| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 34.5 | Very low | 30.3 | Very low | 232 Ų | 232 | 175.1 Ų | 175.1 | 100% | 1.143 | 85% | 0.853 | S | S | * | * | 0 | 103.8 | 0 | -74.5 | 167 | 156.5 | 0 | 0 | 107.1 | |||||
| 2 | S | 31 | Very low | 30.3 | Very low | 103 Ų | 103 | 171.6 Ų | 171.6 | 72% | 0.72 | 85% | 0.849 | S | S | * | * | 63.2 | 128 | 78.7 | 68.1 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 3 | Q | 31.8 | Very low | 30.3 | Very low | 157 Ų | 157 | 169.8 Ų | 169.8 | 73% | 0.734 | 84% | 0.843 | S | S | * | * | cis | -172.3 | 141.7 | -4.4 | -136 | -177.6 | -23.4 | 0 | 0 | 109.3 | ||||
| 4 | H | 31.8 | Very low | 30.1 | Very low | 158 Ų | 158 | 166.6 Ų | 166.6 | 73% | 0.731 | 85% | 0.846 | S | S | * | * | trans | 58.1 | 161.8 | 155 | -64.8 | -42.1 | 0 | 0 | 0 | 119.3 | ||||
| 5 | R | 28.3 | Very low | 30.2 | Very low | 229 Ų | 229 | 161.8 Ų | 161.8 | 86% | 0.864 | 83% | 0.834 | S | S | * | * | cis | -151 | 159.6 | 4.3 | -144.5 | 173.2 | -176.8 | 173.8 | 0.5 | 111.4 | ||||
| 6 | H | 31.5 | Very low | 30.2 | Very low | 181 Ų | 181 | 158.6 Ų | 158.6 | 84% | 0.838 | 83% | 0.83 | S | S | * | * | trans | -56.9 | 151.1 | 170.2 | -71.2 | -90.4 | 0 | 0 | 0 | 114.7 | ||||
| 7 | Q | 27.4 | Very low | 30.7 | Very low | 191 Ų | 191 | 156.1 Ų | 156.1 | 89% | 0.893 | 83% | 0.825 | S | S | * | * | -151.4 | 134.3 | 127.5 | -144.4 | 164.9 | 3.5 | 0 | 0 | 111.9 | |||||
| 8 | S | 28.1 | Very low | 30.6 | Very low | 107 Ų | 107 | 154.9 Ų | 154.9 | 75% | 0.748 | 83% | 0.825 | S | S | * | * | trans | -103.5 | 139.3 | 177.6 | 44.2 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 9 | Q | 28.2 | Very low | 30.5 | Very low | 193 Ų | 193 | 155.4 Ų | 155.4 | 90% | 0.902 | 83% | 0.828 | S | S | * | * | trans | -139 | 110.3 | 166.4 | -79 | -172.1 | -16.7 | 0 | 0 | 109.5 | ||||
| 10 | S | 30 | Very low | 30.8 | Very low | 123 Ų | 123 | 154.1 Ų | 154.1 | 86% | 0.86 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 140.1 | 167.1 | 42.4 | 0 | 0 | 0 | 0 | 110 | ||
| 11 | R | 30.1 | Very low | 30.9 | Very low | 252 Ų | 252 | 153.4 Ų | 153.4 | 95% | 0.951 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 142.7 | 179.7 | -76.4 | -176.5 | -172.4 | 159.6 | 4.9 | 112.4 | ||
| 12 | V | 30.9 | Very low | 30.7 | Very low | 133 Ų | 133 | 148.2 Ų | 148.2 | 81% | 0.806 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 142.6 | 162.8 | 172.5 | 0 | 0 | 0 | 0 | 110.5 | ||
| 13 | L | 29.8 | Very low | 30.9 | Very low | 148 Ų | 148 | 150.5 Ų | 150.5 | 78% | 0.775 | 82% | 0.823 | S | S | * | * | 173.9 | 115.4 | 117.6 | -163.3 | 76.3 | 0 | 0 | 0 | 113.6 | |||||
| 14 | S | 27.4 | Very low | 31.2 | Very low | 125 Ų | 125 | 146 Ų | 146 | 87% | 0.874 | 82% | 0.819 | S | S | * | * | trans | -163.8 | 81.1 | 146.5 | 49.8 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 15 | S | 31.9 | Very low | 31 | Very low | 95 Ų | 95 | 148.4 Ų | 148.4 | 66% | 0.664 | 83% | 0.828 | S | S | * | * | trans | -72.2 | 154.8 | 154.1 | 48 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 16 | S | 31.3 | Very low | 31.3 | Very low | 111 Ų | 111 | 142.3 Ų | 142.3 | 78% | 0.776 | 82% | 0.819 | S | S | * | * | cis | -173.1 | -169.3 | -2.2 | -93.2 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 17 | P | 38.3 | Very low | 31.7 | Very low | 115 Ų | 115 | 139 Ų | 139 | 75% | 0.747 | 81% | 0.814 | S | S | * | * | cis | -134.4 | 174.7 | 0.2 | 41.6 | -24.1 | 0 | 0 | 0 | 115.6 | ||||
| 18 | V | 28.3 | Very low | 32.1 | Very low | 136 Ų | 136 | 134.6 Ų | 134.6 | 82% | 0.824 | 80% | 0.8 | S | S | * | * | trans | 162.6 | 83.8 | 133.5 | 164.2 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 19 | D | 29.3 | Very low | 32.7 | Very low | 164 Ų | 164 | 138 Ų | 138 | 88% | 0.877 | 80% | 0.801 | S | S | * | * | trans | -134.3 | 83.4 | -179.9 | -122.6 | -26 | 0 | 0 | 0 | 108.6 | ||||
| 20 | T | 35.3 | Very low | 33.2 | Very low | 128 Ų | 128 | 136.6 Ų | 136.6 | 79% | 0.785 | 79% | 0.792 | S | S | * | * | trans | -153.9 | 133.6 | 161.9 | 14.6 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 21 | T | 34.5 | Very low | 34 | Very low | 141 Ų | 141 | 137.2 Ų | 137.2 | 87% | 0.865 | 79% | 0.791 | S | S | * | * | trans | 78.6 | 76.2 | 178.1 | 79.6 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 22 | S | 30.3 | Very low | 34.8 | Very low | 122 Ų | 122 | 134.6 Ų | 134.6 | 85% | 0.853 | 79% | 0.787 | S | S | * | * | -156.1 | 113.7 | 113.6 | 51.7 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 23 | V | 35.2 | Very low | 35.8 | Very low | 151 Ų | 151 | 137.5 Ų | 137.5 | 92% | 0.915 | 79% | 0.789 | S | S | * | * | trans | -79.6 | 122.9 | -178.7 | 173.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 24 | G | 36.7 | Very low | 37.2 | Very low | 62 Ų | 62 | 135.7 Ų | 135.7 | 64% | 0.639 | 77% | 0.771 | S | S | * | * | trans | 68.7 | 77 | 145.3 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 25 | F | 29 | Very low | 38.7 | Very low | 210 Ų | 210 | 139.2 Ų | 139.2 | 92% | 0.921 | 77% | 0.771 | S | S | * | * | trans | -119.6 | 74.1 | 148.8 | -110.5 | -91.3 | 0 | 0 | 0 | 110.5 | ||||
| 26 | C | 33.6 | Very low | 40.7 | Very low | 101 Ų | 101 | 138.4 Ų | 138.4 | 68% | 0.682 | 76% | 0.759 | S | S | * | * | trans | -70.5 | 124.6 | 170.1 | -172.9 | 0 | 0 | 0 | 0 | 109 | T28 | C26-T28 VanDerWaalsContact C-N 3.27Å; C26-T28 PolarHBondContact O-N 3.27Å; C26-T28 PolarHBondContact O-OG1 3.49Å | ||
| 27 | P | 39.2 | Very low | 42.8 | Very low | 112 Ų | 112 | 136.8 Ų | 136.8 | 73% | 0.727 | 74% | 0.742 | S | S | * | * | trans | -73.1 | 81.7 | -174.8 | 30.8 | -35.8 | 0 | 0 | 0 | 110.3 | F29 | P27-F29 PolarHBondContact O-N 2.81Š| ||
| 28 | T | 37.6 | Very low | 44.8 | Very low | 98 Ų | 98 | 139.6 Ų | 139.6 | 60% | 0.601 | 75% | 0.745 | S | S | * | * | trans | -80 | 51.3 | 179.3 | -48 | 0 | 0 | 0 | 0 | 110.7 | C26 K30 | C26-T28 VanDerWaalsContact C-N 3.27Å; C26-T28 PolarHBondContact O-N 3.27Å; C26-T28 PolarHBondContact O-OG1 3.49Å; T28-K30 HydrophobicContact CG2-CD 4.26Å; T28-K30 HydrophobicContact CG2-CG 3.93Å; T28-K30 PolarHBondContact O-N 3.39Å | ||
| 29 | F | 40.6 | Very low | 47.3 | Very low | 179 Ų | 179 | 136 Ų | 136 | 79% | 0.785 | 73% | 0.726 | S | S | * | * | trans | -71.4 | 72.1 | 156.2 | -89.9 | -77.4 | 0 | 0 | 0 | 108.2 | P27 T31 | P27-F29 PolarHBondContact O-N 2.81Å; F29-T31 PolarHBondContact O-N 2.92Å | ||
| 30 | K | 38.3 | Very low | 49.9 | Very low | 163 Ų | 163 | 132 Ų | 132 | 71% | 0.709 | 70% | 0.698 | S | S | * | * | trans | -49 | 116.6 | 162.9 | -86.3 | 173 | 177.6 | 175.2 | 0 | 106.9 | T28 F32 | T28-K30 HydrophobicContact CG2-CD 4.26Å; T28-K30 HydrophobicContact CG2-CG 3.93Å; T28-K30 PolarHBondContact O-N 3.39Å; K30-F32 VanDerWaalsContact C-N 3.29Å; K30-F32 PolarHBondContact O-N 3.09Å | ||
| 31 | T | 46.3 | Very low | 52.2 | Low | 136 Ų | 136 | 128.7 Ų | 128.7 | 83% | 0.834 | 68% | 0.684 | S | S | * | * | trans | -60.6 | 97 | 166.9 | 33.8 | 0 | 0 | 0 | 0 | 107.5 | F29 K33 | F29-T31 PolarHBondContact O-N 2.92Å; T31-K33 VanDerWaalsContact C-N 3.29Å; T31-K33 PolarHBondContact O-N 3.21Å | ||
| 32 | F | 47.2 | Very low | 54.7 | Low | 196 Ų | 196 | 128.4 Ų | 128.4 | 86% | 0.86 | 67% | 0.671 | S | S | * | * | trans | -63.6 | 92.5 | 178.4 | -124.2 | -89.8 | 0 | 0 | 0 | 107.8 | K30 R34 | K30-F32 VanDerWaalsContact C-N 3.29Å; K30-F32 PolarHBondContact O-N 3.09Å; F32-R34 PolarHBondContact O-N 3.34Å | ||
| 33 | K | 51.2 | Low | 57.3 | Low | 195 Ų | 195 | 123.7 Ų | 123.7 | 85% | 0.848 | 64% | 0.637 | S | S | * | * | trans | -74.4 | 81.1 | -178.7 | -156.7 | 176.3 | -175.3 | -176.6 | 0 | 108.3 | T31 | T31-K33 VanDerWaalsContact C-N 3.29Å; T31-K33 PolarHBondContact O-N 3.21Å | ||
| 34 | R | 59 | Low | 59.8 | Low | 109 Ų | 109 | 120.4 Ų | 120.4 | 41% | 0.411 | 61% | 0.61 | S | S | . | * | trans | -62.4 | 129.9 | -174.7 | -158.6 | 177 | -169.7 | 172.8 | 6.6 | 109.4 | F32 D36 Y103 | F32-R34 PolarHBondContact O-N 3.34Å; R34-D36 PolarHBondContact O-N 3.42Å; R34-Y103 PolarHBondContact NH1-O 3.35Å; R34-Y103 VanDerWaalsContact NH2-CE2 3.3Å | ||
| 35 | K | 59.3 | Low | 62.3 | Low | 199 Ų | 199 | 125.2 Ų | 125.2 | 87% | 0.865 | 61% | 0.614 | S | S | * | * | S | Bend | trans | -66.5 | -19.9 | -173.7 | -92.6 | -177 | 170.6 | -178 | 0 | 114.7 | D37 | K35-D37 VanDerWaalsContact C-N 3.26Å; K35-D37 PolarHBondContact O-N 2.87Å |
| 36 | D | 74.2 | Confident | 65.1 | Low | 79 Ų | 79 | 117.5 Ų | 117.5 | 42% | 0.422 | 58% | 0.584 | S | S | . | * | trans | -88.4 | 47.7 | -168.8 | -41.8 | -52.6 | 0 | 0 | 0 | 112.9 | R34 E38 C39 R40 | R34-D36 PolarHBondContact O-N 3.42Å; D36-E38 VanDerWaalsContact C-N 3.32Å; D36-E38 PolarHBondContact O-N 3.47Å; D36-C39 HydrophobicContact CB-CB 4.23Å; D36-C39 PolarHBondContact O-N 3.17Å; D36-R40 WeakPolarHBondContact O-CB 3.42Å; D36-R40 PolarHBondContact O-N 3.5Å | ||
| 37 | D | 76.2 | Confident | 67.6 | Low | 77 Ų | 77 | 113.6 Ų | 113.6 | 41% | 0.412 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -59 | -40.4 | -177.2 | -82.5 | -46 | 0 | 0 | 0 | 112.5 | K35 R40 A41 | K35-D37 VanDerWaalsContact C-N 3.26Å; K35-D37 PolarHBondContact O-N 2.87Å; D37-R40 IonicContact OD1-CZ 3.41Å; D37-R40 IonicContact OD1-NH1 2.58Å; D37-R40 PolarHBondContact OD1-NH1 2.76Å; D37-R40 IonicContact OD1-NH2 2.6Å; D37-R40 PolarHBondContact OD1-NH2 3.23Å; D37-A41 WeakPolarHBondContact O-CB 3.32Å; D37-A41 PolarHBondContact O-N 2.97Å |
| 38 | E | 80.4 | Confident | 69.7 | Low | 173 Ų | 173 | 113.9 Ų | 113.9 | 81% | 0.808 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -68.2 | -45.8 | 179.3 | -63.8 | -176.2 | 171.6 | 0 | 0 | 112.6 | D36 A41 F42 | D36-E38 VanDerWaalsContact C-N 3.32Å; D36-E38 PolarHBondContact O-N 3.47Å; E38-A41 PolarHBondContact O-N 3.48Å; E38-F42 PolarHBondContact O-N 3.19Å |
| 39 | C | 79.9 | Confident | 72.2 | Confident | 62 Ų | 62 | 111 Ų | 111 | 42% | 0.419 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.5 | -42.9 | 176.3 | -176.1 | 0 | 0 | 0 | 0 | 110.8 | D36 A41 F42 V43 | D36-C39 HydrophobicContact CB-CB 4.23Å; D36-C39 PolarHBondContact O-N 3.17Å; C39-A41 VanDerWaalsContact C-N 3.33Å; C39-A41 PolarHBondContact O-N 3.39Å; C39-F42 PolarHBondContact O-N 3.01Å; C39-V43 WeakPolarHBondContact O-CG2 3.46Å; C39-V43 PolarHBondContact O-N 3Å |
| 40 | R | 83.6 | Confident | 74.5 | Confident | 79 Ų | 79 | 112.3 Ų | 112.3 | 30% | 0.298 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -58.9 | -44.2 | 172.6 | -171.6 | -173.9 | 67.6 | -111.6 | -3.4 | 111.3 | D36 D37 K44 V104 | D36-R40 WeakPolarHBondContact O-CB 3.42Å; D36-R40 PolarHBondContact O-N 3.5Å; D37-R40 IonicContact OD1-CZ 3.41Å; D37-R40 IonicContact OD1-NH1 2.58Å; D37-R40 PolarHBondContact OD1-NH1 2.76Å; D37-R40 IonicContact OD1-NH2 2.6Å; D37-R40 PolarHBondContact OD1-NH2 3.23Å; R40-K44 WeakPolarHBondContact O-CB 3.45Å; R40-K44 PolarHBondContact O-N 2.9Å; R40-V104 VanDerWaalsContact CD-O 3.29Å; R40-V104 WeakPolarHBondContact CD-O 3.23Å; R40-V104 HydrophobicContact CG-CB 4.42Å; R40-V104 HydrophobicContact CG-CG1 4.06Å; R40-V104 HydrophobicContact CG-CG2 4.38Å |
| 41 | A | 84.4 | Confident | 77 | Confident | 58 Ų | 58 | 112.3 Ų | 112.3 | 48% | 0.479 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.3 | -41.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | D37 E38 C39 K45 | D37-A41 WeakPolarHBondContact O-CB 3.32Å; D37-A41 PolarHBondContact O-N 2.97Å; E38-A41 PolarHBondContact O-N 3.48Å; C39-A41 VanDerWaalsContact C-N 3.33Å; C39-A41 PolarHBondContact O-N 3.39Å; A41-K45 WeakPolarHBondContact O-CB 3.44Å; A41-K45 PolarHBondContact O-N 3.5Å |
| 42 | F | 86.3 | Confident | 79 | Confident | 136 Ų | 136 | 107.3 Ų | 107.3 | 60% | 0.596 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.4 | -53.2 | 174.7 | -179.2 | -96.7 | 0 | 0 | 0 | 112 | E38 C39 K44 K45 V46 | E38-F42 PolarHBondContact O-N 3.19Å; C39-F42 PolarHBondContact O-N 3.01Å; F42-K44 VanDerWaalsContact C-N 3.31Å; F42-K44 PolarHBondContact O-N 3.16Å; F42-K45 WeakPolarHBondContact O-CB 3.19Å; F42-K45 PolarHBondContact O-N 3.47Å; F42-K45 VanDerWaalsContact O-N 3.08Å; F42-V46 HydrophobicContact CD1-CG2 4.27Å; F42-V46 HydrophobicContact CE1-CG2 3.87Å; F42-V46 HydrophobicContact CZ-CG2 4.02Å; F42-V46 WeakPolarHBondContact O-CG2 3.44Å; F42-V46 PolarHBondContact O-N 3.19Å |
| 43 | V | 86.2 | Confident | 81 | Confident | 23 Ų | 23 | 102.1 Ų | 102.1 | 14% | 0.139 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -60.8 | -40.7 | 179 | 177.7 | 0 | 0 | 0 | 0 | 110.8 | C39 K45 V46 I47 M100 V104 | C39-V43 WeakPolarHBondContact O-CG2 3.46Å; C39-V43 PolarHBondContact O-N 3Å; V43-K45 VanDerWaalsContact C-N 3.35Å; V43-K45 PolarHBondContact O-N 3.22Å; V43-V46 PolarHBondContact O-N 2.98Å; V43-I47 HydrophobicContact CG1-CD1 3.91Å; V43-I47 HydrophobicContact CG1-CG1 4.38Å; V43-I47 WeakPolarHBondContact O-CG1 3.44Å; V43-I47 PolarHBondContact O-N 2.9Å; V43-M100 HydrophobicContact CG1-CB 3.92Å; V43-M100 HydrophobicContact CG1-CG 4.2Å; V43-V104 HydrophobicContact CB-CG2 3.93Å; V43-V104 HydrophobicContact CG1-CG2 3.56Å |
| 44 | K | 86.9 | Confident | 82.9 | Confident | 82 Ų | 82 | 97.5 Ų | 97.5 | 36% | 0.357 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61.8 | -39.9 | 174.5 | -169.4 | 163.9 | -171.8 | 145.3 | 0 | 112.1 | R40 F42 M48 V104 D105 | R40-K44 WeakPolarHBondContact O-CB 3.45Å; R40-K44 PolarHBondContact O-N 2.9Å; F42-K44 VanDerWaalsContact C-N 3.31Å; F42-K44 PolarHBondContact O-N 3.16Å; K44-M48 VanDerWaalsContact O-CB 3.31Å; K44-M48 WeakPolarHBondContact O-CB 3.35Å; K44-M48 WeakPolarHBondContact O-CG 3.38Å; K44-M48 PolarHBondContact O-N 2.97Å; K44-V104 HydrophobicContact CB-CG1 3.95Å; K44-V104 HydrophobicContact CB-CG2 4.4Å; K44-V104 HydrophobicContact CD-CG1 3.86Å; K44-V104 HydrophobicContact CG-CG1 4.06Å; K44-D105 IonicContact NZ-OD1 3.76Å; K44-D105 IonicContact NZ-OD2 2.66Å; K44-D105 PolarHBondContact NZ-OD2 3.28Å |
| 45 | K | 88.1 | Confident | 84.4 | Confident | 163 Ų | 163 | 97 Ų | 97 | 71% | 0.709 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -64.3 | -40.5 | 174.4 | -172.3 | 179.2 | -178.6 | -179.5 | 0 | 111.8 | A41 F42 V43 S49 | A41-K45 WeakPolarHBondContact O-CB 3.44Å; A41-K45 PolarHBondContact O-N 3.5Å; F42-K45 WeakPolarHBondContact O-CB 3.19Å; F42-K45 PolarHBondContact O-N 3.47Å; F42-K45 VanDerWaalsContact O-N 3.08Å; V43-K45 VanDerWaalsContact C-N 3.35Å; V43-K45 PolarHBondContact O-N 3.22Å; K45-S49 PolarHBondContact O-N 3.46Å |
| 46 | V | 88.6 | Confident | 85.9 | Confident | 48 Ų | 48 | 87.7 Ų | 87.7 | 29% | 0.291 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.7 | -54.2 | 175.5 | 173.3 | 0 | 0 | 0 | 0 | 110.9 | F42 V43 M48 S49 F52 | F42-V46 HydrophobicContact CD1-CG2 4.27Å; F42-V46 HydrophobicContact CE1-CG2 3.87Å; F42-V46 HydrophobicContact CZ-CG2 4.02Å; F42-V46 WeakPolarHBondContact O-CG2 3.44Å; F42-V46 PolarHBondContact O-N 3.19Å; V43-V46 PolarHBondContact O-N 2.98Å; V46-M48 VanDerWaalsContact C-N 3.3Å; V46-M48 PolarHBondContact O-N 3.49Å; V46-S49 VanDerWaalsContact O-CB 3.3Å; V46-S49 WeakPolarHBondContact O-CB 3.49Å; V46-S49 PolarHBondContact O-N 3.03Å; V46-S49 VanDerWaalsContact O-N 3.11Å; V46-S49 PolarHBondContact O-OG 2.83Å; V46-F52 HydrophobicContact CG1-CD2 4.07Å; V46-F52 HydrophobicContact CG1-CE2 4.48Å; V46-F52 VanDerWaalsContact O-CB 3.25Å; V46-F52 WeakPolarHBondContact O-CB 3.36Å |
| 47 | I | 86.4 | Confident | 86.7 | Confident | 18 Ų | 18 | 86.6 Ų | 86.6 | 9% | 0.092 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -58.7 | -40.1 | 179.9 | -63.8 | 167.3 | 0 | 0 | 0 | 111.8 | V43 S49 M100 K101 V104 | V43-I47 HydrophobicContact CG1-CD1 3.91Å; V43-I47 HydrophobicContact CG1-CG1 4.38Å; V43-I47 WeakPolarHBondContact O-CG1 3.44Å; V43-I47 PolarHBondContact O-N 2.9Å; I47-S49 VanDerWaalsContact C-N 3.29Å; I47-S49 PolarHBondContact O-N 3.35Å; I47-M100 HydrophobicContact CD1-CB 3.94Å; I47-M100 HydrophobicContact CG1-CB 4.27Å; I47-K101 HydrophobicContact CD1-CG 4.32Å; I47-K101 HydrophobicContact CG2-CG 4.4Å; I47-V104 HydrophobicContact CD1-CG2 3.99Å |
| 48 | M | 84 | Confident | 87.4 | Confident | 118 Ų | 118 | 86.4 Ų | 86.4 | 58% | 0.581 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -75.8 | -17.1 | -178.3 | -70.1 | -63.7 | 163.8 | 0 | 0 | 113.6 | K44 V46 K53 | K44-M48 VanDerWaalsContact O-CB 3.31Å; K44-M48 WeakPolarHBondContact O-CB 3.35Å; K44-M48 WeakPolarHBondContact O-CG 3.38Å; K44-M48 PolarHBondContact O-N 2.97Å; V46-M48 VanDerWaalsContact C-N 3.3Å; V46-M48 PolarHBondContact O-N 3.49Å; M48-K53 PolarHBondContact O-NZ 3.19Å |
| 49 | S | 90.1 | Very high | 88 | Confident | 38 Ų | 38 | 78.9 Ų | 78.9 | 27% | 0.266 | 39% | 0.388 | S | S | . | . | S | Bend | trans | -61.3 | 145.3 | -177.9 | 77.5 | 0 | 0 | 0 | 0 | 112.7 | K45 V46 I47 F51 F52 K53 | K45-S49 PolarHBondContact O-N 3.46Å; V46-S49 VanDerWaalsContact O-CB 3.3Å; V46-S49 WeakPolarHBondContact O-CB 3.49Å; V46-S49 PolarHBondContact O-N 3.03Å; V46-S49 VanDerWaalsContact O-N 3.11Å; V46-S49 PolarHBondContact O-OG 2.83Å; I47-S49 VanDerWaalsContact C-N 3.29Å; I47-S49 PolarHBondContact O-N 3.35Å; S49-F51 VanDerWaalsContact C-N 3.32Å; S49-F51 PolarHBondContact O-N 3.32Å; S49-F52 WeakPolarHBondContact OG-CB 3.16Å; S49-F52 PolarHBondContact OG-N 3.06Å; S49-K53 PolarHBondContact O-N 3.31Å |
| 50 | R | 89 | Confident | 88.4 | Confident | 206 Ų | 206 | 76.2 Ų | 76.2 | 78% | 0.777 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -65.6 | -37.3 | 176.8 | -170.6 | -179.8 | -69.2 | -179.4 | -1.2 | 111.4 | K53 I54 | R50-K53 PolarHBondContact O-N 3.21Å; R50-I54 HydrophobicContact CG-CD1 4.01Å; R50-I54 WeakPolarHBondContact O-CG1 3.29Å; R50-I54 PolarHBondContact O-N 3.01Å |
| 51 | F | 89.4 | Confident | 88.7 | Confident | 164 Ų | 164 | 76 Ų | 76 | 72% | 0.719 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -60.9 | -47.4 | 177.6 | -67.3 | -74.4 | 0 | 0 | 0 | 112.4 | S49 K53 I54 I55 | S49-F51 VanDerWaalsContact C-N 3.32Å; S49-F51 PolarHBondContact O-N 3.32Å; F51-K53 VanDerWaalsContact C-N 3.31Å; F51-K53 PolarHBondContact O-N 3.05Å; F51-I54 PolarHBondContact O-N 3.28Å; F51-I54 VanDerWaalsContact O-N 3.16Å; F51-I55 WeakPolarHBondContact O-CG1 3.39Å; F51-I55 PolarHBondContact O-N 3.15Å |
| 52 | F | 89.3 | Confident | 89.1 | Confident | 31 Ų | 31 | 75.3 Ų | 75.3 | 14% | 0.136 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -58.6 | -43.5 | 177.1 | -174.6 | -101.6 | 0 | 0 | 0 | 111.8 | V46 S49 I54 I55 M56 E97 | V46-F52 HydrophobicContact CG1-CD2 4.07Å; V46-F52 HydrophobicContact CG1-CE2 4.48Å; V46-F52 VanDerWaalsContact O-CB 3.25Å; V46-F52 WeakPolarHBondContact O-CB 3.36Å; S49-F52 WeakPolarHBondContact OG-CB 3.16Å; S49-F52 PolarHBondContact OG-N 3.06Å; F52-I54 PolarHBondContact O-N 3.33Å; F52-I55 PolarHBondContact O-N 3.48Å; F52-M56 HydrophobicContact CD1-CG 4.15Å; F52-M56 HydrophobicContact CE1-CG 3.86Å; F52-M56 HydrophobicContact CE2-SD 4.44Å; F52-M56 HydrophobicContact CZ-CG 4.07Å; F52-M56 HydrophobicContact CZ-SD 4.14Å; F52-M56 WeakPolarHBondContact O-CG 3.32Å; F52-M56 PolarHBondContact O-N 3.23Å; F52-E97 HydrophobicContact CE1-CG 3.75Å; F52-E97 HydrophobicContact CZ-CB 4.22Å; F52-E97 HydrophobicContact CZ-CG 3.69Å |
| 53 | K | 88.7 | Confident | 89.2 | Confident | 87 Ų | 87 | 69.2 Ų | 69.2 | 38% | 0.378 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.8 | -40.3 | 176 | -67.4 | 172.1 | -176.8 | 167.5 | 0 | 112.8 | M48 S49 R50 F51 M56 I57 | M48-K53 PolarHBondContact O-NZ 3.19Å; S49-K53 PolarHBondContact O-N 3.31Å; R50-K53 PolarHBondContact O-N 3.21Å; F51-K53 VanDerWaalsContact C-N 3.31Å; F51-K53 PolarHBondContact O-N 3.05Å; K53-M56 PolarHBondContact O-N 3.45Å; K53-I57 WeakPolarHBondContact O-CB 3.12Å; K53-I57 WeakPolarHBondContact O-CD1 3.2Å; K53-I57 VanDerWaalsContact O-CG1 3.28Å; K53-I57 WeakPolarHBondContact O-CG1 2.96Å; K53-I57 PolarHBondContact O-N 3.43Å |
| 54 | I | 90.4 | Very high | 89.3 | Confident | 98 Ų | 98 | 69.6 Ų | 69.6 | 50% | 0.503 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -64.4 | -44.1 | 175.7 | -69.2 | 165.7 | 0 | 0 | 0 | 110.8 | R50 F51 F52 I57 S58 | R50-I54 HydrophobicContact CG-CD1 4.01Å; R50-I54 WeakPolarHBondContact O-CG1 3.29Å; R50-I54 PolarHBondContact O-N 3.01Å; F51-I54 PolarHBondContact O-N 3.28Å; F51-I54 VanDerWaalsContact O-N 3.16Å; F52-I54 PolarHBondContact O-N 3.33Å; I54-I57 PolarHBondContact O-N 2.75Å; I54-S58 VanDerWaalsContact O-CB 3.28Å; I54-S58 WeakPolarHBondContact O-CB 3.43Å; I54-S58 PolarHBondContact O-N 3.45Å |
| 55 | I | 91.6 | Very high | 89.4 | Confident | 98 Ų | 98 | 71.9 Ų | 71.9 | 50% | 0.503 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -57.7 | -52.7 | 174.8 | -68 | 165.4 | 0 | 0 | 0 | 109.5 | F51 F52 I57 S58 T59 | F51-I55 WeakPolarHBondContact O-CG1 3.39Å; F51-I55 PolarHBondContact O-N 3.15Å; F52-I55 PolarHBondContact O-N 3.48Å; I55-I57 PolarHBondContact O-N 3.31Å; I55-S58 WeakPolarHBondContact O-CB 3.5Å; I55-S58 PolarHBondContact O-N 2.71Å; I55-S58 VanDerWaalsContact O-N 3.14Å; I55-T59 WeakPolarHBondContact O-CB 3.26Å; I55-T59 PolarHBondContact O-N 2.94Å; I55-T59 PolarHBondContact O-OG1 3.34Å |
| 56 | M | 90.8 | Very high | 89.4 | Confident | 3 Ų | 3 | 67.4 Ų | 67.4 | 2% | 0.015 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -62.1 | -38.5 | -179 | -67.1 | -50.7 | -54.2 | 0 | 0 | 113.7 | F52 K53 V60 I93 E97 Y159 | F52-M56 HydrophobicContact CD1-CG 4.15Å; F52-M56 HydrophobicContact CE1-CG 3.86Å; F52-M56 HydrophobicContact CE2-SD 4.44Å; F52-M56 HydrophobicContact CZ-CG 4.07Å; F52-M56 HydrophobicContact CZ-SD 4.14Å; F52-M56 WeakPolarHBondContact O-CG 3.32Å; F52-M56 PolarHBondContact O-N 3.23Å; K53-M56 PolarHBondContact O-N 3.45Å; M56-V60 WeakPolarHBondContact O-CG2 3.42Å; M56-V60 PolarHBondContact O-N 3.46Å; M56-V60 VanDerWaalsContact O-N 3.08Å; M56-I93 HydrophobicContact CE-CG2 3.87Å; M56-I93 HydrophobicContact SD-CG2 3.76Å; M56-E97 HydrophobicContact CE-CB 3.91Å; M56-E97 HydrophobicContact CE-CG 4Å; M56-E97 WeakPolarHBondContact CE-OE2 3.49Å; M56-E97 HydrophobicContact CG-CG 4.3Å; M56-E97 HydrophobicContact SD-CB 4.18Å; M56-E97 HydrophobicContact SD-CG 4.12Å; M56-Y159 HydrophobicContact CB-CE1 3.92Å; M56-Y159 HydrophobicContact CB-CE2 4.15Å; M56-Y159 WeakPolarHBondContact CE-OH 3.4Å |
| 57 | I | 90.8 | Very high | 89.2 | Confident | 56 Ų | 56 | 66.8 Ų | 66.8 | 29% | 0.287 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -63.9 | -48.4 | 172.9 | -70.9 | 160.5 | 0 | 0 | 0 | 110.2 | K53 I54 I55 T59 V60 T61 L156 Y159 | K53-I57 WeakPolarHBondContact O-CB 3.12Å; K53-I57 WeakPolarHBondContact O-CD1 3.2Å; K53-I57 VanDerWaalsContact O-CG1 3.28Å; K53-I57 WeakPolarHBondContact O-CG1 2.96Å; K53-I57 PolarHBondContact O-N 3.43Å; I54-I57 PolarHBondContact O-N 2.75Å; I55-I57 PolarHBondContact O-N 3.31Å; I57-T59 VanDerWaalsContact C-N 3.31Å; I57-T59 PolarHBondContact O-N 3.45Å; I57-V60 PolarHBondContact O-N 3.22Å; I57-T61 PolarHBondContact O-N 2.75Å; I57-T61 PolarHBondContact O-OG1 2.86Å; I57-T61 VanDerWaalsContact O-OG1 3.13Å; I57-L156 HydrophobicContact CG1-CD1 4.29Å; I57-L156 HydrophobicContact CG2-CD1 3.96Å; I57-Y159 HydrophobicContact CD1-CG 4.44Å; I57-Y159 HydrophobicContact CG1-CD2 3.72Å; I57-Y159 HydrophobicContact CG1-CG 3.8Å |
| 58 | S | 91.5 | Very high | 89.2 | Confident | 73 Ų | 73 | 69 Ų | 69 | 51% | 0.51 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -58.6 | -42.1 | 177.9 | -179.9 | 0 | 0 | 0 | 0 | 111.8 | I54 I55 T61 S62 | I54-S58 VanDerWaalsContact O-CB 3.28Å; I54-S58 WeakPolarHBondContact O-CB 3.43Å; I54-S58 PolarHBondContact O-N 3.45Å; I55-S58 WeakPolarHBondContact O-CB 3.5Å; I55-S58 PolarHBondContact O-N 2.71Å; I55-S58 VanDerWaalsContact O-N 3.14Å; S58-T61 PolarHBondContact O-N 3.34Å; S58-S62 WeakPolarHBondContact O-CB 3.27Å; S58-S62 PolarHBondContact O-N 3.11Å |
| 59 | T | 90.9 | Very high | 89.4 | Confident | 15 Ų | 15 | 65.7 Ų | 65.7 | 9% | 0.092 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -58.2 | -49.3 | 174 | -58.5 | 0 | 0 | 0 | 0 | 111.7 | I55 I57 N63 F90 I93 | I55-T59 WeakPolarHBondContact O-CB 3.26Å; I55-T59 PolarHBondContact O-N 2.94Å; I55-T59 PolarHBondContact O-OG1 3.34Å; I57-T59 VanDerWaalsContact C-N 3.31Å; I57-T59 PolarHBondContact O-N 3.45Å; T59-N63 VanDerWaalsContact O-CB 3.29Å; T59-N63 WeakPolarHBondContact O-CB 3.37Å; T59-N63 PolarHBondContact O-N 2.86Å; T59-F90 HydrophobicContact CG2-CD1 3.58Å; T59-F90 HydrophobicContact CG2-CE1 4.07Å; T59-F90 WeakPolarHBondContact O-CE1 3.36Å; T59-I93 HydrophobicContact CG2-CB 4.24Å; T59-I93 HydrophobicContact CG2-CD1 4.04Å; T59-I93 HydrophobicContact CG2-CG2 3.9Å |
| 60 | V | 89.8 | Confident | 89.1 | Confident | 6 Ų | 6 | 65.6 Ų | 65.6 | 4% | 0.036 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -66.8 | -44.5 | 179.6 | 172 | 0 | 0 | 0 | 0 | 111.7 | M56 I57 N63 G64 I153 K155 Y159 | M56-V60 WeakPolarHBondContact O-CG2 3.42Å; M56-V60 PolarHBondContact O-N 3.46Å; M56-V60 VanDerWaalsContact O-N 3.08Å; I57-V60 PolarHBondContact O-N 3.22Å; V60-N63 PolarHBondContact O-N 2.76Å; V60-G64 PolarHBondContact O-N 2.98Å; V60-I153 HydrophobicContact CG1-CD1 4.32Å; V60-K155 HydrophobicContact CG2-CB 4.34Å; V60-K155 HydrophobicContact CG2-CD 4.21Å; V60-Y159 HydrophobicContact CG2-CE2 4.15Å |
| 61 | T | 90.3 | Very high | 88.9 | Confident | 76 Ų | 76 | 60.8 Ų | 60.8 | 47% | 0.466 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -65 | -44 | 178.4 | -58.5 | 0 | 0 | 0 | 0 | 111.8 | I57 S58 N63 G64 F65 | I57-T61 PolarHBondContact O-N 2.75Å; I57-T61 PolarHBondContact O-OG1 2.86Å; I57-T61 VanDerWaalsContact O-OG1 3.13Å; S58-T61 PolarHBondContact O-N 3.34Å; T61-N63 VanDerWaalsContact C-N 3.34Å; T61-N63 PolarHBondContact O-N 2.68Å; T61-G64 PolarHBondContact O-N 2.93Å; T61-F65 PolarHBondContact O-N 3.02Å |
| 62 | S | 90.9 | Very high | 88.7 | Confident | 42 Ų | 42 | 55.2 Ų | 55.2 | 29% | 0.294 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -61.9 | -43 | 176.2 | -179.3 | 0 | 0 | 0 | 0 | 111.1 | S58 G64 F65 F66 | S58-S62 WeakPolarHBondContact O-CB 3.27Å; S58-S62 PolarHBondContact O-N 3.11Å; S62-G64 PolarHBondContact O-N 3.2Å; S62-F65 WeakPolarHBondContact O-CB 3.46Å; S62-F65 PolarHBondContact O-N 2.8Å; S62-F65 VanDerWaalsContact O-N 3.12Å; S62-F66 WeakPolarHBondContact O-CD2 3.45Å; S62-F66 PolarHBondContact O-N 3.27Å; S62-F66 WeakPolarHBondContact OG-CE2 3.36Å |
| 63 | N | 89.2 | Confident | 88.4 | Confident | 9 Ų | 9 | 63.1 Ų | 63.1 | 5% | 0.048 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -64.9 | -37.2 | 176.1 | -178.7 | -137 | 0 | 0 | 0 | 112.9 | T59 V60 T61 F65 F66 M67 F90 R152 | T59-N63 VanDerWaalsContact O-CB 3.29Å; T59-N63 WeakPolarHBondContact O-CB 3.37Å; T59-N63 PolarHBondContact O-N 2.86Å; V60-N63 PolarHBondContact O-N 2.76Å; T61-N63 VanDerWaalsContact C-N 3.34Å; T61-N63 PolarHBondContact O-N 2.68Å; N63-F65 VanDerWaalsContact C-N 3.3Å; N63-F65 PolarHBondContact O-N 2.94Å; N63-F66 PolarHBondContact O-N 3.02Å; N63-M67 PolarHBondContact O-N 3.37Å; N63-F90 HydrophobicContact CB-CB 4.17Å; N63-F90 HydrophobicContact CB-CD1 3.77Å; N63-F90 HydrophobicContact CB-CD2 3.56Å; N63-F90 HydrophobicContact CB-CE1 3.94Å; N63-F90 HydrophobicContact CB-CE2 3.76Å; N63-F90 HydrophobicContact CB-CG 3.58Å; N63-F90 HydrophobicContact CB-CZ 3.94Å; N63-F90 WeakPolarHBondContact ND2-CD2 3.43Å; N63-R152 WeakPolarHBondContact OD1-CD 3.15Å; N63-R152 PolarHBondContact OD1-NH1 2.87Å |
| 64 | G | 88.1 | Confident | 88.1 | Confident | 31 Ų | 31 | 65 Ų | 65 | 32% | 0.32 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -59.9 | -38.5 | 170.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | V60 T61 S62 M67 A68 | V60-G64 PolarHBondContact O-N 2.98Å; T61-G64 PolarHBondContact O-N 2.93Å; S62-G64 PolarHBondContact O-N 3.2Å; G64-M67 PolarHBondContact O-N 3.31Å; G64-A68 PolarHBondContact O-N 2.83Å |
| 65 | F | 88.6 | Confident | 87.7 | Confident | 130 Ų | 130 | 62.1 Ų | 62.1 | 57% | 0.57 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -67.3 | -42.6 | 173.6 | 178 | -101.8 | 0 | 0 | 0 | 112.7 | T61 S62 N63 M67 A68 L69 | T61-F65 PolarHBondContact O-N 3.02Å; S62-F65 WeakPolarHBondContact O-CB 3.46Å; S62-F65 PolarHBondContact O-N 2.8Å; S62-F65 VanDerWaalsContact O-N 3.12Å; N63-F65 VanDerWaalsContact C-N 3.3Å; N63-F65 PolarHBondContact O-N 2.94Å; F65-M67 VanDerWaalsContact C-N 3.31Å; F65-M67 PolarHBondContact O-N 3.17Å; F65-A68 WeakPolarHBondContact O-CB 3.47Å; F65-A68 PolarHBondContact O-N 3.37Å; F65-L69 HydrophobicContact CD1-CD1 4.08Å; F65-L69 HydrophobicContact CE1-CD1 3.57Å; F65-L69 HydrophobicContact CE1-CG 4.17Å; F65-L69 HydrophobicContact CZ-CD1 4.02Å; F65-L69 HydrophobicContact CZ-CD2 4.33Å; F65-L69 HydrophobicContact CZ-CG 4.25Å; F65-L69 PolarHBondContact O-N 3.42Å |
| 66 | F | 87.9 | Confident | 87.3 | Confident | 68 Ų | 68 | 61.5 Ų | 61.5 | 30% | 0.298 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61.9 | -37.4 | 172.9 | -79.9 | -72.9 | 0 | 0 | 0 | 112.4 | S62 N63 L69 W70 L83 F90 | S62-F66 WeakPolarHBondContact O-CD2 3.45Å; S62-F66 PolarHBondContact O-N 3.27Å; S62-F66 WeakPolarHBondContact OG-CE2 3.36Å; N63-F66 PolarHBondContact O-N 3.02Å; F66-L69 PolarHBondContact O-N 3.17Å; F66-W70 PolarHBondContact O-N 2.87Å; F66-L83 HydrophobicContact CB-CD2 4.33Å; F66-L83 HydrophobicContact CD1-CD2 3.81Å; F66-F90 HydrophobicContact CB-CE2 4.43Å; F66-F90 AromaticContact CD2-CE2 3.51Å; F66-F90 HydrophobicContact CD2-CE2 3.51Å; F66-F90 AromaticContact CD2-CZ 3.62Å; F66-F90 HydrophobicContact CD2-CZ 3.62Å; F66-F90 HydrophobicContact CE2-CE2 4.07Å; F66-F90 AromaticContact CE2-CZ 3.87Å; F66-F90 HydrophobicContact CE2-CZ 3.87Å; F66-F90 HydrophobicContact CG-CE2 4.2Å |
| 67 | M | 85.4 | Confident | 87 | Confident | 36 Ų | 36 | 71.4 Ų | 71.4 | 18% | 0.177 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -63.5 | -40.6 | 173.1 | -168.7 | 69.6 | -178.5 | 0 | 0 | 111.8 | N63 G64 F65 L69 W70 T71 Q149 | N63-M67 PolarHBondContact O-N 3.37Å; G64-M67 PolarHBondContact O-N 3.31Å; F65-M67 VanDerWaalsContact C-N 3.31Å; F65-M67 PolarHBondContact O-N 3.17Å; M67-L69 VanDerWaalsContact C-N 3.33Å; M67-L69 PolarHBondContact O-N 3.14Å; M67-W70 WeakPolarHBondContact O-CB 3.44Å; M67-W70 PolarHBondContact O-N 2.88Å; M67-T71 PolarHBondContact O-N 2.92Å; M67-T71 PolarHBondContact O-OG1 2.8Å; M67-Q149 HydrophobicContact CE-CB 4.49Å |
| 68 | A | 87.1 | Confident | 86.8 | Confident | 65 Ų | 65 | 76 Ų | 76 | 54% | 0.537 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -63.7 | -37.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | G64 F65 T71 | G64-A68 PolarHBondContact O-N 2.83Å; F65-A68 WeakPolarHBondContact O-CB 3.47Å; F65-A68 PolarHBondContact O-N 3.37Å; A68-T71 PolarHBondContact O-N 2.85Å |
| 69 | L | 87.1 | Confident | 86.5 | Confident | 47 Ų | 47 | 75.7 Ų | 75.7 | 25% | 0.246 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -66.9 | -34.8 | 173.3 | -68.5 | 177.5 | 0 | 0 | 0 | 112.8 | F65 F66 M67 T71 S72 I75 | F65-L69 HydrophobicContact CD1-CD1 4.08Å; F65-L69 HydrophobicContact CE1-CD1 3.57Å; F65-L69 HydrophobicContact CE1-CG 4.17Å; F65-L69 HydrophobicContact CZ-CD1 4.02Å; F65-L69 HydrophobicContact CZ-CD2 4.33Å; F65-L69 HydrophobicContact CZ-CG 4.25Å; F65-L69 PolarHBondContact O-N 3.42Å; F66-L69 PolarHBondContact O-N 3.17Å; M67-L69 VanDerWaalsContact C-N 3.33Å; M67-L69 PolarHBondContact O-N 3.14Å; L69-T71 VanDerWaalsContact C-N 3.27Å; L69-T71 PolarHBondContact O-N 2.85Å; L69-S72 PolarHBondContact O-N 3.04Å; L69-I75 HydrophobicContact CB-CG2 4.29Å; L69-I75 HydrophobicContact CD2-CD1 4.07Å |
| 70 | W | 84.2 | Confident | 86.2 | Confident | 36 Ų | 36 | 79 Ų | 79 | 14% | 0.136 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -64.2 | -28.3 | 178.2 | -177.6 | -99.4 | 0 | 0 | 0 | 113.3 | F66 M67 S72 R76 F80 L83 | F66-W70 PolarHBondContact O-N 2.87Å; M67-W70 WeakPolarHBondContact O-CB 3.44Å; M67-W70 PolarHBondContact O-N 2.88Å; W70-S72 PolarHBondContact O-N 3.4Å; W70-R76 HydrophobicContact CD2-CG 3.97Å; W70-R76 HydrophobicContact CE3-CG 3.82Å; W70-R76 HydrophobicContact CH2-CG 4.48Å; W70-R76 VanDerWaalsContact CZ2-NE 3.27Å; W70-R76 VanDerWaalsContact CZ2-NH2 3.32Å; W70-R76 HydrophobicContact CZ3-CG 4.08Å; W70-R76 WeakPolarHBondContact O-CD 3.44Å; W70-F80 AromaticContact CH2-CD2 3.99Å; W70-F80 HydrophobicContact CH2-CD2 3.99Å; W70-F80 AromaticContact CH2-CE2 3.63Å; W70-F80 HydrophobicContact CH2-CE2 3.63Å; W70-F80 HydrophobicContact CH2-CZ 4.44Å; W70-F80 HydrophobicContact CZ2-CE2 4.5Å; W70-F80 HydrophobicContact CZ3-CD2 4.1Å; W70-F80 HydrophobicContact CZ3-CE2 4.21Å; W70-L83 HydrophobicContact CE3-CB 3.49Å; W70-L83 VanDerWaalsContact CE3-CB 3.49Å; W70-L83 HydrophobicContact CE3-CD1 3.86Å; W70-L83 HydrophobicContact CE3-CD2 4.42Å; W70-L83 HydrophobicContact CE3-CG 4.1Å; W70-L83 HydrophobicContact CZ3-CB 3.55Å; W70-L83 HydrophobicContact CZ3-CD1 4.4Å |
| 71 | T | 84.1 | Confident | 86 | Confident | 105 Ų | 105 | 88.9 Ų | 88.9 | 64% | 0.644 | 42% | 0.423 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -26.6 | 176.5 | -53.1 | 0 | 0 | 0 | 0 | 113 | M67 A68 L69 Y73 | M67-T71 PolarHBondContact O-N 2.92Å; M67-T71 PolarHBondContact O-OG1 2.8Å; A68-T71 PolarHBondContact O-N 2.85Å; L69-T71 VanDerWaalsContact C-N 3.27Å; L69-T71 PolarHBondContact O-N 2.85Å; T71-Y73 PolarHBondContact O-N 3.08Å |
| 72 | S | 85.9 | Confident | 85.8 | Confident | 48 Ų | 48 | 90.9 Ų | 90.9 | 34% | 0.336 | 43% | 0.43 | S | S | . | . | S | Bend | trans | -82.9 | 115.2 | 176.4 | 179 | 0 | 0 | 0 | 0 | 111.4 | L69 W70 E74 I75 R76 | L69-S72 PolarHBondContact O-N 3.04Å; W70-S72 PolarHBondContact O-N 3.4Å; S72-E74 VanDerWaalsContact C-N 3.29Å; S72-E74 PolarHBondContact O-N 3.49Å; S72-I75 PolarHBondContact O-N 2.99Å; S72-R76 VanDerWaalsContact O-CB 3.3Å; S72-R76 WeakPolarHBondContact O-CB 3.5Å; S72-R76 PolarHBondContact O-N 3.44Å |
| 73 | Y | 82.8 | Confident | 85.5 | Confident | 197 Ų | 197 | 89.1 Ų | 89.1 | 77% | 0.773 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -53.9 | -40.7 | -179.4 | -72.9 | -77.6 | 0 | 0 | 0 | 113.8 | T71 Y77 | T71-Y73 PolarHBondContact O-N 3.08Å; Y73-Y77 WeakPolarHBondContact O-CB 3.31Å; Y73-Y77 PolarHBondContact O-N 3.39Å |
| 74 | E | 83.3 | Confident | 85.2 | Confident | 125 Ų | 125 | 92.1 Ų | 92.1 | 58% | 0.584 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -66.1 | -45.5 | -179.5 | -167.5 | -155.3 | 126.2 | 0 | 0 | 111.6 | S72 Y77 R78 | S72-E74 VanDerWaalsContact C-N 3.29Å; S72-E74 PolarHBondContact O-N 3.49Å; E74-Y77 PolarHBondContact O-N 3.26Å; E74-R78 WeakPolarHBondContact O-CB 3.48Å; E74-R78 PolarHBondContact O-N 2.98Å; E74-R78 VanDerWaalsContact O-N 3.07Å; E74-R78 IonicContact OE1-CZ 2.68Å; E74-R78 IonicContact OE1-NH1 2.67Å; E74-R78 PolarHBondContact OE1-NH1 3.02Å; E74-R78 IonicContact OE1-NH2 2.67Å; E74-R78 PolarHBondContact OE1-NH2 3.14Å |
| 75 | I | 81.8 | Confident | 85.2 | Confident | 38 Ų | 38 | 96.2 Ų | 96.2 | 20% | 0.195 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -68.4 | -43 | 179.6 | -57.3 | 179.5 | 0 | 0 | 0 | 109.9 | L69 S72 Y77 R78 L79 | L69-I75 HydrophobicContact CB-CG2 4.29Å; L69-I75 HydrophobicContact CD2-CD1 4.07Å; S72-I75 PolarHBondContact O-N 2.99Å; I75-Y77 PolarHBondContact O-N 3.3Å; I75-R78 PolarHBondContact O-N 3Å; I75-L79 HydrophobicContact CG2-CD1 4.03Å; I75-L79 WeakPolarHBondContact O-CB 3.39Å; I75-L79 PolarHBondContact O-N 3.2Å |
| 76 | R | 82.3 | Confident | 85.2 | Confident | 86 Ų | 86 | 90.6 Ų | 90.6 | 33% | 0.325 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -59.2 | -42.9 | 176.9 | -175.6 | 176.6 | -179.9 | -168 | 2.1 | 112.2 | W70 S72 F80 | W70-R76 HydrophobicContact CD2-CG 3.97Å; W70-R76 HydrophobicContact CE3-CG 3.82Å; W70-R76 HydrophobicContact CH2-CG 4.48Å; W70-R76 VanDerWaalsContact CZ2-NE 3.27Å; W70-R76 VanDerWaalsContact CZ2-NH2 3.32Å; W70-R76 HydrophobicContact CZ3-CG 4.08Å; W70-R76 WeakPolarHBondContact O-CD 3.44Å; S72-R76 VanDerWaalsContact O-CB 3.3Å; S72-R76 WeakPolarHBondContact O-CB 3.5Å; S72-R76 PolarHBondContact O-N 3.44Å; R76-F80 WeakPolarHBondContact O-CA 3.4Å; R76-F80 VanDerWaalsContact O-CB 3.26Å; R76-F80 WeakPolarHBondContact O-CB 3.36Å; R76-F80 PolarHBondContact O-N 3.01Å |
| 77 | Y | 85.6 | Confident | 85 | Confident | 210 Ų | 210 | 89.3 Ų | 89.3 | 82% | 0.824 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -68.3 | -45.3 | 176.6 | -170.6 | -97.7 | 0 | 0 | 0 | 111.8 | Y73 E74 I75 L79 | Y73-Y77 WeakPolarHBondContact O-CB 3.31Å; Y73-Y77 PolarHBondContact O-N 3.39Å; E74-Y77 PolarHBondContact O-N 3.26Å; I75-Y77 PolarHBondContact O-N 3.3Å; Y77-L79 PolarHBondContact O-N 3.48Å |
| 78 | R | 85.7 | Confident | 85.1 | Confident | 152 Ų | 152 | 93.2 Ų | 93.2 | 57% | 0.574 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -66.1 | -36.6 | -178.6 | -179.3 | 167.4 | 58.8 | -128.7 | -3.7 | 113.8 | E74 I75 | E74-R78 WeakPolarHBondContact O-CB 3.48Å; E74-R78 PolarHBondContact O-N 2.98Å; E74-R78 VanDerWaalsContact O-N 3.07Å; E74-R78 IonicContact OE1-CZ 2.68Å; E74-R78 IonicContact OE1-NH1 2.67Å; E74-R78 PolarHBondContact OE1-NH1 3.02Å; E74-R78 IonicContact OE1-NH2 2.67Å; E74-R78 PolarHBondContact OE1-NH2 3.14Å; I75-R78 PolarHBondContact O-N 3Å |
| 79 | L | 85.6 | Confident | 85.3 | Confident | 67 Ų | 67 | 96 Ų | 96 | 35% | 0.351 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -115.7 | 15.6 | -172.7 | -58.6 | 178.9 | 0 | 0 | 0 | 113.8 | I75 Y77 R81 L82 L83 | I75-L79 HydrophobicContact CG2-CD1 4.03Å; I75-L79 WeakPolarHBondContact O-CB 3.39Å; I75-L79 PolarHBondContact O-N 3.2Å; Y77-L79 PolarHBondContact O-N 3.48Å; L79-R81 PolarHBondContact O-N 3.49Å; L79-R81 VanDerWaalsContact O-N 3.13Å; L79-L82 HydrophobicContact CD2-CD1 4.18Å; L79-L82 PolarHBondContact O-N 2.84Å; L79-L83 HydrophobicContact CB-CD1 3.86Å; L79-L83 HydrophobicContact CB-CG 4.39Å; L79-L83 PolarHBondContact O-N 3.31Å; L79-L83 VanDerWaalsContact O-N 3.09Å |
| 80 | F | 84.1 | Confident | 85.4 | Confident | 84 Ų | 84 | 94.3 Ų | 94.3 | 37% | 0.368 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -42 | -54.8 | -171.5 | -174.8 | -99.2 | 0 | 0 | 0 | 114.2 | W70 R76 L82 L83 E84 | W70-F80 AromaticContact CH2-CD2 3.99Å; W70-F80 HydrophobicContact CH2-CD2 3.99Å; W70-F80 AromaticContact CH2-CE2 3.63Å; W70-F80 HydrophobicContact CH2-CE2 3.63Å; W70-F80 HydrophobicContact CH2-CZ 4.44Å; W70-F80 HydrophobicContact CZ2-CE2 4.5Å; W70-F80 HydrophobicContact CZ3-CD2 4.1Å; W70-F80 HydrophobicContact CZ3-CE2 4.21Å; R76-F80 WeakPolarHBondContact O-CA 3.4Å; R76-F80 VanDerWaalsContact O-CB 3.26Å; R76-F80 WeakPolarHBondContact O-CB 3.36Å; R76-F80 PolarHBondContact O-N 3.01Å; F80-L82 VanDerWaalsContact C-N 3.34Å; F80-L82 PolarHBondContact O-N 2.74Å; F80-L83 PolarHBondContact O-N 2.97Å; F80-E84 VanDerWaalsContact CE1-OE2 3.28Å; F80-E84 WeakPolarHBondContact CE1-OE2 3.4Å; F80-E84 PolarHBondContact O-N 3.4Å |
| 81 | R | 85.8 | Confident | 85.6 | Confident | 215 Ų | 215 | 94.1 Ų | 94.1 | 81% | 0.811 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -63.9 | -33.9 | -177.9 | -65.9 | -170.1 | -66.1 | -160.5 | -1.2 | 113.9 | L79 L85 | L79-R81 PolarHBondContact O-N 3.49Å; L79-R81 VanDerWaalsContact O-N 3.13Å; R81-L85 VanDerWaalsContact O-CB 3.23Å; R81-L85 WeakPolarHBondContact O-CB 3.31Å; R81-L85 PolarHBondContact O-N 2.99Å; R81-L85 VanDerWaalsContact O-N 3.13Å |
| 82 | L | 86.7 | Confident | 85.9 | Confident | 117 Ų | 117 | 92.7 Ų | 92.7 | 61% | 0.613 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -74.5 | -38.1 | 179.1 | -71.3 | 172.2 | 0 | 0 | 0 | 110.9 | L79 F80 S86 | L79-L82 HydrophobicContact CD2-CD1 4.18Å; L79-L82 PolarHBondContact O-N 2.84Å; F80-L82 VanDerWaalsContact C-N 3.34Å; F80-L82 PolarHBondContact O-N 2.74Å; L82-S86 WeakPolarHBondContact O-CB 3.35Å; L82-S86 PolarHBondContact O-N 3.05Å |
| 83 | L | 83.8 | Confident | 86.2 | Confident | 5 Ų | 5 | 92.1 Ų | 92.1 | 3% | 0.026 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -66.9 | -48.7 | 177 | -73 | 154.7 | 0 | 0 | 0 | 111.1 | F66 W70 L79 F80 L85 S86 E87 | F66-L83 HydrophobicContact CB-CD2 4.33Å; F66-L83 HydrophobicContact CD1-CD2 3.81Å; W70-L83 HydrophobicContact CE3-CB 3.49Å; W70-L83 VanDerWaalsContact CE3-CB 3.49Å; W70-L83 HydrophobicContact CE3-CD1 3.86Å; W70-L83 HydrophobicContact CE3-CD2 4.42Å; W70-L83 HydrophobicContact CE3-CG 4.1Å; W70-L83 HydrophobicContact CZ3-CB 3.55Å; W70-L83 HydrophobicContact CZ3-CD1 4.4Å; L79-L83 HydrophobicContact CB-CD1 3.86Å; L79-L83 HydrophobicContact CB-CG 4.39Å; L79-L83 PolarHBondContact O-N 3.31Å; L79-L83 VanDerWaalsContact O-N 3.09Å; F80-L83 PolarHBondContact O-N 2.97Å; L83-L85 PolarHBondContact O-N 3.02Å; L83-S86 WeakPolarHBondContact O-CB 3.5Å; L83-S86 PolarHBondContact O-N 3.25Å; L83-S86 VanDerWaalsContact O-N 3.08Å; L83-S86 PolarHBondContact O-OG 2.81Å; L83-E87 PolarHBondContact O-N 2.68Å |
| 84 | E | 83.8 | Confident | 86.4 | Confident | 72 Ų | 72 | 82.9 Ų | 82.9 | 34% | 0.336 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -62 | -41.3 | 177.2 | -172.1 | 168.9 | -134.4 | 0 | 0 | 112.2 | F80 S86 E87 I88 | F80-E84 VanDerWaalsContact CE1-OE2 3.28Å; F80-E84 WeakPolarHBondContact CE1-OE2 3.4Å; F80-E84 PolarHBondContact O-N 3.4Å; E84-S86 VanDerWaalsContact C-N 3.32Å; E84-S86 PolarHBondContact O-N 3.07Å; E84-E87 PolarHBondContact O-N 2.73Å; E84-I88 PolarHBondContact O-N 2.67Å |
| 85 | L | 87.9 | Confident | 86.7 | Confident | 117 Ų | 117 | 79.5 Ų | 79.5 | 61% | 0.613 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -64.2 | -36.3 | 173 | -176.6 | 144.3 | 0 | 0 | 0 | 112.2 | R81 L83 F89 | R81-L85 VanDerWaalsContact O-CB 3.23Å; R81-L85 WeakPolarHBondContact O-CB 3.31Å; R81-L85 PolarHBondContact O-N 2.99Å; R81-L85 VanDerWaalsContact O-N 3.13Å; L83-L85 PolarHBondContact O-N 3.02Å; L85-F89 WeakPolarHBondContact O-CB 3.29Å; L85-F89 PolarHBondContact O-N 3.3Å; L85-F89 VanDerWaalsContact O-N 3.09Å |
| 86 | S | 87.2 | Confident | 87.1 | Confident | 13 Ų | 13 | 80.1 Ų | 80.1 | 9% | 0.091 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -64.6 | -41.2 | 176.2 | 83.3 | 0 | 0 | 0 | 0 | 111.7 | L82 L83 E84 I88 F89 F90 | L82-S86 WeakPolarHBondContact O-CB 3.35Å; L82-S86 PolarHBondContact O-N 3.05Å; L83-S86 WeakPolarHBondContact O-CB 3.5Å; L83-S86 PolarHBondContact O-N 3.25Å; L83-S86 VanDerWaalsContact O-N 3.08Å; L83-S86 PolarHBondContact O-OG 2.81Å; E84-S86 VanDerWaalsContact C-N 3.32Å; E84-S86 PolarHBondContact O-N 3.07Å; S86-I88 PolarHBondContact O-N 2.99Å; S86-F89 WeakPolarHBondContact O-CB 3.38Å; S86-F89 PolarHBondContact O-N 3.4Å; S86-F90 WeakPolarHBondContact O-CB 3.5Å; S86-F90 WeakPolarHBondContact O-CD2 3.29Å; S86-F90 WeakPolarHBondContact O-CG 3.41Å; S86-F90 PolarHBondContact O-N 3.07Å |
| 87 | E | 84.7 | Confident | 87.6 | Confident | 40 Ų | 40 | 76.2 Ų | 76.2 | 19% | 0.187 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -60.2 | -46.9 | 178 | -71.1 | -173.9 | 166.8 | 0 | 0 | 111.9 | L83 E84 F89 F90 V91 | L83-E87 PolarHBondContact O-N 2.68Å; E84-E87 PolarHBondContact O-N 2.73Å; E87-F89 VanDerWaalsContact C-N 3.32Å; E87-F89 PolarHBondContact O-N 2.98Å; E87-F90 PolarHBondContact O-N 3.17Å; E87-V91 WeakPolarHBondContact O-CG2 3.39Å; E87-V91 PolarHBondContact O-N 3.49Å |
| 88 | I | 87.4 | Confident | 87.8 | Confident | 118 Ų | 118 | 67.5 Ų | 67.5 | 61% | 0.605 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -59.8 | -43.8 | 176.8 | -62.9 | 168.1 | 0 | 0 | 0 | 110.5 | E84 S86 S92 | E84-I88 PolarHBondContact O-N 2.67Å; S86-I88 PolarHBondContact O-N 2.99Å; I88-S92 VanDerWaalsContact O-CB 3.28Å; I88-S92 WeakPolarHBondContact O-CB 3.47Å; I88-S92 PolarHBondContact O-N 3.27Å |
| 89 | F | 90.8 | Very high | 87.9 | Confident | 124 Ų | 124 | 63.6 Ų | 63.6 | 54% | 0.544 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.3 | -45.2 | 176.9 | 177.6 | -104.2 | 0 | 0 | 0 | 112.4 | L85 S86 E87 S92 I93 | L85-F89 WeakPolarHBondContact O-CB 3.29Å; L85-F89 PolarHBondContact O-N 3.3Å; L85-F89 VanDerWaalsContact O-N 3.09Å; S86-F89 WeakPolarHBondContact O-CB 3.38Å; S86-F89 PolarHBondContact O-N 3.4Å; E87-F89 VanDerWaalsContact C-N 3.32Å; E87-F89 PolarHBondContact O-N 2.98Å; F89-S92 PolarHBondContact O-N 2.92Å; F89-I93 HydrophobicContact CD1-CD1 3.85Å; F89-I93 HydrophobicContact CD2-CD1 4.48Å; F89-I93 HydrophobicContact CE1-CD1 3.39Å; F89-I93 HydrophobicContact CE2-CD1 4.08Å; F89-I93 HydrophobicContact CG-CD1 4.39Å; F89-I93 HydrophobicContact CZ-CD1 3.53Å; F89-I93 HydrophobicContact CZ-CG1 4.5Å; F89-I93 WeakPolarHBondContact O-CG1 3.45Å; F89-I93 PolarHBondContact O-N 3.22Å |
| 90 | F | 89 | Confident | 88.1 | Confident | 12 Ų | 12 | 63.7 Ų | 63.7 | 5% | 0.053 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -66.7 | -40.6 | 178.8 | -71.1 | -55.7 | 0 | 0 | 0 | 113 | T59 N63 F66 S86 E87 C94 | T59-F90 HydrophobicContact CG2-CD1 3.58Å; T59-F90 HydrophobicContact CG2-CE1 4.07Å; T59-F90 WeakPolarHBondContact O-CE1 3.36Å; N63-F90 HydrophobicContact CB-CB 4.17Å; N63-F90 HydrophobicContact CB-CD1 3.77Å; N63-F90 HydrophobicContact CB-CD2 3.56Å; N63-F90 HydrophobicContact CB-CE1 3.94Å; N63-F90 HydrophobicContact CB-CE2 3.76Å; N63-F90 HydrophobicContact CB-CG 3.58Å; N63-F90 HydrophobicContact CB-CZ 3.94Å; N63-F90 WeakPolarHBondContact ND2-CD2 3.43Å; F66-F90 HydrophobicContact CB-CE2 4.43Å; F66-F90 AromaticContact CD2-CE2 3.51Å; F66-F90 HydrophobicContact CD2-CE2 3.51Å; F66-F90 AromaticContact CD2-CZ 3.62Å; F66-F90 HydrophobicContact CD2-CZ 3.62Å; F66-F90 HydrophobicContact CE2-CE2 4.07Å; F66-F90 AromaticContact CE2-CZ 3.87Å; F66-F90 HydrophobicContact CE2-CZ 3.87Å; F66-F90 HydrophobicContact CG-CE2 4.2Å; S86-F90 WeakPolarHBondContact O-CB 3.5Å; S86-F90 WeakPolarHBondContact O-CD2 3.29Å; S86-F90 WeakPolarHBondContact O-CG 3.41Å; S86-F90 PolarHBondContact O-N 3.07Å; E87-F90 PolarHBondContact O-N 3.17Å; F90-C94 WeakPolarHBondContact O-CB 3.43Å; F90-C94 PolarHBondContact O-N 3.31Å; F90-C94 VanDerWaalsContact O-N 3.09Å; F90-C94 PolarHBondContact O-SG 2.94Å |
| 91 | V | 88.9 | Confident | 88.3 | Confident | 32 Ų | 32 | 61.2 Ų | 61.2 | 19% | 0.194 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63.4 | -47 | 173.2 | 173.3 | 0 | 0 | 0 | 0 | 109.9 | E87 I93 C94 T95 M125 L126 | E87-V91 WeakPolarHBondContact O-CG2 3.39Å; E87-V91 PolarHBondContact O-N 3.49Å; V91-I93 PolarHBondContact O-N 3.24Å; V91-C94 CarbonylContact O-C 3.09Å; V91-C94 WeakPolarHBondContact O-CB 3.36Å; V91-C94 PolarHBondContact O-N 3.16Å; V91-C94 VanDerWaalsContact O-N 3.11Å; V91-T95 PolarHBondContact O-N 2.83Å; V91-T95 PolarHBondContact O-OG1 2.92Å; V91-M125 HydrophobicContact CG2-CB 4.42Å; V91-L126 HydrophobicContact CG1-CD1 4.27Å |
| 92 | S | 90.8 | Very high | 88.4 | Confident | 75 Ų | 75 | 54.3 Ų | 54.3 | 52% | 0.524 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -56 | -47.9 | 177.6 | -178.9 | 0 | 0 | 0 | 0 | 113.1 | I88 F89 C94 T95 S96 | I88-S92 VanDerWaalsContact O-CB 3.28Å; I88-S92 WeakPolarHBondContact O-CB 3.47Å; I88-S92 PolarHBondContact O-N 3.27Å; F89-S92 PolarHBondContact O-N 2.92Å; S92-C94 VanDerWaalsContact C-N 3.35Å; S92-C94 PolarHBondContact O-N 2.96Å; S92-T95 PolarHBondContact O-N 2.95Å; S92-S96 PolarHBondContact O-N 3.11Å |
| 93 | I | 92 | Very high | 88.4 | Confident | 35 Ų | 35 | 51.9 Ų | 51.9 | 18% | 0.179 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -58.4 | -48.7 | 175.1 | -68.8 | 167.6 | 0 | 0 | 0 | 110.4 | M56 T59 F89 V91 T95 S96 E97 | M56-I93 HydrophobicContact CE-CG2 3.87Å; M56-I93 HydrophobicContact SD-CG2 3.76Å; T59-I93 HydrophobicContact CG2-CB 4.24Å; T59-I93 HydrophobicContact CG2-CD1 4.04Å; T59-I93 HydrophobicContact CG2-CG2 3.9Å; F89-I93 HydrophobicContact CD1-CD1 3.85Å; F89-I93 HydrophobicContact CD2-CD1 4.48Å; F89-I93 HydrophobicContact CE1-CD1 3.39Å; F89-I93 HydrophobicContact CE2-CD1 4.08Å; F89-I93 HydrophobicContact CG-CD1 4.39Å; F89-I93 HydrophobicContact CZ-CD1 3.53Å; F89-I93 HydrophobicContact CZ-CG1 4.5Å; F89-I93 WeakPolarHBondContact O-CG1 3.45Å; F89-I93 PolarHBondContact O-N 3.22Å; V91-I93 PolarHBondContact O-N 3.24Å; I93-T95 VanDerWaalsContact C-N 3.35Å; I93-T95 PolarHBondContact O-N 3.42Å; I93-S96 PolarHBondContact O-N 3.5Å; I93-S96 PolarHBondContact O-OG 2.91Å; I93-E97 PolarHBondContact O-N 3.41Å; I93-E97 VanDerWaalsContact O-N 3.09Å |
| 94 | C | 88.1 | Confident | 88.5 | Confident | 4 Ų | 4 | 52 Ų | 52 | 3% | 0.027 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -61.5 | -41.5 | 179.7 | -73.3 | 0 | 0 | 0 | 0 | 112.4 | F90 V91 S92 E97 L98 M122 M125 K155 | F90-C94 WeakPolarHBondContact O-CB 3.43Å; F90-C94 PolarHBondContact O-N 3.31Å; F90-C94 VanDerWaalsContact O-N 3.09Å; F90-C94 PolarHBondContact O-SG 2.94Å; V91-C94 CarbonylContact O-C 3.09Å; V91-C94 WeakPolarHBondContact O-CB 3.36Å; V91-C94 PolarHBondContact O-N 3.16Å; V91-C94 VanDerWaalsContact O-N 3.11Å; S92-C94 VanDerWaalsContact C-N 3.35Å; S92-C94 PolarHBondContact O-N 2.96Å; C94-E97 PolarHBondContact O-N 3.45Å; C94-L98 PolarHBondContact O-N 3.37Å; C94-L98 VanDerWaalsContact O-N 3.15Å; C94-M122 HydrophobicContact CB-CE 3.93Å; C94-M122 WeakPolarHBondContact O-CE 3.49Å; C94-M125 HydrophobicContact CB-CE 4.38Å; C94-M125 HydrophobicContact CB-SD 4Å; C94-K155 PolarHBondContact SG-NZ 2.9Å; C94-K155 VanDerWaalsContact SG-NZ 3.45Å |
| 95 | T | 89.7 | Confident | 88.4 | Confident | 54 Ų | 54 | 51.6 Ų | 51.6 | 33% | 0.331 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -64.4 | -44.4 | 177.3 | -56.2 | 0 | 0 | 0 | 0 | 110.6 | V91 S92 I93 E97 L98 S99 | V91-T95 PolarHBondContact O-N 2.83Å; V91-T95 PolarHBondContact O-OG1 2.92Å; S92-T95 PolarHBondContact O-N 2.95Å; I93-T95 VanDerWaalsContact C-N 3.35Å; I93-T95 PolarHBondContact O-N 3.42Å; T95-E97 VanDerWaalsContact C-N 3.3Å; T95-E97 PolarHBondContact O-N 3.38Å; T95-L98 PolarHBondContact O-N 3.05Å; T95-S99 PolarHBondContact O-N 3Å; T95-S99 PolarHBondContact O-OG 3.09Å |
| 96 | S | 90.3 | Very high | 88.1 | Confident | 51 Ų | 51 | 48.9 Ų | 48.9 | 36% | 0.357 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -59.1 | -40.7 | 177.5 | 78.6 | 0 | 0 | 0 | 0 | 112.3 | S92 I93 S99 M100 | S92-S96 PolarHBondContact O-N 3.11Å; I93-S96 PolarHBondContact O-N 3.5Å; I93-S96 PolarHBondContact O-OG 2.91Å; S96-S99 PolarHBondContact O-N 3.48Å; S96-M100 VanDerWaalsContact O-CG 3.29Å; S96-M100 WeakPolarHBondContact O-CG 3.48Å; S96-M100 PolarHBondContact O-N 3Å |
| 97 | E | 91.3 | Very high | 87.8 | Confident | 3 Ų | 3 | 54.1 Ų | 54.1 | 1% | 0.014 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.6 | -45 | 176.7 | -172.7 | -140.9 | -178.7 | 0 | 0 | 111.9 | F52 M56 I93 C94 T95 M100 K101 K155 Y159 | F52-E97 HydrophobicContact CE1-CG 3.75Å; F52-E97 HydrophobicContact CZ-CB 4.22Å; F52-E97 HydrophobicContact CZ-CG 3.69Å; M56-E97 HydrophobicContact CE-CB 3.91Å; M56-E97 HydrophobicContact CE-CG 4Å; M56-E97 WeakPolarHBondContact CE-OE2 3.49Å; M56-E97 HydrophobicContact CG-CG 4.3Å; M56-E97 HydrophobicContact SD-CB 4.18Å; M56-E97 HydrophobicContact SD-CG 4.12Å; I93-E97 PolarHBondContact O-N 3.41Å; I93-E97 VanDerWaalsContact O-N 3.09Å; C94-E97 PolarHBondContact O-N 3.45Å; T95-E97 VanDerWaalsContact C-N 3.3Å; T95-E97 PolarHBondContact O-N 3.38Å; E97-M100 PolarHBondContact O-N 2.94Å; E97-K101 HydrophobicContact CG-CD 4.5Å; E97-K101 WeakPolarHBondContact O-CG 3.45Å; E97-K101 PolarHBondContact O-N 2.93Å; E97-K101 WeakPolarHBondContact OE1-CE 3.37Å; E97-K101 IonicContact OE1-NZ 3.45Å; E97-K101 PolarHBondContact OE1-NZ 3.47Å; E97-K101 IonicContact OE2-NZ 2.63Å; E97-K155 WeakPolarHBondContact OE2-CE 3.49Å; E97-K155 IonicContact OE2-NZ 2.67Å; E97-K155 PolarHBondContact OE2-NZ 2.95Å; E97-Y159 WeakPolarHBondContact OE1-CE1 3.36Å; E97-Y159 PolarHBondContact OE1-OH 3.47Å; E97-Y159 PolarHBondContact OE2-OH 3.4Å; E97-Y159 VanDerWaalsContact OE2-OH 3.09Å |
| 98 | L | 89.8 | Confident | 87.7 | Confident | 27 Ų | 27 | 57.1 Ų | 57.1 | 14% | 0.141 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.5 | -43.2 | 176.2 | 178.5 | 62.4 | 0 | 0 | 0 | 111.2 | C94 T95 M100 K101 L102 Y109 V119 M122 | C94-L98 PolarHBondContact O-N 3.37Å; C94-L98 VanDerWaalsContact O-N 3.15Å; T95-L98 PolarHBondContact O-N 3.05Å; L98-M100 VanDerWaalsContact C-N 3.34Å; L98-M100 PolarHBondContact O-N 2.99Å; L98-K101 PolarHBondContact O-N 3.27Å; L98-L102 WeakPolarHBondContact O-CB 3.36Å; L98-L102 PolarHBondContact O-N 3.02Å; L98-Y109 HydrophobicContact CD1-CE1 4.07Å; L98-Y109 WeakPolarHBondContact CD1-OH 3.45Å; L98-V119 HydrophobicContact CD1-CG2 3.9Å; L98-V119 HydrophobicContact CD2-CG2 4.46Å; L98-M122 HydrophobicContact CB-CE 3.86Å; L98-M122 HydrophobicContact CD2-CB 3.86Å; L98-M122 HydrophobicContact CD2-CE 3.93Å; L98-M122 HydrophobicContact CD2-CG 3.66Å |
| 99 | S | 88.6 | Confident | 87.5 | Confident | 70 Ų | 70 | 51.9 Ų | 51.9 | 49% | 0.49 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -59.4 | -43.5 | 175.5 | -58.1 | 0 | 0 | 0 | 0 | 111.7 | T95 S96 Y103 | T95-S99 PolarHBondContact O-N 3Å; T95-S99 PolarHBondContact O-OG 3.09Å; S96-S99 PolarHBondContact O-N 3.48Å; S99-Y103 VanDerWaalsContact O-CB 3.24Å; S99-Y103 WeakPolarHBondContact O-CB 3.42Å; S99-Y103 PolarHBondContact O-N 3.25Å |
| 100 | M | 89.8 | Confident | 87.2 | Confident | 69 Ų | 69 | 53 Ų | 53 | 34% | 0.34 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -63.6 | -44.3 | 175.2 | -70.3 | -179.5 | -168 | 0 | 0 | 112.1 | V43 I47 S96 E97 L98 Y103 V104 | V43-M100 HydrophobicContact CG1-CB 3.92Å; V43-M100 HydrophobicContact CG1-CG 4.2Å; I47-M100 HydrophobicContact CD1-CB 3.94Å; I47-M100 HydrophobicContact CG1-CB 4.27Å; S96-M100 VanDerWaalsContact O-CG 3.29Å; S96-M100 WeakPolarHBondContact O-CG 3.48Å; S96-M100 PolarHBondContact O-N 3Å; E97-M100 PolarHBondContact O-N 2.94Å; L98-M100 VanDerWaalsContact C-N 3.34Å; L98-M100 PolarHBondContact O-N 2.99Å; M100-Y103 PolarHBondContact O-N 3.04Å; M100-V104 WeakPolarHBondContact O-CG2 3.15Å; M100-V104 PolarHBondContact O-N 3.47Å |
| 101 | K | 87.8 | Confident | 87 | Confident | 32 Ų | 32 | 60.6 Ų | 60.6 | 14% | 0.139 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -60.9 | -46.7 | 176.6 | -77.3 | 172.1 | 172.2 | 170.6 | 0 | 112.2 | I47 E97 L98 V104 Y109 D118 | I47-K101 HydrophobicContact CD1-CG 4.32Å; I47-K101 HydrophobicContact CG2-CG 4.4Å; E97-K101 HydrophobicContact CG-CD 4.5Å; E97-K101 WeakPolarHBondContact O-CG 3.45Å; E97-K101 PolarHBondContact O-N 2.93Å; E97-K101 WeakPolarHBondContact OE1-CE 3.37Å; E97-K101 IonicContact OE1-NZ 3.45Å; E97-K101 PolarHBondContact OE1-NZ 3.47Å; E97-K101 IonicContact OE2-NZ 2.63Å; L98-K101 PolarHBondContact O-N 3.27Å; K101-V104 PolarHBondContact O-N 2.98Å; K101-Y109 HydrophobicContact CB-CD2 4.25Å; K101-Y109 HydrophobicContact CB-CE2 3.68Å; K101-Y109 HydrophobicContact CD-CE2 4.17Å; K101-Y109 HydrophobicContact CG-CE2 4.4Å; K101-D118 IonicContact NZ-OD2 3.35Å; K101-D118 PolarHBondContact NZ-OD2 3.48Å |
| 102 | L | 87.8 | Confident | 86.8 | Confident | 70 Ų | 70 | 62 Ų | 62 | 37% | 0.366 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -68.7 | -34.6 | 179.4 | -172 | 67.3 | 0 | 0 | 0 | 112 | L98 V104 P106 Y109 | L98-L102 WeakPolarHBondContact O-CB 3.36Å; L98-L102 PolarHBondContact O-N 3.02Å; L102-V104 PolarHBondContact O-N 3.46Å; L102-P106 WeakPolarHBondContact O-CA 3.34Å; L102-P106 WeakPolarHBondContact O-CB 3.4Å; L102-P106 WeakPolarHBondContact O-CD 3.24Å; L102-Y109 HydrophobicContact CD1-CD1 4.1Å |
| 103 | Y | 87.2 | Confident | 86.5 | Confident | 66 Ų | 66 | 61 Ų | 61 | 26% | 0.259 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -62.8 | -39.8 | 176.3 | 177.2 | -94.8 | 0 | 0 | 0 | 112.6 | R34 S99 M100 | R34-Y103 PolarHBondContact NH1-O 3.35Å; R34-Y103 VanDerWaalsContact NH2-CE2 3.3Å; S99-Y103 VanDerWaalsContact O-CB 3.24Å; S99-Y103 WeakPolarHBondContact O-CB 3.42Å; S99-Y103 PolarHBondContact O-N 3.25Å; M100-Y103 PolarHBondContact O-N 3.04Å |
| 104 | V | 85.8 | Confident | 86.2 | Confident | 9 Ų | 9 | 62.2 Ų | 62.2 | 6% | 0.055 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -71.3 | -50.8 | -174 | 169.5 | 0 | 0 | 0 | 0 | 112.8 | R40 V43 K44 I47 M100 K101 L102 | R40-V104 VanDerWaalsContact CD-O 3.29Å; R40-V104 WeakPolarHBondContact CD-O 3.23Å; R40-V104 HydrophobicContact CG-CB 4.42Å; R40-V104 HydrophobicContact CG-CG1 4.06Å; R40-V104 HydrophobicContact CG-CG2 4.38Å; V43-V104 HydrophobicContact CB-CG2 3.93Å; V43-V104 HydrophobicContact CG1-CG2 3.56Å; K44-V104 HydrophobicContact CB-CG1 3.95Å; K44-V104 HydrophobicContact CB-CG2 4.4Å; K44-V104 HydrophobicContact CD-CG1 3.86Å; K44-V104 HydrophobicContact CG-CG1 4.06Å; I47-V104 HydrophobicContact CD1-CG2 3.99Å; M100-V104 WeakPolarHBondContact O-CG2 3.15Å; M100-V104 PolarHBondContact O-N 3.47Å; K101-V104 PolarHBondContact O-N 2.98Å; L102-V104 PolarHBondContact O-N 3.46Å |
| 105 | D | 82.6 | Confident | 86.1 | Confident | 63 Ų | 63 | 63.5 Ų | 63.5 | 34% | 0.337 | 33% | 0.334 | S | S | . | . | S | Bend | trans | -136.4 | 60 | -172.3 | -78.5 | -48.8 | 0 | 0 | 0 | 112 | K44 I107 N108 Y109 | K44-D105 IonicContact NZ-OD1 3.76Å; K44-D105 IonicContact NZ-OD2 2.66Å; K44-D105 PolarHBondContact NZ-OD2 3.28Å; D105-I107 VanDerWaalsContact C-N 3.32Å; D105-I107 PolarHBondContact O-N 3.42Å; D105-I107 VanDerWaalsContact O-N 3.11Å; D105-N108 PolarHBondContact O-N 2.89Å; D105-Y109 VanDerWaalsContact O-CB 3.26Å; D105-Y109 WeakPolarHBondContact O-CB 3.36Å; D105-Y109 PolarHBondContact O-N 2.92Å |
| 106 | P | 80.9 | Confident | 86.1 | Confident | 59 Ų | 59 | 63.3 Ų | 63.3 | 38% | 0.383 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -58.9 | -32.6 | -164.3 | 20.6 | -33.3 | 0 | 0 | 0 | 115.6 | L102 W110 | L102-P106 WeakPolarHBondContact O-CA 3.34Å; L102-P106 WeakPolarHBondContact O-CB 3.4Å; L102-P106 WeakPolarHBondContact O-CD 3.24Å; P106-W110 PolarHBondContact O-NE1 2.9Å |
| 107 | I | 80.6 | Confident | 86 | Confident | 123 Ų | 123 | 63.1 Ų | 63.1 | 63% | 0.631 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -85.3 | -41.9 | -179.4 | -60.7 | 169.8 | 0 | 0 | 0 | 111 | D105 Y109 | D105-I107 VanDerWaalsContact C-N 3.32Å; D105-I107 PolarHBondContact O-N 3.42Å; D105-I107 VanDerWaalsContact O-N 3.11Å; I107-Y109 VanDerWaalsContact C-N 3.29Å; I107-Y109 PolarHBondContact O-N 2.88Å |
| 108 | N | 82.1 | Confident | 85.8 | Confident | 103 Ų | 103 | 63.2 Ų | 63.2 | 55% | 0.551 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -77.9 | -19.2 | -178.2 | -157.5 | 49.3 | 0 | 0 | 0 | 112.2 | D105 W110 K111 | D105-N108 PolarHBondContact O-N 2.89Å; N108-W110 VanDerWaalsContact C-N 3.35Å; N108-W110 PolarHBondContact O-N 3.41Å; N108-K111 PolarHBondContact O-N 3.19Å |
| 109 | Y | 83.2 | Confident | 85.8 | Confident | 8 Ų | 8 | 63 Ų | 63 | 3% | 0.031 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -54.5 | -48.1 | 177.2 | -172.9 | -103.2 | 0 | 0 | 0 | 112 | L98 K101 L102 D105 I107 K111 N112 N115 V119 | L98-Y109 HydrophobicContact CD1-CE1 4.07Å; L98-Y109 WeakPolarHBondContact CD1-OH 3.45Å; K101-Y109 HydrophobicContact CB-CD2 4.25Å; K101-Y109 HydrophobicContact CB-CE2 3.68Å; K101-Y109 HydrophobicContact CD-CE2 4.17Å; K101-Y109 HydrophobicContact CG-CE2 4.4Å; L102-Y109 HydrophobicContact CD1-CD1 4.1Å; D105-Y109 VanDerWaalsContact O-CB 3.26Å; D105-Y109 WeakPolarHBondContact O-CB 3.36Å; D105-Y109 PolarHBondContact O-N 2.92Å; I107-Y109 VanDerWaalsContact C-N 3.29Å; I107-Y109 PolarHBondContact O-N 2.88Å; Y109-K111 VanDerWaalsContact C-N 3.29Å; Y109-K111 PolarHBondContact O-N 3.49Å; Y109-N112 PolarHBondContact O-N 3.24Å; Y109-N115 HydrophobicContact CD1-CB 4.14Å; Y109-N115 HydrophobicContact CD2-CB 3.79Å; Y109-N115 WeakPolarHBondContact CD2-ND2 3.49Å; Y109-N115 HydrophobicContact CE1-CB 3.88Å; Y109-N115 HydrophobicContact CE2-CB 3.45Å; Y109-N115 VanDerWaalsContact CE2-CB 3.45Å; Y109-N115 HydrophobicContact CG-CB 4.09Å; Y109-N115 WeakPolarHBondContact O-CB 3.26Å; Y109-N115 PolarHBondContact O-ND2 3.45Å; Y109-N115 PolarHBondContact OH-O 2.84Å; Y109-N115 VanDerWaalsContact OH-O 3.13Å; Y109-V119 HydrophobicContact CE1-CG2 3.71Å |
| 110 | W | 85.3 | Confident | 85.8 | Confident | 149 Ų | 149 | 64.1 Ų | 64.1 | 56% | 0.564 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | -19.7 | -177.8 | -60.2 | 95.2 | 0 | 0 | 0 | 114.9 | P106 N108 N112 | P106-W110 PolarHBondContact O-NE1 2.9Å; N108-W110 VanDerWaalsContact C-N 3.35Å; N108-W110 PolarHBondContact O-N 3.41Å; W110-N112 VanDerWaalsContact C-N 3.27Å; W110-N112 PolarHBondContact O-N 2.88Å |
| 111 | K | 84.6 | Confident | 85.8 | Confident | 170 Ų | 170 | 61 Ų | 61 | 74% | 0.739 | 31% | 0.313 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.9 | -16.2 | 178.8 | -66.5 | -170.2 | 177.3 | -175.2 | 0 | 113.5 | N108 Y109 | N108-K111 PolarHBondContact O-N 3.19Å; Y109-K111 VanDerWaalsContact C-N 3.29Å; Y109-K111 PolarHBondContact O-N 3.49Å |
| 112 | N | 84.3 | Confident | 85.8 | Confident | 61 Ų | 61 | 60.1 Ų | 60.1 | 33% | 0.326 | 31% | 0.309 | S | S | . | . | S | Bend | trans | -100.4 | 114.7 | -176.9 | 176.6 | 29.9 | 0 | 0 | 0 | 110.5 | Y109 W110 Y114 N115 V116 | Y109-N112 PolarHBondContact O-N 3.24Å; W110-N112 VanDerWaalsContact C-N 3.27Å; W110-N112 PolarHBondContact O-N 2.88Å; N112-Y114 PolarHBondContact O-N 2.93Å; N112-Y114 VanDerWaalsContact O-N 3.12Å; N112-Y114 WeakPolarHBondContact OD1-CD2 3.2Å; N112-N115 HydrophobicContact CB-CB 4.21Å; N112-N115 PolarHBondContact ND2-ND2 3.32Å; N112-N115 PolarHBondContact ND2-OD1 3.01Å; N112-N115 VanDerWaalsContact O-CB 3.31Å; N112-N115 WeakPolarHBondContact O-CB 3.39Å; N112-N115 PolarHBondContact O-N 2.86Å; N112-V116 PolarHBondContact O-N 3.26Å |
| 113 | G | 84.5 | Confident | 85.8 | Confident | 55 Ų | 55 | 61.7 Ų | 61.7 | 57% | 0.567 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -55.2 | -34.7 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | N115 V116 L117 | G113-N115 VanDerWaalsContact C-N 3.3Å; G113-N115 PolarHBondContact O-N 3.22Å; G113-V116 PolarHBondContact O-N 3.44Å; G113-L117 PolarHBondContact O-N 3.36Å |
| 114 | Y | 85.8 | Confident | 85.7 | Confident | 60 Ų | 60 | 59.8 Ų | 59.8 | 24% | 0.235 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -66.7 | -29.7 | 176.3 | -59.6 | -75.7 | 0 | 0 | 0 | 113.5 | N112 D118 I157 S158 R164 | N112-Y114 PolarHBondContact O-N 2.93Å; N112-Y114 VanDerWaalsContact O-N 3.12Å; N112-Y114 WeakPolarHBondContact OD1-CD2 3.2Å; Y114-D118 PolarHBondContact O-N 3.05Å; Y114-D118 VanDerWaalsContact O-N 3.16Å; Y114-I157 HydrophobicContact CD1-CG2 4.45Å; Y114-I157 HydrophobicContact CE1-CG2 4.39Å; Y114-S158 PolarHBondContact O-OG 3.32Å; Y114-R164 HydrophobicContact CD1-CG 4.34Å; Y114-R164 VanDerWaalsContact CD2-NH1 3.28Å; Y114-R164 HydrophobicContact CE1-CB 4.41Å; Y114-R164 HydrophobicContact CE1-CG 3.79Å |
| 115 | N | 87.1 | Confident | 85.7 | Confident | 31 Ų | 31 | 59.7 Ų | 59.7 | 17% | 0.166 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -74.2 | -34.6 | 174.1 | -70.5 | -6.7 | 0 | 0 | 0 | 111 | Y109 N112 G113 L117 D118 V119 | Y109-N115 HydrophobicContact CD1-CB 4.14Å; Y109-N115 HydrophobicContact CD2-CB 3.79Å; Y109-N115 WeakPolarHBondContact CD2-ND2 3.49Å; Y109-N115 HydrophobicContact CE1-CB 3.88Å; Y109-N115 HydrophobicContact CE2-CB 3.45Å; Y109-N115 VanDerWaalsContact CE2-CB 3.45Å; Y109-N115 HydrophobicContact CG-CB 4.09Å; Y109-N115 WeakPolarHBondContact O-CB 3.26Å; Y109-N115 PolarHBondContact O-ND2 3.45Å; Y109-N115 PolarHBondContact OH-O 2.84Å; Y109-N115 VanDerWaalsContact OH-O 3.13Å; N112-N115 HydrophobicContact CB-CB 4.21Å; N112-N115 PolarHBondContact ND2-ND2 3.32Å; N112-N115 PolarHBondContact ND2-OD1 3.01Å; N112-N115 VanDerWaalsContact O-CB 3.31Å; N112-N115 WeakPolarHBondContact O-CB 3.39Å; N112-N115 PolarHBondContact O-N 2.86Å; G113-N115 VanDerWaalsContact C-N 3.3Å; G113-N115 PolarHBondContact O-N 3.22Å; N115-L117 VanDerWaalsContact C-N 3.33Å; N115-D118 WeakPolarHBondContact O-CB 3.27Å; N115-D118 PolarHBondContact O-N 3.41Å; N115-V119 PolarHBondContact O-N 3.37Å |
| 116 | V | 88.5 | Confident | 85.8 | Confident | 51 Ų | 51 | 60.2 Ų | 60.2 | 31% | 0.309 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -66.1 | -38.7 | 173 | -178.2 | 0 | 0 | 0 | 0 | 110.5 | N112 G113 D118 V119 I120 | N112-V116 PolarHBondContact O-N 3.26Å; G113-V116 PolarHBondContact O-N 3.44Å; V116-D118 PolarHBondContact O-N 2.8Å; V116-V119 PolarHBondContact O-N 3.33Å; V116-V119 VanDerWaalsContact O-N 3.16Å; V116-I120 HydrophobicContact CG1-CD1 4.04Å; V116-I120 HydrophobicContact CG1-CG1 4.5Å; V116-I120 WeakPolarHBondContact O-CG1 3.4Å; V116-I120 PolarHBondContact O-N 3.48Å |
| 117 | L | 88.1 | Confident | 85.9 | Confident | 46 Ų | 46 | 59.9 Ų | 59.9 | 24% | 0.241 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -59 | -43.7 | 172 | -172.8 | 154.6 | 0 | 0 | 0 | 111.9 | G113 N115 V119 I120 V121 I157 | G113-L117 PolarHBondContact O-N 3.36Å; N115-L117 VanDerWaalsContact C-N 3.33Å; L117-V119 VanDerWaalsContact C-N 3.27Å; L117-V119 PolarHBondContact O-N 3.46Å; L117-I120 PolarHBondContact O-N 3.24Å; L117-V121 HydrophobicContact CD2-CG2 3.9Å; L117-V121 WeakPolarHBondContact O-CB 3.3Å; L117-V121 WeakPolarHBondContact O-CG2 3.49Å; L117-V121 PolarHBondContact O-N 3.39Å; L117-I157 HydrophobicContact CD1-CD1 4.36Å |
| 118 | D | 87.8 | Confident | 85.8 | Confident | 5 Ų | 5 | 54.6 Ų | 54.6 | 3% | 0.027 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -57.6 | -38.3 | 174.9 | -76.9 | -14.5 | 0 | 0 | 0 | 112.5 | K101 Y114 N115 V116 M122 S158 | K101-D118 IonicContact NZ-OD2 3.35Å; K101-D118 PolarHBondContact NZ-OD2 3.48Å; Y114-D118 PolarHBondContact O-N 3.05Å; Y114-D118 VanDerWaalsContact O-N 3.16Å; N115-D118 WeakPolarHBondContact O-CB 3.27Å; N115-D118 PolarHBondContact O-N 3.41Å; V116-D118 PolarHBondContact O-N 2.8Å; D118-M122 PolarHBondContact O-N 3.46Å; D118-S158 WeakPolarHBondContact OD1-CB 3.42Å; D118-S158 PolarHBondContact OD1-OG 2.98Å |
| 119 | V | 89.4 | Confident | 85.7 | Confident | 24 Ų | 24 | 57.6 Ų | 57.6 | 15% | 0.145 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -70.9 | -44.1 | 176.4 | 175.9 | 0 | 0 | 0 | 0 | 111.5 | L98 Y109 N115 V116 L117 V121 M122 I123 | L98-V119 HydrophobicContact CD1-CG2 3.9Å; L98-V119 HydrophobicContact CD2-CG2 4.46Å; Y109-V119 HydrophobicContact CE1-CG2 3.71Å; N115-V119 PolarHBondContact O-N 3.37Å; V116-V119 PolarHBondContact O-N 3.33Å; V116-V119 VanDerWaalsContact O-N 3.16Å; L117-V119 VanDerWaalsContact C-N 3.27Å; L117-V119 PolarHBondContact O-N 3.46Å; V119-V121 VanDerWaalsContact C-N 3.32Å; V119-V121 PolarHBondContact O-N 2.86Å; V119-M122 VanDerWaalsContact O-CB 3.29Å; V119-M122 WeakPolarHBondContact O-CB 3.33Å; V119-M122 PolarHBondContact O-N 3.08Å; V119-M122 VanDerWaalsContact O-N 3.12Å; V119-I123 HydrophobicContact CG1-CD1 4.07Å; V119-I123 WeakPolarHBondContact O-CG1 3.31Å; V119-I123 PolarHBondContact O-N 2.89Å |
| 120 | I | 88.9 | Confident | 85.3 | Confident | 92 Ų | 92 | 60.2 Ų | 60.2 | 47% | 0.472 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60.1 | -45.2 | 177 | -68.4 | 165.8 | 0 | 0 | 0 | 110.2 | V116 L117 M122 I123 I124 | V116-I120 HydrophobicContact CG1-CD1 4.04Å; V116-I120 HydrophobicContact CG1-CG1 4.5Å; V116-I120 WeakPolarHBondContact O-CG1 3.4Å; V116-I120 PolarHBondContact O-N 3.48Å; L117-I120 PolarHBondContact O-N 3.24Å; I120-M122 VanDerWaalsContact C-N 3.3Å; I120-M122 PolarHBondContact O-N 3.17Å; I120-I123 PolarHBondContact O-N 3.44Å; I120-I124 HydrophobicContact CG2-CD1 4Å; I120-I124 WeakPolarHBondContact O-CG1 3.15Å; I120-I124 PolarHBondContact O-N 2.81Å |
| 121 | V | 88.8 | Confident | 85.1 | Confident | 4 Ų | 4 | 54.8 Ų | 54.8 | 2% | 0.024 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -62.9 | -36.2 | 175.8 | 172 | 0 | 0 | 0 | 0 | 111.6 | L117 V119 I124 M125 R152 L154 K155 | L117-V121 HydrophobicContact CD2-CG2 3.9Å; L117-V121 WeakPolarHBondContact O-CB 3.3Å; L117-V121 WeakPolarHBondContact O-CG2 3.49Å; L117-V121 PolarHBondContact O-N 3.39Å; V119-V121 VanDerWaalsContact C-N 3.32Å; V119-V121 PolarHBondContact O-N 2.86Å; V121-I124 PolarHBondContact O-N 2.94Å; V121-M125 HydrophobicContact CG1-CE 3.86Å; V121-M125 WeakPolarHBondContact O-CG 3.45Å; V121-M125 PolarHBondContact O-N 2.88Å; V121-R152 HydrophobicContact CG1-CB 4.46Å; V121-L154 HydrophobicContact CG2-CB 4.24Å; V121-K155 HydrophobicContact CG1-CB 4.21Å |
| 122 | M | 88.2 | Confident | 84.7 | Confident | 14 Ų | 14 | 52.6 Ų | 52.6 | 7% | 0.069 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -61.4 | -46.2 | 172.3 | -169 | 61.4 | 58.8 | 0 | 0 | 112.2 | C94 L98 D118 V119 I120 I124 M125 L126 | C94-M122 HydrophobicContact CB-CE 3.93Å; C94-M122 WeakPolarHBondContact O-CE 3.49Å; L98-M122 HydrophobicContact CB-CE 3.86Å; L98-M122 HydrophobicContact CD2-CB 3.86Å; L98-M122 HydrophobicContact CD2-CE 3.93Å; L98-M122 HydrophobicContact CD2-CG 3.66Å; D118-M122 PolarHBondContact O-N 3.46Å; V119-M122 VanDerWaalsContact O-CB 3.29Å; V119-M122 WeakPolarHBondContact O-CB 3.33Å; V119-M122 PolarHBondContact O-N 3.08Å; V119-M122 VanDerWaalsContact O-N 3.12Å; I120-M122 VanDerWaalsContact C-N 3.3Å; I120-M122 PolarHBondContact O-N 3.17Å; M122-I124 VanDerWaalsContact C-N 3.28Å; M122-I124 PolarHBondContact O-N 3.19Å; M122-M125 WeakPolarHBondContact O-CB 3.24Å; M122-M125 PolarHBondContact O-N 3.39Å; M122-M125 VanDerWaalsContact O-N 3.09Å; M122-M125 HydrophobicContact SD-SD 4.35Å; M122-L126 HydrophobicContact CG-CD1 4.01Å; M122-L126 VanDerWaalsContact O-CD1 3.27Å; M122-L126 WeakPolarHBondContact O-CD1 3.36Å; M122-L126 PolarHBondContact O-N 3.09Å; M122-L126 HydrophobicContact SD-CD1 3.82Å |
| 123 | I | 88.3 | Confident | 84.5 | Confident | 103 Ų | 103 | 56.5 Ų | 56.5 | 53% | 0.528 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -60.7 | -41.7 | 178.8 | -65.5 | 166.1 | 0 | 0 | 0 | 110 | V119 I120 M125 L126 L127 | V119-I123 HydrophobicContact CG1-CD1 4.07Å; V119-I123 WeakPolarHBondContact O-CG1 3.31Å; V119-I123 PolarHBondContact O-N 2.89Å; I120-I123 PolarHBondContact O-N 3.44Å; I123-M125 VanDerWaalsContact C-N 3.32Å; I123-M125 PolarHBondContact O-N 3.42Å; I123-L126 PolarHBondContact O-N 2.99Å; I123-L127 PolarHBondContact O-N 3.29Å |
| 124 | I | 86.1 | Confident | 84 | Confident | 25 Ų | 25 | 60.9 Ų | 60.9 | 13% | 0.128 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -62.8 | -36.7 | 175.3 | -65.2 | 164.8 | 0 | 0 | 0 | 111.8 | I120 V121 M122 L127 M148 L151 | I120-I124 HydrophobicContact CG2-CD1 4Å; I120-I124 WeakPolarHBondContact O-CG1 3.15Å; I120-I124 PolarHBondContact O-N 2.81Å; V121-I124 PolarHBondContact O-N 2.94Å; M122-I124 VanDerWaalsContact C-N 3.28Å; M122-I124 PolarHBondContact O-N 3.19Å; I124-L127 WeakPolarHBondContact O-CB 3.29Å; I124-M148 HydrophobicContact CG1-CE 4.42Å; I124-M148 HydrophobicContact CG2-CB 4.18Å; I124-M148 VanDerWaalsContact CG2-O 3.24Å; I124-M148 WeakPolarHBondContact CG2-O 3.49Å; I124-L151 HydrophobicContact CD1-CD1 4.21Å; I124-L151 HydrophobicContact CG2-CB 4.41Å |
| 125 | M | 84.5 | Confident | 83 | Confident | 8 Ų | 8 | 63.6 Ų | 63.6 | 4% | 0.039 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -66.6 | -33.8 | 174.1 | -69.8 | 169.4 | 174.1 | 0 | 0 | 113.1 | V91 C94 V121 M122 I123 R152 K155 | V91-M125 HydrophobicContact CG2-CB 4.42Å; C94-M125 HydrophobicContact CB-CE 4.38Å; C94-M125 HydrophobicContact CB-SD 4Å; V121-M125 HydrophobicContact CG1-CE 3.86Å; V121-M125 WeakPolarHBondContact O-CG 3.45Å; V121-M125 PolarHBondContact O-N 2.88Å; M122-M125 WeakPolarHBondContact O-CB 3.24Å; M122-M125 PolarHBondContact O-N 3.39Å; M122-M125 VanDerWaalsContact O-N 3.09Å; M122-M125 HydrophobicContact SD-SD 4.35Å; I123-M125 VanDerWaalsContact C-N 3.32Å; I123-M125 PolarHBondContact O-N 3.42Å; M125-R152 HydrophobicContact CE-CB 3.52Å; M125-R152 HydrophobicContact CG-CB 4.39Å; M125-K155 HydrophobicContact CE-CD 4.3Å |
| 126 | L | 84.5 | Confident | 81.9 | Confident | 74 Ų | 74 | 63.7 Ų | 63.7 | 39% | 0.387 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -85.3 | -22.9 | 179.8 | -87.2 | 75.3 | 0 | 0 | 0 | 113.5 | V91 M122 I123 P128 Y129 T130 | V91-L126 HydrophobicContact CG1-CD1 4.27Å; M122-L126 HydrophobicContact CG-CD1 4.01Å; M122-L126 VanDerWaalsContact O-CD1 3.27Å; M122-L126 WeakPolarHBondContact O-CD1 3.36Å; M122-L126 PolarHBondContact O-N 3.09Å; M122-L126 HydrophobicContact SD-CD1 3.82Å; I123-L126 PolarHBondContact O-N 2.99Å; L126-P128 VanDerWaalsContact C-CD 3.5Å; L126-Y129 WeakPolarHBondContact O-CB 3.48Å; L126-Y129 PolarHBondContact O-N 2.94Å; L126-T130 PolarHBondContact O-N 2.93Å; L126-T130 PolarHBondContact O-OG1 2.9Å |
| 127 | L | 84.4 | Confident | 80.5 | Confident | 51 Ų | 51 | 72.4 Ų | 72.4 | 27% | 0.267 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -45 | -51.1 | 179 | -162.8 | 82.2 | 0 | 0 | 0 | 114.9 | I123 I124 Y129 T130 V131 A145 M148 | I123-L127 PolarHBondContact O-N 3.29Å; I124-L127 WeakPolarHBondContact O-CB 3.29Å; L127-Y129 VanDerWaalsContact C-N 3.29Å; L127-Y129 PolarHBondContact O-N 3.22Å; L127-T130 PolarHBondContact O-N 3.02Å; L127-T130 PolarHBondContact O-OG1 3.37Å; L127-V131 HydrophobicContact CG-CG2 4.27Å; L127-V131 VanDerWaalsContact O-CB 3.3Å; L127-V131 WeakPolarHBondContact O-CB 3.34Å; L127-V131 WeakPolarHBondContact O-CG2 3.46Å; L127-V131 PolarHBondContact O-N 2.88Å; L127-A145 HydrophobicContact CD2-CB 3.94Å; L127-A145 HydrophobicContact CG-CB 4.45Å; L127-M148 HydrophobicContact CD2-CE 4.11Å; L127-M148 HydrophobicContact CD2-SD 3.86Å |
| 128 | P | 78.4 | Confident | 79 | Confident | 13 Ų | 13 | 79.3 Ų | 79.3 | 8% | 0.084 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -64.7 | -31.4 | -179.3 | 28 | -39.5 | 0 | 0 | 0 | 113.4 | L126 R132 Q149 | L126-P128 VanDerWaalsContact C-CD 3.5Å; P128-R132 WeakPolarHBondContact O-CB 3.38Å; P128-R132 PolarHBondContact O-N 3.45Å; P128-Q149 HydrophobicContact CB-CG 4.49Å; P128-Q149 HydrophobicContact CG-CG 3.91Å |
| 129 | Y | 78.8 | Confident | 77.6 | Confident | 165 Ų | 165 | 84.5 Ų | 84.5 | 65% | 0.647 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -72 | -51.1 | 178.2 | -175.7 | -91.9 | 0 | 0 | 0 | 110.3 | L126 L127 V131 R132 E133 | L126-Y129 WeakPolarHBondContact O-CB 3.48Å; L126-Y129 PolarHBondContact O-N 2.94Å; L127-Y129 VanDerWaalsContact C-N 3.29Å; L127-Y129 PolarHBondContact O-N 3.22Å; Y129-V131 PolarHBondContact O-N 3.26Å; Y129-R132 PolarHBondContact O-N 2.94Å; Y129-E133 WeakPolarHBondContact CE1-OE2 3.11Å; Y129-E133 PolarHBondContact O-N 3.35Å |
| 130 | T | 76.1 | Confident | 76.4 | Confident | 64 Ų | 64 | 87.5 Ų | 87.5 | 39% | 0.393 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -66.2 | -37.4 | -179.4 | 56.5 | 0 | 0 | 0 | 0 | 112.5 | L126 L127 E133 L134 | L126-T130 PolarHBondContact O-N 2.93Å; L126-T130 PolarHBondContact O-OG1 2.9Å; L127-T130 PolarHBondContact O-N 3.02Å; L127-T130 PolarHBondContact O-OG1 3.37Å; T130-E133 PolarHBondContact O-N 2.93Å; T130-L134 WeakPolarHBondContact O-CB 3.21Å; T130-L134 PolarHBondContact O-N 2.95Å |
| 131 | V | 79.5 | Confident | 75.3 | Confident | 35 Ų | 35 | 91.4 Ų | 91.4 | 21% | 0.212 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -65.3 | -40.2 | 174.1 | 170.9 | 0 | 0 | 0 | 0 | 111.4 | L127 Y129 M135 V142 | L127-V131 HydrophobicContact CG-CG2 4.27Å; L127-V131 VanDerWaalsContact O-CB 3.3Å; L127-V131 WeakPolarHBondContact O-CB 3.34Å; L127-V131 WeakPolarHBondContact O-CG2 3.46Å; L127-V131 PolarHBondContact O-N 2.88Å; Y129-V131 PolarHBondContact O-N 3.26Å; V131-M135 HydrophobicContact CG1-CB 4.48Å; V131-M135 WeakPolarHBondContact O-CB 3.31Å; V131-M135 PolarHBondContact O-N 3.22Å; V131-V142 HydrophobicContact CG1-CG2 4.1Å |
| 132 | R | 76.4 | Confident | 74.4 | Confident | 123 Ų | 123 | 92.2 Ų | 92.2 | 46% | 0.464 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -68.4 | -34.3 | 178.7 | -171.5 | 179.8 | -63.7 | -179.3 | 3.8 | 112.4 | P128 Y129 | P128-R132 WeakPolarHBondContact O-CB 3.38Å; P128-R132 PolarHBondContact O-N 3.45Å; Y129-R132 PolarHBondContact O-N 2.94Å |
| 133 | E | 79.9 | Confident | 73.7 | Confident | 144 Ų | 144 | 98.4 Ų | 98.4 | 67% | 0.673 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -75.7 | -43.8 | 176.6 | -171.8 | 172.9 | -165.6 | 0 | 0 | 112.5 | Y129 T130 | Y129-E133 WeakPolarHBondContact CE1-OE2 3.11Å; Y129-E133 PolarHBondContact O-N 3.35Å; T130-E133 PolarHBondContact O-N 2.93Å |
| 134 | L | 74.3 | Confident | 73.2 | Confident | 146 Ų | 146 | 98.3 Ų | 98.3 | 76% | 0.764 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -84.7 | -42.2 | -173.3 | -168.9 | 72.4 | 0 | 0 | 0 | 114.1 | T130 | T130-L134 WeakPolarHBondContact O-CB 3.21Å; T130-L134 PolarHBondContact O-N 2.95Å |
| 135 | M | 65.7 | Low | 72.7 | Confident | 117 Ų | 117 | 97.3 Ų | 97.3 | 58% | 0.576 | 47% | 0.465 | S | S | * | . | S | Bend | trans | -101.8 | -9.5 | -168.8 | -115.4 | 68.8 | 179 | 0 | 0 | 114.2 | V131 F139 | V131-M135 HydrophobicContact CG1-CB 4.48Å; V131-M135 WeakPolarHBondContact O-CB 3.31Å; V131-M135 PolarHBondContact O-N 3.22Å; M135-F139 HydrophobicContact CB-CD2 4.24Å; M135-F139 HydrophobicContact CG-CD2 4.25Å; M135-F139 HydrophobicContact CG-CE2 4.44Å; M135-F139 VanDerWaalsContact O-CD2 3.31Å; M135-F139 WeakPolarHBondContact O-CD2 3.46Å; M135-F139 VanDerWaalsContact O-CE2 3.28Å; M135-F139 WeakPolarHBondContact O-CE2 3.31Å |
| 136 | G | 63.4 | Low | 72.3 | Confident | 33 Ų | 33 | 98.7 Ų | 98.7 | 34% | 0.34 | 47% | 0.472 | S | S | . | . | trans | 73.2 | 168.7 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | Q138 | G136-Q138 VanDerWaalsContact C-N 3.3Å; G136-Q138 PolarHBondContact O-N 3.44Å; G136-Q138 VanDerWaalsContact O-N 3.15Å | ||
| 137 | R | 58.8 | Low | 72.2 | Confident | 234 Ų | 234 | 97.1 Ų | 97.1 | 88% | 0.883 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.5 | 1 | -160.4 | -156.8 | 173.9 | -178.6 | 166.3 | 1.3 | 116 | ||
| 138 | Q | 56.4 | Low | 72.1 | Confident | 192 Ų | 192 | 98 Ų | 98 | 90% | 0.897 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.2 | -1.8 | -165 | -100.2 | -162.5 | -19.7 | 0 | 0 | 116.9 | G136 | G136-Q138 VanDerWaalsContact C-N 3.3Å; G136-Q138 PolarHBondContact O-N 3.44Å; G136-Q138 VanDerWaalsContact O-N 3.15Å |
| 139 | F | 59.1 | Low | 72.2 | Confident | 113 Ų | 113 | 98 Ų | 98 | 50% | 0.496 | 48% | 0.477 | S | S | . | . | trans | -91 | 136.2 | -175.9 | -72.2 | -77.3 | 0 | 0 | 0 | 113.9 | M135 Y141 V142 | M135-F139 HydrophobicContact CB-CD2 4.24Å; M135-F139 HydrophobicContact CG-CD2 4.25Å; M135-F139 HydrophobicContact CG-CE2 4.44Å; M135-F139 VanDerWaalsContact O-CD2 3.31Å; M135-F139 WeakPolarHBondContact O-CD2 3.46Å; M135-F139 VanDerWaalsContact O-CE2 3.28Å; M135-F139 WeakPolarHBondContact O-CE2 3.31Å; F139-Y141 HydrophobicContact CB-CD2 4.23Å; F139-Y141 PolarHBondContact O-N 2.94Å; F139-Y141 VanDerWaalsContact O-N 3.07Å; F139-V142 WeakPolarHBondContact O-CB 3.21Å; F139-V142 WeakPolarHBondContact O-CG2 3.39Å; F139-V142 PolarHBondContact O-N 3.02Å | ||
| 140 | S | 63.1 | Low | 72.4 | Confident | 88 Ų | 88 | 93 Ų | 93 | 62% | 0.615 | 47% | 0.466 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.7 | -30.3 | 175.4 | -170.3 | 0 | 0 | 0 | 0 | 113.3 | V142 H143 | S140-V142 PolarHBondContact O-N 3.31Å; S140-V142 VanDerWaalsContact O-N 3.11Å; S140-H143 PolarHBondContact O-N 3.26Å; S140-H143 VanDerWaalsContact O-N 3.08Å |
| 141 | Y | 67.3 | Low | 72.8 | Confident | 173 Ų | 173 | 93.4 Ų | 93.4 | 68% | 0.678 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -56 | -24.2 | 174.3 | -61.6 | -69.7 | 0 | 0 | 0 | 114.5 | F139 H143 I144 A145 | F139-Y141 HydrophobicContact CB-CD2 4.23Å; F139-Y141 PolarHBondContact O-N 2.94Å; F139-Y141 VanDerWaalsContact O-N 3.07Å; Y141-H143 VanDerWaalsContact C-N 3.33Å; Y141-H143 PolarHBondContact O-N 3.13Å; Y141-I144 HydrophobicContact CD1-CD1 4.47Å; Y141-I144 PolarHBondContact O-N 3.08Å; Y141-A145 WeakPolarHBondContact O-CB 3.22Å; Y141-A145 PolarHBondContact O-N 3.33Å |
| 142 | V | 70.1 | Confident | 73.1 | Confident | 22 Ų | 22 | 92.1 Ų | 92.1 | 13% | 0.133 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -62.6 | -40.6 | 175.6 | 178.4 | 0 | 0 | 0 | 0 | 111 | V131 F139 S140 I144 A145 D146 | V131-V142 HydrophobicContact CG1-CG2 4.1Å; F139-V142 WeakPolarHBondContact O-CB 3.21Å; F139-V142 WeakPolarHBondContact O-CG2 3.39Å; F139-V142 PolarHBondContact O-N 3.02Å; S140-V142 PolarHBondContact O-N 3.31Å; S140-V142 VanDerWaalsContact O-N 3.11Å; V142-I144 VanDerWaalsContact C-N 3.34Å; V142-I144 PolarHBondContact O-N 3.17Å; V142-A145 PolarHBondContact O-N 3.18Å; V142-D146 WeakPolarHBondContact O-CB 3.49Å; V142-D146 PolarHBondContact O-N 2.91Å |
| 143 | H | 73.3 | Confident | 73.6 | Confident | 144 Ų | 144 | 90.3 Ų | 90.3 | 67% | 0.667 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -67.4 | -35 | 178.4 | -64.9 | -55 | 0 | 0 | 0 | 112.6 | S140 Y141 G147 | S140-H143 PolarHBondContact O-N 3.26Å; S140-H143 VanDerWaalsContact O-N 3.08Å; Y141-H143 VanDerWaalsContact C-N 3.33Å; Y141-H143 PolarHBondContact O-N 3.13Å; H143-G147 PolarHBondContact O-N 3.23Å |
| 144 | I | 77.1 | Confident | 73.9 | Confident | 101 Ų | 101 | 86.9 Ų | 86.9 | 52% | 0.518 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -69.2 | -44.5 | 175.2 | -56.9 | 176 | 0 | 0 | 0 | 109.9 | Y141 V142 D146 G147 M148 | Y141-I144 HydrophobicContact CD1-CD1 4.47Å; Y141-I144 PolarHBondContact O-N 3.08Å; V142-I144 VanDerWaalsContact C-N 3.34Å; V142-I144 PolarHBondContact O-N 3.17Å; I144-D146 VanDerWaalsContact C-N 3.35Å; I144-D146 PolarHBondContact O-N 3.12Å; I144-G147 PolarHBondContact O-N 3.32Å; I144-G147 VanDerWaalsContact O-N 3.15Å; I144-M148 WeakPolarHBondContact O-CG 3.34Å; I144-M148 PolarHBondContact O-N 3.02Å |
| 145 | A | 76.5 | Confident | 74.5 | Confident | 4 Ų | 4 | 80 Ų | 80 | 3% | 0.033 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -61.4 | -40.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L127 Y141 V142 G147 M148 Q149 | L127-A145 HydrophobicContact CD2-CB 3.94Å; L127-A145 HydrophobicContact CG-CB 4.45Å; Y141-A145 WeakPolarHBondContact O-CB 3.22Å; Y141-A145 PolarHBondContact O-N 3.33Å; V142-A145 PolarHBondContact O-N 3.18Å; A145-G147 VanDerWaalsContact C-N 3.34Å; A145-M148 PolarHBondContact O-N 3.39Å; A145-Q149 WeakPolarHBondContact O-CG 3.46Å; A145-Q149 PolarHBondContact O-N 2.91Å |
| 146 | D | 76.1 | Confident | 75.5 | Confident | 36 Ų | 36 | 76.4 Ų | 76.4 | 19% | 0.193 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -62.2 | -39.5 | 173.1 | -75.5 | -18.3 | 0 | 0 | 0 | 111.8 | V142 I144 Q149 | V142-D146 WeakPolarHBondContact O-CB 3.49Å; V142-D146 PolarHBondContact O-N 2.91Å; I144-D146 VanDerWaalsContact C-N 3.35Å; I144-D146 PolarHBondContact O-N 3.12Å; D146-Q149 VanDerWaalsContact O-CB 3.27Å; D146-Q149 WeakPolarHBondContact O-CB 3.46Å; D146-Q149 WeakPolarHBondContact O-CG 3.39Å; D146-Q149 PolarHBondContact O-N 3.04Å; D146-Q149 PolarHBondContact OD1-NE2 3.02Å |
| 147 | G | 81 | Confident | 76.7 | Confident | 42 Ų | 42 | 75.8 Ų | 75.8 | 43% | 0.433 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -64.7 | -43.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | H143 I144 A145 Q149 S150 | H143-G147 PolarHBondContact O-N 3.23Å; I144-G147 PolarHBondContact O-N 3.32Å; I144-G147 VanDerWaalsContact O-N 3.15Å; A145-G147 VanDerWaalsContact C-N 3.34Å; G147-Q149 PolarHBondContact O-N 3.31Å; G147-Q149 VanDerWaalsContact O-N 3.15Å; G147-S150 VanDerWaalsContact O-CB 3.31Å; G147-S150 WeakPolarHBondContact O-CB 3.5Å; G147-S150 PolarHBondContact O-N 2.98Å; G147-S150 VanDerWaalsContact O-N 3.07Å; G147-S150 PolarHBondContact O-OG 3.41Å |
| 148 | M | 82.5 | Confident | 77.9 | Confident | 70 Ų | 70 | 65.2 Ų | 65.2 | 35% | 0.345 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -58 | -26.7 | 177.5 | -73.5 | 179.7 | 68.9 | 0 | 0 | 112.8 | I124 L127 I144 A145 S150 L151 | I124-M148 HydrophobicContact CG1-CE 4.42Å; I124-M148 HydrophobicContact CG2-CB 4.18Å; I124-M148 VanDerWaalsContact CG2-O 3.24Å; I124-M148 WeakPolarHBondContact CG2-O 3.49Å; L127-M148 HydrophobicContact CD2-CE 4.11Å; L127-M148 HydrophobicContact CD2-SD 3.86Å; I144-M148 WeakPolarHBondContact O-CG 3.34Å; I144-M148 PolarHBondContact O-N 3.02Å; A145-M148 PolarHBondContact O-N 3.39Å; M148-S150 PolarHBondContact O-N 2.6Å; M148-L151 HydrophobicContact CB-CD1 4.48Å; M148-L151 VanDerWaalsContact O-CB 3.25Å; M148-L151 WeakPolarHBondContact O-CB 3.36Å; M148-L151 VanDerWaalsContact O-CG 3.32Å; M148-L151 WeakPolarHBondContact O-CG 3.34Å; M148-L151 PolarHBondContact O-N 2.93Å |
| 149 | Q | 80.4 | Confident | 79.2 | Confident | 11 Ų | 11 | 57.7 Ų | 57.7 | 5% | 0.051 | 30% | 0.303 | C | S | . | . | G | 310 helix | trans | -52.8 | -30.7 | 174.8 | -62.5 | -163.5 | 48.3 | 0 | 0 | 113 | M67 P128 A145 D146 G147 L151 R152 | M67-Q149 HydrophobicContact CE-CB 4.49Å; P128-Q149 HydrophobicContact CB-CG 4.49Å; P128-Q149 HydrophobicContact CG-CG 3.91Å; A145-Q149 WeakPolarHBondContact O-CG 3.46Å; A145-Q149 PolarHBondContact O-N 2.91Å; D146-Q149 VanDerWaalsContact O-CB 3.27Å; D146-Q149 WeakPolarHBondContact O-CB 3.46Å; D146-Q149 WeakPolarHBondContact O-CG 3.39Å; D146-Q149 PolarHBondContact O-N 3.04Å; D146-Q149 PolarHBondContact OD1-NE2 3.02Å; G147-Q149 PolarHBondContact O-N 3.31Å; G147-Q149 VanDerWaalsContact O-N 3.15Å; Q149-L151 PolarHBondContact O-N 3.14Å; Q149-R152 WeakPolarHBondContact O-CB 3.49Å; Q149-R152 WeakPolarHBondContact O-CD 3.41Å; Q149-R152 WeakPolarHBondContact O-CG 3.38Å; Q149-R152 PolarHBondContact O-N 3.35Å; Q149-R152 VanDerWaalsContact O-N 3.12Å; Q149-R152 PolarHBondContact O-NE 3.33Å |
| 150 | S | 83.8 | Confident | 80.5 | Confident | 61 Ų | 61 | 54.2 Ų | 54.2 | 43% | 0.427 | 29% | 0.292 | S | S | . | . | G | 310 helix | trans | -59.3 | -27.7 | 178.5 | -48.1 | 0 | 0 | 0 | 0 | 112.8 | G147 M148 R152 I153 | G147-S150 VanDerWaalsContact O-CB 3.31Å; G147-S150 WeakPolarHBondContact O-CB 3.5Å; G147-S150 PolarHBondContact O-N 2.98Å; G147-S150 VanDerWaalsContact O-N 3.07Å; G147-S150 PolarHBondContact O-OG 3.41Å; M148-S150 PolarHBondContact O-N 2.6Å; S150-R152 PolarHBondContact O-N 3.22Å; S150-I153 WeakPolarHBondContact O-CG2 3.37Å; S150-I153 PolarHBondContact O-N 3.3Å |
| 151 | L | 85.1 | Confident | 81.6 | Confident | 72 Ų | 72 | 60.1 Ų | 60.1 | 38% | 0.377 | 30% | 0.301 | S | S | . | . | G | 310 helix | trans | -62.5 | -11.1 | 177.1 | -60 | 174.5 | 0 | 0 | 0 | 113.1 | I124 M148 Q149 I153 L154 | I124-L151 HydrophobicContact CD1-CD1 4.21Å; I124-L151 HydrophobicContact CG2-CB 4.41Å; M148-L151 HydrophobicContact CB-CD1 4.48Å; M148-L151 VanDerWaalsContact O-CB 3.25Å; M148-L151 WeakPolarHBondContact O-CB 3.36Å; M148-L151 VanDerWaalsContact O-CG 3.32Å; M148-L151 WeakPolarHBondContact O-CG 3.34Å; M148-L151 PolarHBondContact O-N 2.93Å; Q149-L151 PolarHBondContact O-N 3.14Å; L151-I153 PolarHBondContact O-N 2.88Å; L151-I153 VanDerWaalsContact O-N 3.09Å; L151-L154 HydrophobicContact CB-CD1 4.13Å; L151-L154 HydrophobicContact CD2-CD1 4.28Å; L151-L154 WeakPolarHBondContact O-CB 3.29Å; L151-L154 WeakPolarHBondContact O-CG 3.45Å; L151-L154 PolarHBondContact O-N 2.93Å |
| 152 | R | 84.5 | Confident | 82.6 | Confident | 9 Ų | 9 | 53.9 Ų | 53.9 | 3% | 0.034 | 29% | 0.289 | C | S | . | . | G | 310 helix | trans | -55.4 | -23.7 | 171 | 68.4 | -176.1 | 63.6 | -160.9 | 0.9 | 114.3 | N63 V121 M125 Q149 S150 L154 K155 | N63-R152 WeakPolarHBondContact OD1-CD 3.15Å; N63-R152 PolarHBondContact OD1-NH1 2.87Å; V121-R152 HydrophobicContact CG1-CB 4.46Å; M125-R152 HydrophobicContact CE-CB 3.52Å; M125-R152 HydrophobicContact CG-CB 4.39Å; Q149-R152 WeakPolarHBondContact O-CB 3.49Å; Q149-R152 WeakPolarHBondContact O-CD 3.41Å; Q149-R152 WeakPolarHBondContact O-CG 3.38Å; Q149-R152 PolarHBondContact O-N 3.35Å; Q149-R152 VanDerWaalsContact O-N 3.12Å; Q149-R152 PolarHBondContact O-NE 3.33Å; S150-R152 PolarHBondContact O-N 3.22Å; R152-L154 PolarHBondContact O-N 2.58Å; R152-K155 WeakPolarHBondContact O-CB 3.4Å; R152-K155 PolarHBondContact O-N 2.98Å |
| 153 | I | 86.5 | Confident | 83.4 | Confident | 84 Ų | 84 | 55.1 Ų | 55.1 | 43% | 0.431 | 30% | 0.295 | S | S | . | . | G | 310 helix | trans | -59.8 | -26.2 | 173.3 | -162.4 | 56.8 | 0 | 0 | 0 | 112.4 | V60 S150 L151 K155 L156 | V60-I153 HydrophobicContact CG1-CD1 4.32Å; S150-I153 WeakPolarHBondContact O-CG2 3.37Å; S150-I153 PolarHBondContact O-N 3.3Å; L151-I153 PolarHBondContact O-N 2.88Å; L151-I153 VanDerWaalsContact O-N 3.09Å; I153-K155 PolarHBondContact O-N 3.48Å; I153-K155 VanDerWaalsContact O-N 3.13Å; I153-L156 WeakPolarHBondContact O-CB 3.38Å; I153-L156 PolarHBondContact O-N 3.43Å |
| 154 | L | 87.1 | Confident | 84.2 | Confident | 72 Ų | 72 | 51.3 Ų | 51.3 | 38% | 0.377 | 27% | 0.274 | S | S | . | . | G | 310 helix | trans | -59.5 | -22.6 | 173.7 | -61.5 | 176 | 0 | 0 | 0 | 112.5 | V121 L151 R152 L156 I157 | V121-L154 HydrophobicContact CG2-CB 4.24Å; L151-L154 HydrophobicContact CB-CD1 4.13Å; L151-L154 HydrophobicContact CD2-CD1 4.28Å; L151-L154 WeakPolarHBondContact O-CB 3.29Å; L151-L154 WeakPolarHBondContact O-CG 3.45Å; L151-L154 PolarHBondContact O-N 2.93Å; R152-L154 PolarHBondContact O-N 2.58Å; L154-L156 PolarHBondContact O-N 3.14Å; L154-L156 VanDerWaalsContact O-N 3.1Å; L154-I157 HydrophobicContact CB-CD1 4.11Å; L154-I157 HydrophobicContact CD2-CD1 3.87Å; L154-I157 WeakPolarHBondContact O-CB 3.06Å; L154-I157 WeakPolarHBondContact O-CD1 3.5Å; L154-I157 WeakPolarHBondContact O-CG1 3.1Å; L154-I157 PolarHBondContact O-N 3.49Å |
| 155 | K | 86.5 | Confident | 84.7 | Confident | 2 Ų | 2 | 50.4 Ų | 50.4 | 1% | 0.009 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -59.5 | -21.7 | 173.2 | -155.6 | 172.4 | -174.5 | -174.3 | 0 | 112.7 | V60 C94 E97 V121 M125 R152 I153 I157 S158 Y159 | V60-K155 HydrophobicContact CG2-CB 4.34Å; V60-K155 HydrophobicContact CG2-CD 4.21Å; C94-K155 PolarHBondContact SG-NZ 2.9Å; C94-K155 VanDerWaalsContact SG-NZ 3.45Å; E97-K155 WeakPolarHBondContact OE2-CE 3.49Å; E97-K155 IonicContact OE2-NZ 2.67Å; E97-K155 PolarHBondContact OE2-NZ 2.95Å; V121-K155 HydrophobicContact CG1-CB 4.21Å; M125-K155 HydrophobicContact CE-CD 4.3Å; R152-K155 WeakPolarHBondContact O-CB 3.4Å; R152-K155 PolarHBondContact O-N 2.98Å; I153-K155 PolarHBondContact O-N 3.48Å; I153-K155 VanDerWaalsContact O-N 3.13Å; K155-I157 PolarHBondContact O-N 2.95Å; K155-S158 WeakPolarHBondContact O-CB 3.25Å; K155-S158 PolarHBondContact O-N 3.37Å; K155-Y159 HydrophobicContact CD-CE2 4.48Å; K155-Y159 WeakPolarHBondContact CE-OH 3.37Å; K155-Y159 HydrophobicContact CG-CE2 4Å; K155-Y159 WeakPolarHBondContact O-CD2 3.3Å |
| 156 | L | 87.3 | Confident | 85.3 | Confident | 41 Ų | 41 | 55.9 Ų | 55.9 | 22% | 0.215 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.4 | -28.6 | 173.4 | -166.1 | 65.3 | 0 | 0 | 0 | 112.6 | I57 I153 L154 S158 Y159 S160 I163 | I57-L156 HydrophobicContact CG1-CD1 4.29Å; I57-L156 HydrophobicContact CG2-CD1 3.96Å; I153-L156 WeakPolarHBondContact O-CB 3.38Å; I153-L156 PolarHBondContact O-N 3.43Å; L154-L156 PolarHBondContact O-N 3.14Å; L154-L156 VanDerWaalsContact O-N 3.1Å; L156-S158 PolarHBondContact O-N 3.2Å; L156-Y159 PolarHBondContact O-N 2.93Å; L156-Y159 VanDerWaalsContact O-N 3.13Å; L156-S160 PolarHBondContact O-N 2.91Å; L156-I163 HydrophobicContact CB-CD1 4.38Å; L156-I163 HydrophobicContact CD2-CD1 3.72Å; L156-I163 HydrophobicContact CG-CD1 3.75Å |
| 157 | I | 88.2 | Confident | 85.9 | Confident | 21 Ų | 21 | 58 Ų | 58 | 11% | 0.108 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -58.8 | -39.6 | 172 | -57.3 | 165.9 | 0 | 0 | 0 | 110.2 | Y114 L117 L154 K155 Y159 I163 R164 I167 | Y114-I157 HydrophobicContact CD1-CG2 4.45Å; Y114-I157 HydrophobicContact CE1-CG2 4.39Å; L117-I157 HydrophobicContact CD1-CD1 4.36Å; L154-I157 HydrophobicContact CB-CD1 4.11Å; L154-I157 HydrophobicContact CD2-CD1 3.87Å; L154-I157 WeakPolarHBondContact O-CB 3.06Å; L154-I157 WeakPolarHBondContact O-CD1 3.5Å; L154-I157 WeakPolarHBondContact O-CG1 3.1Å; L154-I157 PolarHBondContact O-N 3.49Å; K155-I157 PolarHBondContact O-N 2.95Å; I157-Y159 PolarHBondContact O-N 3.29Å; I157-I163 HydrophobicContact CB-CG2 4.29Å; I157-I163 HydrophobicContact CG1-CG2 3.75Å; I157-I163 HydrophobicContact CG2-CG2 4.45Å; I157-R164 HydrophobicContact CG2-CG 4.22Å; I157-R164 WeakPolarHBondContact O-CG 3.18Å; I157-R164 PolarHBondContact O-NE 3.11Å; I157-I167 HydrophobicContact CB-CD1 4.35Å; I157-I167 HydrophobicContact CD1-CD1 3.68Å; I157-I167 HydrophobicContact CG1-CD1 3.73Å; I157-I167 HydrophobicContact CG2-CD1 3.67Å |
| 158 | S | 84.1 | Confident | 86.3 | Confident | 11 Ų | 11 | 60 Ų | 60 | 8% | 0.077 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -69.9 | -15.7 | 179.5 | -66.2 | 0 | 0 | 0 | 0 | 113.8 | Y114 D118 K155 L156 R164 | Y114-S158 PolarHBondContact O-OG 3.32Å; D118-S158 WeakPolarHBondContact OD1-CB 3.42Å; D118-S158 PolarHBondContact OD1-OG 2.98Å; K155-S158 WeakPolarHBondContact O-CB 3.25Å; K155-S158 PolarHBondContact O-N 3.37Å; L156-S158 PolarHBondContact O-N 3.2Å; S158-R164 PolarHBondContact O-NH2 3.46Å |
| 159 | Y | 84.3 | Confident | 86.4 | Confident | 35 Ų | 35 | 58.8 Ų | 58.8 | 14% | 0.137 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -106.8 | -40.1 | 177.6 | -51.4 | -56.3 | 0 | 0 | 0 | 114.1 | M56 I57 V60 E97 K155 L156 I157 R161 | M56-Y159 HydrophobicContact CB-CE1 3.92Å; M56-Y159 HydrophobicContact CB-CE2 4.15Å; M56-Y159 WeakPolarHBondContact CE-OH 3.4Å; I57-Y159 HydrophobicContact CD1-CG 4.44Å; I57-Y159 HydrophobicContact CG1-CD2 3.72Å; I57-Y159 HydrophobicContact CG1-CG 3.8Å; V60-Y159 HydrophobicContact CG2-CE2 4.15Å; E97-Y159 WeakPolarHBondContact OE1-CE1 3.36Å; E97-Y159 PolarHBondContact OE1-OH 3.47Å; E97-Y159 PolarHBondContact OE2-OH 3.4Å; E97-Y159 VanDerWaalsContact OE2-OH 3.09Å; K155-Y159 HydrophobicContact CD-CE2 4.48Å; K155-Y159 WeakPolarHBondContact CE-OH 3.37Å; K155-Y159 HydrophobicContact CG-CE2 4Å; K155-Y159 WeakPolarHBondContact O-CD2 3.3Å; L156-Y159 PolarHBondContact O-N 2.93Å; L156-Y159 VanDerWaalsContact O-N 3.13Å; I157-Y159 PolarHBondContact O-N 3.29Å; Y159-R161 PolarHBondContact O-N 3.43Å |
| 160 | S | 86.5 | Confident | 86.7 | Confident | 39 Ų | 39 | 62.5 Ų | 62.5 | 27% | 0.273 | 34% | 0.337 | S | S | . | . | trans | -84.7 | 111.9 | -174 | -178.3 | 0 | 0 | 0 | 0 | 111.8 | L156 G162 I163 R164 | L156-S160 PolarHBondContact O-N 2.91Å; S160-G162 PolarHBondContact O-N 3.19Å; S160-G162 PolarHBondContact OG-N 3.35Å; S160-I163 PolarHBondContact O-N 2.66Å; S160-I163 PolarHBondContact OG-N 3.15Å; S160-R164 WeakPolarHBondContact O-CG 3.38Å; S160-R164 PolarHBondContact O-N 2.73Å; S160-R164 VanDerWaalsContact O-N 3.13Å | ||
| 161 | R | 85.7 | Confident | 86.8 | Confident | 212 Ų | 212 | 61.8 Ų | 61.8 | 80% | 0.8 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -57.8 | -36.7 | 171 | -173.4 | 178.7 | 179.7 | -172.9 | -0.3 | 111.5 | Y159 R164 T165 | Y159-R161 PolarHBondContact O-N 3.43Å; R161-R164 PolarHBondContact O-N 3.17Å; R161-T165 PolarHBondContact O-N 3.09Å; R161-T165 PolarHBondContact O-OG1 2.75Å; R161-T165 VanDerWaalsContact O-OG1 3.09Å |
| 162 | G | 87.6 | Confident | 86.6 | Confident | 42 Ų | 42 | 65.2 Ų | 65.2 | 43% | 0.433 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -61.3 | -48.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.4 | S160 R164 T165 L166 | S160-G162 PolarHBondContact O-N 3.19Å; S160-G162 PolarHBondContact OG-N 3.35Å; G162-R164 VanDerWaalsContact C-N 3.32Å; G162-R164 PolarHBondContact O-N 3.39Å; G162-T165 PolarHBondContact O-N 2.95Å; G162-L166 WeakPolarHBondContact O-CG 3Å; G162-L166 PolarHBondContact O-N 3.09Å |
| 163 | I | 88.4 | Confident | 86.5 | Confident | 49 Ų | 49 | 66.6 Ų | 66.6 | 25% | 0.251 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -63.4 | -39.4 | 177.9 | -61.6 | 175.2 | 0 | 0 | 0 | 110.9 | L156 I157 S160 L166 I167 | L156-I163 HydrophobicContact CB-CD1 4.38Å; L156-I163 HydrophobicContact CD2-CD1 3.72Å; L156-I163 HydrophobicContact CG-CD1 3.75Å; I157-I163 HydrophobicContact CB-CG2 4.29Å; I157-I163 HydrophobicContact CG1-CG2 3.75Å; I157-I163 HydrophobicContact CG2-CG2 4.45Å; S160-I163 PolarHBondContact O-N 2.66Å; S160-I163 PolarHBondContact OG-N 3.15Å; I163-L166 PolarHBondContact O-N 3.17Å; I163-I167 HydrophobicContact CG2-CD1 3.79Å; I163-I167 HydrophobicContact CG2-CG1 4.38Å; I163-I167 WeakPolarHBondContact O-CG1 3.43Å; I163-I167 PolarHBondContact O-N 2.63Å |
| 164 | R | 88.8 | Confident | 86.4 | Confident | 63 Ų | 63 | 66.6 Ų | 66.6 | 24% | 0.238 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -60.9 | -45.6 | 173.6 | -65.7 | 176.1 | 177.2 | -143.2 | 7.2 | 112.2 | Y114 I157 S158 S160 R161 G162 L166 I167 I168 | Y114-R164 HydrophobicContact CD1-CG 4.34Å; Y114-R164 VanDerWaalsContact CD2-NH1 3.28Å; Y114-R164 HydrophobicContact CE1-CB 4.41Å; Y114-R164 HydrophobicContact CE1-CG 3.79Å; I157-R164 HydrophobicContact CG2-CG 4.22Å; I157-R164 WeakPolarHBondContact O-CG 3.18Å; I157-R164 PolarHBondContact O-NE 3.11Å; S158-R164 PolarHBondContact O-NH2 3.46Å; S160-R164 WeakPolarHBondContact O-CG 3.38Å; S160-R164 PolarHBondContact O-N 2.73Å; S160-R164 VanDerWaalsContact O-N 3.13Å; R161-R164 PolarHBondContact O-N 3.17Å; G162-R164 VanDerWaalsContact C-N 3.32Å; G162-R164 PolarHBondContact O-N 3.39Å; R164-L166 VanDerWaalsContact C-N 3.33Å; R164-L166 PolarHBondContact O-N 3.5Å; R164-I167 PolarHBondContact O-N 3.46Å; R164-I168 WeakPolarHBondContact O-CB 3.45Å; R164-I168 WeakPolarHBondContact O-CD1 3.48Å; R164-I168 VanDerWaalsContact O-CG1 3.22Å; R164-I168 WeakPolarHBondContact O-CG1 3.22Å; R164-I168 PolarHBondContact O-N 3.25Å |
| 165 | T | 88.5 | Confident | 86.1 | Confident | 82 Ų | 82 | 72 Ų | 72 | 50% | 0.503 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -60 | -43.6 | 176.3 | -58.7 | 0 | 0 | 0 | 0 | 111.3 | R161 G162 I168 A169 | R161-T165 PolarHBondContact O-N 3.09Å; R161-T165 PolarHBondContact O-OG1 2.75Å; R161-T165 VanDerWaalsContact O-OG1 3.09Å; G162-T165 PolarHBondContact O-N 2.95Å; T165-I168 PolarHBondContact O-N 3.16Å; T165-A169 WeakPolarHBondContact O-CB 3.5Å; T165-A169 PolarHBondContact O-N 3.44Å |
| 166 | L | 89.1 | Confident | 85.6 | Confident | 120 Ų | 120 | 73.4 Ų | 73.4 | 63% | 0.628 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -62.1 | -45 | 176.6 | -69 | 170.7 | 0 | 0 | 0 | 112 | G162 I163 R164 I168 A169 V170 | G162-L166 WeakPolarHBondContact O-CG 3Å; G162-L166 PolarHBondContact O-N 3.09Å; I163-L166 PolarHBondContact O-N 3.17Å; R164-L166 VanDerWaalsContact C-N 3.33Å; R164-L166 PolarHBondContact O-N 3.5Å; L166-I168 PolarHBondContact O-N 3.47Å; L166-A169 PolarHBondContact O-N 2.91Å; L166-V170 WeakPolarHBondContact O-CG2 3.4Å; L166-V170 PolarHBondContact O-N 3.02Å |
| 167 | I | 88.8 | Confident | 85.5 | Confident | 79 Ų | 79 | 73.2 Ų | 73.2 | 41% | 0.405 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -65.8 | -37.6 | 177.7 | -70 | 170 | 0 | 0 | 0 | 111.6 | I157 I163 R164 G171 | I157-I167 HydrophobicContact CB-CD1 4.35Å; I157-I167 HydrophobicContact CD1-CD1 3.68Å; I157-I167 HydrophobicContact CG1-CD1 3.73Å; I157-I167 HydrophobicContact CG2-CD1 3.67Å; I163-I167 HydrophobicContact CG2-CD1 3.79Å; I163-I167 HydrophobicContact CG2-CG1 4.38Å; I163-I167 WeakPolarHBondContact O-CG1 3.43Å; I163-I167 PolarHBondContact O-N 2.63Å; R164-I167 PolarHBondContact O-N 3.46Å; I167-G171 PolarHBondContact O-N 2.94Å |
| 168 | I | 88.1 | Confident | 85.4 | Confident | 85 Ų | 85 | 74.4 Ų | 74.4 | 44% | 0.436 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.5 | -44.8 | 174.3 | -68.6 | 162.6 | 0 | 0 | 0 | 110.3 | R164 T165 L166 G171 Q172 | R164-I168 WeakPolarHBondContact O-CB 3.45Å; R164-I168 WeakPolarHBondContact O-CD1 3.48Å; R164-I168 VanDerWaalsContact O-CG1 3.22Å; R164-I168 WeakPolarHBondContact O-CG1 3.22Å; R164-I168 PolarHBondContact O-N 3.25Å; T165-I168 PolarHBondContact O-N 3.16Å; L166-I168 PolarHBondContact O-N 3.47Å; I168-G171 PolarHBondContact O-N 3.48Å; I168-Q172 WeakPolarHBondContact O-CG 3.44Å; I168-Q172 PolarHBondContact O-N 2.97Å |
| 169 | A | 85.1 | Confident | 85.4 | Confident | 44 Ų | 44 | 77.2 Ų | 77.2 | 36% | 0.364 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.5 | -44.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112 | T165 L166 G171 Q172 T173 | T165-A169 WeakPolarHBondContact O-CB 3.5Å; T165-A169 PolarHBondContact O-N 3.44Å; L166-A169 PolarHBondContact O-N 2.91Å; A169-G171 VanDerWaalsContact C-N 3.34Å; A169-G171 PolarHBondContact O-N 2.74Å; A169-Q172 WeakPolarHBondContact O-CB 3.41Å; A169-Q172 PolarHBondContact O-N 2.9Å; A169-T173 PolarHBondContact O-N 3.33Å |
| 170 | V | 87.1 | Confident | 85.5 | Confident | 90 Ų | 90 | 77.1 Ų | 77.1 | 55% | 0.545 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -62.2 | -42.5 | 172.5 | 172.4 | 0 | 0 | 0 | 0 | 110.8 | L166 Q172 T173 V174 | L166-V170 WeakPolarHBondContact O-CG2 3.4Å; L166-V170 PolarHBondContact O-N 3.02Å; V170-Q172 PolarHBondContact O-N 3.49Å; V170-T173 PolarHBondContact O-N 2.6Å; V170-T173 PolarHBondContact O-OG1 3.16Å; V170-V174 HydrophobicContact CG1-CG2 4.46Å; V170-V174 WeakPolarHBondContact O-CG2 3.48Å; V170-V174 PolarHBondContact O-N 2.67Å; V170-V174 VanDerWaalsContact O-N 3.08Å |
| 171 | G | 85.7 | Confident | 85.7 | Confident | 45 Ų | 45 | 79.6 Ų | 79.6 | 46% | 0.464 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -59.9 | -30 | 177 | 0 | 0 | 0 | 0 | 0 | 113.9 | I167 I168 A169 | I167-G171 PolarHBondContact O-N 2.94Å; I168-G171 PolarHBondContact O-N 3.48Å; A169-G171 VanDerWaalsContact C-N 3.34Å; A169-G171 PolarHBondContact O-N 2.74Å |
| 172 | Q | 80.9 | Confident | 85.9 | Confident | 144 Ų | 144 | 75.1 Ų | 75.1 | 67% | 0.673 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -69.7 | -31.4 | 173.7 | -71.6 | 171.4 | -40.9 | 0 | 0 | 112.6 | I168 A169 V170 | I168-Q172 WeakPolarHBondContact O-CG 3.44Å; I168-Q172 PolarHBondContact O-N 2.97Å; A169-Q172 WeakPolarHBondContact O-CB 3.41Å; A169-Q172 PolarHBondContact O-N 2.9Å; V170-Q172 PolarHBondContact O-N 3.49Å |
| 173 | T | 81.5 | Confident | 86.1 | Confident | 39 Ų | 39 | 77.5 Ų | 77.5 | 24% | 0.239 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -86.4 | -17.8 | 177.8 | 74.2 | 0 | 0 | 0 | 0 | 113.5 | A169 V170 Y175 T176 V177 H270 | A169-T173 PolarHBondContact O-N 3.33Å; V170-T173 PolarHBondContact O-N 2.6Å; V170-T173 PolarHBondContact O-OG1 3.16Å; T173-Y175 VanDerWaalsContact C-N 3.28Å; T173-Y175 PolarHBondContact O-N 3.36Å; T173-T176 PolarHBondContact O-N 3.32Å; T173-T176 PolarHBondContact O-OG1 3.47Å; T173-V177 WeakPolarHBondContact O-CG2 3.41Å; T173-V177 PolarHBondContact O-N 2.91Å; T173-V177 VanDerWaalsContact O-N 3.11Å; T173-H270 VanDerWaalsContact CG2-NE2 3.26Å; T173-H270 WeakPolarHBondContact CG2-NE2 3.34Å |
| 174 | V | 85.1 | Confident | 86.3 | Confident | 83 Ų | 83 | 76.2 Ų | 76.2 | 50% | 0.503 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -57.5 | -38.3 | 179.5 | 165.2 | 0 | 0 | 0 | 0 | 112.4 | V170 A178 | V170-V174 HydrophobicContact CG1-CG2 4.46Å; V170-V174 WeakPolarHBondContact O-CG2 3.48Å; V170-V174 PolarHBondContact O-N 2.67Å; V170-V174 VanDerWaalsContact O-N 3.08Å; V174-A178 WeakPolarHBondContact O-CB 3.36Å; V174-A178 PolarHBondContact O-N 3.01Å |
| 175 | Y | 80.4 | Confident | 86.6 | Confident | 186 Ų | 186 | 78.5 Ų | 78.5 | 73% | 0.729 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -66.8 | -42.3 | -177.8 | -177.4 | -97.9 | 0 | 0 | 0 | 113 | T173 S179 | T173-Y175 VanDerWaalsContact C-N 3.28Å; T173-Y175 PolarHBondContact O-N 3.36Å; Y175-S179 PolarHBondContact O-OG 2.83Å |
| 176 | T | 76.1 | Confident | 86.9 | Confident | 32 Ų | 32 | 78.8 Ų | 78.8 | 20% | 0.196 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -69.2 | -42.6 | 179 | 56.1 | 0 | 0 | 0 | 0 | 110.9 | T173 M269 | T173-T176 PolarHBondContact O-N 3.32Å; T173-T176 PolarHBondContact O-OG1 3.47Å; T176-M269 HydrophobicContact CG2-CE 4.02Å; T176-M269 HydrophobicContact CG2-SD 3.58Å; T176-M269 VanDerWaalsContact CG2-SD 3.58Å |
| 177 | V | 85 | Confident | 87.3 | Confident | 37 Ų | 37 | 74.1 Ų | 74.1 | 22% | 0.224 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -66.8 | -41 | 176.3 | 174 | 0 | 0 | 0 | 0 | 112.2 | T173 S179 V180 L181 M262 V266 | T173-V177 WeakPolarHBondContact O-CG2 3.41Å; T173-V177 PolarHBondContact O-N 2.91Å; T173-V177 VanDerWaalsContact O-N 3.11Å; V177-S179 VanDerWaalsContact C-N 3.27Å; V177-S179 PolarHBondContact O-N 3.08Å; V177-V180 PolarHBondContact O-N 3.23Å; V177-V180 VanDerWaalsContact O-N 3.1Å; V177-L181 HydrophobicContact CG1-CD1 3.7Å; V177-L181 HydrophobicContact CG1-CG 3.88Å; V177-L181 PolarHBondContact O-N 3.26Å; V177-M262 HydrophobicContact CG1-SD 4.05Å; V177-V266 HydrophobicContact CG2-CG2 3.98Å |
| 178 | A | 87.4 | Confident | 87.6 | Confident | 45 Ų | 45 | 71.3 Ų | 71.3 | 37% | 0.372 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -59.3 | -35.7 | -177 | 0 | 0 | 0 | 0 | 0 | 113.1 | V174 V180 L181 L182 | V174-A178 WeakPolarHBondContact O-CB 3.36Å; V174-A178 PolarHBondContact O-N 3.01Å; A178-V180 VanDerWaalsContact C-N 3.3Å; A178-V180 PolarHBondContact O-N 3.5Å; A178-L181 PolarHBondContact O-N 3.21Å; A178-L182 WeakPolarHBondContact O-CB 3.08Å; A178-L182 PolarHBondContact O-N 3.03Å |
| 179 | S | 83.4 | Confident | 88.1 | Confident | 70 Ų | 70 | 72.8 Ų | 72.8 | 49% | 0.49 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -62.5 | -37.9 | 178.2 | -59.7 | 0 | 0 | 0 | 0 | 112 | Y175 V177 L183 | Y175-S179 PolarHBondContact O-OG 2.83Å; V177-S179 VanDerWaalsContact C-N 3.27Å; V177-S179 PolarHBondContact O-N 3.08Å; S179-L183 PolarHBondContact O-N 3Å |
| 180 | V | 86.9 | Confident | 88.6 | Confident | 34 Ų | 34 | 75 Ų | 75 | 21% | 0.206 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -84.1 | -33.9 | 179.2 | -165.4 | 0 | 0 | 0 | 0 | 111.9 | V177 A178 L182 L183 L184 I258 M262 | V177-V180 PolarHBondContact O-N 3.23Å; V177-V180 VanDerWaalsContact O-N 3.1Å; A178-V180 VanDerWaalsContact C-N 3.3Å; A178-V180 PolarHBondContact O-N 3.5Å; V180-L182 VanDerWaalsContact C-N 3.25Å; V180-L182 PolarHBondContact O-N 3.44Å; V180-L183 WeakPolarHBondContact O-CB 3.37Å; V180-L183 PolarHBondContact O-N 3.42Å; V180-L184 PolarHBondContact O-N 3.25Å; V180-I258 HydrophobicContact CG1-CG2 3.71Å; V180-M262 HydrophobicContact CB-CB 4.07Å; V180-M262 HydrophobicContact CB-CG 3.84Å; V180-M262 HydrophobicContact CB-SD 4.46Å; V180-M262 HydrophobicContact CG1-CB 3.65Å; V180-M262 HydrophobicContact CG1-CG 3.99Å; V180-M262 HydrophobicContact CG2-CB 4.36Å; V180-M262 HydrophobicContact CG2-CG 4.12Å |
| 181 | L | 89.6 | Confident | 89.1 | Confident | 90 Ų | 90 | 71.7 Ų | 71.7 | 47% | 0.471 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -61.7 | -33.9 | 170.1 | -70.5 | -179.7 | 0 | 0 | 0 | 112.1 | V177 A178 L184 F185 | V177-L181 HydrophobicContact CG1-CD1 3.7Å; V177-L181 HydrophobicContact CG1-CG 3.88Å; V177-L181 PolarHBondContact O-N 3.26Å; A178-L181 PolarHBondContact O-N 3.21Å; L181-L184 PolarHBondContact O-N 3.47Å; L181-F185 VanDerWaalsContact O-CB 3.31Å; L181-F185 WeakPolarHBondContact O-CB 3.26Å; L181-F185 PolarHBondContact O-N 2.93Å |
| 182 | L | 91.4 | Very high | 89.6 | Confident | 119 Ų | 119 | 69.6 Ų | 69.6 | 62% | 0.623 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -66.8 | -40.1 | 173.6 | -173.5 | 152.3 | 0 | 0 | 0 | 111.6 | A178 V180 F185 L186 | A178-L182 WeakPolarHBondContact O-CB 3.08Å; A178-L182 PolarHBondContact O-N 3.03Å; V180-L182 VanDerWaalsContact C-N 3.25Å; V180-L182 PolarHBondContact O-N 3.44Å; L182-F185 PolarHBondContact O-N 2.82Å; L182-L186 WeakPolarHBondContact O-CB 3.36Å; L182-L186 PolarHBondContact O-N 3.26Å |
| 183 | L | 91.1 | Very high | 90.3 | Very high | 91 Ų | 91 | 66.1 Ų | 66.1 | 48% | 0.476 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -63.1 | -44 | 172.9 | -179.4 | 65.3 | 0 | 0 | 0 | 111.7 | S179 V180 L186 L187 I258 | S179-L183 PolarHBondContact O-N 3Å; V180-L183 WeakPolarHBondContact O-CB 3.37Å; V180-L183 PolarHBondContact O-N 3.42Å; L183-L186 PolarHBondContact O-N 2.94Å; L183-L187 PolarHBondContact O-N 3.39Å; L183-I258 HydrophobicContact CD2-CD1 4.43Å; L183-I258 HydrophobicContact CD2-CG1 4.38Å; L183-I258 HydrophobicContact CD2-CG2 4.42Å; L183-I258 HydrophobicContact CG-CD1 4.24Å |
| 184 | L | 93.3 | Very high | 90.9 | Very high | 23 Ų | 23 | 67.9 Ų | 67.9 | 12% | 0.12 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -63.3 | -40.3 | 174.8 | -177.5 | 62.7 | 0 | 0 | 0 | 111.7 | V180 L181 L187 M188 A255 I258 | V180-L184 PolarHBondContact O-N 3.25Å; L181-L184 PolarHBondContact O-N 3.47Å; L184-L187 PolarHBondContact O-N 2.99Å; L184-M188 HydrophobicContact CG-CE 4.34Å; L184-M188 WeakPolarHBondContact O-CG 3.43Å; L184-M188 PolarHBondContact O-N 3.3Å; L184-A255 HydrophobicContact CD1-CB 4.11Å; L184-I258 HydrophobicContact CB-CG2 4.16Å |
| 185 | F | 94.6 | Very high | 91.3 | Very high | 110 Ų | 110 | 64 Ų | 64 | 48% | 0.482 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63.3 | -39.6 | 175.4 | -179.1 | -96.9 | 0 | 0 | 0 | 112.2 | L181 L182 M188 Y189 F217 | L181-F185 VanDerWaalsContact O-CB 3.31Å; L181-F185 WeakPolarHBondContact O-CB 3.26Å; L181-F185 PolarHBondContact O-N 2.93Å; L182-F185 PolarHBondContact O-N 2.82Å; F185-M188 HydrophobicContact CB-CE 4.44Å; F185-M188 HydrophobicContact CD2-CE 4.33Å; F185-M188 PolarHBondContact O-N 3.11Å; F185-Y189 WeakPolarHBondContact O-CB 3.49Å; F185-Y189 PolarHBondContact O-N 3.35Å; F185-F217 AromaticContact CD2-CE1 3.89Å; F185-F217 HydrophobicContact CD2-CE1 3.89Å; F185-F217 HydrophobicContact CD2-CZ 4.34Å; F185-F217 HydrophobicContact CE1-CZ 4.46Å; F185-F217 HydrophobicContact CE2-CD1 4.3Å; F185-F217 AromaticContact CE2-CE1 3.54Å; F185-F217 HydrophobicContact CE2-CE1 3.54Å; F185-F217 HydrophobicContact CE2-CE2 4.44Å; F185-F217 AromaticContact CE2-CZ 3.62Å; F185-F217 HydrophobicContact CE2-CZ 3.62Å; F185-F217 HydrophobicContact CZ-CE1 4.07Å; F185-F217 HydrophobicContact CZ-CE2 4.44Å; F185-F217 AromaticContact CZ-CZ 3.68Å; F185-F217 HydrophobicContact CZ-CZ 3.68Å |
| 186 | L | 95.4 | Very high | 91.8 | Very high | 89 Ų | 89 | 59.3 Ų | 59.3 | 47% | 0.466 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -65.7 | -41.6 | 174.4 | -174.4 | 150.3 | 0 | 0 | 0 | 111.6 | L182 L183 Y189 I190 | L182-L186 WeakPolarHBondContact O-CB 3.36Å; L182-L186 PolarHBondContact O-N 3.26Å; L183-L186 PolarHBondContact O-N 2.94Å; L186-Y189 PolarHBondContact O-N 3.34Å; L186-I190 HydrophobicContact CD2-CD1 3.68Å; L186-I190 WeakPolarHBondContact O-CG1 3.48Å; L186-I190 PolarHBondContact O-N 3.49Å; L186-I190 VanDerWaalsContact O-N 3.12Å |
| 187 | L | 95.6 | Very high | 92.5 | Very high | 22 Ų | 22 | 62 Ų | 62 | 12% | 0.115 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -59.8 | -49.2 | 172.1 | -179.4 | 70.4 | 0 | 0 | 0 | 111 | L183 L184 Y189 I190 F191 F251 L254 I258 | L183-L187 PolarHBondContact O-N 3.39Å; L184-L187 PolarHBondContact O-N 2.99Å; L187-Y189 VanDerWaalsContact C-N 3.3Å; L187-Y189 PolarHBondContact O-N 2.92Å; L187-I190 PolarHBondContact O-N 2.66Å; L187-F191 HydrophobicContact CD1-CD2 3.7Å; L187-F191 HydrophobicContact CD1-CE2 3.54Å; L187-F191 HydrophobicContact CG-CD2 4.15Å; L187-F191 HydrophobicContact CG-CE2 4.38Å; L187-F191 WeakPolarHBondContact O-CD2 3.25Å; L187-F191 PolarHBondContact O-N 3.07Å; L187-F251 HydrophobicContact CD2-CD2 4.41Å; L187-F251 HydrophobicContact CD2-CE2 4.14Å; L187-F251 HydrophobicContact CG-CD2 4.5Å; L187-F251 HydrophobicContact CG-CE2 4.19Å; L187-L254 HydrophobicContact CD1-CB 4.47Å; L187-L254 HydrophobicContact CD1-CD1 4.18Å; L187-L254 HydrophobicContact CD2-CB 3.79Å; L187-I258 HydrophobicContact CB-CD1 4.23Å; L187-I258 HydrophobicContact CD2-CD1 3.65Å; L187-I258 HydrophobicContact CG-CD1 4.48Å |
| 188 | M | 96.6 | Very high | 92.7 | Very high | 20 Ų | 20 | 62.9 Ų | 62.9 | 10% | 0.099 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -59.1 | -39.6 | 176.6 | -73.2 | -170.5 | -61.9 | 0 | 0 | 111.8 | L184 F185 F191 A192 F217 L220 F221 F251 | L184-M188 HydrophobicContact CG-CE 4.34Å; L184-M188 WeakPolarHBondContact O-CG 3.43Å; L184-M188 PolarHBondContact O-N 3.3Å; F185-M188 HydrophobicContact CB-CE 4.44Å; F185-M188 HydrophobicContact CD2-CE 4.33Å; F185-M188 PolarHBondContact O-N 3.11Å; M188-F191 PolarHBondContact O-N 3.22Å; M188-A192 WeakPolarHBondContact O-CA 3.29Å; M188-A192 WeakPolarHBondContact O-CB 3.49Å; M188-A192 PolarHBondContact O-N 3.38Å; M188-F217 HydrophobicContact CB-CD1 3.94Å; M188-F217 HydrophobicContact CB-CE1 3.75Å; M188-L220 HydrophobicContact CG-CB 4.25Å; M188-L220 WeakPolarHBondContact O-CD1 3.47Å; M188-L220 HydrophobicContact SD-CB 4.5Å; M188-F221 HydrophobicContact SD-CB 4.49Å; M188-F251 HydrophobicContact CG-CE2 4.23Å; M188-F251 HydrophobicContact CG-CZ 3.97Å |
| 189 | Y | 97.1 | Very high | 92.8 | Very high | 115 Ų | 115 | 60.9 Ų | 60.9 | 45% | 0.451 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62.1 | -45.1 | 177.1 | 178.8 | -104.3 | 0 | 0 | 0 | 112.5 | F185 L186 L187 A192 I193 L213 F217 | F185-Y189 WeakPolarHBondContact O-CB 3.49Å; F185-Y189 PolarHBondContact O-N 3.35Å; L186-Y189 PolarHBondContact O-N 3.34Å; L187-Y189 VanDerWaalsContact C-N 3.3Å; L187-Y189 PolarHBondContact O-N 2.92Å; Y189-A192 PolarHBondContact O-N 2.96Å; Y189-I193 HydrophobicContact CD1-CD1 4.28Å; Y189-I193 HydrophobicContact CE1-CD1 3.68Å; Y189-I193 HydrophobicContact CE2-CD1 4Å; Y189-I193 PolarHBondContact O-N 2.87Å; Y189-L213 HydrophobicContact CE2-CD2 4.37Å; Y189-F217 HydrophobicContact CD2-CE2 4.25Å; Y189-F217 AromaticContact CD2-CZ 3.93Å; Y189-F217 HydrophobicContact CD2-CZ 3.93Å; Y189-F217 HydrophobicContact CG-CZ 4.43Å |
| 190 | I | 96.9 | Very high | 92.8 | Very high | 91 Ų | 91 | 58.2 Ų | 58.2 | 47% | 0.467 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.8 | -47.9 | 176.3 | -65.6 | 168.5 | 0 | 0 | 0 | 110.3 | L186 L187 A192 I193 L194 | L186-I190 HydrophobicContact CD2-CD1 3.68Å; L186-I190 WeakPolarHBondContact O-CG1 3.48Å; L186-I190 PolarHBondContact O-N 3.49Å; L186-I190 VanDerWaalsContact O-N 3.12Å; L187-I190 PolarHBondContact O-N 2.66Å; I190-A192 VanDerWaalsContact C-N 3.32Å; I190-A192 PolarHBondContact O-N 3.07Å; I190-I193 PolarHBondContact O-N 3.37Å; I190-L194 WeakPolarHBondContact O-CB 3.31Å; I190-L194 PolarHBondContact O-N 3.48Å |
| 191 | F | 96.7 | Very high | 92.6 | Very high | 21 Ų | 21 | 59.5 Ų | 59.5 | 9% | 0.092 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -70.1 | -26.4 | 179.3 | -85.6 | -104.6 | 0 | 0 | 0 | 113 | L187 M188 L194 G195 L220 F247 I250 F251 L254 | L187-F191 HydrophobicContact CD1-CD2 3.7Å; L187-F191 HydrophobicContact CD1-CE2 3.54Å; L187-F191 HydrophobicContact CG-CD2 4.15Å; L187-F191 HydrophobicContact CG-CE2 4.38Å; L187-F191 WeakPolarHBondContact O-CD2 3.25Å; L187-F191 PolarHBondContact O-N 3.07Å; M188-F191 PolarHBondContact O-N 3.22Å; F191-L194 PolarHBondContact O-N 3.46Å; F191-G195 PolarHBondContact O-N 2.99Å; F191-L220 VanDerWaalsContact C-CD1 3.49Å; F191-L220 HydrophobicContact CB-CD1 3.86Å; F191-L220 HydrophobicContact CB-CD2 3.89Å; F191-F247 HydrophobicContact CB-CE2 4.44Å; F191-F247 HydrophobicContact CB-CZ 4.3Å; F191-F247 HydrophobicContact CD1-CD2 4.01Å; F191-F247 HydrophobicContact CD1-CE1 4.44Å; F191-F247 AromaticContact CD1-CE2 3.53Å; F191-F247 HydrophobicContact CD1-CE2 3.53Å; F191-F247 AromaticContact CD1-CZ 3.78Å; F191-F247 HydrophobicContact CD1-CZ 3.78Å; F191-F247 HydrophobicContact CE1-CD2 4.24Å; F191-F247 HydrophobicContact CE1-CE2 4.22Å; F191-F247 HydrophobicContact CG-CE2 4.37Å; F191-F247 WeakPolarHBondContact O-CZ 3.28Å; F191-I250 HydrophobicContact CZ-CG2 4.18Å; F191-F251 HydrophobicContact CB-CD2 3.86Å; F191-F251 HydrophobicContact CB-CE2 4.15Å; F191-F251 HydrophobicContact CD1-CB 3.7Å; F191-F251 AromaticContact CD1-CD2 3.57Å; F191-F251 HydrophobicContact CD1-CD2 3.57Å; F191-F251 AromaticContact CD1-CG 3.98Å; F191-F251 HydrophobicContact CD1-CG 3.98Å; F191-F251 AromaticContact CD2-CD2 4Å; F191-F251 HydrophobicContact CD2-CD2 4Å; F191-F251 HydrophobicContact CE1-CB 3.65Å; F191-F251 HydrophobicContact CE1-CD2 4.09Å; F191-F251 HydrophobicContact CE1-CG 4.34Å; F191-F251 HydrophobicContact CE2-CD2 4.47Å; F191-F251 AromaticContact CG-CD2 3.52Å; F191-F251 HydrophobicContact CG-CD2 3.52Å; F191-F251 HydrophobicContact CG-CE2 4.22Å; F191-F251 HydrophobicContact CG-CG 4.37Å; F191-F251 HydrophobicContact CZ-CB 4.44Å; F191-L254 HydrophobicContact CE2-CD1 4.15Å; F191-L254 HydrophobicContact CZ-CD1 4.02Å |
| 192 | A | 96.9 | Very high | 91.6 | Very high | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -69.7 | -43.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | M188 Y189 I190 F196 L213 A216 L220 | M188-A192 WeakPolarHBondContact O-CA 3.29Å; M188-A192 WeakPolarHBondContact O-CB 3.49Å; M188-A192 PolarHBondContact O-N 3.38Å; Y189-A192 PolarHBondContact O-N 2.96Å; I190-A192 VanDerWaalsContact C-N 3.32Å; I190-A192 PolarHBondContact O-N 3.07Å; A192-F196 VanDerWaalsContact O-CB 3.22Å; A192-F196 WeakPolarHBondContact O-CB 3.47Å; A192-F196 PolarHBondContact O-N 2.79Å; A192-L213 HydrophobicContact CB-CD1 3.74Å; A192-A216 HydrophobicContact CB-CB 3.91Å; A192-L220 VanDerWaalsContact CA-CD1 3.43Å; A192-L220 HydrophobicContact CB-CD1 3.71Å |
| 193 | I | 95.5 | Very high | 90.6 | Very high | 72 Ų | 72 | 61.1 Ų | 61.1 | 37% | 0.369 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -65.2 | -44.8 | 172.8 | -65.3 | 172.6 | 0 | 0 | 0 | 110.2 | Y189 I190 F196 C197 L213 | Y189-I193 HydrophobicContact CD1-CD1 4.28Å; Y189-I193 HydrophobicContact CE1-CD1 3.68Å; Y189-I193 HydrophobicContact CE2-CD1 4Å; Y189-I193 PolarHBondContact O-N 2.87Å; I190-I193 PolarHBondContact O-N 3.37Å; I193-F196 PolarHBondContact O-N 3.16Å; I193-C197 WeakPolarHBondContact O-CB 3.27Å; I193-C197 PolarHBondContact O-N 2.95Å; I193-C197 PolarHBondContact O-SG 2.97Å; I193-L213 HydrophobicContact CG1-CD1 4.26Å |
| 194 | L | 93.9 | Very high | 89.8 | Confident | 76 Ų | 76 | 64.9 Ų | 64.9 | 40% | 0.398 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -62.3 | -45.8 | 179.8 | -177 | 62.2 | 0 | 0 | 0 | 111.9 | I190 F191 C197 L198 F247 | I190-L194 WeakPolarHBondContact O-CB 3.31Å; I190-L194 PolarHBondContact O-N 3.48Å; F191-L194 PolarHBondContact O-N 3.46Å; L194-C197 PolarHBondContact O-N 3.35Å; L194-L198 HydrophobicContact CD1-CD1 3.95Å; L194-L198 HydrophobicContact CD1-CG 4.23Å; L194-L198 HydrophobicContact CG-CD1 3.89Å; L194-L198 HydrophobicContact CG-CG 4.49Å; L194-L198 WeakPolarHBondContact O-CB 3.45Å; L194-L198 VanDerWaalsContact O-CG 3.27Å; L194-L198 WeakPolarHBondContact O-CG 3.4Å; L194-L198 PolarHBondContact O-N 2.91Å; L194-F247 HydrophobicContact CB-CE2 4.17Å; L194-F247 HydrophobicContact CD2-CD2 3.98Å; L194-F247 HydrophobicContact CD2-CE2 3.98Å; L194-F247 HydrophobicContact CG-CD2 4.21Å; L194-F247 HydrophobicContact CG-CE2 3.98Å |
| 195 | G | 92.7 | Very high | 89.1 | Confident | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -68.9 | -36.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | F191 L198 F199 W210 | F191-G195 PolarHBondContact O-N 2.99Å; G195-L198 PolarHBondContact O-N 3.46Å; G195-F199 WeakPolarHBondContact O-CA 3.47Å; G195-F199 WeakPolarHBondContact O-CB 3.28Å; G195-F199 WeakPolarHBondContact O-CD2 3.21Å; G195-F199 PolarHBondContact O-N 3.12Å; G195-W210 VanDerWaalsContact C-CE3 3.4Å |
| 196 | F | 92.3 | Very high | 88.7 | Confident | 89 Ų | 89 | 58.8 Ų | 58.8 | 39% | 0.39 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -58.2 | -48.3 | 168.9 | 178 | -87.5 | 0 | 0 | 0 | 111.1 | A192 I193 L198 G200 W210 | A192-F196 VanDerWaalsContact O-CB 3.22Å; A192-F196 WeakPolarHBondContact O-CB 3.47Å; A192-F196 PolarHBondContact O-N 2.79Å; I193-F196 PolarHBondContact O-N 3.16Å; F196-L198 PolarHBondContact O-N 2.93Å; F196-G200 VanDerWaalsContact O-CA 3.22Å; F196-G200 WeakPolarHBondContact O-CA 3.49Å; F196-G200 PolarHBondContact O-N 3.05Å; F196-W210 WeakPolarHBondContact CD2-O 3.35Å |
| 197 | C | 89.8 | Confident | 88.3 | Confident | 88 Ų | 88 | 58.7 Ų | 58.7 | 60% | 0.595 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -67.1 | -33.6 | 178.8 | -70.2 | 0 | 0 | 0 | 0 | 113.8 | I193 L194 | I193-C197 WeakPolarHBondContact O-CB 3.27Å; I193-C197 PolarHBondContact O-N 2.95Å; I193-C197 PolarHBondContact O-SG 2.97Å; L194-C197 PolarHBondContact O-N 3.35Å |
| 198 | L | 89.1 | Confident | 88 | Confident | 56 Ų | 56 | 64.4 Ų | 64.4 | 29% | 0.293 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -85.2 | -40 | -178.5 | -70.8 | 175.5 | 0 | 0 | 0 | 113.5 | L194 G195 F196 L243 F247 | L194-L198 HydrophobicContact CD1-CD1 3.95Å; L194-L198 HydrophobicContact CD1-CG 4.23Å; L194-L198 HydrophobicContact CG-CD1 3.89Å; L194-L198 HydrophobicContact CG-CG 4.49Å; L194-L198 WeakPolarHBondContact O-CB 3.45Å; L194-L198 VanDerWaalsContact O-CG 3.27Å; L194-L198 WeakPolarHBondContact O-CG 3.4Å; L194-L198 PolarHBondContact O-N 2.91Å; G195-L198 PolarHBondContact O-N 3.46Å; F196-L198 PolarHBondContact O-N 2.93Å; L198-L243 HydrophobicContact CD2-CD1 4.17Å; L198-F247 HydrophobicContact CD1-CD2 4.15Å |
| 199 | F | 89.3 | Confident | 87.7 | Confident | 2 Ų | 2 | 65 Ų | 65 | 1% | 0.009 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -119.2 | -12.8 | -168 | -45.8 | -54.4 | 0 | 0 | 0 | 113.7 | G195 S201 G205 D206 W210 L236 F241 F247 | G195-F199 WeakPolarHBondContact O-CA 3.47Å; G195-F199 WeakPolarHBondContact O-CB 3.28Å; G195-F199 WeakPolarHBondContact O-CD2 3.21Å; G195-F199 PolarHBondContact O-N 3.12Å; F199-S201 VanDerWaalsContact C-N 3.28Å; F199-S201 PolarHBondContact O-N 3.15Å; F199-G205 CarbonylContact O-C 3.53Å; F199-G205 WeakPolarHBondContact O-CA 3.19Å; F199-D206 PolarHBondContact O-N 3.3Å; F199-W210 HydrophobicContact CB-CB 4.13Å; F199-W210 HydrophobicContact CB-CD2 4.41Å; F199-W210 HydrophobicContact CB-CG 3.77Å; F199-W210 HydrophobicContact CD2-CD2 4.09Å; F199-W210 AromaticContact CD2-CE2 3.83Å; F199-W210 HydrophobicContact CD2-CG 4.33Å; F199-W210 HydrophobicContact CD2-CZ2 4.24Å; F199-W210 AromaticContact CD2-NE1 3.91Å; F199-L236 HydrophobicContact CB-CD2 4.24Å; F199-L236 HydrophobicContact CD1-CD2 3.84Å; F199-L236 HydrophobicContact CD2-CD2 4.28Å; F199-L236 HydrophobicContact CE1-CD2 4.3Å; F199-L236 HydrophobicContact CG-CD2 3.84Å; F199-F241 HydrophobicContact CD1-CB 4.18Å; F199-F241 HydrophobicContact CD1-CD1 4.06Å; F199-F241 AromaticContact CD1-CD2 3.93Å; F199-F241 HydrophobicContact CD1-CD2 3.93Å; F199-F241 HydrophobicContact CD1-CE1 4.42Å; F199-F241 HydrophobicContact CD1-CE2 4.28Å; F199-F241 AromaticContact CD1-CG 3.82Å; F199-F241 HydrophobicContact CD1-CG 3.82Å; F199-F241 HydrophobicContact CE1-CB 4Å; F199-F241 HydrophobicContact CE1-CD1 4.49Å; F199-F241 HydrophobicContact CE1-CG 4.15Å; F199-F247 HydrophobicContact CE2-CB 4.34Å; F199-F247 AromaticContact CE2-CD1 3.66Å; F199-F247 HydrophobicContact CE2-CD1 3.66Å; F199-F247 HydrophobicContact CE2-CD2 4.11Å; F199-F247 AromaticContact CE2-CE1 3.9Å; F199-F247 HydrophobicContact CE2-CE1 3.9Å; F199-F247 HydrophobicContact CE2-CE2 4.3Å; F199-F247 AromaticContact CE2-CG 3.78Å; F199-F247 HydrophobicContact CE2-CG 3.78Å; F199-F247 HydrophobicContact CE2-CZ 4.21Å; F199-F247 HydrophobicContact CZ-CB 4.08Å; F199-F247 HydrophobicContact CZ-CD1 4.21Å; F199-F247 HydrophobicContact CZ-CD2 4.49Å; F199-F247 HydrophobicContact CZ-CG 4.02Å |
| 200 | G | 85.1 | Confident | 87.5 | Confident | 14 Ų | 14 | 59.5 Ų | 59.5 | 14% | 0.144 | 33% | 0.326 | C | S | . | . | trans | -84.5 | 19.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | F196 | F196-G200 VanDerWaalsContact O-CA 3.22Å; F196-G200 WeakPolarHBondContact O-CA 3.49Å; F196-G200 PolarHBondContact O-N 3.05Å | ||
| 201 | S | 81.2 | Confident | 87.2 | Confident | 62 Ų | 62 | 56.5 Ų | 56.5 | 43% | 0.434 | 32% | 0.317 | S | S | . | . | trans | -59.6 | 135.9 | -178.4 | -72.8 | 0 | 0 | 0 | 0 | 113 | F199 D203 G205 H207 | F199-S201 VanDerWaalsContact C-N 3.28Å; F199-S201 PolarHBondContact O-N 3.15Å; S201-D203 PolarHBondContact O-N 3.07Å; S201-G205 WeakPolarHBondContact O-CA 3.3Å; S201-G205 PolarHBondContact O-N 3.32Å; S201-H207 PolarHBondContact O-CE1 3.09Å; S201-H207 PolarHBondContact O-NE2 3.4Å | ||
| 202 | A | 68.3 | Low | 87 | Confident | 80 Ų | 80 | 59.5 Ų | 59.5 | 66% | 0.661 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51 | -49.1 | -172 | 0 | 0 | 0 | 0 | 0 | 115 | H207 | A202-H207 PolarHBondContact O-NE2 3.46Š|
| 203 | D | 71.9 | Confident | 86.9 | Confident | 162 Ų | 162 | 63 Ų | 63 | 87% | 0.866 | 35% | 0.353 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.9 | -19.5 | -167.4 | -59.2 | -42.6 | 0 | 0 | 0 | 115.6 | S201 | S201-D203 PolarHBondContact O-N 3.07Š|
| 204 | K | 73.7 | Confident | 86.8 | Confident | 170 Ų | 170 | 63 Ų | 63 | 74% | 0.739 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -139.9 | -2.1 | -176.4 | -68.6 | -170.4 | 178 | -175.9 | 0 | 114.7 | R239 | K204-R239 PolarHBondContact O-NH1 3.06Š|
| 205 | G | 79.3 | Confident | 86.8 | Confident | 5 Ų | 5 | 60.2 Ų | 60.2 | 5% | 0.052 | 35% | 0.351 | C | S | . | . | S | Bend | trans | -65.7 | 164.8 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | F199 S201 H207 R239 | F199-G205 CarbonylContact O-C 3.53Å; F199-G205 WeakPolarHBondContact O-CA 3.19Å; S201-G205 WeakPolarHBondContact O-CA 3.3Å; S201-G205 PolarHBondContact O-N 3.32Å; G205-H207 PolarHBondContact O-N 3.44Å; G205-R239 PolarHBondContact O-NH1 2.98Å |
| 206 | D | 86.2 | Confident | 87 | Confident | 0 Ų | 0 | 60.2 Ų | 60.2 | 0% | 0 | 35% | 0.351 | C | S | . | . | trans | -92.3 | 87.8 | 171.2 | 175.3 | 3.8 | 0 | 0 | 0 | 108.2 | F199 D208 N209 W210 | F199-D206 PolarHBondContact O-N 3.3Å; D206-D208 VanDerWaalsContact C-N 3.29Å; D206-D208 PolarHBondContact O-N 3Å; D206-D208 PolarHBondContact OD1-N 3.36Å; D206-N209 PolarHBondContact OD1-N 2.92Å; D206-N209 PolarHBondContact OD1-ND2 3.43Å; D206-N209 WeakPolarHBondContact OD2-CB 3.34Å; D206-N209 PolarHBondContact OD2-ND2 3.06Å; D206-W210 WeakPolarHBondContact O-CA 3.22Å; D206-W210 WeakPolarHBondContact O-CB 3.49Å; D206-W210 PolarHBondContact O-N 2.79Å | ||
| 207 | H | 85.6 | Confident | 87.2 | Confident | 87 Ų | 87 | 57.9 Ų | 57.9 | 40% | 0.403 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -70.6 | -23.8 | -176.7 | -68.1 | -57.7 | 0 | 0 | 0 | 113.5 | S201 A202 G205 G211 | S201-H207 PolarHBondContact O-CE1 3.09Å; S201-H207 PolarHBondContact O-NE2 3.4Å; A202-H207 PolarHBondContact O-NE2 3.46Å; G205-H207 PolarHBondContact O-N 3.44Å; H207-G211 VanDerWaalsContact O-CA 3.26Å; H207-G211 WeakPolarHBondContact O-CA 3.28Å; H207-G211 PolarHBondContact O-N 3.11Å |
| 208 | D | 89.4 | Confident | 87.4 | Confident | 142 Ų | 142 | 61.2 Ų | 61.2 | 76% | 0.759 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -71.4 | -38.7 | -179.6 | -63.5 | -38.9 | 0 | 0 | 0 | 111.1 | D206 A215 | D206-D208 VanDerWaalsContact C-N 3.29Å; D206-D208 PolarHBondContact O-N 3Å; D206-D208 PolarHBondContact OD1-N 3.36Å; D208-A215 WeakPolarHBondContact O-CB 3.24Å |
| 209 | N | 91.1 | Very high | 87.7 | Confident | 33 Ų | 33 | 58.9 Ų | 58.9 | 18% | 0.176 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -95.6 | -35.9 | 177 | -68 | -70.8 | 0 | 0 | 0 | 113.7 | D206 A215 A216 T219 L232 | D206-N209 PolarHBondContact OD1-N 2.92Å; D206-N209 PolarHBondContact OD1-ND2 3.43Å; D206-N209 WeakPolarHBondContact OD2-CB 3.34Å; D206-N209 PolarHBondContact OD2-ND2 3.06Å; N209-A215 CarbonylContact O-C 3.43Å; N209-A215 WeakPolarHBondContact O-CB 3.21Å; N209-A216 WeakPolarHBondContact O-CA 3.2Å; N209-A216 PolarHBondContact O-N 3.01Å; N209-T219 WeakPolarHBondContact CA-OG1 3.49Å; N209-T219 HydrophobicContact CB-CG2 4.02Å; N209-T219 VanDerWaalsContact CB-OG1 3.31Å; N209-T219 WeakPolarHBondContact CB-OG1 3.4Å; N209-T219 PolarHBondContact O-OG1 3.18Å; N209-T219 PolarHBondContact OD1-OG1 3.43Å; N209-L232 HydrophobicContact CB-CD1 4.21Å; N209-L232 WeakPolarHBondContact ND2-CD1 3.42Å |
| 210 | W | 93.1 | Very high | 88.1 | Confident | 0 Ų | 0 | 58.8 Ų | 58.8 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -124.5 | 7.6 | -168.8 | -54.4 | 99.7 | 0 | 0 | 0 | 114.2 | G195 F196 F199 D206 N212 A216 T219 L220 F247 | G195-W210 VanDerWaalsContact C-CE3 3.4Å; F196-W210 WeakPolarHBondContact CD2-O 3.35Å; F199-W210 HydrophobicContact CB-CB 4.13Å; F199-W210 HydrophobicContact CB-CD2 4.41Å; F199-W210 HydrophobicContact CB-CG 3.77Å; F199-W210 HydrophobicContact CD2-CD2 4.09Å; F199-W210 AromaticContact CD2-CE2 3.83Å; F199-W210 HydrophobicContact CD2-CG 4.33Å; F199-W210 HydrophobicContact CD2-CZ2 4.24Å; F199-W210 AromaticContact CD2-NE1 3.91Å; D206-W210 WeakPolarHBondContact O-CA 3.22Å; D206-W210 WeakPolarHBondContact O-CB 3.49Å; D206-W210 PolarHBondContact O-N 2.79Å; W210-N212 VanDerWaalsContact C-N 3.32Å; W210-N212 PolarHBondContact O-N 3.09Å; W210-A216 HydrophobicContact CE3-CB 3.65Å; W210-A216 HydrophobicContact CZ3-CB 3.89Å; W210-T219 HydrophobicContact CH2-CG2 4.48Å; W210-T219 HydrophobicContact CZ2-CG2 3.96Å; W210-L220 HydrophobicContact CH2-CD1 4.26Å; W210-L220 HydrophobicContact CH2-CD2 3.93Å; W210-L220 HydrophobicContact CH2-CG 3.84Å; W210-L220 HydrophobicContact CZ3-CD1 4.05Å; W210-L220 HydrophobicContact CZ3-CG 4.1Å; W210-F247 AromaticContact CH2-CE1 3.52Å; W210-F247 HydrophobicContact CH2-CE1 3.52Å; W210-F247 AromaticContact CH2-CZ 3.58Å; W210-F247 HydrophobicContact CH2-CZ 3.58Å; W210-F247 AromaticContact CZ2-CE1 3.81Å; W210-F247 HydrophobicContact CZ2-CE1 3.81Å; W210-F247 HydrophobicContact CZ2-CZ 4.26Å; W210-F247 HydrophobicContact CZ3-CE1 4.41Å; W210-F247 HydrophobicContact CZ3-CZ 4.05Å |
| 211 | G | 90.7 | Very high | 88.5 | Confident | 27 Ų | 27 | 63.9 Ų | 63.9 | 28% | 0.278 | 35% | 0.352 | S | S | . | . | S | Bend | trans | -76.4 | -13.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 115 | H207 | H207-G211 VanDerWaalsContact O-CA 3.26Å; H207-G211 WeakPolarHBondContact O-CA 3.28Å; H207-G211 PolarHBondContact O-N 3.11Å |
| 212 | N | 92.4 | Very high | 89.2 | Confident | 84 Ų | 84 | 62.6 Ų | 62.6 | 45% | 0.449 | 34% | 0.342 | S | S | . | . | S | Bend | trans | -154.7 | 165.5 | 170 | 69.7 | 75.6 | 0 | 0 | 0 | 111.3 | W210 A214 A215 A216 | W210-N212 VanDerWaalsContact C-N 3.32Å; W210-N212 PolarHBondContact O-N 3.09Å; N212-A214 VanDerWaalsContact C-N 3.31Å; N212-A214 PolarHBondContact O-N 3.12Å; N212-A214 WeakPolarHBondContact OD1-CA 3.44Å; N212-A214 WeakPolarHBondContact OD1-CB 3.36Å; N212-A214 PolarHBondContact OD1-N 3.04Å; N212-A215 PolarHBondContact O-N 3.44Å; N212-A215 PolarHBondContact OD1-N 2.9Å; N212-A216 PolarHBondContact O-N 3.03Å |
| 213 | L | 93.7 | Very high | 90.5 | Very high | 74 Ų | 74 | 58.9 Ų | 58.9 | 39% | 0.387 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62.6 | -33.8 | -175.5 | -167.9 | 70.3 | 0 | 0 | 0 | 113.3 | Y189 A192 I193 A216 F217 | Y189-L213 HydrophobicContact CE2-CD2 4.37Å; A192-L213 HydrophobicContact CB-CD1 3.74Å; I193-L213 HydrophobicContact CG1-CD1 4.26Å; L213-A216 PolarHBondContact O-N 3.39Å; L213-F217 HydrophobicContact CD1-CD2 4.47Å; L213-F217 HydrophobicContact CD1-CE2 4.25Å; L213-F217 HydrophobicContact CD2-CE2 4.09Å; L213-F217 HydrophobicContact CG-CD2 3.93Å; L213-F217 HydrophobicContact CG-CE2 3.86Å; L213-F217 VanDerWaalsContact O-CD2 3.23Å; L213-F217 WeakPolarHBondContact O-CD2 3.48Å; L213-F217 PolarHBondContact O-N 3.4Å |
| 214 | A | 94.6 | Very high | 91.5 | Very high | 71 Ų | 71 | 52 Ų | 52 | 59% | 0.587 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -73.4 | -38.7 | 180 | 0 | 0 | 0 | 0 | 0 | 112.2 | N212 F217 F218 | N212-A214 VanDerWaalsContact C-N 3.31Å; N212-A214 PolarHBondContact O-N 3.12Å; N212-A214 WeakPolarHBondContact OD1-CA 3.44Å; N212-A214 WeakPolarHBondContact OD1-CB 3.36Å; N212-A214 PolarHBondContact OD1-N 3.04Å; A214-F217 PolarHBondContact O-N 3.45Å; A214-F218 PolarHBondContact O-N 3.34Å |
| 215 | A | 94.2 | Very high | 92.5 | Very high | 18 Ų | 18 | 47.8 Ų | 47.8 | 15% | 0.149 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -59.8 | -49.6 | 169.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | D208 N209 N212 F217 F218 T219 | D208-A215 WeakPolarHBondContact O-CB 3.24Å; N209-A215 CarbonylContact O-C 3.43Å; N209-A215 WeakPolarHBondContact O-CB 3.21Å; N212-A215 PolarHBondContact O-N 3.44Å; N212-A215 PolarHBondContact OD1-N 2.9Å; A215-F217 VanDerWaalsContact C-N 3.32Å; A215-F217 PolarHBondContact O-N 2.94Å; A215-F218 WeakPolarHBondContact O-CA 3.33Å; A215-F218 WeakPolarHBondContact O-CB 3.44Å; A215-F218 PolarHBondContact O-N 3.29Å; A215-T219 PolarHBondContact O-N 3.46Å; A215-T219 PolarHBondContact O-OG1 3.16Å |
| 216 | A | 95.9 | Very high | 93.2 | Very high | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59.9 | -40.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | A192 N209 W210 N212 L213 L220 | A192-A216 HydrophobicContact CB-CB 3.91Å; N209-A216 WeakPolarHBondContact O-CA 3.2Å; N209-A216 PolarHBondContact O-N 3.01Å; W210-A216 HydrophobicContact CE3-CB 3.65Å; W210-A216 HydrophobicContact CZ3-CB 3.89Å; N212-A216 PolarHBondContact O-N 3.03Å; L213-A216 PolarHBondContact O-N 3.39Å; A216-L220 VanDerWaalsContact O-CB 3.3Å; A216-L220 WeakPolarHBondContact O-CB 3.37Å; A216-L220 WeakPolarHBondContact O-CD1 3.16Å; A216-L220 VanDerWaalsContact O-CG 3.25Å; A216-L220 WeakPolarHBondContact O-CG 3.18Å; A216-L220 PolarHBondContact O-N 3.13Å |
| 217 | F | 96.1 | Very high | 93.6 | Very high | 41 Ų | 41 | 55.8 Ų | 55.8 | 18% | 0.18 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.7 | -39.4 | 172 | -92.5 | -64.4 | 0 | 0 | 0 | 113 | F185 M188 Y189 L213 A214 A215 F221 | F185-F217 AromaticContact CD2-CE1 3.89Å; F185-F217 HydrophobicContact CD2-CE1 3.89Å; F185-F217 HydrophobicContact CD2-CZ 4.34Å; F185-F217 HydrophobicContact CE1-CZ 4.46Å; F185-F217 HydrophobicContact CE2-CD1 4.3Å; F185-F217 AromaticContact CE2-CE1 3.54Å; F185-F217 HydrophobicContact CE2-CE1 3.54Å; F185-F217 HydrophobicContact CE2-CE2 4.44Å; F185-F217 AromaticContact CE2-CZ 3.62Å; F185-F217 HydrophobicContact CE2-CZ 3.62Å; F185-F217 HydrophobicContact CZ-CE1 4.07Å; F185-F217 HydrophobicContact CZ-CE2 4.44Å; F185-F217 AromaticContact CZ-CZ 3.68Å; F185-F217 HydrophobicContact CZ-CZ 3.68Å; M188-F217 HydrophobicContact CB-CD1 3.94Å; M188-F217 HydrophobicContact CB-CE1 3.75Å; Y189-F217 HydrophobicContact CD2-CE2 4.25Å; Y189-F217 AromaticContact CD2-CZ 3.93Å; Y189-F217 HydrophobicContact CD2-CZ 3.93Å; Y189-F217 HydrophobicContact CG-CZ 4.43Å; L213-F217 HydrophobicContact CD1-CD2 4.47Å; L213-F217 HydrophobicContact CD1-CE2 4.25Å; L213-F217 HydrophobicContact CD2-CE2 4.09Å; L213-F217 HydrophobicContact CG-CD2 3.93Å; L213-F217 HydrophobicContact CG-CE2 3.86Å; L213-F217 VanDerWaalsContact O-CD2 3.23Å; L213-F217 WeakPolarHBondContact O-CD2 3.48Å; L213-F217 PolarHBondContact O-N 3.4Å; A214-F217 PolarHBondContact O-N 3.45Å; A215-F217 VanDerWaalsContact C-N 3.32Å; A215-F217 PolarHBondContact O-N 2.94Å; F217-F221 VanDerWaalsContact O-CB 3.31Å; F217-F221 WeakPolarHBondContact O-CB 3.15Å; F217-F221 PolarHBondContact O-N 3.37Å |
| 218 | F | 95.3 | Very high | 93.8 | Very high | 157 Ų | 157 | 53.2 Ų | 53.2 | 69% | 0.689 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -67.4 | -45.3 | 177.9 | -173.1 | -96.6 | 0 | 0 | 0 | 111.6 | A214 A215 F221 S222 | A214-F218 PolarHBondContact O-N 3.34Å; A215-F218 WeakPolarHBondContact O-CA 3.33Å; A215-F218 WeakPolarHBondContact O-CB 3.44Å; A215-F218 PolarHBondContact O-N 3.29Å; F218-F221 PolarHBondContact O-N 2.91Å; F218-S222 PolarHBondContact O-N 3.39Å; F218-S222 VanDerWaalsContact O-N 3.07Å |
| 219 | T | 95.1 | Very high | 94 | Very high | 7 Ų | 7 | 51 Ų | 51 | 4% | 0.043 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.2 | -44.7 | 174.5 | -53.9 | 0 | 0 | 0 | 0 | 111.4 | N209 W210 A215 F221 S222 L223 L232 | N209-T219 WeakPolarHBondContact CA-OG1 3.49Å; N209-T219 HydrophobicContact CB-CG2 4.02Å; N209-T219 VanDerWaalsContact CB-OG1 3.31Å; N209-T219 WeakPolarHBondContact CB-OG1 3.4Å; N209-T219 PolarHBondContact O-OG1 3.18Å; N209-T219 PolarHBondContact OD1-OG1 3.43Å; W210-T219 HydrophobicContact CH2-CG2 4.48Å; W210-T219 HydrophobicContact CZ2-CG2 3.96Å; A215-T219 PolarHBondContact O-N 3.46Å; A215-T219 PolarHBondContact O-OG1 3.16Å; T219-F221 VanDerWaalsContact C-N 3.34Å; T219-F221 PolarHBondContact O-N 3.05Å; T219-S222 WeakPolarHBondContact O-CB 3.37Å; T219-S222 PolarHBondContact O-N 3.26Å; T219-L223 WeakPolarHBondContact O-CG 3.4Å; T219-L223 PolarHBondContact O-N 3.02Å; T219-L232 HydrophobicContact CG2-CD1 3.89Å; T219-L232 HydrophobicContact CG2-CD2 3.44Å; T219-L232 VanDerWaalsContact CG2-CD2 3.44Å; T219-L232 HydrophobicContact CG2-CG 4.32Å |
| 220 | L | 96.3 | Very high | 94.2 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -68.2 | -31 | 177.2 | -73.7 | 165 | 0 | 0 | 0 | 113.2 | M188 F191 A192 W210 A216 L223 A224 F247 F251 | M188-L220 HydrophobicContact CG-CB 4.25Å; M188-L220 WeakPolarHBondContact O-CD1 3.47Å; M188-L220 HydrophobicContact SD-CB 4.5Å; F191-L220 VanDerWaalsContact C-CD1 3.49Å; F191-L220 HydrophobicContact CB-CD1 3.86Å; F191-L220 HydrophobicContact CB-CD2 3.89Å; A192-L220 VanDerWaalsContact CA-CD1 3.43Å; A192-L220 HydrophobicContact CB-CD1 3.71Å; W210-L220 HydrophobicContact CH2-CD1 4.26Å; W210-L220 HydrophobicContact CH2-CD2 3.93Å; W210-L220 HydrophobicContact CH2-CG 3.84Å; W210-L220 HydrophobicContact CZ3-CD1 4.05Å; W210-L220 HydrophobicContact CZ3-CG 4.1Å; A216-L220 VanDerWaalsContact O-CB 3.3Å; A216-L220 WeakPolarHBondContact O-CB 3.37Å; A216-L220 WeakPolarHBondContact O-CD1 3.16Å; A216-L220 VanDerWaalsContact O-CG 3.25Å; A216-L220 WeakPolarHBondContact O-CG 3.18Å; A216-L220 PolarHBondContact O-N 3.13Å; L220-L223 HydrophobicContact CD2-CD1 4.23Å; L220-L223 PolarHBondContact O-N 3.45Å; L220-A224 VanDerWaalsContact O-CB 3.31Å; L220-A224 WeakPolarHBondContact O-CB 3.26Å; L220-A224 PolarHBondContact O-N 3.32Å; L220-F247 HydrophobicContact CD2-CE1 4.41Å; L220-F247 HydrophobicContact CD2-CZ 4.32Å; L220-F251 HydrophobicContact CB-CE1 4.29Å; L220-F251 HydrophobicContact CB-CZ 3.98Å; L220-F251 HydrophobicContact CD2-CD1 3.78Å; L220-F251 HydrophobicContact CD2-CD2 3.82Å; L220-F251 HydrophobicContact CD2-CE1 3.69Å; L220-F251 HydrophobicContact CD2-CE2 3.72Å; L220-F251 HydrophobicContact CD2-CG 3.83Å; L220-F251 HydrophobicContact CD2-CZ 3.65Å; L220-F251 HydrophobicContact CG-CZ 4.4Å; L220-F251 VanDerWaalsContact O-CE1 3.27Å; L220-F251 WeakPolarHBondContact O-CE1 3.44Å; L220-F251 WeakPolarHBondContact O-CZ 3.39Å |
| 221 | F | 95.4 | Very high | 94.1 | Very high | 122 Ų | 122 | 57.7 Ų | 57.7 | 54% | 0.535 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -63.9 | -45.6 | 171.4 | -179.7 | -99.1 | 0 | 0 | 0 | 111.2 | M188 F217 F218 T219 L223 A224 T225 | M188-F221 HydrophobicContact SD-CB 4.49Å; F217-F221 VanDerWaalsContact O-CB 3.31Å; F217-F221 WeakPolarHBondContact O-CB 3.15Å; F217-F221 PolarHBondContact O-N 3.37Å; F218-F221 PolarHBondContact O-N 2.91Å; T219-F221 VanDerWaalsContact C-N 3.34Å; T219-F221 PolarHBondContact O-N 3.05Å; F221-L223 VanDerWaalsContact C-N 3.34Å; F221-L223 PolarHBondContact O-N 3.32Å; F221-A224 PolarHBondContact O-N 2.96Å; F221-T225 PolarHBondContact O-N 3.1Å; F221-T225 VanDerWaalsContact O-N 3.11Å; F221-T225 PolarHBondContact O-OG1 3.39Å |
| 222 | S | 94.8 | Very high | 94.1 | Very high | 34 Ų | 34 | 57.1 Ų | 57.1 | 24% | 0.238 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -59.2 | -43.8 | 173.6 | -164.1 | 0 | 0 | 0 | 0 | 112 | F218 T219 A224 T225 V226 D227 | F218-S222 PolarHBondContact O-N 3.39Å; F218-S222 VanDerWaalsContact O-N 3.07Å; T219-S222 WeakPolarHBondContact O-CB 3.37Å; T219-S222 PolarHBondContact O-N 3.26Å; S222-A224 VanDerWaalsContact C-N 3.34Å; S222-A224 PolarHBondContact O-N 2.9Å; S222-T225 PolarHBondContact O-N 3.13Å; S222-T225 PolarHBondContact O-OG1 2.98Å; S222-V226 PolarHBondContact O-N 3.42Å; S222-D227 CarbonylContact C-O 3.55Å; S222-D227 PolarHBondContact O-N 3.33Å; S222-D227 PolarHBondContact OG-O 3.35Å |
| 223 | L | 95 | Very high | 94.2 | Very high | 2 Ų | 2 | 54 Ų | 54 | 1% | 0.01 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -65.3 | -34.6 | 176 | -70.5 | 178.4 | 0 | 0 | 0 | 112.7 | T219 L220 F221 T225 V226 W229 L232 T248 F251 I252 | T219-L223 WeakPolarHBondContact O-CG 3.4Å; T219-L223 PolarHBondContact O-N 3.02Å; L220-L223 HydrophobicContact CD2-CD1 4.23Å; L220-L223 PolarHBondContact O-N 3.45Å; F221-L223 VanDerWaalsContact C-N 3.34Å; F221-L223 PolarHBondContact O-N 3.32Å; L223-T225 VanDerWaalsContact C-N 3.32Å; L223-V226 WeakPolarHBondContact O-CA 3.31Å; L223-V226 PolarHBondContact O-N 2.92Å; L223-W229 HydrophobicContact CD2-CB 3.37Å; L223-L232 HydrophobicContact CD1-CD2 3.78Å; L223-L232 HydrophobicContact CD2-CD2 3.87Å; L223-L232 HydrophobicContact CG-CD2 4Å; L223-T248 HydrophobicContact CD2-CG2 4.01Å; L223-F251 HydrophobicContact CB-CD1 3.69Å; L223-F251 HydrophobicContact CB-CE1 3.59Å; L223-F251 HydrophobicContact CD1-CD1 4.23Å; L223-I252 HydrophobicContact CD2-CD1 4.4Å |
| 224 | A | 94.6 | Very high | 94 | Very high | 17 Ų | 17 | 56.6 Ų | 56.6 | 14% | 0.14 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -70.5 | -29.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112.2 | L220 F221 S222 V226 F251 A255 | L220-A224 VanDerWaalsContact O-CB 3.31Å; L220-A224 WeakPolarHBondContact O-CB 3.26Å; L220-A224 PolarHBondContact O-N 3.32Å; F221-A224 PolarHBondContact O-N 2.96Å; S222-A224 VanDerWaalsContact C-N 3.34Å; S222-A224 PolarHBondContact O-N 2.9Å; A224-V226 VanDerWaalsContact C-N 3.25Å; A224-F251 HydrophobicContact CB-CE1 4.11Å; A224-F251 HydrophobicContact CB-CZ 4.14Å; A224-A255 HydrophobicContact CB-CB 4.01Å |
| 225 | T | 93.9 | Very high | 93.8 | Very high | 83 Ų | 83 | 57.5 Ų | 57.5 | 51% | 0.509 | 30% | 0.3 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.7 | 0.5 | 168.6 | 53.8 | 0 | 0 | 0 | 0 | 113.5 | F221 S222 L223 D227 | F221-T225 PolarHBondContact O-N 3.1Å; F221-T225 VanDerWaalsContact O-N 3.11Å; F221-T225 PolarHBondContact O-OG1 3.39Å; S222-T225 PolarHBondContact O-N 3.13Å; S222-T225 PolarHBondContact O-OG1 2.98Å; L223-T225 VanDerWaalsContact C-N 3.32Å; T225-D227 PolarHBondContact O-N 3.41Å |
| 226 | V | 94.3 | Very high | 93.5 | Very high | 64 Ų | 64 | 56.7 Ų | 56.7 | 39% | 0.388 | 29% | 0.293 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 56.4 | 33.4 | -175.2 | -159.3 | 0 | 0 | 0 | 0 | 111.8 | S222 L223 A224 W229 I252 | S222-V226 PolarHBondContact O-N 3.42Å; L223-V226 WeakPolarHBondContact O-CA 3.31Å; L223-V226 PolarHBondContact O-N 2.92Å; A224-V226 VanDerWaalsContact C-N 3.25Å; V226-W229 HydrophobicContact CG1-CG 4.4Å; V226-I252 HydrophobicContact CG1-CG2 4.39Å; V226-I252 HydrophobicContact CG2-CG2 4.11Å |
| 227 | D | 93.6 | Very high | 93.1 | Very high | 108 Ų | 108 | 59 Ų | 59 | 58% | 0.578 | 31% | 0.306 | S | S | * | . | trans | -105.1 | 140.3 | 179 | -170.3 | 22.6 | 0 | 0 | 0 | 111.1 | S222 T225 W229 | S222-D227 CarbonylContact C-O 3.55Å; S222-D227 PolarHBondContact O-N 3.33Å; S222-D227 PolarHBondContact OG-O 3.35Å; T225-D227 PolarHBondContact O-N 3.41Å; D227-W229 PolarHBondContact O-N 3.13Å | ||
| 228 | G | 91.4 | Very high | 92.7 | Very high | 34 Ų | 34 | 63.1 Ų | 63.1 | 35% | 0.351 | 33% | 0.329 | S | S | . | . | S | Bend | trans | 61.6 | 0.1 | -178.5 | 0 | 0 | 0 | 0 | 0 | 116.7 | T230 D231 L232 | G228-T230 VanDerWaalsContact C-N 3.29Å; G228-T230 PolarHBondContact O-N 3.31Å; G228-D231 PolarHBondContact O-N 2.95Å; G228-D231 VanDerWaalsContact O-N 3.11Å; G228-L232 PolarHBondContact O-N 3.19Å; G228-L232 VanDerWaalsContact O-N 3.15Å |
| 229 | W | 93.6 | Very high | 92.1 | Very high | 94 Ų | 94 | 60.4 Ų | 60.4 | 36% | 0.356 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -61.9 | -32.1 | -167.7 | 76.2 | -90.2 | 0 | 0 | 0 | 114.3 | L223 V226 D227 Q233 T248 I252 | L223-W229 HydrophobicContact CD2-CB 3.37Å; V226-W229 HydrophobicContact CG1-CG 4.4Å; D227-W229 PolarHBondContact O-N 3.13Å; W229-Q233 VanDerWaalsContact O-CB 3.29Å; W229-Q233 WeakPolarHBondContact O-CB 3.43Å; W229-Q233 PolarHBondContact O-N 2.93Å; W229-T248 HydrophobicContact CE3-CG2 4.46Å; W229-I252 HydrophobicContact CB-CD1 3.89Å; W229-I252 HydrophobicContact CD2-CD1 3.93Å; W229-I252 HydrophobicContact CE3-CD1 4.11Å; W229-I252 HydrophobicContact CG-CD1 3.86Å |
| 230 | T | 93.3 | Very high | 91.4 | Very high | 76 Ų | 76 | 68.6 Ų | 68.6 | 47% | 0.466 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -67.4 | -38.1 | 178.2 | 49.9 | 0 | 0 | 0 | 0 | 112.2 | G228 K234 | G228-T230 VanDerWaalsContact C-N 3.29Å; G228-T230 PolarHBondContact O-N 3.31Å; T230-K234 WeakPolarHBondContact O-CB 3.45Å; T230-K234 PolarHBondContact O-N 3.39Å |
| 231 | D | 92 | Very high | 90.6 | Very high | 98 Ų | 98 | 70.7 Ų | 70.7 | 52% | 0.524 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -75.8 | -39.2 | -180 | -68.9 | -38.2 | 0 | 0 | 0 | 110.9 | G228 K234 Q235 | G228-D231 PolarHBondContact O-N 2.95Å; G228-D231 VanDerWaalsContact O-N 3.11Å; D231-K234 PolarHBondContact O-N 2.83Å; D231-Q235 WeakPolarHBondContact O-CG 3.3Å; D231-Q235 PolarHBondContact O-N 3.1Å |
| 232 | L | 91.6 | Very high | 89.7 | Confident | 15 Ų | 15 | 69.6 Ų | 69.6 | 8% | 0.079 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -59.5 | -47.8 | 169.8 | -174.3 | 76 | 0 | 0 | 0 | 111.2 | N209 T219 L223 G228 K234 Q235 L236 | N209-L232 HydrophobicContact CB-CD1 4.21Å; N209-L232 WeakPolarHBondContact ND2-CD1 3.42Å; T219-L232 HydrophobicContact CG2-CD1 3.89Å; T219-L232 HydrophobicContact CG2-CD2 3.44Å; T219-L232 VanDerWaalsContact CG2-CD2 3.44Å; T219-L232 HydrophobicContact CG2-CG 4.32Å; L223-L232 HydrophobicContact CD1-CD2 3.78Å; L223-L232 HydrophobicContact CD2-CD2 3.87Å; L223-L232 HydrophobicContact CG-CD2 4Å; G228-L232 PolarHBondContact O-N 3.19Å; G228-L232 VanDerWaalsContact O-N 3.15Å; L232-K234 VanDerWaalsContact C-N 3.29Å; L232-K234 PolarHBondContact O-N 3.32Å; L232-Q235 WeakPolarHBondContact O-CB 3.24Å; L232-Q235 PolarHBondContact O-N 3.09Å; L232-Q235 VanDerWaalsContact O-N 3.12Å; L232-L236 HydrophobicContact CD2-CD1 4.33Å; L232-L236 HydrophobicContact CG-CD1 3.98Å; L232-L236 WeakPolarHBondContact O-CG 3.44Å; L232-L236 PolarHBondContact O-N 3.12Å |
| 233 | Q | 93.1 | Very high | 89.2 | Confident | 18 Ų | 18 | 73.1 Ų | 73.1 | 8% | 0.084 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -63.4 | -36.4 | 179.3 | -172.5 | 56.2 | 55.7 | 0 | 0 | 111.9 | W229 L236 D237 S244 R245 T248 | W229-Q233 VanDerWaalsContact O-CB 3.29Å; W229-Q233 WeakPolarHBondContact O-CB 3.43Å; W229-Q233 PolarHBondContact O-N 2.93Å; Q233-L236 PolarHBondContact O-N 3.28Å; Q233-D237 PolarHBondContact NE2-OD1 3.29Å; Q233-D237 VanDerWaalsContact O-CB 3.31Å; Q233-D237 WeakPolarHBondContact O-CB 3.49Å; Q233-D237 PolarHBondContact O-N 2.9Å; Q233-S244 PolarHBondContact NE2-OG 3.49Å; Q233-S244 PolarHBondContact OE1-O 2.88Å; Q233-R245 HydrophobicContact CG-CG 4.45Å; Q233-R245 VanDerWaalsContact NE2-CG 3.26Å; Q233-T248 VanDerWaalsContact OE1-CB 3.22Å; Q233-T248 PolarHBondContact OE1-OG1 3.19Å |
| 234 | K | 90.6 | Very high | 89 | Confident | 130 Ų | 130 | 73 Ų | 73 | 57% | 0.565 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -64.5 | -38.3 | 173.6 | -174.5 | 178.3 | -179.6 | -179 | 0 | 112.3 | T230 D231 L232 N238 | T230-K234 WeakPolarHBondContact O-CB 3.45Å; T230-K234 PolarHBondContact O-N 3.39Å; D231-K234 PolarHBondContact O-N 2.83Å; L232-K234 VanDerWaalsContact C-N 3.29Å; L232-K234 PolarHBondContact O-N 3.32Å; K234-N238 WeakPolarHBondContact O-CB 3.28Å; K234-N238 PolarHBondContact O-N 2.84Å; K234-N238 PolarHBondContact O-ND2 3.43Å; K234-N238 PolarHBondContact O-OD1 2.95Å |
| 235 | Q | 89 | Confident | 88.9 | Confident | 90 Ų | 90 | 79.2 Ų | 79.2 | 42% | 0.421 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -67.7 | -38 | 174.5 | -69.4 | 175.5 | 32.2 | 0 | 0 | 112.3 | D231 L232 R239 | D231-Q235 WeakPolarHBondContact O-CG 3.3Å; D231-Q235 PolarHBondContact O-N 3.1Å; L232-Q235 WeakPolarHBondContact O-CB 3.24Å; L232-Q235 PolarHBondContact O-N 3.09Å; L232-Q235 VanDerWaalsContact O-N 3.12Å; Q235-R239 WeakPolarHBondContact O-CG 3.45Å |
| 236 | L | 88.6 | Confident | 88.8 | Confident | 0 Ų | 0 | 77.6 Ų | 77.6 | 0% | 0 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -70.2 | -41.5 | 175.3 | -72 | 161 | 0 | 0 | 0 | 112.5 | F199 L232 Q233 R239 F241 | F199-L236 HydrophobicContact CB-CD2 4.24Å; F199-L236 HydrophobicContact CD1-CD2 3.84Å; F199-L236 HydrophobicContact CD2-CD2 4.28Å; F199-L236 HydrophobicContact CE1-CD2 4.3Å; F199-L236 HydrophobicContact CG-CD2 3.84Å; L232-L236 HydrophobicContact CD2-CD1 4.33Å; L232-L236 HydrophobicContact CG-CD1 3.98Å; L232-L236 WeakPolarHBondContact O-CG 3.44Å; L232-L236 PolarHBondContact O-N 3.12Å; Q233-L236 PolarHBondContact O-N 3.28Å; L236-R239 PolarHBondContact O-N 3.38Å; L236-R239 VanDerWaalsContact O-N 3.15Å; L236-F241 HydrophobicContact CD2-CD2 3.93Å; L236-F241 HydrophobicContact CD2-CE2 4.45Å; L236-F241 PolarHBondContact O-N 3.18Å |
| 237 | D | 87.8 | Confident | 88.8 | Confident | 50 Ų | 50 | 75.1 Ų | 75.1 | 27% | 0.267 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -60.9 | -44.1 | 175 | -84.9 | 6.8 | 0 | 0 | 0 | 111.2 | Q233 R239 E240 R245 | Q233-D237 PolarHBondContact NE2-OD1 3.29Å; Q233-D237 VanDerWaalsContact O-CB 3.31Å; Q233-D237 WeakPolarHBondContact O-CB 3.49Å; Q233-D237 PolarHBondContact O-N 2.9Å; D237-R239 PolarHBondContact O-N 3.31Å; D237-R239 VanDerWaalsContact O-N 3.13Å; D237-E240 PolarHBondContact O-N 3.35Å; D237-R245 WeakPolarHBondContact OD1-CG 3.32Å; D237-R245 IonicContact OD1-CZ 3.83Å; D237-R245 IonicContact OD1-NE 2.98Å; D237-R245 PolarHBondContact OD1-NE 3.31Å; D237-R245 IonicContact OD1-NH2 3.84Å; D237-R245 IonicContact OD2-CZ 3.29Å; D237-R245 VanDerWaalsContact OD2-CZ 3.29Å; D237-R245 IonicContact OD2-NE 3.06Å; D237-R245 PolarHBondContact OD2-NE 2.97Å; D237-R245 IonicContact OD2-NH2 2.69Å; D237-R245 PolarHBondContact OD2-NH2 3.32Å |
| 238 | N | 87.3 | Confident | 88.8 | Confident | 126 Ų | 126 | 70 Ų | 70 | 67% | 0.674 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.3 | -17.2 | 176.3 | -74.4 | -13.1 | 0 | 0 | 0 | 113.9 | K234 | K234-N238 WeakPolarHBondContact O-CB 3.28Å; K234-N238 PolarHBondContact O-N 2.84Å; K234-N238 PolarHBondContact O-ND2 3.43Å; K234-N238 PolarHBondContact O-OD1 2.95Å |
| 239 | R | 82.8 | Confident | 89 | Confident | 100 Ų | 100 | 72.6 Ų | 72.6 | 38% | 0.377 | 37% | 0.367 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.4 | 8.5 | 176.7 | -65.5 | 170.6 | -175.5 | -106.4 | 12.4 | 112.6 | K204 G205 Q235 L236 D237 F241 | K204-R239 PolarHBondContact O-NH1 3.06Å; G205-R239 PolarHBondContact O-NH1 2.98Å; Q235-R239 WeakPolarHBondContact O-CG 3.45Å; L236-R239 PolarHBondContact O-N 3.38Å; L236-R239 VanDerWaalsContact O-N 3.15Å; D237-R239 PolarHBondContact O-N 3.31Å; D237-R239 VanDerWaalsContact O-N 3.13Å; R239-F241 HydrophobicContact CB-CD2 3.61Å; R239-F241 HydrophobicContact CB-CE2 3.59Å; R239-F241 HydrophobicContact CB-CZ 4.5Å; R239-F241 HydrophobicContact CG-CE2 4.35Å; R239-F241 PolarHBondContact O-N 2.94Å |
| 240 | E | 80.1 | Confident | 89.1 | Confident | 180 Ų | 180 | 72.4 Ų | 72.4 | 84% | 0.841 | 37% | 0.372 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.4 | 24.5 | 178.5 | -56.4 | -170.7 | 138.1 | 0 | 0 | 115.1 | D237 A242 | D237-E240 PolarHBondContact O-N 3.35Å; E240-A242 PolarHBondContact O-N 2.92Å |
| 241 | F | 79.4 | Confident | 89.3 | Confident | 44 Ų | 44 | 68.8 Ų | 68.8 | 19% | 0.193 | 35% | 0.349 | C | S | . | . | trans | -73.1 | 90.7 | 176.6 | -70.4 | -59.4 | 0 | 0 | 0 | 111.7 | F199 L236 R239 L243 S244 | F199-F241 HydrophobicContact CD1-CB 4.18Å; F199-F241 HydrophobicContact CD1-CD1 4.06Å; F199-F241 AromaticContact CD1-CD2 3.93Å; F199-F241 HydrophobicContact CD1-CD2 3.93Å; F199-F241 HydrophobicContact CD1-CE1 4.42Å; F199-F241 HydrophobicContact CD1-CE2 4.28Å; F199-F241 AromaticContact CD1-CG 3.82Å; F199-F241 HydrophobicContact CD1-CG 3.82Å; F199-F241 HydrophobicContact CE1-CB 4Å; F199-F241 HydrophobicContact CE1-CD1 4.49Å; F199-F241 HydrophobicContact CE1-CG 4.15Å; L236-F241 HydrophobicContact CD2-CD2 3.93Å; L236-F241 HydrophobicContact CD2-CE2 4.45Å; L236-F241 PolarHBondContact O-N 3.18Å; R239-F241 HydrophobicContact CB-CD2 3.61Å; R239-F241 HydrophobicContact CB-CE2 3.59Å; R239-F241 HydrophobicContact CB-CZ 4.5Å; R239-F241 HydrophobicContact CG-CE2 4.35Å; R239-F241 PolarHBondContact O-N 2.94Å; F241-L243 PolarHBondContact O-N 2.9Å; F241-L243 VanDerWaalsContact O-N 3.1Å; F241-S244 VanDerWaalsContact O-CB 3.25Å; F241-S244 WeakPolarHBondContact O-CB 3.3Å; F241-S244 PolarHBondContact O-N 3.24Å; F241-S244 PolarHBondContact O-OG 3.43Å | ||
| 242 | A | 77.1 | Confident | 89.5 | Confident | 98 Ų | 98 | 65.2 Ų | 65.2 | 81% | 0.81 | 33% | 0.33 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.5 | -31.7 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | E240 | E240-A242 PolarHBondContact O-N 2.92Š|
| 243 | L | 85.3 | Confident | 89.7 | Confident | 109 Ų | 109 | 69.9 Ų | 69.9 | 57% | 0.571 | 35% | 0.354 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.1 | -10.1 | 178.3 | -64.8 | 177.5 | 0 | 0 | 0 | 114.2 | L198 F241 R245 A246 F247 | L198-L243 HydrophobicContact CD2-CD1 4.17Å; F241-L243 PolarHBondContact O-N 2.9Å; F241-L243 VanDerWaalsContact O-N 3.1Å; L243-R245 PolarHBondContact O-N 2.85Å; L243-A246 PolarHBondContact O-N 2.7Å; L243-F247 WeakPolarHBondContact O-CB 3.44Å; L243-F247 PolarHBondContact O-N 2.92Å |
| 244 | S | 90.6 | Very high | 89.8 | Confident | 0 Ų | 0 | 72.3 Ų | 72.3 | 0% | 0 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -61 | -48 | -174 | 61.8 | 0 | 0 | 0 | 0 | 113 | Q233 F241 A246 F247 T248 | Q233-S244 PolarHBondContact NE2-OG 3.49Å; Q233-S244 PolarHBondContact OE1-O 2.88Å; F241-S244 VanDerWaalsContact O-CB 3.25Å; F241-S244 WeakPolarHBondContact O-CB 3.3Å; F241-S244 PolarHBondContact O-N 3.24Å; F241-S244 PolarHBondContact O-OG 3.43Å; S244-A246 VanDerWaalsContact C-N 3.31Å; S244-A246 PolarHBondContact O-N 3.33Å; S244-F247 WeakPolarHBondContact O-CB 3.46Å; S244-F247 PolarHBondContact O-N 2.85Å; S244-T248 PolarHBondContact O-N 3.49Å; S244-T248 PolarHBondContact O-OG1 3.47Å |
| 245 | R | 91.4 | Very high | 90 | Very high | 147 Ų | 147 | 66.2 Ų | 66.2 | 56% | 0.555 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -57.4 | -44.7 | 179.2 | -65.1 | 178.5 | 177.1 | -177.8 | -5.9 | 111.9 | Q233 D237 L243 I249 | Q233-R245 HydrophobicContact CG-CG 4.45Å; Q233-R245 VanDerWaalsContact NE2-CG 3.26Å; D237-R245 WeakPolarHBondContact OD1-CG 3.32Å; D237-R245 IonicContact OD1-CZ 3.83Å; D237-R245 IonicContact OD1-NE 2.98Å; D237-R245 PolarHBondContact OD1-NE 3.31Å; D237-R245 IonicContact OD1-NH2 3.84Å; D237-R245 IonicContact OD2-CZ 3.29Å; D237-R245 VanDerWaalsContact OD2-CZ 3.29Å; D237-R245 IonicContact OD2-NE 3.06Å; D237-R245 PolarHBondContact OD2-NE 2.97Å; D237-R245 IonicContact OD2-NH2 2.69Å; D237-R245 PolarHBondContact OD2-NH2 3.32Å; L243-R245 PolarHBondContact O-N 2.85Å; R245-I249 VanDerWaalsContact O-CB 3.3Å; R245-I249 WeakPolarHBondContact O-CB 3.21Å; R245-I249 WeakPolarHBondContact O-CD1 3.26Å; R245-I249 WeakPolarHBondContact O-CG1 3.35Å; R245-I249 PolarHBondContact O-N 3Å |
| 246 | A | 92.3 | Very high | 90.2 | Very high | 49 Ų | 49 | 64.2 Ų | 64.2 | 41% | 0.405 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -65.1 | -46.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L243 S244 I250 | L243-A246 PolarHBondContact O-N 2.7Å; S244-A246 VanDerWaalsContact C-N 3.31Å; S244-A246 PolarHBondContact O-N 3.33Å; A246-I250 HydrophobicContact CB-CD1 4.47Å; A246-I250 VanDerWaalsContact O-CB 3.23Å; A246-I250 WeakPolarHBondContact O-CB 3.43Å; A246-I250 WeakPolarHBondContact O-CD1 3.44Å; A246-I250 WeakPolarHBondContact O-CG1 3.49Å; A246-I250 PolarHBondContact O-N 3.45Å |
| 247 | F | 94.6 | Very high | 90.3 | Very high | 12 Ų | 12 | 70 Ų | 70 | 5% | 0.053 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -55.9 | -52.9 | 176.3 | 174.3 | -85.4 | 0 | 0 | 0 | 112 | F191 L194 L198 F199 W210 L220 L243 S244 F251 | F191-F247 HydrophobicContact CB-CE2 4.44Å; F191-F247 HydrophobicContact CB-CZ 4.3Å; F191-F247 HydrophobicContact CD1-CD2 4.01Å; F191-F247 HydrophobicContact CD1-CE1 4.44Å; F191-F247 AromaticContact CD1-CE2 3.53Å; F191-F247 HydrophobicContact CD1-CE2 3.53Å; F191-F247 AromaticContact CD1-CZ 3.78Å; F191-F247 HydrophobicContact CD1-CZ 3.78Å; F191-F247 HydrophobicContact CE1-CD2 4.24Å; F191-F247 HydrophobicContact CE1-CE2 4.22Å; F191-F247 HydrophobicContact CG-CE2 4.37Å; F191-F247 WeakPolarHBondContact O-CZ 3.28Å; L194-F247 HydrophobicContact CB-CE2 4.17Å; L194-F247 HydrophobicContact CD2-CD2 3.98Å; L194-F247 HydrophobicContact CD2-CE2 3.98Å; L194-F247 HydrophobicContact CG-CD2 4.21Å; L194-F247 HydrophobicContact CG-CE2 3.98Å; L198-F247 HydrophobicContact CD1-CD2 4.15Å; F199-F247 HydrophobicContact CE2-CB 4.34Å; F199-F247 AromaticContact CE2-CD1 3.66Å; F199-F247 HydrophobicContact CE2-CD1 3.66Å; F199-F247 HydrophobicContact CE2-CD2 4.11Å; F199-F247 AromaticContact CE2-CE1 3.9Å; F199-F247 HydrophobicContact CE2-CE1 3.9Å; F199-F247 HydrophobicContact CE2-CE2 4.3Å; F199-F247 AromaticContact CE2-CG 3.78Å; F199-F247 HydrophobicContact CE2-CG 3.78Å; F199-F247 HydrophobicContact CE2-CZ 4.21Å; F199-F247 HydrophobicContact CZ-CB 4.08Å; F199-F247 HydrophobicContact CZ-CD1 4.21Å; F199-F247 HydrophobicContact CZ-CD2 4.49Å; F199-F247 HydrophobicContact CZ-CG 4.02Å; W210-F247 AromaticContact CH2-CE1 3.52Å; W210-F247 HydrophobicContact CH2-CE1 3.52Å; W210-F247 AromaticContact CH2-CZ 3.58Å; W210-F247 HydrophobicContact CH2-CZ 3.58Å; W210-F247 AromaticContact CZ2-CE1 3.81Å; W210-F247 HydrophobicContact CZ2-CE1 3.81Å; W210-F247 HydrophobicContact CZ2-CZ 4.26Å; W210-F247 HydrophobicContact CZ3-CE1 4.41Å; W210-F247 HydrophobicContact CZ3-CZ 4.05Å; L220-F247 HydrophobicContact CD2-CE1 4.41Å; L220-F247 HydrophobicContact CD2-CZ 4.32Å; L243-F247 WeakPolarHBondContact O-CB 3.44Å; L243-F247 PolarHBondContact O-N 2.92Å; S244-F247 WeakPolarHBondContact O-CB 3.46Å; S244-F247 PolarHBondContact O-N 2.85Å; F247-F251 VanDerWaalsContact O-CB 3.32Å; F247-F251 WeakPolarHBondContact O-CB 3.37Å; F247-F251 PolarHBondContact O-N 3.32Å |
| 248 | T | 93.8 | Very high | 90.5 | Very high | 0 Ų | 0 | 68.6 Ų | 68.6 | 0% | 0 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -64 | -46.8 | -177.4 | -53.6 | 0 | 0 | 0 | 0 | 111.5 | L223 W229 Q233 S244 F251 I252 | L223-T248 HydrophobicContact CD2-CG2 4.01Å; W229-T248 HydrophobicContact CE3-CG2 4.46Å; Q233-T248 VanDerWaalsContact OE1-CB 3.22Å; Q233-T248 PolarHBondContact OE1-OG1 3.19Å; S244-T248 PolarHBondContact O-N 3.49Å; S244-T248 PolarHBondContact O-OG1 3.47Å; T248-F251 PolarHBondContact O-N 3.46Å; T248-I252 HydrophobicContact CG2-CD1 3.8Å; T248-I252 WeakPolarHBondContact O-CB 3.31Å; T248-I252 VanDerWaalsContact O-CG1 3.27Å; T248-I252 WeakPolarHBondContact O-CG1 3.39Å; T248-I252 PolarHBondContact O-N 3.42Å |
| 249 | I | 94.8 | Very high | 90.5 | Very high | 89 Ų | 89 | 68.4 Ų | 68.4 | 46% | 0.456 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -65.9 | -45.5 | -179.6 | -67.3 | 167.8 | 0 | 0 | 0 | 111.1 | R245 F251 I252 L253 | R245-I249 VanDerWaalsContact O-CB 3.3Å; R245-I249 WeakPolarHBondContact O-CB 3.21Å; R245-I249 WeakPolarHBondContact O-CD1 3.26Å; R245-I249 WeakPolarHBondContact O-CG1 3.35Å; R245-I249 PolarHBondContact O-N 3Å; I249-F251 VanDerWaalsContact C-N 3.34Å; I249-F251 PolarHBondContact O-N 3.09Å; I249-I252 PolarHBondContact O-N 2.92Å; I249-L253 HydrophobicContact CG2-CD1 3.84Å; I249-L253 HydrophobicContact CG2-CG 4.36Å; I249-L253 WeakPolarHBondContact O-CB 2.86Å; I249-L253 VanDerWaalsContact O-CG 3.28Å; I249-L253 WeakPolarHBondContact O-CG 3.47Å; I249-L253 PolarHBondContact O-N 3.18Å |
| 250 | I | 96.2 | Very high | 90.7 | Very high | 90 Ų | 90 | 68.5 Ų | 68.5 | 46% | 0.462 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -63.6 | -42.3 | 178.9 | -68.2 | 168 | 0 | 0 | 0 | 110.4 | F191 A246 L253 L254 | F191-I250 HydrophobicContact CZ-CG2 4.18Å; A246-I250 HydrophobicContact CB-CD1 4.47Å; A246-I250 VanDerWaalsContact O-CB 3.23Å; A246-I250 WeakPolarHBondContact O-CB 3.43Å; A246-I250 WeakPolarHBondContact O-CD1 3.44Å; A246-I250 WeakPolarHBondContact O-CG1 3.49Å; A246-I250 PolarHBondContact O-N 3.45Å; I250-L253 PolarHBondContact O-N 3.34Å; I250-L254 HydrophobicContact CG2-CD1 3.77Å; I250-L254 HydrophobicContact CG2-CG 4.39Å; I250-L254 WeakPolarHBondContact O-CB 3.43Å; I250-L254 WeakPolarHBondContact O-CG 3.29Å; I250-L254 PolarHBondContact O-N 3.28Å |
| 251 | F | 96.3 | Very high | 91 | Very high | 0 Ų | 0 | 63.2 Ų | 63.2 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -62.2 | -49.6 | 176.2 | -179.7 | -102.1 | 0 | 0 | 0 | 112.1 | L187 M188 F191 L220 L223 A224 F247 T248 I249 L253 L254 A255 | L187-F251 HydrophobicContact CD2-CD2 4.41Å; L187-F251 HydrophobicContact CD2-CE2 4.14Å; L187-F251 HydrophobicContact CG-CD2 4.5Å; L187-F251 HydrophobicContact CG-CE2 4.19Å; M188-F251 HydrophobicContact CG-CE2 4.23Å; M188-F251 HydrophobicContact CG-CZ 3.97Å; F191-F251 HydrophobicContact CB-CD2 3.86Å; F191-F251 HydrophobicContact CB-CE2 4.15Å; F191-F251 HydrophobicContact CD1-CB 3.7Å; F191-F251 AromaticContact CD1-CD2 3.57Å; F191-F251 HydrophobicContact CD1-CD2 3.57Å; F191-F251 AromaticContact CD1-CG 3.98Å; F191-F251 HydrophobicContact CD1-CG 3.98Å; F191-F251 AromaticContact CD2-CD2 4Å; F191-F251 HydrophobicContact CD2-CD2 4Å; F191-F251 HydrophobicContact CE1-CB 3.65Å; F191-F251 HydrophobicContact CE1-CD2 4.09Å; F191-F251 HydrophobicContact CE1-CG 4.34Å; F191-F251 HydrophobicContact CE2-CD2 4.47Å; F191-F251 AromaticContact CG-CD2 3.52Å; F191-F251 HydrophobicContact CG-CD2 3.52Å; F191-F251 HydrophobicContact CG-CE2 4.22Å; F191-F251 HydrophobicContact CG-CG 4.37Å; F191-F251 HydrophobicContact CZ-CB 4.44Å; L220-F251 HydrophobicContact CB-CE1 4.29Å; L220-F251 HydrophobicContact CB-CZ 3.98Å; L220-F251 HydrophobicContact CD2-CD1 3.78Å; L220-F251 HydrophobicContact CD2-CD2 3.82Å; L220-F251 HydrophobicContact CD2-CE1 3.69Å; L220-F251 HydrophobicContact CD2-CE2 3.72Å; L220-F251 HydrophobicContact CD2-CG 3.83Å; L220-F251 HydrophobicContact CD2-CZ 3.65Å; L220-F251 HydrophobicContact CG-CZ 4.4Å; L220-F251 VanDerWaalsContact O-CE1 3.27Å; L220-F251 WeakPolarHBondContact O-CE1 3.44Å; L220-F251 WeakPolarHBondContact O-CZ 3.39Å; L223-F251 HydrophobicContact CB-CD1 3.69Å; L223-F251 HydrophobicContact CB-CE1 3.59Å; L223-F251 HydrophobicContact CD1-CD1 4.23Å; A224-F251 HydrophobicContact CB-CE1 4.11Å; A224-F251 HydrophobicContact CB-CZ 4.14Å; F247-F251 VanDerWaalsContact O-CB 3.32Å; F247-F251 WeakPolarHBondContact O-CB 3.37Å; F247-F251 PolarHBondContact O-N 3.32Å; T248-F251 PolarHBondContact O-N 3.46Å; I249-F251 VanDerWaalsContact C-N 3.34Å; I249-F251 PolarHBondContact O-N 3.09Å; F251-L253 VanDerWaalsContact C-N 3.31Å; F251-L253 PolarHBondContact O-N 2.91Å; F251-L254 PolarHBondContact O-N 3.22Å; F251-A255 HydrophobicContact CE1-CB 4.22Å; F251-A255 HydrophobicContact CZ-CB 4.17Å; F251-A255 VanDerWaalsContact O-CB 3.27Å; F251-A255 WeakPolarHBondContact O-CB 3.45Å; F251-A255 PolarHBondContact O-N 2.86Å |
| 252 | I | 96 | Very high | 91.3 | Very high | 22 Ų | 22 | 62.4 Ų | 62.4 | 11% | 0.113 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -58.9 | -43.7 | 178.8 | -72 | 169.6 | 0 | 0 | 0 | 110.7 | L223 V226 W229 T248 I249 S256 | L223-I252 HydrophobicContact CD2-CD1 4.4Å; V226-I252 HydrophobicContact CG1-CG2 4.39Å; V226-I252 HydrophobicContact CG2-CG2 4.11Å; W229-I252 HydrophobicContact CB-CD1 3.89Å; W229-I252 HydrophobicContact CD2-CD1 3.93Å; W229-I252 HydrophobicContact CE3-CD1 4.11Å; W229-I252 HydrophobicContact CG-CD1 3.86Å; T248-I252 HydrophobicContact CG2-CD1 3.8Å; T248-I252 WeakPolarHBondContact O-CB 3.31Å; T248-I252 VanDerWaalsContact O-CG1 3.27Å; T248-I252 WeakPolarHBondContact O-CG1 3.39Å; T248-I252 PolarHBondContact O-N 3.42Å; I249-I252 PolarHBondContact O-N 2.92Å; I252-S256 WeakPolarHBondContact O-CB 3.46Å; I252-S256 PolarHBondContact O-N 3.15Å; I252-S256 PolarHBondContact O-OG 3.22Å |
| 253 | L | 96.2 | Very high | 91.6 | Very high | 114 Ų | 114 | 63.4 Ų | 63.4 | 60% | 0.597 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -63.7 | -45.7 | 177.9 | -72.9 | 172.5 | 0 | 0 | 0 | 112 | I249 I250 F251 F257 | I249-L253 HydrophobicContact CG2-CD1 3.84Å; I249-L253 HydrophobicContact CG2-CG 4.36Å; I249-L253 WeakPolarHBondContact O-CB 2.86Å; I249-L253 VanDerWaalsContact O-CG 3.28Å; I249-L253 WeakPolarHBondContact O-CG 3.47Å; I249-L253 PolarHBondContact O-N 3.18Å; I250-L253 PolarHBondContact O-N 3.34Å; F251-L253 VanDerWaalsContact C-N 3.31Å; F251-L253 PolarHBondContact O-N 2.91Å; L253-F257 VanDerWaalsContact O-CB 3.24Å; L253-F257 WeakPolarHBondContact O-CB 3.45Å; L253-F257 PolarHBondContact O-N 2.76Å |
| 254 | L | 95.6 | Very high | 91.7 | Very high | 69 Ų | 69 | 61.4 Ų | 61.4 | 36% | 0.361 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -66.2 | -44.4 | 178 | -73 | 170.8 | 0 | 0 | 0 | 112.3 | L187 F191 I250 F251 F257 I258 | L187-L254 HydrophobicContact CD1-CB 4.47Å; L187-L254 HydrophobicContact CD1-CD1 4.18Å; L187-L254 HydrophobicContact CD2-CB 3.79Å; F191-L254 HydrophobicContact CE2-CD1 4.15Å; F191-L254 HydrophobicContact CZ-CD1 4.02Å; I250-L254 HydrophobicContact CG2-CD1 3.77Å; I250-L254 HydrophobicContact CG2-CG 4.39Å; I250-L254 WeakPolarHBondContact O-CB 3.43Å; I250-L254 WeakPolarHBondContact O-CG 3.29Å; I250-L254 PolarHBondContact O-N 3.28Å; F251-L254 PolarHBondContact O-N 3.22Å; L254-F257 PolarHBondContact O-N 3.27Å; L254-I258 WeakPolarHBondContact O-CG1 3.41Å; L254-I258 PolarHBondContact O-N 3.08Å |
| 255 | A | 94.7 | Very high | 91.4 | Very high | 1 Ų | 1 | 62.6 Ų | 62.6 | 1% | 0.008 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -64.5 | -44.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | L184 A224 F251 F257 I258 F259 | L184-A255 HydrophobicContact CD1-CB 4.11Å; A224-A255 HydrophobicContact CB-CB 4.01Å; F251-A255 HydrophobicContact CE1-CB 4.22Å; F251-A255 HydrophobicContact CZ-CB 4.17Å; F251-A255 VanDerWaalsContact O-CB 3.27Å; F251-A255 WeakPolarHBondContact O-CB 3.45Å; F251-A255 PolarHBondContact O-N 2.86Å; A255-F257 PolarHBondContact O-N 2.88Å; A255-I258 PolarHBondContact O-N 3.21Å; A255-F259 WeakPolarHBondContact O-CB 3.11Å; A255-F259 PolarHBondContact O-N 2.98Å |
| 256 | S | 92.6 | Very high | 91 | Very high | 48 Ų | 48 | 56.8 Ų | 56.8 | 34% | 0.336 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64 | -39.1 | 175.7 | -58.2 | 0 | 0 | 0 | 0 | 112.1 | I252 F259 L260 | I252-S256 WeakPolarHBondContact O-CB 3.46Å; I252-S256 PolarHBondContact O-N 3.15Å; I252-S256 PolarHBondContact O-OG 3.22Å; S256-F259 PolarHBondContact O-N 2.81Å; S256-L260 WeakPolarHBondContact O-CB 3.36Å; S256-L260 PolarHBondContact O-N 2.88Å |
| 257 | F | 92.1 | Very high | 90.6 | Very high | 121 Ų | 121 | 58.9 Ų | 58.9 | 53% | 0.531 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -64.4 | -45.7 | 174.8 | 178.1 | -111.5 | 0 | 0 | 0 | 111.8 | L253 L254 A255 F259 L260 N261 | L253-F257 VanDerWaalsContact O-CB 3.24Å; L253-F257 WeakPolarHBondContact O-CB 3.45Å; L253-F257 PolarHBondContact O-N 2.76Å; L254-F257 PolarHBondContact O-N 3.27Å; A255-F257 PolarHBondContact O-N 2.88Å; F257-F259 VanDerWaalsContact C-N 3.33Å; F257-F259 PolarHBondContact O-N 3.39Å; F257-L260 PolarHBondContact O-N 3.37Å; F257-N261 WeakPolarHBondContact CD1-ND2 3.28Å; F257-N261 WeakPolarHBondContact CE1-ND2 3.39Å; F257-N261 WeakPolarHBondContact CE2-ND2 3.32Å; F257-N261 WeakPolarHBondContact CZ-ND2 3.25Å; F257-N261 WeakPolarHBondContact O-CB 3.17Å; F257-N261 PolarHBondContact O-N 3.31Å; F257-N261 PolarHBondContact O-ND2 2.89Å |
| 258 | I | 91 | Very high | 90.3 | Very high | 21 Ų | 21 | 62.9 Ų | 62.9 | 11% | 0.108 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61 | -42.1 | 174.2 | -68.8 | 170.8 | 0 | 0 | 0 | 110.9 | V180 L183 L184 L187 L254 A255 N261 M262 | V180-I258 HydrophobicContact CG1-CG2 3.71Å; L183-I258 HydrophobicContact CD2-CD1 4.43Å; L183-I258 HydrophobicContact CD2-CG1 4.38Å; L183-I258 HydrophobicContact CD2-CG2 4.42Å; L183-I258 HydrophobicContact CG-CD1 4.24Å; L184-I258 HydrophobicContact CB-CG2 4.16Å; L187-I258 HydrophobicContact CB-CD1 4.23Å; L187-I258 HydrophobicContact CD2-CD1 3.65Å; L187-I258 HydrophobicContact CG-CD1 4.48Å; L254-I258 WeakPolarHBondContact O-CG1 3.41Å; L254-I258 PolarHBondContact O-N 3.08Å; A255-I258 PolarHBondContact O-N 3.21Å; I258-N261 PolarHBondContact O-N 3.29Å; I258-M262 WeakPolarHBondContact O-CB 3.39Å; I258-M262 PolarHBondContact O-N 3.41Å |
| 259 | F | 87.2 | Confident | 89.8 | Confident | 123 Ų | 123 | 66.4 Ų | 66.4 | 54% | 0.539 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -67.6 | -40.7 | 179.3 | -170.5 | -90.9 | 0 | 0 | 0 | 112.7 | A255 S256 F257 M262 F263 | A255-F259 WeakPolarHBondContact O-CB 3.11Å; A255-F259 PolarHBondContact O-N 2.98Å; S256-F259 PolarHBondContact O-N 2.81Å; F257-F259 VanDerWaalsContact C-N 3.33Å; F257-F259 PolarHBondContact O-N 3.39Å; F259-M262 HydrophobicContact CD2-CE 3.81Å; F259-M262 HydrophobicContact CE2-CE 3.57Å; F259-M262 HydrophobicContact CZ-CE 4.09Å; F259-M262 WeakPolarHBondContact O-CB 3.45Å; F259-M262 PolarHBondContact O-N 3.07Å; F259-F263 PolarHBondContact O-N 3.14Å |
| 260 | L | 88.2 | Confident | 89.2 | Confident | 101 Ų | 101 | 65.9 Ų | 65.9 | 53% | 0.529 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 173.9 | -176 | 64.8 | 0 | 0 | 0 | 111 | S256 F257 M262 F263 V264 | S256-L260 WeakPolarHBondContact O-CB 3.36Å; S256-L260 PolarHBondContact O-N 2.88Å; F257-L260 PolarHBondContact O-N 3.37Å; L260-M262 VanDerWaalsContact C-N 3.3Å; L260-M262 PolarHBondContact O-N 2.99Å; L260-F263 PolarHBondContact O-N 3.41Å; L260-F263 VanDerWaalsContact O-N 3.16Å; L260-V264 WeakPolarHBondContact O-CG2 3.18Å; L260-V264 PolarHBondContact O-N 2.93Å |
| 261 | N | 85.5 | Confident | 88.8 | Confident | 69 Ų | 69 | 65 Ų | 65 | 37% | 0.369 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -65.7 | -32.5 | 176.1 | -66.8 | -18.2 | 0 | 0 | 0 | 112.2 | F257 I258 G265 | F257-N261 WeakPolarHBondContact CD1-ND2 3.28Å; F257-N261 WeakPolarHBondContact CE1-ND2 3.39Å; F257-N261 WeakPolarHBondContact CE2-ND2 3.32Å; F257-N261 WeakPolarHBondContact CZ-ND2 3.25Å; F257-N261 WeakPolarHBondContact O-CB 3.17Å; F257-N261 PolarHBondContact O-N 3.31Å; F257-N261 PolarHBondContact O-ND2 2.89Å; I258-N261 PolarHBondContact O-N 3.29Å; N261-G265 PolarHBondContact O-N 3.15Å |
| 262 | M | 86.5 | Confident | 88.5 | Confident | 28 Ų | 28 | 69.2 Ų | 69.2 | 14% | 0.138 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -60 | -50.8 | 169.5 | -173.2 | -173.3 | 69.6 | 0 | 0 | 110.4 | V177 V180 I258 F259 L260 G265 V266 | V177-M262 HydrophobicContact CG1-SD 4.05Å; V180-M262 HydrophobicContact CB-CB 4.07Å; V180-M262 HydrophobicContact CB-CG 3.84Å; V180-M262 HydrophobicContact CB-SD 4.46Å; V180-M262 HydrophobicContact CG1-CB 3.65Å; V180-M262 HydrophobicContact CG1-CG 3.99Å; V180-M262 HydrophobicContact CG2-CB 4.36Å; V180-M262 HydrophobicContact CG2-CG 4.12Å; I258-M262 WeakPolarHBondContact O-CB 3.39Å; I258-M262 PolarHBondContact O-N 3.41Å; F259-M262 HydrophobicContact CD2-CE 3.81Å; F259-M262 HydrophobicContact CE2-CE 3.57Å; F259-M262 HydrophobicContact CZ-CE 4.09Å; F259-M262 WeakPolarHBondContact O-CB 3.45Å; F259-M262 PolarHBondContact O-N 3.07Å; L260-M262 VanDerWaalsContact C-N 3.3Å; L260-M262 PolarHBondContact O-N 2.99Å; M262-G265 PolarHBondContact O-N 3.32Å; M262-V266 HydrophobicContact CG-CG2 4.36Å; M262-V266 VanDerWaalsContact O-CB 3.3Å; M262-V266 WeakPolarHBondContact O-CB 3.5Å; M262-V266 VanDerWaalsContact O-CG2 3.24Å; M262-V266 WeakPolarHBondContact O-CG2 3.41Å; M262-V266 PolarHBondContact O-N 3.03Å |
| 263 | F | 82.8 | Confident | 88 | Confident | 119 Ų | 119 | 73 Ų | 73 | 52% | 0.522 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61 | -49.2 | -179.6 | -179.4 | -99.8 | 0 | 0 | 0 | 111.3 | F259 L260 V266 M267 | F259-F263 PolarHBondContact O-N 3.14Å; L260-F263 PolarHBondContact O-N 3.41Å; L260-F263 VanDerWaalsContact O-N 3.16Å; F263-V266 PolarHBondContact O-N 3.23Å; F263-M267 HydrophobicContact CD1-CG 4.19Å; F263-M267 HydrophobicContact CD2-CG 4.32Å; F263-M267 HydrophobicContact CE1-CG 3.84Å; F263-M267 HydrophobicContact CE2-CG 3.97Å; F263-M267 HydrophobicContact CE2-SD 4.28Å; F263-M267 HydrophobicContact CG-CG 4.42Å; F263-M267 HydrophobicContact CZ-CG 3.72Å; F263-M267 HydrophobicContact CZ-SD 4.09Å; F263-M267 VanDerWaalsContact O-CB 3.26Å; F263-M267 WeakPolarHBondContact O-CB 3.38Å; F263-M267 WeakPolarHBondContact O-CG 3.23Å; F263-M267 PolarHBondContact O-N 3.23Å |
| 264 | V | 86.6 | Confident | 87.7 | Confident | 66 Ų | 66 | 71.2 Ų | 71.2 | 40% | 0.4 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -60.7 | -47.7 | 177.3 | 173.4 | 0 | 0 | 0 | 0 | 111.2 | L260 V266 M267 I268 | L260-V264 WeakPolarHBondContact O-CG2 3.18Å; L260-V264 PolarHBondContact O-N 2.93Å; V264-V266 PolarHBondContact O-N 3.09Å; V264-M267 PolarHBondContact O-N 3.13Å; V264-I268 HydrophobicContact CG1-CD1 3.65Å; V264-I268 HydrophobicContact CG1-CG1 4.36Å; V264-I268 WeakPolarHBondContact O-CB 3.13Å; V264-I268 VanDerWaalsContact O-CG1 3.28Å; V264-I268 WeakPolarHBondContact O-CG1 3.45Å; V264-I268 PolarHBondContact O-N 3.12Å |
| 265 | G | 85.5 | Confident | 87.5 | Confident | 25 Ų | 25 | 72.1 Ų | 72.1 | 26% | 0.258 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -63.6 | -41.9 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | N261 M262 I268 M269 | N261-G265 PolarHBondContact O-N 3.15Å; M262-G265 PolarHBondContact O-N 3.32Å; G265-I268 PolarHBondContact O-N 3.22Å; G265-M269 WeakPolarHBondContact O-CB 3.36Å; G265-M269 VanDerWaalsContact O-CE 3.26Å; G265-M269 WeakPolarHBondContact O-CE 3.38Å; G265-M269 WeakPolarHBondContact O-CG 3.48Å; G265-M269 PolarHBondContact O-N 3.49Å |
| 266 | V | 82.3 | Confident | 87.4 | Confident | 25 Ų | 25 | 76.5 Ų | 76.5 | 15% | 0.152 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -67.8 | -41 | 175.8 | 170.3 | 0 | 0 | 0 | 0 | 111.2 | V177 M262 F263 V264 H270 | V177-V266 HydrophobicContact CG2-CG2 3.98Å; M262-V266 HydrophobicContact CG-CG2 4.36Å; M262-V266 VanDerWaalsContact O-CB 3.3Å; M262-V266 WeakPolarHBondContact O-CB 3.5Å; M262-V266 VanDerWaalsContact O-CG2 3.24Å; M262-V266 WeakPolarHBondContact O-CG2 3.41Å; M262-V266 PolarHBondContact O-N 3.03Å; F263-V266 PolarHBondContact O-N 3.23Å; V264-V266 PolarHBondContact O-N 3.09Å; V266-H270 WeakPolarHBondContact O-CB 3.42Å; V266-H270 PolarHBondContact O-CD2 3.02Å; V266-H270 VanDerWaalsContact O-CD2 3.24Å; V266-H270 PolarHBondContact O-N 2.95Å |
| 267 | M | 84.3 | Confident | 87.4 | Confident | 93 Ų | 93 | 79.2 Ų | 79.2 | 46% | 0.458 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -63.7 | -42.1 | 174.9 | -75.8 | -65.9 | -62.4 | 0 | 0 | 112.2 | F263 V264 T271 | F263-M267 HydrophobicContact CD1-CG 4.19Å; F263-M267 HydrophobicContact CD2-CG 4.32Å; F263-M267 HydrophobicContact CE1-CG 3.84Å; F263-M267 HydrophobicContact CE2-CG 3.97Å; F263-M267 HydrophobicContact CE2-SD 4.28Å; F263-M267 HydrophobicContact CG-CG 4.42Å; F263-M267 HydrophobicContact CZ-CG 3.72Å; F263-M267 HydrophobicContact CZ-SD 4.09Å; F263-M267 VanDerWaalsContact O-CB 3.26Å; F263-M267 WeakPolarHBondContact O-CB 3.38Å; F263-M267 WeakPolarHBondContact O-CG 3.23Å; F263-M267 PolarHBondContact O-N 3.23Å; V264-M267 PolarHBondContact O-N 3.13Å; M267-T271 VanDerWaalsContact O-CB 3.3Å; M267-T271 WeakPolarHBondContact O-CB 3.44Å; M267-T271 PolarHBondContact O-N 2.91Å; M267-T271 PolarHBondContact O-OG1 2.93Å |
| 268 | I | 87.6 | Confident | 87.4 | Confident | 96 Ų | 96 | 79.7 Ų | 79.7 | 49% | 0.492 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -64.7 | -51.7 | 176.5 | -70.5 | 169.6 | 0 | 0 | 0 | 109.9 | V264 G265 H270 T271 E272 | V264-I268 HydrophobicContact CG1-CD1 3.65Å; V264-I268 HydrophobicContact CG1-CG1 4.36Å; V264-I268 WeakPolarHBondContact O-CB 3.13Å; V264-I268 VanDerWaalsContact O-CG1 3.28Å; V264-I268 WeakPolarHBondContact O-CG1 3.45Å; V264-I268 PolarHBondContact O-N 3.12Å; G265-I268 PolarHBondContact O-N 3.22Å; I268-H270 VanDerWaalsContact C-N 3.31Å; I268-H270 PolarHBondContact O-N 3.41Å; I268-T271 PolarHBondContact O-N 2.95Å; I268-E272 VanDerWaalsContact O-CB 3.31Å; I268-E272 WeakPolarHBondContact O-CB 3.34Å; I268-E272 PolarHBondContact O-N 3.32Å |
| 269 | M | 84.4 | Confident | 87.5 | Confident | 75 Ų | 75 | 83.4 Ų | 83.4 | 37% | 0.369 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -55.5 | -44.4 | 177.8 | -80.1 | -178.3 | -83.2 | 0 | 0 | 112.1 | T176 G265 E272 D273 | T176-M269 HydrophobicContact CG2-CE 4.02Å; T176-M269 HydrophobicContact CG2-SD 3.58Å; T176-M269 VanDerWaalsContact CG2-SD 3.58Å; G265-M269 WeakPolarHBondContact O-CB 3.36Å; G265-M269 VanDerWaalsContact O-CE 3.26Å; G265-M269 WeakPolarHBondContact O-CE 3.38Å; G265-M269 WeakPolarHBondContact O-CG 3.48Å; G265-M269 PolarHBondContact O-N 3.49Å; M269-E272 PolarHBondContact O-N 2.95Å; M269-D273 WeakPolarHBondContact O-CB 3.33Å; M269-D273 PolarHBondContact O-N 3.3Å |
| 270 | H | 82.8 | Confident | 87.8 | Confident | 78 Ų | 78 | 84.6 Ų | 84.6 | 36% | 0.361 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -66.2 | -37.5 | 176.3 | -83.7 | -55 | 0 | 0 | 0 | 113.8 | T173 V266 I268 S274 | T173-H270 VanDerWaalsContact CG2-NE2 3.26Å; T173-H270 WeakPolarHBondContact CG2-NE2 3.34Å; V266-H270 WeakPolarHBondContact O-CB 3.42Å; V266-H270 PolarHBondContact O-CD2 3.02Å; V266-H270 VanDerWaalsContact O-CD2 3.24Å; V266-H270 PolarHBondContact O-N 2.95Å; I268-H270 VanDerWaalsContact C-N 3.31Å; I268-H270 PolarHBondContact O-N 3.41Å; H270-S274 VanDerWaalsContact O-CB 3.25Å; H270-S274 WeakPolarHBondContact O-CB 3.1Å; H270-S274 PolarHBondContact O-N 3.45Å; H270-S274 PolarHBondContact O-OG 3.38Å |
| 271 | T | 87.1 | Confident | 88.1 | Confident | 72 Ų | 72 | 84.5 Ų | 84.5 | 44% | 0.442 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -67.6 | -46.1 | 176.9 | -58.1 | 0 | 0 | 0 | 0 | 110.5 | M267 I268 S274 I275 | M267-T271 VanDerWaalsContact O-CB 3.3Å; M267-T271 WeakPolarHBondContact O-CB 3.44Å; M267-T271 PolarHBondContact O-N 2.91Å; M267-T271 PolarHBondContact O-OG1 2.93Å; I268-T271 PolarHBondContact O-N 2.95Å; T271-S274 WeakPolarHBondContact O-CB 3.37Å; T271-S274 PolarHBondContact O-N 3.33Å; T271-I275 HydrophobicContact CG2-CD1 3.84Å; T271-I275 VanDerWaalsContact O-CG1 3.29Å; T271-I275 WeakPolarHBondContact O-CG1 3.39Å; T271-I275 PolarHBondContact O-N 3.47Å |
| 272 | E | 88.9 | Confident | 88.5 | Confident | 88 Ų | 88 | 83.9 Ų | 83.9 | 41% | 0.411 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -63.7 | -46.8 | 179.1 | -167.5 | -170.9 | 160.6 | 0 | 0 | 111.9 | I268 M269 S274 I275 K276 | I268-E272 VanDerWaalsContact O-CB 3.31Å; I268-E272 WeakPolarHBondContact O-CB 3.34Å; I268-E272 PolarHBondContact O-N 3.32Å; M269-E272 PolarHBondContact O-N 2.95Å; E272-S274 VanDerWaalsContact C-N 3.27Å; E272-S274 PolarHBondContact O-N 2.74Å; E272-I275 PolarHBondContact O-N 3.5Å; E272-K276 HydrophobicContact CG-CD 4.17Å; E272-K276 WeakPolarHBondContact O-CB 3.24Å; E272-K276 WeakPolarHBondContact O-CG 3.23Å; E272-K276 PolarHBondContact O-N 3.18Å; E272-K276 WeakPolarHBondContact OE1-CE 3.18Å; E272-K276 IonicContact OE1-NZ 3.1Å; E272-K276 PolarHBondContact OE1-NZ 2.99Å |
| 273 | D | 87.4 | Confident | 88.7 | Confident | 102 Ų | 102 | 88 Ų | 88 | 55% | 0.545 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -61.4 | -36.3 | 174 | -90.4 | -17.4 | 0 | 0 | 0 | 111.9 | M269 K277 | M269-D273 WeakPolarHBondContact O-CB 3.33Å; M269-D273 PolarHBondContact O-N 3.3Å; D273-K277 VanDerWaalsContact O-CB 3.22Å; D273-K277 WeakPolarHBondContact O-CB 3.32Å; D273-K277 PolarHBondContact O-N 2.93Å |
| 274 | S | 88.3 | Confident | 89.3 | Confident | 75 Ų | 75 | 87.1 Ų | 87.1 | 52% | 0.524 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -69.4 | -43.2 | 177.4 | -61.4 | 0 | 0 | 0 | 0 | 111.9 | H270 T271 E272 K277 F278 | H270-S274 VanDerWaalsContact O-CB 3.25Å; H270-S274 WeakPolarHBondContact O-CB 3.1Å; H270-S274 PolarHBondContact O-N 3.45Å; H270-S274 PolarHBondContact O-OG 3.38Å; T271-S274 WeakPolarHBondContact O-CB 3.37Å; T271-S274 PolarHBondContact O-N 3.33Å; E272-S274 VanDerWaalsContact C-N 3.27Å; E272-S274 PolarHBondContact O-N 2.74Å; S274-K277 PolarHBondContact O-N 3.39Å; S274-F278 WeakPolarHBondContact O-CB 3.13Å; S274-F278 PolarHBondContact O-N 2.94Å |
| 275 | I | 92 | Very high | 89.7 | Confident | 88 Ų | 88 | 90.5 Ų | 90.5 | 45% | 0.451 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -61.9 | -52.8 | 174.3 | -69.1 | 165 | 0 | 0 | 0 | 109.8 | T271 E272 K277 F278 E279 | T271-I275 HydrophobicContact CG2-CD1 3.84Å; T271-I275 VanDerWaalsContact O-CG1 3.29Å; T271-I275 WeakPolarHBondContact O-CG1 3.39Å; T271-I275 PolarHBondContact O-N 3.47Å; E272-I275 PolarHBondContact O-N 3.5Å; I275-K277 PolarHBondContact O-N 2.85Å; I275-K277 VanDerWaalsContact O-N 3.14Å; I275-F278 WeakPolarHBondContact O-CB 3.44Å; I275-F278 PolarHBondContact O-N 3.49Å; I275-E279 HydrophobicContact CG2-CG 4.39Å; I275-E279 WeakPolarHBondContact O-CG 3.34Å; I275-E279 PolarHBondContact O-N 3.38Å |
| 276 | K | 92.9 | Very high | 90 | Very high | 93 Ų | 93 | 97.1 Ų | 97.1 | 40% | 0.404 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -59 | -27.9 | 176.7 | -75.1 | 172.8 | 170.3 | 172.2 | 0 | 113.2 | E272 R280 | E272-K276 HydrophobicContact CG-CD 4.17Å; E272-K276 WeakPolarHBondContact O-CB 3.24Å; E272-K276 WeakPolarHBondContact O-CG 3.23Å; E272-K276 PolarHBondContact O-N 3.18Å; E272-K276 WeakPolarHBondContact OE1-CE 3.18Å; E272-K276 IonicContact OE1-NZ 3.1Å; E272-K276 PolarHBondContact OE1-NZ 2.99Å; K276-R280 WeakPolarHBondContact O-CG 3.42Å; K276-R280 PolarHBondContact O-NE 2.83Å |
| 277 | K | 91.6 | Very high | 90.1 | Very high | 105 Ų | 105 | 101.4 Ų | 101.4 | 46% | 0.457 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -75.9 | -45.8 | 173.2 | -176.3 | 175.2 | 177.2 | -71.5 | 0 | 111.3 | D273 S274 I275 R280 E281 | D273-K277 VanDerWaalsContact O-CB 3.22Å; D273-K277 WeakPolarHBondContact O-CB 3.32Å; D273-K277 PolarHBondContact O-N 2.93Å; S274-K277 PolarHBondContact O-N 3.39Å; I275-K277 PolarHBondContact O-N 2.85Å; I275-K277 VanDerWaalsContact O-N 3.14Å; K277-R280 PolarHBondContact O-N 2.88Å; K277-E281 WeakPolarHBondContact CE-OE1 3.08Å; K277-E281 IonicContact NZ-OE1 3.17Å; K277-E281 PolarHBondContact NZ-OE1 3.45Å; K277-E281 IonicContact NZ-OE2 3.47Å; K277-E281 PolarHBondContact NZ-OE2 3.34Å; K277-E281 WeakPolarHBondContact O-CG 2.9Å; K277-E281 PolarHBondContact O-N 3.38Å |
| 278 | F | 93.4 | Very high | 90.6 | Very high | 132 Ų | 132 | 101.6 Ų | 101.6 | 58% | 0.579 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -60.7 | -45.4 | 177.8 | 179.1 | -104.6 | 0 | 0 | 0 | 112.2 | S274 I275 R280 E281 L282 | S274-F278 WeakPolarHBondContact O-CB 3.13Å; S274-F278 PolarHBondContact O-N 2.94Å; I275-F278 WeakPolarHBondContact O-CB 3.44Å; I275-F278 PolarHBondContact O-N 3.49Å; F278-R280 VanDerWaalsContact C-N 3.34Å; F278-R280 PolarHBondContact O-N 3.43Å; F278-E281 PolarHBondContact O-N 3.41Å; F278-L282 HydrophobicContact CE1-CD1 3.96Å; F278-L282 HydrophobicContact CZ-CD1 4.04Å; F278-L282 WeakPolarHBondContact O-CB 3.46Å; F278-L282 PolarHBondContact O-N 2.89Å |
| 279 | E | 92.1 | Very high | 90.7 | Very high | 98 Ų | 98 | 100.7 Ų | 100.7 | 46% | 0.458 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -57.8 | -44 | 175.4 | -71.9 | 176 | 163.9 | 0 | 0 | 112.3 | I275 L282 M283 | I275-E279 HydrophobicContact CG2-CG 4.39Å; I275-E279 WeakPolarHBondContact O-CG 3.34Å; I275-E279 PolarHBondContact O-N 3.38Å; E279-L282 PolarHBondContact O-N 3.16Å; E279-M283 WeakPolarHBondContact O-CB 3.35Å; E279-M283 VanDerWaalsContact O-CG 3.3Å; E279-M283 WeakPolarHBondContact O-CG 3.42Å; E279-M283 PolarHBondContact O-N 3.41Å |
| 280 | R | 93.9 | Very high | 90.9 | Very high | 148 Ų | 148 | 102.3 Ų | 102.3 | 56% | 0.558 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65 | -40.9 | 176.7 | -78 | 179.4 | -70 | 162.3 | -4.1 | 112.6 | K276 K277 F278 L282 M283 L284 | K276-R280 WeakPolarHBondContact O-CG 3.42Å; K276-R280 PolarHBondContact O-NE 2.83Å; K277-R280 PolarHBondContact O-N 2.88Å; F278-R280 VanDerWaalsContact C-N 3.34Å; F278-R280 PolarHBondContact O-N 3.43Å; R280-L282 VanDerWaalsContact C-N 3.34Å; R280-M283 PolarHBondContact O-N 3.31Å; R280-L284 VanDerWaalsContact O-CG 3.27Å; R280-L284 WeakPolarHBondContact O-CG 3.43Å; R280-L284 PolarHBondContact O-N 2.85Å |
| 281 | E | 93.7 | Very high | 91 | Very high | 100 Ų | 100 | 104.1 Ų | 104.1 | 47% | 0.467 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.2 | -42.2 | 176 | -73.8 | 174.5 | 171.7 | 0 | 0 | 110.8 | K277 F278 L284 E285 | K277-E281 WeakPolarHBondContact CE-OE1 3.08Å; K277-E281 IonicContact NZ-OE1 3.17Å; K277-E281 PolarHBondContact NZ-OE1 3.45Å; K277-E281 IonicContact NZ-OE2 3.47Å; K277-E281 PolarHBondContact NZ-OE2 3.34Å; K277-E281 WeakPolarHBondContact O-CG 2.9Å; K277-E281 PolarHBondContact O-N 3.38Å; F278-E281 PolarHBondContact O-N 3.41Å; E281-L284 PolarHBondContact O-N 3.03Å; E281-E285 PolarHBondContact O-N 2.91Å |
| 282 | L | 94.1 | Very high | 91.2 | Very high | 55 Ų | 55 | 102.5 Ų | 102.5 | 29% | 0.288 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.2 | -38.7 | 177.7 | -166.9 | 154 | 0 | 0 | 0 | 112.8 | F278 E279 R280 E285 R286 | F278-L282 HydrophobicContact CE1-CD1 3.96Å; F278-L282 HydrophobicContact CZ-CD1 4.04Å; F278-L282 WeakPolarHBondContact O-CB 3.46Å; F278-L282 PolarHBondContact O-N 2.89Å; E279-L282 PolarHBondContact O-N 3.16Å; R280-L282 VanDerWaalsContact C-N 3.34Å; L282-E285 PolarHBondContact O-N 3.13Å; L282-R286 HydrophobicContact CD2-CG 4.43Å; L282-R286 VanDerWaalsContact CD2-CZ 3.47Å; L282-R286 WeakPolarHBondContact O-CG 3.39Å; L282-R286 PolarHBondContact O-N 3.45Å; L282-R286 VanDerWaalsContact O-N 3.08Å |
| 283 | M | 92.1 | Very high | 91 | Very high | 114 Ų | 114 | 103.8 Ų | 103.8 | 56% | 0.562 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.9 | -41.8 | 172.4 | -74.2 | 179.6 | -173.5 | 0 | 0 | 112 | E279 R280 R286 Q287 | E279-M283 WeakPolarHBondContact O-CB 3.35Å; E279-M283 VanDerWaalsContact O-CG 3.3Å; E279-M283 WeakPolarHBondContact O-CG 3.42Å; E279-M283 PolarHBondContact O-N 3.41Å; R280-M283 PolarHBondContact O-N 3.31Å; M283-R286 PolarHBondContact O-N 3.33Å; M283-Q287 WeakPolarHBondContact O-CG 3.12Å; M283-Q287 PolarHBondContact O-N 3.45Å |
| 284 | L | 95.1 | Very high | 90.6 | Very high | 102 Ų | 102 | 105.8 Ų | 105.8 | 53% | 0.534 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.7 | -42 | 176.9 | -72.4 | 168.7 | 0 | 0 | 0 | 111.7 | R280 E281 R286 Q287 V288 | R280-L284 VanDerWaalsContact O-CG 3.27Å; R280-L284 WeakPolarHBondContact O-CG 3.43Å; R280-L284 PolarHBondContact O-N 2.85Å; E281-L284 PolarHBondContact O-N 3.03Å; L284-R286 PolarHBondContact O-N 3.2Å; L284-Q287 PolarHBondContact O-N 2.94Å; L284-V288 WeakPolarHBondContact O-CG2 3.31Å; L284-V288 PolarHBondContact O-N 2.94Å |
| 285 | E | 93.5 | Very high | 90.4 | Very high | 136 Ų | 136 | 108.3 Ų | 108.3 | 64% | 0.636 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.4 | -42.6 | 176.6 | -173.7 | 172.8 | -162 | 0 | 0 | 111.9 | E281 L282 V288 T289 | E281-E285 PolarHBondContact O-N 2.91Å; L282-E285 PolarHBondContact O-N 3.13Å; E285-V288 PolarHBondContact O-N 3.08Å; E285-T289 WeakPolarHBondContact O-CB 3.27Å; E285-T289 PolarHBondContact O-N 2.96Å; E285-T289 PolarHBondContact O-OG1 3.07Å |
| 286 | R | 91.7 | Very high | 90.3 | Very high | 165 Ų | 165 | 107.4 Ų | 107.4 | 62% | 0.623 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -60.8 | -46.2 | 172.3 | -73.3 | 178.7 | 178.2 | 174.9 | 2.1 | 112 | L282 M283 L284 V288 T289 L290 | L282-R286 HydrophobicContact CD2-CG 4.43Å; L282-R286 VanDerWaalsContact CD2-CZ 3.47Å; L282-R286 WeakPolarHBondContact O-CG 3.39Å; L282-R286 PolarHBondContact O-N 3.45Å; L282-R286 VanDerWaalsContact O-N 3.08Å; M283-R286 PolarHBondContact O-N 3.33Å; L284-R286 PolarHBondContact O-N 3.2Å; R286-V288 PolarHBondContact O-N 3.03Å; R286-T289 PolarHBondContact O-N 3.11Å; R286-L290 WeakPolarHBondContact O-CG 3.26Å; R286-L290 PolarHBondContact O-N 2.87Å |
| 287 | Q | 86.1 | Confident | 89.8 | Confident | 115 Ų | 115 | 107.4 Ų | 107.4 | 54% | 0.537 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.7 | -40.5 | 178.1 | -76.5 | -173.9 | -10.9 | 0 | 0 | 112.7 | M283 L284 M291 | M283-Q287 WeakPolarHBondContact O-CG 3.12Å; M283-Q287 PolarHBondContact O-N 3.45Å; L284-Q287 PolarHBondContact O-N 2.94Å; Q287-M291 HydrophobicContact CB-CE 4.36Å; Q287-M291 WeakPolarHBondContact O-CB 3.42Å; Q287-M291 WeakPolarHBondContact O-CE 3.48Å; Q287-M291 WeakPolarHBondContact O-CG 3.47Å; Q287-M291 PolarHBondContact O-N 3.47Å |
| 288 | V | 93.6 | Very high | 89.4 | Confident | 96 Ų | 96 | 106.9 Ų | 106.9 | 58% | 0.582 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -63.6 | -42 | 175.3 | 170.5 | 0 | 0 | 0 | 0 | 111.1 | L284 E285 R286 M291 G292 | L284-V288 WeakPolarHBondContact O-CG2 3.31Å; L284-V288 PolarHBondContact O-N 2.94Å; E285-V288 PolarHBondContact O-N 3.08Å; R286-V288 PolarHBondContact O-N 3.03Å; V288-M291 HydrophobicContact CG2-CE 4.49Å; V288-M291 PolarHBondContact O-N 3.48Å; V288-G292 PolarHBondContact O-N 2.67Å |
| 289 | T | 89.4 | Confident | 88.9 | Confident | 78 Ų | 78 | 106.3 Ų | 106.3 | 48% | 0.479 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.4 | -51.8 | 176.9 | -54.7 | 0 | 0 | 0 | 0 | 111.3 | E285 R286 M291 G292 E293 | E285-T289 WeakPolarHBondContact O-CB 3.27Å; E285-T289 PolarHBondContact O-N 2.96Å; E285-T289 PolarHBondContact O-OG1 3.07Å; R286-T289 PolarHBondContact O-N 3.11Å; T289-M291 VanDerWaalsContact C-N 3.35Å; T289-M291 PolarHBondContact O-N 3.08Å; T289-G292 WeakPolarHBondContact O-CA 3.46Å; T289-G292 PolarHBondContact O-N 3.46Å; T289-G292 VanDerWaalsContact O-N 3.09Å; T289-E293 PolarHBondContact O-N 3.33Å |
| 290 | L | 88.8 | Confident | 88.6 | Confident | 108 Ų | 108 | 109.8 Ų | 109.8 | 57% | 0.565 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62 | -38.4 | 178.9 | -70.3 | 170.5 | 0 | 0 | 0 | 112.8 | R286 G292 E293 K294 | R286-L290 WeakPolarHBondContact O-CG 3.26Å; R286-L290 PolarHBondContact O-N 2.87Å; L290-G292 VanDerWaalsContact C-N 3.34Å; L290-E293 PolarHBondContact O-N 3.21Å; L290-K294 VanDerWaalsContact O-CB 3.29Å; L290-K294 WeakPolarHBondContact O-CB 3.22Å; L290-K294 PolarHBondContact O-N 3.26Å |
| 291 | M | 84.4 | Confident | 87.7 | Confident | 116 Ų | 116 | 107.1 Ų | 107.1 | 57% | 0.571 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.2 | -39.4 | 173.6 | -78.2 | -172.6 | -74.7 | 0 | 0 | 111.9 | Q287 V288 T289 Q295 | Q287-M291 HydrophobicContact CB-CE 4.36Å; Q287-M291 WeakPolarHBondContact O-CB 3.42Å; Q287-M291 WeakPolarHBondContact O-CE 3.48Å; Q287-M291 WeakPolarHBondContact O-CG 3.47Å; Q287-M291 PolarHBondContact O-N 3.47Å; V288-M291 HydrophobicContact CG2-CE 4.49Å; V288-M291 PolarHBondContact O-N 3.48Å; T289-M291 VanDerWaalsContact C-N 3.35Å; T289-M291 PolarHBondContact O-N 3.08Å; M291-Q295 VanDerWaalsContact O-CB 3.31Å; M291-Q295 WeakPolarHBondContact O-CB 3.22Å; M291-Q295 PolarHBondContact O-N 3.46Å |
| 292 | G | 91.2 | Very high | 86.9 | Confident | 38 Ų | 38 | 108.1 Ų | 108.1 | 39% | 0.392 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.7 | -50.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | V288 T289 L290 Q295 V296 | V288-G292 PolarHBondContact O-N 2.67Å; T289-G292 WeakPolarHBondContact O-CA 3.46Å; T289-G292 PolarHBondContact O-N 3.46Å; T289-G292 VanDerWaalsContact O-N 3.09Å; L290-G292 VanDerWaalsContact C-N 3.34Å; G292-Q295 PolarHBondContact O-N 2.9Å; G292-V296 WeakPolarHBondContact O-CG2 3.09Å; G292-V296 PolarHBondContact O-N 3.44Å; G292-V296 VanDerWaalsContact O-N 3.07Å |
| 293 | E | 85.4 | Confident | 86.5 | Confident | 115 Ų | 115 | 112.1 Ų | 112.1 | 54% | 0.537 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.9 | -46.7 | 177.9 | -68 | -174.7 | 142.7 | 0 | 0 | 112.1 | T289 L290 Q295 V296 I297 | T289-E293 PolarHBondContact O-N 3.33Å; L290-E293 PolarHBondContact O-N 3.21Å; E293-Q295 VanDerWaalsContact C-N 3.26Å; E293-Q295 PolarHBondContact O-N 3.29Å; E293-V296 PolarHBondContact O-N 3.49Å; E293-I297 WeakPolarHBondContact O-CG1 3.37Å; E293-I297 PolarHBondContact O-N 3.38Å |
| 294 | K | 79.4 | Confident | 85.9 | Confident | 144 Ų | 144 | 112.8 Ų | 112.8 | 63% | 0.626 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -58 | -38.9 | 176 | -176.2 | 168.4 | -176.2 | 164.2 | 0 | 112.1 | L290 I297 L298 | L290-K294 VanDerWaalsContact O-CB 3.29Å; L290-K294 WeakPolarHBondContact O-CB 3.22Å; L290-K294 PolarHBondContact O-N 3.26Å; K294-I297 PolarHBondContact O-N 2.96Å; K294-L298 HydrophobicContact CG-CD1 4.21Å; K294-L298 WeakPolarHBondContact O-CG 3.3Å; K294-L298 PolarHBondContact O-N 2.92Å |
| 295 | Q | 83.3 | Confident | 84.9 | Confident | 129 Ų | 129 | 112.1 Ų | 112.1 | 60% | 0.603 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -71.1 | -34.7 | 179.2 | -170.1 | 157.3 | -16.7 | 0 | 0 | 112.6 | M291 G292 E293 Q299 | M291-Q295 VanDerWaalsContact O-CB 3.31Å; M291-Q295 WeakPolarHBondContact O-CB 3.22Å; M291-Q295 PolarHBondContact O-N 3.46Å; G292-Q295 PolarHBondContact O-N 2.9Å; E293-Q295 VanDerWaalsContact C-N 3.26Å; E293-Q295 PolarHBondContact O-N 3.29Å; Q295-Q299 WeakPolarHBondContact O-CG 3.31Å; Q295-Q299 PolarHBondContact O-N 2.9Å; Q295-Q299 VanDerWaalsContact O-N 3.08Å |
| 296 | V | 90.1 | Very high | 84.1 | Confident | 68 Ų | 68 | 108 Ų | 108 | 41% | 0.412 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66 | -41.2 | 171.4 | 172.6 | 0 | 0 | 0 | 0 | 111.4 | G292 E293 Q299 R300 | G292-V296 WeakPolarHBondContact O-CG2 3.09Å; G292-V296 PolarHBondContact O-N 3.44Å; G292-V296 VanDerWaalsContact O-N 3.07Å; E293-V296 PolarHBondContact O-N 3.49Å; V296-Q299 PolarHBondContact O-N 3.15Å; V296-R300 WeakPolarHBondContact O-CG 3.21Å; V296-R300 PolarHBondContact O-N 3.07Å; V296-R300 VanDerWaalsContact O-N 3.14Å |
| 297 | I | 83 | Confident | 83.6 | Confident | 93 Ų | 93 | 109.2 Ų | 109.2 | 48% | 0.477 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63 | -47.4 | 177 | -66.8 | 164.8 | 0 | 0 | 0 | 110.7 | E293 K294 Q299 R300 Q301 | E293-I297 WeakPolarHBondContact O-CG1 3.37Å; E293-I297 PolarHBondContact O-N 3.38Å; K294-I297 PolarHBondContact O-N 2.96Å; I297-Q299 VanDerWaalsContact C-N 3.32Å; I297-Q299 PolarHBondContact O-N 3.05Å; I297-R300 PolarHBondContact O-N 3.04Å; I297-Q301 PolarHBondContact O-N 3.12Å |
| 298 | L | 82.4 | Confident | 83 | Confident | 95 Ų | 95 | 109 Ų | 109 | 50% | 0.497 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.7 | -38.4 | 177.4 | -76.6 | 169.1 | 0 | 0 | 0 | 112.7 | K294 Q301 Q302 | K294-L298 HydrophobicContact CG-CD1 4.21Å; K294-L298 WeakPolarHBondContact O-CG 3.3Å; K294-L298 PolarHBondContact O-N 2.92Å; L298-Q301 PolarHBondContact O-N 2.83Å; L298-Q302 WeakPolarHBondContact O-CB 3.49Å; L298-Q302 PolarHBondContact O-N 3.49Å |
| 299 | Q | 84.2 | Confident | 81.8 | Confident | 119 Ų | 119 | 109.8 Ų | 109.8 | 56% | 0.556 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -62.5 | -45.7 | 174.4 | -79.3 | -176.2 | -30.4 | 0 | 0 | 112 | Q295 V296 I297 Q301 Q302 E303 | Q295-Q299 WeakPolarHBondContact O-CG 3.31Å; Q295-Q299 PolarHBondContact O-N 2.9Å; Q295-Q299 VanDerWaalsContact O-N 3.08Å; V296-Q299 PolarHBondContact O-N 3.15Å; I297-Q299 VanDerWaalsContact C-N 3.32Å; I297-Q299 PolarHBondContact O-N 3.05Å; Q299-Q301 PolarHBondContact O-N 2.88Å; Q299-Q302 PolarHBondContact O-N 2.91Å; Q299-E303 WeakPolarHBondContact O-CG 3.27Å; Q299-E303 PolarHBondContact O-N 2.94Å |
| 300 | R | 84.7 | Confident | 80.9 | Confident | 172 Ų | 172 | 111.5 Ų | 111.5 | 65% | 0.649 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -60.7 | -45.1 | 177 | -70.6 | 179.3 | -178.2 | 179.2 | 2.5 | 112.2 | V296 I297 Q302 E303 E304 | V296-R300 WeakPolarHBondContact O-CG 3.21Å; V296-R300 PolarHBondContact O-N 3.07Å; V296-R300 VanDerWaalsContact O-N 3.14Å; I297-R300 PolarHBondContact O-N 3.04Å; R300-Q302 VanDerWaalsContact C-N 3.32Å; R300-Q302 PolarHBondContact O-N 3.31Å; R300-E303 PolarHBondContact O-N 3.33Å; R300-E304 WeakPolarHBondContact O-CB 3.42Å; R300-E304 PolarHBondContact O-N 3.44Å |
| 301 | Q | 75.7 | Confident | 80.1 | Confident | 92 Ų | 92 | 111.7 Ų | 111.7 | 43% | 0.43 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -60.6 | -42 | 176.9 | -72.4 | -179.7 | -38 | 0 | 0 | 111.8 | I297 L298 Q299 E304 I305 | I297-Q301 PolarHBondContact O-N 3.12Å; L298-Q301 PolarHBondContact O-N 2.83Å; Q299-Q301 PolarHBondContact O-N 2.88Å; Q301-E304 PolarHBondContact O-N 3.2Å; Q301-I305 WeakPolarHBondContact O-CB 3.4Å; Q301-I305 WeakPolarHBondContact O-CD1 3.42Å; Q301-I305 VanDerWaalsContact O-CG1 3.26Å; Q301-I305 WeakPolarHBondContact O-CG1 3.25Å; Q301-I305 PolarHBondContact O-N 3.01Å |
| 302 | Q | 76.5 | Confident | 78.9 | Confident | 120 Ų | 120 | 113.6 Ų | 113.6 | 56% | 0.561 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -65.6 | -39.8 | 178 | -170.5 | 66.8 | 14.2 | 0 | 0 | 112.4 | L298 Q299 R300 S306 | L298-Q302 WeakPolarHBondContact O-CB 3.49Å; L298-Q302 PolarHBondContact O-N 3.49Å; Q299-Q302 PolarHBondContact O-N 2.91Å; R300-Q302 VanDerWaalsContact C-N 3.32Å; R300-Q302 PolarHBondContact O-N 3.31Å; Q302-S306 WeakPolarHBondContact O-CB 3.47Å; Q302-S306 PolarHBondContact O-N 2.96Å; Q302-S306 PolarHBondContact O-OG 3.07Å |
| 303 | E | 85.9 | Confident | 77.4 | Confident | 139 Ų | 139 | 118.8 Ų | 118.8 | 65% | 0.65 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -64 | -42.4 | 174.4 | -74 | 179.8 | 179.8 | 0 | 0 | 112 | Q299 R300 S306 R307 | Q299-E303 WeakPolarHBondContact O-CG 3.27Å; Q299-E303 PolarHBondContact O-N 2.94Å; R300-E303 PolarHBondContact O-N 3.33Å; E303-S306 PolarHBondContact O-N 2.99Å; E303-R307 PolarHBondContact O-N 3.28Å |
| 304 | E | 79.3 | Confident | 76.1 | Confident | 129 Ų | 129 | 119.8 Ų | 119.8 | 60% | 0.603 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -68.3 | -44.8 | -179.6 | -169.1 | 160.3 | -138.9 | 0 | 0 | 112.1 | R300 Q301 S306 R307 L308 | R300-E304 WeakPolarHBondContact O-CB 3.42Å; R300-E304 PolarHBondContact O-N 3.44Å; Q301-E304 PolarHBondContact O-N 3.2Å; E304-S306 VanDerWaalsContact C-N 3.31Å; E304-S306 PolarHBondContact O-N 3.47Å; E304-R307 WeakPolarHBondContact O-CB 3.5Å; E304-R307 PolarHBondContact O-N 2.89Å; E304-L308 WeakPolarHBondContact O-CG 3.48Å; E304-L308 PolarHBondContact O-N 3.28Å |
| 305 | I | 74.2 | Confident | 74.9 | Confident | 88 Ų | 88 | 114.9 Ų | 114.9 | 45% | 0.451 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -58.4 | -43.2 | 171.9 | -71.8 | 166.9 | 0 | 0 | 0 | 111 | Q301 R307 L308 M309 | Q301-I305 WeakPolarHBondContact O-CB 3.4Å; Q301-I305 WeakPolarHBondContact O-CD1 3.42Å; Q301-I305 VanDerWaalsContact O-CG1 3.26Å; Q301-I305 WeakPolarHBondContact O-CG1 3.25Å; Q301-I305 PolarHBondContact O-N 3.01Å; I305-R307 VanDerWaalsContact C-N 3.35Å; I305-R307 PolarHBondContact O-N 3.05Å; I305-L308 PolarHBondContact O-N 3.48Å; I305-M309 HydrophobicContact CG2-CE 3.88Å; I305-M309 PolarHBondContact O-N 3.46Å |
| 306 | S | 76.5 | Confident | 73.3 | Confident | 50 Ų | 50 | 116.8 Ų | 116.8 | 35% | 0.35 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -64.7 | -38.3 | 177.8 | -57.6 | 0 | 0 | 0 | 0 | 112 | Q302 E303 E304 H310 | Q302-S306 WeakPolarHBondContact O-CB 3.47Å; Q302-S306 PolarHBondContact O-N 2.96Å; Q302-S306 PolarHBondContact O-OG 3.07Å; E303-S306 PolarHBondContact O-N 2.99Å; E304-S306 VanDerWaalsContact C-N 3.31Å; E304-S306 PolarHBondContact O-N 3.47Å; S306-H310 PolarHBondContact O-N 2.91Å; S306-H310 VanDerWaalsContact O-N 3.15Å |
| 307 | R | 82.3 | Confident | 71.2 | Confident | 190 Ų | 190 | 117.5 Ų | 117.5 | 72% | 0.717 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -61.5 | -47.5 | 173 | -107.1 | -172.6 | 176 | -164.2 | 0.8 | 112.3 | E303 E304 I305 H310 I311 | E303-R307 PolarHBondContact O-N 3.28Å; E304-R307 WeakPolarHBondContact O-CB 3.5Å; E304-R307 PolarHBondContact O-N 2.89Å; I305-R307 VanDerWaalsContact C-N 3.35Å; I305-R307 PolarHBondContact O-N 3.05Å; R307-H310 PolarHBondContact O-N 3.17Å; R307-I311 WeakPolarHBondContact O-CG1 3.31Å; R307-I311 PolarHBondContact O-N 3.11Å |
| 308 | L | 73.4 | Confident | 69.6 | Low | 111 Ų | 111 | 120.7 Ų | 120.7 | 58% | 0.581 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -63.5 | -42.4 | -178.6 | -68.9 | 171.4 | 0 | 0 | 0 | 111.4 | E304 I305 H310 I311 Q312 | E304-L308 WeakPolarHBondContact O-CG 3.48Å; E304-L308 PolarHBondContact O-N 3.28Å; I305-L308 PolarHBondContact O-N 3.48Å; L308-H310 PolarHBondContact O-N 3.33Å; L308-I311 PolarHBondContact O-N 3.47Å; L308-Q312 PolarHBondContact O-N 3.39Å |
| 309 | M | 68.6 | Low | 68.5 | Low | 112 Ų | 112 | 119.9 Ų | 119.9 | 55% | 0.552 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -58.8 | -44.1 | 172.8 | -77.4 | -170.2 | -70.4 | 0 | 0 | 112.4 | I305 I311 Q312 E313 | I305-M309 HydrophobicContact CG2-CE 3.88Å; I305-M309 PolarHBondContact O-N 3.46Å; M309-I311 VanDerWaalsContact C-N 3.34Å; M309-I311 PolarHBondContact O-N 3.47Å; M309-Q312 PolarHBondContact O-N 2.91Å; M309-E313 PolarHBondContact O-N 3.31Å |
| 310 | H | 69.6 | Low | 66.9 | Low | 113 Ų | 113 | 121.6 Ų | 121.6 | 52% | 0.523 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -69.1 | -29.1 | 179.4 | -115.1 | -30.3 | 0 | 0 | 0 | 113.8 | S306 R307 L308 E313 N314 | S306-H310 PolarHBondContact O-N 2.91Å; S306-H310 VanDerWaalsContact O-N 3.15Å; R307-H310 PolarHBondContact O-N 3.17Å; L308-H310 PolarHBondContact O-N 3.33Å; H310-E313 IonicContact CE1-OE2 3.98Å; H310-E313 PolarHBondContact CE1-OE2 2.8Å; H310-E313 IonicContact ND1-OE2 2.84Å; H310-E313 PolarHBondContact ND1-OE2 2.81Å; H310-N314 PolarHBondContact O-N 2.86Å; H310-N314 PolarHBondContact O-ND2 3.45Å |
| 311 | I | 72.5 | Confident | 65.4 | Low | 112 Ų | 112 | 117 Ų | 117 | 57% | 0.574 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -68.7 | -40.4 | 172.3 | -69.5 | 165.4 | 0 | 0 | 0 | 110 | R307 L308 M309 E313 N314 A315 | R307-I311 WeakPolarHBondContact O-CG1 3.31Å; R307-I311 PolarHBondContact O-N 3.11Å; L308-I311 PolarHBondContact O-N 3.47Å; M309-I311 VanDerWaalsContact C-N 3.34Å; M309-I311 PolarHBondContact O-N 3.47Å; I311-E313 VanDerWaalsContact C-N 3.34Å; I311-E313 PolarHBondContact O-N 2.92Å; I311-N314 PolarHBondContact O-N 2.94Å; I311-A315 WeakPolarHBondContact O-CB 3.27Å; I311-A315 PolarHBondContact O-N 3.48Å |
| 312 | Q | 59.3 | Low | 64.4 | Low | 157 Ų | 157 | 117.4 Ų | 117.4 | 73% | 0.734 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -68.4 | -29.8 | 177 | -172.9 | 171.3 | -5.7 | 0 | 0 | 113.1 | L308 M309 | L308-Q312 PolarHBondContact O-N 3.39Å; M309-Q312 PolarHBondContact O-N 2.91Å |
| 313 | E | 59.8 | Low | 63.5 | Low | 147 Ų | 147 | 116.9 Ų | 116.9 | 69% | 0.687 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -78.9 | -31 | 176.9 | -168.7 | 177.9 | -145.3 | 0 | 0 | 113.2 | M309 H310 I311 | M309-E313 PolarHBondContact O-N 3.31Å; H310-E313 IonicContact CE1-OE2 3.98Å; H310-E313 PolarHBondContact CE1-OE2 2.8Å; H310-E313 IonicContact ND1-OE2 2.84Å; H310-E313 PolarHBondContact ND1-OE2 2.81Å; I311-E313 VanDerWaalsContact C-N 3.34Å; I311-E313 PolarHBondContact O-N 2.92Å |
| 314 | N | 57.4 | Low | 62 | Low | 135 Ų | 135 | 112.2 Ų | 112.2 | 72% | 0.722 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -87 | -12.2 | 179.1 | -76.5 | -62.6 | 0 | 0 | 0 | 114.2 | H310 I311 | H310-N314 PolarHBondContact O-N 2.86Å; H310-N314 PolarHBondContact O-ND2 3.45Å; I311-N314 PolarHBondContact O-N 2.94Å |
| 315 | A | 53.6 | Low | 61 | Low | 42 Ų | 42 | 111.3 Ų | 111.3 | 35% | 0.347 | 57% | 0.569 | S | S | . | * | S | Bend | trans | -98 | 117 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110 | I311 C317 | I311-A315 WeakPolarHBondContact O-CB 3.27Å; I311-A315 PolarHBondContact O-N 3.48Å; A315-C317 HydrophobicContact CB-CB 4.4Å; A315-C317 PolarHBondContact O-N 2.82Å |
| 316 | D | 50.4 | Low | 60.1 | Low | 169 Ų | 169 | 111.5 Ų | 111.5 | 90% | 0.904 | 57% | 0.571 | S | S | * | * | trans | -72 | 62.7 | 166.8 | -171.1 | 28 | 0 | 0 | 0 | 109.9 | K318 | D316-K318 PolarHBondContact O-N 2.94Š| ||
| 317 | C | 46.3 | Very low | 59.2 | Low | 83 Ų | 83 | 116 Ų | 116 | 56% | 0.561 | 59% | 0.585 | S | S | * | * | trans | -82.5 | 102.2 | -177.3 | -90.1 | 0 | 0 | 0 | 0 | 109.5 | A315 S319 | A315-C317 HydrophobicContact CB-CB 4.4Å; A315-C317 PolarHBondContact O-N 2.82Å; C317-S319 PolarHBondContact O-N 3.39Å | ||
| 318 | K | 49.7 | Very low | 57.8 | Low | 160 Ų | 160 | 112.7 Ų | 112.7 | 70% | 0.696 | 58% | 0.575 | S | S | * | * | trans | -42.2 | 135.1 | 151.7 | -63.9 | 178.5 | 179.6 | 179.3 | 0 | 109.2 | D316 F320 | D316-K318 PolarHBondContact O-N 2.94Å; K318-F320 PolarHBondContact O-N 2.87Å | ||
| 319 | S | 58 | Low | 57.1 | Low | 78 Ų | 78 | 114.6 Ų | 114.6 | 55% | 0.545 | 58% | 0.579 | S | S | . | * | trans | -12.5 | 120.1 | -175.2 | -174 | 0 | 0 | 0 | 0 | 115.3 | C317 S321 E322 | C317-S319 PolarHBondContact O-N 3.39Å; S319-S321 PolarHBondContact O-N 3.47Å; S319-E322 WeakPolarHBondContact O-CB 3.32Å; S319-E322 PolarHBondContact O-N 2.7Å | ||
| 320 | F | 51.6 | Low | 56.5 | Low | 155 Ų | 155 | 114.8 Ų | 114.8 | 68% | 0.68 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -42.5 | -37.1 | 175 | -178.4 | -97.8 | 0 | 0 | 0 | 113.2 | K318 E322 L323 V324 | K318-F320 PolarHBondContact O-N 2.87Å; F320-E322 PolarHBondContact O-N 3.4Å; F320-L323 PolarHBondContact O-N 2.94Å; F320-V324 HydrophobicContact CD1-CG2 4.21Å; F320-V324 HydrophobicContact CE1-CG2 3.9Å; F320-V324 HydrophobicContact CZ-CG2 4.2Å; F320-V324 WeakPolarHBondContact O-CG2 3.27Å; F320-V324 PolarHBondContact O-N 3.27Å |
| 321 | S | 53.4 | Low | 55.7 | Low | 76 Ų | 76 | 112.4 Ų | 112.4 | 53% | 0.531 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -60.1 | -37.4 | 176.6 | -163.4 | 0 | 0 | 0 | 0 | 114.5 | S319 L323 E325 | S319-S321 PolarHBondContact O-N 3.47Å; S321-L323 VanDerWaalsContact C-N 3.32Å; S321-E325 VanDerWaalsContact O-CB 3.32Å; S321-E325 WeakPolarHBondContact O-CB 3.16Å; S321-E325 PolarHBondContact O-N 2.91Å; S321-E325 VanDerWaalsContact O-N 3.09Å |
| 322 | E | 53.9 | Low | 55 | Low | 100 Ų | 100 | 114.2 Ų | 114.2 | 47% | 0.467 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -72.9 | -27.4 | -177.7 | -167.5 | 176.5 | -157.4 | 0 | 0 | 111.7 | S319 F320 N326 | S319-E322 WeakPolarHBondContact O-CB 3.32Å; S319-E322 PolarHBondContact O-N 2.7Å; F320-E322 PolarHBondContact O-N 3.4Å; E322-N326 PolarHBondContact O-N 2.97Å; E322-N326 PolarHBondContact O-ND2 3.02Å |
| 323 | L | 57.4 | Low | 54.7 | Low | 109 Ų | 109 | 116.4 Ų | 116.4 | 57% | 0.571 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -81.5 | -41.9 | 179.6 | -147.7 | 153.6 | 0 | 0 | 0 | 111.1 | F320 S321 E325 N326 F327 | F320-L323 PolarHBondContact O-N 2.94Å; S321-L323 VanDerWaalsContact C-N 3.32Å; L323-E325 VanDerWaalsContact C-N 3.31Å; L323-E325 PolarHBondContact O-N 2.97Å; L323-N326 PolarHBondContact O-N 2.98Å; L323-F327 PolarHBondContact O-N 3.29Å; L323-F327 VanDerWaalsContact O-N 3.16Å |
| 324 | V | 54.9 | Low | 54.1 | Low | 41 Ų | 41 | 115.6 Ų | 115.6 | 25% | 0.248 | 60% | 0.598 | C | S | . | * | H | α-helix | trans | -59.5 | -41.2 | 170.2 | 173.8 | 0 | 0 | 0 | 0 | 111.2 | F320 F327 K328 | F320-V324 HydrophobicContact CD1-CG2 4.21Å; F320-V324 HydrophobicContact CE1-CG2 3.9Å; F320-V324 HydrophobicContact CZ-CG2 4.2Å; F320-V324 WeakPolarHBondContact O-CG2 3.27Å; F320-V324 PolarHBondContact O-N 3.27Å; V324-F327 PolarHBondContact O-N 3.09Å; V324-K328 WeakPolarHBondContact O-CB 3.4Å; V324-K328 PolarHBondContact O-N 3.22Å |
| 325 | E | 58.8 | Low | 53.5 | Low | 109 Ų | 109 | 113 Ų | 113 | 51% | 0.509 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -70.1 | -33 | -177.1 | -168.7 | 171.2 | -172 | 0 | 0 | 113.8 | S321 L323 | S321-E325 VanDerWaalsContact O-CB 3.32Å; S321-E325 WeakPolarHBondContact O-CB 3.16Å; S321-E325 PolarHBondContact O-N 2.91Å; S321-E325 VanDerWaalsContact O-N 3.09Å; L323-E325 VanDerWaalsContact C-N 3.31Å; L323-E325 PolarHBondContact O-N 2.97Å |
| 326 | N | 54.8 | Low | 53.2 | Low | 93 Ų | 93 | 117.3 Ų | 117.3 | 50% | 0.497 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -73.9 | -36.8 | 172.6 | -75.7 | -52.8 | 0 | 0 | 0 | 112.3 | E322 L323 K328 K329 T330 | E322-N326 PolarHBondContact O-N 2.97Å; E322-N326 PolarHBondContact O-ND2 3.02Å; L323-N326 PolarHBondContact O-N 2.98Å; N326-K328 VanDerWaalsContact C-N 3.34Å; N326-K328 PolarHBondContact O-N 3.32Å; N326-K329 PolarHBondContact O-N 3.37Å; N326-T330 PolarHBondContact O-OG1 3.46Å |
| 327 | F | 57.3 | Low | 53 | Low | 144 Ų | 144 | 112.7 Ų | 112.7 | 63% | 0.632 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -62.5 | -42.2 | 173.8 | -165.5 | -100.9 | 0 | 0 | 0 | 111.4 | L323 V324 K329 T330 L331 | L323-F327 PolarHBondContact O-N 3.29Å; L323-F327 VanDerWaalsContact O-N 3.16Å; V324-F327 PolarHBondContact O-N 3.09Å; F327-K329 PolarHBondContact O-N 2.93Å; F327-T330 PolarHBondContact O-N 3.37Å; F327-L331 HydrophobicContact CD1-CD1 4.46Å; F327-L331 HydrophobicContact CE1-CD1 4.46Å |
| 328 | K | 53.3 | Low | 53.2 | Low | 120 Ų | 120 | 114.6 Ų | 114.6 | 52% | 0.522 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -61.5 | -23.1 | 178 | -159.4 | 170.9 | -169.2 | 171 | 0 | 114.3 | V324 N326 T330 M337 | V324-K328 WeakPolarHBondContact O-CB 3.4Å; V324-K328 PolarHBondContact O-N 3.22Å; N326-K328 VanDerWaalsContact C-N 3.34Å; N326-K328 PolarHBondContact O-N 3.32Å; K328-T330 VanDerWaalsContact C-N 3.35Å; K328-M337 HydrophobicContact CD-CE 3.95Å; K328-M337 HydrophobicContact CD-SD 4.47Å; K328-M337 HydrophobicContact CG-CE 3.96Å; K328-M337 HydrophobicContact CG-SD 4.16Å |
| 329 | K | 58.7 | Low | 53.1 | Low | 152 Ų | 152 | 112.9 Ų | 112.9 | 66% | 0.661 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.2 | -7.3 | 175.6 | -73 | 170.7 | -175.7 | 161.4 | 0 | 114.3 | N326 F327 | N326-K329 PolarHBondContact O-N 3.37Å; F327-K329 PolarHBondContact O-N 2.93Å |
| 330 | T | 55.3 | Low | 52.7 | Low | 116 Ų | 116 | 113.2 Ų | 113.2 | 71% | 0.712 | 59% | 0.585 | S | S | * | * | S | Bend | trans | -103.7 | -6.2 | -174.6 | -48.3 | 0 | 0 | 0 | 0 | 113.2 | N326 F327 K328 | N326-T330 PolarHBondContact O-OG1 3.46Å; F327-T330 PolarHBondContact O-N 3.37Å; K328-T330 VanDerWaalsContact C-N 3.35Å |
| 331 | L | 53.9 | Low | 52.7 | Low | 63 Ų | 63 | 112.7 Ų | 112.7 | 33% | 0.33 | 59% | 0.589 | S | S | . | * | trans | -88.9 | 142.1 | -176.7 | -70.7 | 160.8 | 0 | 0 | 0 | 112.4 | F327 D335 M337 | F327-L331 HydrophobicContact CD1-CD1 4.46Å; F327-L331 HydrophobicContact CE1-CD1 4.46Å; L331-D335 HydrophobicContact CD2-CB 3.74Å; L331-M337 HydrophobicContact CD1-CG 4.32Å; L331-M337 HydrophobicContact CD1-SD 4.37Å | ||
| 332 | H | 57.6 | Low | 52.8 | Low | 149 Ų | 149 | 116.7 Ų | 116.7 | 69% | 0.69 | 60% | 0.597 | S | S | * | * | trans | -89.4 | 159.4 | 170.3 | -85 | -88.7 | 0 | 0 | 0 | 111 | T334 D335 | H332-T334 PolarHBondContact O-N 3.43Å; H332-D335 PolarHBondContact N-OD2 3.28Å; H332-D335 PolarHBondContact O-N 3.4Å; H332-D335 VanDerWaalsContact O-N 3.11Å | ||
| 333 | H | 52.3 | Low | 52.8 | Low | 204 Ų | 204 | 114.2 Ų | 114.2 | 94% | 0.944 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.3 | 6.8 | -172 | -66.3 | -55.4 | 0 | 0 | 0 | 117 | ||
| 334 | T | 46.5 | Very low | 52.6 | Low | 129 Ų | 129 | 112.9 Ų | 112.9 | 79% | 0.791 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.6 | -1.7 | 178.9 | 36.7 | 0 | 0 | 0 | 0 | 113.9 | H332 | H332-T334 PolarHBondContact O-N 3.43Š|
| 335 | D | 46.2 | Very low | 53.1 | Low | 81 Ų | 81 | 113.4 Ų | 113.4 | 43% | 0.433 | 60% | 0.6 | S | S | . | * | S | Bend | trans | -84.3 | 128.7 | -179 | -60.9 | -41.3 | 0 | 0 | 0 | 111 | L331 H332 M337 | L331-D335 HydrophobicContact CD2-CB 3.74Å; H332-D335 PolarHBondContact N-OD2 3.28Å; H332-D335 PolarHBondContact O-N 3.4Å; H332-D335 VanDerWaalsContact O-N 3.11Å; D335-M337 PolarHBondContact O-N 2.98Å |
| 336 | P | 46.6 | Very low | 53.3 | Low | 133 Ų | 133 | 115.2 Ų | 115.2 | 86% | 0.864 | 61% | 0.613 | S | S | * | * | trans | -70.5 | 114.9 | 179.1 | 27.5 | -33 | 0 | 0 | 0 | 111.1 | ||||
| 337 | M | 46.3 | Very low | 53.8 | Low | 72 Ų | 72 | 114.9 Ų | 114.9 | 36% | 0.355 | 62% | 0.616 | S | S | . | * | P | Polyproline II helix | trans | -98.8 | 135.2 | -179.9 | -173.9 | -177.2 | 176.6 | 0 | 0 | 111.6 | K328 L331 D335 L339 | K328-M337 HydrophobicContact CD-CE 3.95Å; K328-M337 HydrophobicContact CD-SD 4.47Å; K328-M337 HydrophobicContact CG-CE 3.96Å; K328-M337 HydrophobicContact CG-SD 4.16Å; L331-M337 HydrophobicContact CD1-CG 4.32Å; L331-M337 HydrophobicContact CD1-SD 4.37Å; D335-M337 PolarHBondContact O-N 2.98Å; M337-L339 PolarHBondContact O-N 3.02Å |
| 338 | V | 50.3 | Low | 54.4 | Low | 123 Ų | 123 | 111.6 Ų | 111.6 | 75% | 0.745 | 60% | 0.601 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 119.8 | 164.5 | -178.8 | 0 | 0 | 0 | 0 | 108.5 | ||
| 339 | L | 46.8 | Very low | 55.3 | Low | 124 Ų | 124 | 108.8 Ų | 108.8 | 65% | 0.649 | 59% | 0.592 | S | S | * | * | P | Polyproline II helix | trans | -91 | 131.6 | 177 | -73.3 | 163.7 | 0 | 0 | 0 | 110.3 | M337 D341 | M337-L339 PolarHBondContact O-N 3.02Å; L339-D341 PolarHBondContact O-N 3.18Å |
| 340 | D | 50.4 | Low | 55.9 | Low | 85 Ų | 85 | 106.9 Ų | 106.9 | 46% | 0.455 | 59% | 0.589 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64.6 | -16.6 | -176.6 | -83 | -44.9 | 0 | 0 | 0 | 115.3 | T344 | D340-T344 PolarHBondContact O-OG1 3.43Š|
| 341 | D | 52.7 | Low | 56.7 | Low | 144 Ų | 144 | 106.6 Ų | 106.6 | 77% | 0.77 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.3 | 12 | -153.3 | -143.6 | 22 | 0 | 0 | 0 | 115.5 | L339 | L339-D341 PolarHBondContact O-N 3.18Š|
| 342 | F | 53.6 | Low | 57.9 | Low | 160 Ų | 160 | 109.4 Ų | 109.4 | 70% | 0.702 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -135.5 | -57.6 | 170.2 | -97.1 | -91.8 | 0 | 0 | 0 | 112.9 | T344 F348 | F342-T344 PolarHBondContact O-N 3.02Å; F342-F348 HydrophobicContact CD1-CD2 4.39Å; F342-F348 HydrophobicContact CD1-CE2 4.3Å; F342-F348 WeakPolarHBondContact O-CB 3.35Å; F342-F348 WeakPolarHBondContact O-CD1 3.41Å; F342-F348 WeakPolarHBondContact O-CG 3.21Å |
| 343 | G | 55.1 | Low | 58.9 | Low | 48 Ų | 48 | 107.7 Ų | 107.7 | 50% | 0.495 | 58% | 0.579 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -73.8 | -18.5 | -167.9 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 344 | T | 53.6 | Low | 60 | Low | 81 Ų | 81 | 101.3 Ų | 101.3 | 50% | 0.497 | 56% | 0.558 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -114.7 | -4.7 | -166.4 | 44 | 0 | 0 | 0 | 0 | 114.4 | D340 F342 | D340-T344 PolarHBondContact O-OG1 3.43Å; F342-T344 PolarHBondContact O-N 3.02Å |
| 345 | S | 65.9 | Low | 61.6 | Low | 51 Ų | 51 | 98.1 Ų | 98.1 | 36% | 0.357 | 54% | 0.538 | S | S | . | . | trans | -72.2 | 135.1 | 177.5 | 79.6 | 0 | 0 | 0 | 0 | 110.8 | P347 F348 I349 | S345-P347 VanDerWaalsContact C-CD 3.47Å; S345-P347 VanDerWaalsContact C-N 3.3Å; S345-F348 PolarHBondContact O-N 3.43Å; S345-F348 WeakPolarHBondContact OG-CB 3.23Å; S345-F348 PolarHBondContact OG-N 3.36Å; S345-I349 WeakPolarHBondContact O-CG1 3.14Å; S345-I349 PolarHBondContact O-N 3.46Å | ||
| 346 | L | 61.3 | Low | 63.4 | Low | 147 Ų | 147 | 97.2 Ų | 97.2 | 77% | 0.77 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -49.5 | -44 | 176.4 | -112.8 | 150.7 | 0 | 0 | 0 | 113 | I349 D350 | L346-I349 PolarHBondContact O-N 3.03Å; L346-D350 WeakPolarHBondContact O-CB 3.41Å; L346-D350 PolarHBondContact O-N 3.22Å |
| 347 | P | 65.5 | Low | 65.1 | Low | 86 Ų | 86 | 96.5 Ų | 96.5 | 56% | 0.558 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -64.3 | -37.4 | 174.5 | -23.2 | 35.2 | 0 | 0 | 0 | 114.1 | S345 D350 I351 | S345-P347 VanDerWaalsContact C-CD 3.47Å; S345-P347 VanDerWaalsContact C-N 3.3Å; P347-D350 PolarHBondContact O-N 3.23Å; P347-I351 WeakPolarHBondContact O-CB 3.49Å; P347-I351 WeakPolarHBondContact O-CD1 3.28Å; P347-I351 VanDerWaalsContact O-CG1 3.23Å; P347-I351 WeakPolarHBondContact O-CG1 3.14Å; P347-I351 PolarHBondContact O-N 2.87Å |
| 348 | F | 70.8 | Confident | 66.9 | Low | 75 Ų | 75 | 101 Ų | 101 | 33% | 0.329 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -68.9 | -40.5 | 175.6 | 179.9 | -90.9 | 0 | 0 | 0 | 111.5 | F342 S345 D350 I351 Y352 | F342-F348 HydrophobicContact CD1-CD2 4.39Å; F342-F348 HydrophobicContact CD1-CE2 4.3Å; F342-F348 WeakPolarHBondContact O-CB 3.35Å; F342-F348 WeakPolarHBondContact O-CD1 3.41Å; F342-F348 WeakPolarHBondContact O-CG 3.21Å; S345-F348 PolarHBondContact O-N 3.43Å; S345-F348 WeakPolarHBondContact OG-CB 3.23Å; S345-F348 PolarHBondContact OG-N 3.36Å; F348-D350 VanDerWaalsContact C-N 3.31Å; F348-D350 PolarHBondContact O-N 3.43Å; F348-I351 PolarHBondContact O-N 2.89Å; F348-Y352 HydrophobicContact CE1-CG 4.47Å; F348-Y352 WeakPolarHBondContact O-CB 3.48Å; F348-Y352 PolarHBondContact O-N 2.95Å |
| 349 | I | 72.2 | Confident | 68.7 | Low | 62 Ų | 62 | 100.2 Ų | 100.2 | 32% | 0.318 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.7 | -42.2 | 176.1 | -68.3 | 169.2 | 0 | 0 | 0 | 110.4 | S345 L346 Y352 F353 | S345-I349 WeakPolarHBondContact O-CG1 3.14Å; S345-I349 PolarHBondContact O-N 3.46Å; L346-I349 PolarHBondContact O-N 3.03Å; I349-Y352 PolarHBondContact O-N 3.42Å; I349-F353 HydrophobicContact CG2-CD2 3.59Å; I349-F353 HydrophobicContact CG2-CE2 3.36Å; I349-F353 HydrophobicContact CG2-CZ 4.4Å; I349-F353 VanDerWaalsContact O-CD2 3.27Å; I349-F353 WeakPolarHBondContact O-CD2 3.44Å; I349-F353 PolarHBondContact O-N 2.8Å |
| 350 | D | 70.3 | Confident | 70.7 | Confident | 112 Ų | 112 | 98.6 Ų | 98.6 | 60% | 0.599 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -67.4 | -41.2 | 178.1 | -152.3 | 31 | 0 | 0 | 0 | 112.1 | L346 P347 F348 S354 | L346-D350 WeakPolarHBondContact O-CB 3.41Å; L346-D350 PolarHBondContact O-N 3.22Å; P347-D350 PolarHBondContact O-N 3.23Å; F348-D350 VanDerWaalsContact C-N 3.31Å; F348-D350 PolarHBondContact O-N 3.43Å; D350-S354 VanDerWaalsContact O-CB 3.29Å; D350-S354 WeakPolarHBondContact O-CB 3.31Å; D350-S354 PolarHBondContact O-N 2.81Å; D350-S354 PolarHBondContact O-OG 3.19Å |
| 351 | I | 72.6 | Confident | 72.5 | Confident | 109 Ų | 109 | 98 Ų | 98 | 56% | 0.559 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.1 | -39.4 | 171.9 | -70.4 | 166 | 0 | 0 | 0 | 111.3 | P347 F348 S354 T355 | P347-I351 WeakPolarHBondContact O-CB 3.49Å; P347-I351 WeakPolarHBondContact O-CD1 3.28Å; P347-I351 VanDerWaalsContact O-CG1 3.23Å; P347-I351 WeakPolarHBondContact O-CG1 3.14Å; P347-I351 PolarHBondContact O-N 2.87Å; F348-I351 PolarHBondContact O-N 2.89Å; I351-S354 PolarHBondContact O-N 2.85Å; I351-T355 WeakPolarHBondContact O-CB 3.48Å; I351-T355 PolarHBondContact O-N 2.96Å; I351-T355 PolarHBondContact O-OG1 2.8Å |
| 352 | Y | 78.6 | Confident | 74.2 | Confident | 123 Ų | 123 | 94 Ų | 94 | 48% | 0.482 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -69.2 | -45.5 | -179.3 | -178.6 | -109.1 | 0 | 0 | 0 | 111.2 | F348 I349 T355 L356 | F348-Y352 HydrophobicContact CE1-CG 4.47Å; F348-Y352 WeakPolarHBondContact O-CB 3.48Å; F348-Y352 PolarHBondContact O-N 2.95Å; I349-Y352 PolarHBondContact O-N 3.42Å; Y352-T355 WeakPolarHBondContact O-CB 2.97Å; Y352-T355 PolarHBondContact O-N 3.33Å; Y352-L356 HydrophobicContact CD1-CD1 3.96Å; Y352-L356 HydrophobicContact CE1-CD1 3.51Å; Y352-L356 HydrophobicContact CE1-CG 4.25Å; Y352-L356 WeakPolarHBondContact O-CG 3.38Å; Y352-L356 PolarHBondContact O-N 3.03Å |
| 353 | F | 78.4 | Confident | 76 | Confident | 112 Ų | 112 | 90.4 Ų | 90.4 | 49% | 0.491 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.9 | -42.1 | 171.8 | -75.6 | -50.6 | 0 | 0 | 0 | 112.1 | I349 T355 L356 D357 | I349-F353 HydrophobicContact CG2-CD2 3.59Å; I349-F353 HydrophobicContact CG2-CE2 3.36Å; I349-F353 HydrophobicContact CG2-CZ 4.4Å; I349-F353 VanDerWaalsContact O-CD2 3.27Å; I349-F353 WeakPolarHBondContact O-CD2 3.44Å; I349-F353 PolarHBondContact O-N 2.8Å; F353-T355 PolarHBondContact O-N 2.91Å; F353-L356 HydrophobicContact CD1-CD1 4.25Å; F353-L356 PolarHBondContact O-N 3.29Å; F353-L356 VanDerWaalsContact O-N 3.17Å; F353-D357 PolarHBondContact O-N 3.47Å |
| 354 | S | 75.4 | Confident | 77.5 | Confident | 71 Ų | 71 | 93.4 Ų | 93.4 | 50% | 0.497 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.4 | -34.4 | 173.5 | -60.6 | 0 | 0 | 0 | 0 | 112.5 | D350 I351 Y358 | D350-S354 VanDerWaalsContact O-CB 3.29Å; D350-S354 WeakPolarHBondContact O-CB 3.31Å; D350-S354 PolarHBondContact O-N 2.81Å; D350-S354 PolarHBondContact O-OG 3.19Å; I351-S354 PolarHBondContact O-N 2.85Å; S354-Y358 WeakPolarHBondContact O-CB 3.45Å; S354-Y358 PolarHBondContact O-N 2.89Å; S354-Y358 VanDerWaalsContact O-N 3.14Å |
| 355 | T | 80.4 | Confident | 79.2 | Confident | 62 Ų | 62 | 95.6 Ų | 95.6 | 38% | 0.38 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -72.7 | -38.6 | 176 | -57.3 | 0 | 0 | 0 | 0 | 111.5 | I351 Y352 F353 Y358 Q359 | I351-T355 WeakPolarHBondContact O-CB 3.48Å; I351-T355 PolarHBondContact O-N 2.96Å; I351-T355 PolarHBondContact O-OG1 2.8Å; Y352-T355 WeakPolarHBondContact O-CB 2.97Å; Y352-T355 PolarHBondContact O-N 3.33Å; F353-T355 PolarHBondContact O-N 2.91Å; T355-Y358 PolarHBondContact O-N 3.34Å; T355-Q359 WeakPolarHBondContact O-CG 3.39Å; T355-Q359 PolarHBondContact O-N 3.34Å |
| 356 | L | 83.7 | Confident | 80.3 | Confident | 62 Ų | 62 | 99 Ų | 99 | 33% | 0.325 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.8 | -46.7 | 173.8 | -74.3 | 174 | 0 | 0 | 0 | 111.7 | Y352 F353 Y358 Q359 D360 | Y352-L356 HydrophobicContact CD1-CD1 3.96Å; Y352-L356 HydrophobicContact CE1-CD1 3.51Å; Y352-L356 HydrophobicContact CE1-CG 4.25Å; Y352-L356 WeakPolarHBondContact O-CG 3.38Å; Y352-L356 PolarHBondContact O-N 3.03Å; F353-L356 HydrophobicContact CD1-CD1 4.25Å; F353-L356 PolarHBondContact O-N 3.29Å; F353-L356 VanDerWaalsContact O-N 3.17Å; L356-Y358 VanDerWaalsContact C-N 3.25Å; L356-Y358 PolarHBondContact O-N 3.44Å; L356-Q359 WeakPolarHBondContact O-CB 3.44Å; L356-Q359 PolarHBondContact O-N 3.18Å; L356-Q359 VanDerWaalsContact O-N 3.07Å; L356-D360 PolarHBondContact O-N 3.02Å |
| 357 | D | 83.6 | Confident | 81.6 | Confident | 118 Ų | 118 | 96.1 Ų | 96.1 | 63% | 0.631 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -57.5 | -39 | 174.4 | -100.1 | 15.9 | 0 | 0 | 0 | 111.6 | F353 T361 | F353-D357 PolarHBondContact O-N 3.47Å; D357-T361 VanDerWaalsContact O-CB 3.31Å; D357-T361 WeakPolarHBondContact O-CB 3.48Å; D357-T361 PolarHBondContact O-N 3.02Å; D357-T361 PolarHBondContact O-OG1 3.35Å |
| 358 | Y | 84.6 | Confident | 82.6 | Confident | 166 Ų | 166 | 98 Ų | 98 | 65% | 0.651 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -68.3 | -39.3 | 174.8 | -175.5 | -92.9 | 0 | 0 | 0 | 112.7 | S354 T355 L356 T362 | S354-Y358 WeakPolarHBondContact O-CB 3.45Å; S354-Y358 PolarHBondContact O-N 2.89Å; S354-Y358 VanDerWaalsContact O-N 3.14Å; T355-Y358 PolarHBondContact O-N 3.34Å; L356-Y358 VanDerWaalsContact C-N 3.25Å; L356-Y358 PolarHBondContact O-N 3.44Å; Y358-T362 WeakPolarHBondContact O-CB 3.27Å; Y358-T362 PolarHBondContact O-N 2.93Å; Y358-T362 PolarHBondContact O-OG1 3.03Å |
| 359 | Q | 87.9 | Confident | 83.5 | Confident | 106 Ų | 106 | 98.9 Ų | 98.9 | 50% | 0.495 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.4 | -45.5 | 174.4 | -76.4 | 178.7 | 1 | 0 | 0 | 111.3 | T355 L356 T361 T362 V363 | T355-Q359 WeakPolarHBondContact O-CG 3.39Å; T355-Q359 PolarHBondContact O-N 3.34Å; L356-Q359 WeakPolarHBondContact O-CB 3.44Å; L356-Q359 PolarHBondContact O-N 3.18Å; L356-Q359 VanDerWaalsContact O-N 3.07Å; Q359-T361 PolarHBondContact O-N 2.75Å; Q359-T362 CarbonylContact O-C 3.58Å; Q359-T362 WeakPolarHBondContact O-CA 3.44Å; Q359-T362 WeakPolarHBondContact O-CB 3.44Å; Q359-T362 PolarHBondContact O-N 3.13Å; Q359-V363 WeakPolarHBondContact O-CG2 3.3Å; Q359-V363 PolarHBondContact O-N 3.48Å |
| 360 | D | 88.3 | Confident | 84.5 | Confident | 91 Ų | 91 | 104.1 Ų | 104.1 | 49% | 0.487 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.7 | -42.1 | 179.8 | -147.4 | 35.5 | 0 | 0 | 0 | 111.2 | L356 T362 V363 H364 | L356-D360 PolarHBondContact O-N 3.02Å; D360-T362 VanDerWaalsContact C-N 3.26Å; D360-T362 PolarHBondContact O-N 2.86Å; D360-V363 PolarHBondContact O-N 2.93Å; D360-H364 PolarHBondContact O-CD2 3.31Å; D360-H364 PolarHBondContact O-N 2.89Å |
| 361 | T | 87.3 | Confident | 85.4 | Confident | 71 Ų | 71 | 105.9 Ų | 105.9 | 44% | 0.436 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58.2 | -37.3 | 169.9 | -58.8 | 0 | 0 | 0 | 0 | 112.3 | D357 Q359 K365 | D357-T361 VanDerWaalsContact O-CB 3.31Å; D357-T361 WeakPolarHBondContact O-CB 3.48Å; D357-T361 PolarHBondContact O-N 3.02Å; D357-T361 PolarHBondContact O-OG1 3.35Å; Q359-T361 PolarHBondContact O-N 2.75Å; T361-K365 WeakPolarHBondContact O-CG 3.47Å; T361-K365 PolarHBondContact O-N 2.97Å |
| 362 | T | 89.1 | Confident | 86.2 | Confident | 60 Ų | 60 | 106.3 Ų | 106.3 | 37% | 0.368 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -73.1 | -40.2 | 178.5 | -58.1 | 0 | 0 | 0 | 0 | 111.4 | Y358 Q359 D360 K365 L366 | Y358-T362 WeakPolarHBondContact O-CB 3.27Å; Y358-T362 PolarHBondContact O-N 2.93Å; Y358-T362 PolarHBondContact O-OG1 3.03Å; Q359-T362 CarbonylContact O-C 3.58Å; Q359-T362 WeakPolarHBondContact O-CA 3.44Å; Q359-T362 WeakPolarHBondContact O-CB 3.44Å; Q359-T362 PolarHBondContact O-N 3.13Å; D360-T362 VanDerWaalsContact C-N 3.26Å; D360-T362 PolarHBondContact O-N 2.86Å; T362-K365 PolarHBondContact O-N 3.27Å; T362-L366 WeakPolarHBondContact O-CB 3.18Å; T362-L366 PolarHBondContact O-N 3.48Å |
| 363 | V | 92.2 | Very high | 86.8 | Confident | 86 Ų | 86 | 104.9 Ų | 104.9 | 52% | 0.521 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62 | -45 | 174.7 | 170.3 | 0 | 0 | 0 | 0 | 110.7 | Q359 D360 K365 L366 Q367 | Q359-V363 WeakPolarHBondContact O-CG2 3.3Å; Q359-V363 PolarHBondContact O-N 3.48Å; D360-V363 PolarHBondContact O-N 2.93Å; V363-K365 PolarHBondContact O-N 3.38Å; V363-L366 WeakPolarHBondContact O-CB 3.39Å; V363-L366 PolarHBondContact O-N 2.82Å; V363-L366 VanDerWaalsContact O-N 3.16Å; V363-Q367 WeakPolarHBondContact O-CB 3.26Å; V363-Q367 PolarHBondContact O-N 3.24Å |
| 364 | H | 86.6 | Confident | 87.3 | Confident | 111 Ų | 111 | 101.9 Ų | 101.9 | 51% | 0.514 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59 | -45 | 175.5 | -81.2 | -44.8 | 0 | 0 | 0 | 112.9 | D360 L366 Q367 E368 | D360-H364 PolarHBondContact O-CD2 3.31Å; D360-H364 PolarHBondContact O-N 2.89Å; H364-L366 VanDerWaalsContact C-N 3.33Å; H364-L366 PolarHBondContact O-N 2.88Å; H364-Q367 PolarHBondContact O-N 3.32Å; H364-E368 PolarHBondContact O-N 3.46Å |
| 365 | K | 87.8 | Confident | 87.9 | Confident | 127 Ų | 127 | 104.4 Ų | 104.4 | 55% | 0.552 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.6 | -38.4 | 174.3 | -74.8 | 175.7 | 178.3 | 178.2 | 0 | 112.8 | T361 T362 V363 Q367 E368 L369 | T361-K365 WeakPolarHBondContact O-CG 3.47Å; T361-K365 PolarHBondContact O-N 2.97Å; T362-K365 PolarHBondContact O-N 3.27Å; V363-K365 PolarHBondContact O-N 3.38Å; K365-Q367 VanDerWaalsContact C-N 3.32Å; K365-E368 PolarHBondContact O-N 2.82Å; K365-L369 WeakPolarHBondContact O-CB 3.17Å; K365-L369 PolarHBondContact O-N 3.19Å |
| 366 | L | 88.9 | Confident | 88.3 | Confident | 123 Ų | 123 | 105.1 Ų | 105.1 | 64% | 0.644 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.3 | -37.5 | 177 | -149.7 | 91.1 | 0 | 0 | 0 | 111.4 | T362 V363 H364 Y370 | T362-L366 WeakPolarHBondContact O-CB 3.18Å; T362-L366 PolarHBondContact O-N 3.48Å; V363-L366 WeakPolarHBondContact O-CB 3.39Å; V363-L366 PolarHBondContact O-N 2.82Å; V363-L366 VanDerWaalsContact O-N 3.16Å; H364-L366 VanDerWaalsContact C-N 3.33Å; H364-L366 PolarHBondContact O-N 2.88Å; L366-Y370 WeakPolarHBondContact O-CB 3.28Å; L366-Y370 PolarHBondContact O-N 3.01Å |
| 367 | Q | 88.7 | Confident | 88.4 | Confident | 85 Ų | 85 | 107 Ų | 107 | 40% | 0.397 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -69.6 | -40.2 | 177.1 | -167.2 | -175.2 | -5.4 | 0 | 0 | 111.7 | V363 H364 K365 Y370 Y371 | V363-Q367 WeakPolarHBondContact O-CB 3.26Å; V363-Q367 PolarHBondContact O-N 3.24Å; H364-Q367 PolarHBondContact O-N 3.32Å; K365-Q367 VanDerWaalsContact C-N 3.32Å; Q367-Y370 WeakPolarHBondContact O-CB 3.47Å; Q367-Y370 PolarHBondContact O-N 3.11Å; Q367-Y371 HydrophobicContact CG-CD2 4.18Å; Q367-Y371 HydrophobicContact CG-CE2 3.63Å; Q367-Y371 PolarHBondContact NE2-OH 3.25Å; Q367-Y371 WeakPolarHBondContact O-CD2 3.42Å; Q367-Y371 PolarHBondContact O-N 3.34Å |
| 368 | E | 87.4 | Confident | 88.4 | Confident | 127 Ų | 127 | 103 Ų | 103 | 59% | 0.593 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -59 | -50.8 | 172.4 | -173.6 | 171 | -148.1 | 0 | 0 | 111.2 | H364 K365 Y370 Y371 E372 | H364-E368 PolarHBondContact O-N 3.46Å; K365-E368 PolarHBondContact O-N 2.82Å; E368-Y370 VanDerWaalsContact C-N 3.27Å; E368-Y370 PolarHBondContact O-N 3.15Å; E368-Y371 PolarHBondContact O-N 3.12Å; E368-Y371 VanDerWaalsContact O-N 3.09Å; E368-E372 PolarHBondContact O-N 3.1Å |
| 369 | L | 90.6 | Very high | 88.3 | Confident | 92 Ų | 92 | 99 Ų | 99 | 48% | 0.482 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -55.7 | -38.4 | 172 | -94.6 | 153 | 0 | 0 | 0 | 113 | K365 E372 I373 | K365-L369 WeakPolarHBondContact O-CB 3.17Å; K365-L369 PolarHBondContact O-N 3.19Å; L369-E372 PolarHBondContact O-N 2.67Å; L369-I373 WeakPolarHBondContact O-CB 3.47Å; L369-I373 WeakPolarHBondContact O-CD1 3.49Å; L369-I373 VanDerWaalsContact O-CG1 3.24Å; L369-I373 WeakPolarHBondContact O-CG1 3.25Å; L369-I373 PolarHBondContact O-N 2.94Å |
| 370 | Y | 92.1 | Very high | 88.1 | Confident | 172 Ų | 172 | 98.9 Ų | 98.9 | 68% | 0.675 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -68 | -37.9 | 177.4 | -161.9 | -87.7 | 0 | 0 | 0 | 112.1 | L366 Q367 E368 A374 | L366-Y370 WeakPolarHBondContact O-CB 3.28Å; L366-Y370 PolarHBondContact O-N 3.01Å; Q367-Y370 WeakPolarHBondContact O-CB 3.47Å; Q367-Y370 PolarHBondContact O-N 3.11Å; E368-Y370 VanDerWaalsContact C-N 3.27Å; E368-Y370 PolarHBondContact O-N 3.15Å; Y370-A374 VanDerWaalsContact O-CB 3.31Å; Y370-A374 WeakPolarHBondContact O-CB 3.3Å; Y370-A374 PolarHBondContact O-N 2.95Å |
| 371 | Y | 89.4 | Confident | 87.6 | Confident | 149 Ų | 149 | 100.7 Ų | 100.7 | 58% | 0.584 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -67.2 | -40.1 | 172.8 | -71.4 | -56.1 | 0 | 0 | 0 | 112.3 | Q367 E368 A374 H375 | Q367-Y371 HydrophobicContact CG-CD2 4.18Å; Q367-Y371 HydrophobicContact CG-CE2 3.63Å; Q367-Y371 PolarHBondContact NE2-OH 3.25Å; Q367-Y371 WeakPolarHBondContact O-CD2 3.42Å; Q367-Y371 PolarHBondContact O-N 3.34Å; E368-Y371 PolarHBondContact O-N 3.12Å; E368-Y371 VanDerWaalsContact O-N 3.09Å; Y371-A374 PolarHBondContact O-N 3.37Å; Y371-H375 WeakPolarHBondContact O-CB 3.5Å; Y371-H375 PolarHBondContact O-N 2.9Å |
| 372 | E | 89.6 | Confident | 86.9 | Confident | 119 Ų | 119 | 105 Ų | 105 | 56% | 0.556 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -60.8 | -47.5 | 173.1 | -70.5 | -171.6 | 152.3 | 0 | 0 | 111.6 | E368 L369 A374 H375 V376 | E368-E372 PolarHBondContact O-N 3.1Å; L369-E372 PolarHBondContact O-N 2.67Å; E372-A374 VanDerWaalsContact C-N 3.35Å; E372-A374 PolarHBondContact O-N 3.49Å; E372-H375 PolarHBondContact O-N 2.93Å; E372-V376 WeakPolarHBondContact O-CG2 3.36Å; E372-V376 PolarHBondContact O-N 3.48Å |
| 373 | I | 91.6 | Very high | 86 | Confident | 92 Ų | 92 | 109 Ų | 109 | 47% | 0.472 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.9 | -43.6 | 177.2 | -70.9 | 165.1 | 0 | 0 | 0 | 111.1 | L369 H375 V376 L377 | L369-I373 WeakPolarHBondContact O-CB 3.47Å; L369-I373 WeakPolarHBondContact O-CD1 3.49Å; L369-I373 VanDerWaalsContact O-CG1 3.24Å; L369-I373 WeakPolarHBondContact O-CG1 3.25Å; L369-I373 PolarHBondContact O-N 2.94Å; I373-H375 VanDerWaalsContact C-N 3.33Å; I373-H375 PolarHBondContact O-N 2.99Å; I373-V376 PolarHBondContact O-N 3.35Å; I373-L377 HydrophobicContact CG2-CD1 3.86Å; I373-L377 WeakPolarHBondContact O-CB 3.49Å; I373-L377 WeakPolarHBondContact O-CG 3.29Å; I373-L377 PolarHBondContact O-N 3.13Å |
| 374 | A | 88.8 | Confident | 84.6 | Confident | 50 Ų | 50 | 110.1 Ų | 110.1 | 41% | 0.413 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -64.5 | -36.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y370 Y371 E372 G378 | Y370-A374 VanDerWaalsContact O-CB 3.31Å; Y370-A374 WeakPolarHBondContact O-CB 3.3Å; Y370-A374 PolarHBondContact O-N 2.95Å; Y371-A374 PolarHBondContact O-N 3.37Å; E372-A374 VanDerWaalsContact C-N 3.35Å; E372-A374 PolarHBondContact O-N 3.49Å; A374-G378 PolarHBondContact O-N 2.78Å |
| 375 | H | 87.7 | Confident | 83.2 | Confident | 124 Ų | 124 | 110.2 Ų | 110.2 | 57% | 0.574 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -67.5 | -45.7 | 175.7 | -177.4 | 52.3 | 0 | 0 | 0 | 111.8 | Y371 E372 I373 L377 G378 L379 | Y371-H375 WeakPolarHBondContact O-CB 3.5Å; Y371-H375 PolarHBondContact O-N 2.9Å; E372-H375 PolarHBondContact O-N 2.93Å; I373-H375 VanDerWaalsContact C-N 3.33Å; I373-H375 PolarHBondContact O-N 2.99Å; H375-L377 PolarHBondContact O-N 3.07Å; H375-G378 PolarHBondContact O-N 3.49Å; H375-G378 VanDerWaalsContact O-N 3.14Å; H375-L379 WeakPolarHBondContact O-CG 3.41Å; H375-L379 PolarHBondContact O-N 3.21Å |
| 376 | V | 87.9 | Confident | 81.5 | Confident | 76 Ų | 76 | 113.1 Ų | 113.1 | 46% | 0.461 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -63.7 | -39.8 | 175.4 | 174.6 | 0 | 0 | 0 | 0 | 111.6 | E372 I373 G378 L379 M380 | E372-V376 WeakPolarHBondContact O-CG2 3.36Å; E372-V376 PolarHBondContact O-N 3.48Å; I373-V376 PolarHBondContact O-N 3.35Å; V376-G378 VanDerWaalsContact C-N 3.33Å; V376-L379 PolarHBondContact O-N 3.25Å; V376-M380 HydrophobicContact CG1-CE 4.22Å; V376-M380 WeakPolarHBondContact O-CG 3.34Å; V376-M380 PolarHBondContact O-N 3.48Å |
| 377 | L | 85.7 | Confident | 79.5 | Confident | 101 Ų | 101 | 116.2 Ų | 116.2 | 53% | 0.529 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -62.6 | -38.3 | 172 | -83.2 | 162 | 0 | 0 | 0 | 112.4 | I373 H375 M380 L381 | I373-L377 HydrophobicContact CG2-CD1 3.86Å; I373-L377 WeakPolarHBondContact O-CB 3.49Å; I373-L377 WeakPolarHBondContact O-CG 3.29Å; I373-L377 PolarHBondContact O-N 3.13Å; H375-L377 PolarHBondContact O-N 3.07Å; L377-M380 HydrophobicContact CD2-CE 3.83Å; L377-M380 HydrophobicContact CG-CE 4.24Å; L377-M380 PolarHBondContact O-N 3.49Å; L377-L381 WeakPolarHBondContact O-CB 3.34Å; L377-L381 PolarHBondContact O-N 3.34Å |
| 378 | G | 84.6 | Confident | 77.2 | Confident | 36 Ų | 36 | 120.6 Ų | 120.6 | 37% | 0.371 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -59.8 | -49.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | A374 H375 V376 M380 L381 E382 | A374-G378 PolarHBondContact O-N 2.78Å; H375-G378 PolarHBondContact O-N 3.49Å; H375-G378 VanDerWaalsContact O-N 3.14Å; V376-G378 VanDerWaalsContact C-N 3.33Å; G378-M380 PolarHBondContact O-N 3.35Å; G378-L381 WeakPolarHBondContact O-CB 3.4Å; G378-L381 PolarHBondContact O-N 2.96Å; G378-L381 VanDerWaalsContact O-N 3.16Å; G378-E382 PolarHBondContact O-N 3.15Å |
| 379 | L | 83.1 | Confident | 74.9 | Confident | 81 Ų | 81 | 121 Ų | 121 | 42% | 0.424 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -60.4 | -44.5 | 176.7 | -66.6 | 169.8 | 0 | 0 | 0 | 112 | H375 V376 L381 E382 D383 | H375-L379 WeakPolarHBondContact O-CG 3.41Å; H375-L379 PolarHBondContact O-N 3.21Å; V376-L379 PolarHBondContact O-N 3.25Å; L379-L381 VanDerWaalsContact C-N 3.29Å; L379-L381 PolarHBondContact O-N 3Å; L379-E382 WeakPolarHBondContact O-CB 3.31Å; L379-E382 PolarHBondContact O-N 3.05Å; L379-E382 VanDerWaalsContact O-N 3.12Å; L379-D383 PolarHBondContact O-N 3Å |
| 380 | M | 82.2 | Confident | 72.5 | Confident | 103 Ų | 103 | 124.7 Ų | 124.7 | 51% | 0.507 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -66.5 | -27.6 | 176.1 | -70 | -170.5 | -57.1 | 0 | 0 | 113.6 | V376 L377 G378 E382 L384 | V376-M380 HydrophobicContact CG1-CE 4.22Å; V376-M380 WeakPolarHBondContact O-CG 3.34Å; V376-M380 PolarHBondContact O-N 3.48Å; L377-M380 HydrophobicContact CD2-CE 3.83Å; L377-M380 HydrophobicContact CG-CE 4.24Å; L377-M380 PolarHBondContact O-N 3.49Å; G378-M380 PolarHBondContact O-N 3.35Å; M380-E382 VanDerWaalsContact C-N 3.34Å; M380-L384 PolarHBondContact O-N 2.82Å |
| 381 | L | 78.3 | Confident | 70.2 | Confident | 130 Ų | 130 | 122.2 Ų | 122.2 | 68% | 0.681 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -73.6 | -30 | 173.2 | -161.6 | 79.5 | 0 | 0 | 0 | 111.7 | L377 G378 L379 L384 | L377-L381 WeakPolarHBondContact O-CB 3.34Å; L377-L381 PolarHBondContact O-N 3.34Å; G378-L381 WeakPolarHBondContact O-CB 3.4Å; G378-L381 PolarHBondContact O-N 2.96Å; G378-L381 VanDerWaalsContact O-N 3.16Å; L379-L381 VanDerWaalsContact C-N 3.29Å; L379-L381 PolarHBondContact O-N 3Å; L381-L384 HydrophobicContact CD1-CD1 4.22Å |
| 382 | E | 73.8 | Confident | 67.8 | Low | 162 Ų | 162 | 124 Ų | 124 | 76% | 0.757 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -77.9 | -30.6 | 177 | -149.5 | 159.8 | -149.4 | 0 | 0 | 112 | G378 L379 M380 | G378-E382 PolarHBondContact O-N 3.15Å; L379-E382 WeakPolarHBondContact O-CB 3.31Å; L379-E382 PolarHBondContact O-N 3.05Å; L379-E382 VanDerWaalsContact O-N 3.12Å; M380-E382 VanDerWaalsContact C-N 3.34Å |
| 383 | D | 68.8 | Low | 65.6 | Low | 144 Ų | 144 | 127.2 Ų | 127.2 | 77% | 0.77 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -79.2 | -10.4 | 172.5 | -84.5 | -26.6 | 0 | 0 | 0 | 114.6 | L379 | L379-D383 PolarHBondContact O-N 3Š|
| 384 | L | 63 | Low | 63.4 | Low | 109 Ų | 109 | 132.5 Ų | 132.5 | 57% | 0.571 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -70.5 | 125 | 175.3 | -98.4 | 158 | 0 | 0 | 0 | 110.1 | M380 L381 Q386 | M380-L384 PolarHBondContact O-N 2.82Å; L381-L384 HydrophobicContact CD1-CD1 4.22Å; L384-Q386 PolarHBondContact O-N 2.69Å |
| 385 | P | 58.1 | Low | 61.4 | Low | 112 Ų | 112 | 137 Ų | 137 | 73% | 0.727 | 72% | 0.715 | S | S | * | * | trans | -62.5 | 123.8 | -178.9 | 24.6 | -33.9 | 0 | 0 | 0 | 110.7 | E387 | P385-E387 PolarHBondContact O-N 3.06Š| ||
| 386 | Q | 52.1 | Low | 59.3 | Low | 188 Ų | 188 | 140.6 Ų | 140.6 | 88% | 0.879 | 73% | 0.732 | S | S | * | * | trans | -59.8 | 103.7 | 173.9 | -70.6 | -173.7 | -7.9 | 0 | 0 | 110.5 | L384 K388 | L384-Q386 PolarHBondContact O-N 2.69Å; Q386-K388 PolarHBondContact O-N 2.98Å | ||
| 387 | E | 47.3 | Very low | 57.2 | Low | 189 Ų | 189 | 146.2 Ų | 146.2 | 88% | 0.883 | 75% | 0.754 | S | S | * | * | trans | -63 | 107 | 163.6 | -76.2 | -161.8 | 146.7 | 0 | 0 | 108.7 | P385 P389 | P385-E387 PolarHBondContact O-N 3.06Å; E387-P389 WeakPolarHBondContact O-CD 3.44Å | ||
| 388 | K | 40 | Very low | 54.9 | Low | 176 Ų | 176 | 154.9 Ų | 154.9 | 77% | 0.765 | 79% | 0.787 | S | S | * | * | trans | -63.4 | 126.9 | 170.5 | -72 | 178 | 176.8 | 175.3 | 0 | 108.8 | Q386 Q390 | Q386-K388 PolarHBondContact O-N 2.98Å; K388-Q390 PolarHBondContact O-N 2.67Å | ||
| 389 | P | 39.3 | Very low | 53.4 | Low | 135 Ų | 135 | 160.8 Ų | 160.8 | 88% | 0.877 | 81% | 0.808 | S | S | * | * | trans | -68.2 | 103.5 | 168.8 | 27.8 | -32.3 | 0 | 0 | 0 | 109.2 | E387 | E387-P389 WeakPolarHBondContact O-CD 3.44Š| ||
| 390 | Q | 40.3 | Very low | 51.8 | Low | 170 Ų | 170 | 165 Ų | 165 | 79% | 0.794 | 83% | 0.828 | S | S | * | * | trans | -104.7 | 151.6 | 163.1 | -77.8 | -168.9 | -35 | 0 | 0 | 110.1 | K388 | K388-Q390 PolarHBondContact O-N 2.67Š| ||
| 391 | S | 42.3 | Very low | 50.1 | Low | 121 Ų | 121 | 168.4 Ų | 168.4 | 85% | 0.846 | 85% | 0.846 | S | S | * | * | trans | 71.8 | 80.7 | 176.8 | 70.7 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 392 | L | 40.6 | Very low | 48.5 | Very low | 186 Ų | 186 | 170.7 Ų | 170.7 | 97% | 0.974 | 86% | 0.855 | S | S | * | * | trans | -145.5 | 46.3 | 149.5 | -124.7 | 168.1 | 0 | 0 | 0 | 111.5 | ||||
| 393 | E | 41.6 | Very low | 46.9 | Very low | 186 Ų | 186 | 171.3 Ų | 171.3 | 87% | 0.869 | 86% | 0.861 | S | S | * | * | S | Bend | trans | -147 | 62.1 | 177.8 | -163.2 | 175.4 | -134.6 | 0 | 0 | 110 | ||
| 394 | K | 45.6 | Very low | 45.4 | Very low | 204 Ų | 204 | 173.1 Ų | 173.1 | 89% | 0.887 | 87% | 0.868 | S | S | * | * | S | Bend | trans | -162.8 | 32 | 172.5 | -124.2 | 172.3 | -168.6 | 178.3 | 0 | 117.2 | ||
| 395 | V | 47.2 | Very low | 44.2 | Very low | 145 Ų | 145 | 177.6 Ų | 177.6 | 88% | 0.879 | 89% | 0.889 | S | S | * | * | S | Bend | trans | -141.2 | 63.4 | 168.8 | -166.5 | 0 | 0 | 0 | 0 | 110.8 | ||
| 396 | E | 42.8 | Very low | 43.1 | Very low | 198 Ų | 198 | 182.7 Ų | 182.7 | 93% | 0.925 | 90% | 0.901 | S | S | * | * | trans | -159.4 | 52.2 | 160.7 | -129.6 | 170.7 | -151 | 0 | 0 | 112.3 | ||||
| 397 | E | 44.3 | Very low | 42.3 | Very low | 195 Ų | 195 | 182.3 Ų | 182.3 | 91% | 0.911 | 90% | 0.903 | S | S | * | * | trans | -150 | 71.1 | 162.3 | -148.2 | 177.8 | -147.1 | 0 | 0 | 111.8 | ||||
| 398 | K | 36.9 | Very low | 41.9 | Very low | 282 Ų | 282 | 181.6 Ų | 181.6 | 100% | 1.226 | 91% | 0.905 | S | S | * | * | trans | -163.4 | 0 | 151 | -127.8 | -178.3 | -177.2 | -177.5 | 0 | 113.7 |
Retrieved 398 of 398 residues in 106.3 ms
(Link to these results)