| 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 | 36.5 | Very low | 38.7 | Very low | 228 Ų | 228 | 175.2 Ų | 175.2 | 100% | 1.123 | 83% | 0.826 | S | S | * | * | 0 | 106 | 0 | -69.8 | 174.5 | -164.7 | 0 | 0 | 106.2 | |||||
| 2 | E | 41.1 | Very low | 38.6 | Very low | 167 Ų | 167 | 173.8 Ų | 173.8 | 78% | 0.78 | 82% | 0.822 | S | S | * | * | 95.2 | 105.3 | 83.1 | -167.4 | 168.5 | -148.1 | 0 | 0 | 109.3 | |||||
| 3 | N | 43.4 | Very low | 38.4 | Very low | 141 Ų | 141 | 168 Ų | 168 | 75% | 0.754 | 81% | 0.808 | S | S | * | * | trans | -176.5 | 97.2 | 130.9 | -95.4 | -25.1 | 0 | 0 | 0 | 110.5 | ||||
| 4 | M | 40.1 | Very low | 38.1 | Very low | 168 Ų | 168 | 173.1 Ų | 173.1 | 83% | 0.828 | 82% | 0.815 | S | S | * | * | trans | -66 | 125.8 | 154 | -76.3 | -161.6 | -77.4 | 0 | 0 | 109.3 | ||||
| 5 | H | 43.2 | Very low | 38.1 | Very low | 167 Ų | 167 | 172.3 Ų | 172.3 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | trans | -135.7 | 85.9 | 151.5 | -83.2 | -21.3 | 0 | 0 | 0 | 110.1 | ||||
| 6 | L | 36.5 | Very low | 37.7 | Very low | 165 Ų | 165 | 168.4 Ų | 168.4 | 86% | 0.864 | 81% | 0.807 | S | S | * | * | trans | -66.3 | 121.6 | 146.3 | -96.3 | 71.5 | 0 | 0 | 0 | 107.9 | ||||
| 7 | R | 39.5 | Very low | 37.8 | Very low | 208 Ų | 208 | 168.1 Ų | 168.1 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | trans | -139.4 | 106.2 | 161.8 | -108.7 | -173.6 | -174.4 | -170.1 | 4.2 | 111.8 | ||||
| 8 | R | 37.5 | Very low | 37.3 | Very low | 205 Ų | 205 | 165.1 Ų | 165.1 | 77% | 0.774 | 80% | 0.804 | S | S | * | * | 72.7 | 89.6 | 126.9 | -148.5 | 177.2 | -86.8 | 176.3 | -9.6 | 117 | R10 | R8-R10 PolarHBondContact O-N 3.42Š| |||
| 9 | V | 36.5 | Very low | 37.3 | Very low | 132 Ų | 132 | 164.1 Ų | 164.1 | 80% | 0.8 | 80% | 0.802 | S | S | * | * | trans | -50.1 | 121.1 | 151 | 176 | 0 | 0 | 0 | 0 | 109.3 | T11 | V9-T11 HydrophobicContact CG1-CG2 4.48Š| ||
| 10 | R | 38.7 | Very low | 37.2 | Very low | 220 Ų | 220 | 162.4 Ų | 162.4 | 83% | 0.83 | 80% | 0.802 | S | S | * | * | trans | -100.2 | 108 | 165.9 | -104.9 | -178.8 | 170.5 | 168.8 | -3.2 | 107.8 | R8 | R8-R10 PolarHBondContact O-N 3.42Š| ||
| 11 | T | 33.3 | Very low | 36.9 | Very low | 126 Ų | 126 | 163.8 Ų | 163.8 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | trans | -73.9 | 135.5 | 162.5 | 36.3 | 0 | 0 | 0 | 0 | 109.2 | V9 | V9-T11 HydrophobicContact CG1-CG2 4.48Š| ||
| 12 | M | 37 | Very low | 36.9 | Very low | 158 Ų | 158 | 157.5 Ų | 157.5 | 78% | 0.778 | 79% | 0.793 | S | S | * | * | trans | -129.1 | 150.5 | 168.9 | -80.8 | -68.6 | 174.7 | 0 | 0 | 109.5 | ||||
| 13 | P | 35.9 | Very low | 36.5 | Very low | 99 Ų | 99 | 154.6 Ų | 154.6 | 64% | 0.643 | 79% | 0.789 | S | S | * | * | trans | -100.3 | 155.1 | -142.9 | -2.8 | 24.7 | 0 | 0 | 0 | 115.1 | H15 | P13-H15 PolarHBondContact O-N 3.3Š| ||
| 14 | R | 34.1 | Very low | 36 | Very low | 239 Ų | 239 | 158.9 Ų | 158.9 | 90% | 0.902 | 80% | 0.796 | S | S | * | * | trans | -54.3 | 126 | 165.6 | -66.4 | -175.9 | 173.3 | -178.5 | -2.2 | 111 | ||||
| 15 | H | 38.7 | Very low | 35.9 | Very low | 162 Ų | 162 | 156.8 Ų | 156.8 | 75% | 0.75 | 80% | 0.798 | S | S | * | * | trans | -106.6 | 110.6 | 155.9 | -82.5 | 68.6 | 0 | 0 | 0 | 108.5 | P13 | P13-H15 PolarHBondContact O-N 3.3Š| ||
| 16 | S | 31.9 | Very low | 35.8 | Very low | 109 Ų | 109 | 154 Ų | 154 | 76% | 0.762 | 80% | 0.797 | S | S | * | * | trans | -99.3 | 111.3 | 161.9 | -55.3 | 0 | 0 | 0 | 0 | 106 | ||||
| 17 | Q | 38 | Very low | 36 | Very low | 164 Ų | 164 | 152.9 Ų | 152.9 | 77% | 0.766 | 80% | 0.797 | S | S | * | * | trans | -127.6 | 99.5 | 167.3 | -81.8 | -173.6 | 0.3 | 0 | 0 | 108.8 | ||||
| 18 | S | 30.3 | Very low | 36.5 | Very low | 113 Ų | 113 | 146.2 Ų | 146.2 | 79% | 0.79 | 78% | 0.782 | S | S | * | * | trans | -74.7 | 121.2 | 152.7 | 44.1 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 19 | L | 36.1 | Very low | 37.2 | Very low | 147 Ų | 147 | 142.6 Ų | 142.6 | 77% | 0.77 | 78% | 0.778 | S | S | * | * | trans | -157 | 136.2 | 163.3 | -96.6 | 171 | 0 | 0 | 0 | 111.4 | ||||
| 20 | T | 35.8 | Very low | 38.2 | Very low | 130 Ų | 130 | 140.5 Ų | 140.5 | 80% | 0.798 | 77% | 0.765 | S | S | * | * | trans | 72.3 | 102.5 | 154.4 | 43.4 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 21 | M | 31 | Very low | 39.1 | Very low | 191 Ų | 191 | 136.8 Ų | 136.8 | 94% | 0.941 | 76% | 0.757 | S | S | * | * | trans | -62 | 133.6 | 151.1 | -57.8 | -152.6 | 80.9 | 0 | 0 | 110.9 | ||||
| 22 | A | 35.5 | Very low | 40.4 | Very low | 96 Ų | 96 | 137.7 Ų | 137.7 | 79% | 0.793 | 75% | 0.752 | S | S | * | * | trans | -142.4 | 142 | 152.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 23 | P | 34.4 | Very low | 41.5 | Very low | 106 Ų | 106 | 134.3 Ų | 134.3 | 69% | 0.688 | 74% | 0.737 | S | S | * | * | trans | -102.7 | 152.1 | -156.8 | 3.3 | 20.6 | 0 | 0 | 0 | 113.2 | ||||
| 24 | Y | 32.6 | Very low | 43.3 | Very low | 231 Ų | 231 | 135.6 Ų | 135.6 | 91% | 0.906 | 74% | 0.735 | S | S | * | * | trans | 40.9 | 92.7 | 144.7 | -56.8 | -74.1 | 0 | 0 | 0 | 118.7 | ||||
| 25 | S | 37.8 | Very low | 45 | Very low | 125 Ų | 125 | 130 Ų | 130 | 87% | 0.874 | 72% | 0.723 | S | S | * | * | -153.5 | 134.6 | 125 | 53.4 | 0 | 0 | 0 | 0 | 108.6 | |||||
| 26 | S | 40.7 | Very low | 46.8 | Very low | 107 Ų | 107 | 130.8 Ų | 130.8 | 75% | 0.748 | 72% | 0.719 | S | S | * | * | trans | -96.2 | 142.2 | -157.1 | 42.1 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 27 | V | 41 | Very low | 48.9 | Very low | 142 Ų | 142 | 130.3 Ų | 130.3 | 86% | 0.861 | 71% | 0.707 | S | S | * | * | trans | 78.7 | 110.9 | 134.9 | 177.8 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 28 | S | 50.8 | Low | 50.8 | Low | 69 Ų | 69 | 127 Ų | 127 | 48% | 0.483 | 69% | 0.694 | S | S | . | * | -133.2 | 140.9 | 71.6 | 173.9 | 0 | 0 | 0 | 0 | 113.9 | V30 E31 | S28-V30 PolarHBondContact O-N 3.41Å; S28-E31 PolarHBondContact O-N 3.47Å | |||
| 29 | L | 52 | Low | 53.1 | Low | 129 Ų | 129 | 125.6 Ų | 125.6 | 68% | 0.675 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -52.6 | -18.7 | -179.4 | -173.7 | 72 | 0 | 0 | 0 | 114.9 | L33 | L29-L33 HydrophobicContact CG-CD1 4.31Å; L29-L33 PolarHBondContact O-N 3.42Å |
| 30 | V | 57.6 | Low | 55.1 | Low | 87 Ų | 87 | 124.5 Ų | 124.5 | 53% | 0.527 | 67% | 0.674 | S | S | . | * | H | α-helix | trans | -71.3 | -44.1 | -173.8 | 179.9 | 0 | 0 | 0 | 0 | 112.6 | S28 Q32 L33 E34 | S28-V30 PolarHBondContact O-N 3.41Å; V30-Q32 VanDerWaalsContact C-N 3.33Å; V30-Q32 PolarHBondContact O-N 3.38Å; V30-L33 WeakPolarHBondContact O-CB 3.28Å; V30-L33 PolarHBondContact O-N 3.17Å; V30-E34 PolarHBondContact O-N 3.3Å; V30-E34 VanDerWaalsContact O-N 3.09Å |
| 31 | E | 56.4 | Low | 57.2 | Low | 143 Ų | 143 | 124.3 Ų | 124.3 | 67% | 0.668 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -67.1 | -34.3 | -178.6 | -80 | 175.3 | 146.4 | 0 | 0 | 112.2 | S28 L33 E34 D35 | S28-E31 PolarHBondContact O-N 3.47Å; E31-L33 VanDerWaalsContact C-N 3.27Å; E31-L33 PolarHBondContact O-N 3.37Å; E31-E34 PolarHBondContact O-N 3.28Å; E31-D35 PolarHBondContact O-N 3.18Å; E31-D35 VanDerWaalsContact O-N 3.1Å |
| 32 | Q | 59.9 | Low | 59.4 | Low | 144 Ų | 144 | 122.5 Ų | 122.5 | 67% | 0.673 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -70.9 | -25.7 | 178.3 | -145.9 | 177.2 | 29.5 | 0 | 0 | 112.6 | V30 | V30-Q32 VanDerWaalsContact C-N 3.33Å; V30-Q32 PolarHBondContact O-N 3.38Å |
| 33 | L | 62 | Low | 61.6 | Low | 88 Ų | 88 | 121.4 Ų | 121.4 | 46% | 0.461 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -76.4 | -42.2 | 172.2 | -85.3 | 161.1 | 0 | 0 | 0 | 111.3 | L29 V30 E31 R36 I37 | L29-L33 HydrophobicContact CG-CD1 4.31Å; L29-L33 PolarHBondContact O-N 3.42Å; V30-L33 WeakPolarHBondContact O-CB 3.28Å; V30-L33 PolarHBondContact O-N 3.17Å; E31-L33 VanDerWaalsContact C-N 3.27Å; E31-L33 PolarHBondContact O-N 3.37Å; L33-R36 PolarHBondContact O-N 3.48Å; L33-I37 VanDerWaalsContact O-CG1 3.25Å; L33-I37 WeakPolarHBondContact O-CG1 3.37Å; L33-I37 PolarHBondContact O-N 3.49Å |
| 34 | E | 72 | Confident | 63.7 | Low | 126 Ų | 126 | 120.1 Ų | 120.1 | 59% | 0.589 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -61.4 | -43.9 | 177.3 | -79 | -178.6 | 151.9 | 0 | 0 | 112.3 | V30 E31 R36 I37 L38 | V30-E34 PolarHBondContact O-N 3.3Å; V30-E34 VanDerWaalsContact O-N 3.09Å; E31-E34 PolarHBondContact O-N 3.28Å; E34-R36 VanDerWaalsContact C-N 3.32Å; E34-R36 PolarHBondContact O-N 3.12Å; E34-I37 PolarHBondContact O-N 3.44Å; E34-L38 WeakPolarHBondContact O-CB 3.43Å; E34-L38 PolarHBondContact O-N 3.49Å |
| 35 | D | 71.3 | Confident | 65.8 | Low | 122 Ų | 122 | 112 Ų | 112 | 65% | 0.652 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -68 | -34.1 | -178.1 | -137.4 | 30.6 | 0 | 0 | 0 | 112 | E31 C39 | E31-D35 PolarHBondContact O-N 3.18Å; E31-D35 VanDerWaalsContact O-N 3.1Å; D35-C39 WeakPolarHBondContact O-CB 3.45Å; D35-C39 PolarHBondContact O-N 3.41Å |
| 36 | R | 76.1 | Confident | 67.9 | Low | 177 Ų | 177 | 108.7 Ų | 108.7 | 67% | 0.668 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -69 | -39.9 | 171.6 | -85.9 | -179.5 | 61.9 | -174.7 | -3.4 | 112.8 | L33 E34 H40 | L33-R36 PolarHBondContact O-N 3.48Å; E34-R36 VanDerWaalsContact C-N 3.32Å; E34-R36 PolarHBondContact O-N 3.12Å; R36-H40 PolarHBondContact O-N 3.15Å; R36-H40 VanDerWaalsContact O-N 3.13Å |
| 37 | I | 76.7 | Confident | 69.8 | Low | 100 Ų | 100 | 109.1 Ų | 109.1 | 51% | 0.513 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -65.5 | -46.1 | 178.1 | -72.7 | 167.1 | 0 | 0 | 0 | 110.1 | L33 E34 C39 H40 E41 | L33-I37 VanDerWaalsContact O-CG1 3.25Å; L33-I37 WeakPolarHBondContact O-CG1 3.37Å; L33-I37 PolarHBondContact O-N 3.49Å; E34-I37 PolarHBondContact O-N 3.44Å; I37-C39 VanDerWaalsContact C-N 3.29Å; I37-C39 PolarHBondContact O-N 3.22Å; I37-H40 WeakPolarHBondContact O-CB 3.42Å; I37-H40 PolarHBondContact O-N 3.1Å; I37-H40 VanDerWaalsContact O-N 3.07Å; I37-E41 PolarHBondContact O-N 3.29Å |
| 38 | L | 77.6 | Confident | 71.9 | Confident | 94 Ų | 94 | 106 Ų | 106 | 49% | 0.492 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -60.6 | -38.6 | 179.3 | -164.4 | 77.6 | 0 | 0 | 0 | 112.2 | E34 K42 | E34-L38 WeakPolarHBondContact O-CB 3.43Å; E34-L38 PolarHBondContact O-N 3.49Å; L38-K42 PolarHBondContact O-N 3.19Å |
| 39 | C | 77.8 | Confident | 73.4 | Confident | 83 Ų | 83 | 108.7 Ų | 108.7 | 56% | 0.561 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -67.1 | -38.6 | 175.2 | -165.8 | 0 | 0 | 0 | 0 | 112.2 | D35 I37 T43 | D35-C39 WeakPolarHBondContact O-CB 3.45Å; D35-C39 PolarHBondContact O-N 3.41Å; I37-C39 VanDerWaalsContact C-N 3.29Å; I37-C39 PolarHBondContact O-N 3.22Å; C39-T43 PolarHBondContact O-N 3.29Å; C39-T43 PolarHBondContact O-OG1 3.25Å |
| 40 | H | 79 | Confident | 74.9 | Confident | 125 Ų | 125 | 108.4 Ų | 108.4 | 58% | 0.579 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -67.5 | -40.6 | 175.2 | -102.9 | -59.8 | 0 | 0 | 0 | 112.9 | R36 I37 T43 T44 | R36-H40 PolarHBondContact O-N 3.15Å; R36-H40 VanDerWaalsContact O-N 3.13Å; I37-H40 WeakPolarHBondContact O-CB 3.42Å; I37-H40 PolarHBondContact O-N 3.1Å; I37-H40 VanDerWaalsContact O-N 3.07Å; H40-T43 PolarHBondContact O-N 3.26Å; H40-T44 WeakPolarHBondContact O-CB 3.48Å; H40-T44 PolarHBondContact O-N 3.43Å; H40-T44 PolarHBondContact O-OG1 3.34Å |
| 41 | E | 80.2 | Confident | 76.1 | Confident | 125 Ų | 125 | 107 Ų | 107 | 58% | 0.584 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -61.9 | -46.5 | 176.3 | -83.7 | -172.3 | 142.7 | 0 | 0 | 112.1 | I37 T43 T44 A45 | I37-E41 PolarHBondContact O-N 3.29Å; E41-T43 VanDerWaalsContact C-N 3.33Å; E41-T43 PolarHBondContact O-N 3.02Å; E41-T44 PolarHBondContact O-N 3.33Å; E41-A45 WeakPolarHBondContact O-CB 3.42Å; E41-A45 PolarHBondContact O-N 3.07Å |
| 42 | K | 76.5 | Confident | 77.5 | Confident | 153 Ų | 153 | 106.1 Ų | 106.1 | 67% | 0.665 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -59.9 | -41.8 | 176.6 | -88.4 | -179.1 | 175 | 172.6 | 0 | 112.7 | L38 A46 | L38-K42 PolarHBondContact O-N 3.19Å; K42-A46 WeakPolarHBondContact O-CB 3.43Å; K42-A46 PolarHBondContact O-N 3.45Å; K42-A46 VanDerWaalsContact O-N 3.09Å |
| 43 | T | 80.9 | Confident | 78.5 | Confident | 74 Ų | 74 | 107.5 Ų | 107.5 | 45% | 0.454 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -67.7 | -39.5 | 179.2 | -52.2 | 0 | 0 | 0 | 0 | 111.3 | C39 H40 E41 A46 L47 | C39-T43 PolarHBondContact O-N 3.29Å; C39-T43 PolarHBondContact O-OG1 3.25Å; H40-T43 PolarHBondContact O-N 3.26Å; E41-T43 VanDerWaalsContact C-N 3.33Å; E41-T43 PolarHBondContact O-N 3.02Å; T43-A46 PolarHBondContact O-N 3.11Å; T43-L47 HydrophobicContact CG2-CD1 4.34Å; T43-L47 WeakPolarHBondContact O-CG 3.47Å; T43-L47 PolarHBondContact O-N 3.1Å |
| 44 | T | 78.4 | Confident | 79.6 | Confident | 78 Ų | 78 | 107.4 Ų | 107.4 | 48% | 0.479 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -68.7 | -43.1 | 178.7 | -49.6 | 0 | 0 | 0 | 0 | 111.3 | H40 E41 A46 L47 V48 | H40-T44 WeakPolarHBondContact O-CB 3.48Å; H40-T44 PolarHBondContact O-N 3.43Å; H40-T44 PolarHBondContact O-OG1 3.34Å; E41-T44 PolarHBondContact O-N 3.33Å; T44-A46 PolarHBondContact O-N 3.36Å; T44-L47 PolarHBondContact O-N 3.45Å; T44-V48 WeakPolarHBondContact O-CG2 3.43Å; T44-V48 PolarHBondContact O-N 3.48Å |
| 45 | A | 78.2 | Confident | 80.3 | Confident | 60 Ų | 60 | 106.4 Ų | 106.4 | 50% | 0.496 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.1 | -43.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | E41 L47 V48 E49 | E41-A45 WeakPolarHBondContact O-CB 3.42Å; E41-A45 PolarHBondContact O-N 3.07Å; A45-L47 PolarHBondContact O-N 3Å; A45-V48 PolarHBondContact O-N 3.5Å; A45-E49 PolarHBondContact O-N 3.29Å |
| 46 | A | 80 | Confident | 81 | Confident | 56 Ų | 56 | 104.4 Ų | 104.4 | 46% | 0.463 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.4 | -39.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | K42 T43 T44 E49 H50 | K42-A46 WeakPolarHBondContact O-CB 3.43Å; K42-A46 PolarHBondContact O-N 3.45Å; K42-A46 VanDerWaalsContact O-N 3.09Å; T43-A46 PolarHBondContact O-N 3.11Å; T44-A46 PolarHBondContact O-N 3.36Å; A46-E49 PolarHBondContact O-N 3.39Å; A46-H50 WeakPolarHBondContact O-CB 3.47Å; A46-H50 PolarHBondContact O-N 3.26Å |
| 47 | L | 81.4 | Confident | 81.2 | Confident | 117 Ų | 117 | 100.9 Ų | 100.9 | 61% | 0.613 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -66 | -40.6 | 175.5 | -81.2 | 164.2 | 0 | 0 | 0 | 112.4 | T43 T44 A45 H50 A51 | T43-L47 HydrophobicContact CG2-CD1 4.34Å; T43-L47 WeakPolarHBondContact O-CG 3.47Å; T43-L47 PolarHBondContact O-N 3.1Å; T44-L47 PolarHBondContact O-N 3.45Å; A45-L47 PolarHBondContact O-N 3Å; L47-H50 PolarHBondContact O-N 3.35Å; L47-A51 WeakPolarHBondContact O-CB 3.37Å; L47-A51 PolarHBondContact O-N 3.48Å |
| 48 | V | 85.2 | Confident | 81.4 | Confident | 76 Ų | 76 | 100.7 Ų | 100.7 | 46% | 0.461 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.8 | -42.6 | 176 | 172.2 | 0 | 0 | 0 | 0 | 111 | T44 A45 H50 A51 F52 | T44-V48 WeakPolarHBondContact O-CG2 3.43Å; T44-V48 PolarHBondContact O-N 3.48Å; A45-V48 PolarHBondContact O-N 3.5Å; V48-H50 VanDerWaalsContact C-N 3.32Å; V48-H50 PolarHBondContact O-N 3.13Å; V48-A51 PolarHBondContact O-N 3.26Å; V48-F52 HydrophobicContact CG1-CD2 3.97Å; V48-F52 HydrophobicContact CG1-CE2 4.18Å; V48-F52 PolarHBondContact O-N 3.08Å |
| 49 | E | 82 | Confident | 81.5 | Confident | 126 Ų | 126 | 99.2 Ų | 99.2 | 59% | 0.589 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63 | -39.9 | 176.2 | -163.5 | -178 | 176.5 | 0 | 0 | 111.6 | A45 A46 F52 R53 | A45-E49 PolarHBondContact O-N 3.29Å; A46-E49 PolarHBondContact O-N 3.39Å; E49-F52 PolarHBondContact O-N 3.04Å; E49-R53 PolarHBondContact O-N 3.35Å |
| 50 | H | 83.9 | Confident | 81.3 | Confident | 123 Ų | 123 | 99.4 Ų | 99.4 | 57% | 0.569 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.1 | -37.3 | 175.3 | -144.1 | -64.6 | 0 | 0 | 0 | 112.3 | A46 L47 V48 I54 | A46-H50 WeakPolarHBondContact O-CB 3.47Å; A46-H50 PolarHBondContact O-N 3.26Å; L47-H50 PolarHBondContact O-N 3.35Å; V48-H50 VanDerWaalsContact C-N 3.32Å; V48-H50 PolarHBondContact O-N 3.13Å; H50-I54 VanDerWaalsContact O-CG1 3.29Å; H50-I54 WeakPolarHBondContact O-CG1 3.29Å; H50-I54 PolarHBondContact O-N 3.08Å; H50-I54 VanDerWaalsContact O-N 3.12Å |
| 51 | A | 83.4 | Confident | 80.8 | Confident | 57 Ų | 57 | 97 Ų | 97 | 47% | 0.471 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66.7 | -38.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L47 V48 I54 K55 | L47-A51 WeakPolarHBondContact O-CB 3.37Å; L47-A51 PolarHBondContact O-N 3.48Å; V48-A51 PolarHBondContact O-N 3.26Å; A51-I54 PolarHBondContact O-N 3.46Å; A51-K55 WeakPolarHBondContact O-CB 3.45Å; A51-K55 PolarHBondContact O-N 2.85Å |
| 52 | F | 85.2 | Confident | 80.1 | Confident | 124 Ų | 124 | 95.8 Ų | 95.8 | 54% | 0.544 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.5 | -42.5 | 174.9 | -99 | -82.4 | 0 | 0 | 0 | 112.6 | V48 E49 K55 D56 | V48-F52 HydrophobicContact CG1-CD2 3.97Å; V48-F52 HydrophobicContact CG1-CE2 4.18Å; V48-F52 PolarHBondContact O-N 3.08Å; E49-F52 PolarHBondContact O-N 3.04Å; F52-K55 HydrophobicContact CD1-CD 4.44Å; F52-K55 PolarHBondContact O-N 3.36Å; F52-D56 PolarHBondContact O-N 3.28Å |
| 53 | R | 81.4 | Confident | 79.5 | Confident | 173 Ų | 173 | 94.1 Ų | 94.1 | 65% | 0.653 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.2 | -46 | 173.8 | -89.9 | -175.1 | -175.5 | -122 | 2.4 | 112.6 | E49 K55 D56 D57 | E49-R53 PolarHBondContact O-N 3.35Å; R53-K55 VanDerWaalsContact C-N 3.31Å; R53-K55 PolarHBondContact O-N 2.85Å; R53-D56 PolarHBondContact O-N 2.93Å; R53-D57 WeakPolarHBondContact O-CB 3.31Å; R53-D57 PolarHBondContact O-N 3.25Å |
| 54 | I | 83.8 | Confident | 78.5 | Confident | 86 Ų | 86 | 97.9 Ų | 97.9 | 44% | 0.441 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.6 | -42.9 | 178.3 | -69.4 | 166.4 | 0 | 0 | 0 | 110.5 | H50 A51 D57 I58 | H50-I54 VanDerWaalsContact O-CG1 3.29Å; H50-I54 WeakPolarHBondContact O-CG1 3.29Å; H50-I54 PolarHBondContact O-N 3.08Å; H50-I54 VanDerWaalsContact O-N 3.12Å; A51-I54 PolarHBondContact O-N 3.46Å; I54-D57 PolarHBondContact O-N 3.43Å; I54-I58 HydrophobicContact CG2-CD1 3.87Å; I54-I58 VanDerWaalsContact O-CG1 3.28Å; I54-I58 WeakPolarHBondContact O-CG1 3.41Å; I54-I58 PolarHBondContact O-N 3.42Å |
| 55 | K | 86.5 | Confident | 77.4 | Confident | 106 Ų | 106 | 100.5 Ų | 100.5 | 46% | 0.461 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60 | -47 | 175.2 | 175.6 | -125.1 | 160.4 | -160.5 | 0 | 111.2 | A51 F52 R53 D57 I58 V59 | A51-K55 WeakPolarHBondContact O-CB 3.45Å; A51-K55 PolarHBondContact O-N 2.85Å; F52-K55 HydrophobicContact CD1-CD 4.44Å; F52-K55 PolarHBondContact O-N 3.36Å; R53-K55 VanDerWaalsContact C-N 3.31Å; R53-K55 PolarHBondContact O-N 2.85Å; K55-D57 PolarHBondContact O-N 3.42Å; K55-I58 PolarHBondContact O-N 3.12Å; K55-V59 VanDerWaalsContact O-CG2 3.29Å; K55-V59 WeakPolarHBondContact O-CG2 3.29Å; K55-V59 PolarHBondContact O-N 3.23Å |
| 56 | D | 86 | Confident | 76.4 | Confident | 80 Ų | 80 | 106 Ų | 106 | 43% | 0.428 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.4 | -36 | 178 | -87.2 | 6.3 | 0 | 0 | 0 | 112.7 | F52 R53 V59 N60 | F52-D56 PolarHBondContact O-N 3.28Å; R53-D56 PolarHBondContact O-N 2.93Å; D56-V59 PolarHBondContact O-N 3.12Å; D56-N60 WeakPolarHBondContact O-CB 3.42Å; D56-N60 VanDerWaalsContact O-CG 3.31Å; D56-N60 PolarHBondContact O-N 3.48Å; D56-N60 PolarHBondContact O-ND2 3.09Å; D56-N60 VanDerWaalsContact O-ND2 3.12Å |
| 57 | D | 82.1 | Confident | 75.2 | Confident | 102 Ų | 102 | 109.6 Ų | 109.6 | 55% | 0.545 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -65.8 | -38.5 | 174.4 | -77.2 | -21.1 | 0 | 0 | 0 | 112.4 | R53 I54 K55 S61 | R53-D57 WeakPolarHBondContact O-CB 3.31Å; R53-D57 PolarHBondContact O-N 3.25Å; I54-D57 PolarHBondContact O-N 3.43Å; K55-D57 PolarHBondContact O-N 3.42Å; D57-S61 WeakPolarHBondContact O-CB 3.32Å; D57-S61 PolarHBondContact O-N 3.2Å; D57-S61 PolarHBondContact O-OG 2.96Å |
| 58 | I | 80.2 | Confident | 73.9 | Confident | 96 Ų | 96 | 112.5 Ų | 112.5 | 49% | 0.492 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -66.5 | -45.4 | 174.5 | -69.7 | 168.5 | 0 | 0 | 0 | 110.6 | I54 K55 S61 L62 | I54-I58 HydrophobicContact CG2-CD1 3.87Å; I54-I58 VanDerWaalsContact O-CG1 3.28Å; I54-I58 WeakPolarHBondContact O-CG1 3.41Å; I54-I58 PolarHBondContact O-N 3.42Å; K55-I58 PolarHBondContact O-N 3.12Å; I58-S61 PolarHBondContact O-N 2.84Å; I58-L62 HydrophobicContact CG2-CD1 3.94Å; I58-L62 PolarHBondContact O-N 3.27Å |
| 59 | V | 79.4 | Confident | 72.6 | Confident | 63 Ų | 63 | 110.8 Ų | 110.8 | 38% | 0.382 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -61.5 | -46.4 | 178.2 | 171 | 0 | 0 | 0 | 0 | 110.7 | K55 D56 S61 L62 Q63 | K55-V59 VanDerWaalsContact O-CG2 3.29Å; K55-V59 WeakPolarHBondContact O-CG2 3.29Å; K55-V59 PolarHBondContact O-N 3.23Å; D56-V59 PolarHBondContact O-N 3.12Å; V59-S61 VanDerWaalsContact C-N 3.29Å; V59-S61 PolarHBondContact O-N 3.13Å; V59-L62 PolarHBondContact O-N 3.4Å; V59-Q63 WeakPolarHBondContact O-CB 3.48Å; V59-Q63 PolarHBondContact O-N 2.95Å |
| 60 | N | 72.8 | Confident | 71.6 | Confident | 88 Ų | 88 | 107.3 Ų | 107.3 | 47% | 0.471 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -61.9 | -35 | 177.1 | -79.1 | -37.9 | 0 | 0 | 0 | 112.9 | D56 K64 | D56-N60 WeakPolarHBondContact O-CB 3.42Å; D56-N60 VanDerWaalsContact O-CG 3.31Å; D56-N60 PolarHBondContact O-N 3.48Å; D56-N60 PolarHBondContact O-ND2 3.09Å; D56-N60 VanDerWaalsContact O-ND2 3.12Å; N60-K64 WeakPolarHBondContact O-CG 3.4Å; N60-K64 PolarHBondContact O-N 3.38Å |
| 61 | S | 68.8 | Low | 70.7 | Confident | 75 Ų | 75 | 104.2 Ų | 104.2 | 52% | 0.524 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -72.8 | -40.5 | 178.1 | -63.5 | 0 | 0 | 0 | 0 | 112.7 | D57 I58 V59 K64 M65 | D57-S61 WeakPolarHBondContact O-CB 3.32Å; D57-S61 PolarHBondContact O-N 3.2Å; D57-S61 PolarHBondContact O-OG 2.96Å; I58-S61 PolarHBondContact O-N 2.84Å; V59-S61 VanDerWaalsContact C-N 3.29Å; V59-S61 PolarHBondContact O-N 3.13Å; S61-K64 PolarHBondContact O-N 3.22Å; S61-M65 PolarHBondContact O-N 3.43Å |
| 62 | L | 65.9 | Low | 70.4 | Confident | 98 Ų | 98 | 105.7 Ų | 105.7 | 51% | 0.513 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -65.4 | -41.3 | 175.3 | -79.6 | 164.4 | 0 | 0 | 0 | 111.9 | I58 V59 K64 M65 Q66 | I58-L62 HydrophobicContact CG2-CD1 3.94Å; I58-L62 PolarHBondContact O-N 3.27Å; V59-L62 PolarHBondContact O-N 3.4Å; L62-K64 VanDerWaalsContact C-N 3.32Å; L62-K64 PolarHBondContact O-N 3.07Å; L62-M65 HydrophobicContact CD2-CE 3.88Å; L62-M65 PolarHBondContact O-N 3.07Å; L62-M65 VanDerWaalsContact O-N 3.16Å; L62-Q66 PolarHBondContact O-N 2.92Å; L62-Q66 VanDerWaalsContact O-N 3.12Å |
| 63 | Q | 63.9 | Low | 70 | Confident | 118 Ų | 118 | 108.5 Ų | 108.5 | 55% | 0.551 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -68.2 | -32 | 179.7 | -158.2 | 152.4 | 10.4 | 0 | 0 | 112.4 | V59 N67 | V59-Q63 WeakPolarHBondContact O-CB 3.48Å; V59-Q63 PolarHBondContact O-N 2.95Å; Q63-N67 PolarHBondContact O-N 3.01Å |
| 64 | K | 59.8 | Low | 69.8 | Low | 153 Ų | 153 | 105.6 Ų | 105.6 | 67% | 0.665 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -70.1 | -30.7 | 171 | -78.3 | 178.1 | -179.1 | 173.9 | 0 | 113.5 | N60 S61 L62 | N60-K64 WeakPolarHBondContact O-CG 3.4Å; N60-K64 PolarHBondContact O-N 3.38Å; S61-K64 PolarHBondContact O-N 3.22Å; L62-K64 VanDerWaalsContact C-N 3.32Å; L62-K64 PolarHBondContact O-N 3.07Å |
| 65 | M | 56.5 | Low | 69.7 | Low | 134 Ų | 134 | 104.3 Ų | 104.3 | 66% | 0.66 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -72.9 | -40.6 | 175 | -88.3 | -166 | -48.6 | 0 | 0 | 112.7 | S61 L62 N67 K68 | S61-M65 PolarHBondContact O-N 3.43Å; L62-M65 HydrophobicContact CD2-CE 3.88Å; L62-M65 PolarHBondContact O-N 3.07Å; L62-M65 VanDerWaalsContact O-N 3.16Å; M65-N67 PolarHBondContact O-N 2.95Å; M65-K68 PolarHBondContact O-N 3.44Å |
| 66 | Q | 55.9 | Low | 69.6 | Low | 174 Ų | 174 | 106.4 Ų | 106.4 | 81% | 0.813 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -62.6 | -28.8 | 175.9 | -83.7 | -150.5 | -80.3 | 0 | 0 | 113 | L62 | L62-Q66 PolarHBondContact O-N 2.92Å; L62-Q66 VanDerWaalsContact O-N 3.12Å |
| 67 | N | 55.2 | Low | 69.5 | Low | 132 Ų | 132 | 107 Ų | 107 | 71% | 0.706 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | 2.5 | -176.9 | -71.5 | -18.1 | 0 | 0 | 0 | 115 | Q63 M65 G69 | Q63-N67 PolarHBondContact O-N 3.01Å; M65-N67 PolarHBondContact O-N 2.95Å; N67-G69 VanDerWaalsContact C-N 3.32Å; N67-G69 PolarHBondContact O-N 3.3Å |
| 68 | K | 54.5 | Low | 69.7 | Low | 178 Ų | 178 | 108.5 Ų | 108.5 | 77% | 0.774 | 57% | 0.571 | S | S | * | * | trans | -88.3 | 60.3 | 174.3 | -74.5 | -174.2 | -178.5 | -175.9 | 0 | 112.5 | M65 G70 | M65-K68 PolarHBondContact O-N 3.44Å; K68-G70 PolarHBondContact O-N 3.18Å | ||
| 69 | G | 57.7 | Low | 70.3 | Confident | 41 Ų | 41 | 109 Ų | 109 | 42% | 0.423 | 57% | 0.573 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -76.7 | 11.1 | 172 | 0 | 0 | 0 | 0 | 0 | 115.7 | N67 R73 | N67-G69 VanDerWaalsContact C-N 3.32Å; N67-G69 PolarHBondContact O-N 3.3Å; G69-R73 VanDerWaalsContact O-CB 3.3Å; G69-R73 WeakPolarHBondContact O-CB 3.49Å; G69-R73 PolarHBondContact O-N 3.41Å |
| 70 | G | 61 | Low | 70.9 | Confident | 53 Ų | 53 | 111.7 Ų | 111.7 | 55% | 0.546 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -71.9 | -42.3 | -174.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | K68 R73 L74 | K68-G70 PolarHBondContact O-N 3.18Å; G70-R73 PolarHBondContact O-N 3.17Å; G70-L74 PolarHBondContact O-N 3.39Å; G70-L74 VanDerWaalsContact O-N 3.14Å |
| 71 | G | 65.8 | Low | 71.9 | Confident | 57 Ų | 57 | 111.3 Ų | 111.3 | 59% | 0.588 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -68.1 | -40.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | R73 L74 A75 | G71-R73 VanDerWaalsContact C-N 3.3Å; G71-R73 PolarHBondContact O-N 3Å; G71-L74 PolarHBondContact O-N 3.38Å; G71-A75 PolarHBondContact O-N 3.48Å |
| 72 | D | 75.4 | Confident | 73.1 | Confident | 89 Ų | 89 | 112.8 Ų | 112.8 | 48% | 0.476 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -62.4 | -38.1 | 175.1 | -161.6 | 45.3 | 0 | 0 | 0 | 111.3 | R76 | D72-R76 WeakPolarHBondContact O-CB 3.48Å; D72-R76 VanDerWaalsContact O-CG 3.3Å; D72-R76 WeakPolarHBondContact O-CG 3.5Å; D72-R76 PolarHBondContact O-N 3Å; D72-R76 IonicContact OD2-CZ 3.65Å; D72-R76 IonicContact OD2-NE 3.73Å; D72-R76 PolarHBondContact OD2-NE 3.19Å; D72-R76 IonicContact OD2-NH2 3.87Å; D72-R76 PolarHBondContact OD2-NH2 3.43Å |
| 73 | R | 77.2 | Confident | 74.5 | Confident | 182 Ų | 182 | 112.5 Ų | 112.5 | 69% | 0.687 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -66.2 | -41.5 | 175 | -174.1 | 171.1 | 176.2 | 173.4 | -1.8 | 113.2 | G69 G70 G71 R76 L77 | G69-R73 VanDerWaalsContact O-CB 3.3Å; G69-R73 WeakPolarHBondContact O-CB 3.49Å; G69-R73 PolarHBondContact O-N 3.41Å; G70-R73 PolarHBondContact O-N 3.17Å; G71-R73 VanDerWaalsContact C-N 3.3Å; G71-R73 PolarHBondContact O-N 3Å; R73-R76 PolarHBondContact O-N 2.98Å; R73-L77 PolarHBondContact O-N 3.34Å |
| 74 | L | 78.3 | Confident | 76 | Confident | 112 Ų | 112 | 113.2 Ų | 113.2 | 59% | 0.586 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -67.9 | -40.8 | 178.5 | -156.9 | 79.9 | 0 | 0 | 0 | 111.6 | G70 G71 L77 F78 | G70-L74 PolarHBondContact O-N 3.39Å; G70-L74 VanDerWaalsContact O-N 3.14Å; G71-L74 PolarHBondContact O-N 3.38Å; L74-L77 PolarHBondContact O-N 3.41Å; L74-F78 PolarHBondContact O-N 3.14Å |
| 75 | A | 82.1 | Confident | 77.8 | Confident | 59 Ų | 59 | 109 Ų | 109 | 49% | 0.488 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63 | -40 | 174 | 0 | 0 | 0 | 0 | 0 | 112.1 | G71 F78 L79 | G71-A75 PolarHBondContact O-N 3.48Å; A75-F78 PolarHBondContact O-N 3.11Å; A75-L79 WeakPolarHBondContact O-CB 3.46Å; A75-L79 PolarHBondContact O-N 2.86Å |
| 76 | R | 83.4 | Confident | 79.7 | Confident | 150 Ų | 150 | 107.2 Ų | 107.2 | 57% | 0.566 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -60.9 | -45.5 | 172.6 | -77.7 | 179.1 | -162.8 | -166.8 | 5.9 | 112.7 | D72 R73 F78 L79 E80 | D72-R76 WeakPolarHBondContact O-CB 3.48Å; D72-R76 VanDerWaalsContact O-CG 3.3Å; D72-R76 WeakPolarHBondContact O-CG 3.5Å; D72-R76 PolarHBondContact O-N 3Å; D72-R76 IonicContact OD2-CZ 3.65Å; D72-R76 IonicContact OD2-NE 3.73Å; D72-R76 PolarHBondContact OD2-NE 3.19Å; D72-R76 IonicContact OD2-NH2 3.87Å; D72-R76 PolarHBondContact OD2-NH2 3.43Å; R73-R76 PolarHBondContact O-N 2.98Å; R76-F78 PolarHBondContact O-N 2.99Å; R76-L79 PolarHBondContact O-N 3.13Å; R76-E80 WeakPolarHBondContact O-CB 3.37Å; R76-E80 WeakPolarHBondContact O-CG 3.39Å; R76-E80 PolarHBondContact O-N 3.28Å |
| 77 | L | 84.2 | Confident | 81.6 | Confident | 92 Ų | 92 | 102 Ų | 102 | 48% | 0.482 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.7 | -42.9 | 177.3 | -75.6 | 171.7 | 0 | 0 | 0 | 112 | R73 L74 L79 E80 E81 | R73-L77 PolarHBondContact O-N 3.34Å; L74-L77 PolarHBondContact O-N 3.41Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L77-E80 PolarHBondContact O-N 3.24Å; L77-E81 WeakPolarHBondContact O-CB 3.41Å; L77-E81 PolarHBondContact O-N 3.5Å |
| 78 | F | 86.7 | Confident | 83.6 | Confident | 135 Ų | 135 | 98 Ų | 98 | 59% | 0.592 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.3 | -42.6 | 173.4 | -108 | -78.5 | 0 | 0 | 0 | 111.9 | L74 A75 R76 E81 H82 | L74-F78 PolarHBondContact O-N 3.14Å; A75-F78 PolarHBondContact O-N 3.11Å; R76-F78 PolarHBondContact O-N 2.99Å; F78-E81 PolarHBondContact O-N 3.05Å; F78-H82 WeakPolarHBondContact O-CB 3.42Å; F78-H82 PolarHBondContact O-CD2 3.48Å; F78-H82 PolarHBondContact O-N 3.41Å |
| 79 | L | 91.5 | Very high | 85.6 | Confident | 105 Ų | 105 | 94.3 Ų | 94.3 | 55% | 0.55 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.6 | -44.7 | 178.1 | -176.5 | 63.4 | 0 | 0 | 0 | 111.8 | A75 R76 L77 E81 H82 I83 | A75-L79 WeakPolarHBondContact O-CB 3.46Å; A75-L79 PolarHBondContact O-N 2.86Å; R76-L79 PolarHBondContact O-N 3.13Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L79-E81 VanDerWaalsContact C-N 3.33Å; L79-E81 PolarHBondContact O-N 3.05Å; L79-H82 PolarHBondContact O-N 3.02Å; L79-I83 HydrophobicContact CD1-CD1 4.3Å; L79-I83 HydrophobicContact CD1-CG1 4.49Å; L79-I83 HydrophobicContact CG-CD1 3.94Å; L79-I83 WeakPolarHBondContact O-CB 3.22Å; L79-I83 VanDerWaalsContact O-CG1 3.23Å; L79-I83 WeakPolarHBondContact O-CG1 3.4Å; L79-I83 PolarHBondContact O-N 3.22Å |
| 80 | E | 91.6 | Very high | 87.5 | Confident | 120 Ų | 120 | 96.4 Ų | 96.4 | 56% | 0.561 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -59.3 | -44.1 | 175.2 | -77.6 | 173.2 | -172.5 | 0 | 0 | 111.2 | R76 L77 I83 R84 | R76-E80 WeakPolarHBondContact O-CB 3.37Å; R76-E80 WeakPolarHBondContact O-CG 3.39Å; R76-E80 PolarHBondContact O-N 3.28Å; L77-E80 PolarHBondContact O-N 3.24Å; E80-I83 PolarHBondContact O-N 3.2Å; E80-R84 WeakPolarHBondContact O-CB 3.21Å; E80-R84 PolarHBondContact O-N 2.92Å |
| 81 | E | 93.8 | Very high | 89.2 | Confident | 80 Ų | 80 | 99.8 Ų | 99.8 | 37% | 0.374 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.2 | -41.2 | 176.9 | 179.2 | 56.9 | -162.7 | 0 | 0 | 112 | L77 F78 L79 R84 N85 | L77-E81 WeakPolarHBondContact O-CB 3.41Å; L77-E81 PolarHBondContact O-N 3.5Å; F78-E81 PolarHBondContact O-N 3.05Å; L79-E81 VanDerWaalsContact C-N 3.33Å; L79-E81 PolarHBondContact O-N 3.05Å; E81-R84 VanDerWaalsContact CD-NH2 3.31Å; E81-R84 PolarHBondContact O-N 3.23Å; E81-R84 IonicContact OE1-CZ 3.72Å; E81-R84 IonicContact OE1-NE 3.62Å; E81-R84 IonicContact OE1-NH2 3.08Å; E81-R84 PolarHBondContact OE1-NH2 3.08Å; E81-R84 IonicContact OE2-CZ 2.7Å; E81-R84 IonicContact OE2-NE 3.91Å; E81-R84 PolarHBondContact OE2-NE 3.24Å; E81-R84 IonicContact OE2-NH2 3.34Å; E81-R84 PolarHBondContact OE2-NH2 3.1Å; E81-R84 VanDerWaalsContact OE2-NH2 3.16Å; E81-N85 WeakPolarHBondContact O-CB 3.4Å; E81-N85 VanDerWaalsContact O-CG 3.31Å; E81-N85 PolarHBondContact O-N 3.39Å; E81-N85 PolarHBondContact O-ND2 3.15Å; E81-N85 PolarHBondContact OE1-ND2 2.82Å; E81-N85 PolarHBondContact OE1-OD1 3.13Å |
| 82 | H | 95 | Very high | 90.8 | Very high | 106 Ų | 106 | 101.1 Ų | 101.1 | 49% | 0.491 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61 | -45.7 | 172 | -89.8 | -70.6 | 0 | 0 | 0 | 111.8 | F78 L79 R84 N85 I86 | F78-H82 WeakPolarHBondContact O-CB 3.42Å; F78-H82 PolarHBondContact O-CD2 3.48Å; F78-H82 PolarHBondContact O-N 3.41Å; L79-H82 PolarHBondContact O-N 3.02Å; H82-R84 VanDerWaalsContact C-N 3.33Å; H82-R84 PolarHBondContact O-N 3.45Å; H82-N85 PolarHBondContact O-N 3.45Å; H82-I86 WeakPolarHBondContact O-CB 3.34Å; H82-I86 WeakPolarHBondContact O-CD1 3.46Å; H82-I86 WeakPolarHBondContact O-CG1 3.33Å; H82-I86 PolarHBondContact O-N 2.96Å |
| 83 | I | 95.8 | Very high | 91.8 | Very high | 92 Ų | 92 | 101.3 Ų | 101.3 | 47% | 0.472 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.3 | -43.7 | 176.7 | -71.3 | 166.5 | 0 | 0 | 0 | 110.3 | L79 E80 I86 T87 | L79-I83 HydrophobicContact CD1-CD1 4.3Å; L79-I83 HydrophobicContact CD1-CG1 4.49Å; L79-I83 HydrophobicContact CG-CD1 3.94Å; L79-I83 WeakPolarHBondContact O-CB 3.22Å; L79-I83 VanDerWaalsContact O-CG1 3.23Å; L79-I83 WeakPolarHBondContact O-CG1 3.4Å; L79-I83 PolarHBondContact O-N 3.22Å; E80-I83 PolarHBondContact O-N 3.2Å; I83-I86 PolarHBondContact O-N 3.07Å; I83-T87 VanDerWaalsContact O-CB 3.3Å; I83-T87 WeakPolarHBondContact O-CB 3.47Å; I83-T87 PolarHBondContact O-N 3.28Å; I83-T87 PolarHBondContact O-OG1 2.89Å |
| 84 | R | 95 | Very high | 92.8 | Very high | 134 Ų | 134 | 96.7 Ų | 96.7 | 51% | 0.506 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.6 | -46.2 | 177.8 | -167.4 | -170.9 | 68.3 | 69.9 | 7.2 | 111.1 | E80 E81 H82 T87 A88 | E80-R84 WeakPolarHBondContact O-CB 3.21Å; E80-R84 PolarHBondContact O-N 2.92Å; E81-R84 VanDerWaalsContact CD-NH2 3.31Å; E81-R84 PolarHBondContact O-N 3.23Å; E81-R84 IonicContact OE1-CZ 3.72Å; E81-R84 IonicContact OE1-NE 3.62Å; E81-R84 IonicContact OE1-NH2 3.08Å; E81-R84 PolarHBondContact OE1-NH2 3.08Å; E81-R84 IonicContact OE2-CZ 2.7Å; E81-R84 IonicContact OE2-NE 3.91Å; E81-R84 PolarHBondContact OE2-NE 3.24Å; E81-R84 IonicContact OE2-NH2 3.34Å; E81-R84 PolarHBondContact OE2-NH2 3.1Å; E81-R84 VanDerWaalsContact OE2-NH2 3.16Å; H82-R84 VanDerWaalsContact C-N 3.33Å; H82-R84 PolarHBondContact O-N 3.45Å; R84-T87 PolarHBondContact O-N 3.33Å; R84-A88 WeakPolarHBondContact O-CB 3.48Å; R84-A88 PolarHBondContact O-N 2.84Å |
| 85 | N | 96.7 | Very high | 93.8 | Very high | 63 Ų | 63 | 97.5 Ų | 97.5 | 34% | 0.337 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65.7 | -45.1 | 177.6 | -73.5 | -28.4 | 0 | 0 | 0 | 111.9 | E81 H82 T87 A88 I89 | E81-N85 WeakPolarHBondContact O-CB 3.4Å; E81-N85 VanDerWaalsContact O-CG 3.31Å; E81-N85 PolarHBondContact O-N 3.39Å; E81-N85 PolarHBondContact O-ND2 3.15Å; E81-N85 PolarHBondContact OE1-ND2 2.82Å; E81-N85 PolarHBondContact OE1-OD1 3.13Å; H82-N85 PolarHBondContact O-N 3.45Å; N85-T87 VanDerWaalsContact C-N 3.32Å; N85-T87 PolarHBondContact O-N 3.2Å; N85-A88 PolarHBondContact O-N 3.48Å; N85-I89 VanDerWaalsContact O-CG1 3.27Å; N85-I89 WeakPolarHBondContact O-CG1 3.46Å; N85-I89 PolarHBondContact O-N 3.3Å |
| 86 | I | 97.2 | Very high | 94.5 | Very high | 98 Ų | 98 | 97.9 Ų | 97.9 | 50% | 0.503 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -58.6 | -45.4 | 173.8 | -70.4 | 165.4 | 0 | 0 | 0 | 110.3 | H82 I83 A88 I89 V90 | H82-I86 WeakPolarHBondContact O-CB 3.34Å; H82-I86 WeakPolarHBondContact O-CD1 3.46Å; H82-I86 WeakPolarHBondContact O-CG1 3.33Å; H82-I86 PolarHBondContact O-N 2.96Å; I83-I86 PolarHBondContact O-N 3.07Å; I86-A88 VanDerWaalsContact C-N 3.35Å; I86-A88 PolarHBondContact O-N 3.37Å; I86-I89 PolarHBondContact O-N 3.45Å; I86-V90 HydrophobicContact CG2-CG2 4.22Å; I86-V90 WeakPolarHBondContact O-CB 3.34Å; I86-V90 VanDerWaalsContact O-CG2 3.28Å; I86-V90 WeakPolarHBondContact O-CG2 3.46Å; I86-V90 PolarHBondContact O-N 3.06Å |
| 87 | T | 95.4 | Very high | 95.2 | Very high | 63 Ų | 63 | 94.8 Ų | 94.8 | 39% | 0.387 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.8 | -41.8 | 179.1 | -58 | 0 | 0 | 0 | 0 | 111.6 | I83 R84 N85 V90 K91 | I83-T87 VanDerWaalsContact O-CB 3.3Å; I83-T87 WeakPolarHBondContact O-CB 3.47Å; I83-T87 PolarHBondContact O-N 3.28Å; I83-T87 PolarHBondContact O-OG1 2.89Å; R84-T87 PolarHBondContact O-N 3.33Å; N85-T87 VanDerWaalsContact C-N 3.32Å; N85-T87 PolarHBondContact O-N 3.2Å; T87-V90 PolarHBondContact O-N 3.18Å; T87-K91 HydrophobicContact CG2-CD 4.41Å; T87-K91 WeakPolarHBondContact O-CB 3.38Å; T87-K91 WeakPolarHBondContact O-CG 3.39Å; T87-K91 PolarHBondContact O-N 3.19Å |
| 88 | A | 96.6 | Very high | 95.9 | Very high | 49 Ų | 49 | 95.3 Ų | 95.3 | 41% | 0.405 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -63.2 | -43.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | R84 N85 I86 K91 Q92 | R84-A88 WeakPolarHBondContact O-CB 3.48Å; R84-A88 PolarHBondContact O-N 2.84Å; N85-A88 PolarHBondContact O-N 3.48Å; I86-A88 VanDerWaalsContact C-N 3.35Å; I86-A88 PolarHBondContact O-N 3.37Å; A88-K91 PolarHBondContact O-N 2.94Å; A88-Q92 WeakPolarHBondContact O-CB 3.5Å; A88-Q92 PolarHBondContact O-N 3.08Å |
| 89 | I | 97.6 | Very high | 96.4 | Very high | 100 Ų | 100 | 92.7 Ų | 92.7 | 51% | 0.513 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -61 | -48.8 | 175.1 | -69.3 | 164.1 | 0 | 0 | 0 | 110.6 | N85 I86 K91 Q92 L93 | N85-I89 VanDerWaalsContact O-CG1 3.27Å; N85-I89 WeakPolarHBondContact O-CG1 3.46Å; N85-I89 PolarHBondContact O-N 3.3Å; I86-I89 PolarHBondContact O-N 3.45Å; I89-K91 VanDerWaalsContact C-N 3.34Å; I89-K91 PolarHBondContact O-N 3.5Å; I89-Q92 PolarHBondContact O-N 3.4Å; I89-Q92 VanDerWaalsContact O-N 3.17Å; I89-L93 HydrophobicContact CG2-CD1 3.85Å; I89-L93 HydrophobicContact CG2-CG 4.26Å; I89-L93 WeakPolarHBondContact O-CB 3.21Å; I89-L93 WeakPolarHBondContact O-CG 3.44Å; I89-L93 PolarHBondContact O-N 2.91Å |
| 90 | V | 97.9 | Very high | 96.7 | Very high | 85 Ų | 85 | 92.1 Ų | 92.1 | 52% | 0.515 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -61.7 | -42.1 | 179.1 | 170.9 | 0 | 0 | 0 | 0 | 111.2 | I86 T87 Q92 L93 N94 | I86-V90 HydrophobicContact CG2-CG2 4.22Å; I86-V90 WeakPolarHBondContact O-CB 3.34Å; I86-V90 VanDerWaalsContact O-CG2 3.28Å; I86-V90 WeakPolarHBondContact O-CG2 3.46Å; I86-V90 PolarHBondContact O-N 3.06Å; T87-V90 PolarHBondContact O-N 3.18Å; V90-Q92 VanDerWaalsContact C-N 3.34Å; V90-L93 PolarHBondContact O-N 3.48Å; V90-N94 WeakPolarHBondContact O-CB 3.45Å; V90-N94 PolarHBondContact O-N 2.89Å |
| 91 | K | 97.1 | Very high | 97 | Very high | 124 Ų | 124 | 91.3 Ų | 91.3 | 54% | 0.539 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -62.6 | -41.6 | 174.7 | -78.5 | -178.4 | 177.9 | -178.5 | 0 | 112 | T87 A88 I89 N94 R95 | T87-K91 HydrophobicContact CG2-CD 4.41Å; T87-K91 WeakPolarHBondContact O-CB 3.38Å; T87-K91 WeakPolarHBondContact O-CG 3.39Å; T87-K91 PolarHBondContact O-N 3.19Å; A88-K91 PolarHBondContact O-N 2.94Å; I89-K91 VanDerWaalsContact C-N 3.34Å; I89-K91 PolarHBondContact O-N 3.5Å; K91-N94 PolarHBondContact O-N 3.43Å; K91-R95 WeakPolarHBondContact O-CG 3.3Å; K91-R95 PolarHBondContact O-N 2.86Å; K91-R95 VanDerWaalsContact O-N 3.11Å |
| 92 | Q | 97.8 | Very high | 97.2 | Very high | 86 Ų | 86 | 92.2 Ų | 92.2 | 40% | 0.402 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64.7 | -48.4 | 176.8 | -174 | 57.1 | 40.3 | 0 | 0 | 110.8 | A88 I89 V90 N94 R95 D96 | A88-Q92 WeakPolarHBondContact O-CB 3.5Å; A88-Q92 PolarHBondContact O-N 3.08Å; I89-Q92 PolarHBondContact O-N 3.4Å; I89-Q92 VanDerWaalsContact O-N 3.17Å; V90-Q92 VanDerWaalsContact C-N 3.34Å; Q92-N94 VanDerWaalsContact C-N 3.27Å; Q92-N94 PolarHBondContact O-N 2.91Å; Q92-R95 PolarHBondContact O-N 3.39Å; Q92-R95 VanDerWaalsContact O-N 3.11Å; Q92-D96 PolarHBondContact NE2-OD1 3.41Å; Q92-D96 VanDerWaalsContact O-CG 3.23Å; Q92-D96 PolarHBondContact O-N 2.89Å |
| 93 | L | 98 | Very high | 97.4 | Very high | 93 Ų | 93 | 92.8 Ų | 92.8 | 49% | 0.487 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -56.1 | -41.6 | 175.3 | -73.1 | 172.7 | 0 | 0 | 0 | 111.8 | I89 V90 D96 I97 | I89-L93 HydrophobicContact CG2-CD1 3.85Å; I89-L93 HydrophobicContact CG2-CG 4.26Å; I89-L93 WeakPolarHBondContact O-CB 3.21Å; I89-L93 WeakPolarHBondContact O-CG 3.44Å; I89-L93 PolarHBondContact O-N 2.91Å; V90-L93 PolarHBondContact O-N 3.48Å; L93-D96 PolarHBondContact O-N 3.46Å; L93-I97 WeakPolarHBondContact O-CB 3.47Å; L93-I97 WeakPolarHBondContact O-CD1 3.45Å; L93-I97 WeakPolarHBondContact O-CG1 3.42Å; L93-I97 PolarHBondContact O-N 2.63Å |
| 94 | N | 97.8 | Very high | 97.5 | Very high | 84 Ų | 84 | 92 Ų | 92 | 45% | 0.449 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -63.8 | -43.7 | 177.4 | -167.8 | 64.4 | 0 | 0 | 0 | 112.1 | V90 K91 Q92 I97 E98 | V90-N94 WeakPolarHBondContact O-CB 3.45Å; V90-N94 PolarHBondContact O-N 2.89Å; K91-N94 PolarHBondContact O-N 3.43Å; Q92-N94 VanDerWaalsContact C-N 3.27Å; Q92-N94 PolarHBondContact O-N 2.91Å; N94-I97 PolarHBondContact O-N 3.33Å; N94-E98 PolarHBondContact ND2-OE1 3.35Å; N94-E98 WeakPolarHBondContact O-CG 3.39Å; N94-E98 PolarHBondContact O-N 3.45Å |
| 95 | R | 97.8 | Very high | 97.6 | Very high | 130 Ų | 130 | 91.7 Ų | 91.7 | 49% | 0.491 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63 | -42 | 173.9 | -67.9 | 179.9 | -161.1 | 129.3 | -2.8 | 111.8 | K91 Q92 I97 E98 V99 | K91-R95 WeakPolarHBondContact O-CG 3.3Å; K91-R95 PolarHBondContact O-N 2.86Å; K91-R95 VanDerWaalsContact O-N 3.11Å; Q92-R95 PolarHBondContact O-N 3.39Å; Q92-R95 VanDerWaalsContact O-N 3.11Å; R95-I97 VanDerWaalsContact C-N 3.31Å; R95-I97 PolarHBondContact O-N 3.16Å; R95-E98 PolarHBondContact O-N 2.92Å; R95-V99 WeakPolarHBondContact O-CG2 3.33Å; R95-V99 PolarHBondContact O-N 2.8Å |
| 96 | D | 98.3 | Very high | 97.7 | Very high | 67 Ų | 67 | 90.8 Ų | 90.8 | 36% | 0.358 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -63.4 | -39.9 | 178 | -65.8 | -19.8 | 0 | 0 | 0 | 110.7 | Q92 L93 V99 L100 | Q92-D96 PolarHBondContact NE2-OD1 3.41Å; Q92-D96 VanDerWaalsContact O-CG 3.23Å; Q92-D96 PolarHBondContact O-N 2.89Å; L93-D96 PolarHBondContact O-N 3.46Å; D96-V99 PolarHBondContact O-N 2.78Å; D96-L100 VanDerWaalsContact O-CB 3.31Å; D96-L100 WeakPolarHBondContact O-CB 3.3Å; D96-L100 WeakPolarHBondContact O-CG 3.49Å; D96-L100 PolarHBondContact O-N 3.49Å |
| 97 | I | 98.1 | Very high | 97.7 | Very high | 84 Ų | 84 | 93.3 Ų | 93.3 | 43% | 0.431 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -62.2 | -45.9 | 173.7 | -71.3 | 164.8 | 0 | 0 | 0 | 110.9 | L93 N94 R95 L100 Q101 | L93-I97 WeakPolarHBondContact O-CB 3.47Å; L93-I97 WeakPolarHBondContact O-CD1 3.45Å; L93-I97 WeakPolarHBondContact O-CG1 3.42Å; L93-I97 PolarHBondContact O-N 2.63Å; N94-I97 PolarHBondContact O-N 3.33Å; R95-I97 VanDerWaalsContact C-N 3.31Å; R95-I97 PolarHBondContact O-N 3.16Å; I97-L100 PolarHBondContact O-N 3.38Å; I97-Q101 HydrophobicContact CG2-CG 4.34Å; I97-Q101 WeakPolarHBondContact O-CB 3.33Å; I97-Q101 VanDerWaalsContact O-CG 3.25Å; I97-Q101 WeakPolarHBondContact O-CG 3.28Å; I97-Q101 PolarHBondContact O-N 2.92Å |
| 98 | E | 98.1 | Very high | 97.8 | Very high | 104 Ų | 104 | 93.8 Ų | 93.8 | 49% | 0.486 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -60.2 | -45.9 | 177.2 | -74.2 | 168.3 | -166.9 | 0 | 0 | 111.5 | N94 R95 Q101 E102 | N94-E98 PolarHBondContact ND2-OE1 3.35Å; N94-E98 WeakPolarHBondContact O-CG 3.39Å; N94-E98 PolarHBondContact O-N 3.45Å; R95-E98 PolarHBondContact O-N 2.92Å; E98-Q101 PolarHBondContact O-N 2.8Å; E98-E102 PolarHBondContact O-N 3.06Å |
| 99 | V | 98 | Very high | 97.8 | Very high | 80 Ų | 80 | 97.1 Ų | 97.1 | 49% | 0.485 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61.9 | -45.8 | 176.1 | 171.2 | 0 | 0 | 0 | 0 | 110.9 | R95 D96 Q101 E102 Q103 | R95-V99 WeakPolarHBondContact O-CG2 3.33Å; R95-V99 PolarHBondContact O-N 2.8Å; D96-V99 PolarHBondContact O-N 2.78Å; V99-Q101 VanDerWaalsContact C-N 3.35Å; V99-Q101 PolarHBondContact O-N 3.42Å; V99-E102 PolarHBondContact O-N 2.92Å; V99-Q103 HydrophobicContact CG1-CG 4.48Å; V99-Q103 WeakPolarHBondContact O-CG 3.32Å; V99-Q103 PolarHBondContact O-N 2.85Å |
| 100 | L | 98.3 | Very high | 97.8 | Very high | 93 Ų | 93 | 98 Ų | 98 | 49% | 0.487 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.2 | -40.6 | 177.2 | -76.9 | 168.5 | 0 | 0 | 0 | 112 | D96 I97 Q103 I104 | D96-L100 VanDerWaalsContact O-CB 3.31Å; D96-L100 WeakPolarHBondContact O-CB 3.3Å; D96-L100 WeakPolarHBondContact O-CG 3.49Å; D96-L100 PolarHBondContact O-N 3.49Å; I97-L100 PolarHBondContact O-N 3.38Å; L100-Q103 PolarHBondContact O-N 3.25Å; L100-I104 WeakPolarHBondContact O-CB 3.31Å; L100-I104 VanDerWaalsContact O-CG1 3.22Å; L100-I104 WeakPolarHBondContact O-CG1 3.33Å; L100-I104 PolarHBondContact O-N 2.77Å |
| 101 | Q | 98 | Very high | 97.8 | Very high | 103 Ų | 103 | 97.5 Ų | 97.5 | 48% | 0.481 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.5 | -40.8 | 176.3 | -76.1 | 174.5 | -10.4 | 0 | 0 | 112.1 | I97 E98 V99 I104 R105 | I97-Q101 HydrophobicContact CG2-CG 4.34Å; I97-Q101 WeakPolarHBondContact O-CB 3.33Å; I97-Q101 VanDerWaalsContact O-CG 3.25Å; I97-Q101 WeakPolarHBondContact O-CG 3.28Å; I97-Q101 PolarHBondContact O-N 2.92Å; E98-Q101 PolarHBondContact O-N 2.8Å; V99-Q101 VanDerWaalsContact C-N 3.35Å; V99-Q101 PolarHBondContact O-N 3.42Å; Q101-I104 PolarHBondContact O-N 2.8Å; Q101-R105 WeakPolarHBondContact O-CB 3.46Å; Q101-R105 WeakPolarHBondContact O-CG 3.5Å; Q101-R105 PolarHBondContact O-N 2.93Å |
| 102 | E | 97.9 | Very high | 97.7 | Very high | 99 Ų | 99 | 100 Ų | 100 | 46% | 0.463 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.9 | -41.9 | 175 | -167.6 | 61.7 | -127.7 | 0 | 0 | 111.2 | E98 V99 I104 R105 A106 | E98-E102 PolarHBondContact O-N 3.06Å; V99-E102 PolarHBondContact O-N 2.92Å; E102-I104 PolarHBondContact O-N 3.36Å; E102-R105 PolarHBondContact O-N 3.4Å; E102-R105 IonicContact OE1-NH1 3.31Å; E102-R105 PolarHBondContact OE1-NH1 3.08Å; E102-R105 IonicContact OE2-CZ 3.43Å; E102-R105 IonicContact OE2-NH1 2.86Å; E102-R105 PolarHBondContact OE2-NH1 2.86Å; E102-R105 IonicContact OE2-NH2 2.69Å; E102-R105 PolarHBondContact OE2-NH2 3.03Å; E102-A106 WeakPolarHBondContact O-CB 3.3Å; E102-A106 PolarHBondContact O-N 2.77Å |
| 103 | Q | 98 | Very high | 97.7 | Very high | 117 Ų | 117 | 97.8 Ų | 97.8 | 55% | 0.547 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.8 | -42.4 | 174.4 | -73.5 | 177.1 | -0.1 | 0 | 0 | 112.4 | V99 L100 A106 R107 | V99-Q103 HydrophobicContact CG1-CG 4.48Å; V99-Q103 WeakPolarHBondContact O-CG 3.32Å; V99-Q103 PolarHBondContact O-N 2.85Å; L100-Q103 PolarHBondContact O-N 3.25Å; Q103-A106 PolarHBondContact O-N 3.43Å; Q103-R107 WeakPolarHBondContact O-CB 3.4Å; Q103-R107 PolarHBondContact O-N 2.8Å |
| 104 | I | 98.1 | Very high | 97.7 | Very high | 77 Ų | 77 | 97.6 Ų | 97.6 | 40% | 0.395 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.8 | -48.1 | 174.9 | -71.7 | 164.9 | 0 | 0 | 0 | 110 | L100 Q101 E102 A106 R107 D108 | L100-I104 WeakPolarHBondContact O-CB 3.31Å; L100-I104 VanDerWaalsContact O-CG1 3.22Å; L100-I104 WeakPolarHBondContact O-CG1 3.33Å; L100-I104 PolarHBondContact O-N 2.77Å; Q101-I104 PolarHBondContact O-N 2.8Å; E102-I104 PolarHBondContact O-N 3.36Å; I104-A106 PolarHBondContact O-N 2.83Å; I104-R107 PolarHBondContact O-N 3.41Å; I104-D108 WeakPolarHBondContact CG2-OD2 3.42Å; I104-D108 WeakPolarHBondContact O-CB 3.49Å; I104-D108 PolarHBondContact O-N 3.22Å |
| 105 | R | 97.7 | Very high | 97.6 | Very high | 127 Ų | 127 | 97.2 Ų | 97.2 | 48% | 0.479 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -58.7 | -45.6 | 176.6 | -81.3 | -171.6 | -84.3 | 127.9 | -0.3 | 112.2 | Q101 E102 D108 N109 | Q101-R105 WeakPolarHBondContact O-CB 3.46Å; Q101-R105 WeakPolarHBondContact O-CG 3.5Å; Q101-R105 PolarHBondContact O-N 2.93Å; E102-R105 PolarHBondContact O-N 3.4Å; E102-R105 IonicContact OE1-NH1 3.31Å; E102-R105 PolarHBondContact OE1-NH1 3.08Å; E102-R105 IonicContact OE2-CZ 3.43Å; E102-R105 IonicContact OE2-NH1 2.86Å; E102-R105 PolarHBondContact OE2-NH1 2.86Å; E102-R105 IonicContact OE2-NH2 2.69Å; E102-R105 PolarHBondContact OE2-NH2 3.03Å; R105-D108 PolarHBondContact O-N 3.37Å; R105-N109 WeakPolarHBondContact O-CB 3.3Å; R105-N109 VanDerWaalsContact O-CG 3.3Å; R105-N109 PolarHBondContact O-N 2.81Å; R105-N109 PolarHBondContact O-ND2 3.37Å |
| 106 | A | 97.5 | Very high | 97.6 | Very high | 43 Ų | 43 | 93.8 Ų | 93.8 | 36% | 0.355 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.1 | -46.2 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | E102 Q103 I104 D108 N109 I110 | E102-A106 WeakPolarHBondContact O-CB 3.3Å; E102-A106 PolarHBondContact O-N 2.77Å; Q103-A106 PolarHBondContact O-N 3.43Å; I104-A106 PolarHBondContact O-N 2.83Å; A106-D108 PolarHBondContact O-N 3.35Å; A106-N109 PolarHBondContact O-N 3.18Å; A106-I110 WeakPolarHBondContact O-CG1 3.34Å; A106-I110 PolarHBondContact O-N 2.79Å; A106-I110 VanDerWaalsContact O-N 3.1Å |
| 107 | R | 97.4 | Very high | 97.6 | Very high | 151 Ų | 151 | 93.5 Ų | 93.5 | 57% | 0.57 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -61 | -44.5 | 176.4 | -175.8 | -162.2 | 68.2 | -168.3 | -2.5 | 111.8 | Q103 I104 I110 S111 | Q103-R107 WeakPolarHBondContact O-CB 3.4Å; Q103-R107 PolarHBondContact O-N 2.8Å; I104-R107 PolarHBondContact O-N 3.41Å; R107-I110 PolarHBondContact O-N 3.25Å; R107-S111 WeakPolarHBondContact O-CB 3.27Å; R107-S111 PolarHBondContact O-N 3.25Å |
| 108 | D | 97.6 | Very high | 97.6 | Very high | 74 Ų | 74 | 93.6 Ų | 93.6 | 40% | 0.396 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -68.2 | -37.3 | -177.4 | -66.6 | -7.5 | 0 | 0 | 0 | 111.2 | I104 R105 A106 S111 Y112 | I104-D108 WeakPolarHBondContact CG2-OD2 3.42Å; I104-D108 WeakPolarHBondContact O-CB 3.49Å; I104-D108 PolarHBondContact O-N 3.22Å; R105-D108 PolarHBondContact O-N 3.37Å; A106-D108 PolarHBondContact O-N 3.35Å; D108-S111 WeakPolarHBondContact O-CB 3.29Å; D108-S111 PolarHBondContact O-N 3.43Å; D108-Y112 WeakPolarHBondContact O-CB 3.3Å; D108-Y112 PolarHBondContact O-N 3.18Å |
| 109 | N | 97.1 | Very high | 97.6 | Very high | 118 Ų | 118 | 94.2 Ų | 94.2 | 63% | 0.631 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.3 | -44.2 | 172.1 | -75.4 | -23.6 | 0 | 0 | 0 | 112.5 | R105 A106 S111 Y112 G113 | R105-N109 WeakPolarHBondContact O-CB 3.3Å; R105-N109 VanDerWaalsContact O-CG 3.3Å; R105-N109 PolarHBondContact O-N 2.81Å; R105-N109 PolarHBondContact O-ND2 3.37Å; A106-N109 PolarHBondContact O-N 3.18Å; N109-S111 VanDerWaalsContact C-N 3.33Å; N109-Y112 PolarHBondContact O-N 2.77Å; N109-G113 PolarHBondContact O-N 2.98Å |
| 110 | I | 97.3 | Very high | 97.6 | Very high | 120 Ų | 120 | 93.5 Ų | 93.5 | 62% | 0.615 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.1 | -43.7 | 175.3 | -67.8 | 165.9 | 0 | 0 | 0 | 110.4 | A106 R107 G113 T114 | A106-I110 WeakPolarHBondContact O-CG1 3.34Å; A106-I110 PolarHBondContact O-N 2.79Å; A106-I110 VanDerWaalsContact O-N 3.1Å; R107-I110 PolarHBondContact O-N 3.25Å; I110-G113 PolarHBondContact O-N 2.91Å; I110-T114 WeakPolarHBondContact O-CB 3.24Å; I110-T114 PolarHBondContact O-N 3.38Å; I110-T114 PolarHBondContact O-OG1 2.8Å |
| 111 | S | 97.4 | Very high | 97.6 | Very high | 73 Ų | 73 | 93.3 Ų | 93.3 | 51% | 0.51 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.4 | -45.6 | 177.8 | -173.3 | 0 | 0 | 0 | 0 | 111.7 | R107 D108 N109 T114 N115 | R107-S111 WeakPolarHBondContact O-CB 3.27Å; R107-S111 PolarHBondContact O-N 3.25Å; D108-S111 WeakPolarHBondContact O-CB 3.29Å; D108-S111 PolarHBondContact O-N 3.43Å; N109-S111 VanDerWaalsContact C-N 3.33Å; S111-T114 PolarHBondContact O-N 2.92Å; S111-N115 VanDerWaalsContact O-CB 3.32Å; S111-N115 WeakPolarHBondContact O-CB 3.5Å; S111-N115 PolarHBondContact O-N 2.77Å |
| 112 | Y | 96.7 | Very high | 97.6 | Very high | 177 Ų | 177 | 92.8 Ų | 92.8 | 69% | 0.694 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.6 | -47.2 | 176 | -176.8 | -94.4 | 0 | 0 | 0 | 112.1 | D108 N109 T114 N115 S116 | D108-Y112 WeakPolarHBondContact O-CB 3.3Å; D108-Y112 PolarHBondContact O-N 3.18Å; N109-Y112 PolarHBondContact O-N 2.77Å; Y112-T114 PolarHBondContact O-N 2.75Å; Y112-N115 PolarHBondContact O-N 3.24Å; Y112-S116 WeakPolarHBondContact O-CB 3.33Å; Y112-S116 PolarHBondContact O-N 2.86Å |
| 113 | G | 96.7 | Very high | 97.6 | Very high | 39 Ų | 39 | 94.3 Ų | 94.3 | 40% | 0.402 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.3 | -45.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | N109 I110 S116 A117 | N109-G113 PolarHBondContact O-N 2.98Å; I110-G113 PolarHBondContact O-N 2.91Å; G113-S116 PolarHBondContact O-N 3.39Å; G113-A117 PolarHBondContact O-N 2.86Å |
| 114 | T | 97.3 | Very high | 97.5 | Very high | 90 Ų | 90 | 97.5 Ų | 97.5 | 55% | 0.552 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.6 | -45.4 | 177.8 | -55.4 | 0 | 0 | 0 | 0 | 111.7 | I110 S111 Y112 S116 A117 L118 | I110-T114 WeakPolarHBondContact O-CB 3.24Å; I110-T114 PolarHBondContact O-N 3.38Å; I110-T114 PolarHBondContact O-OG1 2.8Å; S111-T114 PolarHBondContact O-N 2.92Å; Y112-T114 PolarHBondContact O-N 2.75Å; T114-S116 PolarHBondContact O-N 2.93Å; T114-A117 PolarHBondContact O-N 3.41Å; T114-L118 WeakPolarHBondContact O-CB 3.21Å; T114-L118 PolarHBondContact O-N 2.98Å |
| 115 | N | 97.5 | Very high | 97.5 | Very high | 76 Ų | 76 | 99.2 Ų | 99.2 | 41% | 0.406 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.4 | -37.8 | 179.1 | -170.1 | 40.4 | 0 | 0 | 0 | 112.1 | S111 Y112 L118 K119 | S111-N115 VanDerWaalsContact O-CB 3.32Å; S111-N115 WeakPolarHBondContact O-CB 3.5Å; S111-N115 PolarHBondContact O-N 2.77Å; Y112-N115 PolarHBondContact O-N 3.24Å; N115-L118 PolarHBondContact O-N 2.96Å; N115-K119 WeakPolarHBondContact O-CB 3.25Å; N115-K119 WeakPolarHBondContact O-CG 3.3Å; N115-K119 PolarHBondContact O-N 2.84Å |
| 116 | S | 97.2 | Very high | 97.5 | Very high | 58 Ų | 58 | 98.5 Ų | 98.5 | 41% | 0.406 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.5 | -44.6 | 174.7 | -176.1 | 0 | 0 | 0 | 0 | 112 | Y112 G113 T114 K119 T120 | Y112-S116 WeakPolarHBondContact O-CB 3.33Å; Y112-S116 PolarHBondContact O-N 2.86Å; G113-S116 PolarHBondContact O-N 3.39Å; T114-S116 PolarHBondContact O-N 2.93Å; S116-K119 PolarHBondContact O-N 3.39Å; S116-T120 WeakPolarHBondContact O-CB 3.46Å; S116-T120 PolarHBondContact O-N 3.44Å; S116-T120 PolarHBondContact O-OG1 2.9Å |
| 117 | A | 98 | Very high | 97.5 | Very high | 61 Ų | 61 | 100.6 Ų | 100.6 | 50% | 0.504 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | G113 T114 T120 L121 | G113-A117 PolarHBondContact O-N 2.86Å; T114-A117 PolarHBondContact O-N 3.41Å; A117-T120 PolarHBondContact O-N 2.82Å; A117-L121 PolarHBondContact O-N 3.47Å |
| 118 | L | 97.8 | Very high | 97.5 | Very high | 85 Ų | 85 | 95 Ų | 95 | 45% | 0.445 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.8 | -51.2 | 176.3 | -174.1 | 71.1 | 0 | 0 | 0 | 111.3 | T114 N115 T120 L121 E122 | T114-L118 WeakPolarHBondContact O-CB 3.21Å; T114-L118 PolarHBondContact O-N 2.98Å; N115-L118 PolarHBondContact O-N 2.96Å; L118-T120 VanDerWaalsContact C-N 3.27Å; L118-T120 PolarHBondContact O-N 2.87Å; L118-L121 WeakPolarHBondContact O-CB 3.49Å; L118-L121 PolarHBondContact O-N 3.41Å; L118-E122 HydrophobicContact CG-CG 4.47Å; L118-E122 WeakPolarHBondContact O-CG 3.41Å; L118-E122 PolarHBondContact O-N 2.7Å |
| 119 | K | 97.8 | Very high | 97.5 | Very high | 117 Ų | 117 | 96.4 Ų | 96.4 | 51% | 0.509 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -57.3 | -41.1 | 176.4 | -75.4 | 179.5 | 178.9 | -176.1 | 0 | 112.3 | N115 S116 L121 E122 M123 | N115-K119 WeakPolarHBondContact O-CB 3.25Å; N115-K119 WeakPolarHBondContact O-CG 3.3Å; N115-K119 PolarHBondContact O-N 2.84Å; S116-K119 PolarHBondContact O-N 3.39Å; K119-L121 VanDerWaalsContact C-N 3.34Å; K119-L121 PolarHBondContact O-N 2.9Å; K119-E122 PolarHBondContact O-N 3.4Å; K119-M123 WeakPolarHBondContact O-CB 3.41Å; K119-M123 VanDerWaalsContact O-CG 3.24Å; K119-M123 WeakPolarHBondContact O-CG 3.41Å; K119-M123 PolarHBondContact O-N 2.86Å |
| 120 | T | 97.9 | Very high | 97.5 | Very high | 66 Ų | 66 | 92.8 Ų | 92.8 | 41% | 0.405 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.3 | -41.6 | 176.9 | -58.5 | 0 | 0 | 0 | 0 | 111.3 | S116 A117 L118 R124 | S116-T120 WeakPolarHBondContact O-CB 3.46Å; S116-T120 PolarHBondContact O-N 3.44Å; S116-T120 PolarHBondContact O-OG1 2.9Å; A117-T120 PolarHBondContact O-N 2.82Å; L118-T120 VanDerWaalsContact C-N 3.27Å; L118-T120 PolarHBondContact O-N 2.87Å; T120-R124 WeakPolarHBondContact O-CG 3.49Å; T120-R124 PolarHBondContact O-N 3.15Å; T120-R124 VanDerWaalsContact O-N 3.1Å |
| 121 | L | 97.9 | Very high | 97.5 | Very high | 89 Ų | 89 | 90.9 Ų | 90.9 | 47% | 0.466 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.4 | -46.9 | 176 | -179.6 | 64.2 | 0 | 0 | 0 | 111.7 | A117 L118 K119 M123 R124 Q125 | A117-L121 PolarHBondContact O-N 3.47Å; L118-L121 WeakPolarHBondContact O-CB 3.49Å; L118-L121 PolarHBondContact O-N 3.41Å; K119-L121 VanDerWaalsContact C-N 3.34Å; K119-L121 PolarHBondContact O-N 2.9Å; L121-M123 VanDerWaalsContact C-N 3.34Å; L121-M123 PolarHBondContact O-N 3.37Å; L121-R124 PolarHBondContact O-N 3.43Å; L121-Q125 HydrophobicContact CD1-CG 4.47Å; L121-Q125 WeakPolarHBondContact O-CG 3.31Å; L121-Q125 PolarHBondContact O-N 3.33Å |
| 122 | E | 98.1 | Very high | 97.6 | Very high | 92 Ų | 92 | 91.7 Ų | 91.7 | 43% | 0.43 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -56.8 | -46.7 | 176.4 | -72.5 | 174.5 | 159.2 | 0 | 0 | 111.1 | L118 K119 R124 Q125 L126 | L118-E122 HydrophobicContact CG-CG 4.47Å; L118-E122 WeakPolarHBondContact O-CG 3.41Å; L118-E122 PolarHBondContact O-N 2.7Å; K119-E122 PolarHBondContact O-N 3.4Å; E122-R124 VanDerWaalsContact C-N 3.34Å; E122-R124 PolarHBondContact O-N 2.87Å; E122-Q125 PolarHBondContact O-N 2.98Å; E122-L126 WeakPolarHBondContact O-CB 3.25Å; E122-L126 WeakPolarHBondContact O-CG 3.29Å; E122-L126 PolarHBondContact O-N 2.93Å |
| 123 | M | 97.7 | Very high | 97.7 | Very high | 130 Ų | 130 | 92.5 Ų | 92.5 | 64% | 0.64 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.1 | -40.2 | 177.5 | -71.4 | -59.4 | -67.1 | 0 | 0 | 112.5 | K119 L121 L126 S127 | K119-M123 WeakPolarHBondContact O-CB 3.41Å; K119-M123 VanDerWaalsContact O-CG 3.24Å; K119-M123 WeakPolarHBondContact O-CG 3.41Å; K119-M123 PolarHBondContact O-N 2.86Å; L121-M123 VanDerWaalsContact C-N 3.34Å; L121-M123 PolarHBondContact O-N 3.37Å; M123-L126 HydrophobicContact SD-CD1 4.41Å; M123-S127 WeakPolarHBondContact O-CB 3.43Å; M123-S127 PolarHBondContact O-N 3.44Å |
| 124 | R | 97.5 | Very high | 97.8 | Very high | 185 Ų | 185 | 91.9 Ų | 91.9 | 70% | 0.698 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.1 | -42.3 | 174.5 | -73.9 | 176.4 | -178.3 | -177.5 | 1.7 | 111.9 | T120 L121 E122 S127 G128 | T120-R124 WeakPolarHBondContact O-CG 3.49Å; T120-R124 PolarHBondContact O-N 3.15Å; T120-R124 VanDerWaalsContact O-N 3.1Å; L121-R124 PolarHBondContact O-N 3.43Å; E122-R124 VanDerWaalsContact C-N 3.34Å; E122-R124 PolarHBondContact O-N 2.87Å; R124-S127 PolarHBondContact O-N 3.3Å; R124-G128 PolarHBondContact O-N 3.33Å |
| 125 | Q | 97.5 | Very high | 97.8 | Very high | 112 Ų | 112 | 94.1 Ų | 94.1 | 52% | 0.523 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.4 | -44.7 | 177.2 | -73.7 | -178.2 | -6.9 | 0 | 0 | 111.6 | L121 E122 S127 G128 L129 | L121-Q125 HydrophobicContact CD1-CG 4.47Å; L121-Q125 WeakPolarHBondContact O-CG 3.31Å; L121-Q125 PolarHBondContact O-N 3.33Å; E122-Q125 PolarHBondContact O-N 2.98Å; Q125-S127 VanDerWaalsContact C-N 3.33Å; Q125-S127 PolarHBondContact O-N 2.83Å; Q125-G128 PolarHBondContact O-N 2.92Å; Q125-L129 WeakPolarHBondContact O-CB 3.24Å; Q125-L129 VanDerWaalsContact O-CG 3.28Å; Q125-L129 WeakPolarHBondContact O-CG 3.47Å; Q125-L129 PolarHBondContact O-N 3.38Å |
| 126 | L | 97.6 | Very high | 97.9 | Very high | 112 Ų | 112 | 94.5 Ų | 94.5 | 59% | 0.586 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -59.8 | -43.4 | 176 | -72.9 | 172.9 | 0 | 0 | 0 | 111.7 | E122 M123 G130 | E122-L126 WeakPolarHBondContact O-CB 3.25Å; E122-L126 WeakPolarHBondContact O-CG 3.29Å; E122-L126 PolarHBondContact O-N 2.93Å; M123-L126 HydrophobicContact SD-CD1 4.41Å; L126-G130 PolarHBondContact O-N 3.49Å |
| 127 | S | 96.8 | Very high | 98 | Very high | 88 Ų | 88 | 94.4 Ų | 94.4 | 62% | 0.615 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.1 | -46.7 | 175.3 | 180 | 0 | 0 | 0 | 0 | 112 | M123 R124 Q125 G130 D131 | M123-S127 WeakPolarHBondContact O-CB 3.43Å; M123-S127 PolarHBondContact O-N 3.44Å; R124-S127 PolarHBondContact O-N 3.3Å; Q125-S127 VanDerWaalsContact C-N 3.33Å; Q125-S127 PolarHBondContact O-N 2.83Å; S127-G130 PolarHBondContact O-N 3.2Å; S127-D131 PolarHBondContact O-N 3.37Å |
| 128 | G | 97.5 | Very high | 98 | Very high | 34 Ų | 34 | 98.5 Ų | 98.5 | 35% | 0.351 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.9 | -42 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | R124 Q125 G130 D131 L132 | R124-G128 PolarHBondContact O-N 3.33Å; Q125-G128 PolarHBondContact O-N 2.92Å; G128-G130 VanDerWaalsContact C-N 3.33Å; G128-G130 PolarHBondContact O-N 2.88Å; G128-D131 PolarHBondContact O-N 3.43Å; G128-L132 WeakPolarHBondContact O-CG 3.28Å; G128-L132 PolarHBondContact O-N 2.96Å |
| 129 | L | 98.2 | Very high | 98 | Very high | 102 Ų | 102 | 97.6 Ų | 97.6 | 53% | 0.534 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.2 | -38 | 174.2 | -73.3 | 171.8 | 0 | 0 | 0 | 111.7 | Q125 R133 | Q125-L129 WeakPolarHBondContact O-CB 3.24Å; Q125-L129 VanDerWaalsContact O-CG 3.28Å; Q125-L129 WeakPolarHBondContact O-CG 3.47Å; Q125-L129 PolarHBondContact O-N 3.38Å; L129-R133 WeakPolarHBondContact O-CB 3.3Å; L129-R133 VanDerWaalsContact O-CG 3.25Å; L129-R133 WeakPolarHBondContact O-CG 3.38Å; L129-R133 PolarHBondContact O-N 3.2Å |
| 130 | G | 97.7 | Very high | 98.1 | Very high | 42 Ų | 42 | 96.4 Ų | 96.4 | 43% | 0.433 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.5 | -48.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | L126 S127 G128 R133 G134 | L126-G130 PolarHBondContact O-N 3.49Å; S127-G130 PolarHBondContact O-N 3.2Å; G128-G130 VanDerWaalsContact C-N 3.33Å; G128-G130 PolarHBondContact O-N 2.88Å; G130-R133 PolarHBondContact O-N 2.94Å; G130-G134 PolarHBondContact O-N 2.93Å |
| 131 | D | 97.7 | Very high | 98.1 | Very high | 81 Ų | 81 | 96.2 Ų | 96.2 | 43% | 0.433 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61 | -48.8 | 176.4 | 176.9 | 62.4 | 0 | 0 | 0 | 111.8 | S127 G128 R133 G134 R135 | S127-D131 PolarHBondContact O-N 3.37Å; G128-D131 PolarHBondContact O-N 3.43Å; D131-R133 PolarHBondContact O-N 2.84Å; D131-G134 PolarHBondContact O-N 3.44Å; D131-G134 VanDerWaalsContact O-N 3.12Å; D131-R135 WeakPolarHBondContact O-CG 3.32Å; D131-R135 PolarHBondContact O-N 2.96Å; D131-R135 WeakPolarHBondContact OD2-CD 3.42Å; D131-R135 IonicContact OD2-NH1 2.67Å |
| 132 | L | 98.5 | Very high | 98.2 | Very high | 89 Ų | 89 | 94 Ų | 94 | 47% | 0.466 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -58.4 | -46.6 | 178.6 | -74.4 | 174.6 | 0 | 0 | 0 | 111.6 | G128 G134 R135 V136 | G128-L132 WeakPolarHBondContact O-CG 3.28Å; G128-L132 PolarHBondContact O-N 2.96Å; L132-G134 VanDerWaalsContact C-N 3.31Å; L132-G134 PolarHBondContact O-N 2.85Å; L132-R135 PolarHBondContact O-N 2.86Å; L132-V136 WeakPolarHBondContact O-CB 3.45Å; L132-V136 VanDerWaalsContact O-CG2 3.29Å; L132-V136 WeakPolarHBondContact O-CG2 3.35Å; L132-V136 PolarHBondContact O-N 3.42Å |
| 133 | R | 98.5 | Very high | 98.2 | Very high | 195 Ų | 195 | 94 Ų | 94 | 74% | 0.736 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.8 | -42.2 | 175.4 | -75.6 | 177.3 | 67.3 | -179.8 | 1.1 | 111.9 | L129 G130 D131 V136 A137 | L129-R133 WeakPolarHBondContact O-CB 3.3Å; L129-R133 VanDerWaalsContact O-CG 3.25Å; L129-R133 WeakPolarHBondContact O-CG 3.38Å; L129-R133 PolarHBondContact O-N 3.2Å; G130-R133 PolarHBondContact O-N 2.94Å; D131-R133 PolarHBondContact O-N 2.84Å; R133-V136 PolarHBondContact O-N 2.95Å; R133-A137 WeakPolarHBondContact O-CB 3.41Å; R133-A137 PolarHBondContact O-N 3.47Å |
| 134 | G | 98.5 | Very high | 98.2 | Very high | 25 Ų | 25 | 90.7 Ų | 90.7 | 26% | 0.258 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.6 | -40.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | G130 D131 L132 R138 | G130-G134 PolarHBondContact O-N 2.93Å; D131-G134 PolarHBondContact O-N 3.44Å; D131-G134 VanDerWaalsContact O-N 3.12Å; L132-G134 VanDerWaalsContact C-N 3.31Å; L132-G134 PolarHBondContact O-N 2.85Å; G134-R138 WeakPolarHBondContact O-CG 3.3Å; G134-R138 PolarHBondContact O-N 3.31Å; G134-R138 VanDerWaalsContact O-N 3.12Å; G134-R138 PolarHBondContact O-NH1 3.23Å |
| 135 | R | 98.7 | Very high | 98.3 | Very high | 138 Ų | 138 | 88.7 Ų | 88.7 | 52% | 0.521 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -67.3 | -44.2 | 175.9 | -72 | 169.3 | 61 | -170.3 | -2.1 | 112.2 | D131 L132 R138 C139 | D131-R135 WeakPolarHBondContact O-CG 3.32Å; D131-R135 PolarHBondContact O-N 2.96Å; D131-R135 WeakPolarHBondContact OD2-CD 3.42Å; D131-R135 IonicContact OD2-NH1 2.67Å; L132-R135 PolarHBondContact O-N 2.86Å; R135-R138 PolarHBondContact O-N 3.06Å; R135-C139 PolarHBondContact O-N 3.3Å |
| 136 | V | 98.7 | Very high | 98.4 | Very high | 83 Ų | 83 | 88.2 Ų | 88.2 | 50% | 0.503 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59 | -48.6 | 175.3 | 170.1 | 0 | 0 | 0 | 0 | 110 | L132 R133 R138 C139 D140 | L132-V136 WeakPolarHBondContact O-CB 3.45Å; L132-V136 VanDerWaalsContact O-CG2 3.29Å; L132-V136 WeakPolarHBondContact O-CG2 3.35Å; L132-V136 PolarHBondContact O-N 3.42Å; R133-V136 PolarHBondContact O-N 2.95Å; V136-R138 VanDerWaalsContact C-N 3.31Å; V136-R138 PolarHBondContact O-N 3.37Å; V136-C139 WeakPolarHBondContact O-CA 3.49Å; V136-C139 VanDerWaalsContact O-CB 3.29Å; V136-C139 WeakPolarHBondContact O-CB 3.32Å; V136-C139 PolarHBondContact O-N 3.27Å; V136-D140 PolarHBondContact O-N 2.92Å |
| 137 | A | 98.6 | Very high | 98.4 | Very high | 57 Ų | 57 | 86.2 Ų | 86.2 | 47% | 0.471 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59 | -39.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | R133 A141 | R133-A137 WeakPolarHBondContact O-CB 3.41Å; R133-A137 PolarHBondContact O-N 3.47Å; A137-A141 WeakPolarHBondContact O-CB 3.43Å; A137-A141 PolarHBondContact O-N 2.95Å |
| 138 | R | 98.6 | Very high | 98.5 | Very high | 147 Ų | 147 | 84.8 Ų | 84.8 | 56% | 0.555 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -68.1 | -35.8 | 174.5 | -72.5 | -171 | -60.9 | -89.2 | 9.9 | 112.6 | G134 R135 V136 S142 | G134-R138 WeakPolarHBondContact O-CG 3.3Å; G134-R138 PolarHBondContact O-N 3.31Å; G134-R138 VanDerWaalsContact O-N 3.12Å; G134-R138 PolarHBondContact O-NH1 3.23Å; R135-R138 PolarHBondContact O-N 3.06Å; V136-R138 VanDerWaalsContact C-N 3.31Å; V136-R138 PolarHBondContact O-N 3.37Å; R138-S142 WeakPolarHBondContact O-CB 3.46Å; R138-S142 PolarHBondContact O-N 2.86Å; R138-S142 PolarHBondContact O-OG 2.89Å |
| 139 | C | 98.6 | Very high | 98.6 | Very high | 66 Ų | 66 | 87.9 Ų | 87.9 | 45% | 0.446 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.2 | -50.8 | 174.8 | -165.7 | 0 | 0 | 0 | 0 | 110.2 | R135 V136 A141 S142 I143 | R135-C139 PolarHBondContact O-N 3.3Å; V136-C139 WeakPolarHBondContact O-CA 3.49Å; V136-C139 VanDerWaalsContact O-CB 3.29Å; V136-C139 WeakPolarHBondContact O-CB 3.32Å; V136-C139 PolarHBondContact O-N 3.27Å; C139-A141 VanDerWaalsContact C-N 3.33Å; C139-A141 PolarHBondContact O-N 2.63Å; C139-S142 CarbonylContact O-C 3.59Å; C139-S142 WeakPolarHBondContact O-CA 3.42Å; C139-S142 WeakPolarHBondContact O-CB 3.31Å; C139-S142 PolarHBondContact O-N 2.95Å; C139-I143 WeakPolarHBondContact O-CG1 3.45Å; C139-I143 PolarHBondContact O-N 3.46Å |
| 140 | D | 98.7 | Very high | 98.6 | Very high | 92 Ų | 92 | 89.3 Ų | 89.3 | 49% | 0.492 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -58.4 | -45 | 179 | -66.8 | -18.1 | 0 | 0 | 0 | 111.5 | V136 S142 I143 A144 | V136-D140 PolarHBondContact O-N 2.92Å; D140-S142 VanDerWaalsContact C-N 3.32Å; D140-S142 PolarHBondContact O-N 3.4Å; D140-I143 PolarHBondContact O-N 2.94Å; D140-A144 WeakPolarHBondContact O-CB 3.46Å; D140-A144 PolarHBondContact O-N 2.84Å |
| 141 | A | 98.7 | Very high | 98.6 | Very high | 61 Ų | 61 | 93.3 Ų | 93.3 | 50% | 0.504 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.5 | -39.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | A137 C139 R145 | A137-A141 WeakPolarHBondContact O-CB 3.43Å; A137-A141 PolarHBondContact O-N 2.95Å; C139-A141 VanDerWaalsContact C-N 3.33Å; C139-A141 PolarHBondContact O-N 2.63Å; A141-R145 WeakPolarHBondContact O-CB 3.33Å; A141-R145 PolarHBondContact O-N 2.67Å; A141-R145 VanDerWaalsContact O-N 3.07Å |
| 142 | S | 98.8 | Very high | 98.7 | Very high | 44 Ų | 44 | 94 Ų | 94 | 31% | 0.308 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -69.7 | -42 | 178 | -59.9 | 0 | 0 | 0 | 0 | 111.8 | R138 C139 D140 R145 L146 | R138-S142 WeakPolarHBondContact O-CB 3.46Å; R138-S142 PolarHBondContact O-N 2.86Å; R138-S142 PolarHBondContact O-OG 2.89Å; C139-S142 CarbonylContact O-C 3.59Å; C139-S142 WeakPolarHBondContact O-CA 3.42Å; C139-S142 WeakPolarHBondContact O-CB 3.31Å; C139-S142 PolarHBondContact O-N 2.95Å; D140-S142 VanDerWaalsContact C-N 3.32Å; D140-S142 PolarHBondContact O-N 3.4Å; S142-R145 PolarHBondContact O-N 3.36Å; S142-L146 WeakPolarHBondContact O-CB 3.38Å; S142-L146 VanDerWaalsContact O-CG 3.3Å; S142-L146 WeakPolarHBondContact O-CG 3.36Å; S142-L146 PolarHBondContact O-N 3.48Å |
| 143 | I | 98.8 | Very high | 98.7 | Very high | 91 Ų | 91 | 94 Ų | 94 | 47% | 0.467 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.7 | -44.7 | 176.2 | -69.2 | 167.6 | 0 | 0 | 0 | 110.3 | C139 D140 R145 L146 S147 | C139-I143 WeakPolarHBondContact O-CG1 3.45Å; C139-I143 PolarHBondContact O-N 3.46Å; D140-I143 PolarHBondContact O-N 2.94Å; I143-R145 PolarHBondContact O-N 2.96Å; I143-L146 PolarHBondContact O-N 3.35Å; I143-S147 VanDerWaalsContact O-CB 3.29Å; I143-S147 WeakPolarHBondContact O-CB 3.43Å; I143-S147 PolarHBondContact O-N 3.25Å; I143-S147 PolarHBondContact O-OG 2.92Å |
| 144 | A | 98.7 | Very high | 98.7 | Very high | 61 Ų | 61 | 90.8 Ų | 90.8 | 50% | 0.504 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.4 | -45 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | D140 S147 A148 | D140-A144 WeakPolarHBondContact O-CB 3.46Å; D140-A144 PolarHBondContact O-N 2.84Å; A144-S147 PolarHBondContact O-N 3.41Å; A144-A148 PolarHBondContact O-N 3.4Å |
| 145 | R | 98.7 | Very high | 98.7 | Very high | 143 Ų | 143 | 94.6 Ų | 94.6 | 54% | 0.54 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.2 | -50.7 | 176 | -176 | 179.9 | 64.6 | -137.2 | -6.4 | 111.9 | A141 S142 I143 S147 A148 E149 | A141-R145 WeakPolarHBondContact O-CB 3.33Å; A141-R145 PolarHBondContact O-N 2.67Å; A141-R145 VanDerWaalsContact O-N 3.07Å; S142-R145 PolarHBondContact O-N 3.36Å; I143-R145 PolarHBondContact O-N 2.96Å; R145-S147 VanDerWaalsContact C-N 3.25Å; R145-S147 PolarHBondContact O-N 3.37Å; R145-A148 WeakPolarHBondContact O-CB 3.46Å; R145-A148 PolarHBondContact O-N 3.39Å; R145-A148 VanDerWaalsContact O-N 3.13Å; R145-E149 HydrophobicContact CG-CG 4.48Å; R145-E149 VanDerWaalsContact CG-OE1 3.32Å; R145-E149 WeakPolarHBondContact CG-OE1 3.33Å; R145-E149 IonicContact NE-OE1 3.16Å; R145-E149 WeakPolarHBondContact O-CG 3.32Å; R145-E149 PolarHBondContact O-N 2.91Å |
| 146 | L | 98.8 | Very high | 98.7 | Very high | 101 Ų | 101 | 90 Ų | 90 | 53% | 0.529 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.1 | -36.9 | 178.5 | -73.1 | 172.2 | 0 | 0 | 0 | 112 | S142 I143 E149 H150 | S142-L146 WeakPolarHBondContact O-CB 3.38Å; S142-L146 VanDerWaalsContact O-CG 3.3Å; S142-L146 WeakPolarHBondContact O-CG 3.36Å; S142-L146 PolarHBondContact O-N 3.48Å; I143-L146 PolarHBondContact O-N 3.35Å; L146-E149 PolarHBondContact O-N 3.46Å; L146-H150 VanDerWaalsContact O-CB 3.24Å; L146-H150 WeakPolarHBondContact O-CB 3.27Å; L146-H150 PolarHBondContact O-N 3.05Å |
| 147 | S | 98.8 | Very high | 98.7 | Very high | 70 Ų | 70 | 91.2 Ų | 91.2 | 49% | 0.49 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.5 | -39.4 | 176.9 | -59.2 | 0 | 0 | 0 | 0 | 111.9 | I143 A144 R145 K151 | I143-S147 VanDerWaalsContact O-CB 3.29Å; I143-S147 WeakPolarHBondContact O-CB 3.43Å; I143-S147 PolarHBondContact O-N 3.25Å; I143-S147 PolarHBondContact O-OG 2.92Å; A144-S147 PolarHBondContact O-N 3.41Å; R145-S147 VanDerWaalsContact C-N 3.25Å; R145-S147 PolarHBondContact O-N 3.37Å; S147-K151 WeakPolarHBondContact O-CB 3.34Å; S147-K151 PolarHBondContact O-N 3.41Å; S147-K151 VanDerWaalsContact O-N 3.09Å |
| 148 | A | 98.7 | Very high | 98.7 | Very high | 58 Ų | 58 | 92 Ų | 92 | 48% | 0.479 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.2 | -46.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | A144 R145 H150 K151 T152 | A144-A148 PolarHBondContact O-N 3.4Å; R145-A148 WeakPolarHBondContact O-CB 3.46Å; R145-A148 PolarHBondContact O-N 3.39Å; R145-A148 VanDerWaalsContact O-N 3.13Å; A148-H150 PolarHBondContact O-N 2.91Å; A148-K151 WeakPolarHBondContact O-CB 3.29Å; A148-K151 PolarHBondContact O-N 2.9Å; A148-T152 PolarHBondContact O-N 3.48Å; A148-T152 PolarHBondContact O-OG1 2.9Å |
| 149 | E | 98.8 | Very high | 98.7 | Very high | 99 Ų | 99 | 90.3 Ų | 90.3 | 46% | 0.463 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.5 | -48 | 175.8 | -72.6 | 171.1 | -170.6 | 0 | 0 | 111.3 | R145 L146 K151 T152 T153 | R145-E149 HydrophobicContact CG-CG 4.48Å; R145-E149 VanDerWaalsContact CG-OE1 3.32Å; R145-E149 WeakPolarHBondContact CG-OE1 3.33Å; R145-E149 IonicContact NE-OE1 3.16Å; R145-E149 WeakPolarHBondContact O-CG 3.32Å; R145-E149 PolarHBondContact O-N 2.91Å; L146-E149 PolarHBondContact O-N 3.46Å; E149-K151 VanDerWaalsContact C-N 3.31Å; E149-K151 PolarHBondContact O-N 3.45Å; E149-T152 PolarHBondContact O-N 2.86Å; E149-T153 PolarHBondContact O-N 3.5Å; E149-T153 PolarHBondContact O-OG1 2.94Å; E149-T153 VanDerWaalsContact O-OG1 3.12Å |
| 150 | H | 98.7 | Very high | 98.7 | Very high | 132 Ų | 132 | 92 Ų | 92 | 61% | 0.611 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -56.7 | -44 | 176.2 | 174.5 | -91.5 | 0 | 0 | 0 | 112 | L146 A148 T153 Y154 | L146-H150 VanDerWaalsContact O-CB 3.24Å; L146-H150 WeakPolarHBondContact O-CB 3.27Å; L146-H150 PolarHBondContact O-N 3.05Å; A148-H150 PolarHBondContact O-N 2.91Å; H150-T153 PolarHBondContact O-N 3.28Å; H150-Y154 VanDerWaalsContact O-CB 3.29Å; H150-Y154 WeakPolarHBondContact O-CB 3.49Å; H150-Y154 PolarHBondContact O-N 3.33Å |
| 151 | K | 98.7 | Very high | 98.7 | Very high | 127 Ų | 127 | 91 Ų | 91 | 55% | 0.552 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -60.9 | -47.9 | 176.8 | -177.9 | 179.5 | 173.9 | -177.4 | 0 | 111.4 | S147 A148 E149 T153 Y154 E155 | S147-K151 WeakPolarHBondContact O-CB 3.34Å; S147-K151 PolarHBondContact O-N 3.41Å; S147-K151 VanDerWaalsContact O-N 3.09Å; A148-K151 WeakPolarHBondContact O-CB 3.29Å; A148-K151 PolarHBondContact O-N 2.9Å; E149-K151 VanDerWaalsContact C-N 3.31Å; E149-K151 PolarHBondContact O-N 3.45Å; K151-T153 PolarHBondContact O-N 2.92Å; K151-Y154 PolarHBondContact O-N 3.49Å; K151-E155 WeakPolarHBondContact CE-OE1 3.44Å; K151-E155 WeakPolarHBondContact O-CG 3.29Å; K151-E155 PolarHBondContact O-N 2.9Å |
| 152 | T | 98.7 | Very high | 98.7 | Very high | 95 Ų | 95 | 95.1 Ų | 95.1 | 58% | 0.583 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.4 | -43.9 | 177.6 | -61.5 | 0 | 0 | 0 | 0 | 111.9 | A148 E149 E155 G156 | A148-T152 PolarHBondContact O-N 3.48Å; A148-T152 PolarHBondContact O-OG1 2.9Å; E149-T152 PolarHBondContact O-N 2.86Å; T152-E155 PolarHBondContact O-N 2.79Å; T152-G156 PolarHBondContact O-N 3.33Å |
| 153 | T | 98.8 | Very high | 98.7 | Very high | 89 Ų | 89 | 97.9 Ų | 97.9 | 55% | 0.546 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.5 | -43.3 | 176.2 | -59.3 | 0 | 0 | 0 | 0 | 111.6 | E149 H150 K151 G156 L157 | E149-T153 PolarHBondContact O-N 3.5Å; E149-T153 PolarHBondContact O-OG1 2.94Å; E149-T153 VanDerWaalsContact O-OG1 3.12Å; H150-T153 PolarHBondContact O-N 3.28Å; K151-T153 PolarHBondContact O-N 2.92Å; T153-G156 PolarHBondContact O-N 3.33Å; T153-L157 HydrophobicContact CG2-CD1 4.27Å; T153-L157 WeakPolarHBondContact O-CG 3.41Å; T153-L157 PolarHBondContact O-N 3.43Å |
| 154 | Y | 98.8 | Very high | 98.7 | Very high | 128 Ų | 128 | 99.5 Ų | 99.5 | 50% | 0.502 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.6 | -44.7 | 178.1 | 180 | -98.6 | 0 | 0 | 0 | 112.1 | H150 K151 G156 L157 Q158 | H150-Y154 VanDerWaalsContact O-CB 3.29Å; H150-Y154 WeakPolarHBondContact O-CB 3.49Å; H150-Y154 PolarHBondContact O-N 3.33Å; K151-Y154 PolarHBondContact O-N 3.49Å; Y154-G156 VanDerWaalsContact C-N 3.35Å; Y154-L157 PolarHBondContact O-N 3.29Å; Y154-Q158 HydrophobicContact CD1-CG 4.36Å; Y154-Q158 HydrophobicContact CE1-CG 3.98Å; Y154-Q158 WeakPolarHBondContact O-CG 3.34Å; Y154-Q158 PolarHBondContact O-N 3.24Å; Y154-Q158 PolarHBondContact OH-NE2 2.82Å |
| 155 | E | 98.7 | Very high | 98.7 | Very high | 105 Ų | 105 | 100.9 Ų | 100.9 | 49% | 0.491 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.3 | -41.8 | 175 | -72.1 | 171 | 176 | 0 | 0 | 111.7 | K151 T152 Q158 H159 | K151-E155 WeakPolarHBondContact CE-OE1 3.44Å; K151-E155 WeakPolarHBondContact O-CG 3.29Å; K151-E155 PolarHBondContact O-N 2.9Å; T152-E155 PolarHBondContact O-N 2.79Å; E155-Q158 PolarHBondContact O-N 2.9Å; E155-H159 PolarHBondContact O-N 3.3Å |
| 156 | G | 98.7 | Very high | 98.7 | Very high | 42 Ų | 42 | 96.4 Ų | 96.4 | 43% | 0.433 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.3 | -42.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | T152 T153 Y154 Q158 H159 L160 | T152-G156 PolarHBondContact O-N 3.33Å; T153-G156 PolarHBondContact O-N 3.33Å; Y154-G156 VanDerWaalsContact C-N 3.35Å; G156-Q158 PolarHBondContact O-N 2.95Å; G156-H159 PolarHBondContact O-N 2.9Å; G156-L160 PolarHBondContact O-N 3.43Å |
| 157 | L | 98.8 | Very high | 98.7 | Very high | 107 Ų | 107 | 93.9 Ų | 93.9 | 56% | 0.56 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.3 | -40.6 | 174.8 | -77.1 | 170.8 | 0 | 0 | 0 | 112.1 | T153 Y154 H159 L160 N161 | T153-L157 HydrophobicContact CG2-CD1 4.27Å; T153-L157 WeakPolarHBondContact O-CG 3.41Å; T153-L157 PolarHBondContact O-N 3.43Å; Y154-L157 PolarHBondContact O-N 3.29Å; L157-H159 VanDerWaalsContact C-N 3.34Å; L157-L160 PolarHBondContact O-N 3.48Å; L157-N161 WeakPolarHBondContact O-CB 3.49Å; L157-N161 PolarHBondContact O-N 2.97Å |
| 158 | Q | 98.7 | Very high | 98.7 | Very high | 74 Ų | 74 | 95.6 Ų | 95.6 | 35% | 0.346 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.9 | -38.6 | 176.5 | -72.2 | -68.8 | -0.2 | 0 | 0 | 112.1 | Y154 E155 G156 K162 | Y154-Q158 HydrophobicContact CD1-CG 4.36Å; Y154-Q158 HydrophobicContact CE1-CG 3.98Å; Y154-Q158 WeakPolarHBondContact O-CG 3.34Å; Y154-Q158 PolarHBondContact O-N 3.24Å; Y154-Q158 PolarHBondContact OH-NE2 2.82Å; E155-Q158 PolarHBondContact O-N 2.9Å; G156-Q158 PolarHBondContact O-N 2.95Å; Q158-K162 WeakPolarHBondContact O-CG 3.3Å; Q158-K162 PolarHBondContact O-N 3.49Å |
| 159 | H | 98.7 | Very high | 98.7 | Very high | 111 Ų | 111 | 97.9 Ų | 97.9 | 51% | 0.514 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.8 | -52 | 173.8 | -173.8 | -87.3 | 0 | 0 | 0 | 111.5 | E155 G156 L157 N161 K162 E163 | E155-H159 PolarHBondContact O-N 3.3Å; G156-H159 PolarHBondContact O-N 2.9Å; L157-H159 VanDerWaalsContact C-N 3.34Å; H159-N161 VanDerWaalsContact C-N 3.29Å; H159-N161 PolarHBondContact O-N 2.88Å; H159-K162 WeakPolarHBondContact O-CB 3.35Å; H159-K162 PolarHBondContact O-N 3.19Å; H159-E163 IonicContact CE1-OE1 2.81Å; H159-E163 PolarHBondContact CE1-OE1 2.91Å; H159-E163 IonicContact CE1-OE2 3.4Å; H159-E163 IonicContact ND1-OE1 3.82Å; H159-E163 IonicContact ND1-OE2 3.64Å; H159-E163 PolarHBondContact ND1-OE2 3.42Å; H159-E163 PolarHBondContact O-N 3.37Å |
| 160 | L | 98.8 | Very high | 98.7 | Very high | 102 Ų | 102 | 97.8 Ų | 97.8 | 53% | 0.534 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.8 | -39.8 | -179.7 | -176 | 63.6 | 0 | 0 | 0 | 112 | G156 L157 K162 E163 Q164 | G156-L160 PolarHBondContact O-N 3.43Å; L157-L160 PolarHBondContact O-N 3.48Å; L160-K162 VanDerWaalsContact C-N 3.34Å; L160-K162 PolarHBondContact O-N 2.87Å; L160-E163 PolarHBondContact O-N 3.17Å; L160-Q164 WeakPolarHBondContact O-CB 3.39Å; L160-Q164 PolarHBondContact O-N 3.28Å |
| 161 | N | 98.7 | Very high | 98.7 | Very high | 70 Ų | 70 | 96.5 Ų | 96.5 | 37% | 0.374 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.8 | -41.3 | 175.5 | -177.4 | 44.8 | 0 | 0 | 0 | 111.7 | L157 H159 Q164 Q165 | L157-N161 WeakPolarHBondContact O-CB 3.49Å; L157-N161 PolarHBondContact O-N 2.97Å; H159-N161 VanDerWaalsContact C-N 3.29Å; H159-N161 PolarHBondContact O-N 2.88Å; N161-Q164 PolarHBondContact O-N 2.99Å; N161-Q165 WeakPolarHBondContact O-CG 3.32Å; N161-Q165 PolarHBondContact O-N 2.7Å |
| 162 | K | 98.7 | Very high | 98.7 | Very high | 148 Ų | 148 | 94.2 Ų | 94.2 | 64% | 0.643 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -64.1 | -43.6 | 175.4 | -71 | 172 | -176.9 | 177.9 | 0 | 111.9 | Q158 H159 L160 Q164 Q165 A166 | Q158-K162 WeakPolarHBondContact O-CG 3.3Å; Q158-K162 PolarHBondContact O-N 3.49Å; H159-K162 WeakPolarHBondContact O-CB 3.35Å; H159-K162 PolarHBondContact O-N 3.19Å; L160-K162 VanDerWaalsContact C-N 3.34Å; L160-K162 PolarHBondContact O-N 2.87Å; K162-Q164 VanDerWaalsContact C-N 3.33Å; K162-Q164 PolarHBondContact O-N 2.73Å; K162-Q165 PolarHBondContact O-N 3.46Å; K162-A166 PolarHBondContact O-N 3.47Å |
| 163 | E | 98.7 | Very high | 98.7 | Very high | 102 Ų | 102 | 93.4 Ų | 93.4 | 48% | 0.477 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.3 | -42.6 | 175.6 | -69.9 | -176.9 | 136.6 | 0 | 0 | 111.7 | H159 L160 Q165 A166 A167 | H159-E163 IonicContact CE1-OE1 2.81Å; H159-E163 PolarHBondContact CE1-OE1 2.91Å; H159-E163 IonicContact CE1-OE2 3.4Å; H159-E163 IonicContact ND1-OE1 3.82Å; H159-E163 IonicContact ND1-OE2 3.64Å; H159-E163 PolarHBondContact ND1-OE2 3.42Å; H159-E163 PolarHBondContact O-N 3.37Å; L160-E163 PolarHBondContact O-N 3.17Å; E163-Q165 PolarHBondContact O-N 2.94Å; E163-A166 PolarHBondContact O-N 2.89Å; E163-A167 WeakPolarHBondContact O-CB 3.39Å; E163-A167 PolarHBondContact O-N 3.31Å |
| 164 | Q | 98.8 | Very high | 98.7 | Very high | 126 Ų | 126 | 95.6 Ų | 95.6 | 59% | 0.589 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -60.4 | -45 | 175.7 | -177.5 | -176.9 | -4 | 0 | 0 | 111.6 | L160 N161 K162 A167 K168 | L160-Q164 WeakPolarHBondContact O-CB 3.39Å; L160-Q164 PolarHBondContact O-N 3.28Å; N161-Q164 PolarHBondContact O-N 2.99Å; K162-Q164 VanDerWaalsContact C-N 3.33Å; K162-Q164 PolarHBondContact O-N 2.73Å; Q164-A167 PolarHBondContact O-N 3.47Å; Q164-K168 WeakPolarHBondContact O-CB 3.47Å; Q164-K168 PolarHBondContact O-N 3.49Å |
| 165 | Q | 98.8 | Very high | 98.7 | Very high | 90 Ų | 90 | 94 Ų | 94 | 42% | 0.421 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65 | -40.5 | 176.9 | -65.1 | -56.5 | -27.8 | 0 | 0 | 111.9 | N161 K162 E163 K168 L169 | N161-Q165 WeakPolarHBondContact O-CG 3.32Å; N161-Q165 PolarHBondContact O-N 2.7Å; K162-Q165 PolarHBondContact O-N 3.46Å; E163-Q165 PolarHBondContact O-N 2.94Å; Q165-K168 PolarHBondContact O-N 3.34Å; Q165-L169 WeakPolarHBondContact O-CG 3.47Å; Q165-L169 PolarHBondContact O-N 3.31Å |
| 166 | A | 98.7 | Very high | 98.7 | Very high | 48 Ų | 48 | 95.7 Ų | 95.7 | 40% | 0.397 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.1 | -46.5 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | K162 E163 K168 L169 I170 | K162-A166 PolarHBondContact O-N 3.47Å; E163-A166 PolarHBondContact O-N 2.89Å; A166-K168 VanDerWaalsContact C-N 3.32Å; A166-K168 PolarHBondContact O-N 3Å; A166-L169 PolarHBondContact O-N 2.91Å; A166-I170 VanDerWaalsContact O-CG1 3.32Å; A166-I170 WeakPolarHBondContact O-CG1 3.27Å; A166-I170 PolarHBondContact O-N 3.34Å |
| 167 | A | 98.8 | Very high | 98.7 | Very high | 48 Ų | 48 | 98.3 Ų | 98.3 | 40% | 0.397 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.8 | -41.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | E163 Q164 I170 L171 | E163-A167 WeakPolarHBondContact O-CB 3.39Å; E163-A167 PolarHBondContact O-N 3.31Å; Q164-A167 PolarHBondContact O-N 3.47Å; A167-I170 PolarHBondContact O-N 2.89Å; A167-L171 WeakPolarHBondContact O-CG 3.25Å; A167-L171 PolarHBondContact O-N 3.26Å |
| 168 | K | 98.8 | Very high | 98.7 | Very high | 107 Ų | 107 | 95.3 Ų | 95.3 | 47% | 0.465 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -58.4 | -49.2 | 175 | 179.7 | -178.9 | 170.1 | -175.4 | 0 | 111.6 | Q164 Q165 A166 I170 L171 E172 | Q164-K168 WeakPolarHBondContact O-CB 3.47Å; Q164-K168 PolarHBondContact O-N 3.49Å; Q165-K168 PolarHBondContact O-N 3.34Å; A166-K168 VanDerWaalsContact C-N 3.32Å; A166-K168 PolarHBondContact O-N 3Å; K168-I170 VanDerWaalsContact C-N 3.33Å; K168-I170 PolarHBondContact O-N 3.44Å; K168-L171 PolarHBondContact O-N 2.87Å; K168-E172 WeakPolarHBondContact CE-OE1 3.4Å; K168-E172 IonicContact NZ-OE1 3.53Å; K168-E172 WeakPolarHBondContact O-CG 3.38Å; K168-E172 PolarHBondContact O-N 3.32Å |
| 169 | L | 98.7 | Very high | 98.7 | Very high | 106 Ų | 106 | 97 Ų | 97 | 56% | 0.555 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.5 | -40.4 | 178.3 | -72.1 | 171.1 | 0 | 0 | 0 | 112.5 | Q165 A166 E172 T173 | Q165-L169 WeakPolarHBondContact O-CG 3.47Å; Q165-L169 PolarHBondContact O-N 3.31Å; A166-L169 PolarHBondContact O-N 2.91Å; L169-E172 PolarHBondContact O-N 2.93Å; L169-T173 PolarHBondContact O-N 3.36Å; L169-T173 PolarHBondContact O-OG1 2.93Å |
| 170 | I | 98.7 | Very high | 98.7 | Very high | 97 Ų | 97 | 93.2 Ų | 93.2 | 50% | 0.497 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.2 | -45 | 176 | -68.2 | 165.5 | 0 | 0 | 0 | 110.7 | A166 A167 K168 T173 K174 | A166-I170 VanDerWaalsContact O-CG1 3.32Å; A166-I170 WeakPolarHBondContact O-CG1 3.27Å; A166-I170 PolarHBondContact O-N 3.34Å; A167-I170 PolarHBondContact O-N 2.89Å; K168-I170 VanDerWaalsContact C-N 3.33Å; K168-I170 PolarHBondContact O-N 3.44Å; I170-T173 PolarHBondContact O-N 3.38Å; I170-K174 HydrophobicContact CG2-CD 4.36Å; I170-K174 WeakPolarHBondContact O-CG 3.42Å; I170-K174 PolarHBondContact O-N 2.89Å |
| 171 | L | 98.8 | Very high | 98.7 | Very high | 104 Ų | 104 | 94.3 Ų | 94.3 | 55% | 0.545 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.1 | -44.7 | 178.2 | -73.1 | 173.3 | 0 | 0 | 0 | 112 | A167 K168 T173 K174 I175 | A167-L171 WeakPolarHBondContact O-CG 3.25Å; A167-L171 PolarHBondContact O-N 3.26Å; K168-L171 PolarHBondContact O-N 2.87Å; L171-T173 VanDerWaalsContact C-N 3.26Å; L171-T173 PolarHBondContact O-N 2.8Å; L171-K174 PolarHBondContact O-N 2.87Å; L171-I175 VanDerWaalsContact O-CG1 3.29Å; L171-I175 WeakPolarHBondContact O-CG1 3.38Å; L171-I175 PolarHBondContact O-N 2.86Å |
| 172 | E | 98.7 | Very high | 98.7 | Very high | 79 Ų | 79 | 95.7 Ų | 95.7 | 37% | 0.369 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.7 | -39.1 | 176.2 | -74.6 | 175.8 | 176.1 | 0 | 0 | 111.8 | K168 L169 K176 | K168-E172 WeakPolarHBondContact CE-OE1 3.4Å; K168-E172 IonicContact NZ-OE1 3.53Å; K168-E172 WeakPolarHBondContact O-CG 3.38Å; K168-E172 PolarHBondContact O-N 3.32Å; L169-E172 PolarHBondContact O-N 2.93Å; E172-K176 WeakPolarHBondContact O-CG 3.41Å; E172-K176 PolarHBondContact O-N 2.98Å; E172-K176 VanDerWaalsContact O-N 3.12Å |
| 173 | T | 98.7 | Very high | 98.7 | Very high | 79 Ų | 79 | 91.5 Ų | 91.5 | 49% | 0.485 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -66.1 | -47.7 | 175.8 | -54.3 | 0 | 0 | 0 | 0 | 111.2 | L169 I170 L171 I175 K176 D177 | L169-T173 PolarHBondContact O-N 3.36Å; L169-T173 PolarHBondContact O-OG1 2.93Å; I170-T173 PolarHBondContact O-N 3.38Å; L171-T173 VanDerWaalsContact C-N 3.26Å; L171-T173 PolarHBondContact O-N 2.8Å; T173-I175 VanDerWaalsContact C-N 3.31Å; T173-I175 PolarHBondContact O-N 3.28Å; T173-K176 PolarHBondContact O-N 2.94Å; T173-D177 PolarHBondContact O-N 3.24Å |
| 174 | K | 98.8 | Very high | 98.7 | Very high | 134 Ų | 134 | 93 Ų | 93 | 58% | 0.583 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61.1 | -37.8 | 177.9 | -74.7 | -177.9 | 176.9 | -176 | 0 | 113.1 | I170 L171 A178 | I170-K174 HydrophobicContact CG2-CD 4.36Å; I170-K174 WeakPolarHBondContact O-CG 3.42Å; I170-K174 PolarHBondContact O-N 2.89Å; L171-K174 PolarHBondContact O-N 2.87Å; K174-A178 WeakPolarHBondContact O-CB 3.44Å; K174-A178 PolarHBondContact O-N 3.25Å |
| 175 | I | 98.8 | Very high | 98.7 | Very high | 94 Ų | 94 | 91.6 Ų | 91.6 | 48% | 0.482 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.8 | -49.5 | 176.2 | -71.3 | 166.6 | 0 | 0 | 0 | 109.8 | L171 T173 D177 A178 E179 | L171-I175 VanDerWaalsContact O-CG1 3.29Å; L171-I175 WeakPolarHBondContact O-CG1 3.38Å; L171-I175 PolarHBondContact O-N 2.86Å; T173-I175 VanDerWaalsContact C-N 3.31Å; T173-I175 PolarHBondContact O-N 3.28Å; I175-D177 VanDerWaalsContact C-N 3.32Å; I175-D177 PolarHBondContact O-N 3.41Å; I175-A178 PolarHBondContact O-N 3.35Å; I175-E179 HydrophobicContact CG2-CG 4.35Å; I175-E179 WeakPolarHBondContact O-CG 3.32Å; I175-E179 PolarHBondContact O-N 2.88Å |
| 176 | K | 98.7 | Very high | 98.7 | Very high | 141 Ų | 141 | 92.1 Ų | 92.1 | 61% | 0.613 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -59.8 | -41.2 | 177.4 | -74.4 | 177.3 | 179.5 | 177 | 0 | 112.7 | E172 T173 E179 G180 | E172-K176 WeakPolarHBondContact O-CG 3.41Å; E172-K176 PolarHBondContact O-N 2.98Å; E172-K176 VanDerWaalsContact O-N 3.12Å; T173-K176 PolarHBondContact O-N 2.94Å; K176-E179 PolarHBondContact O-N 3.39Å; K176-G180 PolarHBondContact O-N 2.91Å |
| 177 | D | 98.7 | Very high | 98.7 | Very high | 98 Ų | 98 | 94.6 Ų | 94.6 | 52% | 0.524 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.8 | -43.9 | 176.7 | -73.3 | -15 | 0 | 0 | 0 | 111.3 | T173 I175 G180 Q181 | T173-D177 PolarHBondContact O-N 3.24Å; I175-D177 VanDerWaalsContact C-N 3.32Å; I175-D177 PolarHBondContact O-N 3.41Å; D177-G180 PolarHBondContact O-N 3.32Å; D177-Q181 WeakPolarHBondContact O-CG 3.33Å; D177-Q181 PolarHBondContact O-N 3.27Å |
| 178 | A | 98.7 | Very high | 98.7 | Very high | 43 Ų | 43 | 100.8 Ų | 100.8 | 36% | 0.355 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.7 | -44.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | K174 I175 G180 Q181 I182 | K174-A178 WeakPolarHBondContact O-CB 3.44Å; K174-A178 PolarHBondContact O-N 3.25Å; I175-A178 PolarHBondContact O-N 3.35Å; A178-G180 VanDerWaalsContact C-N 3.29Å; A178-G180 PolarHBondContact O-N 3.05Å; A178-Q181 PolarHBondContact O-N 3.18Å; A178-I182 WeakPolarHBondContact O-CB 3.3Å; A178-I182 VanDerWaalsContact O-CG1 3.29Å; A178-I182 WeakPolarHBondContact O-CG1 3.36Å; A178-I182 PolarHBondContact O-N 3.44Å |
| 179 | E | 98.6 | Very high | 98.7 | Very high | 110 Ų | 110 | 99.5 Ų | 99.5 | 51% | 0.514 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.2 | -40.3 | 174.3 | -72.4 | 173.1 | 161.4 | 0 | 0 | 111.7 | I175 K176 S183 | I175-E179 HydrophobicContact CG2-CG 4.35Å; I175-E179 WeakPolarHBondContact O-CG 3.32Å; I175-E179 PolarHBondContact O-N 2.88Å; K176-E179 PolarHBondContact O-N 3.39Å; E179-S183 WeakPolarHBondContact O-CB 3.36Å; E179-S183 PolarHBondContact O-N 3.04Å; E179-S183 PolarHBondContact O-OG 3.07Å |
| 180 | G | 98.6 | Very high | 98.7 | Very high | 31 Ų | 31 | 98.9 Ų | 98.9 | 32% | 0.32 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.1 | -45.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | K176 D177 A178 S183 Q184 | K176-G180 PolarHBondContact O-N 2.91Å; D177-G180 PolarHBondContact O-N 3.32Å; A178-G180 VanDerWaalsContact C-N 3.29Å; A178-G180 PolarHBondContact O-N 3.05Å; G180-S183 PolarHBondContact O-N 3.47Å; G180-Q184 WeakPolarHBondContact O-CG 3.35Å; G180-Q184 PolarHBondContact O-N 2.91Å |
| 181 | Q | 98.7 | Very high | 98.7 | Very high | 125 Ų | 125 | 99.4 Ų | 99.4 | 58% | 0.584 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.2 | -43.8 | 176.3 | -72 | 176.8 | 17.5 | 0 | 0 | 112.2 | D177 A178 S183 Q184 L185 | D177-Q181 WeakPolarHBondContact O-CG 3.33Å; D177-Q181 PolarHBondContact O-N 3.27Å; A178-Q181 PolarHBondContact O-N 3.18Å; Q181-S183 VanDerWaalsContact C-N 3.33Å; Q181-S183 PolarHBondContact O-N 2.95Å; Q181-Q184 PolarHBondContact O-N 2.98Å; Q181-L185 WeakPolarHBondContact O-CG 3.29Å; Q181-L185 PolarHBondContact O-N 3.44Å |
| 182 | I | 98.7 | Very high | 98.7 | Very high | 99 Ų | 99 | 97.1 Ų | 97.1 | 51% | 0.508 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.5 | -46.5 | 175.8 | -70.8 | 166.6 | 0 | 0 | 0 | 110 | A178 Q184 L185 L186 | A178-I182 WeakPolarHBondContact O-CB 3.3Å; A178-I182 VanDerWaalsContact O-CG1 3.29Å; A178-I182 WeakPolarHBondContact O-CG1 3.36Å; A178-I182 PolarHBondContact O-N 3.44Å; I182-Q184 VanDerWaalsContact C-N 3.34Å; I182-Q184 PolarHBondContact O-N 2.91Å; I182-L185 PolarHBondContact O-N 3.47Å; I182-L186 HydrophobicContact CG2-CD1 4.04Å; I182-L186 HydrophobicContact CG2-CG 4.42Å; I182-L186 WeakPolarHBondContact O-CG 3.49Å; I182-L186 PolarHBondContact O-N 2.89Å |
| 183 | S | 98.6 | Very high | 98.7 | Very high | 61 Ų | 61 | 98.2 Ų | 98.2 | 43% | 0.427 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.2 | -40.9 | 178.3 | -58.6 | 0 | 0 | 0 | 0 | 112.3 | E179 G180 Q181 L186 N187 | E179-S183 WeakPolarHBondContact O-CB 3.36Å; E179-S183 PolarHBondContact O-N 3.04Å; E179-S183 PolarHBondContact O-OG 3.07Å; G180-S183 PolarHBondContact O-N 3.47Å; Q181-S183 VanDerWaalsContact C-N 3.33Å; Q181-S183 PolarHBondContact O-N 2.95Å; S183-L186 PolarHBondContact O-N 3.35Å; S183-N187 PolarHBondContact O-N 2.85Å; S183-N187 PolarHBondContact O-ND2 3.35Å |
| 184 | Q | 98.6 | Very high | 98.7 | Very high | 132 Ų | 132 | 97.8 Ų | 97.8 | 62% | 0.617 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.3 | -41 | 174.8 | -72.6 | 175.9 | 6.7 | 0 | 0 | 112.4 | G180 Q181 I182 N187 R188 | G180-Q184 WeakPolarHBondContact O-CG 3.35Å; G180-Q184 PolarHBondContact O-N 2.91Å; Q181-Q184 PolarHBondContact O-N 2.98Å; I182-Q184 VanDerWaalsContact C-N 3.34Å; I182-Q184 PolarHBondContact O-N 2.91Å; Q184-N187 PolarHBondContact O-N 2.82Å; Q184-R188 WeakPolarHBondContact O-CG 3.36Å; Q184-R188 PolarHBondContact O-N 2.97Å; Q184-R188 VanDerWaalsContact O-N 3.08Å |
| 185 | L | 98.7 | Very high | 98.6 | Very high | 98 Ų | 98 | 96.2 Ų | 96.2 | 51% | 0.513 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.2 | -42.7 | 176.7 | -74.1 | 173.7 | 0 | 0 | 0 | 111.7 | Q181 I182 R188 V189 | Q181-L185 WeakPolarHBondContact O-CG 3.29Å; Q181-L185 PolarHBondContact O-N 3.44Å; I182-L185 PolarHBondContact O-N 3.47Å; L185-R188 PolarHBondContact O-N 3.42Å; L185-V189 WeakPolarHBondContact O-CG2 3.43Å; L185-V189 PolarHBondContact O-N 3.44Å |
| 186 | L | 98.7 | Very high | 98.6 | Very high | 101 Ų | 101 | 96.7 Ų | 96.7 | 53% | 0.529 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -58.7 | -48.6 | 175.5 | -72 | 172.5 | 0 | 0 | 0 | 111.2 | I182 S183 R188 V189 D190 | I182-L186 HydrophobicContact CG2-CD1 4.04Å; I182-L186 HydrophobicContact CG2-CG 4.42Å; I182-L186 WeakPolarHBondContact O-CG 3.49Å; I182-L186 PolarHBondContact O-N 2.89Å; S183-L186 PolarHBondContact O-N 3.35Å; L186-R188 VanDerWaalsContact C-N 3.29Å; L186-R188 PolarHBondContact O-N 2.97Å; L186-V189 WeakPolarHBondContact O-CB 3.31Å; L186-V189 PolarHBondContact O-N 3.19Å; L186-V189 VanDerWaalsContact O-N 3.09Å; L186-D190 PolarHBondContact O-N 3.43Å |
| 187 | N | 98.6 | Very high | 98.6 | Very high | 100 Ų | 100 | 92.4 Ų | 92.4 | 54% | 0.535 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.1 | -40.3 | 176.3 | -72.8 | -29.3 | 0 | 0 | 0 | 112.6 | S183 Q184 D190 L191 | S183-N187 PolarHBondContact O-N 2.85Å; S183-N187 PolarHBondContact O-ND2 3.35Å; Q184-N187 PolarHBondContact O-N 2.82Å; N187-D190 PolarHBondContact O-N 3.03Å; N187-L191 WeakPolarHBondContact O-CB 3.34Å; N187-L191 VanDerWaalsContact O-CG 3.31Å; N187-L191 WeakPolarHBondContact O-CG 3.41Å; N187-L191 PolarHBondContact O-N 3.46Å |
| 188 | R | 98.7 | Very high | 98.6 | Very high | 177 Ų | 177 | 91.6 Ų | 91.6 | 67% | 0.668 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -65.8 | -39.3 | 176.7 | -74 | 173.1 | 64 | 175.1 | 0.6 | 112.3 | Q184 L185 L186 S192 | Q184-R188 WeakPolarHBondContact O-CG 3.36Å; Q184-R188 PolarHBondContact O-N 2.97Å; Q184-R188 VanDerWaalsContact O-N 3.08Å; L185-R188 PolarHBondContact O-N 3.42Å; L186-R188 VanDerWaalsContact C-N 3.29Å; L186-R188 PolarHBondContact O-N 2.97Å; R188-S192 WeakPolarHBondContact O-CB 3.22Å; R188-S192 PolarHBondContact O-N 3.34Å |
| 189 | V | 98.7 | Very high | 98.6 | Very high | 81 Ų | 81 | 95 Ų | 95 | 49% | 0.491 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.5 | -45.7 | 175.7 | 169 | 0 | 0 | 0 | 0 | 110.2 | L185 L186 L191 S192 I193 | L185-V189 WeakPolarHBondContact O-CG2 3.43Å; L185-V189 PolarHBondContact O-N 3.44Å; L186-V189 WeakPolarHBondContact O-CB 3.31Å; L186-V189 PolarHBondContact O-N 3.19Å; L186-V189 VanDerWaalsContact O-N 3.09Å; V189-L191 PolarHBondContact O-N 2.86Å; V189-S192 WeakPolarHBondContact O-CB 3.35Å; V189-S192 PolarHBondContact O-N 2.88Å; V189-I193 HydrophobicContact CG1-CD1 3.7Å; V189-I193 HydrophobicContact CG1-CG1 4.33Å; V189-I193 VanDerWaalsContact O-CG1 3.3Å; V189-I193 WeakPolarHBondContact O-CG1 3.28Å; V189-I193 PolarHBondContact O-N 3.18Å |
| 190 | D | 98.6 | Very high | 98.6 | Very high | 92 Ų | 92 | 95.9 Ų | 95.9 | 49% | 0.492 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.4 | -41.3 | 179.1 | -72.4 | -26.5 | 0 | 0 | 0 | 112.9 | L186 N187 I193 S194 | L186-D190 PolarHBondContact O-N 3.43Å; N187-D190 PolarHBondContact O-N 3.03Å; D190-I193 PolarHBondContact O-N 3.4Å; D190-S194 WeakPolarHBondContact O-CB 3.47Å; D190-S194 PolarHBondContact O-N 3Å; D190-S194 PolarHBondContact O-OG 2.84Å |
| 191 | L | 98.6 | Very high | 98.5 | Very high | 109 Ų | 109 | 100.3 Ų | 100.3 | 57% | 0.571 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.9 | -46.9 | 172.3 | -73.6 | 172.1 | 0 | 0 | 0 | 111 | N187 V189 I193 S194 E195 | N187-L191 WeakPolarHBondContact O-CB 3.34Å; N187-L191 VanDerWaalsContact O-CG 3.31Å; N187-L191 WeakPolarHBondContact O-CG 3.41Å; N187-L191 PolarHBondContact O-N 3.46Å; V189-L191 PolarHBondContact O-N 2.86Å; L191-I193 PolarHBondContact O-N 2.99Å; L191-S194 WeakPolarHBondContact O-CB 3.46Å; L191-S194 PolarHBondContact O-N 3.43Å; L191-E195 WeakPolarHBondContact O-CG 3.42Å; L191-E195 PolarHBondContact O-N 3.07Å |
| 192 | S | 98.7 | Very high | 98.5 | Very high | 56 Ų | 56 | 99 Ų | 99 | 39% | 0.392 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.2 | -42.6 | 178.6 | -167.2 | 0 | 0 | 0 | 0 | 112.1 | R188 V189 S194 E195 Q196 | R188-S192 WeakPolarHBondContact O-CB 3.22Å; R188-S192 PolarHBondContact O-N 3.34Å; V189-S192 WeakPolarHBondContact O-CB 3.35Å; V189-S192 PolarHBondContact O-N 2.88Å; S192-S194 VanDerWaalsContact C-N 3.31Å; S192-S194 PolarHBondContact O-N 2.91Å; S192-E195 PolarHBondContact O-N 3.45Å; S192-Q196 WeakPolarHBondContact O-CB 3.3Å; S192-Q196 VanDerWaalsContact O-CG 3.28Å; S192-Q196 WeakPolarHBondContact O-CG 3.49Å; S192-Q196 PolarHBondContact O-N 2.87Å |
| 193 | I | 98.7 | Very high | 98.5 | Very high | 101 Ų | 101 | 98 Ų | 98 | 52% | 0.518 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.2 | -43.7 | 175.1 | -71.4 | 168.4 | 0 | 0 | 0 | 110.5 | V189 D190 L191 Q196 S197 | V189-I193 HydrophobicContact CG1-CD1 3.7Å; V189-I193 HydrophobicContact CG1-CG1 4.33Å; V189-I193 VanDerWaalsContact O-CG1 3.3Å; V189-I193 WeakPolarHBondContact O-CG1 3.28Å; V189-I193 PolarHBondContact O-N 3.18Å; D190-I193 PolarHBondContact O-N 3.4Å; L191-I193 PolarHBondContact O-N 2.99Å; I193-Q196 PolarHBondContact O-N 3.46Å; I193-S197 WeakPolarHBondContact O-CB 3.37Å; I193-S197 PolarHBondContact O-N 3.29Å |
| 194 | S | 98.5 | Very high | 98.5 | Very high | 70 Ų | 70 | 100.7 Ų | 100.7 | 49% | 0.49 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64 | -44.6 | 178.2 | -60.7 | 0 | 0 | 0 | 0 | 111.9 | D190 L191 S192 S197 T198 | D190-S194 WeakPolarHBondContact O-CB 3.47Å; D190-S194 PolarHBondContact O-N 3Å; D190-S194 PolarHBondContact O-OG 2.84Å; L191-S194 WeakPolarHBondContact O-CB 3.46Å; L191-S194 PolarHBondContact O-N 3.43Å; S192-S194 VanDerWaalsContact C-N 3.31Å; S192-S194 PolarHBondContact O-N 2.91Å; S194-S197 PolarHBondContact O-N 3.09Å; S194-T198 WeakPolarHBondContact O-CG2 3.28Å; S194-T198 PolarHBondContact O-N 2.91Å; S194-T198 PolarHBondContact O-OG1 2.95Å |
| 195 | E | 98.5 | Very high | 98.4 | Very high | 101 Ų | 101 | 102.4 Ų | 102.4 | 47% | 0.472 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.8 | -44.1 | 174.5 | -73.3 | 177.2 | -173 | 0 | 0 | 112.3 | L191 S192 T198 K199 | L191-E195 WeakPolarHBondContact O-CG 3.42Å; L191-E195 PolarHBondContact O-N 3.07Å; S192-E195 PolarHBondContact O-N 3.45Å; E195-T198 WeakPolarHBondContact CA-OG1 3.37Å; E195-T198 PolarHBondContact O-N 3.45Å; E195-T198 PolarHBondContact O-OG1 3.49Å; E195-K199 WeakPolarHBondContact O-CB 3.38Å; E195-K199 VanDerWaalsContact O-CG 3.28Å; E195-K199 WeakPolarHBondContact O-CG 3.47Å; E195-K199 PolarHBondContact O-N 2.95Å |
| 196 | Q | 98.4 | Very high | 98.4 | Very high | 104 Ų | 104 | 102 Ų | 102 | 49% | 0.486 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.8 | -40 | 178.3 | -67.1 | -58.6 | -25.7 | 0 | 0 | 111.8 | S192 I193 T198 K199 L200 | S192-Q196 WeakPolarHBondContact O-CB 3.3Å; S192-Q196 VanDerWaalsContact O-CG 3.28Å; S192-Q196 WeakPolarHBondContact O-CG 3.49Å; S192-Q196 PolarHBondContact O-N 2.87Å; I193-Q196 PolarHBondContact O-N 3.46Å; Q196-T198 VanDerWaalsContact C-N 3.33Å; Q196-T198 PolarHBondContact O-N 3.21Å; Q196-K199 PolarHBondContact O-N 3.41Å; Q196-L200 WeakPolarHBondContact O-CB 3.43Å; Q196-L200 PolarHBondContact O-N 3.08Å |
| 197 | S | 98.6 | Very high | 98.4 | Very high | 52 Ų | 52 | 99.9 Ų | 99.9 | 36% | 0.364 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.2 | -42.7 | 175.4 | -176.1 | 0 | 0 | 0 | 0 | 111.7 | I193 S194 K201 | I193-S197 WeakPolarHBondContact O-CB 3.37Å; I193-S197 PolarHBondContact O-N 3.29Å; S194-S197 PolarHBondContact O-N 3.09Å; S197-K201 WeakPolarHBondContact O-CB 3.39Å; S197-K201 VanDerWaalsContact O-CG 3.29Å; S197-K201 WeakPolarHBondContact O-CG 3.49Å; S197-K201 PolarHBondContact O-N 3.29Å |
| 198 | T | 98 | Very high | 98.4 | Very high | 80 Ų | 80 | 98.1 Ų | 98.1 | 49% | 0.491 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -68 | -45.2 | 176.1 | 51.7 | 0 | 0 | 0 | 0 | 112.3 | S194 E195 Q196 L200 K201 M202 | S194-T198 WeakPolarHBondContact O-CG2 3.28Å; S194-T198 PolarHBondContact O-N 2.91Å; S194-T198 PolarHBondContact O-OG1 2.95Å; E195-T198 WeakPolarHBondContact CA-OG1 3.37Å; E195-T198 PolarHBondContact O-N 3.45Å; E195-T198 PolarHBondContact O-OG1 3.49Å; Q196-T198 VanDerWaalsContact C-N 3.33Å; Q196-T198 PolarHBondContact O-N 3.21Å; T198-L200 VanDerWaalsContact C-N 3.34Å; T198-L200 PolarHBondContact O-N 3.18Å; T198-K201 PolarHBondContact O-N 3.27Å; T198-M202 WeakPolarHBondContact O-CG 3.31Å; T198-M202 PolarHBondContact O-N 3.34Å |
| 199 | K | 98.3 | Very high | 98.3 | Very high | 115 Ų | 115 | 95.4 Ų | 95.4 | 50% | 0.5 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -57.3 | -45.1 | 174.6 | -75.2 | 172.1 | -176.8 | 170.2 | 0 | 112.2 | E195 Q196 M202 S203 | E195-K199 WeakPolarHBondContact O-CB 3.38Å; E195-K199 VanDerWaalsContact O-CG 3.28Å; E195-K199 WeakPolarHBondContact O-CG 3.47Å; E195-K199 PolarHBondContact O-N 2.95Å; Q196-K199 PolarHBondContact O-N 3.41Å; K199-M202 PolarHBondContact O-N 3.47Å; K199-S203 WeakPolarHBondContact O-CB 3.49Å; K199-S203 PolarHBondContact O-N 2.89Å |
| 200 | L | 98.3 | Very high | 98.3 | Very high | 128 Ų | 128 | 97.9 Ų | 97.9 | 67% | 0.67 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.4 | -44.3 | 178.3 | -171.9 | 115.7 | 0 | 0 | 0 | 111.6 | Q196 T198 M202 S203 H204 | Q196-L200 WeakPolarHBondContact O-CB 3.43Å; Q196-L200 PolarHBondContact O-N 3.08Å; T198-L200 VanDerWaalsContact C-N 3.34Å; T198-L200 PolarHBondContact O-N 3.18Å; L200-M202 PolarHBondContact O-N 2.79Å; L200-S203 PolarHBondContact O-N 2.95Å; L200-H204 VanDerWaalsContact O-CB 3.3Å; L200-H204 WeakPolarHBondContact O-CB 3.37Å; L200-H204 PolarHBondContact O-N 2.98Å |
| 201 | K | 98.4 | Very high | 98.3 | Very high | 124 Ų | 124 | 98.2 Ų | 98.2 | 54% | 0.539 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.5 | -42 | 176 | -75.9 | 173 | -176.6 | 175.4 | 0 | 112.4 | S197 T198 R205 | S197-K201 WeakPolarHBondContact O-CB 3.39Å; S197-K201 VanDerWaalsContact O-CG 3.29Å; S197-K201 WeakPolarHBondContact O-CG 3.49Å; S197-K201 PolarHBondContact O-N 3.29Å; T198-K201 PolarHBondContact O-N 3.27Å; K201-R205 VanDerWaalsContact O-CG 3.31Å; K201-R205 WeakPolarHBondContact O-CG 3.42Å; K201-R205 PolarHBondContact O-N 3.41Å |
| 202 | M | 97.8 | Very high | 98.3 | Very high | 99 Ų | 99 | 98.9 Ų | 98.9 | 49% | 0.488 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.2 | -50 | 177.1 | -70.3 | -58.6 | -61.4 | 0 | 0 | 111.1 | T198 K199 L200 H204 R205 D206 | T198-M202 WeakPolarHBondContact O-CG 3.31Å; T198-M202 PolarHBondContact O-N 3.34Å; K199-M202 PolarHBondContact O-N 3.47Å; L200-M202 PolarHBondContact O-N 2.79Å; M202-H204 VanDerWaalsContact C-N 3.31Å; M202-H204 PolarHBondContact O-N 3.24Å; M202-R205 WeakPolarHBondContact O-CB 3.34Å; M202-R205 PolarHBondContact O-N 3.42Å; M202-D206 PolarHBondContact O-N 2.87Å |
| 203 | S | 98.1 | Very high | 98.3 | Very high | 78 Ų | 78 | 100.4 Ų | 100.4 | 55% | 0.545 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58.3 | -41.8 | 177.4 | 177.2 | 0 | 0 | 0 | 0 | 112.6 | K199 L200 D206 S207 | K199-S203 WeakPolarHBondContact O-CB 3.49Å; K199-S203 PolarHBondContact O-N 2.89Å; L200-S203 PolarHBondContact O-N 2.95Å; S203-D206 PolarHBondContact O-N 3.39Å; S203-S207 WeakPolarHBondContact O-CB 3.29Å; S203-S207 PolarHBondContact O-N 3.19Å |
| 204 | H | 98.2 | Very high | 98.3 | Very high | 116 Ų | 116 | 99.5 Ų | 99.5 | 54% | 0.537 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.5 | -39.4 | 175.6 | -179.5 | -100.6 | 0 | 0 | 0 | 112.3 | L200 M202 N208 | L200-H204 VanDerWaalsContact O-CB 3.3Å; L200-H204 WeakPolarHBondContact O-CB 3.37Å; L200-H204 PolarHBondContact O-N 2.98Å; M202-H204 VanDerWaalsContact C-N 3.31Å; M202-H204 PolarHBondContact O-N 3.24Å; H204-N208 PolarHBondContact CE1-ND2 2.91Å; H204-N208 PolarHBondContact ND1-ND2 2.95Å; H204-N208 PolarHBondContact NE2-ND2 3.33Å; H204-N208 WeakPolarHBondContact O-CB 3.5Å; H204-N208 VanDerWaalsContact O-CG 3.27Å; H204-N208 PolarHBondContact O-N 3.02Å; H204-N208 PolarHBondContact O-ND2 3.23Å |
| 205 | R | 98 | Very high | 98.3 | Very high | 169 Ų | 169 | 99.8 Ų | 99.8 | 64% | 0.638 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.5 | -45.6 | 174.3 | -77.1 | 175.4 | 177.1 | 179.2 | -1.7 | 111.6 | K201 M202 N208 H209 | K201-R205 VanDerWaalsContact O-CG 3.31Å; K201-R205 WeakPolarHBondContact O-CG 3.42Å; K201-R205 PolarHBondContact O-N 3.41Å; M202-R205 WeakPolarHBondContact O-CB 3.34Å; M202-R205 PolarHBondContact O-N 3.42Å; R205-N208 PolarHBondContact O-N 3.12Å; R205-H209 WeakPolarHBondContact O-CB 3.4Å; R205-H209 PolarHBondContact O-N 2.89Å |
| 206 | D | 98 | Very high | 98.3 | Very high | 90 Ų | 90 | 99.4 Ų | 99.4 | 48% | 0.481 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.2 | -44.8 | 179.6 | -66.5 | -18.8 | 0 | 0 | 0 | 111 | M202 S203 H209 Q210 | M202-D206 PolarHBondContact O-N 2.87Å; S203-D206 PolarHBondContact O-N 3.39Å; D206-H209 PolarHBondContact O-N 3.37Å; D206-Q210 WeakPolarHBondContact O-CG 3.36Å; D206-Q210 PolarHBondContact O-N 3Å |
| 207 | S | 97.9 | Very high | 98.3 | Very high | 56 Ų | 56 | 100.7 Ų | 100.7 | 39% | 0.392 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.7 | -46.4 | 175.9 | -178.2 | 0 | 0 | 0 | 0 | 111.8 | S203 H209 Q210 L211 | S203-S207 WeakPolarHBondContact O-CB 3.29Å; S203-S207 PolarHBondContact O-N 3.19Å; S207-H209 VanDerWaalsContact C-N 3.31Å; S207-H209 PolarHBondContact O-N 3.21Å; S207-Q210 PolarHBondContact O-N 3.47Å; S207-L211 WeakPolarHBondContact O-CG 3.36Å; S207-L211 PolarHBondContact O-N 2.91Å |
| 208 | N | 98.6 | Very high | 98.3 | Very high | 62 Ų | 62 | 104.1 Ų | 104.1 | 33% | 0.332 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.4 | -39.2 | 175.9 | -77.1 | -28 | 0 | 0 | 0 | 112.3 | H204 R205 L211 Q212 | H204-N208 PolarHBondContact CE1-ND2 2.91Å; H204-N208 PolarHBondContact ND1-ND2 2.95Å; H204-N208 PolarHBondContact NE2-ND2 3.33Å; H204-N208 WeakPolarHBondContact O-CB 3.5Å; H204-N208 VanDerWaalsContact O-CG 3.27Å; H204-N208 PolarHBondContact O-N 3.02Å; H204-N208 PolarHBondContact O-ND2 3.23Å; R205-N208 PolarHBondContact O-N 3.12Å; N208-L211 PolarHBondContact O-N 3.34Å; N208-Q212 VanDerWaalsContact O-CG 3.32Å; N208-Q212 WeakPolarHBondContact O-CG 3.41Å; N208-Q212 PolarHBondContact O-N 2.93Å |
| 209 | H | 98.5 | Very high | 98.3 | Very high | 120 Ų | 120 | 105.7 Ų | 105.7 | 56% | 0.556 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.8 | -42.5 | 175.9 | -176.4 | 64.1 | 0 | 0 | 0 | 111.7 | R205 D206 S207 Q212 L213 | R205-H209 WeakPolarHBondContact O-CB 3.4Å; R205-H209 PolarHBondContact O-N 2.89Å; D206-H209 PolarHBondContact O-N 3.37Å; S207-H209 VanDerWaalsContact C-N 3.31Å; S207-H209 PolarHBondContact O-N 3.21Å; H209-Q212 PolarHBondContact O-N 3.23Å; H209-L213 PolarHBondContact O-N 3.38Å |
| 210 | Q | 98.4 | Very high | 98.3 | Very high | 133 Ų | 133 | 101.8 Ų | 101.8 | 62% | 0.621 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.6 | -41.4 | 174.4 | -73.9 | 178.9 | -5.6 | 0 | 0 | 112.2 | D206 S207 L213 L214 | D206-Q210 WeakPolarHBondContact O-CG 3.36Å; D206-Q210 PolarHBondContact O-N 3Å; S207-Q210 PolarHBondContact O-N 3.47Å; Q210-L213 PolarHBondContact O-N 2.93Å; Q210-L214 WeakPolarHBondContact O-CB 3.39Å; Q210-L214 PolarHBondContact O-N 3.43Å |
| 211 | L | 98.5 | Very high | 98.3 | Very high | 99 Ų | 99 | 99.3 Ų | 99.3 | 52% | 0.518 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.3 | -41.8 | 175.1 | -73.5 | 173.4 | 0 | 0 | 0 | 111.9 | S207 N208 L214 D215 | S207-L211 WeakPolarHBondContact O-CG 3.36Å; S207-L211 PolarHBondContact O-N 2.91Å; N208-L211 PolarHBondContact O-N 3.34Å; L211-L214 PolarHBondContact O-N 2.97Å; L211-D215 WeakPolarHBondContact O-CB 2.92Å; L211-D215 PolarHBondContact O-N 3.02Å |
| 212 | Q | 98.4 | Very high | 98.3 | Very high | 123 Ų | 123 | 97.9 Ų | 97.9 | 58% | 0.575 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.4 | -41.4 | 174.6 | -74.5 | 173.8 | 5.2 | 0 | 0 | 112.3 | N208 H209 L214 D215 T216 | N208-Q212 VanDerWaalsContact O-CG 3.32Å; N208-Q212 WeakPolarHBondContact O-CG 3.41Å; N208-Q212 PolarHBondContact O-N 2.93Å; H209-Q212 PolarHBondContact O-N 3.23Å; Q212-L214 VanDerWaalsContact C-N 3.32Å; Q212-D215 PolarHBondContact O-N 3.03Å; Q212-T216 WeakPolarHBondContact O-CB 3.34Å; Q212-T216 PolarHBondContact O-N 3.38Å; Q212-T216 PolarHBondContact O-OG1 3.43Å |
| 213 | L | 98.3 | Very high | 98.4 | Very high | 88 Ų | 88 | 99.1 Ų | 99.1 | 46% | 0.461 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.7 | -41.1 | 175.9 | -177.2 | 64.1 | 0 | 0 | 0 | 111.1 | H209 Q210 T216 K217 | H209-L213 PolarHBondContact O-N 3.38Å; Q210-L213 PolarHBondContact O-N 2.93Å; L213-T216 PolarHBondContact O-N 2.87Å; L213-K217 WeakPolarHBondContact O-CG 3.29Å; L213-K217 PolarHBondContact O-N 3.46Å |
| 214 | L | 98.3 | Very high | 98.4 | Very high | 82 Ų | 82 | 100.2 Ų | 100.2 | 43% | 0.429 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.4 | -45.4 | 177.1 | -174.6 | 63.1 | 0 | 0 | 0 | 111.6 | Q210 L211 Q212 T216 K217 F218 | Q210-L214 WeakPolarHBondContact O-CB 3.39Å; Q210-L214 PolarHBondContact O-N 3.43Å; L211-L214 PolarHBondContact O-N 2.97Å; Q212-L214 VanDerWaalsContact C-N 3.32Å; L214-T216 VanDerWaalsContact C-N 3.34Å; L214-T216 PolarHBondContact O-N 3.49Å; L214-K217 PolarHBondContact O-N 3.34Å; L214-F218 HydrophobicContact CD1-CD2 3.89Å; L214-F218 HydrophobicContact CD1-CE2 3.46Å; L214-F218 VanDerWaalsContact CD1-CE2 3.46Å; L214-F218 HydrophobicContact CD1-CZ 4.23Å; L214-F218 HydrophobicContact CD2-CE2 3.97Å; L214-F218 HydrophobicContact CG-CD2 3.72Å; L214-F218 HydrophobicContact CG-CE2 3.49Å; L214-F218 VanDerWaalsContact CG-CE2 3.49Å; L214-F218 VanDerWaalsContact O-CD2 3.25Å; L214-F218 WeakPolarHBondContact O-CD2 3.4Å; L214-F218 PolarHBondContact O-N 3.39Å |
| 215 | D | 98.6 | Very high | 98.4 | Very high | 76 Ų | 76 | 99.4 Ų | 99.4 | 41% | 0.406 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58.8 | -44.5 | 174.8 | 179.3 | 63.7 | 0 | 0 | 0 | 111.6 | L211 Q212 K217 F218 K219 | L211-D215 WeakPolarHBondContact O-CB 2.92Å; L211-D215 PolarHBondContact O-N 3.02Å; Q212-D215 PolarHBondContact O-N 3.03Å; D215-K217 PolarHBondContact O-N 2.83Å; D215-F218 PolarHBondContact O-N 3.29Å; D215-K219 WeakPolarHBondContact O-CB 3.38Å; D215-K219 WeakPolarHBondContact O-CG 3.42Å; D215-K219 PolarHBondContact O-N 3.03Å; D215-K219 IonicContact OD1-NZ 3.55Å; D215-K219 VanDerWaalsContact OD2-CE 3.27Å; D215-K219 WeakPolarHBondContact OD2-CE 3.38Å; D215-K219 IonicContact OD2-NZ 2.84Å; D215-K219 PolarHBondContact OD2-NZ 3.48Å |
| 216 | T | 98.4 | Very high | 98.4 | Very high | 93 Ų | 93 | 94.2 Ų | 94.2 | 57% | 0.571 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61.7 | -44.1 | 176.9 | -55.5 | 0 | 0 | 0 | 0 | 111.5 | Q212 L213 L214 K219 G220 | Q212-T216 WeakPolarHBondContact O-CB 3.34Å; Q212-T216 PolarHBondContact O-N 3.38Å; Q212-T216 PolarHBondContact O-OG1 3.43Å; L213-T216 PolarHBondContact O-N 2.87Å; L214-T216 VanDerWaalsContact C-N 3.34Å; L214-T216 PolarHBondContact O-N 3.49Å; T216-K219 PolarHBondContact O-N 2.95Å; T216-G220 PolarHBondContact O-N 3.3Å |
| 217 | K | 98.5 | Very high | 98.4 | Very high | 132 Ų | 132 | 94 Ų | 94 | 57% | 0.574 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.3 | -46.5 | 175.7 | -76.5 | 179.7 | 179.5 | -176.7 | 0 | 111.6 | L213 L214 D215 G220 T221 | L213-K217 WeakPolarHBondContact O-CG 3.29Å; L213-K217 PolarHBondContact O-N 3.46Å; L214-K217 PolarHBondContact O-N 3.34Å; D215-K217 PolarHBondContact O-N 2.83Å; K217-G220 PolarHBondContact O-N 3.01Å; K217-T221 WeakPolarHBondContact O-CG2 3.34Å; K217-T221 PolarHBondContact O-N 2.92Å; K217-T221 PolarHBondContact O-OG1 2.86Å |
| 218 | F | 98.6 | Very high | 98.5 | Very high | 124 Ų | 124 | 96.1 Ų | 96.1 | 54% | 0.544 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.9 | -46.8 | 178.5 | -84.7 | -59.4 | 0 | 0 | 0 | 111.7 | L214 D215 G220 T221 V222 | L214-F218 HydrophobicContact CD1-CD2 3.89Å; L214-F218 HydrophobicContact CD1-CE2 3.46Å; L214-F218 VanDerWaalsContact CD1-CE2 3.46Å; L214-F218 HydrophobicContact CD1-CZ 4.23Å; L214-F218 HydrophobicContact CD2-CE2 3.97Å; L214-F218 HydrophobicContact CG-CD2 3.72Å; L214-F218 HydrophobicContact CG-CE2 3.49Å; L214-F218 VanDerWaalsContact CG-CE2 3.49Å; L214-F218 VanDerWaalsContact O-CD2 3.25Å; L214-F218 WeakPolarHBondContact O-CD2 3.4Å; L214-F218 PolarHBondContact O-N 3.39Å; D215-F218 PolarHBondContact O-N 3.29Å; F218-G220 VanDerWaalsContact C-N 3.34Å; F218-G220 PolarHBondContact O-N 3.43Å; F218-T221 WeakPolarHBondContact CA-OG1 3.4Å; F218-T221 PolarHBondContact O-N 3.32Å; F218-T221 VanDerWaalsContact O-N 3.17Å; F218-T221 PolarHBondContact O-OG1 3.29Å; F218-V222 VanDerWaalsContact O-CG2 3.32Å; F218-V222 WeakPolarHBondContact O-CG2 3.32Å; F218-V222 PolarHBondContact O-N 3.19Å |
| 219 | K | 98.6 | Very high | 98.5 | Very high | 112 Ų | 112 | 98.8 Ų | 98.8 | 49% | 0.487 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -55.3 | -49 | 174.2 | -76.5 | 172.4 | 176.9 | 163.2 | 0 | 111.7 | D215 T216 T221 V222 E223 | D215-K219 WeakPolarHBondContact O-CB 3.38Å; D215-K219 WeakPolarHBondContact O-CG 3.42Å; D215-K219 PolarHBondContact O-N 3.03Å; D215-K219 IonicContact OD1-NZ 3.55Å; D215-K219 VanDerWaalsContact OD2-CE 3.27Å; D215-K219 WeakPolarHBondContact OD2-CE 3.38Å; D215-K219 IonicContact OD2-NZ 2.84Å; D215-K219 PolarHBondContact OD2-NZ 3.48Å; T216-K219 PolarHBondContact O-N 2.95Å; K219-T221 VanDerWaalsContact C-N 3.34Å; K219-T221 PolarHBondContact O-N 3Å; K219-V222 PolarHBondContact O-N 3.05Å; K219-E223 WeakPolarHBondContact O-CB 3.35Å; K219-E223 WeakPolarHBondContact O-CG 3.33Å; K219-E223 PolarHBondContact O-N 3.31Å |
| 220 | G | 98.4 | Very high | 98.5 | Very high | 34 Ų | 34 | 97.6 Ų | 97.6 | 35% | 0.351 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.2 | -42.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | T216 K217 F218 E223 E224 | T216-G220 PolarHBondContact O-N 3.3Å; K217-G220 PolarHBondContact O-N 3.01Å; F218-G220 VanDerWaalsContact C-N 3.34Å; F218-G220 PolarHBondContact O-N 3.43Å; G220-E223 PolarHBondContact O-N 2.97Å; G220-E224 WeakPolarHBondContact O-CB 3.43Å; G220-E224 PolarHBondContact O-N 3.34Å |
| 221 | T | 98.6 | Very high | 98.5 | Very high | 75 Ų | 75 | 95 Ų | 95 | 46% | 0.46 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -68.1 | -36.4 | 177 | 56.5 | 0 | 0 | 0 | 0 | 113.2 | K217 F218 K219 L225 | K217-T221 WeakPolarHBondContact O-CG2 3.34Å; K217-T221 PolarHBondContact O-N 2.92Å; K217-T221 PolarHBondContact O-OG1 2.86Å; F218-T221 WeakPolarHBondContact CA-OG1 3.4Å; F218-T221 PolarHBondContact O-N 3.32Å; F218-T221 VanDerWaalsContact O-N 3.17Å; F218-T221 PolarHBondContact O-OG1 3.29Å; K219-T221 VanDerWaalsContact C-N 3.34Å; K219-T221 PolarHBondContact O-N 3Å; T221-L225 WeakPolarHBondContact O-CB 3.43Å; T221-L225 VanDerWaalsContact O-CG 3.3Å; T221-L225 WeakPolarHBondContact O-CG 3.42Å; T221-L225 PolarHBondContact O-N 3.46Å |
| 222 | V | 98.7 | Very high | 98.5 | Very high | 94 Ų | 94 | 92.8 Ų | 92.8 | 57% | 0.57 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -68.6 | -42.8 | 177.1 | 169.1 | 0 | 0 | 0 | 0 | 110.3 | F218 K219 L225 S226 | F218-V222 VanDerWaalsContact O-CG2 3.32Å; F218-V222 WeakPolarHBondContact O-CG2 3.32Å; F218-V222 PolarHBondContact O-N 3.19Å; K219-V222 PolarHBondContact O-N 3.05Å; V222-L225 PolarHBondContact O-N 3.32Å; V222-S226 VanDerWaalsContact O-CB 3.29Å; V222-S226 WeakPolarHBondContact O-CB 3.35Å; V222-S226 PolarHBondContact O-N 3.3Å |
| 223 | E | 98.5 | Very high | 98.5 | Very high | 126 Ų | 126 | 94.1 Ų | 94.1 | 59% | 0.589 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.8 | -45.6 | 174.8 | -75 | 173.7 | -174.2 | 0 | 0 | 111.6 | K219 G220 S226 N227 | K219-E223 WeakPolarHBondContact O-CB 3.35Å; K219-E223 WeakPolarHBondContact O-CG 3.33Å; K219-E223 PolarHBondContact O-N 3.31Å; G220-E223 PolarHBondContact O-N 2.97Å; E223-S226 WeakPolarHBondContact O-CB 3.37Å; E223-S226 PolarHBondContact O-N 2.9Å; E223-N227 WeakPolarHBondContact O-CB 3.24Å; E223-N227 VanDerWaalsContact O-CG 3.24Å; E223-N227 PolarHBondContact O-N 3.28Å; E223-N227 PolarHBondContact O-ND2 3.12Å |
| 224 | E | 98.4 | Very high | 98.5 | Very high | 101 Ų | 101 | 92.4 Ų | 92.4 | 47% | 0.472 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.9 | -47.8 | 176.7 | -179.6 | 56.9 | -153.2 | 0 | 0 | 111.9 | G220 S226 N227 Q228 | G220-E224 WeakPolarHBondContact O-CB 3.43Å; G220-E224 PolarHBondContact O-N 3.34Å; E224-S226 VanDerWaalsContact C-N 3.33Å; E224-S226 PolarHBondContact O-N 3Å; E224-N227 PolarHBondContact O-N 3.5Å; E224-Q228 WeakPolarHBondContact O-CG 3.32Å; E224-Q228 PolarHBondContact O-N 2.94Å; E224-Q228 PolarHBondContact OE1-NE2 3.08Å |
| 225 | L | 98.6 | Very high | 98.5 | Very high | 98 Ų | 98 | 96 Ų | 96 | 51% | 0.513 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.4 | -41.4 | 176 | -75.5 | 171.5 | 0 | 0 | 0 | 112 | T221 V222 N227 Q228 I229 | T221-L225 WeakPolarHBondContact O-CB 3.43Å; T221-L225 VanDerWaalsContact O-CG 3.3Å; T221-L225 WeakPolarHBondContact O-CG 3.42Å; T221-L225 PolarHBondContact O-N 3.46Å; V222-L225 PolarHBondContact O-N 3.32Å; L225-N227 VanDerWaalsContact C-N 3.35Å; L225-N227 PolarHBondContact O-N 3.04Å; L225-Q228 PolarHBondContact O-N 2.88Å; L225-I229 WeakPolarHBondContact O-CB 3.46Å; L225-I229 VanDerWaalsContact O-CG1 3.27Å; L225-I229 WeakPolarHBondContact O-CG1 3.49Å; L225-I229 PolarHBondContact O-N 3.29Å |
| 226 | S | 98.6 | Very high | 98.5 | Very high | 60 Ų | 60 | 97.4 Ų | 97.4 | 42% | 0.42 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.4 | -46.4 | 175.4 | -175.6 | 0 | 0 | 0 | 0 | 111.1 | V222 E223 E224 Q228 I229 L230 | V222-S226 VanDerWaalsContact O-CB 3.29Å; V222-S226 WeakPolarHBondContact O-CB 3.35Å; V222-S226 PolarHBondContact O-N 3.3Å; E223-S226 WeakPolarHBondContact O-CB 3.37Å; E223-S226 PolarHBondContact O-N 2.9Å; E224-S226 VanDerWaalsContact C-N 3.33Å; E224-S226 PolarHBondContact O-N 3Å; S226-Q228 PolarHBondContact O-N 2.97Å; S226-I229 PolarHBondContact O-N 3.41Å; S226-L230 WeakPolarHBondContact O-CG 2.97Å; S226-L230 PolarHBondContact O-N 2.95Å |
| 227 | N | 98.5 | Very high | 98.5 | Very high | 87 Ų | 87 | 97.3 Ų | 97.3 | 47% | 0.465 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.7 | -40.3 | 177.4 | -70.5 | -24.9 | 0 | 0 | 0 | 112.4 | E223 E224 L225 L230 S231 | E223-N227 WeakPolarHBondContact O-CB 3.24Å; E223-N227 VanDerWaalsContact O-CG 3.24Å; E223-N227 PolarHBondContact O-N 3.28Å; E223-N227 PolarHBondContact O-ND2 3.12Å; E224-N227 PolarHBondContact O-N 3.5Å; L225-N227 VanDerWaalsContact C-N 3.35Å; L225-N227 PolarHBondContact O-N 3.04Å; N227-L230 PolarHBondContact O-N 3.43Å; N227-S231 WeakPolarHBondContact O-CB 3.29Å; N227-S231 PolarHBondContact O-N 2.92Å; N227-S231 PolarHBondContact O-OG 3.33Å |
| 228 | Q | 98.5 | Very high | 98.5 | Very high | 99 Ų | 99 | 96.9 Ų | 96.9 | 46% | 0.463 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.8 | -44.5 | 175.3 | -72.7 | 176.9 | 14.9 | 0 | 0 | 111.8 | E224 L225 S226 S231 A232 | E224-Q228 WeakPolarHBondContact O-CG 3.32Å; E224-Q228 PolarHBondContact O-N 2.94Å; E224-Q228 PolarHBondContact OE1-NE2 3.08Å; L225-Q228 PolarHBondContact O-N 2.88Å; S226-Q228 PolarHBondContact O-N 2.97Å; Q228-S231 PolarHBondContact O-N 2.87Å; Q228-A232 WeakPolarHBondContact O-CB 3.37Å; Q228-A232 PolarHBondContact O-N 3.49Å |
| 229 | I | 98.7 | Very high | 98.5 | Very high | 118 Ų | 118 | 93.5 Ų | 93.5 | 61% | 0.605 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.7 | -44.8 | 176.5 | -70.9 | 167 | 0 | 0 | 0 | 110.7 | L225 S226 A232 R233 | L225-I229 WeakPolarHBondContact O-CB 3.46Å; L225-I229 VanDerWaalsContact O-CG1 3.27Å; L225-I229 WeakPolarHBondContact O-CG1 3.49Å; L225-I229 PolarHBondContact O-N 3.29Å; S226-I229 PolarHBondContact O-N 3.41Å; I229-A232 PolarHBondContact O-N 3.28Å; I229-R233 VanDerWaalsContact O-CB 3.29Å; I229-R233 WeakPolarHBondContact O-CB 3.3Å; I229-R233 PolarHBondContact O-N 3.35Å |
| 230 | L | 98.5 | Very high | 98.4 | Very high | 96 Ų | 96 | 93.5 Ų | 93.5 | 50% | 0.503 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.4 | -42.1 | 177.2 | -72.2 | 173.7 | 0 | 0 | 0 | 112 | S226 N227 R233 S234 | S226-L230 WeakPolarHBondContact O-CG 2.97Å; S226-L230 PolarHBondContact O-N 2.95Å; N227-L230 PolarHBondContact O-N 3.43Å; L230-R233 PolarHBondContact O-N 3.49Å; L230-S234 PolarHBondContact O-N 3.5Å |
| 231 | S | 98.4 | Very high | 98.4 | Very high | 78 Ų | 78 | 96.9 Ų | 96.9 | 55% | 0.545 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.2 | -46.2 | 177.6 | -59.1 | 0 | 0 | 0 | 0 | 111.6 | N227 Q228 R233 S234 W235 | N227-S231 WeakPolarHBondContact O-CB 3.29Å; N227-S231 PolarHBondContact O-N 2.92Å; N227-S231 PolarHBondContact O-OG 3.33Å; Q228-S231 PolarHBondContact O-N 2.87Å; S231-R233 VanDerWaalsContact C-N 3.33Å; S231-R233 PolarHBondContact O-N 3.23Å; S231-S234 PolarHBondContact O-N 2.78Å; S231-W235 WeakPolarHBondContact O-CB 3.42Å; S231-W235 PolarHBondContact O-N 3.36Å |
| 232 | A | 98.6 | Very high | 98.4 | Very high | 52 Ų | 52 | 98.2 Ų | 98.2 | 43% | 0.43 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.2 | -41.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q228 I229 W235 L236 | Q228-A232 WeakPolarHBondContact O-CB 3.37Å; Q228-A232 PolarHBondContact O-N 3.49Å; I229-A232 PolarHBondContact O-N 3.28Å; A232-W235 PolarHBondContact O-N 3.19Å; A232-L236 WeakPolarHBondContact O-CB 3.29Å; A232-L236 WeakPolarHBondContact O-CG 3.38Å; A232-L236 PolarHBondContact O-N 3.01Å |
| 233 | R | 98.4 | Very high | 98.4 | Very high | 151 Ų | 151 | 97.1 Ų | 97.1 | 57% | 0.57 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61.1 | -47.9 | 174.5 | 179.9 | -178.7 | 174 | -178.1 | 0.2 | 111.7 | I229 L230 S231 W235 L236 Q237 | I229-R233 VanDerWaalsContact O-CB 3.29Å; I229-R233 WeakPolarHBondContact O-CB 3.3Å; I229-R233 PolarHBondContact O-N 3.35Å; L230-R233 PolarHBondContact O-N 3.49Å; S231-R233 VanDerWaalsContact C-N 3.33Å; S231-R233 PolarHBondContact O-N 3.23Å; R233-W235 VanDerWaalsContact C-N 3.32Å; R233-W235 PolarHBondContact O-N 3.09Å; R233-L236 PolarHBondContact O-N 2.73Å; R233-Q237 WeakPolarHBondContact O-CG 3.46Å; R233-Q237 PolarHBondContact O-N 2.87Å |
| 234 | S | 98.3 | Very high | 98.4 | Very high | 52 Ų | 52 | 95.6 Ų | 95.6 | 36% | 0.364 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -60.8 | -42.6 | 177.9 | 179.9 | 0 | 0 | 0 | 0 | 111.7 | L230 S231 Q237 Q238 | L230-S234 PolarHBondContact O-N 3.5Å; S231-S234 PolarHBondContact O-N 2.78Å; S234-Q237 PolarHBondContact O-N 2.89Å; S234-Q238 WeakPolarHBondContact O-CG 3.49Å; S234-Q238 PolarHBondContact O-N 3.4Å; S234-Q238 PolarHBondContact OG-NE2 3.41Å |
| 235 | W | 98.3 | Very high | 98.3 | Very high | 159 Ų | 159 | 96.9 Ų | 96.9 | 60% | 0.602 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -63.3 | -46.7 | 177.4 | -178.8 | 85.8 | 0 | 0 | 0 | 111.6 | S231 A232 R233 Q237 Q238 E239 | S231-W235 WeakPolarHBondContact O-CB 3.42Å; S231-W235 PolarHBondContact O-N 3.36Å; A232-W235 PolarHBondContact O-N 3.19Å; R233-W235 VanDerWaalsContact C-N 3.32Å; R233-W235 PolarHBondContact O-N 3.09Å; W235-Q237 VanDerWaalsContact C-N 3.31Å; W235-Q237 PolarHBondContact O-N 3.13Å; W235-Q238 PolarHBondContact O-N 2.86Å; W235-E239 HydrophobicContact CH2-CG 4.37Å; W235-E239 WeakPolarHBondContact O-CB 3.5Å; W235-E239 PolarHBondContact O-N 3.48Å |
| 236 | L | 98.5 | Very high | 98.3 | Very high | 105 Ų | 105 | 96.5 Ų | 96.5 | 55% | 0.55 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -60.2 | -39.7 | 176.4 | -77.6 | 170.6 | 0 | 0 | 0 | 112.3 | A232 R233 E239 Q240 | A232-L236 WeakPolarHBondContact O-CB 3.29Å; A232-L236 WeakPolarHBondContact O-CG 3.38Å; A232-L236 PolarHBondContact O-N 3.01Å; R233-L236 PolarHBondContact O-N 2.73Å; L236-E239 PolarHBondContact O-N 3.07Å; L236-Q240 VanDerWaalsContact O-CB 3.31Å; L236-Q240 WeakPolarHBondContact O-CB 3.49Å; L236-Q240 PolarHBondContact O-N 2.94Å |
| 237 | Q | 98.3 | Very high | 98.3 | Very high | 91 Ų | 91 | 98.5 Ų | 98.5 | 43% | 0.425 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.1 | -45.3 | 176.2 | -74.8 | 177.5 | -56.3 | 0 | 0 | 111.8 | R233 S234 W235 E239 Q240 E241 | R233-Q237 WeakPolarHBondContact O-CG 3.46Å; R233-Q237 PolarHBondContact O-N 2.87Å; S234-Q237 PolarHBondContact O-N 2.89Å; W235-Q237 VanDerWaalsContact C-N 3.31Å; W235-Q237 PolarHBondContact O-N 3.13Å; Q237-E239 VanDerWaalsContact C-N 3.34Å; Q237-E239 PolarHBondContact O-N 3.05Å; Q237-Q240 PolarHBondContact O-N 3.32Å; Q237-E241 WeakPolarHBondContact O-CG 3.29Å; Q237-E241 PolarHBondContact O-N 2.87Å |
| 238 | Q | 98.1 | Very high | 98.2 | Very high | 122 Ų | 122 | 99.3 Ų | 99.3 | 57% | 0.57 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -63.4 | -40.8 | 177.1 | -71.7 | 173.4 | 27.6 | 0 | 0 | 112 | S234 W235 E241 R242 | S234-Q238 WeakPolarHBondContact O-CG 3.49Å; S234-Q238 PolarHBondContact O-N 3.4Å; S234-Q238 PolarHBondContact OG-NE2 3.41Å; W235-Q238 PolarHBondContact O-N 2.86Å; Q238-E241 PolarHBondContact O-N 3.02Å; Q238-R242 WeakPolarHBondContact O-CB 3.49Å; Q238-R242 PolarHBondContact O-N 3.02Å |
| 239 | E | 98.3 | Very high | 98.2 | Very high | 54 Ų | 54 | 100.2 Ų | 100.2 | 25% | 0.252 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -67.3 | -40.6 | 177.9 | -176.6 | 62.4 | -177.9 | 0 | 0 | 111.7 | W235 L236 Q237 R242 I243 | W235-E239 HydrophobicContact CH2-CG 4.37Å; W235-E239 WeakPolarHBondContact O-CB 3.5Å; W235-E239 PolarHBondContact O-N 3.48Å; L236-E239 PolarHBondContact O-N 3.07Å; Q237-E239 VanDerWaalsContact C-N 3.34Å; Q237-E239 PolarHBondContact O-N 3.05Å; E239-R242 PolarHBondContact O-N 3.29Å; E239-R242 IonicContact OE1-CZ 2.63Å; E239-R242 IonicContact OE1-NE 3.61Å; E239-R242 IonicContact OE1-NH2 3.51Å; E239-R242 PolarHBondContact OE1-NH2 2.82Å; E239-R242 IonicContact OE2-CZ 3.86Å; E239-R242 IonicContact OE2-NE 3.75Å; E239-R242 PolarHBondContact OE2-NE 2.91Å; E239-R242 IonicContact OE2-NH2 3.45Å; E239-I243 HydrophobicContact CG-CD1 4.07Å; E239-I243 VanDerWaalsContact O-CG1 3.32Å; E239-I243 WeakPolarHBondContact O-CG1 3.4Å; E239-I243 PolarHBondContact O-N 3.42Å |
| 240 | Q | 98.2 | Very high | 98.1 | Very high | 111 Ų | 111 | 100.4 Ų | 100.4 | 52% | 0.519 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59 | -49.2 | 172.3 | -177.5 | -178.3 | -13.4 | 0 | 0 | 111.1 | L236 Q237 R242 I243 E244 | L236-Q240 VanDerWaalsContact O-CB 3.31Å; L236-Q240 WeakPolarHBondContact O-CB 3.49Å; L236-Q240 PolarHBondContact O-N 2.94Å; Q237-Q240 PolarHBondContact O-N 3.32Å; Q240-R242 VanDerWaalsContact C-N 3.3Å; Q240-R242 PolarHBondContact O-N 3.12Å; Q240-I243 PolarHBondContact O-N 3.28Å; Q240-E244 HydrophobicContact CG-CG 4.42Å; Q240-E244 WeakPolarHBondContact CG-OE1 3.29Å; Q240-E244 PolarHBondContact NE2-OE1 3.44Å; Q240-E244 WeakPolarHBondContact O-CB 3.46Å; Q240-E244 WeakPolarHBondContact O-CG 3.18Å; Q240-E244 PolarHBondContact O-N 3.03Å |
| 241 | E | 98.3 | Very high | 98.1 | Very high | 105 Ų | 105 | 100.8 Ų | 100.8 | 49% | 0.491 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.7 | -37.7 | 177.4 | -74.6 | 178.9 | -161.9 | 0 | 0 | 112.7 | Q237 Q238 K245 | Q237-E241 WeakPolarHBondContact O-CG 3.29Å; Q237-E241 PolarHBondContact O-N 2.87Å; Q238-E241 PolarHBondContact O-N 3.02Å; E241-K245 WeakPolarHBondContact O-CB 3.49Å; E241-K245 VanDerWaalsContact O-CG 3.3Å; E241-K245 WeakPolarHBondContact O-CG 3.38Å; E241-K245 PolarHBondContact O-N 2.86Å |
| 242 | R | 98 | Very high | 98 | Very high | 104 Ų | 104 | 101.8 Ų | 101.8 | 39% | 0.392 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.4 | -50.1 | 175.7 | -173.8 | -171.8 | 71.4 | 79.5 | 3.5 | 110.8 | Q238 E239 Q240 K245 E246 | Q238-R242 WeakPolarHBondContact O-CB 3.49Å; Q238-R242 PolarHBondContact O-N 3.02Å; E239-R242 PolarHBondContact O-N 3.29Å; E239-R242 IonicContact OE1-CZ 2.63Å; E239-R242 IonicContact OE1-NE 3.61Å; E239-R242 IonicContact OE1-NH2 3.51Å; E239-R242 PolarHBondContact OE1-NH2 2.82Å; E239-R242 IonicContact OE2-CZ 3.86Å; E239-R242 IonicContact OE2-NE 3.75Å; E239-R242 PolarHBondContact OE2-NE 2.91Å; E239-R242 IonicContact OE2-NH2 3.45Å; Q240-R242 VanDerWaalsContact C-N 3.3Å; Q240-R242 PolarHBondContact O-N 3.12Å; R242-K245 PolarHBondContact O-N 3.22Å; R242-E246 IonicContact CZ-OE1 2.73Å; R242-E246 IonicContact CZ-OE2 3Å; R242-E246 IonicContact NH1-OE1 2.92Å; R242-E246 PolarHBondContact NH1-OE1 3.37Å; R242-E246 IonicContact NH1-OE2 2.71Å; R242-E246 PolarHBondContact NH1-OE2 3.12Å; R242-E246 WeakPolarHBondContact O-CG 3.35Å; R242-E246 PolarHBondContact O-N 3.27Å |
| 243 | I | 98.2 | Very high | 97.9 | Very high | 71 Ų | 71 | 103.5 Ų | 103.5 | 36% | 0.364 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.7 | -43.8 | 179.2 | -68.8 | 168.2 | 0 | 0 | 0 | 110.7 | E239 Q240 K245 E246 L247 | E239-I243 HydrophobicContact CG-CD1 4.07Å; E239-I243 VanDerWaalsContact O-CG1 3.32Å; E239-I243 WeakPolarHBondContact O-CG1 3.4Å; E239-I243 PolarHBondContact O-N 3.42Å; Q240-I243 PolarHBondContact O-N 3.28Å; I243-K245 VanDerWaalsContact C-N 3.33Å; I243-K245 PolarHBondContact O-N 2.86Å; I243-E246 PolarHBondContact O-N 3.41Å; I243-L247 HydrophobicContact CG2-CD1 3.86Å; I243-L247 HydrophobicContact CG2-CG 4.19Å; I243-L247 WeakPolarHBondContact O-CB 3.38Å; I243-L247 VanDerWaalsContact O-CG 3.32Å; I243-L247 WeakPolarHBondContact O-CG 3.39Å; I243-L247 PolarHBondContact O-N 2.96Å |
| 244 | E | 98.2 | Very high | 97.8 | Very high | 93 Ų | 93 | 101.5 Ų | 101.5 | 44% | 0.435 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -58.8 | -43.9 | 176.6 | -76.7 | 176.9 | -173.3 | 0 | 0 | 111.6 | Q240 L247 L248 | Q240-E244 HydrophobicContact CG-CG 4.42Å; Q240-E244 WeakPolarHBondContact CG-OE1 3.29Å; Q240-E244 PolarHBondContact NE2-OE1 3.44Å; Q240-E244 WeakPolarHBondContact O-CB 3.46Å; Q240-E244 WeakPolarHBondContact O-CG 3.18Å; Q240-E244 PolarHBondContact O-N 3.03Å; E244-L247 PolarHBondContact O-N 3.37Å; E244-L248 WeakPolarHBondContact O-CB 3.37Å; E244-L248 VanDerWaalsContact O-CG 3.3Å; E244-L248 WeakPolarHBondContact O-CG 3.44Å; E244-L248 PolarHBondContact O-N 3.03Å |
| 245 | K | 97.8 | Very high | 97.8 | Very high | 129 Ų | 129 | 102.7 Ų | 102.7 | 56% | 0.561 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.8 | -42.7 | 175 | -74.9 | 170 | -175.9 | 163.4 | 0 | 112.6 | E241 R242 I243 L248 Q249 | E241-K245 WeakPolarHBondContact O-CB 3.49Å; E241-K245 VanDerWaalsContact O-CG 3.3Å; E241-K245 WeakPolarHBondContact O-CG 3.38Å; E241-K245 PolarHBondContact O-N 2.86Å; R242-K245 PolarHBondContact O-N 3.22Å; I243-K245 VanDerWaalsContact C-N 3.33Å; I243-K245 PolarHBondContact O-N 2.86Å; K245-L248 PolarHBondContact O-N 2.92Å; K245-Q249 WeakPolarHBondContact O-CG 3.41Å; K245-Q249 PolarHBondContact O-N 3.5Å |
| 246 | E | 97.8 | Very high | 97.7 | Very high | 89 Ų | 89 | 100 Ų | 100 | 42% | 0.416 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.6 | -43.2 | 177.8 | -76.8 | 176.7 | -174.7 | 0 | 0 | 111.8 | R242 I243 Q249 K250 | R242-E246 IonicContact CZ-OE1 2.73Å; R242-E246 IonicContact CZ-OE2 3Å; R242-E246 IonicContact NH1-OE1 2.92Å; R242-E246 PolarHBondContact NH1-OE1 3.37Å; R242-E246 IonicContact NH1-OE2 2.71Å; R242-E246 PolarHBondContact NH1-OE2 3.12Å; R242-E246 WeakPolarHBondContact O-CG 3.35Å; R242-E246 PolarHBondContact O-N 3.27Å; I243-E246 PolarHBondContact O-N 3.41Å; E246-Q249 PolarHBondContact O-N 3.01Å; E246-K250 VanDerWaalsContact O-CG 3.28Å; E246-K250 WeakPolarHBondContact O-CG 3.41Å; E246-K250 PolarHBondContact O-N 3.28Å |
| 247 | L | 97.6 | Very high | 97.6 | Very high | 102 Ų | 102 | 99.8 Ų | 99.8 | 53% | 0.534 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.4 | -44.3 | 175.5 | -72.1 | 176.2 | 0 | 0 | 0 | 111.4 | I243 E244 Q249 K250 I251 | I243-L247 HydrophobicContact CG2-CD1 3.86Å; I243-L247 HydrophobicContact CG2-CG 4.19Å; I243-L247 WeakPolarHBondContact O-CB 3.38Å; I243-L247 VanDerWaalsContact O-CG 3.32Å; I243-L247 WeakPolarHBondContact O-CG 3.39Å; I243-L247 PolarHBondContact O-N 2.96Å; E244-L247 PolarHBondContact O-N 3.37Å; L247-Q249 PolarHBondContact O-N 2.91Å; L247-K250 PolarHBondContact O-N 3.01Å; L247-I251 WeakPolarHBondContact O-CB 3.28Å; L247-I251 VanDerWaalsContact O-CG1 3.24Å; L247-I251 WeakPolarHBondContact O-CG1 3.35Å; L247-I251 PolarHBondContact O-N 3.21Å |
| 248 | L | 97.9 | Very high | 97.5 | Very high | 104 Ų | 104 | 100.1 Ų | 100.1 | 55% | 0.545 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.9 | -47 | 174.9 | -77.9 | 168 | 0 | 0 | 0 | 111.6 | E244 K245 K250 I251 D252 | E244-L248 WeakPolarHBondContact O-CB 3.37Å; E244-L248 VanDerWaalsContact O-CG 3.3Å; E244-L248 WeakPolarHBondContact O-CG 3.44Å; E244-L248 PolarHBondContact O-N 3.03Å; K245-L248 PolarHBondContact O-N 2.92Å; L248-K250 VanDerWaalsContact C-N 3.31Å; L248-K250 PolarHBondContact O-N 3.41Å; L248-I251 PolarHBondContact O-N 3.4Å; L248-D252 PolarHBondContact O-N 2.83Å |
| 249 | Q | 97 | Very high | 97.4 | Very high | 118 Ų | 118 | 101.8 Ų | 101.8 | 55% | 0.551 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -60.6 | -39.2 | 175.6 | -74.7 | 179.4 | 14.5 | 0 | 0 | 112.5 | K245 E246 L247 D252 Q253 | K245-Q249 WeakPolarHBondContact O-CG 3.41Å; K245-Q249 PolarHBondContact O-N 3.5Å; E246-Q249 PolarHBondContact O-N 3.01Å; L247-Q249 PolarHBondContact O-N 2.91Å; Q249-D252 PolarHBondContact O-N 3.44Å; Q249-Q253 WeakPolarHBondContact O-CB 3.25Å; Q249-Q253 VanDerWaalsContact O-CG 3.25Å; Q249-Q253 WeakPolarHBondContact O-CG 3.36Å; Q249-Q253 PolarHBondContact O-N 2.89Å |
| 250 | K | 97.3 | Very high | 97.2 | Very high | 123 Ų | 123 | 105.3 Ų | 105.3 | 54% | 0.535 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.3 | -39.8 | 176.3 | -71.6 | -69.5 | 170 | -161.5 | 0 | 112 | E246 L247 L248 Q253 L254 | E246-K250 VanDerWaalsContact O-CG 3.28Å; E246-K250 WeakPolarHBondContact O-CG 3.41Å; E246-K250 PolarHBondContact O-N 3.28Å; L247-K250 PolarHBondContact O-N 3.01Å; L248-K250 VanDerWaalsContact C-N 3.31Å; L248-K250 PolarHBondContact O-N 3.41Å; K250-Q253 PolarHBondContact O-N 3.22Å; K250-L254 WeakPolarHBondContact O-CB 3.44Å; K250-L254 VanDerWaalsContact O-CG 3.29Å; K250-L254 WeakPolarHBondContact O-CG 3.47Å; K250-L254 PolarHBondContact O-N 3.43Å |
| 251 | I | 97.8 | Very high | 97 | Very high | 103 Ų | 103 | 105.6 Ų | 105.6 | 53% | 0.528 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.8 | -45.5 | 173.8 | -70.9 | 164.8 | 0 | 0 | 0 | 110.2 | L247 L248 L254 S255 | L247-I251 WeakPolarHBondContact O-CB 3.28Å; L247-I251 VanDerWaalsContact O-CG1 3.24Å; L247-I251 WeakPolarHBondContact O-CG1 3.35Å; L247-I251 PolarHBondContact O-N 3.21Å; L248-I251 PolarHBondContact O-N 3.4Å; I251-L254 PolarHBondContact O-N 2.95Å; I251-S255 VanDerWaalsContact O-CB 3.3Å; I251-S255 WeakPolarHBondContact O-CB 3.32Å; I251-S255 PolarHBondContact O-N 3.19Å |
| 252 | D | 96.9 | Very high | 96.8 | Very high | 99 Ų | 99 | 103.6 Ų | 103.6 | 53% | 0.529 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.7 | -42.8 | 177.6 | -73.6 | -23.6 | 0 | 0 | 0 | 112.2 | L248 Q249 S255 L256 | L248-D252 PolarHBondContact O-N 2.83Å; Q249-D252 PolarHBondContact O-N 3.44Å; D252-S255 WeakPolarHBondContact O-CB 3.37Å; D252-S255 PolarHBondContact O-N 2.94Å; D252-L256 WeakPolarHBondContact O-CB 3.41Å; D252-L256 PolarHBondContact O-N 3.42Å |
| 253 | Q | 96.9 | Very high | 96.6 | Very high | 88 Ų | 88 | 99.5 Ų | 99.5 | 41% | 0.411 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.1 | -46.9 | 174.4 | -76.3 | 170.9 | 11 | 0 | 0 | 111.7 | Q249 K250 S255 L256 I257 | Q249-Q253 WeakPolarHBondContact O-CB 3.25Å; Q249-Q253 VanDerWaalsContact O-CG 3.25Å; Q249-Q253 WeakPolarHBondContact O-CG 3.36Å; Q249-Q253 PolarHBondContact O-N 2.89Å; K250-Q253 PolarHBondContact O-N 3.22Å; Q253-S255 VanDerWaalsContact C-N 3.34Å; Q253-L256 PolarHBondContact O-N 3.03Å; Q253-I257 WeakPolarHBondContact O-CD1 3.49Å; Q253-I257 VanDerWaalsContact O-CG1 3.31Å; Q253-I257 WeakPolarHBondContact O-CG1 3.24Å; Q253-I257 PolarHBondContact O-N 2.86Å |
| 254 | L | 97 | Very high | 96.4 | Very high | 110 Ų | 110 | 98.1 Ų | 98.1 | 58% | 0.576 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.4 | -41.2 | 176.5 | -74.4 | 171.3 | 0 | 0 | 0 | 111.4 | K250 I251 I257 V258 | K250-L254 WeakPolarHBondContact O-CB 3.44Å; K250-L254 VanDerWaalsContact O-CG 3.29Å; K250-L254 WeakPolarHBondContact O-CG 3.47Å; K250-L254 PolarHBondContact O-N 3.43Å; I251-L254 PolarHBondContact O-N 2.95Å; L254-I257 PolarHBondContact O-N 3.41Å; L254-V258 WeakPolarHBondContact O-CB 3.38Å; L254-V258 VanDerWaalsContact O-CG2 3.25Å; L254-V258 WeakPolarHBondContact O-CG2 3.41Å; L254-V258 PolarHBondContact O-N 2.95Å |
| 255 | S | 96.8 | Very high | 96.1 | Very high | 76 Ų | 76 | 96.6 Ų | 96.6 | 53% | 0.531 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.5 | -44.2 | 176.3 | -174.1 | 0 | 0 | 0 | 0 | 111.8 | I251 D252 Q253 V258 K259 | I251-S255 VanDerWaalsContact O-CB 3.3Å; I251-S255 WeakPolarHBondContact O-CB 3.32Å; I251-S255 PolarHBondContact O-N 3.19Å; D252-S255 WeakPolarHBondContact O-CB 3.37Å; D252-S255 PolarHBondContact O-N 2.94Å; Q253-S255 VanDerWaalsContact C-N 3.34Å; S255-V258 PolarHBondContact O-N 3.1Å; S255-K259 WeakPolarHBondContact O-CB 3.36Å; S255-K259 PolarHBondContact O-N 3.5Å |
| 256 | L | 96.4 | Very high | 95.9 | Very high | 103 Ų | 103 | 96.7 Ų | 96.7 | 54% | 0.539 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.1 | -50.1 | 173.5 | -91.3 | 154 | 0 | 0 | 0 | 112.1 | D252 Q253 V258 K259 E260 | D252-L256 WeakPolarHBondContact O-CB 3.41Å; D252-L256 PolarHBondContact O-N 3.42Å; Q253-L256 PolarHBondContact O-N 3.03Å; L256-V258 VanDerWaalsContact C-N 3.33Å; L256-V258 PolarHBondContact O-N 3.44Å; L256-K259 WeakPolarHBondContact O-CB 3.41Å; L256-K259 PolarHBondContact O-N 3.06Å; L256-K259 VanDerWaalsContact O-N 3.15Å; L256-E260 WeakPolarHBondContact O-CG 3.48Å; L256-E260 PolarHBondContact O-N 2.88Å |
| 257 | I | 96.6 | Very high | 95.7 | Very high | 100 Ų | 100 | 99.8 Ų | 99.8 | 51% | 0.513 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.6 | -44.5 | 178.5 | -69.4 | 161.5 | 0 | 0 | 0 | 110.8 | Q253 L254 K259 E260 N261 | Q253-I257 WeakPolarHBondContact O-CD1 3.49Å; Q253-I257 VanDerWaalsContact O-CG1 3.31Å; Q253-I257 WeakPolarHBondContact O-CG1 3.24Å; Q253-I257 PolarHBondContact O-N 2.86Å; L254-I257 PolarHBondContact O-N 3.41Å; I257-K259 VanDerWaalsContact C-N 3.33Å; I257-K259 PolarHBondContact O-N 3.33Å; I257-E260 PolarHBondContact O-N 2.99Å; I257-N261 WeakPolarHBondContact O-CB 3.35Å; I257-N261 PolarHBondContact O-N 3.45Å |
| 258 | V | 96.5 | Very high | 95.5 | Very high | 98 Ų | 98 | 98.5 Ų | 98.5 | 59% | 0.594 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.2 | -42 | 177 | 168.8 | 0 | 0 | 0 | 0 | 110.8 | L254 S255 L256 S262 | L254-V258 WeakPolarHBondContact O-CB 3.38Å; L254-V258 VanDerWaalsContact O-CG2 3.25Å; L254-V258 WeakPolarHBondContact O-CG2 3.41Å; L254-V258 PolarHBondContact O-N 2.95Å; S255-V258 PolarHBondContact O-N 3.1Å; L256-V258 VanDerWaalsContact C-N 3.33Å; L256-V258 PolarHBondContact O-N 3.44Å; V258-S262 VanDerWaalsContact O-CB 3.24Å; V258-S262 WeakPolarHBondContact O-CB 3.47Å; V258-S262 PolarHBondContact O-N 2.95Å; V258-S262 PolarHBondContact O-OG 2.94Å |
| 259 | K | 95.4 | Very high | 95.2 | Very high | 157 Ų | 157 | 98.5 Ų | 98.5 | 68% | 0.683 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -66 | -41.8 | 177.5 | -171.1 | 176.9 | -179.2 | 179.8 | 0 | 112.5 | S255 L256 I257 S262 G263 | S255-K259 WeakPolarHBondContact O-CB 3.36Å; S255-K259 PolarHBondContact O-N 3.5Å; L256-K259 WeakPolarHBondContact O-CB 3.41Å; L256-K259 PolarHBondContact O-N 3.06Å; L256-K259 VanDerWaalsContact O-N 3.15Å; I257-K259 VanDerWaalsContact C-N 3.33Å; I257-K259 PolarHBondContact O-N 3.33Å; K259-S262 VanDerWaalsContact CA-OG 3.3Å; K259-S262 WeakPolarHBondContact CA-OG 3.34Å; K259-S262 PolarHBondContact O-OG 2.84Å; K259-G263 PolarHBondContact O-N 2.9Å |
| 260 | E | 94.2 | Very high | 95 | Very high | 129 Ų | 129 | 98.8 Ų | 98.8 | 60% | 0.603 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66.8 | -44.4 | 176.4 | -73.6 | 178.8 | 167.3 | 0 | 0 | 111.7 | L256 I257 G263 A264 | L256-E260 WeakPolarHBondContact O-CG 3.48Å; L256-E260 PolarHBondContact O-N 2.88Å; I257-E260 PolarHBondContact O-N 2.99Å; E260-G263 PolarHBondContact O-N 3.36Å; E260-A264 VanDerWaalsContact O-CB 3.29Å; E260-A264 WeakPolarHBondContact O-CB 3.43Å; E260-A264 PolarHBondContact O-N 3.47Å |
| 261 | N | 94.9 | Very high | 94.8 | Very high | 116 Ų | 116 | 100 Ų | 100 | 62% | 0.62 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -69.1 | -39.9 | -179.3 | -159.1 | 40.2 | 0 | 0 | 0 | 111.5 | I257 A264 S265 | I257-N261 WeakPolarHBondContact O-CB 3.35Å; I257-N261 PolarHBondContact O-N 3.45Å; N261-A264 PolarHBondContact O-N 3.3Å; N261-S265 VanDerWaalsContact O-CB 3.27Å; N261-S265 WeakPolarHBondContact O-CB 3.49Å; N261-S265 PolarHBondContact O-N 3.33Å |
| 262 | S | 94.4 | Very high | 94.6 | Very high | 63 Ų | 63 | 100.4 Ų | 100.4 | 44% | 0.441 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.9 | -46.6 | 171.9 | 53.5 | 0 | 0 | 0 | 0 | 111.6 | V258 K259 A264 S265 E266 | V258-S262 VanDerWaalsContact O-CB 3.24Å; V258-S262 WeakPolarHBondContact O-CB 3.47Å; V258-S262 PolarHBondContact O-N 2.95Å; V258-S262 PolarHBondContact O-OG 2.94Å; K259-S262 VanDerWaalsContact CA-OG 3.3Å; K259-S262 WeakPolarHBondContact CA-OG 3.34Å; K259-S262 PolarHBondContact O-OG 2.84Å; S262-A264 VanDerWaalsContact C-N 3.33Å; S262-A264 PolarHBondContact O-N 3.44Å; S262-S265 PolarHBondContact O-N 2.89Å; S262-E266 VanDerWaalsContact O-CB 3.3Å; S262-E266 WeakPolarHBondContact O-CB 3.45Å; S262-E266 PolarHBondContact O-N 2.9Å |
| 263 | G | 93.1 | Very high | 94.3 | Very high | 19 Ų | 19 | 101 Ų | 101 | 20% | 0.196 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -67 | -28.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | K259 E260 R267 | K259-G263 PolarHBondContact O-N 2.9Å; E260-G263 PolarHBondContact O-N 3.36Å; G263-R267 WeakPolarHBondContact O-CB 3.32Å; G263-R267 WeakPolarHBondContact O-CG 3.38Å; G263-R267 PolarHBondContact O-N 2.94Å; G263-R267 PolarHBondContact O-NE 3.32Å |
| 264 | A | 93.2 | Very high | 94 | Very high | 42 Ų | 42 | 100.2 Ų | 100.2 | 35% | 0.347 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -72.3 | -44.2 | 170.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | E260 N261 S262 E266 R267 D268 | E260-A264 VanDerWaalsContact O-CB 3.29Å; E260-A264 WeakPolarHBondContact O-CB 3.43Å; E260-A264 PolarHBondContact O-N 3.47Å; N261-A264 PolarHBondContact O-N 3.3Å; S262-A264 VanDerWaalsContact C-N 3.33Å; S262-A264 PolarHBondContact O-N 3.44Å; A264-E266 VanDerWaalsContact C-N 3.33Å; A264-R267 PolarHBondContact O-N 2.91Å; A264-D268 PolarHBondContact O-N 3.39Å |
| 265 | S | 92.9 | Very high | 93.8 | Very high | 61 Ų | 61 | 100.3 Ų | 100.3 | 43% | 0.427 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63 | -39.5 | 175 | -175.1 | 0 | 0 | 0 | 0 | 111.8 | N261 S262 D268 M269 | N261-S265 VanDerWaalsContact O-CB 3.27Å; N261-S265 WeakPolarHBondContact O-CB 3.49Å; N261-S265 PolarHBondContact O-N 3.33Å; S262-S265 PolarHBondContact O-N 2.89Å; S265-D268 PolarHBondContact O-N 3.39Å; S265-M269 WeakPolarHBondContact O-CB 3.46Å; S265-M269 VanDerWaalsContact O-CG 3.3Å; S265-M269 WeakPolarHBondContact O-CG 3.47Å; S265-M269 PolarHBondContact O-N 3.46Å |
| 266 | E | 93.8 | Very high | 93.6 | Very high | 130 Ų | 130 | 102.1 Ų | 102.1 | 61% | 0.607 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.1 | -47.4 | 176 | -170.4 | 174.7 | -163.9 | 0 | 0 | 110.9 | S262 A264 D268 M269 E270 | S262-E266 VanDerWaalsContact O-CB 3.3Å; S262-E266 WeakPolarHBondContact O-CB 3.45Å; S262-E266 PolarHBondContact O-N 2.9Å; A264-E266 VanDerWaalsContact C-N 3.33Å; E266-D268 PolarHBondContact O-N 3.41Å; E266-M269 PolarHBondContact O-N 3.02Å; E266-E270 WeakPolarHBondContact O-CB 3.47Å; E266-E270 PolarHBondContact O-N 3.44Å |
| 267 | R | 92.6 | Very high | 93.2 | Very high | 154 Ų | 154 | 100.1 Ų | 100.1 | 58% | 0.581 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.1 | -36.7 | 174.3 | -75.8 | 178.6 | -71.8 | 156.4 | -4.5 | 113.4 | G263 A264 K271 | G263-R267 WeakPolarHBondContact O-CB 3.32Å; G263-R267 WeakPolarHBondContact O-CG 3.38Å; G263-R267 PolarHBondContact O-N 2.94Å; G263-R267 PolarHBondContact O-NE 3.32Å; A264-R267 PolarHBondContact O-N 2.91Å; R267-K271 WeakPolarHBondContact O-CB 3.38Å; R267-K271 VanDerWaalsContact O-CG 3.31Å; R267-K271 WeakPolarHBondContact O-CG 3.32Å; R267-K271 PolarHBondContact O-N 3.1Å |
| 268 | D | 94.3 | Very high | 92.8 | Very high | 75 Ų | 75 | 97.7 Ų | 97.7 | 40% | 0.401 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -67.7 | -42.9 | 174.7 | -169.8 | 58.4 | 0 | 0 | 0 | 111.2 | A264 S265 E266 K271 K272 | A264-D268 PolarHBondContact O-N 3.39Å; S265-D268 PolarHBondContact O-N 3.39Å; E266-D268 PolarHBondContact O-N 3.41Å; D268-K271 PolarHBondContact O-N 3.4Å; D268-K272 WeakPolarHBondContact O-CB 3.22Å; D268-K272 WeakPolarHBondContact O-CG 3.33Å; D268-K272 PolarHBondContact O-N 2.94Å; D268-K272 WeakPolarHBondContact OD2-CE 3.45Å; D268-K272 IonicContact OD2-NZ 2.75Å; D268-K272 PolarHBondContact OD2-NZ 3.35Å |
| 269 | M | 92.2 | Very high | 92.5 | Very high | 105 Ų | 105 | 100.7 Ų | 100.7 | 52% | 0.517 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.9 | -43.8 | 173.3 | -76.7 | -171.2 | -66.6 | 0 | 0 | 111.5 | S265 E266 K272 L273 | S265-M269 WeakPolarHBondContact O-CB 3.46Å; S265-M269 VanDerWaalsContact O-CG 3.3Å; S265-M269 WeakPolarHBondContact O-CG 3.47Å; S265-M269 PolarHBondContact O-N 3.46Å; E266-M269 PolarHBondContact O-N 3.02Å; M269-K272 PolarHBondContact O-N 2.77Å; M269-L273 WeakPolarHBondContact O-CB 3.35Å; M269-L273 PolarHBondContact O-N 3.32Å |
| 270 | E | 92.8 | Very high | 92 | Very high | 123 Ų | 123 | 97.9 Ų | 97.9 | 58% | 0.575 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.2 | -38.8 | 178.6 | -167.2 | 172.2 | -150.7 | 0 | 0 | 112 | E266 S274 | E266-E270 WeakPolarHBondContact O-CB 3.47Å; E266-E270 PolarHBondContact O-N 3.44Å; E270-S274 VanDerWaalsContact O-CB 3.3Å; E270-S274 WeakPolarHBondContact O-CB 3.25Å; E270-S274 PolarHBondContact O-N 2.86Å; E270-S274 PolarHBondContact O-OG 2.73Å |
| 271 | K | 92.1 | Very high | 91.6 | Very high | 150 Ų | 150 | 96.3 Ų | 96.3 | 65% | 0.652 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.6 | -44.4 | 171.2 | -77.4 | 176.7 | -177.4 | 179.3 | 0 | 112.3 | R267 D268 S274 Q275 | R267-K271 WeakPolarHBondContact O-CB 3.38Å; R267-K271 VanDerWaalsContact O-CG 3.31Å; R267-K271 WeakPolarHBondContact O-CG 3.32Å; R267-K271 PolarHBondContact O-N 3.1Å; D268-K271 PolarHBondContact O-N 3.4Å; K271-S274 PolarHBondContact O-N 2.99Å; K271-Q275 VanDerWaalsContact O-CB 3.28Å; K271-Q275 WeakPolarHBondContact O-CB 3.41Å; K271-Q275 PolarHBondContact O-N 3.45Å |
| 272 | K | 93.4 | Very high | 91 | Very high | 111 Ų | 111 | 98.4 Ų | 98.4 | 48% | 0.483 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65 | -41.5 | 177.2 | -77 | 178.1 | 179.2 | 153 | 0 | 111.6 | D268 M269 Q275 M276 | D268-K272 WeakPolarHBondContact O-CB 3.22Å; D268-K272 WeakPolarHBondContact O-CG 3.33Å; D268-K272 PolarHBondContact O-N 2.94Å; D268-K272 WeakPolarHBondContact OD2-CE 3.45Å; D268-K272 IonicContact OD2-NZ 2.75Å; D268-K272 PolarHBondContact OD2-NZ 3.35Å; M269-K272 PolarHBondContact O-N 2.77Å; K272-Q275 PolarHBondContact O-N 3.27Å; K272-M276 WeakPolarHBondContact O-CB 3.21Å; K272-M276 VanDerWaalsContact O-CG 3.3Å; K272-M276 WeakPolarHBondContact O-CG 3.43Å; K272-M276 PolarHBondContact O-N 3.44Å |
| 273 | L | 91.8 | Very high | 90.4 | Very high | 110 Ų | 110 | 100.2 Ų | 100.2 | 58% | 0.576 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.4 | -48 | 172 | -94.3 | 157.8 | 0 | 0 | 0 | 111 | M269 Q275 M276 S277 | M269-L273 WeakPolarHBondContact O-CB 3.35Å; M269-L273 PolarHBondContact O-N 3.32Å; L273-Q275 VanDerWaalsContact C-N 3.33Å; L273-Q275 PolarHBondContact O-N 2.92Å; L273-M276 CarbonylContact O-C 3.58Å; L273-M276 WeakPolarHBondContact O-CB 3.31Å; L273-M276 PolarHBondContact O-N 3.5Å; L273-S277 PolarHBondContact O-N 3.43Å |
| 274 | S | 90.2 | Very high | 89.7 | Confident | 72 Ų | 72 | 105.3 Ų | 105.3 | 50% | 0.503 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.6 | -40.9 | 176.8 | -60.5 | 0 | 0 | 0 | 0 | 112.1 | E270 K271 S277 A278 | E270-S274 VanDerWaalsContact O-CB 3.3Å; E270-S274 WeakPolarHBondContact O-CB 3.25Å; E270-S274 PolarHBondContact O-N 2.86Å; E270-S274 PolarHBondContact O-OG 2.73Å; K271-S274 PolarHBondContact O-N 2.99Å; S274-S277 PolarHBondContact O-N 2.71Å; S274-A278 WeakPolarHBondContact O-CB 3.17Å; S274-A278 PolarHBondContact O-N 3.49Å |
| 275 | Q | 93.4 | Very high | 88.9 | Confident | 112 Ų | 112 | 108.7 Ų | 108.7 | 52% | 0.523 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.9 | -38.7 | 175.6 | -172.7 | -179.1 | 30 | 0 | 0 | 111.7 | K271 K272 L273 R279 | K271-Q275 VanDerWaalsContact O-CB 3.28Å; K271-Q275 WeakPolarHBondContact O-CB 3.41Å; K271-Q275 PolarHBondContact O-N 3.45Å; K272-Q275 PolarHBondContact O-N 3.27Å; L273-Q275 VanDerWaalsContact C-N 3.33Å; L273-Q275 PolarHBondContact O-N 2.92Å; Q275-R279 WeakPolarHBondContact O-CB 3.42Å; Q275-R279 WeakPolarHBondContact O-CG 3.45Å; Q275-R279 PolarHBondContact O-N 3.3Å |
| 276 | M | 91.1 | Very high | 88 | Confident | 115 Ų | 115 | 107.4 Ų | 107.4 | 57% | 0.567 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -66 | -44.2 | 173.6 | -80.2 | 179.1 | 57.7 | 0 | 0 | 111.3 | K272 L273 R279 L280 | K272-M276 WeakPolarHBondContact O-CB 3.21Å; K272-M276 VanDerWaalsContact O-CG 3.3Å; K272-M276 WeakPolarHBondContact O-CG 3.43Å; K272-M276 PolarHBondContact O-N 3.44Å; L273-M276 CarbonylContact O-C 3.58Å; L273-M276 WeakPolarHBondContact O-CB 3.31Å; L273-M276 PolarHBondContact O-N 3.5Å; M276-R279 WeakPolarHBondContact O-CB 3.45Å; M276-R279 PolarHBondContact O-N 3.38Å; M276-L280 WeakPolarHBondContact O-CB 3.32Å; M276-L280 WeakPolarHBondContact O-CG 3.45Å; M276-L280 PolarHBondContact O-N 2.93Å |
| 277 | S | 89.2 | Confident | 86.9 | Confident | 61 Ų | 61 | 107.4 Ų | 107.4 | 43% | 0.427 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59 | -48.8 | 172.5 | -79.2 | 0 | 0 | 0 | 0 | 111.2 | L273 S274 R279 L280 D281 | L273-S277 PolarHBondContact O-N 3.43Å; S274-S277 PolarHBondContact O-N 2.71Å; S277-R279 VanDerWaalsContact C-N 3.25Å; S277-R279 PolarHBondContact O-N 2.84Å; S277-L280 CarbonylContact O-C 3.57Å; S277-L280 WeakPolarHBondContact O-CA 3.4Å; S277-L280 WeakPolarHBondContact O-CB 3.47Å; S277-L280 PolarHBondContact O-N 3.43Å; S277-D281 VanDerWaalsContact O-CG 3.28Å; S277-D281 PolarHBondContact O-N 2.87Å |
| 278 | A | 87.8 | Confident | 85.7 | Confident | 49 Ų | 49 | 107.1 Ų | 107.1 | 41% | 0.405 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.6 | -30.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | S274 K282 | S274-A278 WeakPolarHBondContact O-CB 3.17Å; S274-A278 PolarHBondContact O-N 3.49Å; A278-K282 WeakPolarHBondContact O-CB 3.47Å; A278-K282 WeakPolarHBondContact O-CG 3.27Å; A278-K282 PolarHBondContact O-N 3.47Å; A278-K282 VanDerWaalsContact O-N 3.08Å |
| 279 | R | 89.5 | Confident | 84.2 | Confident | 161 Ų | 161 | 110.3 Ų | 110.3 | 61% | 0.608 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -70.1 | -42.1 | 171.1 | -86 | -178.6 | 158.6 | 165.9 | -3.9 | 111.5 | Q275 M276 S277 K282 I283 | Q275-R279 WeakPolarHBondContact O-CB 3.42Å; Q275-R279 WeakPolarHBondContact O-CG 3.45Å; Q275-R279 PolarHBondContact O-N 3.3Å; M276-R279 WeakPolarHBondContact O-CB 3.45Å; M276-R279 PolarHBondContact O-N 3.38Å; S277-R279 VanDerWaalsContact C-N 3.25Å; S277-R279 PolarHBondContact O-N 2.84Å; R279-K282 PolarHBondContact O-N 2.92Å; R279-I283 WeakPolarHBondContact O-CB 3.3Å; R279-I283 WeakPolarHBondContact O-CD1 3.41Å; R279-I283 WeakPolarHBondContact O-CG1 3.35Å; R279-I283 PolarHBondContact O-N 2.87Å |
| 280 | L | 85.6 | Confident | 82.7 | Confident | 98 Ų | 98 | 109 Ų | 109 | 51% | 0.513 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.2 | -47.8 | 174.3 | -82.1 | 163.9 | 0 | 0 | 0 | 110.5 | M276 S277 K282 I283 E284 | M276-L280 WeakPolarHBondContact O-CB 3.32Å; M276-L280 WeakPolarHBondContact O-CG 3.45Å; M276-L280 PolarHBondContact O-N 2.93Å; S277-L280 CarbonylContact O-C 3.57Å; S277-L280 WeakPolarHBondContact O-CA 3.4Å; S277-L280 WeakPolarHBondContact O-CB 3.47Å; S277-L280 PolarHBondContact O-N 3.43Å; L280-K282 VanDerWaalsContact C-N 3.33Å; L280-K282 PolarHBondContact O-N 3.34Å; L280-I283 CarbonylContact O-C 3.54Å; L280-I283 PolarHBondContact O-N 3.45Å; L280-E284 PolarHBondContact O-N 3.32Å |
| 281 | D | 84.5 | Confident | 81.1 | Confident | 95 Ų | 95 | 110.1 Ų | 110.1 | 51% | 0.508 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -58.1 | -43.8 | 176.1 | -65.5 | -24.9 | 0 | 0 | 0 | 111.5 | S277 I283 E284 E285 | S277-D281 VanDerWaalsContact O-CG 3.28Å; S277-D281 PolarHBondContact O-N 2.87Å; D281-I283 PolarHBondContact O-N 3.31Å; D281-E284 PolarHBondContact O-N 2.99Å; D281-E285 WeakPolarHBondContact O-CB 3.28Å; D281-E285 PolarHBondContact O-N 2.86Å |
| 282 | K | 83.5 | Confident | 79.5 | Confident | 160 Ų | 160 | 107.2 Ų | 107.2 | 70% | 0.696 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65.3 | -36.8 | 175.2 | -83.1 | -176.8 | 179.5 | -179.1 | 0 | 113.2 | A278 R279 L280 G286 | A278-K282 WeakPolarHBondContact O-CB 3.47Å; A278-K282 WeakPolarHBondContact O-CG 3.27Å; A278-K282 PolarHBondContact O-N 3.47Å; A278-K282 VanDerWaalsContact O-N 3.08Å; R279-K282 PolarHBondContact O-N 2.92Å; L280-K282 VanDerWaalsContact C-N 3.33Å; L280-K282 PolarHBondContact O-N 3.34Å; K282-G286 WeakPolarHBondContact O-CA 3.48Å; K282-G286 PolarHBondContact O-N 3.43Å |
| 283 | I | 82.2 | Confident | 77.8 | Confident | 101 Ų | 101 | 103.7 Ų | 103.7 | 52% | 0.518 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -68.6 | -44.5 | 176.1 | -70.9 | 165.1 | 0 | 0 | 0 | 109.3 | R279 L280 D281 G286 Q287 | R279-I283 WeakPolarHBondContact O-CB 3.3Å; R279-I283 WeakPolarHBondContact O-CD1 3.41Å; R279-I283 WeakPolarHBondContact O-CG1 3.35Å; R279-I283 PolarHBondContact O-N 2.87Å; L280-I283 CarbonylContact O-C 3.54Å; L280-I283 PolarHBondContact O-N 3.45Å; D281-I283 PolarHBondContact O-N 3.31Å; I283-G286 PolarHBondContact O-N 3.36Å; I283-Q287 WeakPolarHBondContact O-CB 3.38Å; I283-Q287 WeakPolarHBondContact O-CG 3.32Å; I283-Q287 PolarHBondContact O-N 2.93Å |
| 284 | E | 77.8 | Confident | 76 | Confident | 127 Ų | 127 | 105 Ų | 105 | 59% | 0.593 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -62.3 | -45.4 | 175.7 | -77.9 | -170.2 | 160.1 | 0 | 0 | 111.8 | L280 D281 Q287 K288 | L280-E284 PolarHBondContact O-N 3.32Å; D281-E284 PolarHBondContact O-N 2.99Å; E284-Q287 PolarHBondContact O-N 3.26Å; E284-K288 WeakPolarHBondContact O-CB 3.44Å; E284-K288 PolarHBondContact O-N 3.47Å |
| 285 | E | 76.7 | Confident | 74.5 | Confident | 113 Ų | 113 | 109 Ų | 109 | 53% | 0.528 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -70.4 | -35.7 | 179 | -160.9 | 176.2 | -155.1 | 0 | 0 | 111.8 | D281 K288 K289 | D281-E285 WeakPolarHBondContact O-CB 3.28Å; D281-E285 PolarHBondContact O-N 2.86Å; E285-K288 PolarHBondContact O-N 2.96Å; E285-K289 WeakPolarHBondContact O-CB 3.48Å; E285-K289 WeakPolarHBondContact O-CG 3.19Å; E285-K289 PolarHBondContact O-N 3.11Å |
| 286 | G | 73.1 | Confident | 72.9 | Confident | 34 Ų | 34 | 107.2 Ų | 107.2 | 35% | 0.351 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.6 | -44.4 | 171 | 0 | 0 | 0 | 0 | 0 | 112.2 | K282 I283 K289 T290 | K282-G286 WeakPolarHBondContact O-CA 3.48Å; K282-G286 PolarHBondContact O-N 3.43Å; I283-G286 PolarHBondContact O-N 3.36Å; G286-K289 PolarHBondContact O-N 3.34Å; G286-T290 PolarHBondContact O-N 3.3Å; G286-T290 PolarHBondContact O-OG1 2.89Å |
| 287 | Q | 71.6 | Confident | 71.4 | Confident | 129 Ų | 129 | 110.2 Ų | 110.2 | 60% | 0.603 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.1 | -40.4 | 173.7 | -79.7 | -168.3 | -35.8 | 0 | 0 | 111.4 | I283 E284 T290 F291 | I283-Q287 WeakPolarHBondContact O-CB 3.38Å; I283-Q287 WeakPolarHBondContact O-CG 3.32Å; I283-Q287 PolarHBondContact O-N 2.93Å; E284-Q287 PolarHBondContact O-N 3.26Å; Q287-T290 WeakPolarHBondContact CA-OG1 3.36Å; Q287-T290 PolarHBondContact O-N 2.97Å; Q287-T290 PolarHBondContact O-OG1 2.85Å; Q287-F291 WeakPolarHBondContact O-CB 3.36Å; Q287-F291 PolarHBondContact O-N 2.83Å |
| 288 | K | 66.9 | Low | 69.9 | Low | 148 Ų | 148 | 114.3 Ų | 114.3 | 64% | 0.643 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -64.5 | -45.9 | 176.6 | -156.6 | 174.4 | -175.2 | 178.5 | 0 | 112.1 | E284 E285 F291 D292 | E284-K288 WeakPolarHBondContact O-CB 3.44Å; E284-K288 PolarHBondContact O-N 3.47Å; E285-K288 PolarHBondContact O-N 2.96Å; K288-F291 PolarHBondContact O-N 2.77Å; K288-D292 PolarHBondContact O-N 3.11Å |
| 289 | K | 62.3 | Low | 68.7 | Low | 142 Ų | 142 | 117.7 Ų | 117.7 | 62% | 0.617 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -66 | -36.7 | 176.3 | -75.7 | 177.4 | -178.4 | 168.7 | 0 | 113.4 | E285 G286 G293 | E285-K289 WeakPolarHBondContact O-CB 3.48Å; E285-K289 WeakPolarHBondContact O-CG 3.19Å; E285-K289 PolarHBondContact O-N 3.11Å; G286-K289 PolarHBondContact O-N 3.34Å; K289-G293 PolarHBondContact O-N 2.84Å |
| 290 | T | 61 | Low | 67.4 | Low | 78 Ų | 78 | 116.2 Ų | 116.2 | 48% | 0.479 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -70.3 | -39.5 | 174.2 | 30.3 | 0 | 0 | 0 | 0 | 111.5 | G286 Q287 G293 Q294 | G286-T290 PolarHBondContact O-N 3.3Å; G286-T290 PolarHBondContact O-OG1 2.89Å; Q287-T290 WeakPolarHBondContact CA-OG1 3.36Å; Q287-T290 PolarHBondContact O-N 2.97Å; Q287-T290 PolarHBondContact O-OG1 2.85Å; T290-G293 PolarHBondContact O-N 3.31Å; T290-Q294 WeakPolarHBondContact O-CB 3.36Å; T290-Q294 PolarHBondContact O-N 2.91Å; T290-Q294 PolarHBondContact O-OE1 3.43Å |
| 291 | F | 59.4 | Low | 66.3 | Low | 146 Ų | 146 | 118.1 Ų | 118.1 | 64% | 0.64 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -65.1 | -44.1 | 177.3 | -158 | -94.2 | 0 | 0 | 0 | 112.3 | Q287 K288 R295 | Q287-F291 WeakPolarHBondContact O-CB 3.36Å; Q287-F291 PolarHBondContact O-N 2.83Å; K288-F291 PolarHBondContact O-N 2.77Å; F291-R295 PolarHBondContact O-N 3.42Å |
| 292 | D | 58.7 | Low | 65.7 | Low | 89 Ų | 89 | 121.4 Ų | 121.4 | 48% | 0.476 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -68.6 | -46.7 | 174.8 | -72.3 | -25.6 | 0 | 0 | 0 | 111 | K288 Q294 R295 T296 | K288-D292 PolarHBondContact O-N 3.11Å; D292-Q294 PolarHBondContact O-N 3.45Å; D292-R295 WeakPolarHBondContact O-CB 3.43Å; D292-R295 PolarHBondContact O-N 2.81Å; D292-R295 VanDerWaalsContact O-N 3.08Å; D292-T296 PolarHBondContact O-N 2.91Å; D292-T296 PolarHBondContact O-OG1 3.42Å |
| 293 | G | 56.7 | Low | 64.9 | Low | 38 Ų | 38 | 118.6 Ų | 118.6 | 39% | 0.392 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63.4 | -37.7 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | K289 T290 R295 R297 | K289-G293 PolarHBondContact O-N 2.84Å; T290-G293 PolarHBondContact O-N 3.31Å; G293-R295 VanDerWaalsContact C-N 3.3Å; G293-R295 PolarHBondContact O-N 3.17Å; G293-R297 WeakPolarHBondContact O-CB 3.43Å; G293-R297 PolarHBondContact O-N 3.4Å |
| 294 | Q | 55.8 | Low | 64.2 | Low | 136 Ų | 136 | 120.2 Ų | 120.2 | 64% | 0.636 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -67.7 | -31.9 | 173.6 | -88.7 | 168.2 | -78.8 | 0 | 0 | 112.3 | T290 D292 Q298 | T290-Q294 WeakPolarHBondContact O-CB 3.36Å; T290-Q294 PolarHBondContact O-N 2.91Å; T290-Q294 PolarHBondContact O-OE1 3.43Å; D292-Q294 PolarHBondContact O-N 3.45Å; Q294-Q298 PolarHBondContact O-N 2.93Å |
| 295 | R | 57.2 | Low | 63.8 | Low | 157 Ų | 157 | 116.5 Ų | 116.5 | 59% | 0.592 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -72 | -45.4 | 176.8 | -159.6 | 173.9 | -175.6 | 170.1 | 2.3 | 111.3 | F291 D292 G293 R297 Q298 E299 | F291-R295 PolarHBondContact O-N 3.42Å; D292-R295 WeakPolarHBondContact O-CB 3.43Å; D292-R295 PolarHBondContact O-N 2.81Å; D292-R295 VanDerWaalsContact O-N 3.08Å; G293-R295 VanDerWaalsContact C-N 3.3Å; G293-R295 PolarHBondContact O-N 3.17Å; R295-R297 PolarHBondContact O-N 2.82Å; R295-Q298 PolarHBondContact O-N 3.44Å; R295-E299 PolarHBondContact O-N 2.72Å |
| 296 | T | 59.7 | Low | 63.9 | Low | 74 Ų | 74 | 119.1 Ų | 119.1 | 45% | 0.454 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -63.7 | -39.9 | 177.8 | -32.2 | 0 | 0 | 0 | 0 | 111.8 | D292 Q298 E299 E300 | D292-T296 PolarHBondContact O-N 2.91Å; D292-T296 PolarHBondContact O-OG1 3.42Å; T296-Q298 PolarHBondContact O-N 3.26Å; T296-E299 PolarHBondContact O-N 3.37Å; T296-E300 PolarHBondContact O-N 2.83Å |
| 297 | R | 60.5 | Low | 64 | Low | 178 Ų | 178 | 121.4 Ų | 121.4 | 67% | 0.672 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -66.1 | -37.4 | 179.2 | -162.2 | 175.3 | -167.1 | 166.8 | 5 | 113 | G293 R295 E299 E301 | G293-R297 WeakPolarHBondContact O-CB 3.43Å; G293-R297 PolarHBondContact O-N 3.4Å; R295-R297 PolarHBondContact O-N 2.82Å; R297-E299 VanDerWaalsContact C-N 3.33Å; R297-E301 PolarHBondContact O-N 3.42Å |
| 298 | Q | 57.2 | Low | 64.2 | Low | 148 Ų | 148 | 118.5 Ų | 118.5 | 69% | 0.692 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -67.8 | -32.3 | 173.8 | -80.1 | -175 | 0.1 | 0 | 0 | 112.7 | Q294 R295 T296 | Q294-Q298 PolarHBondContact O-N 2.93Å; R295-Q298 PolarHBondContact O-N 3.44Å; T296-Q298 PolarHBondContact O-N 3.26Å |
| 299 | E | 62.4 | Low | 64.6 | Low | 120 Ų | 120 | 118.4 Ų | 118.4 | 56% | 0.561 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -76.1 | -38.1 | 175.9 | -71.9 | -176.3 | 175.1 | 0 | 0 | 112.3 | R295 T296 R297 K302 M303 | R295-E299 PolarHBondContact O-N 2.72Å; T296-E299 PolarHBondContact O-N 3.37Å; R297-E299 VanDerWaalsContact C-N 3.33Å; E299-K302 PolarHBondContact O-N 3.45Å; E299-M303 WeakPolarHBondContact O-CG 3.23Å; E299-M303 PolarHBondContact O-N 2.91Å |
| 300 | E | 62.2 | Low | 65.3 | Low | 129 Ų | 129 | 116.7 Ų | 116.7 | 60% | 0.603 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -62.6 | -47.3 | 176.1 | -81.5 | -169.9 | 157 | 0 | 0 | 112.8 | T296 K302 M303 H304 | T296-E300 PolarHBondContact O-N 2.83Å; E300-K302 PolarHBondContact O-N 3.24Å; E300-M303 PolarHBondContact O-N 2.82Å; E300-M303 VanDerWaalsContact O-N 3.13Å; E300-H304 WeakPolarHBondContact O-CB 3.34Å; E300-H304 PolarHBondContact O-N 2.81Å |
| 301 | E | 63.8 | Low | 65.9 | Low | 139 Ų | 139 | 118 Ų | 118 | 65% | 0.65 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -61 | -34.6 | 177.6 | -79.7 | 178.7 | 170.4 | 0 | 0 | 112 | R297 G305 | R297-E301 PolarHBondContact O-N 3.42Å; E301-G305 PolarHBondContact O-N 2.88Å; E301-G305 VanDerWaalsContact O-N 3.15Å |
| 302 | K | 70.6 | Confident | 66.7 | Low | 163 Ų | 163 | 116.9 Ų | 116.9 | 71% | 0.709 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -72.1 | -35.4 | 177.1 | -152.5 | 176.6 | -172.2 | 178.3 | 0 | 112.2 | E299 E300 R306 | E299-K302 PolarHBondContact O-N 3.45Å; E300-K302 PolarHBondContact O-N 3.24Å; K302-R306 WeakPolarHBondContact O-CG 3.47Å; K302-R306 PolarHBondContact O-N 3.16Å |
| 303 | M | 66.6 | Low | 67.6 | Low | 102 Ų | 102 | 118 Ų | 118 | 50% | 0.502 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -72.1 | -41.1 | 174.2 | -77.2 | -65.5 | -71.9 | 0 | 0 | 111.9 | E299 E300 G305 R306 I307 | E299-M303 WeakPolarHBondContact O-CG 3.23Å; E299-M303 PolarHBondContact O-N 2.91Å; E300-M303 PolarHBondContact O-N 2.82Å; E300-M303 VanDerWaalsContact O-N 3.13Å; M303-G305 PolarHBondContact O-N 3.25Å; M303-R306 WeakPolarHBondContact O-CB 3.3Å; M303-R306 PolarHBondContact O-N 2.69Å; M303-R306 VanDerWaalsContact O-N 3.07Å; M303-I307 PolarHBondContact O-N 3.34Å |
| 304 | H | 68.7 | Low | 68.6 | Low | 134 Ų | 134 | 121.5 Ų | 121.5 | 62% | 0.62 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -61.2 | -44.4 | 177.9 | -134.8 | 50.4 | 0 | 0 | 0 | 111.2 | E300 R306 I307 T308 | E300-H304 WeakPolarHBondContact O-CB 3.34Å; E300-H304 PolarHBondContact O-N 2.81Å; H304-R306 VanDerWaalsContact C-N 3.25Å; H304-R306 PolarHBondContact O-N 2.88Å; H304-I307 PolarHBondContact O-N 2.83Å; H304-T308 PolarHBondContact O-N 3.33Å; H304-T308 VanDerWaalsContact O-N 3.08Å; H304-T308 PolarHBondContact O-OG1 3.41Å; H304-T308 VanDerWaalsContact O-OG1 3.1Å |
| 305 | G | 69.8 | Low | 69.7 | Low | 49 Ų | 49 | 119.9 Ų | 119.9 | 51% | 0.505 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -60.6 | -29.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | E301 M303 K309 | E301-G305 PolarHBondContact O-N 2.88Å; E301-G305 VanDerWaalsContact O-N 3.15Å; M303-G305 PolarHBondContact O-N 3.25Å; G305-K309 PolarHBondContact O-N 3.34Å |
| 306 | R | 78.2 | Confident | 70.6 | Confident | 169 Ų | 169 | 117.3 Ų | 117.3 | 64% | 0.638 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -76.2 | -40 | 175.6 | -74.2 | 175.9 | 69.7 | 171.4 | 1.6 | 112.4 | K302 M303 H304 K309 L310 | K302-R306 WeakPolarHBondContact O-CG 3.47Å; K302-R306 PolarHBondContact O-N 3.16Å; M303-R306 WeakPolarHBondContact O-CB 3.3Å; M303-R306 PolarHBondContact O-N 2.69Å; M303-R306 VanDerWaalsContact O-N 3.07Å; H304-R306 VanDerWaalsContact C-N 3.25Å; H304-R306 PolarHBondContact O-N 2.88Å; R306-K309 PolarHBondContact O-N 3.47Å; R306-L310 PolarHBondContact O-N 3.29Å |
| 307 | I | 74.8 | Confident | 71.3 | Confident | 82 Ų | 82 | 118.2 Ų | 118.2 | 42% | 0.421 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63.2 | -49.5 | 178.1 | -69.6 | 170 | 0 | 0 | 0 | 110.1 | M303 H304 K309 L310 E311 | M303-I307 PolarHBondContact O-N 3.34Å; H304-I307 PolarHBondContact O-N 2.83Å; I307-K309 PolarHBondContact O-N 2.82Å; I307-L310 WeakPolarHBondContact O-CB 3.3Å; I307-L310 PolarHBondContact O-N 2.88Å; I307-E311 HydrophobicContact CG2-CG 4.43Å; I307-E311 PolarHBondContact O-N 2.97Å |
| 308 | T | 75.4 | Confident | 72.1 | Confident | 68 Ų | 68 | 113.5 Ų | 113.5 | 42% | 0.417 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -59.2 | -36.2 | 178.8 | -50.9 | 0 | 0 | 0 | 0 | 112.2 | H304 L312 | H304-T308 PolarHBondContact O-N 3.33Å; H304-T308 VanDerWaalsContact O-N 3.08Å; H304-T308 PolarHBondContact O-OG1 3.41Å; H304-T308 VanDerWaalsContact O-OG1 3.1Å; T308-L312 PolarHBondContact O-N 2.79Å |
| 309 | K | 76.4 | Confident | 73.1 | Confident | 145 Ų | 145 | 113.8 Ų | 113.8 | 63% | 0.63 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -68.7 | -39.2 | 176 | -166.8 | 176.8 | -176.8 | 179.6 | 0 | 112.4 | G305 R306 I307 Q313 | G305-K309 PolarHBondContact O-N 3.34Å; R306-K309 PolarHBondContact O-N 3.47Å; I307-K309 PolarHBondContact O-N 2.82Å; K309-Q313 PolarHBondContact O-N 3.06Å; K309-Q313 VanDerWaalsContact O-N 3.14Å |
| 310 | L | 75.7 | Confident | 73.7 | Confident | 107 Ų | 107 | 113.2 Ų | 113.2 | 56% | 0.56 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -68.1 | -40.8 | 176.4 | -82.3 | 165.7 | 0 | 0 | 0 | 112.1 | R306 I307 L312 Q313 M314 | R306-L310 PolarHBondContact O-N 3.29Å; I307-L310 WeakPolarHBondContact O-CB 3.3Å; I307-L310 PolarHBondContact O-N 2.88Å; L310-L312 VanDerWaalsContact C-N 3.35Å; L310-L312 PolarHBondContact O-N 3.47Å; L310-Q313 PolarHBondContact O-N 3.44Å; L310-M314 WeakPolarHBondContact O-CB 3.44Å; L310-M314 PolarHBondContact O-N 3.46Å |
| 311 | E | 74.3 | Confident | 74.4 | Confident | 105 Ų | 105 | 112.7 Ų | 112.7 | 49% | 0.491 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -62.9 | -40.5 | 176.4 | -74 | 179.7 | 140.5 | 0 | 0 | 112.2 | I307 M314 N315 | I307-E311 HydrophobicContact CG2-CG 4.43Å; I307-E311 PolarHBondContact O-N 2.97Å; E311-M314 PolarHBondContact O-N 2.9Å; E311-N315 WeakPolarHBondContact O-CB 3.33Å; E311-N315 PolarHBondContact O-N 3.03Å |
| 312 | L | 77.3 | Confident | 74.9 | Confident | 122 Ų | 122 | 113 Ų | 113 | 64% | 0.639 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -63.1 | -43.1 | 173.7 | -96.3 | 154.6 | 0 | 0 | 0 | 112.3 | T308 L310 Q316 | T308-L312 PolarHBondContact O-N 2.79Å; L310-L312 VanDerWaalsContact C-N 3.35Å; L310-L312 PolarHBondContact O-N 3.47Å; L312-Q316 PolarHBondContact O-N 3.48Å; L312-Q316 VanDerWaalsContact O-N 3.11Å |
| 313 | Q | 76.3 | Confident | 75.1 | Confident | 114 Ų | 114 | 108.3 Ų | 108.3 | 53% | 0.533 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65.1 | -41.4 | 174.8 | -82 | -173.7 | -52.5 | 0 | 0 | 112.4 | K309 L310 N315 Q316 N317 | K309-Q313 PolarHBondContact O-N 3.06Å; K309-Q313 VanDerWaalsContact O-N 3.14Å; L310-Q313 PolarHBondContact O-N 3.44Å; Q313-N315 PolarHBondContact O-N 3.42Å; Q313-Q316 PolarHBondContact O-N 3.18Å; Q313-N317 PolarHBondContact O-N 2.96Å |
| 314 | M | 77.2 | Confident | 75.4 | Confident | 110 Ų | 110 | 110.7 Ų | 110.7 | 54% | 0.542 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -63.3 | -42.9 | 178.5 | -171 | 174.9 | 67 | 0 | 0 | 111.3 | L310 E311 Q316 N317 I318 | L310-M314 WeakPolarHBondContact O-CB 3.44Å; L310-M314 PolarHBondContact O-N 3.46Å; E311-M314 PolarHBondContact O-N 2.9Å; M314-Q316 VanDerWaalsContact C-N 3.31Å; M314-Q316 PolarHBondContact O-N 3.2Å; M314-N317 PolarHBondContact O-N 3.34Å; M314-I318 HydrophobicContact CG-CD1 4.26Å; M314-I318 WeakPolarHBondContact O-CG1 3.43Å; M314-I318 PolarHBondContact O-N 3.14Å |
| 315 | N | 79 | Confident | 75.8 | Confident | 102 Ų | 102 | 108 Ų | 108 | 55% | 0.545 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64 | -35.1 | 175.4 | -89.6 | -31.1 | 0 | 0 | 0 | 113.1 | E311 Q313 K319 | E311-N315 WeakPolarHBondContact O-CB 3.33Å; E311-N315 PolarHBondContact O-N 3.03Å; Q313-N315 PolarHBondContact O-N 3.42Å; N315-K319 PolarHBondContact O-N 3.31Å |
| 316 | Q | 76.1 | Confident | 76.1 | Confident | 103 Ų | 103 | 110.7 Ų | 110.7 | 48% | 0.481 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -66.4 | -46.4 | 175 | -165.7 | 67.8 | 23 | 0 | 0 | 111.2 | L312 Q313 M314 I318 K319 E320 | L312-Q316 PolarHBondContact O-N 3.48Å; L312-Q316 VanDerWaalsContact O-N 3.11Å; Q313-Q316 PolarHBondContact O-N 3.18Å; M314-Q316 VanDerWaalsContact C-N 3.31Å; M314-Q316 PolarHBondContact O-N 3.2Å; Q316-I318 VanDerWaalsContact C-N 3.33Å; Q316-I318 PolarHBondContact O-N 2.86Å; Q316-K319 WeakPolarHBondContact O-CB 3.4Å; Q316-K319 PolarHBondContact O-N 3.42Å; Q316-K319 VanDerWaalsContact O-N 3.13Å; Q316-E320 PolarHBondContact O-N 2.98Å |
| 317 | N | 76 | Confident | 75.9 | Confident | 94 Ų | 94 | 105.5 Ų | 105.5 | 50% | 0.503 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.8 | -38.7 | 177.1 | -75 | -3.8 | 0 | 0 | 0 | 112.5 | Q313 M314 K319 E320 M321 | Q313-N317 PolarHBondContact O-N 2.96Å; M314-N317 PolarHBondContact O-N 3.34Å; N317-K319 VanDerWaalsContact C-N 3.32Å; N317-K319 PolarHBondContact O-N 3.04Å; N317-E320 PolarHBondContact O-N 3.29Å; N317-M321 VanDerWaalsContact O-CB 3.29Å; N317-M321 WeakPolarHBondContact O-CB 3.48Å; N317-M321 PolarHBondContact O-N 3.18Å |
| 318 | I | 77.4 | Confident | 75.7 | Confident | 78 Ų | 78 | 103.4 Ų | 103.4 | 40% | 0.4 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -65.1 | -36.9 | 176.4 | -70.4 | 172.1 | 0 | 0 | 0 | 111.2 | M314 Q316 K322 | M314-I318 HydrophobicContact CG-CD1 4.26Å; M314-I318 WeakPolarHBondContact O-CG1 3.43Å; M314-I318 PolarHBondContact O-N 3.14Å; Q316-I318 VanDerWaalsContact C-N 3.33Å; Q316-I318 PolarHBondContact O-N 2.86Å; I318-K322 PolarHBondContact O-N 3.37Å |
| 319 | K | 77.1 | Confident | 75.6 | Confident | 154 Ų | 154 | 106.5 Ų | 106.5 | 67% | 0.67 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66.5 | -44.5 | 174.8 | -93.4 | -177.8 | 175.6 | 177.6 | 0 | 112 | N315 Q316 N317 K322 A323 | N315-K319 PolarHBondContact O-N 3.31Å; Q316-K319 WeakPolarHBondContact O-CB 3.4Å; Q316-K319 PolarHBondContact O-N 3.42Å; Q316-K319 VanDerWaalsContact O-N 3.13Å; N317-K319 VanDerWaalsContact C-N 3.32Å; N317-K319 PolarHBondContact O-N 3.04Å; K319-K322 PolarHBondContact O-N 3.44Å; K319-A323 PolarHBondContact O-N 3.28Å |
| 320 | E | 75.6 | Confident | 75.5 | Confident | 109 Ų | 109 | 103.6 Ų | 103.6 | 51% | 0.509 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65 | -45.1 | 178.5 | -76.6 | 172.4 | -171.5 | 0 | 0 | 111.6 | Q316 N317 K322 A323 E324 | Q316-E320 PolarHBondContact O-N 2.98Å; N317-E320 PolarHBondContact O-N 3.29Å; E320-K322 VanDerWaalsContact C-N 3.3Å; E320-K322 PolarHBondContact O-N 3.43Å; E320-A323 WeakPolarHBondContact O-CB 3.29Å; E320-A323 PolarHBondContact O-N 3.41Å; E320-E324 PolarHBondContact O-N 3.27Å |
| 321 | M | 76.2 | Confident | 75.4 | Confident | 118 Ų | 118 | 101 Ų | 101 | 58% | 0.581 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -59.2 | -39.2 | 176.8 | -167.4 | -173 | -52.8 | 0 | 0 | 112.4 | N317 E324 V325 | N317-M321 VanDerWaalsContact O-CB 3.29Å; N317-M321 WeakPolarHBondContact O-CB 3.48Å; N317-M321 PolarHBondContact O-N 3.18Å; M321-E324 PolarHBondContact O-N 3.12Å; M321-V325 VanDerWaalsContact O-CG2 3.31Å; M321-V325 WeakPolarHBondContact O-CG2 3.41Å; M321-V325 PolarHBondContact O-N 3.16Å |
| 322 | K | 75.5 | Confident | 75.3 | Confident | 146 Ų | 146 | 99.9 Ų | 99.9 | 64% | 0.635 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -64.9 | -37 | 173.7 | -84.8 | -175.4 | 174.3 | -178.6 | 0 | 112.9 | I318 K319 E320 N326 | I318-K322 PolarHBondContact O-N 3.37Å; K319-K322 PolarHBondContact O-N 3.44Å; E320-K322 VanDerWaalsContact C-N 3.3Å; E320-K322 PolarHBondContact O-N 3.43Å; K322-N326 PolarHBondContact O-N 3.2Å |
| 323 | A | 74.4 | Confident | 74.8 | Confident | 63 Ų | 63 | 103 Ų | 103 | 52% | 0.521 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -68.2 | -41.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | K319 E320 N326 A327 | K319-A323 PolarHBondContact O-N 3.28Å; E320-A323 WeakPolarHBondContact O-CB 3.29Å; E320-A323 PolarHBondContact O-N 3.41Å; A323-N326 PolarHBondContact O-N 3.43Å; A323-A327 WeakPolarHBondContact O-CB 3.28Å; A323-A327 PolarHBondContact O-N 3.45Å |
| 324 | E | 72.6 | Confident | 74.4 | Confident | 153 Ų | 153 | 104.2 Ų | 104.2 | 72% | 0.715 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -67.1 | -41.4 | -179.3 | -140.9 | 170.3 | -153.6 | 0 | 0 | 112.1 | E320 M321 A327 G328 | E320-E324 PolarHBondContact O-N 3.27Å; M321-E324 PolarHBondContact O-N 3.12Å; E324-A327 PolarHBondContact O-N 3.22Å; E324-G328 PolarHBondContact O-N 2.99Å |
| 325 | V | 76.2 | Confident | 74 | Confident | 76 Ų | 76 | 102.3 Ų | 102.3 | 46% | 0.461 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -62.8 | -44.7 | 174 | 170.4 | 0 | 0 | 0 | 0 | 111.5 | M321 G328 F329 | M321-V325 VanDerWaalsContact O-CG2 3.31Å; M321-V325 WeakPolarHBondContact O-CG2 3.41Å; M321-V325 PolarHBondContact O-N 3.16Å; V325-G328 PolarHBondContact O-N 3.34Å; V325-F329 HydrophobicContact CG1-CD2 3.88Å; V325-F329 HydrophobicContact CG1-CE2 3.73Å; V325-F329 VanDerWaalsContact O-CD2 3.29Å; V325-F329 WeakPolarHBondContact O-CD2 3.41Å; V325-F329 PolarHBondContact O-N 3.12Å |
| 326 | N | 77.2 | Confident | 73.5 | Confident | 106 Ų | 106 | 102.3 Ų | 102.3 | 57% | 0.567 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -66.1 | -37.7 | 178.1 | -82.5 | -13.2 | 0 | 0 | 0 | 112.7 | K322 A323 F329 T330 | K322-N326 PolarHBondContact O-N 3.2Å; A323-N326 PolarHBondContact O-N 3.43Å; N326-F329 PolarHBondContact O-N 2.86Å; N326-T330 PolarHBondContact O-N 3.48Å; N326-T330 VanDerWaalsContact O-N 3.13Å; N326-T330 PolarHBondContact O-OG1 3.35Å |
| 327 | A | 73.7 | Confident | 73.2 | Confident | 60 Ų | 60 | 99.2 Ų | 99.2 | 50% | 0.496 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.5 | -41.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | A323 E324 F329 T330 A331 | A323-A327 WeakPolarHBondContact O-CB 3.28Å; A323-A327 PolarHBondContact O-N 3.45Å; E324-A327 PolarHBondContact O-N 3.22Å; A327-F329 PolarHBondContact O-N 3.01Å; A327-T330 WeakPolarHBondContact O-CB 3.29Å; A327-T330 PolarHBondContact O-N 2.91Å; A327-A331 PolarHBondContact O-N 3.33Å; A327-A331 VanDerWaalsContact O-N 3.09Å |
| 328 | G | 69.3 | Low | 73 | Confident | 38 Ų | 38 | 98 Ų | 98 | 39% | 0.392 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -58.5 | -45.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | E324 V325 T330 A331 V332 | E324-G328 PolarHBondContact O-N 2.99Å; V325-G328 PolarHBondContact O-N 3.34Å; G328-T330 VanDerWaalsContact C-N 3.31Å; G328-T330 PolarHBondContact O-N 3.07Å; G328-A331 PolarHBondContact O-N 3.25Å; G328-V332 WeakPolarHBondContact O-CG2 3.37Å; G328-V332 PolarHBondContact O-N 3.41Å |
| 329 | F | 74.7 | Confident | 72.5 | Confident | 134 Ų | 134 | 100 Ų | 100 | 59% | 0.588 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -64.7 | -33.8 | 176 | -83.1 | -69.9 | 0 | 0 | 0 | 113.2 | V325 N326 A327 Y333 | V325-F329 HydrophobicContact CG1-CD2 3.88Å; V325-F329 HydrophobicContact CG1-CE2 3.73Å; V325-F329 VanDerWaalsContact O-CD2 3.29Å; V325-F329 WeakPolarHBondContact O-CD2 3.41Å; V325-F329 PolarHBondContact O-N 3.12Å; N326-F329 PolarHBondContact O-N 2.86Å; A327-F329 PolarHBondContact O-N 3.01Å; F329-Y333 PolarHBondContact O-N 2.91Å |
| 330 | T | 74.6 | Confident | 72.1 | Confident | 84 Ų | 84 | 101.6 Ų | 101.6 | 52% | 0.515 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -66.4 | -44.9 | 177.8 | -53.9 | 0 | 0 | 0 | 0 | 111.2 | N326 A327 G328 V332 Y333 E334 | N326-T330 PolarHBondContact O-N 3.48Å; N326-T330 VanDerWaalsContact O-N 3.13Å; N326-T330 PolarHBondContact O-OG1 3.35Å; A327-T330 WeakPolarHBondContact O-CB 3.29Å; A327-T330 PolarHBondContact O-N 2.91Å; G328-T330 VanDerWaalsContact C-N 3.31Å; G328-T330 PolarHBondContact O-N 3.07Å; T330-V332 PolarHBondContact O-N 2.87Å; T330-Y333 PolarHBondContact O-N 2.96Å; T330-E334 PolarHBondContact O-N 3.31Å; T330-E334 VanDerWaalsContact O-N 3.12Å |
| 331 | A | 72.4 | Confident | 71.8 | Confident | 52 Ų | 52 | 103.5 Ų | 103.5 | 43% | 0.43 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -65.6 | -35 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | A327 G328 S335 | A327-A331 PolarHBondContact O-N 3.33Å; A327-A331 VanDerWaalsContact O-N 3.09Å; G328-A331 PolarHBondContact O-N 3.25Å; A331-S335 WeakPolarHBondContact O-CB 3.46Å; A331-S335 PolarHBondContact O-N 3.43Å; A331-S335 VanDerWaalsContact O-N 3.12Å; A331-S335 PolarHBondContact O-OG 3.47Å |
| 332 | V | 71.9 | Confident | 71.7 | Confident | 82 Ų | 82 | 102.6 Ų | 102.6 | 50% | 0.497 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -68 | -41.3 | 175.6 | 173.6 | 0 | 0 | 0 | 0 | 111.1 | G328 T330 S335 I336 | G328-V332 WeakPolarHBondContact O-CG2 3.37Å; G328-V332 PolarHBondContact O-N 3.41Å; T330-V332 PolarHBondContact O-N 2.87Å; V332-S335 PolarHBondContact O-N 3.23Å; V332-I336 HydrophobicContact CG1-CD1 3.95Å; V332-I336 WeakPolarHBondContact O-CG1 3.46Å; V332-I336 PolarHBondContact O-N 3.12Å; V332-I336 VanDerWaalsContact O-N 3.08Å |
| 333 | Y | 67 | Low | 71.4 | Confident | 188 Ų | 188 | 101.3 Ų | 101.3 | 74% | 0.737 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -64.9 | -41.5 | 178.2 | -108.2 | -85.5 | 0 | 0 | 0 | 112.7 | F329 T330 I336 G337 | F329-Y333 PolarHBondContact O-N 2.91Å; T330-Y333 PolarHBondContact O-N 2.96Å; Y333-I336 PolarHBondContact O-N 3Å; Y333-G337 PolarHBondContact O-N 3.31Å |
| 334 | E | 68 | Low | 71.2 | Confident | 138 Ų | 138 | 105 Ų | 105 | 65% | 0.645 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -66.2 | -36.9 | 175.6 | -77.5 | -169.7 | 155.3 | 0 | 0 | 112.7 | T330 G337 S338 | T330-E334 PolarHBondContact O-N 3.31Å; T330-E334 VanDerWaalsContact O-N 3.12Å; E334-G337 PolarHBondContact O-N 2.93Å; E334-S338 WeakPolarHBondContact O-CB 3.41Å; E334-S338 PolarHBondContact O-N 2.98Å; E334-S338 PolarHBondContact O-OG 2.98Å |
| 335 | S | 69.4 | Low | 71.2 | Confident | 71 Ų | 71 | 100.7 Ų | 100.7 | 50% | 0.497 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -66 | -40.4 | 177.5 | -62.8 | 0 | 0 | 0 | 0 | 112 | A331 V332 S338 L339 | A331-S335 WeakPolarHBondContact O-CB 3.46Å; A331-S335 PolarHBondContact O-N 3.43Å; A331-S335 VanDerWaalsContact O-N 3.12Å; A331-S335 PolarHBondContact O-OG 3.47Å; V332-S335 PolarHBondContact O-N 3.23Å; S335-S338 PolarHBondContact O-N 3.32Å; S335-L339 WeakPolarHBondContact O-CG 3.41Å; S335-L339 PolarHBondContact O-N 3Å; S335-L339 VanDerWaalsContact O-N 3.08Å |
| 336 | I | 68.8 | Low | 70.9 | Confident | 102 Ų | 102 | 103.8 Ų | 103.8 | 52% | 0.523 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -67.8 | -39.3 | 175.6 | -67.8 | 170.2 | 0 | 0 | 0 | 111 | V332 Y333 R340 | V332-I336 HydrophobicContact CG1-CD1 3.95Å; V332-I336 WeakPolarHBondContact O-CG1 3.46Å; V332-I336 PolarHBondContact O-N 3.12Å; V332-I336 VanDerWaalsContact O-N 3.08Å; Y333-I336 PolarHBondContact O-N 3Å; I336-R340 PolarHBondContact O-N 3.48Å |
| 337 | G | 69.7 | Low | 70.7 | Confident | 38 Ų | 38 | 105.3 Ų | 105.3 | 39% | 0.392 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63.2 | -42.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y333 E334 R340 Q341 | Y333-G337 PolarHBondContact O-N 3.31Å; E334-G337 PolarHBondContact O-N 2.93Å; G337-R340 WeakPolarHBondContact O-CB 3.49Å; G337-R340 PolarHBondContact O-N 3.22Å; G337-Q341 PolarHBondContact O-N 2.92Å |
| 338 | S | 70.4 | Confident | 70.6 | Confident | 68 Ų | 68 | 109.6 Ų | 109.6 | 48% | 0.476 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -67.5 | -40.8 | 179.7 | -58.7 | 0 | 0 | 0 | 0 | 112.2 | E334 S335 R340 Q341 V342 | E334-S338 WeakPolarHBondContact O-CB 3.41Å; E334-S338 PolarHBondContact O-N 2.98Å; E334-S338 PolarHBondContact O-OG 2.98Å; S335-S338 PolarHBondContact O-N 3.32Å; S338-R340 VanDerWaalsContact C-N 3.3Å; S338-R340 PolarHBondContact O-N 3.45Å; S338-Q341 PolarHBondContact O-N 3.36Å; S338-V342 WeakPolarHBondContact O-CG2 3.43Å; S338-V342 PolarHBondContact O-N 2.98Å; S338-V342 VanDerWaalsContact O-N 3.13Å |
| 339 | L | 66.9 | Low | 70.8 | Confident | 121 Ų | 121 | 112.9 Ų | 112.9 | 63% | 0.634 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -60.9 | -38.2 | 175.4 | -82.1 | 164.4 | 0 | 0 | 0 | 112.3 | S335 V342 L343 | S335-L339 WeakPolarHBondContact O-CG 3.41Å; S335-L339 PolarHBondContact O-N 3Å; S335-L339 VanDerWaalsContact O-N 3.08Å; L339-V342 PolarHBondContact O-N 3.39Å; L339-L343 PolarHBondContact O-N 3.5Å; L339-L343 VanDerWaalsContact O-N 3.1Å |
| 340 | R | 68.6 | Low | 70.5 | Confident | 187 Ų | 187 | 110.4 Ų | 110.4 | 71% | 0.706 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -61.1 | -47.1 | 174.7 | -99.2 | -179.1 | 143.3 | -142 | -5.6 | 112.3 | I336 G337 S338 V342 L343 E344 | I336-R340 PolarHBondContact O-N 3.48Å; G337-R340 WeakPolarHBondContact O-CB 3.49Å; G337-R340 PolarHBondContact O-N 3.22Å; S338-R340 VanDerWaalsContact C-N 3.3Å; S338-R340 PolarHBondContact O-N 3.45Å; R340-V342 PolarHBondContact O-N 3.09Å; R340-L343 PolarHBondContact O-N 3.31Å; R340-E344 WeakPolarHBondContact O-CB 3.5Å; R340-E344 PolarHBondContact O-N 3.27Å; R340-E344 VanDerWaalsContact O-N 3.11Å |
| 341 | Q | 70.4 | Confident | 70 | Confident | 148 Ų | 148 | 115.4 Ų | 115.4 | 69% | 0.692 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -62.7 | -40.8 | 179.1 | -84.4 | -175.5 | -5.4 | 0 | 0 | 112.9 | G337 S338 E344 A345 | G337-Q341 PolarHBondContact O-N 2.92Å; S338-Q341 PolarHBondContact O-N 3.36Å; Q341-E344 PolarHBondContact O-N 2.99Å; Q341-A345 WeakPolarHBondContact O-CB 3.47Å; Q341-A345 PolarHBondContact O-N 3.07Å |
| 342 | V | 73.5 | Confident | 69.8 | Low | 99 Ų | 99 | 117.5 Ų | 117.5 | 60% | 0.6 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -67.1 | -40 | 179.4 | 174.7 | 0 | 0 | 0 | 0 | 111.3 | S338 L339 R340 E344 K346 | S338-V342 WeakPolarHBondContact O-CG2 3.43Å; S338-V342 PolarHBondContact O-N 2.98Å; S338-V342 VanDerWaalsContact O-N 3.13Å; L339-V342 PolarHBondContact O-N 3.39Å; R340-V342 PolarHBondContact O-N 3.09Å; V342-E344 VanDerWaalsContact C-N 3.34Å; V342-E344 PolarHBondContact O-N 3.47Å; V342-K346 WeakPolarHBondContact O-CB 3.25Å; V342-K346 PolarHBondContact O-N 2.69Å; V342-K346 VanDerWaalsContact O-N 3.07Å |
| 343 | L | 69 | Low | 69.5 | Low | 120 Ų | 120 | 119.3 Ų | 119.3 | 63% | 0.628 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -63.7 | -42.5 | 178 | -137.2 | 90.7 | 0 | 0 | 0 | 111.6 | L339 R340 K346 M347 | L339-L343 PolarHBondContact O-N 3.5Å; L339-L343 VanDerWaalsContact O-N 3.1Å; R340-L343 PolarHBondContact O-N 3.31Å; L343-K346 PolarHBondContact O-N 3.47Å; L343-M347 PolarHBondContact O-N 2.83Å |
| 344 | E | 71.4 | Confident | 69.3 | Low | 141 Ų | 141 | 115.8 Ų | 115.8 | 66% | 0.659 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -72.7 | -36.7 | -176.3 | -155.6 | 144.3 | -151.3 | 0 | 0 | 111.9 | R340 Q341 V342 K348 | R340-E344 WeakPolarHBondContact O-CB 3.5Å; R340-E344 PolarHBondContact O-N 3.27Å; R340-E344 VanDerWaalsContact O-N 3.11Å; Q341-E344 PolarHBondContact O-N 2.99Å; V342-E344 VanDerWaalsContact C-N 3.34Å; V342-E344 PolarHBondContact O-N 3.47Å; E344-K348 PolarHBondContact O-N 3.39Å |
| 345 | A | 71.5 | Confident | 69 | Low | 62 Ų | 62 | 115.7 Ų | 115.7 | 51% | 0.512 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -64.1 | -39.9 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q341 K348 L349 | Q341-A345 WeakPolarHBondContact O-CB 3.47Å; Q341-A345 PolarHBondContact O-N 3.07Å; A345-K348 PolarHBondContact O-N 2.89Å; A345-L349 PolarHBondContact O-N 3.21Å |
| 346 | K | 71.7 | Confident | 68.6 | Low | 140 Ų | 140 | 119.3 Ų | 119.3 | 61% | 0.609 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -69 | -43.1 | 179.5 | -171.5 | 148.3 | -176 | 165.8 | 0 | 112.6 | V342 L343 K348 L349 D350 | V342-K346 WeakPolarHBondContact O-CB 3.25Å; V342-K346 PolarHBondContact O-N 2.69Å; V342-K346 VanDerWaalsContact O-N 3.07Å; L343-K346 PolarHBondContact O-N 3.47Å; K346-K348 PolarHBondContact O-N 3.26Å; K346-L349 PolarHBondContact O-N 2.95Å; K346-D350 PolarHBondContact O-N 3.38Å; K346-D350 VanDerWaalsContact O-N 3.15Å |
| 347 | M | 72.5 | Confident | 68.1 | Low | 139 Ų | 139 | 120.9 Ų | 120.9 | 69% | 0.685 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -59.6 | -32.7 | 175.8 | -80.5 | -172.5 | 57.5 | 0 | 0 | 113.3 | L343 R351 | L343-M347 PolarHBondContact O-N 2.83Å; M347-R351 PolarHBondContact O-N 3.18Å |
| 348 | K | 71.7 | Confident | 67.5 | Low | 150 Ų | 150 | 124.6 Ų | 124.6 | 65% | 0.652 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -76.5 | -39.2 | -179.6 | -154.9 | 174.6 | -176.8 | -178.8 | 0 | 112 | E344 A345 K346 R351 D352 | E344-K348 PolarHBondContact O-N 3.39Å; A345-K348 PolarHBondContact O-N 2.89Å; K346-K348 PolarHBondContact O-N 3.26Å; K348-R351 VanDerWaalsContact O-CB 3.28Å; K348-R351 WeakPolarHBondContact O-CB 3.48Å; K348-R351 PolarHBondContact O-N 2.92Å; K348-D352 PolarHBondContact O-N 3.22Å |
| 349 | L | 72.2 | Confident | 66.6 | Low | 106 Ų | 106 | 128.8 Ų | 128.8 | 56% | 0.555 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -67.3 | -38.8 | 179.8 | -137.6 | 150.7 | 0 | 0 | 0 | 112.2 | A345 K346 R351 D352 Q353 | A345-L349 PolarHBondContact O-N 3.21Å; K346-L349 PolarHBondContact O-N 2.95Å; L349-R351 VanDerWaalsContact C-N 3.27Å; L349-R351 PolarHBondContact O-N 3.33Å; L349-D352 PolarHBondContact O-N 2.9Å; L349-Q353 PolarHBondContact O-N 3.07Å; L349-Q353 VanDerWaalsContact O-N 3.1Å |
| 350 | D | 68.4 | Low | 66 | Low | 82 Ų | 82 | 130 Ų | 130 | 44% | 0.439 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -64.8 | -32.9 | 174.3 | -75 | -13.7 | 0 | 0 | 0 | 111.7 | K346 Q353 L354 | K346-D350 PolarHBondContact O-N 3.38Å; K346-D350 VanDerWaalsContact O-N 3.15Å; D350-Q353 PolarHBondContact O-N 3.13Å; D350-L354 PolarHBondContact O-N 2.98Å; D350-L354 VanDerWaalsContact O-N 3.12Å |
| 351 | R | 65.6 | Low | 65.3 | Low | 189 Ų | 189 | 129.3 Ų | 129.3 | 71% | 0.713 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -65.6 | -42.9 | 175.3 | -140 | -178.3 | -156.1 | 154.9 | 4.8 | 111.8 | M347 K348 L349 L354 Q355 | M347-R351 PolarHBondContact O-N 3.18Å; K348-R351 VanDerWaalsContact O-CB 3.28Å; K348-R351 WeakPolarHBondContact O-CB 3.48Å; K348-R351 PolarHBondContact O-N 2.92Å; L349-R351 VanDerWaalsContact C-N 3.27Å; L349-R351 PolarHBondContact O-N 3.33Å; R351-L354 PolarHBondContact O-N 3.46Å; R351-Q355 PolarHBondContact O-N 3.4Å |
| 352 | D | 67.9 | Low | 64.2 | Low | 97 Ų | 97 | 130.1 Ų | 130.1 | 52% | 0.519 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -69.4 | -32.8 | 179.6 | -70.1 | -16.8 | 0 | 0 | 0 | 112.3 | K348 L349 K356 | K348-D352 PolarHBondContact O-N 3.22Å; L349-D352 PolarHBondContact O-N 2.9Å; D352-K356 PolarHBondContact O-N 3.1Å |
| 353 | Q | 65.8 | Low | 62.7 | Low | 120 Ų | 120 | 134.8 Ų | 134.8 | 56% | 0.561 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -71.1 | -42.1 | 174.8 | -82.7 | -169.8 | -16.1 | 0 | 0 | 112.7 | L349 D350 Q355 K356 Q357 | L349-Q353 PolarHBondContact O-N 3.07Å; L349-Q353 VanDerWaalsContact O-N 3.1Å; D350-Q353 PolarHBondContact O-N 3.13Å; Q353-Q355 VanDerWaalsContact C-N 3.31Å; Q353-Q355 PolarHBondContact O-N 3.4Å; Q353-K356 PolarHBondContact O-N 3.19Å; Q353-Q357 PolarHBondContact O-N 3.2Å; Q353-Q357 VanDerWaalsContact O-N 3.17Å |
| 354 | L | 61.6 | Low | 61.5 | Low | 113 Ų | 113 | 134 Ų | 134 | 59% | 0.592 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -62.8 | -38.5 | 177.1 | -88.4 | 158 | 0 | 0 | 0 | 111.8 | D350 R351 Q357 I358 | D350-L354 PolarHBondContact O-N 2.98Å; D350-L354 VanDerWaalsContact O-N 3.12Å; R351-L354 PolarHBondContact O-N 3.46Å; L354-Q357 PolarHBondContact O-N 3.34Å; L354-I358 PolarHBondContact O-N 3.49Å |
| 355 | Q | 62.9 | Low | 59.7 | Low | 137 Ų | 137 | 135.4 Ų | 135.4 | 64% | 0.64 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -73 | -31.4 | -179.3 | -154.4 | 166.5 | 1.2 | 0 | 0 | 112.8 | R351 Q353 | R351-Q355 PolarHBondContact O-N 3.4Å; Q353-Q355 VanDerWaalsContact C-N 3.31Å; Q353-Q355 PolarHBondContact O-N 3.4Å |
| 356 | K | 61.4 | Low | 58 | Low | 146 Ų | 146 | 138.9 Ų | 138.9 | 64% | 0.635 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -68.6 | -34.8 | 171.6 | -90.8 | -178.2 | 175.5 | 175.9 | 0 | 113.3 | D352 Q353 I358 Q359 | D352-K356 PolarHBondContact O-N 3.1Å; Q353-K356 PolarHBondContact O-N 3.19Å; K356-I358 VanDerWaalsContact C-N 3.31Å; K356-I358 PolarHBondContact O-N 3.4Å; K356-Q359 PolarHBondContact O-N 3.09Å |
| 357 | Q | 57.7 | Low | 56.8 | Low | 135 Ų | 135 | 138 Ų | 138 | 63% | 0.631 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -68.6 | -30.2 | 177.9 | -78.4 | -174.5 | -7.7 | 0 | 0 | 112.7 | Q353 L354 Q359 L360 | Q353-Q357 PolarHBondContact O-N 3.2Å; Q353-Q357 VanDerWaalsContact O-N 3.17Å; L354-Q357 PolarHBondContact O-N 3.34Å; Q357-Q359 VanDerWaalsContact C-N 3.29Å; Q357-Q359 PolarHBondContact O-N 3.41Å; Q357-L360 PolarHBondContact O-N 3.49Å |
| 358 | I | 55.9 | Low | 55.3 | Low | 117 Ų | 117 | 143.5 Ų | 143.5 | 60% | 0.6 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -67 | -30.8 | 175.6 | -64.1 | 169.4 | 0 | 0 | 0 | 111.6 | L354 K356 L360 | L354-I358 PolarHBondContact O-N 3.49Å; K356-I358 VanDerWaalsContact C-N 3.31Å; K356-I358 PolarHBondContact O-N 3.4Å; I358-L360 VanDerWaalsContact C-N 3.31Å; I358-L360 PolarHBondContact O-N 2.95Å |
| 359 | Q | 52 | Low | 54.5 | Low | 155 Ų | 155 | 143.2 Ų | 143.2 | 72% | 0.724 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -71.5 | -20.6 | 177.4 | -78.2 | -177.1 | -17 | 0 | 0 | 114.4 | K356 Q357 | K356-Q359 PolarHBondContact O-N 3.09Å; Q357-Q359 VanDerWaalsContact C-N 3.29Å; Q357-Q359 PolarHBondContact O-N 3.41Å |
| 360 | L | 54.1 | Low | 53.5 | Low | 148 Ų | 148 | 145.2 Ų | 145.2 | 78% | 0.775 | 72% | 0.718 | S | S | * | * | H | α-helix | trans | -93.8 | -16.3 | -172.3 | -80.4 | 160.4 | 0 | 0 | 0 | 114.1 | Q357 I358 | Q357-L360 PolarHBondContact O-N 3.49Å; I358-L360 VanDerWaalsContact C-N 3.31Å; I358-L360 PolarHBondContact O-N 2.95Å |
| 361 | M | 54 | Low | 52.7 | Low | 171 Ų | 171 | 148.7 Ų | 148.7 | 84% | 0.842 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -94.8 | 3.4 | 179.7 | -59.5 | -153.8 | -40.3 | 0 | 0 | 114.8 | ||
| 362 | Q | 47.8 | Very low | 52 | Low | 166 Ų | 166 | 146.3 Ų | 146.3 | 78% | 0.776 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -121.4 | 70.7 | 177.6 | -67.2 | -171.1 | -8 | 0 | 0 | 111.7 | ||
| 363 | K | 41.6 | Very low | 51 | Low | 196 Ų | 196 | 149.4 Ų | 149.4 | 85% | 0.852 | 75% | 0.748 | S | S | * | * | trans | -156.7 | 110.5 | 162.8 | -110.9 | 175.5 | -178.7 | 179.2 | 0 | 108.8 | ||||
| 364 | P | 43.2 | Very low | 50 | Low | 103 Ų | 103 | 151.3 Ų | 151.3 | 67% | 0.669 | 76% | 0.761 | S | S | * | * | -147.4 | 159.7 | 108.3 | 38.2 | -21.6 | 0 | 0 | 0 | 115.1 | |||||
| 365 | E | 34.6 | Very low | 49.1 | Very low | 172 Ų | 172 | 154.1 Ų | 154.1 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | 75.3 | 131.7 | 137.4 | -72.8 | 161.4 | -171.6 | 0 | 0 | 123 | ||||
| 366 | T | 34.9 | Very low | 48.1 | Very low | 135 Ų | 135 | 155.4 Ų | 155.4 | 83% | 0.828 | 78% | 0.783 | S | S | * | * | trans | 86 | 144.6 | 162 | 64.7 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 367 | P | 47 | Very low | 47 | Very low | 121 Ų | 121 | 156.2 Ų | 156.2 | 79% | 0.786 | 80% | 0.795 | S | S | * | * | cis | -135.1 | -154.3 | -48.5 | 38.4 | -19.4 | 0 | 0 | 0 | 111 | ||||
| 368 | M | 41 | Very low | 46 | Very low | 255 Ų | 255 | 158.1 Ų | 158.1 | 100% | 1.256 | 81% | 0.81 | S | S | * | * | trans | -36.9 | 0 | 170.9 | -75.9 | -138.4 | -59.2 | 0 | 0 | 116.2 |
Retrieved 368 of 368 residues in 343.6 ms
(Link to these results)