-N 3.31Å; M170-R172 PolarHBondContact O-N 2.99Å; R172-N174 VanDerWaalsContact C-N 3.35Å; R172-N175 PolarHBondContact O-N 2.96Å; R172-M176 PolarHBondContact O-N 3.12Å |
| 173 | L | 92.3 | Very high | 90.3 | Very high | 114 Ų | 114 | 97.4 Ų | 97.4 | 60% | 0.597 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62.2 | -43.6 | 175.7 | -72.2 | 172.5 | 0 | 0 | 0 | 111.3 | L169 M170 N175 M176 | L169-L173 WeakPolarHBondContact O-CG 3.4Å; L169-L173 PolarHBondContact O-N 3.44Å; M170-L173 PolarHBondContact O-N 3.09Å; L173-N175 VanDerWaalsContact C-N 3.28Å; L173-N175 PolarHBondContact O-N 3.32Å; L173-M176 WeakPolarHBondContact O-CB 3.26Å; L173-M176 PolarHBondContact O-N 3.28Å; L173-M176 VanDerWaalsContact O-N 3.1Å |
| 174 | N | 92.9 | Very high | 90.1 | Very high | 22 Ų | 22 | 104.4 Ų | 104.4 | 12% | 0.118 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -59.7 | -39.2 | 178.7 | -165 | 41.3 | 0 | 0 | 0 | 112.1 | M170 E171 R172 M176 L177 L183 | M170-N174 WeakPolarHBondContact O-CB 3.47Å; M170-N174 PolarHBondContact O-N 2.96Å; E171-N174 PolarHBondContact O-N 3.43Å; R172-N174 VanDerWaalsContact C-N 3.35Å; N174-M176 PolarHBondContact O-N 3.42Å; N174-L177 WeakPolarHBondContact O-CB 3.19Å; N174-L177 PolarHBondContact O-N 3.31Å; N174-L183 PolarHBondContact ND2-O 3.35Å; N174-L183 WeakPolarHBondContact OD1-CB 3.37Å; N174-L183 PolarHBondContact OD1-N 2.9Å |
| 175 | N | 90.8 | Very high | 89.6 | Confident | 99 Ų | 99 | 104.8 Ų | 104.8 | 53% | 0.529 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -69.7 | -18.9 | 178.8 | -72.5 | -31.2 | 0 | 0 | 0 | 114.1 | E171 R172 L173 L177 R182 | E171-N175 VanDerWaalsContact O-CG 3.26Å; E171-N175 PolarHBondContact O-N 3.05Å; E171-N175 PolarHBondContact O-ND2 2.92Å; E171-N175 VanDerWaalsContact O-ND2 3.16Å; R172-N175 PolarHBondContact O-N 2.96Å; L173-N175 VanDerWaalsContact C-N 3.28Å; L173-N175 PolarHBondContact O-N 3.32Å; N175-L177 VanDerWaalsContact C-N 3.33Å; N175-R182 PolarHBondContact O-NH2 3.13Å |
| 176 | M | 92.4 | Very high | 88.7 | Confident | 144 Ų | 144 | 103.3 Ų | 103.3 | 71% | 0.709 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.6 | -14.3 | 175 | -69.3 | 177.1 | 43.5 | 0 | 0 | 113.4 | R172 L173 N174 | R172-M176 PolarHBondContact O-N 3.12Å; L173-M176 WeakPolarHBondContact O-CB 3.26Å; L173-M176 PolarHBondContact O-N 3.28Å; L173-M176 VanDerWaalsContact O-N 3.1Å; N174-M176 PolarHBondContact O-N 3.42Å |
| 177 | L | 90.8 | Very high | 87.5 | Confident | 62 Ų | 62 | 103.2 Ų | 103.2 | 33% | 0.325 | 53% | 0.531 | S | S | . | . | S | Bend | trans | -74.4 | 151.3 | 174.7 | -77.1 | 128.9 | 0 | 0 | 0 | 111.6 | N174 N175 E181 R182 | N174-L177 WeakPolarHBondContact O-CB 3.19Å; N174-L177 PolarHBondContact O-N 3.31Å; N175-L177 VanDerWaalsContact C-N 3.33Å; L177-E181 HydrophobicContact CB-CB 4.5Å; L177-E181 HydrophobicContact CD2-CB 4.02Å; L177-R182 HydrophobicContact CB-CG 4.31Å; L177-R182 PolarHBondContact O-NE 2.99Å |
| 178 | P | 92.9 | Very high | 86.2 | Confident | 75 Ų | 75 | 105.1 Ų | 105.1 | 49% | 0.487 | 54% | 0.539 | S | S | . | . | trans | -53.8 | 147.1 | 167.5 | -20.3 | 31.1 | 0 | 0 | 0 | 110.9 | S180 E181 R182 | P178-S180 PolarHBondContact O-N 2.96Å; P178-E181 PolarHBondContact O-N 3.45Å; P178-R182 PolarHBondContact O-N 3.03Å | ||
| 179 | E | 85.3 | Confident | 84.7 | Confident | 162 Ų | 162 | 112.3 Ų | 112.3 | 76% | 0.757 | 56% | 0.557 | S | S | * | * | G | 310 helix | trans | -56 | -31.5 | -174.4 | -76 | -177.8 | 162.5 | 0 | 0 | 114 | E181 R182 | E179-E181 PolarHBondContact O-N 3.37Å; E179-R182 IonicContact OE1-NH1 3.89Å |
| 180 | S | 88.6 | Confident | 82.9 | Confident | 111 Ų | 111 | 111 Ų | 111 | 78% | 0.776 | 56% | 0.558 | S | S | * | * | G | 310 helix | trans | -69.3 | -16.5 | 176.9 | 52.8 | 0 | 0 | 0 | 0 | 114.5 | P178 | P178-S180 PolarHBondContact O-N 2.96Š|
| 181 | E | 89.8 | Confident | 81.2 | Confident | 120 Ų | 120 | 113.3 Ų | 113.3 | 56% | 0.561 | 57% | 0.571 | S | S | * | * | G | 310 helix | trans | -118 | 4.6 | -173.3 | -62 | -177.1 | 175.1 | 0 | 0 | 113.1 | L177 P178 E179 L183 | L177-E181 HydrophobicContact CB-CB 4.5Å; L177-E181 HydrophobicContact CD2-CB 4.02Å; P178-E181 PolarHBondContact O-N 3.45Å; E179-E181 PolarHBondContact O-N 3.37Å; E181-L183 PolarHBondContact O-N 2.97Å |
| 182 | R | 91.3 | Very high | 80 | Confident | 109 Ų | 109 | 111.5 Ų | 111.5 | 41% | 0.411 | 57% | 0.565 | S | S | . | * | P | Polyproline II helix | trans | -68.9 | 133.3 | 178.4 | -69.3 | -175 | 174.6 | 162.4 | -5.3 | 111 | N175 L177 P178 E179 | N175-R182 PolarHBondContact O-NH2 3.13Å; L177-R182 HydrophobicContact CB-CG 4.31Å; L177-R182 PolarHBondContact O-NE 2.99Å; P178-R182 PolarHBondContact O-N 3.03Å; E179-R182 IonicContact OE1-NH1 3.89Å |
| 183 | L | 87.3 | Confident | 78.5 | Confident | 128 Ų | 128 | 106.1 Ų | 106.1 | 67% | 0.67 | 56% | 0.556 | S | S | * | * | P | Polyproline II helix | trans | -77 | 157.5 | 174.2 | -59.3 | 171.6 | 0 | 0 | 0 | 111 | N174 E181 | N174-L183 PolarHBondContact ND2-O 3.35Å; N174-L183 WeakPolarHBondContact OD1-CB 3.37Å; N174-L183 PolarHBondContact OD1-N 2.9Å; E181-L183 PolarHBondContact O-N 2.97Å |
| 184 | E | 82.3 | Confident | 77.1 | Confident | 182 Ų | 182 | 106.6 Ų | 106.6 | 85% | 0.85 | 56% | 0.558 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 146.6 | 171.6 | -67.5 | -168.4 | 170.4 | 0 | 0 | 111.5 | F186 | E184-F186 PolarHBondContact O-N 3.29Š|
| 185 | P | 77.3 | Confident | 75.9 | Confident | 105 Ų | 105 | 109 Ų | 109 | 68% | 0.682 | 57% | 0.566 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 129.4 | 175.5 | -23.9 | 33.3 | 0 | 0 | 0 | 111.4 | S187 | P185-S187 PolarHBondContact O-N 3.16Š|
| 186 | F | 73.1 | Confident | 74.7 | Confident | 97 Ų | 97 | 112.5 Ų | 112.5 | 43% | 0.425 | 57% | 0.572 | S | S | . | * | P | Polyproline II helix | trans | -68.5 | 127 | 179.3 | 178 | -95.5 | 0 | 0 | 0 | 111.2 | V167 M170 E184 M188 | V167-F186 HydrophobicContact CG2-CD1 3.87Å; V167-F186 HydrophobicContact CG2-CE1 4.15Å; M170-F186 HydrophobicContact CE-CB 3.15Å; M170-F186 HydrophobicContact CE-CD1 4.24Å; M170-F186 HydrophobicContact CE-CD2 3.92Å; M170-F186 HydrophobicContact CE-CG 3.53Å; E184-F186 PolarHBondContact O-N 3.29Å; F186-M188 HydrophobicContact CE1-CB 4.07Å; F186-M188 HydrophobicContact CE1-CE 3.74Å; F186-M188 HydrophobicContact CZ-CB 4.43Å; F186-M188 HydrophobicContact CZ-CE 3.54Å |
| 187 | S | 66.3 | Low | 73.6 | Confident | 82 Ų | 82 | 109.7 Ų | 109.7 | 57% | 0.573 | 57% | 0.566 | S | S | * | * | trans | -130.3 | 119 | 179.1 | 84.4 | 0 | 0 | 0 | 0 | 112.1 | P185 | P185-S187 PolarHBondContact O-N 3.16Š| ||
| 188 | M | 63.5 | Low | 72.7 | Confident | 72 Ų | 72 | 113.8 Ų | 113.8 | 36% | 0.355 | 58% | 0.578 | S | S | . | * | trans | -103.4 | 40.8 | 176.9 | -154.5 | -174.1 | -73.9 | 0 | 0 | 111 | I163 F186 S190 V192 | I163-M188 HydrophobicContact CD1-CE 3.51Å; I163-M188 HydrophobicContact CD1-SD 3.61Å; I163-M188 HydrophobicContact CG1-CE 3.95Å; I163-M188 HydrophobicContact CG2-CE 4.05Å; F186-M188 HydrophobicContact CE1-CB 4.07Å; F186-M188 HydrophobicContact CE1-CE 3.74Å; F186-M188 HydrophobicContact CZ-CB 4.43Å; F186-M188 HydrophobicContact CZ-CE 3.54Å; M188-S190 PolarHBondContact O-N 2.96Å; M188-V192 HydrophobicContact SD-CG2 4.33Å | ||
| 189 | R | 57.5 | Low | 71.3 | Confident | 214 Ų | 214 | 112.1 Ų | 112.1 | 81% | 0.808 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.7 | -20 | -164.5 | -76.5 | -178 | -175.1 | -131 | 1.6 | 115.6 | S193 | R189-S193 WeakPolarHBondContact O-CB 3.23Å; R189-S193 PolarHBondContact O-OG 3.3Å |
| 190 | S | 54.2 | Low | 70.6 | Confident | 82 Ų | 82 | 112 Ų | 112 | 57% | 0.573 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.2 | -37.6 | -172 | 88.4 | 0 | 0 | 0 | 0 | 114.6 | M188 S193 L194 | M188-S190 PolarHBondContact O-N 2.96Å; S190-S193 PolarHBondContact O-OG 3.1Å; S190-L194 WeakPolarHBondContact O-CB 3.33Å; S190-L194 VanDerWaalsContact O-CD1 3.23Å; S190-L194 WeakPolarHBondContact O-CD1 3.47Å |
| 191 | L | 55.8 | Low | 69.7 | Low | 131 Ų | 131 | 111.7 Ų | 111.7 | 69% | 0.686 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -81.4 | -40 | -173.7 | -81.1 | 164.4 | 0 | 0 | 0 | 113.5 | Y195 | L191-Y195 WeakPolarHBondContact O-CB 3.5Å; L191-Y195 PolarHBondContact O-N 3.46Å; L191-Y195 VanDerWaalsContact O-N 3.12Å |
| 192 | V | 63.1 | Low | 68.4 | Low | 49 Ų | 49 | 108.6 Ų | 108.6 | 30% | 0.297 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -74.7 | -35.9 | -175.8 | -177.6 | 0 | 0 | 0 | 0 | 111.5 | M188 R196 | M188-V192 HydrophobicContact SD-CG2 4.33Å; V192-R196 WeakPolarHBondContact O-CB 3.42Å; V192-R196 PolarHBondContact O-N 3.4Å |
| 193 | S | 61.9 | Low | 66.3 | Low | 68 Ų | 68 | 112.2 Ų | 112.2 | 48% | 0.476 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -70.3 | -44.4 | 178.7 | 60.3 | 0 | 0 | 0 | 0 | 111.9 | R189 S190 R196 S197 | R189-S193 WeakPolarHBondContact O-CB 3.23Å; R189-S193 PolarHBondContact O-OG 3.3Å; S190-S193 PolarHBondContact O-OG 3.1Å; S193-R196 PolarHBondContact O-N 2.86Å; S193-S197 WeakPolarHBondContact O-CB 3.34Å; S193-S197 PolarHBondContact O-N 3.29Å |
| 194 | L | 61.9 | Low | 65.3 | Low | 125 Ų | 125 | 111.5 Ų | 111.5 | 65% | 0.654 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -62.1 | -44.8 | 174.3 | -101.2 | 126.1 | 0 | 0 | 0 | 112 | S190 S197 W198 | S190-L194 WeakPolarHBondContact O-CB 3.33Å; S190-L194 VanDerWaalsContact O-CD1 3.23Å; S190-L194 WeakPolarHBondContact O-CD1 3.47Å; L194-S197 PolarHBondContact O-N 2.8Å; L194-W198 WeakPolarHBondContact O-CB 3.39Å; L194-W198 PolarHBondContact O-N 3.21Å |
| 195 | Y | 67.2 | Low | 64.4 | Low | 72 Ų | 72 | 107.7 Ų | 107.7 | 28% | 0.282 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -65.6 | -41.7 | 177.7 | -175.9 | -104.2 | 0 | 0 | 0 | 112.3 | S153 L156 L191 S197 W198 L199 | S153-Y195 WeakPolarHBondContact CA-OH 3.41Å; S153-Y195 PolarHBondContact OG-OH 3.35Å; S153-Y195 VanDerWaalsContact OG-OH 3.12Å; L156-Y195 HydrophobicContact CB-CE1 4.47Å; L156-Y195 HydrophobicContact CD1-CD2 4.22Å; L156-Y195 HydrophobicContact CD1-CE1 3.97Å; L156-Y195 HydrophobicContact CD1-CE2 3.57Å; L156-Y195 VanDerWaalsContact CD1-CZ 3.42Å; L191-Y195 WeakPolarHBondContact O-CB 3.5Å; L191-Y195 PolarHBondContact O-N 3.46Å; L191-Y195 VanDerWaalsContact O-N 3.12Å; Y195-S197 VanDerWaalsContact C-N 3.28Å; Y195-S197 PolarHBondContact O-N 3.02Å; Y195-W198 HydrophobicContact CE2-CE3 4.33Å; Y195-W198 PolarHBondContact O-N 3.31Å; Y195-L199 HydrophobicContact CE1-CD1 3.87Å; Y195-L199 HydrophobicContact CE2-CD1 4.19Å; Y195-L199 WeakPolarHBondContact O-CB 3.32Å; Y195-L199 PolarHBondContact O-N 2.79Å; Y195-L199 WeakPolarHBondContact OH-CD1 3.44Å |
| 196 | R | 65.9 | Low | 63.7 | Low | 172 Ų | 172 | 107.9 Ų | 107.9 | 65% | 0.649 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -63.8 | -34.1 | 176.5 | -168.1 | -178.4 | -116 | -125.7 | 0.5 | 112 | V192 S193 K200 | V192-R196 WeakPolarHBondContact O-CB 3.42Å; V192-R196 PolarHBondContact O-N 3.4Å; S193-R196 PolarHBondContact O-N 2.86Å; R196-K200 WeakPolarHBondContact O-CG 3.5Å; R196-K200 PolarHBondContact O-N 3.5Å |
| 197 | S | 69.1 | Low | 63.1 | Low | 85 Ų | 85 | 108.5 Ų | 108.5 | 59% | 0.594 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -71.8 | -40.4 | 174 | -134.3 | 0 | 0 | 0 | 0 | 111.9 | S193 L194 Y195 S201 | S193-S197 WeakPolarHBondContact O-CB 3.34Å; S193-S197 PolarHBondContact O-N 3.29Å; L194-S197 PolarHBondContact O-N 2.8Å; Y195-S197 VanDerWaalsContact C-N 3.28Å; Y195-S197 PolarHBondContact O-N 3.02Å; S197-S201 PolarHBondContact O-N 3.26Å |
| 198 | W | 72.2 | Confident | 62.9 | Low | 148 Ų | 148 | 110.2 Ų | 110.2 | 56% | 0.561 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65.9 | -44.1 | 176.7 | -171.7 | 84.2 | 0 | 0 | 0 | 112.2 | L194 Y195 K200 S201 A202 | L194-W198 WeakPolarHBondContact O-CB 3.39Å; L194-W198 PolarHBondContact O-N 3.21Å; Y195-W198 HydrophobicContact CE2-CE3 4.33Å; Y195-W198 PolarHBondContact O-N 3.31Å; W198-K200 VanDerWaalsContact C-N 3.33Å; W198-K200 PolarHBondContact O-N 3.34Å; W198-S201 PolarHBondContact O-N 3.06Å; W198-A202 WeakPolarHBondContact O-CB 3.39Å; W198-A202 PolarHBondContact O-N 2.88Å |
| 199 | L | 64.8 | Low | 62.9 | Low | 41 Ų | 41 | 112.7 Ų | 112.7 | 22% | 0.215 | 57% | 0.566 | C | S | . | * | H | α-helix | trans | -64.2 | -35.9 | 179.8 | -148.8 | 90.8 | 0 | 0 | 0 | 112.8 | Y195 S201 | Y195-L199 HydrophobicContact CE1-CD1 3.87Å; Y195-L199 HydrophobicContact CE2-CD1 4.19Å; Y195-L199 WeakPolarHBondContact O-CB 3.32Å; Y195-L199 PolarHBondContact O-N 2.79Å; Y195-L199 WeakPolarHBondContact OH-CD1 3.44Å; L199-S201 VanDerWaalsContact C-N 3.26Å; L199-S201 PolarHBondContact O-N 3.37Å |
| 200 | K | 68.9 | Low | 63.3 | Low | 158 Ų | 158 | 105.5 Ų | 105.5 | 69% | 0.687 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -72.7 | -16.4 | 174.7 | -78.3 | -176.7 | 174.9 | -169.4 | 0 | 113.9 | R196 W198 | R196-K200 WeakPolarHBondContact O-CG 3.5Å; R196-K200 PolarHBondContact O-N 3.5Å; W198-K200 VanDerWaalsContact C-N 3.33Å; W198-K200 PolarHBondContact O-N 3.34Å |
| 201 | S | 69.6 | Low | 64 | Low | 105 Ų | 105 | 107.3 Ų | 107.3 | 73% | 0.734 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -98.8 | -18.7 | 179.3 | -172.2 | 0 | 0 | 0 | 0 | 112.5 | S197 W198 L199 | S197-S201 PolarHBondContact O-N 3.26Å; W198-S201 PolarHBondContact O-N 3.06Å; L199-S201 VanDerWaalsContact C-N 3.26Å; L199-S201 PolarHBondContact O-N 3.37Å |
| 202 | A | 62.3 | Low | 64.7 | Low | 55 Ų | 55 | 105.3 Ų | 105.3 | 46% | 0.455 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -93.7 | -13.8 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | W198 | W198-A202 WeakPolarHBondContact O-CB 3.39Å; W198-A202 PolarHBondContact O-N 2.88Å |
| 203 | F | 48.9 | Very low | 64.8 | Low | 186 Ų | 186 | 110.5 Ų | 110.5 | 82% | 0.816 | 56% | 0.557 | S | S | * | * | trans | -134.7 | 0 | 176.1 | -71.9 | -84.2 | 0 | 0 | 0 | 109.4 |
Retrieved 203 of 203 residues in 73.2 ms
(Link to these results)