| 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 | 41.3 | Very low | 39.1 | Very low | 250 Ų | 250 | 157.8 Ų | 157.8 | 100% | 1.232 | 81% | 0.811 | S | S | * | * | 0 | 165 | 0 | -68.7 | -176.4 | 179.5 | 0 | 0 | 108.7 | |||||
| 2 | A | 40.5 | Very low | 39 | Very low | 83 Ų | 83 | 152.2 Ų | 152.2 | 69% | 0.686 | 81% | 0.806 | S | S | * | * | trans | -24.9 | 128.4 | -179 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 3 | D | 38.4 | Very low | 38.6 | Very low | 147 Ų | 147 | 150.8 Ų | 150.8 | 79% | 0.786 | 81% | 0.807 | S | S | * | * | 73.5 | 111 | 62.8 | -76.9 | -57.1 | 0 | 0 | 0 | 115.3 | |||||
| 4 | K | 49.2 | Very low | 38.3 | Very low | 197 Ų | 197 | 151.3 Ų | 151.3 | 86% | 0.857 | 81% | 0.806 | S | S | * | * | -179.7 | 123.4 | 126.9 | -87.5 | 140.3 | -161.9 | 172.9 | 0 | 107.7 | |||||
| 5 | S | 38.1 | Very low | 38.3 | Very low | 104 Ų | 104 | 148.1 Ų | 148.1 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | cis | 71.6 | 129.4 | 49.5 | -165.7 | 0 | 0 | 0 | 0 | 112 | ||||
| 6 | C | 36.5 | Very low | 37.9 | Very low | 101 Ų | 101 | 148.7 Ų | 148.7 | 68% | 0.682 | 80% | 0.797 | S | S | * | * | cis | -157.5 | 138.4 | -5.6 | -114.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 7 | K | 40 | Very low | 38 | Very low | 178 Ų | 178 | 144.8 Ų | 144.8 | 77% | 0.774 | 79% | 0.79 | S | S | * | * | 70.1 | 111 | 95.3 | -88.5 | -173.3 | 168 | 177.7 | 0 | 119.2 | |||||
| 8 | I | 37.1 | Very low | 37.9 | Very low | 127 Ų | 127 | 145.1 Ų | 145.1 | 65% | 0.651 | 78% | 0.782 | S | S | * | * | trans | 60.4 | 121.6 | 139.8 | -18.7 | 141.2 | 0 | 0 | 0 | 119.8 | ||||
| 9 | K | 35 | Very low | 37.7 | Very low | 192 Ų | 192 | 147.6 Ų | 147.6 | 84% | 0.835 | 79% | 0.785 | S | S | * | * | 176.3 | 152 | 102.6 | -94.4 | -175.8 | -177 | -176.5 | 0 | 116.6 | |||||
| 10 | D | 39.9 | Very low | 37.8 | Very low | 141 Ų | 141 | 152.3 Ų | 152.3 | 75% | 0.754 | 79% | 0.792 | S | S | * | * | trans | -84 | 164.1 | -175.1 | -33.3 | -101.8 | 0 | 0 | 0 | 113.2 | ||||
| 11 | K | 33.7 | Very low | 38.3 | Very low | 216 Ų | 216 | 150.7 Ų | 150.7 | 94% | 0.939 | 79% | 0.791 | S | S | * | * | trans | -165.1 | 149.4 | 139.4 | -112.7 | 166.8 | -174.3 | -178.3 | 0 | 112.6 | ||||
| 12 | A | 38.3 | Very low | 38 | Very low | 90 Ų | 90 | 143.5 Ų | 143.5 | 74% | 0.744 | 77% | 0.765 | S | S | * | * | trans | -122.3 | 144.9 | 178 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 13 | V | 34.1 | Very low | 37.9 | Very low | 135 Ų | 135 | 144.7 Ų | 144.7 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | trans | -148.1 | 107.7 | 166.9 | -176.3 | 0 | 0 | 0 | 0 | 104.1 | ||||
| 14 | I | 33.9 | Very low | 37.8 | Very low | 157 Ų | 157 | 141.9 Ų | 141.9 | 81% | 0.805 | 76% | 0.76 | S | S | * | * | 68.5 | 133.6 | 77.3 | -61.7 | 174 | 0 | 0 | 0 | 112.7 | |||||
| 15 | S | 37.8 | Very low | 37.3 | Very low | 103 Ų | 103 | 138.8 Ų | 138.8 | 72% | 0.72 | 76% | 0.758 | S | S | * | * | trans | -88.8 | 161.5 | -172.5 | 50.9 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 16 | E | 33.3 | Very low | 37.1 | Very low | 158 Ų | 158 | 142.1 Ų | 142.1 | 74% | 0.738 | 76% | 0.762 | S | S | * | * | -160.8 | 164.1 | 128.7 | -103.6 | -133 | 122.4 | 0 | 0 | 111.3 | K18 | E16-K18 IonicContact OE1-NZ 3.12Å; E16-K18 PolarHBondContact OE1-NZ 2.69Å; E16-K18 IonicContact OE2-NZ 3.88Å; E16-K18 PolarHBondContact OE2-NZ 3.03Å | |||
| 17 | A | 39.7 | Very low | 37 | Very low | 83 Ų | 83 | 142.3 Ų | 142.3 | 69% | 0.686 | 77% | 0.765 | S | S | * | * | trans | -137.8 | 146.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 18 | K | 34.6 | Very low | 36.9 | Very low | 149 Ų | 149 | 137.9 Ų | 137.9 | 65% | 0.648 | 76% | 0.761 | S | S | * | * | trans | -163.7 | 139.3 | 164.6 | -99.7 | 126.9 | -166.9 | 170.6 | 0 | 115.2 | E16 | E16-K18 IonicContact OE1-NZ 3.12Å; E16-K18 PolarHBondContact OE1-NZ 2.69Å; E16-K18 IonicContact OE2-NZ 3.88Å; E16-K18 PolarHBondContact OE2-NZ 3.03Å | ||
| 19 | K | 34.6 | Very low | 37 | Very low | 193 Ų | 193 | 141.9 Ų | 141.9 | 84% | 0.839 | 77% | 0.774 | S | S | * | * | trans | 69.6 | 119.2 | 140.5 | -67.3 | 175.6 | 176.7 | -176.8 | 0 | 122.3 | ||||
| 20 | R | 40.1 | Very low | 37.1 | Very low | 242 Ų | 242 | 140.1 Ų | 140.1 | 91% | 0.913 | 77% | 0.766 | S | S | * | * | trans | -75.2 | 153.3 | 136.7 | -80.4 | 176.8 | 164 | 174.9 | -5.4 | 110.6 | ||||
| 21 | P | 47.5 | Very low | 37 | Very low | 118 Ų | 118 | 140.6 Ų | 140.6 | 77% | 0.766 | 77% | 0.774 | S | S | * | * | -144.9 | -178.9 | 112.6 | 37.2 | -21.7 | 0 | 0 | 0 | 112.6 | |||||
| 22 | S | 35.8 | Very low | 37.5 | Very low | 99 Ų | 99 | 137.2 Ų | 137.2 | 69% | 0.692 | 76% | 0.761 | S | S | * | * | cis | -169.8 | 151 | -36.6 | 57.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 23 | S | 37.8 | Very low | 37.2 | Very low | 108 Ų | 108 | 137.7 Ų | 137.7 | 76% | 0.755 | 77% | 0.765 | S | S | * | * | trans | 60.6 | 171.3 | 156.3 | 78.5 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 24 | S | 36.9 | Very low | 37.4 | Very low | 89 Ų | 89 | 141.3 Ų | 141.3 | 62% | 0.622 | 77% | 0.77 | S | S | * | * | cis | -164 | 150.7 | -1.5 | 10.5 | 0 | 0 | 0 | 0 | 111 | ||||
| 25 | T | 37.7 | Very low | 37.9 | Very low | 132 Ų | 132 | 139.2 Ų | 139.2 | 81% | 0.81 | 77% | 0.767 | S | S | * | * | trans | 48.2 | 144.4 | 149.2 | 55.6 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 26 | E | 34.9 | Very low | 37.8 | Very low | 174 Ų | 174 | 144 Ų | 144 | 81% | 0.813 | 77% | 0.774 | S | S | * | * | cis | -157 | -160.1 | 4.1 | -134.1 | -151.9 | -83.6 | 0 | 0 | 107.5 | ||||
| 27 | S | 34.3 | Very low | 38.1 | Very low | 105 Ų | 105 | 145.3 Ų | 145.3 | 73% | 0.734 | 78% | 0.78 | S | S | * | * | cis | -143.5 | -144.5 | 4 | 65.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 28 | A | 38.9 | Very low | 37.8 | Very low | 84 Ų | 84 | 153.2 Ų | 153.2 | 69% | 0.694 | 79% | 0.793 | S | S | * | * | trans | -147.9 | 146.4 | -174.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 29 | K | 37.2 | Very low | 37.7 | Very low | 212 Ų | 212 | 151.9 Ų | 151.9 | 92% | 0.922 | 80% | 0.801 | S | S | * | * | -167.5 | 145.7 | 119.1 | -112.2 | 174.3 | -178.1 | 173.8 | 0 | 116.7 | |||||
| 30 | K | 39.1 | Very low | 37.9 | Very low | 154 Ų | 154 | 150.5 Ų | 150.5 | 67% | 0.67 | 80% | 0.802 | S | S | * | * | trans | -55.5 | 140.7 | -175.7 | -169.8 | -167.9 | -159.8 | -157.1 | 0 | 117.4 | E32 | K30-E32 WeakPolarHBondContact CE-OE2 3.49Å; K30-E32 IonicContact NZ-OE1 2.71Å; K30-E32 IonicContact NZ-OE2 2.81Å; K30-E32 PolarHBondContact NZ-OE2 3.3Å | ||
| 31 | V | 36.6 | Very low | 38.3 | Very low | 152 Ų | 152 | 144.2 Ų | 144.2 | 92% | 0.921 | 80% | 0.796 | S | S | * | * | trans | -136.8 | 154.1 | 145.6 | -179.7 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 32 | E | 43.7 | Very low | 38.9 | Very low | 144 Ų | 144 | 143.3 Ų | 143.3 | 67% | 0.673 | 79% | 0.792 | S | S | * | * | trans | -143.8 | 120.8 | -158.2 | 175.2 | 176.7 | -165.2 | 0 | 0 | 113.3 | K30 | K30-E32 WeakPolarHBondContact CE-OE2 3.49Å; K30-E32 IonicContact NZ-OE1 2.71Å; K30-E32 IonicContact NZ-OE2 2.81Å; K30-E32 PolarHBondContact NZ-OE2 3.3Å | ||
| 33 | A | 33.4 | Very low | 39.9 | Very low | 100 Ų | 100 | 142.9 Ų | 142.9 | 83% | 0.826 | 79% | 0.787 | S | S | * | * | trans | -166.4 | 96.1 | 168.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 34 | K | 38 | Very low | 41.3 | Very low | 211 Ų | 211 | 142.3 Ų | 142.3 | 92% | 0.917 | 78% | 0.779 | S | S | * | * | trans | 56.4 | 162.8 | 151.1 | -89.7 | -169.5 | 174.8 | -177.5 | 0 | 121 | ||||
| 35 | P | 44.3 | Very low | 43 | Very low | 114 Ų | 114 | 145.8 Ų | 145.8 | 74% | 0.74 | 78% | 0.783 | S | S | * | * | trans | -93.3 | 162.7 | -158.7 | 36.7 | -37.5 | 0 | 0 | 0 | 115 | ||||
| 36 | K | 36.2 | Very low | 44.8 | Very low | 203 Ų | 203 | 147.6 Ų | 147.6 | 88% | 0.883 | 78% | 0.78 | S | S | * | * | trans | -124.8 | 154.7 | 156.1 | -86.5 | -172.7 | 170.5 | -177.2 | 0 | 110.3 | ||||
| 37 | E | 39 | Very low | 47.1 | Very low | 185 Ų | 185 | 144.4 Ų | 144.4 | 86% | 0.864 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 162 | -168.8 | -67.1 | 136 | 136.3 | 0 | 0 | 113.5 | C39 | E37-C39 PolarHBondContact O-N 3.18Š|
| 38 | R | 32.7 | Very low | 49.6 | Very low | 249 Ų | 249 | 143 Ų | 143 | 94% | 0.94 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 132.5 | -172.6 | -69.2 | 178.7 | 174.6 | 172.4 | -2 | 111.1 | ||
| 39 | C | 33 | Very low | 52 | Low | 121 Ų | 121 | 142.9 Ų | 142.9 | 82% | 0.818 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 144.4 | 170.2 | -57 | 0 | 0 | 0 | 0 | 111.2 | E37 S41 | E37-C39 PolarHBondContact O-N 3.18Å; C39-S41 PolarHBondContact O-N 3.36Å; C39-S41 VanDerWaalsContact O-N 3.16Å |
| 40 | N | 39.8 | Very low | 54.7 | Low | 164 Ų | 164 | 136.4 Ų | 136.4 | 88% | 0.877 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 118.2 | 164.6 | -65.9 | -19.3 | 0 | 0 | 0 | 108.8 | S42 | N40-S42 PolarHBondContact O-N 3.1Š|
| 41 | S | 48.2 | Very low | 57.2 | Low | 110 Ų | 110 | 133.3 Ų | 133.3 | 77% | 0.769 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 117.3 | -179.4 | 53.1 | 0 | 0 | 0 | 0 | 110.8 | C39 | C39-S41 PolarHBondContact O-N 3.36Å; C39-S41 VanDerWaalsContact O-N 3.16Å |
| 42 | S | 58.6 | Low | 59.8 | Low | 100 Ų | 100 | 132.7 Ų | 132.7 | 70% | 0.699 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 143.5 | 160.5 | -49.7 | 0 | 0 | 0 | 0 | 109.7 | N40 T44 | N40-S42 PolarHBondContact O-N 3.1Å; S42-T44 PolarHBondContact O-N 3.33Å; S42-T44 VanDerWaalsContact O-N 3.07Å |
| 43 | P | 56.9 | Low | 62.2 | Low | 89 Ų | 89 | 128.2 Ų | 128.2 | 58% | 0.578 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 119.2 | 178.6 | -27 | 35.2 | 0 | 0 | 0 | 111 | I48 | P43-I48 HydrophobicContact CB-CG1 4.3Š|
| 44 | T | 68.2 | Low | 65.1 | Low | 96 Ų | 96 | 127.6 Ų | 127.6 | 59% | 0.589 | 65% | 0.65 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 147.5 | 174.5 | 62.8 | 0 | 0 | 0 | 0 | 109 | S42 K46 H47 | S42-T44 PolarHBondContact O-N 3.33Å; S42-T44 VanDerWaalsContact O-N 3.07Å; T44-K46 PolarHBondContact O-N 3.33Å; T44-H47 WeakPolarHBondContact O-CB 3.5Å; T44-H47 PolarHBondContact O-N 3.05Å |
| 45 | K | 71.9 | Confident | 67.7 | Low | 162 Ų | 162 | 123.1 Ų | 123.1 | 70% | 0.704 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -50 | -40.9 | -172.2 | -164.5 | 179.7 | 177.6 | -175.6 | 0 | 113.2 | H47 I48 D49 | K45-H47 PolarHBondContact O-N 2.93Å; K45-H47 VanDerWaalsContact O-N 3.15Å; K45-I48 WeakPolarHBondContact O-CA 3.41Å; K45-I48 WeakPolarHBondContact O-CB 3.3Å; K45-I48 PolarHBondContact O-N 3.39Å; K45-D49 VanDerWaalsContact C-OD2 3.29Å; K45-D49 PolarHBondContact O-N 3.4Å; K45-D49 VanDerWaalsContact O-OD2 3.1Å |
| 46 | K | 76.4 | Confident | 70.1 | Confident | 171 Ų | 171 | 124.4 Ų | 124.4 | 74% | 0.743 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -53.7 | -32.2 | 175.1 | -62.2 | -172.4 | 175.2 | -169.4 | 0 | 115 | T44 D49 D50 | T44-K46 PolarHBondContact O-N 3.33Å; K46-D49 WeakPolarHBondContact CA-OD2 3.39Å; K46-D49 PolarHBondContact N-OD2 3.1Å; K46-D50 VanDerWaalsContact O-CB 3.27Å; K46-D50 WeakPolarHBondContact O-CB 3.21Å; K46-D50 PolarHBondContact O-N 2.99Å |
| 47 | H | 83.5 | Confident | 72.9 | Confident | 106 Ų | 106 | 121.2 Ų | 121.2 | 49% | 0.491 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -77.5 | -25.1 | 177.3 | -174.5 | -62 | 0 | 0 | 0 | 112 | T44 K45 I51 | T44-H47 WeakPolarHBondContact O-CB 3.5Å; T44-H47 PolarHBondContact O-N 3.05Å; K45-H47 PolarHBondContact O-N 2.93Å; K45-H47 VanDerWaalsContact O-N 3.15Å; H47-I51 WeakPolarHBondContact O-CD1 3.4Å; H47-I51 VanDerWaalsContact O-CG1 3.28Å; H47-I51 WeakPolarHBondContact O-CG1 3.49Å; H47-I51 PolarHBondContact O-N 3.36Å |
| 48 | I | 86.4 | Confident | 75.7 | Confident | 76 Ų | 76 | 119.7 Ų | 119.7 | 39% | 0.39 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -76.8 | -44.5 | 171.4 | -59 | 172.3 | 0 | 0 | 0 | 108.6 | P43 K45 D50 I51 Y52 | P43-I48 HydrophobicContact CB-CG1 4.3Å; K45-I48 WeakPolarHBondContact O-CA 3.41Å; K45-I48 WeakPolarHBondContact O-CB 3.3Å; K45-I48 PolarHBondContact O-N 3.39Å; I48-D50 VanDerWaalsContact C-N 3.32Å; I48-D50 PolarHBondContact O-N 2.91Å; I48-I51 PolarHBondContact O-N 3.13Å; I48-Y52 HydrophobicContact CG2-CD2 3.88Å; I48-Y52 HydrophobicContact CG2-CE2 3.52Å; I48-Y52 WeakPolarHBondContact O-CD2 3.5Å; I48-Y52 PolarHBondContact O-N 3.4Å; I48-Y52 VanDerWaalsContact O-N 3.07Å |
| 49 | D | 89 | Confident | 78.7 | Confident | 81 Ų | 81 | 115.3 Ų | 115.3 | 43% | 0.433 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -59.5 | -40.2 | 175.9 | -49.9 | -38.5 | 0 | 0 | 0 | 111.6 | K45 K46 Y52 A53 | K45-D49 VanDerWaalsContact C-OD2 3.29Å; K45-D49 PolarHBondContact O-N 3.4Å; K45-D49 VanDerWaalsContact O-OD2 3.1Å; K46-D49 WeakPolarHBondContact CA-OD2 3.39Å; K46-D49 PolarHBondContact N-OD2 3.1Å; D49-Y52 PolarHBondContact O-N 3.03Å; D49-A53 PolarHBondContact O-N 3.4Å; D49-A53 VanDerWaalsContact O-N 3.12Å |
| 50 | D | 93.4 | Very high | 81.8 | Confident | 77 Ų | 77 | 115.7 Ų | 115.7 | 41% | 0.412 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -69.2 | -30.7 | 175.4 | 178.2 | 71.9 | 0 | 0 | 0 | 114.2 | K46 I48 K54 | K46-D50 VanDerWaalsContact O-CB 3.27Å; K46-D50 WeakPolarHBondContact O-CB 3.21Å; K46-D50 PolarHBondContact O-N 2.99Å; I48-D50 VanDerWaalsContact C-N 3.32Å; I48-D50 PolarHBondContact O-N 2.91Å; D50-K54 WeakPolarHBondContact O-CG 3.44Å; D50-K54 PolarHBondContact O-N 2.96Å; D50-K54 IonicContact OD1-NZ 2.63Å; D50-K54 PolarHBondContact OD1-NZ 3.31Å; D50-K54 IonicContact OD2-NZ 2.59Å; D50-K54 PolarHBondContact OD2-NZ 3.04Å |
| 51 | I | 91.3 | Very high | 84.5 | Confident | 88 Ų | 88 | 111.8 Ų | 111.8 | 45% | 0.451 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -69.5 | -44.9 | 172.6 | -75.6 | 168.6 | 0 | 0 | 0 | 110.3 | H47 I48 A53 K54 E55 | H47-I51 WeakPolarHBondContact O-CD1 3.4Å; H47-I51 VanDerWaalsContact O-CG1 3.28Å; H47-I51 WeakPolarHBondContact O-CG1 3.49Å; H47-I51 PolarHBondContact O-N 3.36Å; I48-I51 PolarHBondContact O-N 3.13Å; I51-A53 PolarHBondContact O-N 3.48Å; I51-K54 PolarHBondContact O-N 2.97Å; I51-E55 PolarHBondContact O-N 2.89Å |
| 52 | Y | 91.8 | Very high | 86.7 | Confident | 139 Ų | 139 | 110.8 Ų | 110.8 | 55% | 0.545 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.9 | -38.8 | 179 | -76.7 | -55.2 | 0 | 0 | 0 | 112.7 | I48 D49 K54 E55 E56 | I48-Y52 HydrophobicContact CG2-CD2 3.88Å; I48-Y52 HydrophobicContact CG2-CE2 3.52Å; I48-Y52 WeakPolarHBondContact O-CD2 3.5Å; I48-Y52 PolarHBondContact O-N 3.4Å; I48-Y52 VanDerWaalsContact O-N 3.07Å; D49-Y52 PolarHBondContact O-N 3.03Å; Y52-K54 VanDerWaalsContact C-N 3.31Å; Y52-K54 PolarHBondContact O-N 3.03Å; Y52-E55 WeakPolarHBondContact CD1-OE2 3.45Å; Y52-E55 WeakPolarHBondContact O-CB 3.31Å; Y52-E55 PolarHBondContact O-N 3.04Å; Y52-E56 PolarHBondContact O-N 3.32Å |
| 53 | A | 93.9 | Very high | 88.5 | Confident | 51 Ų | 51 | 108.5 Ų | 108.5 | 42% | 0.421 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -58.3 | -43.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112 | D49 I51 E56 E57 | D49-A53 PolarHBondContact O-N 3.4Å; D49-A53 VanDerWaalsContact O-N 3.12Å; I51-A53 PolarHBondContact O-N 3.48Å; A53-E56 PolarHBondContact O-N 2.88Å; A53-E57 PolarHBondContact O-N 3.39Å |
| 54 | K | 94.1 | Very high | 90.4 | Very high | 87 Ų | 87 | 108.8 Ų | 108.8 | 38% | 0.378 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -68.9 | -34.1 | 176.2 | -71.9 | 174.6 | 174.3 | 94.1 | 0 | 112.8 | D50 I51 Y52 E56 E57 Y58 | D50-K54 WeakPolarHBondContact O-CG 3.44Å; D50-K54 PolarHBondContact O-N 2.96Å; D50-K54 IonicContact OD1-NZ 2.63Å; D50-K54 PolarHBondContact OD1-NZ 3.31Å; D50-K54 IonicContact OD2-NZ 2.59Å; D50-K54 PolarHBondContact OD2-NZ 3.04Å; I51-K54 PolarHBondContact O-N 2.97Å; Y52-K54 VanDerWaalsContact C-N 3.31Å; Y52-K54 PolarHBondContact O-N 3.03Å; K54-E56 VanDerWaalsContact C-N 3.34Å; K54-E57 PolarHBondContact O-N 3.02Å; K54-Y58 HydrophobicContact CB-CE2 4.41Å; K54-Y58 WeakPolarHBondContact O-CD2 3.47Å; K54-Y58 PolarHBondContact O-N 3.41Å |
| 55 | E | 93.4 | Very high | 91.7 | Very high | 116 Ų | 116 | 108.4 Ų | 108.4 | 54% | 0.542 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.7 | -41.7 | 173.6 | -170 | -179.9 | 173.1 | 0 | 0 | 111.3 | I51 Y52 K59 | I51-E55 PolarHBondContact O-N 2.89Å; Y52-E55 WeakPolarHBondContact CD1-OE2 3.45Å; Y52-E55 WeakPolarHBondContact O-CB 3.31Å; Y52-E55 PolarHBondContact O-N 3.04Å; E55-K59 VanDerWaalsContact O-CB 3.27Å; E55-K59 WeakPolarHBondContact O-CB 3.42Å; E55-K59 PolarHBondContact O-N 2.92Å |
| 56 | E | 94.6 | Very high | 92.8 | Very high | 142 Ų | 142 | 106.9 Ų | 106.9 | 66% | 0.664 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -67.5 | -41.8 | 174.1 | -66.5 | -162.7 | 137.1 | 0 | 0 | 112.6 | Y52 A53 K54 K59 L60 | Y52-E56 PolarHBondContact O-N 3.32Å; A53-E56 PolarHBondContact O-N 2.88Å; K54-E56 VanDerWaalsContact C-N 3.34Å; E56-K59 PolarHBondContact O-N 2.98Å; E56-L60 WeakPolarHBondContact O-CG 3.35Å; E56-L60 PolarHBondContact O-N 3.3Å |
| 57 | E | 95.8 | Very high | 93.8 | Very high | 135 Ų | 135 | 101.5 Ų | 101.5 | 63% | 0.631 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -59.5 | -47.8 | 174.3 | -74.1 | -175.4 | 157.5 | 0 | 0 | 112.5 | A53 K54 K59 L60 L61 | A53-E57 PolarHBondContact O-N 3.39Å; K54-E57 PolarHBondContact O-N 3.02Å; E57-K59 VanDerWaalsContact C-N 3.28Å; E57-K59 PolarHBondContact O-N 3.42Å; E57-L60 PolarHBondContact O-N 3.31Å; E57-L61 WeakPolarHBondContact O-CB 3.41Å; E57-L61 PolarHBondContact O-N 3.37Å |
| 58 | Y | 96.6 | Very high | 94.4 | Very high | 154 Ų | 154 | 102.1 Ų | 102.1 | 60% | 0.604 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.8 | -33.6 | 176.8 | -76 | -57.5 | 0 | 0 | 0 | 112.5 | K54 L61 N62 | K54-Y58 HydrophobicContact CB-CE2 4.41Å; K54-Y58 WeakPolarHBondContact O-CD2 3.47Å; K54-Y58 PolarHBondContact O-N 3.41Å; Y58-L61 PolarHBondContact O-N 3.01Å; Y58-N62 WeakPolarHBondContact O-CB 3.42Å; Y58-N62 PolarHBondContact O-N 3.2Å |
| 59 | K | 96.7 | Very high | 94.9 | Very high | 156 Ų | 156 | 102.5 Ų | 102.5 | 68% | 0.678 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -69 | -39 | 177 | -171.5 | 176.1 | -177.9 | 179.5 | 0 | 112.2 | E55 E56 E57 A63 | E55-K59 VanDerWaalsContact O-CB 3.27Å; E55-K59 WeakPolarHBondContact O-CB 3.42Å; E55-K59 PolarHBondContact O-N 2.92Å; E56-K59 PolarHBondContact O-N 2.98Å; E57-K59 VanDerWaalsContact C-N 3.28Å; E57-K59 PolarHBondContact O-N 3.42Å; K59-A63 PolarHBondContact O-N 3.42Å; K59-A63 VanDerWaalsContact O-N 3.13Å |
| 60 | L | 96.6 | Very high | 95.2 | Very high | 129 Ų | 129 | 102.3 Ų | 102.3 | 68% | 0.675 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -66.5 | -43.8 | 172.4 | -69.5 | 171.6 | 0 | 0 | 0 | 111.5 | E56 E57 N62 A63 E64 | E56-L60 WeakPolarHBondContact O-CG 3.35Å; E56-L60 PolarHBondContact O-N 3.3Å; E57-L60 PolarHBondContact O-N 3.31Å; L60-N62 PolarHBondContact O-N 2.92Å; L60-A63 PolarHBondContact O-N 2.92Å; L60-E64 PolarHBondContact O-N 3.13Å |
| 61 | L | 96.9 | Very high | 95.4 | Very high | 83 Ų | 83 | 102.2 Ų | 102.2 | 44% | 0.435 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.3 | -41 | 177.9 | -175.3 | 61.7 | 0 | 0 | 0 | 112.1 | E57 Y58 E64 L65 | E57-L61 WeakPolarHBondContact O-CB 3.41Å; E57-L61 PolarHBondContact O-N 3.37Å; Y58-L61 PolarHBondContact O-N 3.01Å; L61-E64 PolarHBondContact O-N 2.64Å; L61-L65 HydrophobicContact CG-CD1 4.38Å; L61-L65 WeakPolarHBondContact O-CG 3.48Å; L61-L65 PolarHBondContact O-N 3.1Å |
| 62 | N | 94.9 | Very high | 95.7 | Very high | 88 Ų | 88 | 103.5 Ų | 103.5 | 47% | 0.471 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.1 | -41.7 | 173.9 | -78.5 | -3.6 | 0 | 0 | 0 | 111.9 | Y58 L60 E64 L65 E66 | Y58-N62 WeakPolarHBondContact O-CB 3.42Å; Y58-N62 PolarHBondContact O-N 3.2Å; L60-N62 PolarHBondContact O-N 2.92Å; N62-E64 VanDerWaalsContact C-N 3.3Å; N62-E64 PolarHBondContact O-N 3.5Å; N62-L65 PolarHBondContact O-N 2.99Å; N62-E66 WeakPolarHBondContact O-CB 3.19Å; N62-E66 WeakPolarHBondContact O-CG 3.36Å; N62-E66 PolarHBondContact O-N 3.04Å |
| 63 | A | 96.9 | Very high | 95.9 | Very high | 52 Ų | 52 | 100.6 Ų | 100.6 | 43% | 0.43 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.6 | -36 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | K59 L60 A67 | K59-A63 PolarHBondContact O-N 3.42Å; K59-A63 VanDerWaalsContact O-N 3.13Å; L60-A63 PolarHBondContact O-N 2.92Å; A63-A67 WeakPolarHBondContact O-CB 3.48Å; A63-A67 PolarHBondContact O-N 3.39Å |
| 64 | E | 95.9 | Very high | 96 | Very high | 96 Ų | 96 | 104.1 Ų | 104.1 | 45% | 0.449 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -68.1 | -39 | 173.4 | -162.3 | -167.4 | 148.4 | 0 | 0 | 112.2 | L60 L61 N62 A67 K68 | L60-E64 PolarHBondContact O-N 3.13Å; L61-E64 PolarHBondContact O-N 2.64Å; N62-E64 VanDerWaalsContact C-N 3.3Å; N62-E64 PolarHBondContact O-N 3.5Å; E64-A67 PolarHBondContact O-N 2.83Å; E64-K68 HydrophobicContact CG-CD 4.43Å; E64-K68 WeakPolarHBondContact O-CB 3.3Å; E64-K68 WeakPolarHBondContact O-CG 3.39Å; E64-K68 PolarHBondContact O-N 3.4Å; E64-K68 WeakPolarHBondContact OE1-CE 3.5Å; E64-K68 IonicContact OE1-NZ 2.96Å; E64-K68 PolarHBondContact OE1-NZ 3.16Å |
| 65 | L | 96.1 | Very high | 96.1 | Very high | 87 Ų | 87 | 104.3 Ų | 104.3 | 46% | 0.455 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67.3 | -40.2 | 175.1 | -70.7 | 170.3 | 0 | 0 | 0 | 112.1 | L61 N62 K68 T69 | L61-L65 HydrophobicContact CG-CD1 4.38Å; L61-L65 WeakPolarHBondContact O-CG 3.48Å; L61-L65 PolarHBondContact O-N 3.1Å; N62-L65 PolarHBondContact O-N 2.99Å; L65-K68 PolarHBondContact O-N 3.4Å; L65-T69 VanDerWaalsContact O-CB 3.32Å; L65-T69 WeakPolarHBondContact O-CB 3.4Å; L65-T69 PolarHBondContact O-N 3.02Å; L65-T69 PolarHBondContact O-OG1 2.86Å |
| 66 | E | 94.9 | Very high | 96.1 | Very high | 131 Ų | 131 | 101.2 Ų | 101.2 | 61% | 0.612 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.2 | -41.7 | 173.3 | -75.2 | 175.7 | -165.9 | 0 | 0 | 111.4 | N62 T69 S70 | N62-E66 WeakPolarHBondContact O-CB 3.19Å; N62-E66 WeakPolarHBondContact O-CG 3.36Å; N62-E66 PolarHBondContact O-N 3.04Å; E66-T69 PolarHBondContact O-N 3.48Å; E66-S70 WeakPolarHBondContact O-CB 3.4Å; E66-S70 PolarHBondContact O-N 3.45Å; E66-S70 PolarHBondContact O-OG 3.44Å |
| 67 | A | 96.6 | Very high | 96.1 | Very high | 57 Ų | 57 | 98.4 Ų | 98.4 | 47% | 0.471 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.5 | -45.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A63 E64 T69 S70 E71 | A63-A67 WeakPolarHBondContact O-CB 3.48Å; A63-A67 PolarHBondContact O-N 3.39Å; E64-A67 PolarHBondContact O-N 2.83Å; A67-T69 VanDerWaalsContact C-N 3.34Å; A67-T69 PolarHBondContact O-N 3.18Å; A67-S70 PolarHBondContact O-N 3.48Å; A67-E71 PolarHBondContact O-N 3.3Å |
| 68 | K | 96.8 | Very high | 96 | Very high | 120 Ų | 120 | 95.2 Ų | 95.2 | 52% | 0.522 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.1 | -38.4 | 175 | -77.7 | 169.6 | 171.6 | 170.3 | 0 | 112.6 | E64 L65 E71 L72 | E64-K68 HydrophobicContact CG-CD 4.43Å; E64-K68 WeakPolarHBondContact O-CB 3.3Å; E64-K68 WeakPolarHBondContact O-CG 3.39Å; E64-K68 PolarHBondContact O-N 3.4Å; E64-K68 WeakPolarHBondContact OE1-CE 3.5Å; E64-K68 IonicContact OE1-NZ 2.96Å; E64-K68 PolarHBondContact OE1-NZ 3.16Å; L65-K68 PolarHBondContact O-N 3.4Å; K68-E71 PolarHBondContact O-N 2.85Å; K68-L72 WeakPolarHBondContact O-CB 3.45Å; K68-L72 PolarHBondContact O-N 2.89Å |
| 69 | T | 97 | Very high | 95.9 | Very high | 84 Ų | 84 | 93.4 Ų | 93.4 | 52% | 0.515 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.8 | -43.6 | 175.2 | -57.5 | 0 | 0 | 0 | 0 | 110.9 | L65 E66 A67 E71 L72 V73 | L65-T69 VanDerWaalsContact O-CB 3.32Å; L65-T69 WeakPolarHBondContact O-CB 3.4Å; L65-T69 PolarHBondContact O-N 3.02Å; L65-T69 PolarHBondContact O-OG1 2.86Å; E66-T69 PolarHBondContact O-N 3.48Å; A67-T69 VanDerWaalsContact C-N 3.34Å; A67-T69 PolarHBondContact O-N 3.18Å; T69-E71 PolarHBondContact O-N 3.44Å; T69-L72 PolarHBondContact O-N 3.12Å; T69-V73 WeakPolarHBondContact O-CG2 3.44Å; T69-V73 PolarHBondContact O-N 2.85Å |
| 70 | S | 95.7 | Very high | 95.6 | Very high | 77 Ų | 77 | 91.9 Ų | 91.9 | 54% | 0.538 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.5 | -41.4 | 176.9 | -56.9 | 0 | 0 | 0 | 0 | 112 | E66 A67 V73 R74 | E66-S70 WeakPolarHBondContact O-CB 3.4Å; E66-S70 PolarHBondContact O-N 3.45Å; E66-S70 PolarHBondContact O-OG 3.44Å; A67-S70 PolarHBondContact O-N 3.48Å; S70-V73 PolarHBondContact O-N 3.33Å; S70-R74 WeakPolarHBondContact O-CB 3.26Å; S70-R74 PolarHBondContact O-N 3.05Å |
| 71 | E | 96.8 | Very high | 95.4 | Very high | 74 Ų | 74 | 90.7 Ų | 90.7 | 35% | 0.346 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -67 | -41.2 | 176 | 175.7 | 55.3 | -159.8 | 0 | 0 | 112.2 | A67 K68 T69 V73 R74 Q75 | A67-E71 PolarHBondContact O-N 3.3Å; K68-E71 PolarHBondContact O-N 2.85Å; T69-E71 PolarHBondContact O-N 3.44Å; E71-V73 PolarHBondContact O-N 2.97Å; E71-R74 WeakPolarHBondContact O-CB 2.76Å; E71-R74 PolarHBondContact O-N 3.39Å; E71-R74 IonicContact OE1-CZ 3.46Å; E71-R74 IonicContact OE1-NE 2.63Å; E71-R74 IonicContact OE1-NH2 2.7Å; E71-R74 PolarHBondContact OE1-NH2 3.02Å; E71-R74 IonicContact OE2-CZ 3.33Å; E71-R74 IonicContact OE2-NE 2.66Å; E71-R74 PolarHBondContact OE2-NE 3.14Å; E71-R74 IonicContact OE2-NH2 3.09Å; E71-R74 PolarHBondContact OE2-NH2 3.34Å; E71-Q75 WeakPolarHBondContact O-CG 3.44Å; E71-Q75 PolarHBondContact O-N 3.05Å; E71-Q75 PolarHBondContact OE1-NE2 2.9Å |
| 72 | L | 97 | Very high | 95 | Very high | 116 Ų | 116 | 90.8 Ų | 90.8 | 61% | 0.607 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -63.5 | -40.7 | 174.8 | -177.1 | 63.2 | 0 | 0 | 0 | 111.9 | K68 T69 Q75 A76 | K68-L72 WeakPolarHBondContact O-CB 3.45Å; K68-L72 PolarHBondContact O-N 2.89Å; T69-L72 PolarHBondContact O-N 3.12Å; L72-Q75 PolarHBondContact O-N 3.35Å; L72-A76 WeakPolarHBondContact O-CB 3.41Å; L72-A76 PolarHBondContact O-N 3.19Å |
| 73 | V | 96.8 | Very high | 94.5 | Very high | 77 Ų | 77 | 92.8 Ų | 92.8 | 47% | 0.467 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.5 | -44.3 | 173 | 170.3 | 0 | 0 | 0 | 0 | 110.7 | T69 S70 E71 Q75 A76 E77 | T69-V73 WeakPolarHBondContact O-CG2 3.44Å; T69-V73 PolarHBondContact O-N 2.85Å; S70-V73 PolarHBondContact O-N 3.33Å; E71-V73 PolarHBondContact O-N 2.97Å; V73-Q75 VanDerWaalsContact C-N 3.3Å; V73-Q75 PolarHBondContact O-N 2.91Å; V73-A76 PolarHBondContact O-N 3.27Å; V73-E77 HydrophobicContact CG1-CG 4.41Å; V73-E77 WeakPolarHBondContact O-CG 3.35Å; V73-E77 PolarHBondContact O-N 3.02Å |
| 74 | R | 96.7 | Very high | 93.8 | Very high | 125 Ų | 125 | 93.3 Ų | 93.3 | 47% | 0.472 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -59.3 | -39.6 | 176.4 | -167.9 | -167.7 | 69 | 76.3 | 3.8 | 112.1 | S70 E71 Q78 | S70-R74 WeakPolarHBondContact O-CB 3.26Å; S70-R74 PolarHBondContact O-N 3.05Å; E71-R74 WeakPolarHBondContact O-CB 2.76Å; E71-R74 PolarHBondContact O-N 3.39Å; E71-R74 IonicContact OE1-CZ 3.46Å; E71-R74 IonicContact OE1-NE 2.63Å; E71-R74 IonicContact OE1-NH2 2.7Å; E71-R74 PolarHBondContact OE1-NH2 3.02Å; E71-R74 IonicContact OE2-CZ 3.33Å; E71-R74 IonicContact OE2-NE 2.66Å; E71-R74 PolarHBondContact OE2-NE 3.14Å; E71-R74 IonicContact OE2-NH2 3.09Å; E71-R74 PolarHBondContact OE2-NH2 3.34Å; R74-Q78 VanDerWaalsContact O-CB 3.25Å; R74-Q78 WeakPolarHBondContact O-CB 3.29Å; R74-Q78 PolarHBondContact O-N 3.45Å |
| 75 | Q | 96.1 | Very high | 93.2 | Very high | 91 Ų | 91 | 94.1 Ų | 94.1 | 43% | 0.425 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -68 | -42.9 | 174.9 | -70.8 | 174.9 | 18.2 | 0 | 0 | 112 | E71 L72 V73 Q78 L79 | E71-Q75 WeakPolarHBondContact O-CG 3.44Å; E71-Q75 PolarHBondContact O-N 3.05Å; E71-Q75 PolarHBondContact OE1-NE2 2.9Å; L72-Q75 PolarHBondContact O-N 3.35Å; V73-Q75 VanDerWaalsContact C-N 3.3Å; V73-Q75 PolarHBondContact O-N 2.91Å; Q75-Q78 PolarHBondContact O-N 3.24Å; Q75-L79 WeakPolarHBondContact O-CG 3.39Å; Q75-L79 PolarHBondContact O-N 2.92Å |
| 76 | A | 93.7 | Very high | 92.3 | Very high | 51 Ų | 51 | 95.7 Ų | 95.7 | 42% | 0.421 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64 | -44.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L72 V73 Q78 L79 M80 | L72-A76 WeakPolarHBondContact O-CB 3.41Å; L72-A76 PolarHBondContact O-N 3.19Å; V73-A76 PolarHBondContact O-N 3.27Å; A76-Q78 VanDerWaalsContact C-N 3.28Å; A76-Q78 PolarHBondContact O-N 3.01Å; A76-L79 PolarHBondContact O-N 3.42Å; A76-M80 WeakPolarHBondContact O-CG 3.41Å; A76-M80 PolarHBondContact O-N 2.94Å |
| 77 | E | 94.1 | Very high | 91 | Very high | 84 Ų | 84 | 96.2 Ų | 96.2 | 39% | 0.393 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.5 | -39.6 | 171.3 | -75.8 | -174 | -169 | 0 | 0 | 112.3 | V73 M80 R81 | V73-E77 HydrophobicContact CG1-CG 4.41Å; V73-E77 WeakPolarHBondContact O-CG 3.35Å; V73-E77 PolarHBondContact O-N 3.02Å; E77-M80 PolarHBondContact O-N 3.45Å; E77-R81 WeakPolarHBondContact O-CB 3.49Å; E77-R81 WeakPolarHBondContact O-CG 3.27Å; E77-R81 PolarHBondContact O-N 2.72Å; E77-R81 IonicContact OE2-CZ 3.3Å; E77-R81 IonicContact OE2-NH1 2.58Å; E77-R81 PolarHBondContact OE2-NH1 3.36Å; E77-R81 IonicContact OE2-NH2 3.02Å |
| 78 | Q | 94.3 | Very high | 89.9 | Confident | 67 Ų | 67 | 97.3 Ų | 97.3 | 31% | 0.313 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.7 | -44 | -179 | -175.9 | 57.4 | 24.2 | 0 | 0 | 111.4 | R74 Q75 A76 M80 R81 E82 | R74-Q78 VanDerWaalsContact O-CB 3.25Å; R74-Q78 WeakPolarHBondContact O-CB 3.29Å; R74-Q78 PolarHBondContact O-N 3.45Å; Q75-Q78 PolarHBondContact O-N 3.24Å; A76-Q78 VanDerWaalsContact C-N 3.28Å; A76-Q78 PolarHBondContact O-N 3.01Å; Q78-M80 VanDerWaalsContact C-N 3.33Å; Q78-M80 PolarHBondContact O-N 3.49Å; Q78-R81 WeakPolarHBondContact O-CB 3.44Å; Q78-R81 PolarHBondContact O-N 2.97Å; Q78-R81 VanDerWaalsContact OE1-NE 3.12Å; Q78-E82 VanDerWaalsContact CG-OE1 3.29Å; Q78-E82 WeakPolarHBondContact CG-OE1 3.42Å; Q78-E82 PolarHBondContact NE2-OE1 2.59Å; Q78-E82 WeakPolarHBondContact O-CB 3.38Å; Q78-E82 WeakPolarHBondContact O-CG 3.44Å; Q78-E82 PolarHBondContact O-N 3.49Å |
| 79 | L | 93.4 | Very high | 88 | Confident | 116 Ų | 116 | 100.2 Ų | 100.2 | 61% | 0.607 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.7 | -38 | 173 | -71 | 169.3 | 0 | 0 | 0 | 112.2 | Q75 A76 Q83 | Q75-L79 WeakPolarHBondContact O-CG 3.39Å; Q75-L79 PolarHBondContact O-N 2.92Å; A76-L79 PolarHBondContact O-N 3.42Å; L79-Q83 VanDerWaalsContact O-CB 3.29Å; L79-Q83 WeakPolarHBondContact O-CB 3.34Å; L79-Q83 PolarHBondContact O-N 3.18Å |
| 80 | M | 90.6 | Very high | 85.7 | Confident | 124 Ų | 124 | 100.8 Ų | 100.8 | 61% | 0.611 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -67.4 | -37.8 | 172.9 | -71.2 | -159.8 | -52.2 | 0 | 0 | 112.4 | A76 E77 Q78 S84 | A76-M80 WeakPolarHBondContact O-CG 3.41Å; A76-M80 PolarHBondContact O-N 2.94Å; E77-M80 PolarHBondContact O-N 3.45Å; Q78-M80 VanDerWaalsContact C-N 3.33Å; Q78-M80 PolarHBondContact O-N 3.49Å; M80-S84 VanDerWaalsContact O-CB 3.3Å; M80-S84 WeakPolarHBondContact O-CB 3.46Å; M80-S84 PolarHBondContact O-N 3.39Å; M80-S84 PolarHBondContact O-OG 3.05Å |
| 81 | R | 92 | Very high | 83.4 | Confident | 104 Ų | 104 | 105.9 Ų | 105.9 | 39% | 0.392 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -62.6 | -52 | 174 | -80.8 | -173.9 | -70.5 | -94.1 | -4.7 | 110.7 | E77 Q78 Q83 S84 E85 | E77-R81 WeakPolarHBondContact O-CB 3.49Å; E77-R81 WeakPolarHBondContact O-CG 3.27Å; E77-R81 PolarHBondContact O-N 2.72Å; E77-R81 IonicContact OE2-CZ 3.3Å; E77-R81 IonicContact OE2-NH1 2.58Å; E77-R81 PolarHBondContact OE2-NH1 3.36Å; E77-R81 IonicContact OE2-NH2 3.02Å; Q78-R81 WeakPolarHBondContact O-CB 3.44Å; Q78-R81 PolarHBondContact O-N 2.97Å; Q78-R81 VanDerWaalsContact OE1-NE 3.12Å; R81-Q83 VanDerWaalsContact C-N 3.34Å; R81-Q83 PolarHBondContact O-N 3.01Å; R81-S84 WeakPolarHBondContact CA-OG 3.47Å; R81-S84 CarbonylContact O-C 3.55Å; R81-S84 WeakPolarHBondContact O-CA 3.49Å; R81-S84 PolarHBondContact O-N 3.18Å; R81-S84 PolarHBondContact O-OG 2.9Å; R81-E85 WeakPolarHBondContact O-CB 3.06Å; R81-E85 PolarHBondContact O-N 2.82Å |
| 82 | E | 89 | Confident | 80.6 | Confident | 86 Ų | 86 | 107.4 Ų | 107.4 | 40% | 0.402 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -58.2 | -43.9 | 177.4 | -73.1 | 164.5 | -166.9 | 0 | 0 | 111.8 | Q78 S84 E85 V86 | Q78-E82 VanDerWaalsContact CG-OE1 3.29Å; Q78-E82 WeakPolarHBondContact CG-OE1 3.42Å; Q78-E82 PolarHBondContact NE2-OE1 2.59Å; Q78-E82 WeakPolarHBondContact O-CB 3.38Å; Q78-E82 WeakPolarHBondContact O-CG 3.44Å; Q78-E82 PolarHBondContact O-N 3.49Å; E82-S84 PolarHBondContact O-N 2.87Å; E82-E85 PolarHBondContact O-N 2.94Å; E82-V86 WeakPolarHBondContact O-CG2 3.15Å; E82-V86 PolarHBondContact O-N 3.18Å |
| 83 | Q | 83.9 | Confident | 77.6 | Confident | 130 Ų | 130 | 109.3 Ų | 109.3 | 61% | 0.607 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -62.4 | -41.5 | 173.5 | -171.2 | 179.1 | 30.3 | 0 | 0 | 111.9 | L79 R81 E85 L87 | L79-Q83 VanDerWaalsContact O-CB 3.29Å; L79-Q83 WeakPolarHBondContact O-CB 3.34Å; L79-Q83 PolarHBondContact O-N 3.18Å; R81-Q83 VanDerWaalsContact C-N 3.34Å; R81-Q83 PolarHBondContact O-N 3.01Å; Q83-E85 VanDerWaalsContact C-N 3.34Å; Q83-L87 HydrophobicContact CG-CD1 4.12Å; Q83-L87 WeakPolarHBondContact O-CB 3.26Å; Q83-L87 WeakPolarHBondContact O-CD1 3.41Å; Q83-L87 WeakPolarHBondContact O-CG 3.4Å; Q83-L87 PolarHBondContact O-N 2.92Å; Q83-L87 VanDerWaalsContact O-N 3.08Å |
| 84 | S | 83.2 | Confident | 74.6 | Confident | 62 Ų | 62 | 113.3 Ų | 113.3 | 43% | 0.434 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -69.4 | -30.3 | 177.3 | 75.9 | 0 | 0 | 0 | 0 | 113.1 | M80 R81 E82 L87 S88 | M80-S84 VanDerWaalsContact O-CB 3.3Å; M80-S84 WeakPolarHBondContact O-CB 3.46Å; M80-S84 PolarHBondContact O-N 3.39Å; M80-S84 PolarHBondContact O-OG 3.05Å; R81-S84 WeakPolarHBondContact CA-OG 3.47Å; R81-S84 CarbonylContact O-C 3.55Å; R81-S84 WeakPolarHBondContact O-CA 3.49Å; R81-S84 PolarHBondContact O-N 3.18Å; R81-S84 PolarHBondContact O-OG 2.9Å; E82-S84 PolarHBondContact O-N 2.87Å; S84-L87 CarbonylContact O-C 3.51Å; S84-L87 PolarHBondContact O-N 3.08Å; S84-S88 VanDerWaalsContact O-CB 3.23Å; S84-S88 WeakPolarHBondContact O-CB 3.21Å; S84-S88 PolarHBondContact O-N 3.26Å; S84-S88 PolarHBondContact O-OG 3.09Å |
| 85 | E | 82.6 | Confident | 71.3 | Confident | 113 Ų | 113 | 116.2 Ų | 116.2 | 53% | 0.528 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -73.8 | -45.1 | 177.9 | -170.5 | 166.2 | -168.5 | 0 | 0 | 110.6 | R81 E82 Q83 L87 S88 Y89 | R81-E85 WeakPolarHBondContact O-CB 3.06Å; R81-E85 PolarHBondContact O-N 2.82Å; E82-E85 PolarHBondContact O-N 2.94Å; Q83-E85 VanDerWaalsContact C-N 3.34Å; E85-L87 PolarHBondContact O-N 3.33Å; E85-S88 WeakPolarHBondContact CA-OG 3.33Å; E85-S88 PolarHBondContact O-N 3.29Å; E85-S88 VanDerWaalsContact O-N 3.09Å; E85-Y89 PolarHBondContact O-N 2.95Å |
| 86 | V | 76.7 | Confident | 68.4 | Low | 121 Ų | 121 | 117.9 Ų | 117.9 | 73% | 0.733 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -59.1 | -32 | 169.7 | 171.2 | 0 | 0 | 0 | 0 | 112.2 | E82 | E82-V86 WeakPolarHBondContact O-CG2 3.15Å; E82-V86 PolarHBondContact O-N 3.18Å |
| 87 | L | 69 | Low | 65.6 | Low | 141 Ų | 141 | 120.9 Ų | 120.9 | 74% | 0.738 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.7 | -11 | 176.6 | -70.9 | 172 | 0 | 0 | 0 | 114.7 | Q83 S84 E85 | Q83-L87 HydrophobicContact CG-CD1 4.12Å; Q83-L87 WeakPolarHBondContact O-CB 3.26Å; Q83-L87 WeakPolarHBondContact O-CD1 3.41Å; Q83-L87 WeakPolarHBondContact O-CG 3.4Å; Q83-L87 PolarHBondContact O-N 2.92Å; Q83-L87 VanDerWaalsContact O-N 3.08Å; S84-L87 CarbonylContact O-C 3.51Å; S84-L87 PolarHBondContact O-N 3.08Å; E85-L87 PolarHBondContact O-N 3.33Å |
| 88 | S | 72.7 | Confident | 63.1 | Low | 81 Ų | 81 | 125.7 Ų | 125.7 | 57% | 0.566 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.3 | -5.9 | -178.3 | 58.3 | 0 | 0 | 0 | 0 | 114.4 | S84 E85 P90 | S84-S88 VanDerWaalsContact O-CB 3.23Å; S84-S88 WeakPolarHBondContact O-CB 3.21Å; S84-S88 PolarHBondContact O-N 3.26Å; S84-S88 PolarHBondContact O-OG 3.09Å; E85-S88 WeakPolarHBondContact CA-OG 3.33Å; E85-S88 PolarHBondContact O-N 3.29Å; E85-S88 VanDerWaalsContact O-N 3.09Å; S88-P90 WeakPolarHBondContact O-CD 3.39Å |
| 89 | Y | 56.6 | Low | 60.3 | Low | 181 Ų | 181 | 129.2 Ų | 129.2 | 71% | 0.71 | 68% | 0.678 | S | S | * | * | trans | -58.3 | 115.8 | 171.9 | -133 | -83.8 | 0 | 0 | 0 | 110.7 | E85 L91 | E85-Y89 PolarHBondContact O-N 2.95Å; Y89-L91 PolarHBondContact O-N 3.09Å | ||
| 90 | P | 49.5 | Very low | 57.8 | Low | 96 Ų | 96 | 133 Ų | 133 | 62% | 0.623 | 69% | 0.693 | S | S | * | * | trans | -70.4 | 133.9 | -179.8 | -17.9 | 32.6 | 0 | 0 | 0 | 110.5 | S88 S92 | S88-P90 WeakPolarHBondContact O-CD 3.39Å; P90-S92 PolarHBondContact O-N 2.71Å | ||
| 91 | L | 47.6 | Very low | 55.1 | Low | 183 Ų | 183 | 131 Ų | 131 | 96% | 0.958 | 70% | 0.704 | S | S | * | * | trans | -79 | 70.6 | 179.8 | -152.2 | 82.6 | 0 | 0 | 0 | 111.6 | Y89 | Y89-L91 PolarHBondContact O-N 3.09Š| ||
| 92 | S | 37.5 | Very low | 52.4 | Low | 106 Ų | 106 | 129.9 Ų | 129.9 | 74% | 0.741 | 73% | 0.725 | S | S | * | * | trans | -156.4 | 133.2 | 177.7 | -74 | 0 | 0 | 0 | 0 | 108.8 | P90 | P90-S92 PolarHBondContact O-N 2.71Š| ||
| 93 | N | 33.6 | Very low | 49.9 | Very low | 157 Ų | 157 | 134.1 Ų | 134.1 | 84% | 0.84 | 75% | 0.751 | S | S | * | * | cis | -157.3 | -174.9 | -1.8 | -170.5 | 27.6 | 0 | 0 | 0 | 109 | ||||
| 94 | E | 34.4 | Very low | 47.6 | Very low | 161 Ų | 161 | 130.1 Ų | 130.1 | 75% | 0.752 | 75% | 0.745 | S | S | * | * | trans | 80.7 | 84.9 | 155.5 | -160.9 | 164.7 | -108.3 | 0 | 0 | 118.3 | ||||
| 95 | F | 27.8 | Very low | 45.2 | Very low | 186 Ų | 186 | 135.8 Ų | 135.8 | 82% | 0.816 | 76% | 0.762 | S | S | * | * | -141.6 | 98.4 | 129.3 | -165.2 | -100.4 | 0 | 0 | 0 | 110.7 | V97 | F95-V97 HydrophobicContact CD1-CG2 4.28Å; F95-V97 HydrophobicContact CE1-CB 4.13Å; F95-V97 HydrophobicContact CE1-CG2 3.44Å; F95-V97 VanDerWaalsContact CE1-CG2 3.44Å; F95-V97 HydrophobicContact CZ-CG2 3.77Å | |||
| 96 | T | 34.4 | Very low | 43.2 | Very low | 126 Ų | 126 | 139.6 Ų | 139.6 | 77% | 0.773 | 77% | 0.771 | S | S | * | * | trans | -90.3 | 108.3 | 174.5 | 47.1 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 97 | V | 35.4 | Very low | 41.1 | Very low | 113 Ų | 113 | 141 Ų | 141 | 69% | 0.685 | 78% | 0.775 | S | S | * | * | trans | -130.7 | 130.2 | 153 | 172.5 | 0 | 0 | 0 | 0 | 107.1 | F95 | F95-V97 HydrophobicContact CD1-CG2 4.28Å; F95-V97 HydrophobicContact CE1-CB 4.13Å; F95-V97 HydrophobicContact CE1-CG2 3.44Å; F95-V97 VanDerWaalsContact CE1-CG2 3.44Å; F95-V97 HydrophobicContact CZ-CG2 3.77Å | ||
| 98 | E | 41.3 | Very low | 39.6 | Very low | 185 Ų | 185 | 138.5 Ų | 138.5 | 86% | 0.864 | 77% | 0.769 | S | S | * | * | trans | -78.9 | 136.9 | -172.4 | -59.5 | 179 | 142.9 | 0 | 0 | 112.3 | ||||
| 99 | T | 35.8 | Very low | 37.9 | Very low | 141 Ų | 141 | 143.6 Ų | 143.6 | 87% | 0.865 | 78% | 0.781 | S | S | * | * | trans | -155.5 | 132.2 | 148.2 | -64 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 100 | E | 40.6 | Very low | 36.9 | Very low | 196 Ų | 196 | 140.3 Ų | 140.3 | 92% | 0.916 | 78% | 0.784 | S | S | * | * | trans | -80.6 | 164.8 | -171.4 | -54.5 | 178.8 | 110.7 | 0 | 0 | 113.4 | ||||
| 101 | G | 33.8 | Very low | 36.1 | Very low | 81 Ų | 81 | 144 Ų | 144 | 84% | 0.835 | 79% | 0.794 | S | S | * | * | trans | 155.5 | 33.2 | 157.6 | 0 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 102 | G | 36 | Very low | 35.9 | Very low | 82 Ų | 82 | 141 Ų | 141 | 85% | 0.845 | 78% | 0.784 | S | S | * | * | trans | 74.5 | 166.6 | 164.6 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 103 | D | 35.5 | Very low | 35.8 | Very low | 174 Ų | 174 | 146 Ų | 146 | 93% | 0.93 | 79% | 0.793 | S | S | * | * | cis | -148.3 | -177.1 | -6.9 | -165.3 | 10.6 | 0 | 0 | 0 | 110.7 | ||||
| 104 | G | 34.8 | Very low | 35.7 | Very low | 47 Ų | 47 | 143.2 Ų | 143.2 | 49% | 0.485 | 79% | 0.792 | S | S | . | * | trans | -45.2 | 152 | -162.7 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 105 | F | 34.6 | Very low | 35.6 | Very low | 180 Ų | 180 | 140.3 Ų | 140.3 | 79% | 0.789 | 80% | 0.796 | S | S | * | * | 56.1 | 130.2 | 69 | -75.7 | -48.8 | 0 | 0 | 0 | 112.9 | |||||
| 106 | R | 39.3 | Very low | 35.9 | Very low | 193 Ų | 193 | 140.7 Ų | 140.7 | 73% | 0.728 | 80% | 0.8 | S | S | * | * | cis | -151.9 | 178.1 | 5.6 | -88.3 | 147.3 | -159.7 | 175.3 | 9.9 | 107.2 | ||||
| 107 | N | 33.4 | Very low | 35.9 | Very low | 151 Ų | 151 | 141.8 Ų | 141.8 | 81% | 0.807 | 80% | 0.801 | S | S | * | * | cis | -151.6 | -156.7 | 18.4 | -153.7 | -22.1 | 0 | 0 | 0 | 111.8 | ||||
| 108 | S | 36.9 | Very low | 36.1 | Very low | 88 Ų | 88 | 142.1 Ų | 142.1 | 62% | 0.615 | 81% | 0.805 | S | S | * | * | trans | -126.9 | 154.1 | -173.8 | 56.4 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 109 | K | 37.2 | Very low | 35.5 | Very low | 188 Ų | 188 | 136.3 Ų | 136.3 | 82% | 0.817 | 80% | 0.796 | S | S | * | * | 163.9 | 128.3 | 123.1 | -95.5 | 178.5 | 173.1 | 176.5 | 0 | 116.9 | |||||
| 110 | S | 35.7 | Very low | 35.5 | Very low | 112 Ų | 112 | 138.5 Ų | 138.5 | 78% | 0.783 | 80% | 0.798 | S | S | * | * | trans | 64.2 | 159.2 | 143.2 | 74.2 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 111 | Q | 33.3 | Very low | 35.2 | Very low | 175 Ų | 175 | 138.8 Ų | 138.8 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | cis | -135 | 161.6 | 6.9 | -89.5 | -166.5 | -38.8 | 0 | 0 | 112 | ||||
| 112 | P | 43 | Very low | 35.2 | Very low | 118 Ų | 118 | 141.4 Ų | 141.4 | 77% | 0.766 | 80% | 0.796 | S | S | * | * | trans | -82.9 | 163.6 | 167.1 | 36.2 | -35.4 | 0 | 0 | 0 | 112.9 | ||||
| 113 | K | 35 | Very low | 35 | Very low | 211 Ų | 211 | 143.2 Ų | 143.2 | 92% | 0.917 | 80% | 0.795 | S | S | * | * | trans | -128.5 | 142.4 | 163.7 | -81.1 | -176.1 | 175.3 | 177 | 0 | 110.6 | ||||
| 114 | A | 31.6 | Very low | 35 | Very low | 100 Ų | 100 | 144.1 Ų | 144.1 | 83% | 0.826 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -84.4 | 143.9 | -173.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 115 | A | 31.5 | Very low | 34.9 | Very low | 100 Ų | 100 | 151.8 Ų | 151.8 | 83% | 0.826 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 146.5 | 156.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||
| 116 | Q | 34.8 | Very low | 34.6 | Very low | 194 Ų | 194 | 154.1 Ų | 154.1 | 91% | 0.907 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -97.5 | 135.9 | 167.9 | -70.4 | -171.6 | -1 | 0 | 0 | 109.8 | ||
| 117 | D | 34.2 | Very low | 34.2 | Very low | 149 Ų | 149 | 151 Ų | 151 | 80% | 0.797 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -96.9 | 122.3 | -178.8 | -174.3 | 26.5 | 0 | 0 | 0 | 110.3 | G119 | D117-G119 VanDerWaalsContact C-N 3.26Å; D117-G119 PolarHBondContact O-N 2.72Å |
| 118 | P | 39.2 | Very low | 34.2 | Very low | 119 Ų | 119 | 150 Ų | 150 | 77% | 0.773 | 82% | 0.816 | S | S | * | * | trans | -79 | 67.2 | -174.4 | 32.6 | -36.5 | 0 | 0 | 0 | 112.7 | M120 | P118-M120 PolarHBondContact O-N 3.1Š| ||
| 119 | G | 29.8 | Very low | 33.9 | Very low | 64 Ų | 64 | 150.1 Ų | 150.1 | 66% | 0.66 | 82% | 0.817 | S | S | * | * | trans | -63.8 | 103.9 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | D117 K121 | D117-G119 VanDerWaalsContact C-N 3.26Å; D117-G119 PolarHBondContact O-N 2.72Å; G119-K121 PolarHBondContact O-N 2.97Å | ||
| 120 | M | 35.8 | Very low | 33.5 | Very low | 187 Ų | 187 | 146.7 Ų | 146.7 | 92% | 0.921 | 81% | 0.812 | S | S | * | * | trans | -55.9 | 124.1 | 171.4 | -77.5 | -174 | 154.8 | 0 | 0 | 112.4 | P118 | P118-M120 PolarHBondContact O-N 3.1Š| ||
| 121 | K | 33 | Very low | 33.3 | Very low | 202 Ų | 202 | 146.3 Ų | 146.3 | 88% | 0.878 | 81% | 0.805 | S | S | * | * | trans | -136 | 133.7 | 160.8 | -72.3 | -169.2 | 177 | 176.1 | 0 | 112.1 | G119 | G119-K121 PolarHBondContact O-N 2.97Š| ||
| 122 | V | 33.5 | Very low | 33.4 | Very low | 135 Ų | 135 | 146.8 Ų | 146.8 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | trans | -95.3 | 129.9 | -174.8 | 175.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 123 | S | 32.5 | Very low | 33 | Very low | 120 Ų | 120 | 145.3 Ų | 145.3 | 84% | 0.839 | 80% | 0.8 | S | S | * | * | trans | -131.2 | 125.1 | 175.4 | -66.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 124 | K | 35.8 | Very low | 32.8 | Very low | 194 Ų | 194 | 144.5 Ų | 144.5 | 84% | 0.843 | 80% | 0.797 | S | S | * | * | trans | -99.3 | 127.8 | 179.2 | -68.8 | 176.4 | 178.2 | 174.1 | 0 | 111.9 | ||||
| 125 | K | 32.7 | Very low | 32.8 | Very low | 208 Ų | 208 | 148.1 Ų | 148.1 | 90% | 0.904 | 80% | 0.796 | S | S | * | * | trans | 156.4 | 161.2 | 151.3 | -90.7 | 160.5 | -176.4 | 179.9 | 0 | 109.2 | ||||
| 126 | R | 28 | Very low | 32.8 | Very low | 228 Ų | 228 | 148.5 Ų | 148.5 | 86% | 0.86 | 80% | 0.799 | S | S | * | * | cis | -170.1 | 129.1 | -33.3 | 173 | 179.5 | -179.4 | -179.8 | 1.7 | 106.8 | ||||
| 127 | V | 31.4 | Very low | 32.6 | Very low | 127 Ų | 127 | 142.8 Ų | 142.8 | 77% | 0.77 | 79% | 0.793 | S | S | * | * | trans | -12.9 | 126.7 | 166.9 | -176.6 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 128 | T | 32.4 | Very low | 32.6 | Very low | 130 Ų | 130 | 144.4 Ų | 144.4 | 80% | 0.798 | 79% | 0.793 | S | S | * | * | trans | -177.4 | 138.5 | 131.4 | 31.8 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 129 | S | 31.1 | Very low | 32.3 | Very low | 92 Ų | 92 | 145.6 Ų | 145.6 | 64% | 0.643 | 79% | 0.788 | S | S | * | * | cis | 146.1 | 162.3 | -6.7 | 52.3 | 0 | 0 | 0 | 0 | 107 | ||||
| 130 | T | 28.2 | Very low | 32.2 | Very low | 116 Ų | 116 | 148.7 Ų | 148.7 | 71% | 0.712 | 79% | 0.785 | S | S | * | * | trans | 99.3 | 96.9 | 153.2 | -49.2 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 131 | T | 31.9 | Very low | 32.1 | Very low | 104 Ų | 104 | 148.4 Ų | 148.4 | 64% | 0.638 | 78% | 0.779 | S | S | * | * | trans | 65.5 | 124.5 | 140.8 | 58.5 | 0 | 0 | 0 | 0 | 125.4 | ||||
| 132 | Q | 35.8 | Very low | 32.1 | Very low | 184 Ų | 184 | 148.4 Ų | 148.4 | 86% | 0.86 | 78% | 0.779 | S | S | * | * | 67 | 154.9 | 129 | -59.9 | 175.6 | 29.1 | 0 | 0 | 118.4 | |||||
| 133 | S | 33.5 | Very low | 32.6 | Very low | 88 Ų | 88 | 146.8 Ų | 146.8 | 62% | 0.615 | 77% | 0.771 | S | S | * | * | cis | -133.5 | 173.1 | 17.1 | -173.7 | 0 | 0 | 0 | 0 | 113.7 | H135 | S133-H135 PolarHBondContact OG-NE2 3.05Å; S133-H135 VanDerWaalsContact OG-NE2 3.12Å | ||
| 134 | K | 31.8 | Very low | 32.5 | Very low | 194 Ų | 194 | 149.7 Ų | 149.7 | 84% | 0.843 | 77% | 0.771 | S | S | * | * | trans | -107.8 | 124.8 | 171 | -62.6 | 174.8 | -179.9 | 177 | 0 | 110.4 | ||||
| 135 | H | 32.4 | Very low | 32.2 | Very low | 175 Ų | 175 | 147.7 Ų | 147.7 | 81% | 0.81 | 77% | 0.769 | S | S | * | * | trans | -139.2 | 143.2 | 160.2 | -61.7 | -71.5 | 0 | 0 | 0 | 110.2 | S133 | S133-H135 PolarHBondContact OG-NE2 3.05Å; S133-H135 VanDerWaalsContact OG-NE2 3.12Å | ||
| 136 | A | 31.4 | Very low | 32 | Very low | 108 Ų | 108 | 147 Ų | 147 | 89% | 0.893 | 77% | 0.766 | S | S | * | * | trans | -150.9 | 143 | -175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 137 | G | 29.3 | Very low | 32.2 | Very low | 75 Ų | 75 | 142.4 Ų | 142.4 | 77% | 0.773 | 76% | 0.764 | S | S | * | * | trans | 86.9 | 154 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 138 | K | 35.9 | Very low | 32.1 | Very low | 182 Ų | 182 | 141.3 Ų | 141.3 | 79% | 0.791 | 77% | 0.768 | S | S | * | * | cis | -164.5 | 142.2 | -1.3 | -131.3 | -177.5 | 178.1 | -168.9 | 0 | 110.6 | ||||
| 139 | Q | 32.6 | Very low | 32 | Very low | 145 Ų | 145 | 140.9 Ų | 140.9 | 68% | 0.678 | 77% | 0.765 | S | S | * | * | trans | 65.5 | 159.8 | 161.4 | -69.4 | 167.2 | -98.7 | 0 | 0 | 115.5 | ||||
| 140 | E | 27.6 | Very low | 32.1 | Very low | 129 Ų | 129 | 141.3 Ų | 141.3 | 60% | 0.603 | 77% | 0.768 | S | S | * | * | cis | -153.7 | 174.1 | 7.5 | -143.8 | 170.9 | -126.5 | 0 | 0 | 114 | ||||
| 141 | K | 33.8 | Very low | 32.3 | Very low | 181 Ų | 181 | 144.7 Ų | 144.7 | 79% | 0.787 | 77% | 0.773 | S | S | * | * | trans | 81.1 | 119.7 | 157.4 | -69.5 | 172.7 | 174.2 | 92.7 | 0 | 120.7 | ||||
| 142 | K | 31.6 | Very low | 32.3 | Very low | 202 Ų | 202 | 145.7 Ų | 145.7 | 88% | 0.878 | 77% | 0.774 | S | S | * | * | trans | -78.4 | -175.9 | 162.9 | -98.1 | -178.4 | 178.1 | -179.2 | 0 | 110.9 | ||||
| 143 | P | 44.2 | Very low | 32.7 | Very low | 101 Ų | 101 | 141.6 Ų | 141.6 | 66% | 0.656 | 77% | 0.766 | S | S | * | * | cis | -138.2 | 175.7 | -31.1 | 37.1 | -20.5 | 0 | 0 | 0 | 113.8 | ||||
| 144 | Q | 30.4 | Very low | 33.1 | Very low | 180 Ų | 180 | 148.9 Ų | 148.9 | 84% | 0.841 | 78% | 0.78 | S | S | * | * | trans | 163.3 | 116.6 | 137.6 | -90.6 | 165.2 | 64.6 | 0 | 0 | 107.2 | ||||
| 145 | L | 29.3 | Very low | 33.6 | Very low | 152 Ų | 152 | 146.2 Ų | 146.2 | 80% | 0.796 | 78% | 0.775 | S | S | * | * | 71.9 | 94.8 | 53.9 | -164.3 | 90.7 | 0 | 0 | 0 | 114.1 | |||||
| 146 | K | 29.8 | Very low | 34.2 | Very low | 193 Ų | 193 | 144.6 Ų | 144.6 | 84% | 0.839 | 77% | 0.773 | S | S | * | * | -175.2 | 128.9 | 115.1 | -98.5 | 165 | -173.1 | 179.5 | 0 | 111.9 | |||||
| 147 | T | 31.8 | Very low | 35.1 | Very low | 133 Ų | 133 | 147.2 Ų | 147.2 | 82% | 0.816 | 77% | 0.766 | S | S | * | * | trans | -82 | 140.2 | 161.6 | -43.2 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 148 | A | 28.7 | Very low | 36.3 | Very low | 103 Ų | 103 | 146.9 Ų | 146.9 | 85% | 0.851 | 76% | 0.757 | S | S | * | * | trans | -142.7 | 128 | 166 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 149 | T | 31.5 | Very low | 37.2 | Very low | 122 Ų | 122 | 144.2 Ų | 144.2 | 75% | 0.748 | 75% | 0.749 | S | S | * | * | trans | -130.4 | 156.6 | -177.8 | -40.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 150 | S | 31.6 | Very low | 38.1 | Very low | 101 Ų | 101 | 143 Ų | 143 | 71% | 0.706 | 75% | 0.747 | S | S | * | * | trans | 83.3 | 131.9 | 165.5 | 84.3 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 151 | K | 33.3 | Very low | 39.7 | Very low | 187 Ų | 187 | 141.4 Ų | 141.4 | 81% | 0.813 | 74% | 0.743 | S | S | * | * | 55.8 | 147 | 121.6 | -74.8 | -163.2 | 169.7 | -162.2 | 0 | 120.7 | |||||
| 152 | D | 32.8 | Very low | 41.2 | Very low | 124 Ų | 124 | 140.7 Ų | 140.7 | 66% | 0.663 | 74% | 0.74 | S | S | * | * | cis | -167.3 | 172.1 | -17.3 | -147.9 | -27.3 | 0 | 0 | 0 | 108.3 | ||||
| 153 | S | 43.1 | Very low | 43.1 | Very low | 99 Ų | 99 | 133.9 Ų | 133.9 | 69% | 0.692 | 72% | 0.721 | S | S | * | * | trans | 38.9 | 94.8 | 153.3 | 66.3 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 154 | R | 42.3 | Very low | 44.2 | Very low | 240 Ų | 240 | 133.3 Ų | 133.3 | 91% | 0.906 | 71% | 0.712 | S | S | * | * | trans | -154.9 | 99.2 | 152.8 | -76.8 | -163.5 | 178 | 161.7 | -0.6 | 111.6 | ||||
| 155 | D | 42.3 | Very low | 46.2 | Very low | 138 Ų | 138 | 130.6 Ų | 130.6 | 74% | 0.738 | 70% | 0.702 | S | S | * | * | trans | -154 | -26.6 | 165.5 | -98.5 | -44.5 | 0 | 0 | 0 | 114.3 | E157 A158 | D155-E157 VanDerWaalsContact C-N 3.29Å; D155-E157 PolarHBondContact O-N 3.45Å; D155-E157 VanDerWaalsContact O-N 3.17Å; D155-A158 PolarHBondContact O-N 2.86Å | ||
| 156 | D | 45.3 | Very low | 48.5 | Very low | 141 Ų | 141 | 130.7 Ų | 130.7 | 75% | 0.754 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | -28.3 | -172.9 | -61.4 | -56.8 | 0 | 0 | 0 | 115.3 | A158 I159 | D156-A158 VanDerWaalsContact C-N 3.29Å; D156-A158 PolarHBondContact O-N 3.01Å; D156-I159 PolarHBondContact O-N 2.92Å |
| 157 | E | 49.3 | Very low | 50.7 | Low | 163 Ų | 163 | 126.6 Ų | 126.6 | 76% | 0.762 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -75.4 | -15 | -174.6 | -162.7 | 161.7 | -153.4 | 0 | 0 | 113.6 | D155 N161 | D155-E157 VanDerWaalsContact C-N 3.29Å; D155-E157 PolarHBondContact O-N 3.45Å; D155-E157 VanDerWaalsContact O-N 3.17Å; E157-N161 PolarHBondContact O-ND2 2.93Å |
| 158 | A | 55.4 | Low | 52.8 | Low | 69 Ų | 69 | 122.8 Ų | 122.8 | 57% | 0.57 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -75.8 | -21.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | D155 D156 | D155-A158 PolarHBondContact O-N 2.86Å; D156-A158 VanDerWaalsContact C-N 3.29Å; D156-A158 PolarHBondContact O-N 3.01Å |
| 159 | I | 55 | Low | 55 | Low | 125 Ų | 125 | 125.5 Ų | 125.5 | 64% | 0.641 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -83 | -42.3 | -171.6 | -59.4 | -180 | 0 | 0 | 0 | 111.5 | D156 N161 K162 | D156-I159 PolarHBondContact O-N 2.92Å; I159-N161 PolarHBondContact O-N 3.32Å; I159-K162 PolarHBondContact O-N 3.31Å |
| 160 | L | 51 | Low | 57.1 | Low | 119 Ų | 119 | 123.4 Ų | 123.4 | 62% | 0.623 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -54 | -52.9 | 178.4 | -93.2 | 161.1 | 0 | 0 | 0 | 112.3 | K162 A163 D164 | L160-K162 PolarHBondContact O-N 2.96Å; L160-A163 WeakPolarHBondContact O-CB 3.46Å; L160-A163 PolarHBondContact O-N 3.34Å; L160-D164 PolarHBondContact O-N 2.94Å |
| 161 | N | 62.1 | Low | 59 | Low | 96 Ų | 96 | 123.2 Ų | 123.2 | 51% | 0.513 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -51.6 | -31.3 | 179.7 | -77.5 | -77.5 | 0 | 0 | 0 | 113.7 | E157 I159 I165 | E157-N161 PolarHBondContact O-ND2 2.93Å; I159-N161 PolarHBondContact O-N 3.32Å; N161-I165 WeakPolarHBondContact O-CD1 3.47Å; N161-I165 VanDerWaalsContact O-CG1 3.24Å; N161-I165 WeakPolarHBondContact O-CG1 3.37Å; N161-I165 PolarHBondContact O-N 3.38Å |
| 162 | K | 65.3 | Low | 60.7 | Low | 167 Ų | 167 | 120 Ų | 120 | 73% | 0.726 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -78.7 | -26 | -179 | -162.5 | 175.4 | -177.9 | -178.5 | 0 | 113.1 | I159 L160 | I159-K162 PolarHBondContact O-N 3.31Å; L160-K162 PolarHBondContact O-N 2.96Å |
| 163 | A | 70.2 | Confident | 62.3 | Low | 59 Ų | 59 | 116.1 Ų | 116.1 | 49% | 0.488 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -74.8 | -45.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111 | L160 I165 F166 L167 | L160-A163 WeakPolarHBondContact O-CB 3.46Å; L160-A163 PolarHBondContact O-N 3.34Å; A163-I165 VanDerWaalsContact C-N 3.34Å; A163-I165 PolarHBondContact O-N 3.07Å; A163-F166 WeakPolarHBondContact O-CA 3.45Å; A163-F166 WeakPolarHBondContact O-CB 3.31Å; A163-F166 PolarHBondContact O-N 3.47Å; A163-L167 PolarHBondContact O-N 3.49Å |
| 164 | D | 68 | Low | 63.3 | Low | 88 Ų | 88 | 117.4 Ų | 117.4 | 47% | 0.471 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -61.3 | -40.4 | -179.2 | -64 | -35.1 | 0 | 0 | 0 | 112.4 | L160 F166 L167 A168 | L160-D164 PolarHBondContact O-N 2.94Å; D164-F166 VanDerWaalsContact C-N 3.25Å; D164-F166 PolarHBondContact O-N 2.95Å; D164-L167 PolarHBondContact O-N 3.3Å; D164-A168 WeakPolarHBondContact O-CB 3.36Å; D164-A168 PolarHBondContact O-N 2.87Å |
| 165 | I | 72 | Confident | 63.6 | Low | 123 Ų | 123 | 113 Ų | 113 | 63% | 0.631 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -60.9 | -33.9 | 174 | -70.5 | 167 | 0 | 0 | 0 | 111.9 | N161 A163 K169 | N161-I165 WeakPolarHBondContact O-CD1 3.47Å; N161-I165 VanDerWaalsContact O-CG1 3.24Å; N161-I165 WeakPolarHBondContact O-CG1 3.37Å; N161-I165 PolarHBondContact O-N 3.38Å; A163-I165 VanDerWaalsContact C-N 3.34Å; A163-I165 PolarHBondContact O-N 3.07Å; I165-K169 WeakPolarHBondContact O-CB 3.22Å; I165-K169 PolarHBondContact O-N 3.44Å |
| 166 | F | 77.4 | Confident | 64.1 | Low | 155 Ų | 155 | 114.9 Ų | 114.9 | 68% | 0.68 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -75.4 | -44 | 178.1 | -133.3 | -83.2 | 0 | 0 | 0 | 111.3 | A163 D164 K169 T170 | A163-F166 WeakPolarHBondContact O-CA 3.45Å; A163-F166 WeakPolarHBondContact O-CB 3.31Å; A163-F166 PolarHBondContact O-N 3.47Å; D164-F166 VanDerWaalsContact C-N 3.25Å; D164-F166 PolarHBondContact O-N 2.95Å; F166-K169 PolarHBondContact O-N 2.97Å; F166-T170 PolarHBondContact O-N 3.07Å; F166-T170 PolarHBondContact O-OG1 3.37Å |
| 167 | L | 76.9 | Confident | 64.4 | Low | 106 Ų | 106 | 114.6 Ų | 114.6 | 56% | 0.555 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -60.7 | -47.2 | 177 | -178.6 | 60.1 | 0 | 0 | 0 | 111.6 | A163 D164 K169 T170 I171 | A163-L167 PolarHBondContact O-N 3.49Å; D164-L167 PolarHBondContact O-N 3.3Å; L167-K169 VanDerWaalsContact C-N 3.26Å; L167-K169 PolarHBondContact O-N 2.9Å; L167-T170 PolarHBondContact O-N 3.39Å; L167-I171 HydrophobicContact CD1-CD1 4.19Å; L167-I171 HydrophobicContact CG-CD1 4.01Å; L167-I171 WeakPolarHBondContact O-CG1 3.48Å; L167-I171 PolarHBondContact O-N 2.93Å |
| 168 | A | 74.2 | Confident | 63.9 | Low | 53 Ų | 53 | 114.1 Ų | 114.1 | 44% | 0.438 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -58.9 | -37 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | D164 L172 | D164-A168 WeakPolarHBondContact O-CB 3.36Å; D164-A168 PolarHBondContact O-N 2.87Å; A168-L172 PolarHBondContact O-N 3.21Å; A168-L172 VanDerWaalsContact O-N 3.17Å |
| 169 | K | 76.3 | Confident | 63.3 | Low | 161 Ų | 161 | 116.2 Ų | 116.2 | 70% | 0.7 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -71.9 | -35.8 | 178.2 | -169.1 | 169 | -176.5 | 175.3 | 0 | 112.9 | I165 F166 L167 G173 | I165-K169 WeakPolarHBondContact O-CB 3.22Å; I165-K169 PolarHBondContact O-N 3.44Å; F166-K169 PolarHBondContact O-N 2.97Å; L167-K169 VanDerWaalsContact C-N 3.26Å; L167-K169 PolarHBondContact O-N 2.9Å; K169-G173 PolarHBondContact O-N 3.41Å |
| 170 | T | 75.2 | Confident | 62.6 | Low | 78 Ų | 78 | 114.3 Ų | 114.3 | 48% | 0.479 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -69.1 | -38.1 | 173.5 | -63.5 | 0 | 0 | 0 | 0 | 112 | F166 L167 G173 L174 | F166-T170 PolarHBondContact O-N 3.07Å; F166-T170 PolarHBondContact O-OG1 3.37Å; L167-T170 PolarHBondContact O-N 3.39Å; T170-G173 PolarHBondContact O-N 3.33Å; T170-L174 HydrophobicContact CG2-CD1 4.3Å; T170-L174 PolarHBondContact O-N 3.03Å |
| 171 | I | 71 | Confident | 62.1 | Low | 97 Ų | 97 | 116.3 Ų | 116.3 | 50% | 0.497 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -63 | -46.3 | 177 | -69.1 | 165.8 | 0 | 0 | 0 | 111 | L167 G173 L174 Q175 | L167-I171 HydrophobicContact CD1-CD1 4.19Å; L167-I171 HydrophobicContact CG-CD1 4.01Å; L167-I171 WeakPolarHBondContact O-CG1 3.48Å; L167-I171 PolarHBondContact O-N 2.93Å; I171-G173 VanDerWaalsContact C-N 3.32Å; I171-G173 PolarHBondContact O-N 2.82Å; I171-L174 PolarHBondContact O-N 2.87Å; I171-L174 VanDerWaalsContact O-N 3.15Å; I171-Q175 PolarHBondContact O-N 3.09Å |
| 172 | L | 69.7 | Low | 61 | Low | 118 Ų | 118 | 119.7 Ų | 119.7 | 62% | 0.618 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -59.5 | -40.6 | 175.9 | -78.1 | 166.2 | 0 | 0 | 0 | 112.6 | A168 L174 Q175 | A168-L172 PolarHBondContact O-N 3.21Å; A168-L172 VanDerWaalsContact O-N 3.17Å; L172-L174 PolarHBondContact O-N 3.46Å; L172-Q175 PolarHBondContact O-N 2.63Å |
| 173 | G | 66.4 | Low | 59.5 | Low | 43 Ų | 43 | 118.4 Ų | 118.4 | 44% | 0.443 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -69.2 | -12.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | K169 T170 I171 | K169-G173 PolarHBondContact O-N 3.41Å; T170-G173 PolarHBondContact O-N 3.33Å; I171-G173 VanDerWaalsContact C-N 3.32Å; I171-G173 PolarHBondContact O-N 2.82Å |
| 174 | L | 63.1 | Low | 58.3 | Low | 126 Ų | 126 | 122.3 Ų | 122.3 | 66% | 0.66 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -98.2 | -19.9 | 174.2 | -73.6 | 166.9 | 0 | 0 | 0 | 112.8 | T170 I171 L172 E176 | T170-L174 HydrophobicContact CG2-CD1 4.3Å; T170-L174 PolarHBondContact O-N 3.03Å; I171-L174 PolarHBondContact O-N 2.87Å; I171-L174 VanDerWaalsContact O-N 3.15Å; L172-L174 PolarHBondContact O-N 3.46Å; L174-E176 VanDerWaalsContact C-N 3.27Å; L174-E176 PolarHBondContact O-N 3.06Å |
| 175 | Q | 49.8 | Very low | 57.1 | Low | 149 Ų | 149 | 124 Ų | 124 | 70% | 0.696 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -79.9 | -8.8 | 178.4 | -164.5 | 167.5 | 6.8 | 0 | 0 | 113.2 | I171 L172 | I171-Q175 PolarHBondContact O-N 3.09Å; L172-Q175 PolarHBondContact O-N 2.63Å |
| 176 | E | 53.2 | Low | 55.5 | Low | 176 Ų | 176 | 124.5 Ų | 124.5 | 82% | 0.822 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | 7 | -179.8 | -155.6 | 163.8 | -140.2 | 0 | 0 | 113.3 | L174 | L174-E176 VanDerWaalsContact C-N 3.27Å; L174-E176 PolarHBondContact O-N 3.06Å |
| 177 | I | 51.8 | Low | 53.7 | Low | 136 Ų | 136 | 121.8 Ų | 121.8 | 70% | 0.697 | 68% | 0.677 | S | S | * | * | trans | -126.7 | 60.5 | 177.5 | -43.2 | -179.8 | 0 | 0 | 0 | 110.2 | ||||
| 178 | D | 38.2 | Very low | 52.3 | Low | 152 Ų | 152 | 121 Ų | 121 | 81% | 0.813 | 69% | 0.686 | S | S | * | * | trans | -90.1 | 150.8 | 169 | -163 | 7.5 | 0 | 0 | 0 | 111.2 | G180 | D178-G180 PolarHBondContact O-N 2.95Š| ||
| 179 | C | 43 | Very low | 50.7 | Low | 114 Ų | 114 | 127.7 Ų | 127.7 | 77% | 0.77 | 71% | 0.708 | S | S | * | * | trans | -86.1 | 105.6 | -159.4 | -64.9 | 0 | 0 | 0 | 0 | 113.4 | Q181 | C179-Q181 PolarHBondContact O-N 3.16Š| ||
| 180 | G | 39.8 | Very low | 49.3 | Very low | 85 Ų | 85 | 126.2 Ų | 126.2 | 88% | 0.876 | 71% | 0.708 | S | S | * | * | trans | -69.1 | 54.5 | 171.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | D178 | D178-G180 PolarHBondContact O-N 2.95Š| ||
| 181 | Q | 41.5 | Very low | 47.8 | Very low | 161 Ų | 161 | 132.8 Ų | 132.8 | 75% | 0.752 | 73% | 0.726 | S | S | * | * | trans | 39.4 | 116.8 | 152.3 | -165.3 | 168.6 | 2 | 0 | 0 | 119.7 | C179 | C179-Q181 PolarHBondContact O-N 3.16Š| ||
| 182 | E | 37.6 | Very low | 46.5 | Very low | 166 Ų | 166 | 132 Ų | 132 | 78% | 0.776 | 74% | 0.741 | S | S | * | * | trans | -55.8 | 140.3 | 166 | -57 | -179.7 | 141.7 | 0 | 0 | 112.2 | ||||
| 183 | N | 34.6 | Very low | 45 | Very low | 140 Ų | 140 | 128.1 Ų | 128.1 | 75% | 0.749 | 73% | 0.729 | S | S | * | * | trans | -131.1 | 93.7 | 160.4 | -98.4 | -73 | 0 | 0 | 0 | 109.4 | V185 | N183-V185 PolarHBondContact O-N 3.4Š| ||
| 184 | I | 45.4 | Very low | 44.3 | Very low | 141 Ų | 141 | 134.1 Ų | 134.1 | 72% | 0.723 | 75% | 0.75 | S | S | * | * | trans | -72.8 | 109.2 | 170.8 | -64.9 | 167.4 | 0 | 0 | 0 | 107.5 | D186 | I184-D186 PolarHBondContact O-N 2.79Š| ||
| 185 | V | 41.8 | Very low | 43.8 | Very low | 124 Ų | 124 | 132.3 Ų | 132.3 | 75% | 0.752 | 75% | 0.754 | S | S | * | * | trans | -85.3 | 95.9 | 164.2 | 179.4 | 0 | 0 | 0 | 0 | 107.5 | N183 | N183-V185 PolarHBondContact O-N 3.4Š| ||
| 186 | D | 39.4 | Very low | 44 | Very low | 133 Ų | 133 | 129.8 Ų | 129.8 | 71% | 0.711 | 75% | 0.749 | S | S | * | * | trans | -69.3 | 136 | 164.6 | -174.2 | 16 | 0 | 0 | 0 | 109.3 | I184 | I184-D186 PolarHBondContact O-N 2.79Š| ||
| 187 | S | 39.2 | Very low | 44.4 | Very low | 98 Ų | 98 | 124.4 Ų | 124.4 | 69% | 0.685 | 73% | 0.73 | S | S | * | * | trans | -158.1 | 69.4 | 178.1 | -74.1 | 0 | 0 | 0 | 0 | 108.5 | E189 | S187-E189 PolarHBondContact O-N 2.79Š| ||
| 188 | A | 47.1 | Very low | 45 | Very low | 91 Ų | 91 | 121.6 Ų | 121.6 | 75% | 0.752 | 72% | 0.717 | S | S | * | * | trans | -68.4 | 107 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 189 | E | 40.9 | Very low | 46.8 | Very low | 193 Ų | 193 | 116.9 Ų | 116.9 | 90% | 0.902 | 70% | 0.699 | S | S | * | * | trans | -110.6 | 128.1 | 158.3 | -69.4 | -161 | 148.3 | 0 | 0 | 110 | S187 | S187-E189 PolarHBondContact O-N 2.79Š| ||
| 190 | D | 47.1 | Very low | 48.5 | Very low | 130 Ų | 130 | 117.2 Ų | 117.2 | 70% | 0.695 | 69% | 0.689 | S | S | * | * | trans | -76.6 | 154.8 | 178.1 | 179.7 | 26 | 0 | 0 | 0 | 111.1 | ||||
| 191 | Y | 42.6 | Very low | 50.5 | Low | 216 Ų | 216 | 116.8 Ų | 116.8 | 85% | 0.847 | 67% | 0.67 | S | S | * | * | trans | 161.3 | 112 | 130.1 | -101.8 | -89.8 | 0 | 0 | 0 | 112.4 | ||||
| 192 | G | 44.1 | Very low | 52.6 | Low | 79 Ų | 79 | 116.9 Ų | 116.9 | 81% | 0.814 | 66% | 0.663 | S | S | * | * | trans | 76.4 | 83.9 | 144.5 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 193 | G | 38.3 | Very low | 54.9 | Low | 37 Ų | 37 | 113.9 Ų | 113.9 | 38% | 0.381 | 66% | 0.656 | S | S | . | * | trans | -166 | 62.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | A195 V196 S197 | G193-A195 PolarHBondContact O-N 3.25Å; G193-A195 VanDerWaalsContact O-N 3.14Å; G193-V196 WeakPolarHBondContact O-CA 3.37Å; G193-V196 WeakPolarHBondContact O-CB 3.45Å; G193-V196 PolarHBondContact O-N 3.01Å; G193-S197 PolarHBondContact O-N 2.91Å | ||
| 194 | L | 51.7 | Low | 57.4 | Low | 169 Ų | 169 | 112 Ų | 112 | 89% | 0.885 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -58.4 | -31.1 | -175.4 | -154.1 | 77.4 | 0 | 0 | 0 | 114 | ||
| 195 | A | 52.9 | Low | 59.5 | Low | 89 Ų | 89 | 112.7 Ų | 112.7 | 74% | 0.736 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -82.3 | -22.8 | 174 | 0 | 0 | 0 | 0 | 0 | 113.9 | G193 | G193-A195 PolarHBondContact O-N 3.25Å; G193-A195 VanDerWaalsContact O-N 3.14Å |
| 196 | V | 53.2 | Low | 61.9 | Low | 96 Ų | 96 | 109.2 Ų | 109.2 | 58% | 0.582 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -74.8 | -37.2 | 174.7 | -176.7 | 0 | 0 | 0 | 0 | 109.9 | G193 D198 A199 Q200 | G193-V196 WeakPolarHBondContact O-CA 3.37Å; G193-V196 WeakPolarHBondContact O-CB 3.45Å; G193-V196 PolarHBondContact O-N 3.01Å; V196-D198 PolarHBondContact O-N 2.99Å; V196-A199 PolarHBondContact O-N 3.3Å; V196-Q200 WeakPolarHBondContact O-CB 3.16Å; V196-Q200 PolarHBondContact O-N 2.99Å |
| 197 | S | 63 | Low | 64.4 | Low | 62 Ų | 62 | 109.1 Ų | 109.1 | 43% | 0.434 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -57 | -44 | 178.2 | -178 | 0 | 0 | 0 | 0 | 113.6 | G193 Q200 T201 | G193-S197 PolarHBondContact O-N 2.91Å; S197-Q200 PolarHBondContact O-N 3.43Å; S197-T201 VanDerWaalsContact O-CB 3.28Å; S197-T201 WeakPolarHBondContact O-CB 3.5Å; S197-T201 PolarHBondContact O-N 3.31Å; S197-T201 PolarHBondContact O-OG1 2.94Å |
| 198 | D | 63.5 | Low | 67 | Low | 77 Ų | 77 | 110.2 Ų | 110.2 | 41% | 0.412 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -67.5 | -42.8 | 177.1 | 172.1 | 39.7 | 0 | 0 | 0 | 111.9 | V196 Q200 T201 R202 | V196-D198 PolarHBondContact O-N 2.99Å; D198-Q200 PolarHBondContact O-N 2.97Å; D198-T201 WeakPolarHBondContact O-CB 3.43Å; D198-T201 PolarHBondContact O-N 3.49Å; D198-R202 VanDerWaalsContact CG-NE 3.33Å; D198-R202 VanDerWaalsContact O-CG 3.3Å; D198-R202 WeakPolarHBondContact O-CG 3.22Å; D198-R202 PolarHBondContact O-N 2.82Å; D198-R202 IonicContact OD1-CZ 3.54Å; D198-R202 IonicContact OD1-NE 3.97Å; D198-R202 PolarHBondContact OD1-NE 3.47Å; D198-R202 IonicContact OD1-NH2 3.5Å; D198-R202 PolarHBondContact OD1-NH2 2.93Å; D198-R202 IonicContact OD2-CZ 3.6Å; D198-R202 IonicContact OD2-NE 2.76Å; D198-R202 PolarHBondContact OD2-NE 2.98Å; D198-R202 VanDerWaalsContact OD2-NE 3.16Å; D198-R202 IonicContact OD2-NH2 2.65Å; D198-R202 PolarHBondContact OD2-NH2 3.49Å |
| 199 | A | 75.9 | Confident | 69.2 | Low | 54 Ų | 54 | 114 Ų | 114 | 45% | 0.446 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -60.4 | -46.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | V196 T201 R202 V203 | V196-A199 PolarHBondContact O-N 3.3Å; A199-T201 PolarHBondContact O-N 2.96Å; A199-R202 PolarHBondContact O-N 3.15Å; A199-V203 WeakPolarHBondContact O-CG2 3.48Å; A199-V203 PolarHBondContact O-N 2.97Å |
| 200 | Q | 79 | Confident | 71.7 | Confident | 120 Ų | 120 | 109 Ų | 109 | 56% | 0.561 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -61.7 | -41.9 | 175 | -169.8 | 176.3 | 8.3 | 0 | 0 | 111.7 | V196 S197 D198 R202 V203 L204 | V196-Q200 WeakPolarHBondContact O-CB 3.16Å; V196-Q200 PolarHBondContact O-N 2.99Å; S197-Q200 PolarHBondContact O-N 3.43Å; D198-Q200 PolarHBondContact O-N 2.97Å; Q200-R202 PolarHBondContact O-N 3.03Å; Q200-V203 PolarHBondContact O-N 3.27Å; Q200-L204 HydrophobicContact CG-CD1 4.27Å; Q200-L204 WeakPolarHBondContact O-CB 3.26Å; Q200-L204 WeakPolarHBondContact O-CG 3.2Å; Q200-L204 PolarHBondContact O-N 3.37Å |
| 201 | T | 81.6 | Confident | 74 | Confident | 77 Ų | 77 | 106.8 Ų | 106.8 | 47% | 0.472 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -60.9 | -41.4 | 175.5 | -61.6 | 0 | 0 | 0 | 0 | 111.9 | S197 D198 A199 L204 K205 | S197-T201 VanDerWaalsContact O-CB 3.28Å; S197-T201 WeakPolarHBondContact O-CB 3.5Å; S197-T201 PolarHBondContact O-N 3.31Å; S197-T201 PolarHBondContact O-OG1 2.94Å; D198-T201 WeakPolarHBondContact O-CB 3.43Å; D198-T201 PolarHBondContact O-N 3.49Å; A199-T201 PolarHBondContact O-N 2.96Å; T201-L204 PolarHBondContact O-N 3.15Å; T201-K205 VanDerWaalsContact O-CB 3.29Å; T201-K205 WeakPolarHBondContact O-CB 3.37Å; T201-K205 PolarHBondContact O-N 2.91Å |
| 202 | R | 85.9 | Confident | 76.5 | Confident | 163 Ų | 163 | 101.2 Ų | 101.2 | 62% | 0.615 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -65.5 | -41.4 | 175.8 | -67.7 | 169.9 | -166.6 | -153.2 | 7.3 | 112 | D198 A199 Q200 K205 A206 | D198-R202 VanDerWaalsContact CG-NE 3.33Å; D198-R202 VanDerWaalsContact O-CG 3.3Å; D198-R202 WeakPolarHBondContact O-CG 3.22Å; D198-R202 PolarHBondContact O-N 2.82Å; D198-R202 IonicContact OD1-CZ 3.54Å; D198-R202 IonicContact OD1-NE 3.97Å; D198-R202 PolarHBondContact OD1-NE 3.47Å; D198-R202 IonicContact OD1-NH2 3.5Å; D198-R202 PolarHBondContact OD1-NH2 2.93Å; D198-R202 IonicContact OD2-CZ 3.6Å; D198-R202 IonicContact OD2-NE 2.76Å; D198-R202 PolarHBondContact OD2-NE 2.98Å; D198-R202 VanDerWaalsContact OD2-NE 3.16Å; D198-R202 IonicContact OD2-NH2 2.65Å; D198-R202 PolarHBondContact OD2-NH2 3.49Å; A199-R202 PolarHBondContact O-N 3.15Å; Q200-R202 PolarHBondContact O-N 3.03Å; R202-K205 PolarHBondContact O-N 2.89Å; R202-A206 WeakPolarHBondContact O-CB 3.35Å; R202-A206 PolarHBondContact O-N 3.07Å |
| 203 | V | 85.9 | Confident | 78.9 | Confident | 103 Ų | 103 | 102.5 Ų | 102.5 | 62% | 0.624 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -64.7 | -45 | 175.9 | 172 | 0 | 0 | 0 | 0 | 111.3 | A199 Q200 K205 A206 K207 | A199-V203 WeakPolarHBondContact O-CG2 3.48Å; A199-V203 PolarHBondContact O-N 2.97Å; Q200-V203 PolarHBondContact O-N 3.27Å; V203-K205 VanDerWaalsContact C-N 3.34Å; V203-K205 PolarHBondContact O-N 2.87Å; V203-A206 PolarHBondContact O-N 3.34Å; V203-K207 PolarHBondContact O-N 3.49Å |
| 204 | L | 87.5 | Confident | 81.6 | Confident | 99 Ų | 99 | 105.8 Ų | 105.8 | 52% | 0.518 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -61.9 | -40.8 | 175.5 | -71.9 | 169.6 | 0 | 0 | 0 | 111.9 | Q200 T201 K207 L208 | Q200-L204 HydrophobicContact CG-CD1 4.27Å; Q200-L204 WeakPolarHBondContact O-CB 3.26Å; Q200-L204 WeakPolarHBondContact O-CG 3.2Å; Q200-L204 PolarHBondContact O-N 3.37Å; T201-L204 PolarHBondContact O-N 3.15Å; L204-K207 PolarHBondContact O-N 3.46Å; L204-L208 WeakPolarHBondContact O-CB 3.48Å; L204-L208 PolarHBondContact O-N 2.95Å |
| 205 | K | 89.8 | Confident | 83.7 | Confident | 156 Ų | 156 | 102 Ų | 102 | 68% | 0.678 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -68.3 | -33.6 | 176.2 | -168.9 | 169.8 | -174.8 | 171.9 | 0 | 112.9 | T201 R202 V203 R209 | T201-K205 VanDerWaalsContact O-CB 3.29Å; T201-K205 WeakPolarHBondContact O-CB 3.37Å; T201-K205 PolarHBondContact O-N 2.91Å; R202-K205 PolarHBondContact O-N 2.89Å; V203-K205 VanDerWaalsContact C-N 3.34Å; V203-K205 PolarHBondContact O-N 2.87Å; K205-R209 PolarHBondContact O-N 2.71Å; K205-R209 VanDerWaalsContact O-N 3.13Å |
| 206 | A | 90.6 | Very high | 85.7 | Confident | 52 Ų | 52 | 101.9 Ų | 101.9 | 43% | 0.43 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -68.8 | -44.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | R202 V203 L208 R209 I210 | R202-A206 WeakPolarHBondContact O-CB 3.35Å; R202-A206 PolarHBondContact O-N 3.07Å; V203-A206 PolarHBondContact O-N 3.34Å; A206-L208 PolarHBondContact O-N 3.46Å; A206-R209 PolarHBondContact O-N 3.32Å; A206-R209 VanDerWaalsContact O-N 3.16Å; A206-I210 WeakPolarHBondContact O-CG1 3.49Å; A206-I210 PolarHBondContact O-N 3.36Å |
| 207 | K | 93.1 | Very high | 87.8 | Confident | 130 Ų | 130 | 101.1 Ų | 101.1 | 57% | 0.565 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61 | -43 | 174.7 | -171.5 | 179.7 | 179.4 | -175.9 | 0 | 111.8 | V203 L204 R209 I210 M211 | V203-K207 PolarHBondContact O-N 3.49Å; L204-K207 PolarHBondContact O-N 3.46Å; K207-R209 VanDerWaalsContact C-N 3.31Å; K207-R209 PolarHBondContact O-N 3.19Å; K207-I210 PolarHBondContact O-N 3.4Å; K207-M211 HydrophobicContact CD-SD 4.34Å; K207-M211 HydrophobicContact CG-CG 4.37Å; K207-M211 HydrophobicContact CG-SD 3.99Å; K207-M211 WeakPolarHBondContact O-CB 3.29Å; K207-M211 WeakPolarHBondContact O-CG 3.24Å; K207-M211 PolarHBondContact O-N 3.44Å |
| 208 | L | 92.9 | Very high | 89.4 | Confident | 122 Ų | 122 | 104 Ų | 104 | 64% | 0.639 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -59.5 | -39.3 | 173.7 | -85.8 | 167.9 | 0 | 0 | 0 | 112.6 | L204 A206 Q212 | L204-L208 WeakPolarHBondContact O-CB 3.48Å; L204-L208 PolarHBondContact O-N 2.95Å; A206-L208 PolarHBondContact O-N 3.46Å; L208-Q212 WeakPolarHBondContact O-CB 3.38Å; L208-Q212 PolarHBondContact O-N 2.68Å |
| 209 | R | 93.7 | Very high | 90.9 | Very high | 169 Ų | 169 | 102.8 Ų | 102.8 | 64% | 0.638 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -66.1 | -46.3 | 174.3 | 175.8 | 174.6 | -70.1 | 175.2 | -4.6 | 111.9 | K205 A206 K207 M211 Q212 E213 | K205-R209 PolarHBondContact O-N 2.71Å; K205-R209 VanDerWaalsContact O-N 3.13Å; A206-R209 PolarHBondContact O-N 3.32Å; A206-R209 VanDerWaalsContact O-N 3.16Å; K207-R209 VanDerWaalsContact C-N 3.31Å; K207-R209 PolarHBondContact O-N 3.19Å; R209-M211 VanDerWaalsContact C-N 3.34Å; R209-M211 PolarHBondContact O-N 2.96Å; R209-Q212 WeakPolarHBondContact O-CB 3.46Å; R209-Q212 PolarHBondContact O-N 2.89Å; R209-Q212 VanDerWaalsContact O-N 3.16Å; R209-E213 WeakPolarHBondContact CD-OE1 3.46Å; R209-E213 HydrophobicContact CG-CG 4.31Å; R209-E213 WeakPolarHBondContact CG-OE1 3.42Å; R209-E213 WeakPolarHBondContact O-CG 3.27Å; R209-E213 PolarHBondContact O-N 3.43Å |
| 210 | I | 94.2 | Very high | 91.9 | Very high | 89 Ų | 89 | 102.7 Ų | 102.7 | 46% | 0.456 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.4 | -47.1 | 177.8 | -67.5 | 164.8 | 0 | 0 | 0 | 110 | A206 K207 Q212 E213 E214 | A206-I210 WeakPolarHBondContact O-CG1 3.49Å; A206-I210 PolarHBondContact O-N 3.36Å; K207-I210 PolarHBondContact O-N 3.4Å; I210-Q212 VanDerWaalsContact C-N 3.3Å; I210-Q212 PolarHBondContact O-N 2.76Å; I210-E213 PolarHBondContact O-N 2.88Å; I210-E214 HydrophobicContact CG2-CG 4.39Å; I210-E214 WeakPolarHBondContact O-CB 3.31Å; I210-E214 VanDerWaalsContact O-CG 3.29Å; I210-E214 WeakPolarHBondContact O-CG 3.35Å; I210-E214 PolarHBondContact O-N 3.12Å |
| 211 | M | 94.8 | Very high | 92.7 | Very high | 83 Ų | 83 | 100.6 Ų | 100.6 | 41% | 0.409 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.2 | -32.2 | 176.8 | -69.1 | 178.3 | 69.4 | 0 | 0 | 112.9 | K207 R209 I215 | K207-M211 HydrophobicContact CD-SD 4.34Å; K207-M211 HydrophobicContact CG-CG 4.37Å; K207-M211 HydrophobicContact CG-SD 3.99Å; K207-M211 WeakPolarHBondContact O-CB 3.29Å; K207-M211 WeakPolarHBondContact O-CG 3.24Å; K207-M211 PolarHBondContact O-N 3.44Å; R209-M211 VanDerWaalsContact C-N 3.34Å; R209-M211 PolarHBondContact O-N 2.96Å; M211-I215 WeakPolarHBondContact O-CB 3.23Å; M211-I215 WeakPolarHBondContact O-CD1 3.39Å; M211-I215 WeakPolarHBondContact O-CG1 3.45Å; M211-I215 PolarHBondContact O-N 3.07Å |
| 212 | Q | 94.9 | Very high | 93.4 | Very high | 99 Ų | 99 | 104 Ų | 104 | 46% | 0.463 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -68.8 | -45.9 | 171.9 | -173.2 | 67.1 | 61.2 | 0 | 0 | 111.5 | L208 R209 I210 E214 I215 D216 | L208-Q212 WeakPolarHBondContact O-CB 3.38Å; L208-Q212 PolarHBondContact O-N 2.68Å; R209-Q212 WeakPolarHBondContact O-CB 3.46Å; R209-Q212 PolarHBondContact O-N 2.89Å; R209-Q212 VanDerWaalsContact O-N 3.16Å; I210-Q212 VanDerWaalsContact C-N 3.3Å; I210-Q212 PolarHBondContact O-N 2.76Å; Q212-E214 VanDerWaalsContact C-N 3.29Å; Q212-E214 PolarHBondContact O-N 2.9Å; Q212-I215 PolarHBondContact O-N 3.38Å; Q212-D216 PolarHBondContact NE2-OD1 2.92Å; Q212-D216 WeakPolarHBondContact O-CB 3.46Å; Q212-D216 PolarHBondContact O-N 3.43Å |
| 213 | E | 93.9 | Very high | 93.9 | Very high | 106 Ų | 106 | 102.1 Ų | 102.1 | 50% | 0.495 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.3 | -35.1 | 177.2 | -71.5 | 168.9 | -166.1 | 0 | 0 | 111.5 | R209 I210 T217 | R209-E213 WeakPolarHBondContact CD-OE1 3.46Å; R209-E213 HydrophobicContact CG-CG 4.31Å; R209-E213 WeakPolarHBondContact CG-OE1 3.42Å; R209-E213 WeakPolarHBondContact O-CG 3.27Å; R209-E213 PolarHBondContact O-N 3.43Å; I210-E213 PolarHBondContact O-N 2.88Å; E213-T217 VanDerWaalsContact O-CB 3.26Å; E213-T217 WeakPolarHBondContact O-CB 3.32Å; E213-T217 PolarHBondContact O-N 3.4Å; E213-T217 PolarHBondContact O-OG1 3.44Å |
| 214 | E | 94.8 | Very high | 94.4 | Very high | 106 Ų | 106 | 101.7 Ų | 101.7 | 50% | 0.495 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.6 | -48.2 | 169.8 | -73.6 | 168.9 | 171.9 | 0 | 0 | 111.9 | I210 Q212 T217 L218 | I210-E214 HydrophobicContact CG2-CG 4.39Å; I210-E214 WeakPolarHBondContact O-CB 3.31Å; I210-E214 VanDerWaalsContact O-CG 3.29Å; I210-E214 WeakPolarHBondContact O-CG 3.35Å; I210-E214 PolarHBondContact O-N 3.12Å; Q212-E214 VanDerWaalsContact C-N 3.29Å; Q212-E214 PolarHBondContact O-N 2.9Å; E214-T217 PolarHBondContact O-N 2.88Å; E214-L218 WeakPolarHBondContact O-CB 3.45Å; E214-L218 VanDerWaalsContact O-CG 3.25Å; E214-L218 WeakPolarHBondContact O-CG 3.45Å; E214-L218 PolarHBondContact O-N 3.46Å |
| 215 | I | 96 | Very high | 94.9 | Very high | 89 Ų | 89 | 102.7 Ų | 102.7 | 46% | 0.456 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.8 | -43.6 | 176.9 | -74.3 | 164.6 | 0 | 0 | 0 | 111.5 | M211 Q212 L218 S219 | M211-I215 WeakPolarHBondContact O-CB 3.23Å; M211-I215 WeakPolarHBondContact O-CD1 3.39Å; M211-I215 WeakPolarHBondContact O-CG1 3.45Å; M211-I215 PolarHBondContact O-N 3.07Å; Q212-I215 PolarHBondContact O-N 3.38Å; I215-L218 PolarHBondContact O-N 3.08Å; I215-S219 VanDerWaalsContact O-CB 3.28Å; I215-S219 WeakPolarHBondContact O-CB 3.33Å; I215-S219 PolarHBondContact O-N 3.2Å; I215-S219 PolarHBondContact O-OG 3.38Å |
| 216 | D | 95.8 | Very high | 95.2 | Very high | 87 Ų | 87 | 99 Ų | 99 | 47% | 0.465 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.7 | -38.8 | 179.6 | -66.6 | -11.1 | 0 | 0 | 0 | 110.8 | Q212 S219 S220 | Q212-D216 PolarHBondContact NE2-OD1 2.92Å; Q212-D216 WeakPolarHBondContact O-CB 3.46Å; Q212-D216 PolarHBondContact O-N 3.43Å; D216-S219 PolarHBondContact O-N 3.01Å; D216-S220 WeakPolarHBondContact O-CB 3.37Å; D216-S220 PolarHBondContact O-N 3.31Å |
| 217 | T | 96.3 | Very high | 95.5 | Very high | 81 Ų | 81 | 101.8 Ų | 101.8 | 50% | 0.497 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.5 | -48.4 | 174.8 | -59.3 | 0 | 0 | 0 | 0 | 111.5 | E213 E214 S219 S220 D221 | E213-T217 VanDerWaalsContact O-CB 3.26Å; E213-T217 WeakPolarHBondContact O-CB 3.32Å; E213-T217 PolarHBondContact O-N 3.4Å; E213-T217 PolarHBondContact O-OG1 3.44Å; E214-T217 PolarHBondContact O-N 2.88Å; T217-S219 VanDerWaalsContact C-N 3.29Å; T217-S219 PolarHBondContact O-N 2.9Å; T217-S220 WeakPolarHBondContact O-CB 3.27Å; T217-S220 PolarHBondContact O-N 3.41Å; T217-D221 PolarHBondContact O-N 3.06Å |
| 218 | L | 96.3 | Very high | 95.7 | Very high | 122 Ų | 122 | 99.7 Ų | 99.7 | 64% | 0.639 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.1 | -37.6 | 176.1 | -73 | 169.2 | 0 | 0 | 0 | 111.9 | E214 I215 D221 Y222 | E214-L218 WeakPolarHBondContact O-CB 3.45Å; E214-L218 VanDerWaalsContact O-CG 3.25Å; E214-L218 WeakPolarHBondContact O-CG 3.45Å; E214-L218 PolarHBondContact O-N 3.46Å; I215-L218 PolarHBondContact O-N 3.08Å; L218-D221 PolarHBondContact O-N 2.68Å; L218-Y222 VanDerWaalsContact O-CB 3.22Å; L218-Y222 WeakPolarHBondContact O-CB 3.33Å; L218-Y222 PolarHBondContact O-N 3.37Å |
| 219 | S | 96 | Very high | 95.8 | Very high | 51 Ų | 51 | 98 Ų | 98 | 36% | 0.357 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.9 | -41.6 | 174.8 | -58.4 | 0 | 0 | 0 | 0 | 111.7 | I215 D216 T217 Y222 H223 | I215-S219 VanDerWaalsContact O-CB 3.28Å; I215-S219 WeakPolarHBondContact O-CB 3.33Å; I215-S219 PolarHBondContact O-N 3.2Å; I215-S219 PolarHBondContact O-OG 3.38Å; D216-S219 PolarHBondContact O-N 3.01Å; T217-S219 VanDerWaalsContact C-N 3.29Å; T217-S219 PolarHBondContact O-N 2.9Å; S219-Y222 PolarHBondContact O-N 2.94Å; S219-H223 PolarHBondContact O-CD2 3.13Å; S219-H223 PolarHBondContact O-N 3.05Å |
| 220 | S | 95.9 | Very high | 96 | Very high | 52 Ų | 52 | 93 Ų | 93 | 36% | 0.364 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -59.6 | -46.3 | 173.8 | -172.4 | 0 | 0 | 0 | 0 | 112 | D216 T217 H223 K224 | D216-S220 WeakPolarHBondContact O-CB 3.37Å; D216-S220 PolarHBondContact O-N 3.31Å; T217-S220 WeakPolarHBondContact O-CB 3.27Å; T217-S220 PolarHBondContact O-N 3.41Å; S220-H223 PolarHBondContact O-N 2.89Å; S220-K224 WeakPolarHBondContact O-CE 3.5Å; S220-K224 WeakPolarHBondContact O-CG 3.32Å; S220-K224 PolarHBondContact O-N 2.89Å; S220-K224 VanDerWaalsContact O-N 3.1Å; S220-K224 WeakPolarHBondContact OG-CE 3.23Å; S220-K224 PolarHBondContact OG-NZ 3.21Å |
| 221 | D | 96.3 | Very high | 96.2 | Very high | 77 Ų | 77 | 94.1 Ų | 94.1 | 41% | 0.412 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -73.4 | -34.8 | 179.8 | -75.3 | -17 | 0 | 0 | 0 | 112.7 | T217 L218 K224 K225 | T217-D221 PolarHBondContact O-N 3.06Å; L218-D221 PolarHBondContact O-N 2.68Å; D221-K224 PolarHBondContact O-N 3.04Å; D221-K224 IonicContact OD1-NZ 2.96Å; D221-K224 PolarHBondContact OD1-NZ 3.08Å; D221-K225 WeakPolarHBondContact O-CB 3.41Å; D221-K225 VanDerWaalsContact O-CG 3.3Å; D221-K225 WeakPolarHBondContact O-CG 3.44Å; D221-K225 PolarHBondContact O-N 2.87Å |
| 222 | Y | 96.6 | Very high | 96.3 | Very high | 147 Ų | 147 | 95.5 Ų | 95.5 | 58% | 0.576 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -58.6 | -47.7 | 169.3 | 174.5 | -104.7 | 0 | 0 | 0 | 111.5 | L218 S219 K224 K225 E226 | L218-Y222 VanDerWaalsContact O-CB 3.22Å; L218-Y222 WeakPolarHBondContact O-CB 3.33Å; L218-Y222 PolarHBondContact O-N 3.37Å; S219-Y222 PolarHBondContact O-N 2.94Å; Y222-K224 PolarHBondContact O-N 3.41Å; Y222-K225 PolarHBondContact O-N 3.46Å; Y222-K225 VanDerWaalsContact O-N 3.17Å; Y222-E226 PolarHBondContact O-N 3.32Å |
| 223 | H | 96.2 | Very high | 96.4 | Very high | 125 Ų | 125 | 93.4 Ų | 93.4 | 58% | 0.579 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -63.5 | -38.5 | 177.4 | -72.7 | -47.4 | 0 | 0 | 0 | 113.2 | S219 S220 K225 E226 E227 | S219-H223 PolarHBondContact O-CD2 3.13Å; S219-H223 PolarHBondContact O-N 3.05Å; S220-H223 PolarHBondContact O-N 2.89Å; H223-K225 VanDerWaalsContact C-N 3.34Å; H223-E226 PolarHBondContact O-N 3.13Å; H223-E227 PolarHBondContact O-N 3.11Å |
| 224 | K | 97.4 | Very high | 96.6 | Very high | 93 Ų | 93 | 91.3 Ų | 91.3 | 40% | 0.404 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61.3 | -43.4 | 172.4 | -67.6 | 162.4 | -150.2 | 156.9 | 0 | 111.2 | S220 D221 Y222 E227 E228 | S220-K224 WeakPolarHBondContact O-CE 3.5Å; S220-K224 WeakPolarHBondContact O-CG 3.32Å; S220-K224 PolarHBondContact O-N 2.89Å; S220-K224 VanDerWaalsContact O-N 3.1Å; S220-K224 WeakPolarHBondContact OG-CE 3.23Å; S220-K224 PolarHBondContact OG-NZ 3.21Å; D221-K224 PolarHBondContact O-N 3.04Å; D221-K224 IonicContact OD1-NZ 2.96Å; D221-K224 PolarHBondContact OD1-NZ 3.08Å; Y222-K224 PolarHBondContact O-N 3.41Å; K224-E227 PolarHBondContact O-N 3.25Å; K224-E228 WeakPolarHBondContact O-CG 3.44Å; K224-E228 PolarHBondContact O-N 2.97Å |
| 225 | K | 97.1 | Very high | 96.8 | Very high | 120 Ų | 120 | 90.6 Ų | 90.6 | 52% | 0.522 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -68.8 | -33.8 | 179.1 | -70.6 | -73.8 | 163.8 | -117.5 | 0 | 112.5 | D221 Y222 H223 E228 N229 | D221-K225 WeakPolarHBondContact O-CB 3.41Å; D221-K225 VanDerWaalsContact O-CG 3.3Å; D221-K225 WeakPolarHBondContact O-CG 3.44Å; D221-K225 PolarHBondContact O-N 2.87Å; Y222-K225 PolarHBondContact O-N 3.46Å; Y222-K225 VanDerWaalsContact O-N 3.17Å; H223-K225 VanDerWaalsContact C-N 3.34Å; K225-E228 IonicContact NZ-OE1 2.89Å; K225-E228 PolarHBondContact NZ-OE1 2.94Å; K225-E228 IonicContact NZ-OE2 3.16Å; K225-E228 PolarHBondContact NZ-OE2 3.3Å; K225-E228 PolarHBondContact O-N 3.25Å; K225-N229 WeakPolarHBondContact O-CB 3.28Å; K225-N229 PolarHBondContact O-N 3.38Å |
| 226 | E | 96.4 | Very high | 96.8 | Very high | 79 Ų | 79 | 91.3 Ų | 91.3 | 37% | 0.369 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -72.5 | -32.6 | 173.8 | -171.2 | 54 | -157.1 | 0 | 0 | 112.4 | Y222 H223 N229 S230 | Y222-E226 PolarHBondContact O-N 3.32Å; H223-E226 PolarHBondContact O-N 3.13Å; E226-N229 PolarHBondContact O-N 2.83Å; E226-N229 PolarHBondContact OE2-ND2 3.36Å; E226-S230 VanDerWaalsContact O-CB 3.32Å; E226-S230 WeakPolarHBondContact O-CB 3.46Å; E226-S230 PolarHBondContact O-N 3.19Å; E226-S230 PolarHBondContact O-OG 2.81Å |
| 227 | E | 96.8 | Very high | 96.9 | Very high | 110 Ų | 110 | 93.4 Ų | 93.4 | 51% | 0.514 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -68.7 | -40.9 | 171 | -154.7 | -150.9 | 165.3 | 0 | 0 | 111.9 | H223 K224 K231 | H223-E227 PolarHBondContact O-N 3.11Å; K224-E227 PolarHBondContact O-N 3.25Å; E227-K231 WeakPolarHBondContact O-CD 3.32Å; E227-K231 VanDerWaalsContact O-CG 3.24Å; E227-K231 WeakPolarHBondContact O-CG 3.47Å; E227-K231 PolarHBondContact O-N 2.8Å; E227-K231 WeakPolarHBondContact OE1-CE 3.31Å; E227-K231 IonicContact OE1-NZ 2.76Å; E227-K231 PolarHBondContact OE1-NZ 3.38Å; E227-K231 IonicContact OE2-NZ 2.69Å; E227-K231 PolarHBondContact OE2-NZ 2.93Å |
| 228 | E | 97.3 | Very high | 97 | Very high | 86 Ų | 86 | 94.1 Ų | 94.1 | 40% | 0.402 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.8 | -45.9 | 170.8 | -75.6 | 173.4 | -144.7 | 0 | 0 | 111.9 | K224 K225 S230 K231 L232 | K224-E228 WeakPolarHBondContact O-CG 3.44Å; K224-E228 PolarHBondContact O-N 2.97Å; K225-E228 IonicContact NZ-OE1 2.89Å; K225-E228 PolarHBondContact NZ-OE1 2.94Å; K225-E228 IonicContact NZ-OE2 3.16Å; K225-E228 PolarHBondContact NZ-OE2 3.3Å; K225-E228 PolarHBondContact O-N 3.25Å; E228-S230 PolarHBondContact O-N 3.27Å; E228-K231 WeakPolarHBondContact O-CB 3.35Å; E228-K231 PolarHBondContact O-N 2.98Å; E228-L232 WeakPolarHBondContact O-CG 3.44Å; E228-L232 PolarHBondContact O-N 3.22Å |
| 229 | N | 95.9 | Very high | 97 | Very high | 87 Ų | 87 | 93.1 Ų | 93.1 | 47% | 0.465 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -58.5 | -46.4 | 176.5 | -174.1 | 29.1 | 0 | 0 | 0 | 111 | K225 E226 K231 L232 A233 | K225-N229 WeakPolarHBondContact O-CB 3.28Å; K225-N229 PolarHBondContact O-N 3.38Å; E226-N229 PolarHBondContact O-N 2.83Å; E226-N229 PolarHBondContact OE2-ND2 3.36Å; N229-K231 PolarHBondContact O-N 3.05Å; N229-L232 PolarHBondContact O-N 3.3Å; N229-A233 WeakPolarHBondContact O-CB 3.48Å; N229-A233 PolarHBondContact O-N 3.02Å |
| 230 | S | 97.6 | Very high | 97.1 | Very high | 65 Ų | 65 | 94.9 Ų | 94.9 | 46% | 0.455 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -58.7 | -42.7 | 174.3 | -65 | 0 | 0 | 0 | 0 | 112.6 | E226 E228 A234 | E226-S230 VanDerWaalsContact O-CB 3.32Å; E226-S230 WeakPolarHBondContact O-CB 3.46Å; E226-S230 PolarHBondContact O-N 3.19Å; E226-S230 PolarHBondContact O-OG 2.81Å; E228-S230 PolarHBondContact O-N 3.27Å; S230-A234 WeakPolarHBondContact O-CB 3.42Å; S230-A234 PolarHBondContact O-N 3.05Å |
| 231 | K | 98.1 | Very high | 97.2 | Very high | 111 Ų | 111 | 98 Ų | 98 | 48% | 0.483 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.8 | -41.2 | 175.9 | -70.8 | 160.8 | -173.7 | 166.9 | 0 | 112 | E227 E228 N229 A234 K235 | E227-K231 WeakPolarHBondContact O-CD 3.32Å; E227-K231 VanDerWaalsContact O-CG 3.24Å; E227-K231 WeakPolarHBondContact O-CG 3.47Å; E227-K231 PolarHBondContact O-N 2.8Å; E227-K231 WeakPolarHBondContact OE1-CE 3.31Å; E227-K231 IonicContact OE1-NZ 2.76Å; E227-K231 PolarHBondContact OE1-NZ 3.38Å; E227-K231 IonicContact OE2-NZ 2.69Å; E227-K231 PolarHBondContact OE2-NZ 2.93Å; E228-K231 WeakPolarHBondContact O-CB 3.35Å; E228-K231 PolarHBondContact O-N 2.98Å; N229-K231 PolarHBondContact O-N 3.05Å; K231-A234 PolarHBondContact O-N 2.83Å; K231-K235 PolarHBondContact O-N 3.23Å |
| 232 | L | 97.3 | Very high | 97.2 | Very high | 112 Ų | 112 | 96.9 Ų | 96.9 | 59% | 0.586 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -67 | -43.5 | 177 | -71.1 | 171.5 | 0 | 0 | 0 | 111.7 | E228 N229 A234 K235 I236 | E228-L232 WeakPolarHBondContact O-CG 3.44Å; E228-L232 PolarHBondContact O-N 3.22Å; N229-L232 PolarHBondContact O-N 3.3Å; L232-A234 PolarHBondContact O-N 2.58Å; L232-K235 PolarHBondContact O-N 3.01Å; L232-I236 WeakPolarHBondContact O-CG1 3.26Å; L232-I236 PolarHBondContact O-N 3.23Å |
| 233 | A | 97.4 | Very high | 97.3 | Very high | 55 Ų | 55 | 97 Ų | 97 | 46% | 0.455 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.5 | -42.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | N229 I236 K237 | N229-A233 WeakPolarHBondContact O-CB 3.48Å; N229-A233 PolarHBondContact O-N 3.02Å; A233-I236 PolarHBondContact O-N 3.07Å; A233-K237 PolarHBondContact O-N 3.48Å |
| 234 | A | 97.8 | Very high | 97.4 | Very high | 62 Ų | 62 | 94 Ų | 94 | 51% | 0.512 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -61 | -43.4 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | S230 K231 L232 K237 E238 | S230-A234 WeakPolarHBondContact O-CB 3.42Å; S230-A234 PolarHBondContact O-N 3.05Å; K231-A234 PolarHBondContact O-N 2.83Å; L232-A234 PolarHBondContact O-N 2.58Å; A234-K237 PolarHBondContact O-N 3.48Å; A234-E238 PolarHBondContact O-N 3.28Å |
| 235 | K | 98 | Very high | 97.4 | Very high | 92 Ų | 92 | 96.8 Ų | 96.8 | 40% | 0.4 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -67.3 | -37.8 | 178 | -167.5 | 72 | -140.8 | 174.9 | 0 | 112.8 | K231 L232 E238 L239 | K231-K235 PolarHBondContact O-N 3.23Å; L232-K235 PolarHBondContact O-N 3.01Å; K235-E238 WeakPolarHBondContact CE-OE2 3.49Å; K235-E238 IonicContact NZ-OE1 3.63Å; K235-E238 PolarHBondContact NZ-OE1 2.91Å; K235-E238 IonicContact NZ-OE2 3.21Å; K235-E238 PolarHBondContact NZ-OE2 2.96Å; K235-E238 PolarHBondContact O-N 3.4Å; K235-L239 HydrophobicContact CG-CD1 4.27Å; K235-L239 VanDerWaalsContact O-CG 3.28Å; K235-L239 WeakPolarHBondContact O-CG 3.36Å; K235-L239 PolarHBondContact O-N 3.47Å |
| 236 | I | 97.3 | Very high | 97.5 | Very high | 104 Ų | 104 | 95.9 Ų | 95.9 | 53% | 0.533 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -60.2 | -49.9 | 173.5 | -71.4 | 164.5 | 0 | 0 | 0 | 109.6 | L232 A233 E238 L239 E240 | L232-I236 WeakPolarHBondContact O-CG1 3.26Å; L232-I236 PolarHBondContact O-N 3.23Å; A233-I236 PolarHBondContact O-N 3.07Å; I236-E238 PolarHBondContact O-N 3.13Å; I236-L239 PolarHBondContact O-N 3.39Å; I236-L239 VanDerWaalsContact O-N 3.16Å; I236-E240 HydrophobicContact CG2-CG 4.42Å; I236-E240 WeakPolarHBondContact O-CG 3.48Å; I236-E240 PolarHBondContact O-N 2.86Å |
| 237 | K | 98.1 | Very high | 97.6 | Very high | 131 Ų | 131 | 96.7 Ų | 96.7 | 57% | 0.57 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -57.9 | -45.8 | 178.4 | -175.8 | -175.5 | 168.2 | -169.2 | 0 | 112.4 | A233 A234 L239 E240 E241 | A233-K237 PolarHBondContact O-N 3.48Å; A234-K237 PolarHBondContact O-N 3.48Å; K237-L239 VanDerWaalsContact C-N 3.34Å; K237-L239 PolarHBondContact O-N 3.07Å; K237-E240 PolarHBondContact O-N 3.45Å; K237-E241 WeakPolarHBondContact CE-OE1 3.29Å; K237-E241 IonicContact NZ-OE1 3.41Å; K237-E241 PolarHBondContact O-N 2.82Å |
| 238 | E | 97.7 | Very high | 97.6 | Very high | 95 Ų | 95 | 99.6 Ų | 99.6 | 44% | 0.444 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -57 | -46.6 | 175.8 | -169.9 | -160.1 | 136.2 | 0 | 0 | 111.6 | A234 K235 I236 E240 E241 D242 | A234-E238 PolarHBondContact O-N 3.28Å; K235-E238 WeakPolarHBondContact CE-OE2 3.49Å; K235-E238 IonicContact NZ-OE1 3.63Å; K235-E238 PolarHBondContact NZ-OE1 2.91Å; K235-E238 IonicContact NZ-OE2 3.21Å; K235-E238 PolarHBondContact NZ-OE2 2.96Å; K235-E238 PolarHBondContact O-N 3.4Å; I236-E238 PolarHBondContact O-N 3.13Å; E238-E240 VanDerWaalsContact C-N 3.34Å; E238-E240 PolarHBondContact O-N 3.23Å; E238-E241 PolarHBondContact O-N 2.89Å; E238-D242 PolarHBondContact O-N 3.49Å |
| 239 | L | 96.6 | Very high | 97.6 | Very high | 102 Ų | 102 | 98.3 Ų | 98.3 | 53% | 0.534 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.6 | -30.3 | 178.3 | -69.4 | 170.3 | 0 | 0 | 0 | 113 | K235 I236 K237 R243 | K235-L239 HydrophobicContact CG-CD1 4.27Å; K235-L239 VanDerWaalsContact O-CG 3.28Å; K235-L239 WeakPolarHBondContact O-CG 3.36Å; K235-L239 PolarHBondContact O-N 3.47Å; I236-L239 PolarHBondContact O-N 3.39Å; I236-L239 VanDerWaalsContact O-N 3.16Å; K237-L239 VanDerWaalsContact C-N 3.34Å; K237-L239 PolarHBondContact O-N 3.07Å; L239-R243 WeakPolarHBondContact O-CB 3.07Å; L239-R243 PolarHBondContact O-N 3.35Å |
| 240 | E | 97.2 | Very high | 97.7 | Very high | 88 Ų | 88 | 98.7 Ų | 98.7 | 41% | 0.411 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -73.4 | -41 | 173.7 | -68.7 | -150.3 | 110.9 | 0 | 0 | 112.7 | I236 K237 E238 D242 R243 V244 | I236-E240 HydrophobicContact CG2-CG 4.42Å; I236-E240 WeakPolarHBondContact O-CG 3.48Å; I236-E240 PolarHBondContact O-N 2.86Å; K237-E240 PolarHBondContact O-N 3.45Å; E238-E240 VanDerWaalsContact C-N 3.34Å; E238-E240 PolarHBondContact O-N 3.23Å; E240-D242 VanDerWaalsContact C-N 3.29Å; E240-D242 PolarHBondContact O-N 3Å; E240-R243 PolarHBondContact O-N 3.12Å; E240-R243 IonicContact OE1-CZ 2.65Å; E240-R243 IonicContact OE1-NH1 3.6Å; E240-R243 PolarHBondContact OE1-NH1 2.9Å; E240-R243 IonicContact OE1-NH2 2.74Å; E240-R243 PolarHBondContact OE1-NH2 3Å; E240-V244 WeakPolarHBondContact O-CG2 3.48Å; E240-V244 PolarHBondContact O-N 3.1Å |
| 241 | E | 97.6 | Very high | 97.8 | Very high | 118 Ų | 118 | 99.4 Ų | 99.4 | 55% | 0.551 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -60.8 | -41 | 171.9 | -72.5 | -179.4 | -176.4 | 0 | 0 | 110.6 | K237 E238 V244 R245 | K237-E241 WeakPolarHBondContact CE-OE1 3.29Å; K237-E241 IonicContact NZ-OE1 3.41Å; K237-E241 PolarHBondContact O-N 2.82Å; E238-E241 PolarHBondContact O-N 2.89Å; E241-V244 PolarHBondContact O-N 3.46Å; E241-R245 WeakPolarHBondContact O-CB 3.46Å; E241-R245 PolarHBondContact O-N 3.31Å |
| 242 | D | 97.6 | Very high | 97.8 | Very high | 52 Ų | 52 | 99 Ų | 99 | 28% | 0.278 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -69.8 | -38 | 175.5 | -116.5 | 1.9 | 0 | 0 | 0 | 113.4 | E238 E240 V244 R245 L246 | E238-D242 PolarHBondContact O-N 3.49Å; E240-D242 VanDerWaalsContact C-N 3.29Å; E240-D242 PolarHBondContact O-N 3Å; D242-V244 VanDerWaalsContact C-N 3.31Å; D242-V244 PolarHBondContact O-N 2.92Å; D242-R245 PolarHBondContact O-N 3.45Å; D242-R245 IonicContact OD1-CZ 2.71Å; D242-R245 IonicContact OD1-NE 3.24Å; D242-R245 PolarHBondContact OD1-NE 2.87Å; D242-R245 IonicContact OD1-NH2 3.69Å; D242-R245 PolarHBondContact OD1-NH2 2.71Å; D242-R245 IonicContact OD2-NH2 3.16Å; D242-R245 PolarHBondContact OD2-NH2 3.18Å; D242-L246 WeakPolarHBondContact O-CB 3.42Å; D242-L246 WeakPolarHBondContact O-CG 3.42Å; D242-L246 PolarHBondContact O-N 2.9Å |
| 243 | R | 97.8 | Very high | 97.8 | Very high | 149 Ų | 149 | 98.4 Ų | 98.4 | 56% | 0.562 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -57.2 | -44.9 | 171 | -175 | -173.7 | 71.2 | -146.3 | -7.4 | 110.8 | L239 E240 Q247 | L239-R243 WeakPolarHBondContact O-CB 3.07Å; L239-R243 PolarHBondContact O-N 3.35Å; E240-R243 PolarHBondContact O-N 3.12Å; E240-R243 IonicContact OE1-CZ 2.65Å; E240-R243 IonicContact OE1-NH1 3.6Å; E240-R243 PolarHBondContact OE1-NH1 2.9Å; E240-R243 IonicContact OE1-NH2 2.74Å; E240-R243 PolarHBondContact OE1-NH2 3Å; R243-Q247 WeakPolarHBondContact O-CB 3.46Å; R243-Q247 PolarHBondContact O-N 2.86Å |
| 244 | V | 98.3 | Very high | 97.8 | Very high | 62 Ų | 62 | 100.7 Ų | 100.7 | 38% | 0.376 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -67.9 | -38.9 | 177.5 | 171.9 | 0 | 0 | 0 | 0 | 111.6 | E240 E241 D242 R248 | E240-V244 WeakPolarHBondContact O-CG2 3.48Å; E240-V244 PolarHBondContact O-N 3.1Å; E241-V244 PolarHBondContact O-N 3.46Å; D242-V244 VanDerWaalsContact C-N 3.31Å; D242-V244 PolarHBondContact O-N 2.92Å; V244-R248 WeakPolarHBondContact O-CG 3.36Å; V244-R248 PolarHBondContact O-N 2.95Å; V244-R248 VanDerWaalsContact O-N 3.13Å |
| 245 | R | 98.3 | Very high | 97.9 | Very high | 153 Ų | 153 | 101.8 Ų | 101.8 | 58% | 0.577 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -61.6 | -49.9 | 174.6 | -174.6 | 170.2 | 69.3 | 126.3 | -5.6 | 111.4 | E241 D242 R248 T249 | E241-R245 WeakPolarHBondContact O-CB 3.46Å; E241-R245 PolarHBondContact O-N 3.31Å; D242-R245 PolarHBondContact O-N 3.45Å; D242-R245 IonicContact OD1-CZ 2.71Å; D242-R245 IonicContact OD1-NE 3.24Å; D242-R245 PolarHBondContact OD1-NE 2.87Å; D242-R245 IonicContact OD1-NH2 3.69Å; D242-R245 PolarHBondContact OD1-NH2 2.71Å; D242-R245 IonicContact OD2-NH2 3.16Å; D242-R245 PolarHBondContact OD2-NH2 3.18Å; R245-R248 PolarHBondContact O-N 3.14Å; R245-T249 PolarHBondContact O-N 2.97Å; R245-T249 VanDerWaalsContact O-N 3.17Å; R245-T249 PolarHBondContact O-OG1 2.83Å |
| 246 | L | 98 | Very high | 97.9 | Very high | 101 Ų | 101 | 101.9 Ų | 101.9 | 53% | 0.529 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.4 | -41.8 | 178 | -70.5 | 171.4 | 0 | 0 | 0 | 112.1 | D242 R248 T249 I250 | D242-L246 WeakPolarHBondContact O-CB 3.42Å; D242-L246 WeakPolarHBondContact O-CG 3.42Å; D242-L246 PolarHBondContact O-N 2.9Å; L246-R248 VanDerWaalsContact C-N 3.32Å; L246-R248 PolarHBondContact O-N 2.88Å; L246-T249 WeakPolarHBondContact O-CB 3.39Å; L246-T249 PolarHBondContact O-N 3.37Å; L246-T249 VanDerWaalsContact O-N 3.16Å; L246-I250 WeakPolarHBondContact O-CG1 3.48Å; L246-I250 PolarHBondContact O-N 2.9Å |
| 247 | Q | 98.2 | Very high | 97.9 | Very high | 96 Ų | 96 | 100.9 Ų | 100.9 | 45% | 0.449 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.8 | -40.1 | 176.8 | -170.8 | 64.3 | 62.5 | 0 | 0 | 112.2 | R243 I250 N251 | R243-Q247 WeakPolarHBondContact O-CB 3.46Å; R243-Q247 PolarHBondContact O-N 2.86Å; Q247-I250 PolarHBondContact O-N 3.4Å; Q247-N251 PolarHBondContact NE2-OD1 3.4Å; Q247-N251 PolarHBondContact O-N 3.45Å; Q247-N251 PolarHBondContact O-OD1 3.37Å; Q247-N251 VanDerWaalsContact O-OD1 3.04Å |
| 248 | R | 98.1 | Very high | 97.9 | Very high | 170 Ų | 170 | 99.5 Ų | 99.5 | 64% | 0.642 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -61.2 | -46.3 | 173.8 | -70.4 | 169.3 | -176.3 | 172.6 | 3.5 | 111.1 | V244 R245 L246 I250 N251 I252 | V244-R248 WeakPolarHBondContact O-CG 3.36Å; V244-R248 PolarHBondContact O-N 2.95Å; V244-R248 VanDerWaalsContact O-N 3.13Å; R245-R248 PolarHBondContact O-N 3.14Å; L246-R248 VanDerWaalsContact C-N 3.32Å; L246-R248 PolarHBondContact O-N 2.88Å; R248-I250 PolarHBondContact O-N 2.97Å; R248-N251 PolarHBondContact O-N 3.34Å; R248-I252 VanDerWaalsContact O-CG1 3.27Å; R248-I252 WeakPolarHBondContact O-CG1 3.48Å; R248-I252 PolarHBondContact O-N 3.37Å |
| 249 | T | 97.8 | Very high | 97.9 | Very high | 60 Ų | 60 | 102.1 Ų | 102.1 | 37% | 0.368 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.8 | -41.7 | 177.5 | -58.6 | 0 | 0 | 0 | 0 | 112.4 | R245 L246 I252 H253 | R245-T249 PolarHBondContact O-N 2.97Å; R245-T249 VanDerWaalsContact O-N 3.17Å; R245-T249 PolarHBondContact O-OG1 2.83Å; L246-T249 WeakPolarHBondContact O-CB 3.39Å; L246-T249 PolarHBondContact O-N 3.37Å; L246-T249 VanDerWaalsContact O-N 3.16Å; T249-I252 PolarHBondContact O-N 3.03Å; T249-H253 PolarHBondContact O-CD2 2.7Å; T249-H253 PolarHBondContact O-N 3.19Å |
| 250 | I | 98 | Very high | 98 | Very high | 95 Ų | 95 | 102.8 Ų | 102.8 | 49% | 0.487 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.9 | -49 | 174.9 | -70.7 | 164.8 | 0 | 0 | 0 | 110.7 | L246 Q247 R248 I252 H253 Q254 | L246-I250 WeakPolarHBondContact O-CG1 3.48Å; L246-I250 PolarHBondContact O-N 2.9Å; Q247-I250 PolarHBondContact O-N 3.4Å; R248-I250 PolarHBondContact O-N 2.97Å; I250-I252 VanDerWaalsContact C-N 3.31Å; I250-I252 PolarHBondContact O-N 3.09Å; I250-H253 PolarHBondContact O-N 3.23Å; I250-Q254 WeakPolarHBondContact O-CB 3.41Å; I250-Q254 PolarHBondContact O-N 2.74Å |
| 251 | N | 98.3 | Very high | 98 | Very high | 80 Ų | 80 | 105 Ų | 105 | 43% | 0.428 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.9 | -38.1 | 179.7 | -65.2 | 8.2 | 0 | 0 | 0 | 112 | Q247 R248 T255 | Q247-N251 PolarHBondContact NE2-OD1 3.4Å; Q247-N251 PolarHBondContact O-N 3.45Å; Q247-N251 PolarHBondContact O-OD1 3.37Å; Q247-N251 VanDerWaalsContact O-OD1 3.04Å; R248-N251 PolarHBondContact O-N 3.34Å; N251-T255 PolarHBondContact O-N 3.4Å; N251-T255 VanDerWaalsContact O-N 3.11Å; N251-T255 PolarHBondContact O-OG1 3.29Å; N251-T255 VanDerWaalsContact O-OG1 3.13Å |
| 252 | I | 98.2 | Very high | 98.1 | Very high | 103 Ų | 103 | 102.1 Ų | 102.1 | 53% | 0.528 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.1 | -49 | 175.5 | -67.4 | 167.2 | 0 | 0 | 0 | 110.7 | R248 T249 I250 Q254 T255 Q256 | R248-I252 VanDerWaalsContact O-CG1 3.27Å; R248-I252 WeakPolarHBondContact O-CG1 3.48Å; R248-I252 PolarHBondContact O-N 3.37Å; T249-I252 PolarHBondContact O-N 3.03Å; I250-I252 VanDerWaalsContact C-N 3.31Å; I250-I252 PolarHBondContact O-N 3.09Å; I252-Q254 VanDerWaalsContact C-N 3.33Å; I252-Q254 PolarHBondContact O-N 3.41Å; I252-T255 PolarHBondContact O-N 2.99Å; I252-T255 PolarHBondContact O-OG1 3.33Å; I252-Q256 WeakPolarHBondContact O-CB 3.42Å; I252-Q256 PolarHBondContact O-N 3.49Å |
| 253 | H | 98 | Very high | 98.1 | Very high | 99 Ų | 99 | 104.1 Ų | 104.1 | 46% | 0.458 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.8 | -32.6 | 178.3 | -69.3 | -40.9 | 0 | 0 | 0 | 113.1 | T249 I250 Q256 T257 | T249-H253 PolarHBondContact O-CD2 2.7Å; T249-H253 PolarHBondContact O-N 3.19Å; I250-H253 PolarHBondContact O-N 3.23Å; H253-Q256 PolarHBondContact ND1-OE1 3.24Å; H253-Q256 PolarHBondContact O-N 3.49Å; H253-T257 WeakPolarHBondContact O-CB 3.31Å; H253-T257 PolarHBondContact O-N 2.96Å; H253-T257 PolarHBondContact O-OG1 2.78Å |
| 254 | Q | 98.2 | Very high | 98.1 | Very high | 103 Ų | 103 | 99.6 Ų | 99.6 | 48% | 0.481 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.4 | -55.7 | 172.9 | 178.7 | 174.7 | -12.1 | 0 | 0 | 111 | I250 I252 Q256 T257 E258 | I250-Q254 WeakPolarHBondContact O-CB 3.41Å; I250-Q254 PolarHBondContact O-N 2.74Å; I252-Q254 VanDerWaalsContact C-N 3.33Å; I252-Q254 PolarHBondContact O-N 3.41Å; Q254-Q256 VanDerWaalsContact C-N 3.26Å; Q254-Q256 PolarHBondContact O-N 2.93Å; Q254-T257 WeakPolarHBondContact O-CB 3.47Å; Q254-T257 PolarHBondContact O-N 3.29Å; Q254-E258 HydrophobicContact CG-CG 4.47Å; Q254-E258 VanDerWaalsContact CG-OE1 3.25Å; Q254-E258 WeakPolarHBondContact CG-OE1 3.28Å; Q254-E258 PolarHBondContact NE2-OE1 3.37Å; Q254-E258 WeakPolarHBondContact O-CG 3.27Å; Q254-E258 PolarHBondContact O-N 2.71Å |
| 255 | T | 98.1 | Very high | 98.1 | Very high | 85 Ų | 85 | 100.5 Ų | 100.5 | 52% | 0.521 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.7 | -33.5 | 179 | 54.5 | 0 | 0 | 0 | 0 | 112.8 | N251 I252 K259 | N251-T255 PolarHBondContact O-N 3.4Å; N251-T255 VanDerWaalsContact O-N 3.11Å; N251-T255 PolarHBondContact O-OG1 3.29Å; N251-T255 VanDerWaalsContact O-OG1 3.13Å; I252-T255 PolarHBondContact O-N 2.99Å; I252-T255 PolarHBondContact O-OG1 3.33Å; T255-K259 WeakPolarHBondContact O-CB 3.32Å; T255-K259 PolarHBondContact O-N 2.98Å |
| 256 | Q | 98.3 | Very high | 98.1 | Very high | 93 Ų | 93 | 99.2 Ų | 99.2 | 44% | 0.435 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.5 | -42.8 | 171.6 | -175 | 178.5 | 8 | 0 | 0 | 112.2 | I252 H253 Q254 K259 Q260 | I252-Q256 WeakPolarHBondContact O-CB 3.42Å; I252-Q256 PolarHBondContact O-N 3.49Å; H253-Q256 PolarHBondContact ND1-OE1 3.24Å; H253-Q256 PolarHBondContact O-N 3.49Å; Q254-Q256 VanDerWaalsContact C-N 3.26Å; Q254-Q256 PolarHBondContact O-N 2.93Å; Q256-K259 PolarHBondContact O-N 2.76Å; Q256-Q260 WeakPolarHBondContact O-CG 3.46Å; Q256-Q260 PolarHBondContact O-N 3.47Å |
| 257 | T | 97.6 | Very high | 98 | Very high | 84 Ų | 84 | 97.6 Ų | 97.6 | 52% | 0.515 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.9 | -44.2 | 178.3 | -59.6 | 0 | 0 | 0 | 0 | 111.2 | H253 Q254 Q260 K261 | H253-T257 WeakPolarHBondContact O-CB 3.31Å; H253-T257 PolarHBondContact O-N 2.96Å; H253-T257 PolarHBondContact O-OG1 2.78Å; Q254-T257 WeakPolarHBondContact O-CB 3.47Å; Q254-T257 PolarHBondContact O-N 3.29Å; T257-Q260 PolarHBondContact O-N 3.36Å; T257-K261 WeakPolarHBondContact O-CB 3.46Å; T257-K261 PolarHBondContact O-N 2.86Å |
| 258 | E | 98.3 | Very high | 98 | Very high | 102 Ų | 102 | 95.3 Ų | 95.3 | 48% | 0.477 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.4 | -43.2 | 175.6 | -71 | 169.3 | -176 | 0 | 0 | 111.4 | Q254 K261 A262 | Q254-E258 HydrophobicContact CG-CG 4.47Å; Q254-E258 VanDerWaalsContact CG-OE1 3.25Å; Q254-E258 WeakPolarHBondContact CG-OE1 3.28Å; Q254-E258 PolarHBondContact NE2-OE1 3.37Å; Q254-E258 WeakPolarHBondContact O-CG 3.27Å; Q254-E258 PolarHBondContact O-N 2.71Å; E258-K261 PolarHBondContact O-N 2.93Å; E258-A262 WeakPolarHBondContact O-CB 3.38Å; E258-A262 PolarHBondContact O-N 3.48Å |
| 259 | K | 98.4 | Very high | 98.1 | Very high | 149 Ų | 149 | 94.3 Ų | 94.3 | 65% | 0.648 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62.7 | -44.6 | 174.1 | -177.7 | 177.7 | 179.2 | 179.3 | 0 | 112.6 | T255 Q256 K261 A262 L263 | T255-K259 WeakPolarHBondContact O-CB 3.32Å; T255-K259 PolarHBondContact O-N 2.98Å; Q256-K259 PolarHBondContact O-N 2.76Å; K259-K261 VanDerWaalsContact C-N 3.35Å; K259-A262 PolarHBondContact O-N 3.41Å; K259-L263 HydrophobicContact CG-CD1 4.3Å; K259-L263 WeakPolarHBondContact O-CG 3.34Å; K259-L263 PolarHBondContact O-N 3.08Å; K259-L263 VanDerWaalsContact O-N 3.12Å |
| 260 | Q | 97.6 | Very high | 98.1 | Very high | 117 Ų | 117 | 98.2 Ų | 98.2 | 55% | 0.547 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.6 | -39.9 | 177.3 | -75.9 | 177.6 | -13.2 | 0 | 0 | 111.7 | Q256 T257 L263 A264 | Q256-Q260 WeakPolarHBondContact O-CG 3.46Å; Q256-Q260 PolarHBondContact O-N 3.47Å; T257-Q260 PolarHBondContact O-N 3.36Å; Q260-L263 PolarHBondContact O-N 2.99Å; Q260-A264 WeakPolarHBondContact O-CB 3.45Å; Q260-A264 PolarHBondContact O-N 2.93Å |
| 261 | K | 98.4 | Very high | 98.1 | Very high | 133 Ų | 133 | 97.5 Ų | 97.5 | 58% | 0.578 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.5 | -44.5 | 174.3 | -175.9 | -178 | 172.7 | -169.1 | 0 | 111.9 | T257 E258 K259 L263 A264 E265 | T257-K261 WeakPolarHBondContact O-CB 3.46Å; T257-K261 PolarHBondContact O-N 2.86Å; E258-K261 PolarHBondContact O-N 2.93Å; K259-K261 VanDerWaalsContact C-N 3.35Å; K261-L263 PolarHBondContact O-N 3.35Å; K261-A264 WeakPolarHBondContact O-CB 3.22Å; K261-A264 PolarHBondContact O-N 2.86Å; K261-E265 WeakPolarHBondContact CE-OE1 3.37Å; K261-E265 IonicContact NZ-OE1 2.7Å; K261-E265 PolarHBondContact O-N 3.08Å |
| 262 | A | 98.3 | Very high | 98.1 | Very high | 58 Ų | 58 | 98.3 Ų | 98.3 | 48% | 0.479 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.2 | -44 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | E258 K259 A264 E265 E266 | E258-A262 WeakPolarHBondContact O-CB 3.38Å; E258-A262 PolarHBondContact O-N 3.48Å; K259-A262 PolarHBondContact O-N 3.41Å; A262-A264 VanDerWaalsContact C-N 3.35Å; A262-A264 PolarHBondContact O-N 3.37Å; A262-E265 PolarHBondContact O-N 3.28Å; A262-E266 WeakPolarHBondContact O-CB 3.43Å; A262-E266 PolarHBondContact O-N 3.2Å |
| 263 | L | 98.1 | Very high | 98.1 | Very high | 94 Ų | 94 | 98.4 Ų | 98.4 | 49% | 0.492 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66 | -34.6 | 175.7 | -69.5 | 168.1 | 0 | 0 | 0 | 112.6 | K259 Q260 K261 S267 | K259-L263 HydrophobicContact CG-CD1 4.3Å; K259-L263 WeakPolarHBondContact O-CG 3.34Å; K259-L263 PolarHBondContact O-N 3.08Å; K259-L263 VanDerWaalsContact O-N 3.12Å; Q260-L263 PolarHBondContact O-N 2.99Å; K261-L263 PolarHBondContact O-N 3.35Å; L263-S267 WeakPolarHBondContact O-CB 3.41Å; L263-S267 PolarHBondContact O-N 2.86Å; L263-S267 PolarHBondContact O-OG 3.18Å |
| 264 | A | 97.6 | Very high | 98.1 | Very high | 55 Ų | 55 | 97.8 Ų | 97.8 | 46% | 0.455 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -67 | -43.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q260 K261 A262 S267 A268 | Q260-A264 WeakPolarHBondContact O-CB 3.45Å; Q260-A264 PolarHBondContact O-N 2.93Å; K261-A264 WeakPolarHBondContact O-CB 3.22Å; K261-A264 PolarHBondContact O-N 2.86Å; A262-A264 VanDerWaalsContact C-N 3.35Å; A262-A264 PolarHBondContact O-N 3.37Å; A264-S267 PolarHBondContact O-OG 2.96Å; A264-S267 VanDerWaalsContact O-OG 3.08Å; A264-A268 VanDerWaalsContact O-CB 3.32Å; A264-A268 WeakPolarHBondContact O-CB 3.31Å; A264-A268 PolarHBondContact O-N 3.44Å |
| 265 | E | 98.3 | Very high | 98.1 | Very high | 81 Ų | 81 | 99.1 Ų | 99.1 | 38% | 0.379 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.9 | -38.8 | 175.2 | -73.2 | -174.5 | -150.3 | 0 | 0 | 112.9 | K261 A262 R269 | K261-E265 WeakPolarHBondContact CE-OE1 3.37Å; K261-E265 IonicContact NZ-OE1 2.7Å; K261-E265 PolarHBondContact O-N 3.08Å; A262-E265 PolarHBondContact O-N 3.28Å; E265-R269 VanDerWaalsContact O-CG 3.28Å; E265-R269 WeakPolarHBondContact O-CG 3.25Å; E265-R269 PolarHBondContact O-N 2.92Å; E265-R269 VanDerWaalsContact O-N 3.07Å; E265-R269 IonicContact OE2-NH2 3.6Å; E265-R269 PolarHBondContact OE2-NH2 3.39Å |
| 266 | E | 98.3 | Very high | 98.2 | Very high | 126 Ų | 126 | 100.7 Ų | 100.7 | 59% | 0.589 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.9 | -46.5 | 175.9 | -173.8 | -177.5 | 175.6 | 0 | 0 | 111.5 | A262 A268 R269 K270 | A262-E266 WeakPolarHBondContact O-CB 3.43Å; A262-E266 PolarHBondContact O-N 3.2Å; E266-A268 PolarHBondContact O-N 2.86Å; E266-R269 PolarHBondContact O-N 2.95Å; E266-K270 PolarHBondContact O-N 2.69Å |
| 267 | S | 97 | Very high | 98.2 | Very high | 66 Ų | 66 | 101.7 Ų | 101.7 | 46% | 0.462 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -66.7 | -36 | 177.9 | 59.6 | 0 | 0 | 0 | 0 | 112.6 | L263 A264 K270 C271 | L263-S267 WeakPolarHBondContact O-CB 3.41Å; L263-S267 PolarHBondContact O-N 2.86Å; L263-S267 PolarHBondContact O-OG 3.18Å; A264-S267 PolarHBondContact O-OG 2.96Å; A264-S267 VanDerWaalsContact O-OG 3.08Å; S267-K270 PolarHBondContact O-N 2.92Å; S267-C271 PolarHBondContact O-N 3.25Å; S267-C271 PolarHBondContact O-SG 2.76Å; S267-C271 VanDerWaalsContact O-SG 3.4Å |
| 268 | A | 98.4 | Very high | 98.2 | Very high | 49 Ų | 49 | 101.3 Ų | 101.3 | 41% | 0.405 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.8 | -49.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | A264 E266 K270 C271 D272 | A264-A268 VanDerWaalsContact O-CB 3.32Å; A264-A268 WeakPolarHBondContact O-CB 3.31Å; A264-A268 PolarHBondContact O-N 3.44Å; E266-A268 PolarHBondContact O-N 2.86Å; A268-K270 VanDerWaalsContact C-N 3.29Å; A268-K270 PolarHBondContact O-N 2.97Å; A268-C271 WeakPolarHBondContact O-CA 3.35Å; A268-C271 WeakPolarHBondContact O-CB 3.36Å; A268-C271 PolarHBondContact O-N 2.88Å; A268-D272 PolarHBondContact O-N 2.97Å |
| 269 | R | 98.4 | Very high | 98.2 | Very high | 149 Ų | 149 | 98.9 Ų | 98.9 | 56% | 0.562 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -58.4 | -41.8 | 176.3 | -68.1 | 169.3 | -155 | -179.2 | 8.8 | 111.7 | E265 E266 C271 D272 D273 | E265-R269 VanDerWaalsContact O-CG 3.28Å; E265-R269 WeakPolarHBondContact O-CG 3.25Å; E265-R269 PolarHBondContact O-N 2.92Å; E265-R269 VanDerWaalsContact O-N 3.07Å; E265-R269 IonicContact OE2-NH2 3.6Å; E265-R269 PolarHBondContact OE2-NH2 3.39Å; E266-R269 PolarHBondContact O-N 2.95Å; R269-C271 VanDerWaalsContact C-N 3.31Å; R269-C271 PolarHBondContact O-N 2.83Å; R269-D272 PolarHBondContact O-N 3.21Å; R269-D273 PolarHBondContact O-N 3.36Å |
| 270 | K | 98.5 | Very high | 98.2 | Very high | 141 Ų | 141 | 94.5 Ų | 94.5 | 61% | 0.613 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.5 | -35.3 | 176 | -172.1 | 175 | -178.4 | 176.8 | 0 | 112.6 | E266 S267 A268 L274 | E266-K270 PolarHBondContact O-N 2.69Å; S267-K270 PolarHBondContact O-N 2.92Å; A268-K270 VanDerWaalsContact C-N 3.29Å; A268-K270 PolarHBondContact O-N 2.97Å; K270-L274 HydrophobicContact CG-CD1 4.26Å; K270-L274 WeakPolarHBondContact O-CB 3.32Å; K270-L274 WeakPolarHBondContact O-CD1 3.38Å; K270-L274 VanDerWaalsContact O-CG 3.23Å; K270-L274 WeakPolarHBondContact O-CG 3.44Å; K270-L274 PolarHBondContact O-N 3.03Å; K270-L274 VanDerWaalsContact O-N 3.08Å |
| 271 | C | 97.8 | Very high | 98.2 | Very high | 80 Ų | 80 | 93.2 Ų | 93.2 | 54% | 0.541 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.5 | -43.6 | 171.9 | -73.8 | 0 | 0 | 0 | 0 | 112 | S267 A268 R269 L274 Q275 | S267-C271 PolarHBondContact O-N 3.25Å; S267-C271 PolarHBondContact O-SG 2.76Å; S267-C271 VanDerWaalsContact O-SG 3.4Å; A268-C271 WeakPolarHBondContact O-CA 3.35Å; A268-C271 WeakPolarHBondContact O-CB 3.36Å; A268-C271 PolarHBondContact O-N 2.88Å; R269-C271 VanDerWaalsContact C-N 3.31Å; R269-C271 PolarHBondContact O-N 2.83Å; C271-L274 PolarHBondContact O-N 3.38Å; C271-Q275 WeakPolarHBondContact O-CB 3.42Å; C271-Q275 PolarHBondContact O-N 3.5Å |
| 272 | D | 98.4 | Very high | 98.2 | Very high | 98 Ų | 98 | 91.4 Ų | 91.4 | 52% | 0.524 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.3 | -46.9 | 176.2 | -68.1 | -30.1 | 0 | 0 | 0 | 111.5 | A268 R269 L274 Q275 L276 | A268-D272 PolarHBondContact O-N 2.97Å; R269-D272 PolarHBondContact O-N 3.21Å; D272-L274 PolarHBondContact O-N 2.91Å; D272-Q275 PolarHBondContact O-N 3.07Å; D272-L276 WeakPolarHBondContact O-CG 3.25Å; D272-L276 PolarHBondContact O-N 3.05Å |
| 273 | D | 98.4 | Very high | 98.3 | Very high | 105 Ų | 105 | 95.2 Ų | 95.2 | 56% | 0.561 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -60.3 | -44.1 | 177.2 | -75.5 | -31.1 | 0 | 0 | 0 | 112.2 | R269 L276 Q277 | R269-D273 PolarHBondContact O-N 3.36Å; D273-L276 PolarHBondContact O-N 3.44Å; D273-Q277 PolarHBondContact O-N 3.5Å |
| 274 | L | 98.4 | Very high | 98.3 | Very high | 86 Ų | 86 | 96 Ų | 96 | 45% | 0.45 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.4 | -38.4 | 174.7 | -74 | 169.9 | 0 | 0 | 0 | 111.8 | K270 C271 D272 L276 Q277 V278 | K270-L274 HydrophobicContact CG-CD1 4.26Å; K270-L274 WeakPolarHBondContact O-CB 3.32Å; K270-L274 WeakPolarHBondContact O-CD1 3.38Å; K270-L274 VanDerWaalsContact O-CG 3.23Å; K270-L274 WeakPolarHBondContact O-CG 3.44Å; K270-L274 PolarHBondContact O-N 3.03Å; K270-L274 VanDerWaalsContact O-N 3.08Å; C271-L274 PolarHBondContact O-N 3.38Å; D272-L274 PolarHBondContact O-N 2.91Å; L274-L276 VanDerWaalsContact C-N 3.35Å; L274-Q277 PolarHBondContact O-N 3.37Å; L274-V278 WeakPolarHBondContact O-CB 3.42Å; L274-V278 WeakPolarHBondContact O-CG2 3.49Å; L274-V278 PolarHBondContact O-N 2.97Å |
| 275 | Q | 98.4 | Very high | 98.3 | Very high | 130 Ų | 130 | 97.4 Ų | 97.4 | 61% | 0.607 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -68.1 | -34.8 | 176.7 | -172.8 | 166.4 | 1.5 | 0 | 0 | 111.9 | C271 D272 S279 | C271-Q275 WeakPolarHBondContact O-CB 3.42Å; C271-Q275 PolarHBondContact O-N 3.5Å; D272-Q275 PolarHBondContact O-N 3.07Å; Q275-S279 VanDerWaalsContact O-CB 3.24Å; Q275-S279 WeakPolarHBondContact O-CB 3.42Å; Q275-S279 PolarHBondContact O-N 3.17Å; Q275-S279 PolarHBondContact O-OG 3.42Å |
| 276 | L | 98.4 | Very high | 98.3 | Very high | 119 Ų | 119 | 98.2 Ų | 98.2 | 62% | 0.623 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.4 | -44.1 | 169.9 | -71.6 | 173.3 | 0 | 0 | 0 | 111.6 | D272 D273 L274 S279 A280 | D272-L276 WeakPolarHBondContact O-CG 3.25Å; D272-L276 PolarHBondContact O-N 3.05Å; D273-L276 PolarHBondContact O-N 3.44Å; L274-L276 VanDerWaalsContact C-N 3.35Å; L276-S279 CarbonylContact O-C 3.59Å; L276-S279 WeakPolarHBondContact O-CB 3.42Å; L276-S279 PolarHBondContact O-N 2.98Å; L276-A280 PolarHBondContact O-N 3.34Å |
| 277 | Q | 98.5 | Very high | 98.3 | Very high | 113 Ų | 113 | 96 Ų | 96 | 53% | 0.528 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.5 | -47.1 | 176.9 | -173.9 | 178.5 | 65.1 | 0 | 0 | 111.9 | D273 L274 S279 A280 L281 | D273-Q277 PolarHBondContact O-N 3.5Å; L274-Q277 PolarHBondContact O-N 3.37Å; Q277-S279 VanDerWaalsContact C-N 3.27Å; Q277-S279 PolarHBondContact O-N 2.9Å; Q277-A280 WeakPolarHBondContact O-CB 3.45Å; Q277-A280 PolarHBondContact O-N 3.2Å; Q277-A280 VanDerWaalsContact O-N 3.08Å; Q277-L281 HydrophobicContact CG-CD1 4.09Å; Q277-L281 HydrophobicContact CG-CG 4.5Å; Q277-L281 WeakPolarHBondContact O-CG 3.39Å; Q277-L281 PolarHBondContact O-N 2.79Å |
| 278 | V | 98.4 | Very high | 98.4 | Very high | 77 Ų | 77 | 97.6 Ų | 97.6 | 47% | 0.467 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.9 | -38.4 | 173.6 | 169.1 | 0 | 0 | 0 | 0 | 111 | L274 A280 N282 | L274-V278 WeakPolarHBondContact O-CB 3.42Å; L274-V278 WeakPolarHBondContact O-CG2 3.49Å; L274-V278 PolarHBondContact O-N 2.97Å; V278-A280 VanDerWaalsContact C-N 3.31Å; V278-A280 PolarHBondContact O-N 3.4Å; V278-N282 WeakPolarHBondContact CG1-ND2 3.23Å; V278-N282 WeakPolarHBondContact O-CB 3.3Å; V278-N282 PolarHBondContact O-N 3Å; V278-N282 PolarHBondContact O-ND2 2.87Å |
| 279 | S | 98.4 | Very high | 98.4 | Very high | 51 Ų | 51 | 97.7 Ų | 97.7 | 36% | 0.357 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -70 | -23.4 | 175.9 | -61.7 | 0 | 0 | 0 | 0 | 113.9 | Q275 L276 Q277 K283 | Q275-S279 VanDerWaalsContact O-CB 3.24Å; Q275-S279 WeakPolarHBondContact O-CB 3.42Å; Q275-S279 PolarHBondContact O-N 3.17Å; Q275-S279 PolarHBondContact O-OG 3.42Å; L276-S279 CarbonylContact O-C 3.59Å; L276-S279 WeakPolarHBondContact O-CB 3.42Å; L276-S279 PolarHBondContact O-N 2.98Å; Q277-S279 VanDerWaalsContact C-N 3.27Å; Q277-S279 PolarHBondContact O-N 2.9Å; S279-K283 VanDerWaalsContact O-CD 3.3Å; S279-K283 WeakPolarHBondContact O-CD 3.47Å; S279-K283 WeakPolarHBondContact O-CE 3.26Å; S279-K283 WeakPolarHBondContact O-CG 3.48Å |
| 280 | A | 98.5 | Very high | 98.4 | Very high | 57 Ų | 57 | 97.6 Ų | 97.6 | 47% | 0.471 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -80.4 | -50.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | L276 Q277 V278 N282 K283 E284 | L276-A280 PolarHBondContact O-N 3.34Å; Q277-A280 WeakPolarHBondContact O-CB 3.45Å; Q277-A280 PolarHBondContact O-N 3.2Å; Q277-A280 VanDerWaalsContact O-N 3.08Å; V278-A280 VanDerWaalsContact C-N 3.31Å; V278-A280 PolarHBondContact O-N 3.4Å; A280-N282 VanDerWaalsContact C-N 3.32Å; A280-N282 PolarHBondContact O-N 2.92Å; A280-K283 WeakPolarHBondContact O-CB 3.44Å; A280-K283 PolarHBondContact O-N 2.96Å; A280-E284 PolarHBondContact O-N 2.7Å; A280-E284 VanDerWaalsContact O-N 3.09Å |
| 281 | L | 98.4 | Very high | 98.4 | Very high | 90 Ų | 90 | 93.7 Ų | 93.7 | 47% | 0.471 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.4 | -39.9 | 178.9 | -70 | 171.3 | 0 | 0 | 0 | 112.2 | Q277 K283 E284 V285 | Q277-L281 HydrophobicContact CG-CD1 4.09Å; Q277-L281 HydrophobicContact CG-CG 4.5Å; Q277-L281 WeakPolarHBondContact O-CG 3.39Å; Q277-L281 PolarHBondContact O-N 2.79Å; L281-K283 VanDerWaalsContact C-N 3.31Å; L281-K283 PolarHBondContact O-N 3.46Å; L281-E284 PolarHBondContact O-N 3.34Å; L281-V285 WeakPolarHBondContact O-CG2 3.37Å; L281-V285 PolarHBondContact O-N 2.76Å |
| 282 | N | 98.3 | Very high | 98.4 | Very high | 94 Ų | 94 | 96.3 Ų | 96.3 | 50% | 0.503 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.9 | -39.1 | 174.2 | -82 | -53.9 | 0 | 0 | 0 | 112.6 | V278 A280 V285 E286 | V278-N282 WeakPolarHBondContact CG1-ND2 3.23Å; V278-N282 WeakPolarHBondContact O-CB 3.3Å; V278-N282 PolarHBondContact O-N 3Å; V278-N282 PolarHBondContact O-ND2 2.87Å; A280-N282 VanDerWaalsContact C-N 3.32Å; A280-N282 PolarHBondContact O-N 2.92Å; N282-V285 PolarHBondContact O-N 3Å; N282-E286 WeakPolarHBondContact O-CG 3.34Å; N282-E286 PolarHBondContact O-N 2.94Å |
| 283 | K | 98.6 | Very high | 98.4 | Very high | 139 Ų | 139 | 98.5 Ų | 98.5 | 60% | 0.604 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67.6 | -37.1 | 176.7 | -67.8 | 166.7 | -173 | 167.8 | 0 | 111.7 | S279 A280 L281 E286 T287 | S279-K283 VanDerWaalsContact O-CD 3.3Å; S279-K283 WeakPolarHBondContact O-CD 3.47Å; S279-K283 WeakPolarHBondContact O-CE 3.26Å; S279-K283 WeakPolarHBondContact O-CG 3.48Å; A280-K283 WeakPolarHBondContact O-CB 3.44Å; A280-K283 PolarHBondContact O-N 2.96Å; L281-K283 VanDerWaalsContact C-N 3.31Å; L281-K283 PolarHBondContact O-N 3.46Å; K283-E286 PolarHBondContact O-N 3.32Å; K283-T287 WeakPolarHBondContact O-CG2 3.47Å; K283-T287 PolarHBondContact O-N 3.44Å; K283-T287 PolarHBondContact O-OG1 3Å |
| 284 | E | 98.3 | Very high | 98.4 | Very high | 109 Ų | 109 | 99.6 Ų | 99.6 | 51% | 0.509 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -67 | -44.3 | 174.6 | -173.9 | 172.1 | -169.2 | 0 | 0 | 111.9 | A280 L281 E286 T287 L288 | A280-E284 PolarHBondContact O-N 2.7Å; A280-E284 VanDerWaalsContact O-N 3.09Å; L281-E284 PolarHBondContact O-N 3.34Å; E284-E286 VanDerWaalsContact C-N 3.28Å; E284-E286 PolarHBondContact O-N 2.87Å; E284-T287 WeakPolarHBondContact CA-OG1 3.46Å; E284-T287 PolarHBondContact O-N 3.18Å; E284-T287 VanDerWaalsContact O-N 3.14Å; E284-T287 PolarHBondContact O-OG1 3.43Å; E284-L288 HydrophobicContact CG-CD1 4.06Å; E284-L288 HydrophobicContact CG-CG 4.42Å; E284-L288 WeakPolarHBondContact O-CB 3.34Å; E284-L288 VanDerWaalsContact O-CG 3.31Å; E284-L288 WeakPolarHBondContact O-CG 3.38Å; E284-L288 PolarHBondContact O-N 2.82Å |
| 285 | V | 98.3 | Very high | 98.4 | Very high | 86 Ų | 86 | 98.1 Ų | 98.1 | 52% | 0.521 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -58.7 | -40.1 | 172.6 | 170.6 | 0 | 0 | 0 | 0 | 111.1 | L281 N282 T289 | L281-V285 WeakPolarHBondContact O-CG2 3.37Å; L281-V285 PolarHBondContact O-N 2.76Å; N282-V285 PolarHBondContact O-N 3Å; V285-T289 VanDerWaalsContact O-CB 3.25Å; V285-T289 WeakPolarHBondContact O-CB 3.46Å; V285-T289 PolarHBondContact O-N 3.46Å; V285-T289 PolarHBondContact O-OG1 3.31Å |
| 286 | E | 98.4 | Very high | 98.4 | Very high | 98 Ų | 98 | 94.9 Ų | 94.9 | 46% | 0.458 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.5 | -41.6 | 173.6 | -71.5 | -172.1 | -173.4 | 0 | 0 | 113.4 | N282 K283 E284 T289 R290 | N282-E286 WeakPolarHBondContact O-CG 3.34Å; N282-E286 PolarHBondContact O-N 2.94Å; K283-E286 PolarHBondContact O-N 3.32Å; E284-E286 VanDerWaalsContact C-N 3.28Å; E284-E286 PolarHBondContact O-N 2.87Å; E286-T289 PolarHBondContact O-N 3.43Å; E286-R290 VanDerWaalsContact CB-NH1 3.31Å; E286-R290 VanDerWaalsContact O-CG 3.26Å; E286-R290 WeakPolarHBondContact O-CG 3.38Å; E286-R290 PolarHBondContact O-N 3.12Å; E286-R290 IonicContact OE2-CZ 2.99Å; E286-R290 IonicContact OE2-NH1 2.66Å; E286-R290 PolarHBondContact OE2-NH1 3.38Å; E286-R290 IonicContact OE2-NH2 2.68Å; E286-R290 PolarHBondContact OE2-NH2 2.93Å |
| 287 | T | 98.4 | Very high | 98.4 | Very high | 79 Ų | 79 | 96.2 Ų | 96.2 | 49% | 0.485 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -69.2 | -40 | 179.5 | 54.4 | 0 | 0 | 0 | 0 | 111.6 | K283 E284 R290 S291 | K283-T287 WeakPolarHBondContact O-CG2 3.47Å; K283-T287 PolarHBondContact O-N 3.44Å; K283-T287 PolarHBondContact O-OG1 3Å; E284-T287 WeakPolarHBondContact CA-OG1 3.46Å; E284-T287 PolarHBondContact O-N 3.18Å; E284-T287 VanDerWaalsContact O-N 3.14Å; E284-T287 PolarHBondContact O-OG1 3.43Å; T287-R290 PolarHBondContact O-N 3.08Å; T287-S291 PolarHBondContact O-N 3.49Å; T287-S291 PolarHBondContact O-OG 2.95Å |
| 288 | L | 98.3 | Very high | 98.4 | Very high | 99 Ų | 99 | 95.1 Ų | 95.1 | 52% | 0.518 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.4 | -41.5 | 171.5 | -68 | 173.2 | 0 | 0 | 0 | 111.7 | E284 R290 S291 Q292 | E284-L288 HydrophobicContact CG-CD1 4.06Å; E284-L288 HydrophobicContact CG-CG 4.42Å; E284-L288 WeakPolarHBondContact O-CB 3.34Å; E284-L288 VanDerWaalsContact O-CG 3.31Å; E284-L288 WeakPolarHBondContact O-CG 3.38Å; E284-L288 PolarHBondContact O-N 2.82Å; L288-R290 VanDerWaalsContact C-N 3.3Å; L288-R290 PolarHBondContact O-N 3.38Å; L288-S291 PolarHBondContact O-N 2.93Å; L288-S291 PolarHBondContact O-OG 3.12Å; L288-S291 VanDerWaalsContact O-OG 3.07Å; L288-Q292 VanDerWaalsContact O-CB 3.25Å; L288-Q292 WeakPolarHBondContact O-CB 3.44Å; L288-Q292 PolarHBondContact O-N 3.4Å |
| 289 | T | 98.6 | Very high | 98.4 | Very high | 51 Ų | 51 | 97.2 Ų | 97.2 | 31% | 0.313 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.7 | -35.3 | 174.8 | -61 | 0 | 0 | 0 | 0 | 112 | V285 E286 K293 | V285-T289 VanDerWaalsContact O-CB 3.25Å; V285-T289 WeakPolarHBondContact O-CB 3.46Å; V285-T289 PolarHBondContact O-N 3.46Å; V285-T289 PolarHBondContact O-OG1 3.31Å; E286-T289 PolarHBondContact O-N 3.43Å; T289-K293 HydrophobicContact CG2-CD 4.36Å; T289-K293 WeakPolarHBondContact O-CD 3.35Å; T289-K293 VanDerWaalsContact O-CG 3.3Å; T289-K293 WeakPolarHBondContact O-CG 3.3Å; T289-K293 PolarHBondContact O-N 3.29Å |
| 290 | R | 98.5 | Very high | 98.4 | Very high | 147 Ų | 147 | 97.9 Ų | 97.9 | 56% | 0.555 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -70.4 | -45.8 | 175.4 | -73 | 168.3 | -176.2 | 121.1 | 8.2 | 111.5 | E286 T287 L288 K293 Q294 | E286-R290 VanDerWaalsContact CB-NH1 3.31Å; E286-R290 VanDerWaalsContact O-CG 3.26Å; E286-R290 WeakPolarHBondContact O-CG 3.38Å; E286-R290 PolarHBondContact O-N 3.12Å; E286-R290 IonicContact OE2-CZ 2.99Å; E286-R290 IonicContact OE2-NH1 2.66Å; E286-R290 PolarHBondContact OE2-NH1 3.38Å; E286-R290 IonicContact OE2-NH2 2.68Å; E286-R290 PolarHBondContact OE2-NH2 2.93Å; T287-R290 PolarHBondContact O-N 3.08Å; L288-R290 VanDerWaalsContact C-N 3.3Å; L288-R290 PolarHBondContact O-N 3.38Å; R290-K293 PolarHBondContact O-N 3.47Å; R290-Q294 PolarHBondContact O-N 3.03Å; R290-Q294 VanDerWaalsContact O-N 3.1Å |
| 291 | S | 98.3 | Very high | 98.4 | Very high | 59 Ų | 59 | 97.5 Ų | 97.5 | 41% | 0.413 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -68.2 | -37.8 | 179.2 | 67.1 | 0 | 0 | 0 | 0 | 112.2 | T287 L288 K293 Q294 A295 | T287-S291 PolarHBondContact O-N 3.49Å; T287-S291 PolarHBondContact O-OG 2.95Å; L288-S291 PolarHBondContact O-N 2.93Å; L288-S291 PolarHBondContact O-OG 3.12Å; L288-S291 VanDerWaalsContact O-OG 3.07Å; S291-K293 PolarHBondContact O-N 2.9Å; S291-Q294 PolarHBondContact O-N 3.21Å; S291-A295 WeakPolarHBondContact O-CB 3.24Å; S291-A295 PolarHBondContact O-N 2.97Å |
| 292 | Q | 98.2 | Very high | 98.4 | Very high | 135 Ų | 135 | 97.2 Ų | 97.2 | 63% | 0.631 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -58.7 | -45 | 173.1 | -172.2 | -169.9 | 26.3 | 0 | 0 | 111.7 | L288 Q294 A295 A296 | L288-Q292 VanDerWaalsContact O-CB 3.25Å; L288-Q292 WeakPolarHBondContact O-CB 3.44Å; L288-Q292 PolarHBondContact O-N 3.4Å; Q292-Q294 PolarHBondContact O-N 2.95Å; Q292-A295 PolarHBondContact O-N 2.79Å; Q292-A296 WeakPolarHBondContact O-CB 3.38Å; Q292-A296 PolarHBondContact O-N 3.35Å |
| 293 | K | 98.6 | Very high | 98.4 | Very high | 144 Ų | 144 | 96.9 Ų | 96.9 | 63% | 0.626 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.6 | -39.8 | 176.6 | -74.7 | 169.6 | -178.6 | 173.5 | 0 | 112.2 | T289 R290 S291 F297 | T289-K293 HydrophobicContact CG2-CD 4.36Å; T289-K293 WeakPolarHBondContact O-CD 3.35Å; T289-K293 VanDerWaalsContact O-CG 3.3Å; T289-K293 WeakPolarHBondContact O-CG 3.3Å; T289-K293 PolarHBondContact O-N 3.29Å; R290-K293 PolarHBondContact O-N 3.47Å; S291-K293 PolarHBondContact O-N 2.9Å; K293-F297 PolarHBondContact O-N 3.03Å; K293-F297 VanDerWaalsContact O-N 3.12Å |
| 294 | Q | 98.4 | Very high | 98.4 | Very high | 128 Ų | 128 | 95 Ų | 95 | 60% | 0.598 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.4 | -43.5 | 174.4 | -172.7 | 178.7 | 4.9 | 0 | 0 | 111.7 | R290 S291 Q292 F297 I298 | R290-Q294 PolarHBondContact O-N 3.03Å; R290-Q294 VanDerWaalsContact O-N 3.1Å; S291-Q294 PolarHBondContact O-N 3.21Å; Q292-Q294 PolarHBondContact O-N 2.95Å; Q294-F297 PolarHBondContact O-N 3.36Å; Q294-I298 HydrophobicContact CG-CD1 4.06Å; Q294-I298 VanDerWaalsContact O-CG1 3.32Å; Q294-I298 WeakPolarHBondContact O-CG1 3.47Å; Q294-I298 PolarHBondContact O-N 2.88Å |
| 295 | A | 98.3 | Very high | 98.4 | Very high | 56 Ų | 56 | 98.3 Ų | 98.3 | 46% | 0.463 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.4 | -42.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | S291 Q292 I298 H299 | S291-A295 WeakPolarHBondContact O-CB 3.24Å; S291-A295 PolarHBondContact O-N 2.97Å; Q292-A295 PolarHBondContact O-N 2.79Å; A295-I298 PolarHBondContact O-N 2.72Å; A295-H299 WeakPolarHBondContact O-CB 3.47Å; A295-H299 PolarHBondContact O-N 3.32Å |
| 296 | A | 98.4 | Very high | 98.4 | Very high | 61 Ų | 61 | 99.1 Ų | 99.1 | 50% | 0.504 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.1 | -40.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q292 H299 S300 | Q292-A296 WeakPolarHBondContact O-CB 3.38Å; Q292-A296 PolarHBondContact O-N 3.35Å; A296-H299 PolarHBondContact O-N 3.5Å; A296-S300 PolarHBondContact O-N 3.43Å |
| 297 | F | 98.6 | Very high | 98.4 | Very high | 147 Ų | 147 | 98.2 Ų | 98.2 | 65% | 0.645 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.9 | -41.8 | 173.7 | 176.2 | -96 | 0 | 0 | 0 | 112.3 | K293 Q294 T301 | K293-F297 PolarHBondContact O-N 3.03Å; K293-F297 VanDerWaalsContact O-N 3.12Å; Q294-F297 PolarHBondContact O-N 3.36Å; F297-T301 WeakPolarHBondContact O-CB 3.49Å; F297-T301 PolarHBondContact O-N 3.43Å; F297-T301 PolarHBondContact O-OG1 3.03Å |
| 298 | I | 98.4 | Very high | 98.4 | Very high | 90 Ų | 90 | 103.1 Ų | 103.1 | 46% | 0.462 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.1 | -43 | 175.3 | -68.2 | 166.4 | 0 | 0 | 0 | 110.6 | Q294 A295 T301 V302 | Q294-I298 HydrophobicContact CG-CD1 4.06Å; Q294-I298 VanDerWaalsContact O-CG1 3.32Å; Q294-I298 WeakPolarHBondContact O-CG1 3.47Å; Q294-I298 PolarHBondContact O-N 2.88Å; A295-I298 PolarHBondContact O-N 2.72Å; I298-T301 WeakPolarHBondContact O-CB 3.34Å; I298-T301 PolarHBondContact O-N 3.11Å; I298-V302 HydrophobicContact CG2-CG2 4.44Å; I298-V302 WeakPolarHBondContact O-CG2 3.47Å; I298-V302 PolarHBondContact O-N 3.13Å |
| 299 | H | 98.4 | Very high | 98.4 | Very high | 122 Ų | 122 | 101.1 Ų | 101.1 | 57% | 0.565 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -56.1 | -55.5 | 175.7 | -173.8 | -76.7 | 0 | 0 | 0 | 111.1 | A295 A296 T301 V302 E303 | A295-H299 WeakPolarHBondContact O-CB 3.47Å; A295-H299 PolarHBondContact O-N 3.32Å; A296-H299 PolarHBondContact O-N 3.5Å; H299-T301 PolarHBondContact O-N 2.98Å; H299-V302 CarbonylContact O-C 3.6Å; H299-V302 PolarHBondContact O-N 3.29Å; H299-E303 IonicContact CE1-OE2 3.55Å; H299-E303 PolarHBondContact CE1-OE2 2.9Å; H299-E303 VanDerWaalsContact CE1-OE2 3.3Å; H299-E303 IonicContact ND1-OE2 2.68Å; H299-E303 PolarHBondContact ND1-OE2 2.72Å; H299-E303 VanDerWaalsContact O-CB 3.28Å; H299-E303 WeakPolarHBondContact O-CB 3.47Å; H299-E303 PolarHBondContact O-N 3Å |
| 300 | S | 98.5 | Very high | 98.4 | Very high | 64 Ų | 64 | 102 Ų | 102 | 45% | 0.448 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -56.9 | -37.8 | 178.3 | -177.1 | 0 | 0 | 0 | 0 | 112.3 | A296 E303 V304 | A296-S300 PolarHBondContact O-N 3.43Å; S300-E303 PolarHBondContact O-N 3.04Å; S300-V304 WeakPolarHBondContact O-CG2 3.47Å; S300-V304 PolarHBondContact O-N 2.87Å; S300-V304 VanDerWaalsContact O-N 3.07Å |
| 301 | T | 98.4 | Very high | 98.4 | Very high | 50 Ų | 50 | 101.1 Ų | 101.1 | 31% | 0.307 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.3 | -36.8 | 175.3 | -57.9 | 0 | 0 | 0 | 0 | 112.9 | F297 I298 H299 R305 | F297-T301 WeakPolarHBondContact O-CB 3.49Å; F297-T301 PolarHBondContact O-N 3.43Å; F297-T301 PolarHBondContact O-OG1 3.03Å; I298-T301 WeakPolarHBondContact O-CB 3.34Å; I298-T301 PolarHBondContact O-N 3.11Å; H299-T301 PolarHBondContact O-N 2.98Å; T301-R305 WeakPolarHBondContact O-CD 3.49Å; T301-R305 VanDerWaalsContact O-CG 3.31Å; T301-R305 WeakPolarHBondContact O-CG 3.37Å |
| 302 | V | 98.4 | Very high | 98.4 | Very high | 83 Ų | 83 | 102.6 Ų | 102.6 | 50% | 0.503 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -75 | -40 | 176.5 | 170.8 | 0 | 0 | 0 | 0 | 111.1 | I298 H299 R305 L306 | I298-V302 HydrophobicContact CG2-CG2 4.44Å; I298-V302 WeakPolarHBondContact O-CG2 3.47Å; I298-V302 PolarHBondContact O-N 3.13Å; H299-V302 CarbonylContact O-C 3.6Å; H299-V302 PolarHBondContact O-N 3.29Å; V302-R305 CarbonylContact O-C 3.58Å; V302-R305 WeakPolarHBondContact O-CB 3.28Å; V302-R305 PolarHBondContact O-N 3.43Å; V302-R305 VanDerWaalsContact O-N 3.13Å; V302-L306 WeakPolarHBondContact O-CB 3.38Å; V302-L306 PolarHBondContact O-N 2.88Å |
| 303 | E | 98.5 | Very high | 98.4 | Very high | 88 Ų | 88 | 98.9 Ų | 98.9 | 41% | 0.411 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.8 | -45.8 | 178.5 | -174 | 175.2 | 179.2 | 0 | 0 | 112 | H299 S300 R305 L306 N307 | H299-E303 IonicContact CE1-OE2 3.55Å; H299-E303 PolarHBondContact CE1-OE2 2.9Å; H299-E303 VanDerWaalsContact CE1-OE2 3.3Å; H299-E303 IonicContact ND1-OE2 2.68Å; H299-E303 PolarHBondContact ND1-OE2 2.72Å; H299-E303 VanDerWaalsContact O-CB 3.28Å; H299-E303 WeakPolarHBondContact O-CB 3.47Å; H299-E303 PolarHBondContact O-N 3Å; S300-E303 PolarHBondContact O-N 3.04Å; E303-R305 VanDerWaalsContact C-N 3.29Å; E303-R305 PolarHBondContact O-N 2.89Å; E303-L306 PolarHBondContact O-N 2.84Å; E303-N307 VanDerWaalsContact O-CG 3.26Å; E303-N307 PolarHBondContact O-N 3.27Å |
| 304 | V | 98.7 | Very high | 98.4 | Very high | 98 Ų | 98 | 97.5 Ų | 97.5 | 59% | 0.594 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.4 | -36.5 | 173.2 | 170.7 | 0 | 0 | 0 | 0 | 112.1 | S300 R308 | S300-V304 WeakPolarHBondContact O-CG2 3.47Å; S300-V304 PolarHBondContact O-N 2.87Å; S300-V304 VanDerWaalsContact O-N 3.07Å; V304-R308 PolarHBondContact O-N 3.4Å |
| 305 | R | 98.4 | Very high | 98.4 | Very high | 179 Ų | 179 | 96.3 Ų | 96.3 | 68% | 0.675 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -70.7 | -38.3 | 175.7 | -68.9 | 170.6 | -178.3 | -166.8 | 0.9 | 112 | T301 V302 E303 A309 | T301-R305 WeakPolarHBondContact O-CD 3.49Å; T301-R305 VanDerWaalsContact O-CG 3.31Å; T301-R305 WeakPolarHBondContact O-CG 3.37Å; V302-R305 CarbonylContact O-C 3.58Å; V302-R305 WeakPolarHBondContact O-CB 3.28Å; V302-R305 PolarHBondContact O-N 3.43Å; V302-R305 VanDerWaalsContact O-N 3.13Å; E303-R305 VanDerWaalsContact C-N 3.29Å; E303-R305 PolarHBondContact O-N 2.89Å; R305-A309 WeakPolarHBondContact O-CB 3.38Å; R305-A309 PolarHBondContact O-N 2.91Å; R305-A309 VanDerWaalsContact O-N 3.11Å |
| 306 | L | 98.4 | Very high | 98.4 | Very high | 103 Ų | 103 | 97.8 Ų | 97.8 | 54% | 0.539 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.8 | -48.8 | 176.9 | 178.6 | 60.8 | 0 | 0 | 0 | 110.9 | V302 E303 R308 A309 V310 | V302-L306 WeakPolarHBondContact O-CB 3.38Å; V302-L306 PolarHBondContact O-N 2.88Å; E303-L306 PolarHBondContact O-N 2.84Å; L306-R308 PolarHBondContact O-N 2.82Å; L306-A309 WeakPolarHBondContact O-CB 3.34Å; L306-A309 PolarHBondContact O-N 3.17Å; L306-V310 HydrophobicContact CD1-CG2 4.37Å; L306-V310 WeakPolarHBondContact O-CG2 3.29Å; L306-V310 PolarHBondContact O-N 3.09Å |
| 307 | N | 98.5 | Very high | 98.4 | Very high | 80 Ų | 80 | 102.1 Ų | 102.1 | 43% | 0.428 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.7 | -46.5 | 179.4 | -67.5 | -12.2 | 0 | 0 | 0 | 111.2 | E303 A309 V310 E311 | E303-N307 VanDerWaalsContact O-CG 3.26Å; E303-N307 PolarHBondContact O-N 3.27Å; N307-A309 VanDerWaalsContact C-N 3.3Å; N307-A309 PolarHBondContact O-N 3.08Å; N307-V310 PolarHBondContact O-N 2.65Å; N307-V310 VanDerWaalsContact O-N 3.13Å; N307-E311 WeakPolarHBondContact O-CG 3.25Å; N307-E311 PolarHBondContact O-N 3.33Å |
| 308 | R | 98.4 | Very high | 98.4 | Very high | 181 Ų | 181 | 98.8 Ų | 98.8 | 68% | 0.683 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -58.7 | -38 | 173.6 | 179.4 | 175.9 | 171 | 166.8 | -0.3 | 113.2 | V304 L306 E312 | V304-R308 PolarHBondContact O-N 3.4Å; L306-R308 PolarHBondContact O-N 2.82Å; R308-E312 WeakPolarHBondContact O-CB 3.29Å; R308-E312 PolarHBondContact O-N 3.13Å; R308-E312 VanDerWaalsContact O-N 3.08Å |
| 309 | A | 98.4 | Very high | 98.4 | Very high | 58 Ų | 58 | 99.2 Ų | 99.2 | 48% | 0.479 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -71.1 | -33.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | R305 L306 N307 A313 | R305-A309 WeakPolarHBondContact O-CB 3.38Å; R305-A309 PolarHBondContact O-N 2.91Å; R305-A309 VanDerWaalsContact O-N 3.11Å; L306-A309 WeakPolarHBondContact O-CB 3.34Å; L306-A309 PolarHBondContact O-N 3.17Å; N307-A309 VanDerWaalsContact C-N 3.3Å; N307-A309 PolarHBondContact O-N 3.08Å; A309-A313 WeakPolarHBondContact O-CB 3.49Å; A309-A313 PolarHBondContact O-N 3.39Å |
| 310 | V | 98.3 | Very high | 98.4 | Very high | 70 Ų | 70 | 98.2 Ų | 98.2 | 42% | 0.424 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -67.3 | -49.3 | 172.7 | 172.3 | 0 | 0 | 0 | 0 | 110.6 | L306 N307 E312 A313 E314 | L306-V310 HydrophobicContact CD1-CG2 4.37Å; L306-V310 WeakPolarHBondContact O-CG2 3.29Å; L306-V310 PolarHBondContact O-N 3.09Å; N307-V310 PolarHBondContact O-N 2.65Å; N307-V310 VanDerWaalsContact O-N 3.13Å; V310-E312 VanDerWaalsContact C-N 3.28Å; V310-E312 PolarHBondContact O-N 2.94Å; V310-A313 WeakPolarHBondContact O-CB 3.47Å; V310-A313 PolarHBondContact O-N 3.24Å; V310-A313 VanDerWaalsContact O-N 3.08Å; V310-E314 HydrophobicContact CG1-CG 4.46Å; V310-E314 WeakPolarHBondContact O-CG 3.43Å; V310-E314 PolarHBondContact O-N 3.49Å |
| 311 | E | 98.3 | Very high | 98.4 | Very high | 128 Ų | 128 | 98 Ų | 98 | 60% | 0.598 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -53.6 | -44.2 | 174.7 | -72 | 166.3 | -161 | 0 | 0 | 111.9 | N307 E314 R315 | N307-E311 WeakPolarHBondContact O-CG 3.25Å; N307-E311 PolarHBondContact O-N 3.33Å; E311-E314 PolarHBondContact O-N 2.87Å; E311-R315 VanDerWaalsContact O-CB 3.26Å; E311-R315 WeakPolarHBondContact O-CB 3.36Å; E311-R315 PolarHBondContact O-N 3.32Å |
| 312 | E | 98.4 | Very high | 98.4 | Very high | 89 Ų | 89 | 102.6 Ų | 102.6 | 42% | 0.416 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.6 | -40.8 | 176.3 | 178.2 | 133.1 | -116.5 | 0 | 0 | 112.5 | R308 V310 R315 L316 | R308-E312 WeakPolarHBondContact O-CB 3.29Å; R308-E312 PolarHBondContact O-N 3.13Å; R308-E312 VanDerWaalsContact O-N 3.08Å; V310-E312 VanDerWaalsContact C-N 3.28Å; V310-E312 PolarHBondContact O-N 2.94Å; E312-R315 WeakPolarHBondContact O-CB 3.42Å; E312-R315 PolarHBondContact O-N 2.96Å; E312-R315 IonicContact OE1-CZ 2.95Å; E312-R315 IonicContact OE1-NE 2.71Å; E312-R315 IonicContact OE1-NH2 2.68Å; E312-R315 PolarHBondContact OE1-NH2 3.16Å; E312-L316 HydrophobicContact CG-CD1 4.03Å; E312-L316 WeakPolarHBondContact O-CB 3.49Å; E312-L316 VanDerWaalsContact O-CG 3.29Å; E312-L316 WeakPolarHBondContact O-CG 3.5Å; E312-L316 PolarHBondContact O-N 3.32Å |
| 313 | A | 98.4 | Very high | 98.4 | Very high | 58 Ų | 58 | 102.2 Ų | 102.2 | 48% | 0.479 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.3 | -40.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | A309 V310 L316 K317 | A309-A313 WeakPolarHBondContact O-CB 3.49Å; A309-A313 PolarHBondContact O-N 3.39Å; V310-A313 WeakPolarHBondContact O-CB 3.47Å; V310-A313 PolarHBondContact O-N 3.24Å; V310-A313 VanDerWaalsContact O-N 3.08Å; A313-L316 PolarHBondContact O-N 3.17Å; A313-K317 VanDerWaalsContact O-CB 3.23Å; A313-K317 WeakPolarHBondContact O-CB 3.5Å; A313-K317 PolarHBondContact O-N 3.02Å |
| 314 | E | 98.4 | Very high | 98.4 | Very high | 115 Ų | 115 | 104.8 Ų | 104.8 | 54% | 0.537 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -69.9 | -38.9 | 176.2 | -67.5 | -163.3 | 147.7 | 0 | 0 | 112.5 | V310 E311 K317 S318 | V310-E314 HydrophobicContact CG1-CG 4.46Å; V310-E314 WeakPolarHBondContact O-CG 3.43Å; V310-E314 PolarHBondContact O-N 3.49Å; E311-E314 PolarHBondContact O-N 2.87Å; E314-K317 PolarHBondContact O-N 3.42Å; E314-S318 VanDerWaalsContact O-CB 3.31Å; E314-S318 WeakPolarHBondContact O-CB 3.43Å; E314-S318 PolarHBondContact O-N 3.44Å; E314-S318 PolarHBondContact O-OG 3.45Å |
| 315 | R | 98.6 | Very high | 98.3 | Very high | 102 Ų | 102 | 104.4 Ų | 104.4 | 39% | 0.385 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -57.1 | -49.3 | 170.6 | -176.6 | -169.3 | 67.1 | 68.3 | -7.8 | 111.1 | E311 E312 S318 Q319 | E311-R315 VanDerWaalsContact O-CB 3.26Å; E311-R315 WeakPolarHBondContact O-CB 3.36Å; E311-R315 PolarHBondContact O-N 3.32Å; E312-R315 WeakPolarHBondContact O-CB 3.42Å; E312-R315 PolarHBondContact O-N 2.96Å; E312-R315 IonicContact OE1-CZ 2.95Å; E312-R315 IonicContact OE1-NE 2.71Å; E312-R315 IonicContact OE1-NH2 2.68Å; E312-R315 PolarHBondContact OE1-NH2 3.16Å; R315-S318 PolarHBondContact O-N 3.35Å; R315-Q319 VanDerWaalsContact NH1-CD 3.3Å; R315-Q319 VanDerWaalsContact NH1-NE2 3.17Å; R315-Q319 WeakPolarHBondContact O-CG 3.42Å; R315-Q319 PolarHBondContact O-N 2.92Å |
| 316 | L | 98.4 | Very high | 98.3 | Very high | 88 Ų | 88 | 99.3 Ų | 99.3 | 46% | 0.461 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.8 | -42 | 179.6 | -73.1 | 169.4 | 0 | 0 | 0 | 112.2 | E312 A313 S318 Q319 L320 | E312-L316 HydrophobicContact CG-CD1 4.03Å; E312-L316 WeakPolarHBondContact O-CB 3.49Å; E312-L316 VanDerWaalsContact O-CG 3.29Å; E312-L316 WeakPolarHBondContact O-CG 3.5Å; E312-L316 PolarHBondContact O-N 3.32Å; A313-L316 PolarHBondContact O-N 3.17Å; L316-S318 VanDerWaalsContact C-N 3.31Å; L316-S318 PolarHBondContact O-N 3.01Å; L316-Q319 PolarHBondContact O-N 3.46Å; L316-L320 WeakPolarHBondContact O-CB 3.32Å; L316-L320 PolarHBondContact O-N 3.26Å |
| 317 | K | 98.6 | Very high | 98.3 | Very high | 152 Ų | 152 | 98.5 Ų | 98.5 | 66% | 0.661 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -58.5 | -42.4 | 173.6 | -177.8 | -176.2 | 178.2 | -172.1 | 0 | 111.7 | A313 E314 L320 A321 | A313-K317 VanDerWaalsContact O-CB 3.23Å; A313-K317 WeakPolarHBondContact O-CB 3.5Å; A313-K317 PolarHBondContact O-N 3.02Å; E314-K317 PolarHBondContact O-N 3.42Å; K317-L320 PolarHBondContact O-N 2.94Å; K317-A321 WeakPolarHBondContact O-CB 3.46Å; K317-A321 PolarHBondContact O-N 3.06Å |
| 318 | S | 98.3 | Very high | 98.3 | Very high | 77 Ų | 77 | 101.3 Ų | 101.3 | 54% | 0.538 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -69.1 | -41.6 | 178 | -57.9 | 0 | 0 | 0 | 0 | 112.4 | E314 R315 L316 A321 K322 | E314-S318 VanDerWaalsContact O-CB 3.31Å; E314-S318 WeakPolarHBondContact O-CB 3.43Å; E314-S318 PolarHBondContact O-N 3.44Å; E314-S318 PolarHBondContact O-OG 3.45Å; R315-S318 PolarHBondContact O-N 3.35Å; L316-S318 VanDerWaalsContact C-N 3.31Å; L316-S318 PolarHBondContact O-N 3.01Å; S318-A321 PolarHBondContact O-N 3.23Å; S318-K322 PolarHBondContact O-N 2.71Å |
| 319 | Q | 98.3 | Very high | 98.2 | Very high | 99 Ų | 99 | 95.9 Ų | 95.9 | 46% | 0.463 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.7 | -43.5 | 173 | -73.7 | 177.3 | -6 | 0 | 0 | 111.7 | R315 L316 A321 K322 T323 | R315-Q319 VanDerWaalsContact NH1-CD 3.3Å; R315-Q319 VanDerWaalsContact NH1-NE2 3.17Å; R315-Q319 WeakPolarHBondContact O-CG 3.42Å; R315-Q319 PolarHBondContact O-N 2.92Å; L316-Q319 PolarHBondContact O-N 3.46Å; Q319-A321 PolarHBondContact O-N 3.33Å; Q319-K322 PolarHBondContact O-N 3.35Å; Q319-T323 PolarHBondContact O-N 2.98Å; Q319-T323 PolarHBondContact O-OG1 3.42Å |
| 320 | L | 98.3 | Very high | 98.2 | Very high | 100 Ų | 100 | 98.2 Ų | 98.2 | 52% | 0.524 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.6 | -41.4 | 175.8 | 179.5 | 62.7 | 0 | 0 | 0 | 112.1 | L316 K317 K324 | L316-L320 WeakPolarHBondContact O-CB 3.32Å; L316-L320 PolarHBondContact O-N 3.26Å; K317-L320 PolarHBondContact O-N 2.94Å; L320-K324 HydrophobicContact CG-CD 4.45Å; L320-K324 WeakPolarHBondContact O-CB 3.39Å; L320-K324 WeakPolarHBondContact O-CG 3.35Å; L320-K324 PolarHBondContact O-N 2.99Å |
| 321 | A | 98.3 | Very high | 98.2 | Very high | 59 Ų | 59 | 100.1 Ų | 100.1 | 49% | 0.488 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.5 | -46.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | K317 S318 Q319 T323 K324 Q325 | K317-A321 WeakPolarHBondContact O-CB 3.46Å; K317-A321 PolarHBondContact O-N 3.06Å; S318-A321 PolarHBondContact O-N 3.23Å; Q319-A321 PolarHBondContact O-N 3.33Å; A321-T323 PolarHBondContact O-N 3.49Å; A321-K324 PolarHBondContact O-N 3.33Å; A321-Q325 PolarHBondContact O-N 2.87Å |
| 322 | K | 98.5 | Very high | 98.2 | Very high | 147 Ų | 147 | 96.8 Ų | 96.8 | 64% | 0.639 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.9 | -44.8 | 177.3 | -172.6 | 173.8 | -178.7 | 176.4 | 0 | 112.2 | S318 Q319 Q325 I326 | S318-K322 PolarHBondContact O-N 2.71Å; Q319-K322 PolarHBondContact O-N 3.35Å; K322-Q325 PolarHBondContact O-N 3.48Å; K322-I326 HydrophobicContact CG-CD1 3.92Å; K322-I326 WeakPolarHBondContact O-CG1 3.15Å; K322-I326 PolarHBondContact O-N 2.81Å |
| 323 | T | 97.9 | Very high | 98.1 | Very high | 76 Ų | 76 | 98.5 Ų | 98.5 | 47% | 0.466 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.8 | -38.8 | 177.3 | -59.2 | 0 | 0 | 0 | 0 | 112.2 | Q319 A321 Q325 I326 N327 | Q319-T323 PolarHBondContact O-N 2.98Å; Q319-T323 PolarHBondContact O-OG1 3.42Å; A321-T323 PolarHBondContact O-N 3.49Å; T323-Q325 VanDerWaalsContact C-N 3.34Å; T323-Q325 PolarHBondContact O-N 2.95Å; T323-I326 PolarHBondContact O-N 2.96Å; T323-N327 WeakPolarHBondContact O-CB 3.47Å; T323-N327 PolarHBondContact O-N 2.88Å |
| 324 | K | 98.3 | Very high | 98.1 | Very high | 141 Ų | 141 | 102 Ų | 102 | 61% | 0.613 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -62 | -41.1 | 173.5 | -77.5 | 179.1 | 178.4 | -174.8 | 0 | 112.2 | L320 A321 K328 | L320-K324 HydrophobicContact CG-CD 4.45Å; L320-K324 WeakPolarHBondContact O-CB 3.39Å; L320-K324 WeakPolarHBondContact O-CG 3.35Å; L320-K324 PolarHBondContact O-N 2.99Å; A321-K324 PolarHBondContact O-N 3.33Å; K324-K328 PolarHBondContact O-N 3.34Å |
| 325 | Q | 98 | Very high | 98 | Very high | 91 Ų | 91 | 100.3 Ų | 100.3 | 43% | 0.425 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66 | -50.3 | 176.9 | -175.3 | 55 | 36.6 | 0 | 0 | 111.1 | A321 K322 T323 N327 K328 D329 | A321-Q325 PolarHBondContact O-N 2.87Å; K322-Q325 PolarHBondContact O-N 3.48Å; T323-Q325 VanDerWaalsContact C-N 3.34Å; T323-Q325 PolarHBondContact O-N 2.95Å; Q325-N327 VanDerWaalsContact C-N 3.28Å; Q325-N327 PolarHBondContact O-N 2.89Å; Q325-K328 WeakPolarHBondContact O-CB 3.48Å; Q325-K328 PolarHBondContact O-N 3.38Å; Q325-D329 WeakPolarHBondContact CG-OD2 3.27Å; Q325-D329 PolarHBondContact NE2-OD1 2.84Å; Q325-D329 PolarHBondContact NE2-OD2 3.23Å; Q325-D329 VanDerWaalsContact O-CG 3.28Å; Q325-D329 PolarHBondContact O-N 2.95Å |
| 326 | I | 97.9 | Very high | 98 | Very high | 72 Ų | 72 | 101.2 Ų | 101.2 | 37% | 0.369 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -55 | -41.9 | 175.9 | -69.5 | 165.9 | 0 | 0 | 0 | 111.9 | K322 T323 D329 K330 | K322-I326 HydrophobicContact CG-CD1 3.92Å; K322-I326 WeakPolarHBondContact O-CG1 3.15Å; K322-I326 PolarHBondContact O-N 2.81Å; T323-I326 PolarHBondContact O-N 2.96Å; I326-D329 PolarHBondContact O-N 3.21Å; I326-K330 HydrophobicContact CG2-CD 4.25Å; I326-K330 WeakPolarHBondContact O-CB 3.33Å; I326-K330 WeakPolarHBondContact O-CG 3.37Å; I326-K330 PolarHBondContact O-N 2.99Å |
| 327 | N | 97.8 | Very high | 98 | Very high | 86 Ų | 86 | 100.2 Ų | 100.2 | 46% | 0.46 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -68.1 | -37 | 177.5 | -74.4 | 4.1 | 0 | 0 | 0 | 112.5 | T323 Q325 I331 | T323-N327 WeakPolarHBondContact O-CB 3.47Å; T323-N327 PolarHBondContact O-N 2.88Å; Q325-N327 VanDerWaalsContact C-N 3.28Å; Q325-N327 PolarHBondContact O-N 2.89Å; N327-I331 WeakPolarHBondContact O-CD1 3.25Å; N327-I331 VanDerWaalsContact O-CG1 3.23Å; N327-I331 WeakPolarHBondContact O-CG1 3.37Å; N327-I331 PolarHBondContact O-N 3.33Å; N327-I331 VanDerWaalsContact O-N 3.09Å |
| 328 | K | 98.3 | Very high | 97.9 | Very high | 139 Ų | 139 | 98.4 Ų | 98.4 | 60% | 0.604 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64 | -44 | 174.3 | -176.6 | -167.5 | 172.4 | -165.1 | 0 | 111.2 | K324 Q325 I331 S332 | K324-K328 PolarHBondContact O-N 3.34Å; Q325-K328 WeakPolarHBondContact O-CB 3.48Å; Q325-K328 PolarHBondContact O-N 3.38Å; K328-I331 PolarHBondContact O-N 2.92Å; K328-S332 PolarHBondContact O-N 2.98Å; K328-S332 VanDerWaalsContact O-N 3.07Å |
| 329 | D | 97.8 | Very high | 97.9 | Very high | 66 Ų | 66 | 99.8 Ų | 99.8 | 35% | 0.353 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -67.6 | -43.6 | -178.3 | -61.9 | -29.7 | 0 | 0 | 0 | 110.8 | Q325 I326 I331 S332 E333 | Q325-D329 WeakPolarHBondContact CG-OD2 3.27Å; Q325-D329 PolarHBondContact NE2-OD1 2.84Å; Q325-D329 PolarHBondContact NE2-OD2 3.23Å; Q325-D329 VanDerWaalsContact O-CG 3.28Å; Q325-D329 PolarHBondContact O-N 2.95Å; I326-D329 PolarHBondContact O-N 3.21Å; D329-I331 PolarHBondContact O-N 3.31Å; D329-S332 CarbonylContact O-C 3.54Å; D329-S332 WeakPolarHBondContact O-CA 3.43Å; D329-S332 VanDerWaalsContact O-CB 3.27Å; D329-S332 WeakPolarHBondContact O-CB 3.41Å; D329-S332 PolarHBondContact O-N 3.33Å; D329-E333 WeakPolarHBondContact O-CG 3.3Å; D329-E333 PolarHBondContact O-N 3.38Å |
| 330 | K | 98.1 | Very high | 97.9 | Very high | 107 Ų | 107 | 98.8 Ų | 98.8 | 47% | 0.465 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -56.8 | -44.8 | 171.3 | -76.5 | -179.2 | 174.6 | -168 | 0 | 113.5 | I326 S332 E333 E334 | I326-K330 HydrophobicContact CG2-CD 4.25Å; I326-K330 WeakPolarHBondContact O-CB 3.33Å; I326-K330 WeakPolarHBondContact O-CG 3.37Å; I326-K330 PolarHBondContact O-N 2.99Å; K330-S332 PolarHBondContact O-N 3Å; K330-E333 PolarHBondContact O-N 3.31Å; K330-E334 WeakPolarHBondContact O-CB 3.42Å; K330-E334 VanDerWaalsContact O-CG 3.31Å; K330-E334 WeakPolarHBondContact O-CG 3.39Å; K330-E334 PolarHBondContact O-N 3.18Å |
| 331 | I | 97.5 | Very high | 97.9 | Very high | 111 Ų | 111 | 98.9 Ų | 98.9 | 57% | 0.569 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.2 | -34.1 | 176.5 | -70.2 | 164.6 | 0 | 0 | 0 | 110.8 | N327 K328 D329 Q335 | N327-I331 WeakPolarHBondContact O-CD1 3.25Å; N327-I331 VanDerWaalsContact O-CG1 3.23Å; N327-I331 WeakPolarHBondContact O-CG1 3.37Å; N327-I331 PolarHBondContact O-N 3.33Å; N327-I331 VanDerWaalsContact O-N 3.09Å; K328-I331 PolarHBondContact O-N 2.92Å; D329-I331 PolarHBondContact O-N 3.31Å; I331-Q335 VanDerWaalsContact O-CB 3.26Å; I331-Q335 WeakPolarHBondContact O-CB 3.5Å; I331-Q335 PolarHBondContact O-N 2.87Å; I331-Q335 VanDerWaalsContact O-N 3.07Å |
| 332 | S | 97.6 | Very high | 97.8 | Very high | 58 Ų | 58 | 100.6 Ų | 100.6 | 41% | 0.406 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.9 | -44.6 | 173.8 | -169.3 | 0 | 0 | 0 | 0 | 112.2 | K328 D329 K330 Q335 Q336 | K328-S332 PolarHBondContact O-N 2.98Å; K328-S332 VanDerWaalsContact O-N 3.07Å; D329-S332 CarbonylContact O-C 3.54Å; D329-S332 WeakPolarHBondContact O-CA 3.43Å; D329-S332 VanDerWaalsContact O-CB 3.27Å; D329-S332 WeakPolarHBondContact O-CB 3.41Å; D329-S332 PolarHBondContact O-N 3.33Å; K330-S332 PolarHBondContact O-N 3Å; S332-Q335 PolarHBondContact O-N 2.66Å; S332-Q336 WeakPolarHBondContact O-CB 3.23Å; S332-Q336 VanDerWaalsContact O-CG 3.29Å; S332-Q336 WeakPolarHBondContact O-CG 3.21Å; S332-Q336 PolarHBondContact O-N 3.04Å |
| 333 | E | 97.7 | Very high | 97.8 | Very high | 125 Ų | 125 | 95.9 Ų | 95.9 | 58% | 0.584 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.1 | -45.9 | 176.2 | -70 | 172 | 173 | 0 | 0 | 111.9 | D329 K330 Q335 Q336 S337 | D329-E333 WeakPolarHBondContact O-CG 3.3Å; D329-E333 PolarHBondContact O-N 3.38Å; K330-E333 PolarHBondContact O-N 3.31Å; E333-Q335 PolarHBondContact O-N 3.46Å; E333-Q336 PolarHBondContact O-N 3.22Å; E333-S337 VanDerWaalsContact O-CB 3.24Å; E333-S337 WeakPolarHBondContact O-CB 3.38Å; E333-S337 PolarHBondContact O-N 2.91Å |
| 334 | E | 97.4 | Very high | 97.8 | Very high | 131 Ų | 131 | 97.2 Ų | 97.2 | 61% | 0.612 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -60.9 | -42.1 | 176.3 | -74.7 | 172.5 | -160.8 | 0 | 0 | 111.6 | K330 K338 | K330-E334 WeakPolarHBondContact O-CB 3.42Å; K330-E334 VanDerWaalsContact O-CG 3.31Å; K330-E334 WeakPolarHBondContact O-CG 3.39Å; K330-E334 PolarHBondContact O-N 3.18Å; E334-K338 WeakPolarHBondContact O-CB 3.36Å; E334-K338 PolarHBondContact O-N 3.32Å |
| 335 | Q | 97.8 | Very high | 97.7 | Very high | 79 Ų | 79 | 94 Ų | 94 | 37% | 0.369 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -69.6 | -41.9 | 177.6 | -178.7 | 62 | 23.2 | 0 | 0 | 112.1 | I331 S332 E333 K338 E339 | I331-Q335 VanDerWaalsContact O-CB 3.26Å; I331-Q335 WeakPolarHBondContact O-CB 3.5Å; I331-Q335 PolarHBondContact O-N 2.87Å; I331-Q335 VanDerWaalsContact O-N 3.07Å; S332-Q335 PolarHBondContact O-N 2.66Å; E333-Q335 PolarHBondContact O-N 3.46Å; Q335-K338 PolarHBondContact O-N 3.45Å; Q335-E339 PolarHBondContact NE2-OE1 3.41Å; Q335-E339 WeakPolarHBondContact O-CB 3.5Å; Q335-E339 WeakPolarHBondContact O-CG 3.35Å; Q335-E339 PolarHBondContact O-N 3.05Å |
| 336 | Q | 97.7 | Very high | 97.7 | Very high | 121 Ų | 121 | 95.1 Ų | 95.1 | 57% | 0.565 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -63.7 | -42.7 | 174.5 | -73.3 | 174.7 | 15.1 | 0 | 0 | 112.1 | S332 E333 E339 S340 | S332-Q336 WeakPolarHBondContact O-CB 3.23Å; S332-Q336 VanDerWaalsContact O-CG 3.29Å; S332-Q336 WeakPolarHBondContact O-CG 3.21Å; S332-Q336 PolarHBondContact O-N 3.04Å; E333-Q336 PolarHBondContact O-N 3.22Å; Q336-E339 PolarHBondContact O-N 3.4Å; Q336-S340 WeakPolarHBondContact O-CB 3.49Å; Q336-S340 PolarHBondContact O-N 3.37Å |
| 337 | S | 97.9 | Very high | 97.7 | Very high | 68 Ų | 68 | 96 Ų | 96 | 48% | 0.476 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60 | -46.3 | 175.4 | 179.8 | 0 | 0 | 0 | 0 | 111.5 | E333 E339 S340 L341 | E333-S337 VanDerWaalsContact O-CB 3.24Å; E333-S337 WeakPolarHBondContact O-CB 3.38Å; E333-S337 PolarHBondContact O-N 2.91Å; S337-E339 PolarHBondContact O-N 3.01Å; S337-S340 WeakPolarHBondContact O-CB 3.38Å; S337-S340 PolarHBondContact O-N 3.25Å; S337-L341 WeakPolarHBondContact O-CB 3.21Å; S337-L341 WeakPolarHBondContact O-CG 3.34Å; S337-L341 PolarHBondContact O-N 3.45Å |
| 338 | K | 97.6 | Very high | 97.7 | Very high | 114 Ų | 114 | 95.9 Ų | 95.9 | 50% | 0.496 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.9 | -40.9 | 174.9 | 174.8 | -176.9 | 167.2 | -162 | 0 | 112.9 | E334 Q335 L342 | E334-K338 WeakPolarHBondContact O-CB 3.36Å; E334-K338 PolarHBondContact O-N 3.32Å; Q335-K338 PolarHBondContact O-N 3.45Å; K338-L342 HydrophobicContact CG-CD1 4.18Å; K338-L342 WeakPolarHBondContact O-CB 3.46Å; K338-L342 WeakPolarHBondContact O-CG 3.33Å; K338-L342 PolarHBondContact O-N 3.16Å |
| 339 | E | 97.6 | Very high | 97.7 | Very high | 106 Ų | 106 | 95.4 Ų | 95.4 | 50% | 0.495 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.4 | -42.4 | 175.5 | -76.7 | 171.6 | -167 | 0 | 0 | 111.9 | Q335 Q336 S337 L342 A343 | Q335-E339 PolarHBondContact NE2-OE1 3.41Å; Q335-E339 WeakPolarHBondContact O-CB 3.5Å; Q335-E339 WeakPolarHBondContact O-CG 3.35Å; Q335-E339 PolarHBondContact O-N 3.05Å; Q336-E339 PolarHBondContact O-N 3.4Å; S337-E339 PolarHBondContact O-N 3.01Å; E339-L342 PolarHBondContact O-N 3.46Å; E339-A343 PolarHBondContact O-N 3.15Å |
| 340 | S | 97.5 | Very high | 97.7 | Very high | 78 Ų | 78 | 97.9 Ų | 97.9 | 55% | 0.545 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60 | -50.6 | 174.2 | -171.5 | 0 | 0 | 0 | 0 | 111.9 | Q336 S337 L342 A343 E344 | Q336-S340 WeakPolarHBondContact O-CB 3.49Å; Q336-S340 PolarHBondContact O-N 3.37Å; S337-S340 WeakPolarHBondContact O-CB 3.38Å; S337-S340 PolarHBondContact O-N 3.25Å; S340-L342 VanDerWaalsContact C-N 3.29Å; S340-L342 PolarHBondContact O-N 3.17Å; S340-A343 WeakPolarHBondContact O-CB 3.41Å; S340-A343 PolarHBondContact O-N 3.39Å; S340-A343 VanDerWaalsContact O-N 3.1Å; S340-E344 PolarHBondContact O-N 3.33Å |
| 341 | L | 98 | Very high | 97.7 | Very high | 102 Ų | 102 | 97.9 Ų | 97.9 | 53% | 0.534 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.5 | -35.1 | 176.8 | -71.9 | 169.6 | 0 | 0 | 0 | 112.5 | S337 N345 | S337-L341 WeakPolarHBondContact O-CB 3.21Å; S337-L341 WeakPolarHBondContact O-CG 3.34Å; S337-L341 PolarHBondContact O-N 3.45Å; L341-N345 WeakPolarHBondContact O-CB 2.93Å; L341-N345 PolarHBondContact O-N 3.25Å |
| 342 | L | 97.7 | Very high | 97.8 | Very high | 94 Ų | 94 | 99.3 Ų | 99.3 | 49% | 0.492 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.9 | -38.9 | 174 | -77.2 | 169.1 | 0 | 0 | 0 | 112.1 | K338 E339 S340 Q346 | K338-L342 HydrophobicContact CG-CD1 4.18Å; K338-L342 WeakPolarHBondContact O-CB 3.46Å; K338-L342 WeakPolarHBondContact O-CG 3.33Å; K338-L342 PolarHBondContact O-N 3.16Å; E339-L342 PolarHBondContact O-N 3.46Å; S340-L342 VanDerWaalsContact C-N 3.29Å; S340-L342 PolarHBondContact O-N 3.17Å; L342-Q346 WeakPolarHBondContact O-CG 3.46Å; L342-Q346 PolarHBondContact O-N 3.38Å; L342-Q346 VanDerWaalsContact O-N 3.09Å |
| 343 | A | 97.8 | Very high | 97.8 | Very high | 49 Ų | 49 | 100.8 Ų | 100.8 | 41% | 0.405 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.6 | -47 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | E339 S340 N345 Q346 I347 | E339-A343 PolarHBondContact O-N 3.15Å; S340-A343 WeakPolarHBondContact O-CB 3.41Å; S340-A343 PolarHBondContact O-N 3.39Å; S340-A343 VanDerWaalsContact O-N 3.1Å; A343-N345 VanDerWaalsContact C-N 3.34Å; A343-N345 PolarHBondContact O-N 3.3Å; A343-Q346 WeakPolarHBondContact O-CB 3.32Å; A343-Q346 PolarHBondContact O-N 3.03Å; A343-I347 WeakPolarHBondContact O-CG1 3.36Å; A343-I347 PolarHBondContact O-N 2.63Å |
| 344 | E | 97.3 | Very high | 97.8 | Very high | 104 Ų | 104 | 100.7 Ų | 100.7 | 49% | 0.486 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.9 | -45.7 | 174.3 | -170.4 | -170.9 | 174.5 | 0 | 0 | 111.1 | S340 Q346 I347 L348 | S340-E344 PolarHBondContact O-N 3.33Å; E344-Q346 VanDerWaalsContact C-N 3.25Å; E344-Q346 PolarHBondContact O-N 3.21Å; E344-I347 PolarHBondContact O-N 2.83Å; E344-L348 HydrophobicContact CG-CD1 4.01Å; E344-L348 HydrophobicContact CG-CG 4.34Å; E344-L348 WeakPolarHBondContact O-CG 3.33Å; E344-L348 PolarHBondContact O-N 3.48Å |
| 345 | N | 97.6 | Very high | 97.9 | Very high | 72 Ų | 72 | 99.5 Ų | 99.5 | 39% | 0.385 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.9 | -32 | 178.6 | -164.9 | -96.6 | 0 | 0 | 0 | 112.7 | L341 A343 K349 | L341-N345 WeakPolarHBondContact O-CB 2.93Å; L341-N345 PolarHBondContact O-N 3.25Å; A343-N345 VanDerWaalsContact C-N 3.34Å; A343-N345 PolarHBondContact O-N 3.3Å; N345-K349 WeakPolarHBondContact O-CB 3.43Å; N345-K349 WeakPolarHBondContact O-CD 3.33Å; N345-K349 VanDerWaalsContact O-CG 3.22Å; N345-K349 WeakPolarHBondContact O-CG 3.5Å; N345-K349 PolarHBondContact O-N 2.89Å; N345-K349 VanDerWaalsContact O-N 3.09Å; N345-K349 WeakPolarHBondContact OD1-CE 3.24Å; N345-K349 PolarHBondContact OD1-NZ 3.23Å |
| 346 | Q | 98.1 | Very high | 97.9 | Very high | 115 Ų | 115 | 99.2 Ų | 99.2 | 54% | 0.537 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -69.8 | -39.7 | 170.8 | -73.4 | -177.6 | 42 | 0 | 0 | 112.7 | L342 A343 E344 K349 K350 | L342-Q346 WeakPolarHBondContact O-CG 3.46Å; L342-Q346 PolarHBondContact O-N 3.38Å; L342-Q346 VanDerWaalsContact O-N 3.09Å; A343-Q346 WeakPolarHBondContact O-CB 3.32Å; A343-Q346 PolarHBondContact O-N 3.03Å; E344-Q346 VanDerWaalsContact C-N 3.25Å; E344-Q346 PolarHBondContact O-N 3.21Å; Q346-K349 PolarHBondContact O-N 3.25Å; Q346-K350 WeakPolarHBondContact O-CG 3.42Å; Q346-K350 PolarHBondContact O-N 2.7Å |
| 347 | I | 97.9 | Very high | 97.9 | Very high | 90 Ų | 90 | 95.6 Ų | 95.6 | 46% | 0.462 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.8 | -48.2 | 176.8 | -66.6 | 165.3 | 0 | 0 | 0 | 110.3 | A343 E344 K349 K350 Q351 | A343-I347 WeakPolarHBondContact O-CG1 3.36Å; A343-I347 PolarHBondContact O-N 2.63Å; E344-I347 PolarHBondContact O-N 2.83Å; I347-K349 VanDerWaalsContact C-N 3.28Å; I347-K349 PolarHBondContact O-N 3.42Å; I347-K350 WeakPolarHBondContact O-CB 3.44Å; I347-K350 PolarHBondContact O-N 3.49Å; I347-K350 VanDerWaalsContact O-N 3.08Å; I347-Q351 HydrophobicContact CG2-CG 4.43Å; I347-Q351 WeakPolarHBondContact O-CG 3.35Å; I347-Q351 PolarHBondContact O-N 3.02Å |
| 348 | L | 97.9 | Very high | 97.9 | Very high | 85 Ų | 85 | 93.7 Ų | 93.7 | 45% | 0.445 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.8 | -36.9 | 175.9 | -68.4 | 170.5 | 0 | 0 | 0 | 112.1 | E344 K352 | E344-L348 HydrophobicContact CG-CD1 4.01Å; E344-L348 HydrophobicContact CG-CG 4.34Å; E344-L348 WeakPolarHBondContact O-CG 3.33Å; E344-L348 PolarHBondContact O-N 3.48Å; L348-K352 VanDerWaalsContact O-CB 3.26Å; L348-K352 WeakPolarHBondContact O-CB 3.43Å; L348-K352 PolarHBondContact O-N 3.47Å |
| 349 | K | 97.8 | Very high | 97.9 | Very high | 128 Ų | 128 | 93.6 Ų | 93.6 | 56% | 0.557 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -63.5 | -44.6 | 172.2 | -81.5 | 165.6 | 175.1 | 158 | 0 | 112.3 | N345 Q346 I347 K352 T353 | N345-K349 WeakPolarHBondContact O-CB 3.43Å; N345-K349 WeakPolarHBondContact O-CD 3.33Å; N345-K349 VanDerWaalsContact O-CG 3.22Å; N345-K349 WeakPolarHBondContact O-CG 3.5Å; N345-K349 PolarHBondContact O-N 2.89Å; N345-K349 VanDerWaalsContact O-N 3.09Å; N345-K349 WeakPolarHBondContact OD1-CE 3.24Å; N345-K349 PolarHBondContact OD1-NZ 3.23Å; Q346-K349 PolarHBondContact O-N 3.25Å; I347-K349 VanDerWaalsContact C-N 3.28Å; I347-K349 PolarHBondContact O-N 3.42Å; K349-K352 PolarHBondContact O-N 2.84Å; K349-T353 PolarHBondContact O-N 3.01Å; K349-T353 PolarHBondContact O-OG1 3.06Å |
| 350 | K | 98 | Very high | 98 | Very high | 119 Ų | 119 | 95 Ų | 95 | 52% | 0.517 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.1 | -53.1 | 176.2 | -71.6 | 171.4 | -177.7 | 177.3 | 0 | 111.3 | Q346 I347 K352 T353 E354 | Q346-K350 WeakPolarHBondContact O-CG 3.42Å; Q346-K350 PolarHBondContact O-N 2.7Å; I347-K350 WeakPolarHBondContact O-CB 3.44Å; I347-K350 PolarHBondContact O-N 3.49Å; I347-K350 VanDerWaalsContact O-N 3.08Å; K350-K352 VanDerWaalsContact C-N 3.3Å; K350-K352 PolarHBondContact O-N 2.88Å; K350-T353 WeakPolarHBondContact CA-OG1 3.28Å; K350-T353 WeakPolarHBondContact O-CA 3.32Å; K350-T353 PolarHBondContact O-N 2.86Å; K350-T353 PolarHBondContact O-OG1 2.8Å; K350-E354 WeakPolarHBondContact O-CG 3.33Å; K350-E354 PolarHBondContact O-N 3.3Å |
| 351 | Q | 98.1 | Very high | 98 | Very high | 106 Ų | 106 | 98.7 Ų | 98.7 | 50% | 0.495 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -54.9 | -43.4 | 176.3 | -70.6 | 174.2 | -15.7 | 0 | 0 | 112.1 | I347 T353 E354 L355 | I347-Q351 HydrophobicContact CG2-CG 4.43Å; I347-Q351 WeakPolarHBondContact O-CG 3.35Å; I347-Q351 PolarHBondContact O-N 3.02Å; Q351-T353 PolarHBondContact O-N 3.18Å; Q351-E354 PolarHBondContact O-N 3.47Å; Q351-L355 VanDerWaalsContact O-CB 3.31Å; Q351-L355 WeakPolarHBondContact O-CB 3.1Å; Q351-L355 PolarHBondContact O-N 2.97Å |
| 352 | K | 98.4 | Very high | 98 | Very high | 141 Ų | 141 | 99 Ų | 99 | 61% | 0.613 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.5 | -43.7 | 173.9 | 178.5 | 173.7 | 178.3 | 175.1 | 0 | 112.3 | L348 K349 K350 I356 | L348-K352 VanDerWaalsContact O-CB 3.26Å; L348-K352 WeakPolarHBondContact O-CB 3.43Å; L348-K352 PolarHBondContact O-N 3.47Å; K349-K352 PolarHBondContact O-N 2.84Å; K350-K352 VanDerWaalsContact C-N 3.3Å; K350-K352 PolarHBondContact O-N 2.88Å; K352-I356 HydrophobicContact CG-CD1 3.87Å; K352-I356 WeakPolarHBondContact O-CB 3.49Å; K352-I356 WeakPolarHBondContact O-CD1 3.39Å; K352-I356 WeakPolarHBondContact O-CG1 3.34Å; K352-I356 PolarHBondContact O-N 3.33Å |
| 353 | T | 98.1 | Very high | 98 | Very high | 89 Ų | 89 | 99.6 Ų | 99.6 | 55% | 0.546 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -68 | -37.6 | 177.4 | 50.7 | 0 | 0 | 0 | 0 | 113 | K349 K350 Q351 I356 A357 | K349-T353 PolarHBondContact O-N 3.01Å; K349-T353 PolarHBondContact O-OG1 3.06Å; K350-T353 WeakPolarHBondContact CA-OG1 3.28Å; K350-T353 WeakPolarHBondContact O-CA 3.32Å; K350-T353 PolarHBondContact O-N 2.86Å; K350-T353 PolarHBondContact O-OG1 2.8Å; Q351-T353 PolarHBondContact O-N 3.18Å; T353-I356 PolarHBondContact O-N 3.39Å; T353-A357 WeakPolarHBondContact O-CB 3.38Å; T353-A357 PolarHBondContact O-N 2.85Å |
| 354 | E | 97.8 | Very high | 98 | Very high | 124 Ų | 124 | 104.4 Ų | 104.4 | 58% | 0.579 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.7 | -45.2 | 176.2 | -71.8 | 160.7 | -157.1 | 0 | 0 | 111.4 | K350 Q351 A357 G358 | K350-E354 WeakPolarHBondContact O-CG 3.33Å; K350-E354 PolarHBondContact O-N 3.3Å; Q351-E354 PolarHBondContact O-N 3.47Å; E354-A357 CarbonylContact O-C 3.58Å; E354-A357 WeakPolarHBondContact O-CB 3.24Å; E354-A357 PolarHBondContact O-N 3.19Å; E354-G358 PolarHBondContact O-N 3.26Å |
| 355 | L | 98.4 | Very high | 98.1 | Very high | 106 Ų | 106 | 104.1 Ų | 104.1 | 56% | 0.555 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.6 | -43.3 | 175.9 | -177.6 | 61.5 | 0 | 0 | 0 | 112 | Q351 A357 G358 F359 | Q351-L355 VanDerWaalsContact O-CB 3.31Å; Q351-L355 WeakPolarHBondContact O-CB 3.1Å; Q351-L355 PolarHBondContact O-N 2.97Å; L355-A357 VanDerWaalsContact C-N 3.31Å; L355-A357 PolarHBondContact O-N 3.04Å; L355-G358 PolarHBondContact O-N 2.91Å; L355-F359 HydrophobicContact CD1-CD2 4.1Å; L355-F359 HydrophobicContact CD1-CE2 3.62Å; L355-F359 HydrophobicContact CD1-CZ 4.19Å; L355-F359 HydrophobicContact CD2-CE2 4.17Å; L355-F359 HydrophobicContact CG-CD2 3.99Å; L355-F359 HydrophobicContact CG-CE2 3.66Å; L355-F359 WeakPolarHBondContact O-CD2 3.36Å; L355-F359 PolarHBondContact O-N 3.46Å |
| 356 | I | 98.1 | Very high | 98.1 | Very high | 73 Ų | 73 | 104.5 Ų | 104.5 | 37% | 0.374 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.5 | -38.7 | 173.9 | -70.9 | 167 | 0 | 0 | 0 | 111.1 | K352 T353 K360 | K352-I356 HydrophobicContact CG-CD1 3.87Å; K352-I356 WeakPolarHBondContact O-CB 3.49Å; K352-I356 WeakPolarHBondContact O-CD1 3.39Å; K352-I356 WeakPolarHBondContact O-CG1 3.34Å; K352-I356 PolarHBondContact O-N 3.33Å; T353-I356 PolarHBondContact O-N 3.39Å; I356-K360 HydrophobicContact CG2-CD 4.22Å; I356-K360 WeakPolarHBondContact O-CB 3.28Å; I356-K360 VanDerWaalsContact O-CG 3.29Å; I356-K360 WeakPolarHBondContact O-CG 3.37Å; I356-K360 PolarHBondContact O-N 3.5Å |
| 357 | A | 98.2 | Very high | 98.1 | Very high | 44 Ų | 44 | 103.3 Ų | 103.3 | 36% | 0.364 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -67.5 | -36.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | T353 E354 L355 K360 K361 | T353-A357 WeakPolarHBondContact O-CB 3.38Å; T353-A357 PolarHBondContact O-N 2.85Å; E354-A357 CarbonylContact O-C 3.58Å; E354-A357 WeakPolarHBondContact O-CB 3.24Å; E354-A357 PolarHBondContact O-N 3.19Å; L355-A357 VanDerWaalsContact C-N 3.31Å; L355-A357 PolarHBondContact O-N 3.04Å; A357-K360 PolarHBondContact O-N 3.17Å; A357-K361 WeakPolarHBondContact O-CG 3.43Å; A357-K361 PolarHBondContact O-N 2.99Å |
| 358 | G | 98.1 | Very high | 98.1 | Very high | 28 Ų | 28 | 103.1 Ų | 103.1 | 29% | 0.289 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.4 | -54.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | E354 L355 K360 K361 Q362 | E354-G358 PolarHBondContact O-N 3.26Å; L355-G358 PolarHBondContact O-N 2.91Å; G358-K360 VanDerWaalsContact C-N 3.31Å; G358-K360 PolarHBondContact O-N 2.82Å; G358-K361 WeakPolarHBondContact O-CB 3.33Å; G358-K361 PolarHBondContact O-N 2.68Å; G358-Q362 PolarHBondContact O-N 3.46Å |
| 359 | F | 98.2 | Very high | 98.1 | Very high | 113 Ų | 113 | 103.4 Ų | 103.4 | 50% | 0.496 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58.7 | -40.4 | 176 | -75 | -57.8 | 0 | 0 | 0 | 112.5 | L355 K361 Q362 L363 | L355-F359 HydrophobicContact CD1-CD2 4.1Å; L355-F359 HydrophobicContact CD1-CE2 3.62Å; L355-F359 HydrophobicContact CD1-CZ 4.19Å; L355-F359 HydrophobicContact CD2-CE2 4.17Å; L355-F359 HydrophobicContact CG-CD2 3.99Å; L355-F359 HydrophobicContact CG-CE2 3.66Å; L355-F359 WeakPolarHBondContact O-CD2 3.36Å; L355-F359 PolarHBondContact O-N 3.46Å; F359-K361 VanDerWaalsContact C-N 3.31Å; F359-K361 PolarHBondContact O-N 2.71Å; F359-Q362 PolarHBondContact O-N 3.47Å; F359-L363 WeakPolarHBondContact O-CG 3.17Å; F359-L363 PolarHBondContact O-N 3.1Å |
| 360 | K | 98.4 | Very high | 98.1 | Very high | 136 Ų | 136 | 103.7 Ų | 103.7 | 59% | 0.591 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.1 | -32.9 | 174.7 | -75.9 | 176.4 | 179.2 | -176.8 | 0 | 113.3 | I356 A357 G358 K364 | I356-K360 HydrophobicContact CG2-CD 4.22Å; I356-K360 WeakPolarHBondContact O-CB 3.28Å; I356-K360 VanDerWaalsContact O-CG 3.29Å; I356-K360 WeakPolarHBondContact O-CG 3.37Å; I356-K360 PolarHBondContact O-N 3.5Å; A357-K360 PolarHBondContact O-N 3.17Å; G358-K360 VanDerWaalsContact C-N 3.31Å; G358-K360 PolarHBondContact O-N 2.82Å; K360-K364 WeakPolarHBondContact O-CG 3.3Å; K360-K364 PolarHBondContact O-N 2.84Å |
| 361 | K | 98.4 | Very high | 98 | Very high | 155 Ų | 155 | 105.7 Ų | 105.7 | 67% | 0.674 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -71.9 | -43.5 | 172.1 | -73 | 173 | 178.6 | -179.5 | 0 | 111.5 | A357 G358 F359 K364 L365 | A357-K361 WeakPolarHBondContact O-CG 3.43Å; A357-K361 PolarHBondContact O-N 2.99Å; G358-K361 WeakPolarHBondContact O-CB 3.33Å; G358-K361 PolarHBondContact O-N 2.68Å; F359-K361 VanDerWaalsContact C-N 3.31Å; F359-K361 PolarHBondContact O-N 2.71Å; K361-K364 PolarHBondContact O-N 3.09Å; K361-L365 PolarHBondContact O-N 2.96Å |
| 362 | Q | 98.2 | Very high | 98 | Very high | 109 Ų | 109 | 106 Ų | 106 | 51% | 0.509 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.2 | -43 | 177.5 | -72.7 | 173.6 | -18.2 | 0 | 0 | 112.4 | G358 F359 L365 I366 | G358-Q362 PolarHBondContact O-N 3.46Å; F359-Q362 PolarHBondContact O-N 3.47Å; Q362-L365 WeakPolarHBondContact O-CB 3.47Å; Q362-L365 PolarHBondContact O-N 3.47Å; Q362-I366 WeakPolarHBondContact O-CG1 3.19Å; Q362-I366 PolarHBondContact O-N 2.95Å |
| 363 | L | 97.9 | Very high | 97.9 | Very high | 106 Ų | 106 | 105.1 Ų | 105.1 | 56% | 0.555 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -58.5 | -48.8 | 175.1 | -73.4 | 167.4 | 0 | 0 | 0 | 111.7 | F359 L365 I366 D367 | F359-L363 WeakPolarHBondContact O-CG 3.17Å; F359-L363 PolarHBondContact O-N 3.1Å; L363-L365 VanDerWaalsContact C-N 3.29Å; L363-L365 PolarHBondContact O-N 3.36Å; L363-I366 WeakPolarHBondContact O-CB 3.22Å; L363-I366 PolarHBondContact O-N 3.44Å; L363-I366 VanDerWaalsContact O-N 3.14Å; L363-D367 PolarHBondContact O-N 2.66Å |
| 364 | K | 97.9 | Very high | 97.9 | Very high | 150 Ų | 150 | 105.9 Ų | 105.9 | 65% | 0.652 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -59.7 | -38.3 | 175.2 | -71.8 | -174.2 | 177.1 | -166.8 | 0 | 112.8 | K360 K361 D367 I368 | K360-K364 WeakPolarHBondContact O-CG 3.3Å; K360-K364 PolarHBondContact O-N 2.84Å; K361-K364 PolarHBondContact O-N 3.09Å; K364-D367 PolarHBondContact O-N 3.38Å; K364-I368 VanDerWaalsContact O-CG1 3.3Å; K364-I368 WeakPolarHBondContact O-CG1 3.35Å; K364-I368 PolarHBondContact O-N 2.85Å |
| 365 | L | 98.1 | Very high | 97.8 | Very high | 98 Ų | 98 | 105.2 Ų | 105.2 | 51% | 0.513 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.6 | -41.5 | 175.8 | 179.4 | 60.8 | 0 | 0 | 0 | 111.5 | K361 Q362 L363 D367 I368 L369 | K361-L365 PolarHBondContact O-N 2.96Å; Q362-L365 WeakPolarHBondContact O-CB 3.47Å; Q362-L365 PolarHBondContact O-N 3.47Å; L363-L365 VanDerWaalsContact C-N 3.29Å; L363-L365 PolarHBondContact O-N 3.36Å; L365-D367 VanDerWaalsContact C-N 3.32Å; L365-D367 PolarHBondContact O-N 2.7Å; L365-I368 PolarHBondContact O-N 3.34Å; L365-L369 HydrophobicContact CD1-CD1 4.1Å; L365-L369 HydrophobicContact CD1-CG 4.1Å; L365-L369 HydrophobicContact CG-CD1 3.86Å; L365-L369 HydrophobicContact CG-CG 4.33Å; L365-L369 WeakPolarHBondContact O-CB 3.41Å; L365-L369 VanDerWaalsContact O-CG 3.27Å; L365-L369 WeakPolarHBondContact O-CG 3.17Å; L365-L369 PolarHBondContact O-N 3.49Å |
| 366 | I | 97.8 | Very high | 97.7 | Very high | 79 Ų | 79 | 107.4 Ų | 107.4 | 41% | 0.405 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.9 | -42.4 | 174.6 | -70.7 | 162.8 | 0 | 0 | 0 | 110.9 | Q362 L363 L369 K370 | Q362-I366 WeakPolarHBondContact O-CG1 3.19Å; Q362-I366 PolarHBondContact O-N 2.95Å; L363-I366 WeakPolarHBondContact O-CB 3.22Å; L363-I366 PolarHBondContact O-N 3.44Å; L363-I366 VanDerWaalsContact O-N 3.14Å; I366-L369 PolarHBondContact O-N 2.93Å; I366-K370 HydrophobicContact CG2-CD 4.04Å; I366-K370 VanDerWaalsContact CG2-CE 3.48Å; I366-K370 HydrophobicContact CG2-CG 4.45Å; I366-K370 WeakPolarHBondContact O-CB 3.39Å; I366-K370 VanDerWaalsContact O-CG 3.26Å; I366-K370 WeakPolarHBondContact O-CG 3.4Å; I366-K370 PolarHBondContact O-N 3.01Å |
| 367 | D | 98.1 | Very high | 97.6 | Very high | 90 Ų | 90 | 108.4 Ų | 108.4 | 48% | 0.481 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.4 | -36 | 178.8 | -63.6 | -29.8 | 0 | 0 | 0 | 112.6 | L363 K364 L365 R371 | L363-D367 PolarHBondContact O-N 2.66Å; K364-D367 PolarHBondContact O-N 3.38Å; L365-D367 VanDerWaalsContact C-N 3.32Å; L365-D367 PolarHBondContact O-N 2.7Å; D367-R371 WeakPolarHBondContact O-CB 3.36Å; D367-R371 PolarHBondContact O-N 2.65Å; D367-R371 VanDerWaalsContact O-N 3.16Å |
| 368 | I | 97.9 | Very high | 97.4 | Very high | 87 Ų | 87 | 109 Ų | 109 | 45% | 0.446 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.2 | -47.6 | 172.2 | -68.8 | 164.5 | 0 | 0 | 0 | 110.7 | K364 L365 K370 R371 Q372 | K364-I368 VanDerWaalsContact O-CG1 3.3Å; K364-I368 WeakPolarHBondContact O-CG1 3.35Å; K364-I368 PolarHBondContact O-N 2.85Å; L365-I368 PolarHBondContact O-N 3.34Å; I368-K370 PolarHBondContact O-N 3.28Å; I368-R371 WeakPolarHBondContact O-CB 3.25Å; I368-R371 PolarHBondContact O-N 2.8Å; I368-Q372 HydrophobicContact CG2-CG 4.33Å; I368-Q372 WeakPolarHBondContact O-CG 3.45Å; I368-Q372 PolarHBondContact O-N 3.19Å |
| 369 | L | 97.7 | Very high | 97.2 | Very high | 91 Ų | 91 | 110.4 Ų | 110.4 | 48% | 0.476 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.9 | -40 | 179.9 | -72.7 | 169.5 | 0 | 0 | 0 | 112.2 | L365 I366 R371 Q372 K373 | L365-L369 HydrophobicContact CD1-CD1 4.1Å; L365-L369 HydrophobicContact CD1-CG 4.1Å; L365-L369 HydrophobicContact CG-CD1 3.86Å; L365-L369 HydrophobicContact CG-CG 4.33Å; L365-L369 WeakPolarHBondContact O-CB 3.41Å; L365-L369 VanDerWaalsContact O-CG 3.27Å; L365-L369 WeakPolarHBondContact O-CG 3.17Å; L365-L369 PolarHBondContact O-N 3.49Å; I366-L369 PolarHBondContact O-N 2.93Å; L369-R371 VanDerWaalsContact C-N 3.35Å; L369-R371 PolarHBondContact O-N 3.41Å; L369-Q372 PolarHBondContact O-N 2.95Å; L369-K373 WeakPolarHBondContact O-CB 3.37Å; L369-K373 PolarHBondContact O-N 2.99Å |
| 370 | K | 97.8 | Very high | 97 | Very high | 134 Ų | 134 | 111.9 Ų | 111.9 | 58% | 0.583 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -59.4 | -44.8 | 172.1 | -76.7 | 169.6 | -179.7 | 170.5 | 0 | 111.6 | I366 I368 K373 M374 | I366-K370 HydrophobicContact CG2-CD 4.04Å; I366-K370 VanDerWaalsContact CG2-CE 3.48Å; I366-K370 HydrophobicContact CG2-CG 4.45Å; I366-K370 WeakPolarHBondContact O-CB 3.39Å; I366-K370 VanDerWaalsContact O-CG 3.26Å; I366-K370 WeakPolarHBondContact O-CG 3.4Å; I366-K370 PolarHBondContact O-N 3.01Å; I368-K370 PolarHBondContact O-N 3.28Å; K370-K373 PolarHBondContact O-N 3.45Å; K370-M374 PolarHBondContact O-N 3.17Å |
| 371 | R | 97.3 | Very high | 96.8 | Very high | 161 Ų | 161 | 111.5 Ų | 111.5 | 61% | 0.608 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -65.4 | -43.9 | 177.6 | -173.7 | -175 | -58.1 | -87.3 | -2.9 | 111.7 | D367 I368 L369 M374 H375 | D367-R371 WeakPolarHBondContact O-CB 3.36Å; D367-R371 PolarHBondContact O-N 2.65Å; D367-R371 VanDerWaalsContact O-N 3.16Å; I368-R371 WeakPolarHBondContact O-CB 3.25Å; I368-R371 PolarHBondContact O-N 2.8Å; L369-R371 VanDerWaalsContact C-N 3.35Å; L369-R371 PolarHBondContact O-N 3.41Å; R371-M374 PolarHBondContact O-N 2.82Å; R371-H375 WeakPolarHBondContact CG-NE2 3.38Å; R371-H375 PolarHBondContact O-CD2 3.48Å; R371-H375 PolarHBondContact O-N 3.13Å |
| 372 | Q | 97.3 | Very high | 96.5 | Very high | 111 Ų | 111 | 109 Ų | 109 | 52% | 0.519 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.9 | -43.9 | 175.2 | -74.9 | 173.8 | -28.5 | 0 | 0 | 111.7 | I368 L369 M374 H375 F376 | I368-Q372 HydrophobicContact CG2-CG 4.33Å; I368-Q372 WeakPolarHBondContact O-CG 3.45Å; I368-Q372 PolarHBondContact O-N 3.19Å; L369-Q372 PolarHBondContact O-N 2.95Å; Q372-M374 PolarHBondContact O-N 3.36Å; Q372-H375 PolarHBondContact O-N 3.42Å; Q372-F376 WeakPolarHBondContact O-CB 3.26Å; Q372-F376 PolarHBondContact O-N 2.88Å |
| 373 | K | 97.2 | Very high | 96.2 | Very high | 124 Ų | 124 | 106 Ų | 106 | 54% | 0.539 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -56.8 | -49.4 | 173.3 | 179.8 | -177.7 | 167.9 | -176.6 | 0 | 111.2 | L369 K370 H375 F376 E377 | L369-K373 WeakPolarHBondContact O-CB 3.37Å; L369-K373 PolarHBondContact O-N 2.99Å; K370-K373 PolarHBondContact O-N 3.45Å; K373-H375 VanDerWaalsContact C-N 3.35Å; K373-H375 PolarHBondContact O-N 2.94Å; K373-F376 PolarHBondContact O-N 3.2Å; K373-F376 VanDerWaalsContact O-N 3.13Å; K373-E377 WeakPolarHBondContact CE-OE1 3.41Å; K373-E377 WeakPolarHBondContact CE-OE2 3.29Å; K373-E377 HydrophobicContact CG-CG 4.41Å; K373-E377 IonicContact NZ-OE1 3.95Å; K373-E377 PolarHBondContact NZ-OE1 2.93Å; K373-E377 VanDerWaalsContact NZ-OE1 3.12Å; K373-E377 IonicContact NZ-OE2 3.67Å; K373-E377 PolarHBondContact O-N 2.86Å |
| 374 | M | 96.6 | Very high | 95.9 | Very high | 105 Ų | 105 | 106.7 Ų | 106.7 | 52% | 0.517 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -58.8 | -43.1 | 178.2 | -174.8 | -162.1 | 78.5 | 0 | 0 | 112.3 | K370 R371 Q372 A378 | K370-M374 PolarHBondContact O-N 3.17Å; R371-M374 PolarHBondContact O-N 2.82Å; Q372-M374 PolarHBondContact O-N 3.36Å; M374-A378 WeakPolarHBondContact O-CB 3.43Å; M374-A378 PolarHBondContact O-N 3.16Å |
| 375 | H | 97 | Very high | 95.5 | Very high | 109 Ų | 109 | 102.1 Ų | 102.1 | 51% | 0.505 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.1 | -37.8 | 175 | -69.4 | -56.5 | 0 | 0 | 0 | 112.5 | R371 Q372 K373 A379 | R371-H375 WeakPolarHBondContact CG-NE2 3.38Å; R371-H375 PolarHBondContact O-CD2 3.48Å; R371-H375 PolarHBondContact O-N 3.13Å; Q372-H375 PolarHBondContact O-N 3.42Å; K373-H375 VanDerWaalsContact C-N 3.35Å; K373-H375 PolarHBondContact O-N 2.94Å; H375-A379 WeakPolarHBondContact O-CB 3.36Å; H375-A379 PolarHBondContact O-N 3.47Å |
| 376 | F | 96.4 | Very high | 95.2 | Very high | 153 Ų | 153 | 102.6 Ų | 102.6 | 67% | 0.671 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -70.3 | -40.5 | 177.7 | -172.3 | -93.4 | 0 | 0 | 0 | 112.6 | Q372 K373 A379 K380 | Q372-F376 WeakPolarHBondContact O-CB 3.26Å; Q372-F376 PolarHBondContact O-N 2.88Å; K373-F376 PolarHBondContact O-N 3.2Å; K373-F376 VanDerWaalsContact O-N 3.13Å; F376-A379 PolarHBondContact O-N 2.87Å; F376-K380 WeakPolarHBondContact O-CB 3.48Å; F376-K380 PolarHBondContact O-N 2.86Å |
| 377 | E | 95.2 | Very high | 94.8 | Very high | 94 Ų | 94 | 103.9 Ų | 103.9 | 44% | 0.439 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.2 | -41.1 | 173.8 | -73.9 | 176.2 | 148.3 | 0 | 0 | 111.3 | K373 K380 L381 | K373-E377 WeakPolarHBondContact CE-OE1 3.41Å; K373-E377 WeakPolarHBondContact CE-OE2 3.29Å; K373-E377 HydrophobicContact CG-CG 4.41Å; K373-E377 IonicContact NZ-OE1 3.95Å; K373-E377 PolarHBondContact NZ-OE1 2.93Å; K373-E377 VanDerWaalsContact NZ-OE1 3.12Å; K373-E377 IonicContact NZ-OE2 3.67Å; K373-E377 PolarHBondContact O-N 2.86Å; E377-K380 PolarHBondContact O-N 2.83Å; E377-L381 WeakPolarHBondContact O-CG 3.49Å; E377-L381 PolarHBondContact O-N 2.68Å |
| 378 | A | 94.4 | Very high | 94.2 | Very high | 55 Ų | 55 | 103.7 Ų | 103.7 | 46% | 0.455 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.5 | -43.8 | 173 | 0 | 0 | 0 | 0 | 0 | 112.6 | M374 K380 L381 L382 | M374-A378 WeakPolarHBondContact O-CB 3.43Å; M374-A378 PolarHBondContact O-N 3.16Å; A378-K380 VanDerWaalsContact C-N 3.35Å; A378-K380 PolarHBondContact O-N 3.36Å; A378-L381 PolarHBondContact O-N 3.16Å; A378-L382 PolarHBondContact O-N 3.23Å |
| 379 | A | 94.2 | Very high | 93.7 | Very high | 58 Ų | 58 | 106.1 Ų | 106.1 | 48% | 0.479 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.4 | -36.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | H375 F376 L382 S383 | H375-A379 WeakPolarHBondContact O-CB 3.36Å; H375-A379 PolarHBondContact O-N 3.47Å; F376-A379 PolarHBondContact O-N 2.87Å; A379-L382 PolarHBondContact O-N 2.71Å; A379-S383 PolarHBondContact O-N 2.93Å |
| 380 | K | 94.2 | Very high | 93.2 | Very high | 145 Ų | 145 | 106.8 Ų | 106.8 | 63% | 0.63 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -69.9 | -35.7 | 175.3 | -174.2 | 179.7 | 177.9 | -175.7 | 0 | 112.8 | F376 E377 A378 L382 S383 F384 | F376-K380 WeakPolarHBondContact O-CB 3.48Å; F376-K380 PolarHBondContact O-N 2.86Å; E377-K380 PolarHBondContact O-N 2.83Å; A378-K380 VanDerWaalsContact C-N 3.35Å; A378-K380 PolarHBondContact O-N 3.36Å; K380-L382 VanDerWaalsContact C-N 3.33Å; K380-S383 PolarHBondContact O-OG 2.94Å; K380-F384 WeakPolarHBondContact O-CB 3.5Å; K380-F384 PolarHBondContact O-N 3.27Å; K380-F384 VanDerWaalsContact O-N 3.1Å |
| 381 | L | 92.4 | Very high | 92.6 | Very high | 128 Ų | 128 | 104.7 Ų | 104.7 | 67% | 0.67 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -67.2 | -37.1 | 172.4 | -73.8 | 167.8 | 0 | 0 | 0 | 111.4 | E377 A378 A385 | E377-L381 WeakPolarHBondContact O-CG 3.49Å; E377-L381 PolarHBondContact O-N 2.68Å; A378-L381 PolarHBondContact O-N 3.16Å; L381-A385 PolarHBondContact O-N 3.36Å; L381-A385 VanDerWaalsContact O-N 3.13Å |
| 382 | L | 92.4 | Very high | 92 | Very high | 102 Ų | 102 | 99.8 Ų | 99.8 | 53% | 0.534 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65 | -48.9 | 173.8 | -175.3 | 65.1 | 0 | 0 | 0 | 111.6 | A378 A379 K380 F384 A385 E386 | A378-L382 PolarHBondContact O-N 3.23Å; A379-L382 PolarHBondContact O-N 2.71Å; K380-L382 VanDerWaalsContact C-N 3.33Å; L382-F384 VanDerWaalsContact C-N 3.28Å; L382-F384 PolarHBondContact O-N 3.4Å; L382-A385 WeakPolarHBondContact O-CA 3.48Å; L382-A385 WeakPolarHBondContact O-CB 3.28Å; L382-A385 PolarHBondContact O-N 3.28Å; L382-E386 WeakPolarHBondContact O-CG 3.29Å; L382-E386 PolarHBondContact O-N 2.91Å |
| 383 | S | 91.9 | Very high | 91.2 | Very high | 45 Ų | 45 | 99.1 Ų | 99.1 | 32% | 0.315 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.6 | -33.4 | 179.6 | 74.4 | 0 | 0 | 0 | 0 | 112.6 | A379 K380 E386 E387 | A379-S383 PolarHBondContact O-N 2.93Å; K380-S383 PolarHBondContact O-OG 2.94Å; S383-E386 PolarHBondContact O-N 3.49Å; S383-E387 WeakPolarHBondContact O-CB 3.34Å; S383-E387 WeakPolarHBondContact O-CG 3.22Å; S383-E387 PolarHBondContact O-N 2.84Å |
| 384 | F | 92.3 | Very high | 90.2 | Very high | 121 Ų | 121 | 97 Ų | 97 | 53% | 0.531 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.9 | -41.3 | 171.8 | -176.6 | -96.6 | 0 | 0 | 0 | 112 | K380 L382 E387 E388 | K380-F384 WeakPolarHBondContact O-CB 3.5Å; K380-F384 PolarHBondContact O-N 3.27Å; K380-F384 VanDerWaalsContact O-N 3.1Å; L382-F384 VanDerWaalsContact C-N 3.28Å; L382-F384 PolarHBondContact O-N 3.4Å; F384-E387 PolarHBondContact O-N 3.45Å; F384-E388 HydrophobicContact CD1-CG 4.27Å; F384-E388 HydrophobicContact CE1-CG 3.82Å; F384-E388 HydrophobicContact CE2-CG 4.38Å; F384-E388 HydrophobicContact CZ-CG 3.87Å; F384-E388 WeakPolarHBondContact O-CG 3.05Å; F384-E388 PolarHBondContact O-N 2.9Å |
| 385 | A | 90.1 | Very high | 88.6 | Confident | 55 Ų | 55 | 102.5 Ų | 102.5 | 46% | 0.455 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.1 | -36.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L381 L382 F389 | L381-A385 PolarHBondContact O-N 3.36Å; L381-A385 VanDerWaalsContact O-N 3.13Å; L382-A385 WeakPolarHBondContact O-CA 3.48Å; L382-A385 WeakPolarHBondContact O-CB 3.28Å; L382-A385 PolarHBondContact O-N 3.28Å; A385-F389 WeakPolarHBondContact O-CB 3.42Å; A385-F389 PolarHBondContact O-N 3.45Å |
| 386 | E | 90.3 | Very high | 86.7 | Confident | 108 Ų | 108 | 100.7 Ų | 100.7 | 51% | 0.505 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65 | -44.2 | 173.3 | -69.6 | 169.1 | 172.2 | 0 | 0 | 111.7 | L382 S383 F389 M390 | L382-E386 WeakPolarHBondContact O-CG 3.29Å; L382-E386 PolarHBondContact O-N 2.91Å; S383-E386 PolarHBondContact O-N 3.49Å; E386-F389 PolarHBondContact O-N 3.25Å; E386-M390 WeakPolarHBondContact O-CB 3.38Å; E386-M390 VanDerWaalsContact O-CG 3.3Å; E386-M390 WeakPolarHBondContact O-CG 3.3Å; E386-M390 PolarHBondContact O-N 2.89Å |
| 387 | E | 89.3 | Confident | 84.8 | Confident | 105 Ų | 105 | 100.6 Ų | 100.6 | 49% | 0.491 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.5 | -46.6 | 175.3 | -79.5 | 179.5 | -142.6 | 0 | 0 | 112.7 | S383 F384 M390 K391 | S383-E387 WeakPolarHBondContact O-CB 3.34Å; S383-E387 WeakPolarHBondContact O-CG 3.22Å; S383-E387 PolarHBondContact O-N 2.84Å; F384-E387 PolarHBondContact O-N 3.45Å; E387-M390 PolarHBondContact O-N 2.87Å; E387-K391 VanDerWaalsContact O-CG 3.31Å; E387-K391 WeakPolarHBondContact O-CG 3.41Å; E387-K391 PolarHBondContact O-N 3.06Å; E387-K391 IonicContact OE2-NZ 3.85Å |
| 388 | E | 87.3 | Confident | 82.6 | Confident | 87 Ų | 87 | 105.8 Ų | 105.8 | 41% | 0.407 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -66.8 | -36.9 | 177.8 | -67.2 | -62.2 | 108.4 | 0 | 0 | 111.8 | F384 K391 A392 | F384-E388 HydrophobicContact CD1-CG 4.27Å; F384-E388 HydrophobicContact CE1-CG 3.82Å; F384-E388 HydrophobicContact CE2-CG 4.38Å; F384-E388 HydrophobicContact CZ-CG 3.87Å; F384-E388 WeakPolarHBondContact O-CG 3.05Å; F384-E388 PolarHBondContact O-N 2.9Å; E388-K391 PolarHBondContact O-N 3.16Å; E388-K391 WeakPolarHBondContact OE1-CD 3.42Å; E388-K391 IonicContact OE1-NZ 2.64Å; E388-K391 PolarHBondContact OE1-NZ 2.89Å; E388-A392 PolarHBondContact O-N 3.49Å |
| 389 | F | 86.5 | Confident | 82 | Confident | 137 Ų | 137 | 108.3 Ų | 108.3 | 60% | 0.601 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -64.3 | -41.6 | 174.2 | -176.7 | -101.3 | 0 | 0 | 0 | 112 | A385 E386 A392 L393 | A385-F389 WeakPolarHBondContact O-CB 3.42Å; A385-F389 PolarHBondContact O-N 3.45Å; E386-F389 PolarHBondContact O-N 3.25Å; F389-A392 PolarHBondContact O-N 3.49Å; F389-L393 HydrophobicContact CD1-CD1 4.06Å; F389-L393 HydrophobicContact CE1-CD1 3.69Å; F389-L393 HydrophobicContact CE1-CG 4.41Å; F389-L393 HydrophobicContact CZ-CD1 4.3Å; F389-L393 WeakPolarHBondContact O-CG 3.45Å; F389-L393 PolarHBondContact O-N 2.65Å |
| 390 | M | 87.6 | Confident | 81.4 | Confident | 106 Ų | 106 | 110.9 Ų | 110.9 | 52% | 0.522 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -64.8 | -41.8 | 175.1 | -72.6 | -66 | -65.9 | 0 | 0 | 112.3 | E386 E387 A392 L393 D394 | E386-M390 WeakPolarHBondContact O-CB 3.38Å; E386-M390 VanDerWaalsContact O-CG 3.3Å; E386-M390 WeakPolarHBondContact O-CG 3.3Å; E386-M390 PolarHBondContact O-N 2.89Å; E387-M390 PolarHBondContact O-N 2.87Å; M390-A392 VanDerWaalsContact C-N 3.31Å; M390-A392 PolarHBondContact O-N 3.26Å; M390-L393 WeakPolarHBondContact O-CB 3.47Å; M390-L393 PolarHBondContact O-N 3.5Å; M390-L393 VanDerWaalsContact O-N 3.1Å; M390-L393 HydrophobicContact SD-CD1 4.31Å; M390-D394 PolarHBondContact O-N 3.24Å |
| 391 | K | 85.9 | Confident | 80.6 | Confident | 90 Ų | 90 | 109.1 Ų | 109.1 | 39% | 0.391 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -59.1 | -41.7 | 174 | -69 | 163.8 | -157.3 | 165.9 | 0 | 111.7 | E387 E388 L393 D394 W395 | E387-K391 VanDerWaalsContact O-CG 3.31Å; E387-K391 WeakPolarHBondContact O-CG 3.41Å; E387-K391 PolarHBondContact O-N 3.06Å; E387-K391 IonicContact OE2-NZ 3.85Å; E388-K391 PolarHBondContact O-N 3.16Å; E388-K391 WeakPolarHBondContact OE1-CD 3.42Å; E388-K391 IonicContact OE1-NZ 2.64Å; E388-K391 PolarHBondContact OE1-NZ 2.89Å; K391-L393 VanDerWaalsContact C-N 3.26Å; K391-L393 PolarHBondContact O-N 3.46Å; K391-D394 PolarHBondContact O-N 3.42Å; K391-W395 PolarHBondContact O-N 2.99Å; K391-W395 VanDerWaalsContact O-N 3.1Å |
| 392 | A | 82.9 | Confident | 79.9 | Confident | 57 Ų | 57 | 107.9 Ų | 107.9 | 47% | 0.471 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -65.5 | -25.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | E388 F389 M390 | E388-A392 PolarHBondContact O-N 3.49Å; F389-A392 PolarHBondContact O-N 3.49Å; M390-A392 VanDerWaalsContact C-N 3.31Å; M390-A392 PolarHBondContact O-N 3.26Å |
| 393 | L | 80.9 | Confident | 79.2 | Confident | 97 Ų | 97 | 108.3 Ų | 108.3 | 51% | 0.508 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -79.5 | -39 | 172.8 | -68.8 | 173.3 | 0 | 0 | 0 | 112.7 | F389 M390 K391 G396 | F389-L393 HydrophobicContact CD1-CD1 4.06Å; F389-L393 HydrophobicContact CE1-CD1 3.69Å; F389-L393 HydrophobicContact CE1-CG 4.41Å; F389-L393 HydrophobicContact CZ-CD1 4.3Å; F389-L393 WeakPolarHBondContact O-CG 3.45Å; F389-L393 PolarHBondContact O-N 2.65Å; M390-L393 WeakPolarHBondContact O-CB 3.47Å; M390-L393 PolarHBondContact O-N 3.5Å; M390-L393 VanDerWaalsContact O-N 3.1Å; M390-L393 HydrophobicContact SD-CD1 4.31Å; K391-L393 VanDerWaalsContact C-N 3.26Å; K391-L393 PolarHBondContact O-N 3.46Å; L393-G396 PolarHBondContact O-N 2.9Å |
| 394 | D | 75.9 | Confident | 78.3 | Confident | 79 Ų | 79 | 112.5 Ų | 112.5 | 42% | 0.422 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -77.8 | -16.7 | -179.1 | -79.2 | -34.2 | 0 | 0 | 0 | 113.9 | M390 K391 G396 K397 | M390-D394 PolarHBondContact O-N 3.24Å; K391-D394 PolarHBondContact O-N 3.42Å; D394-G396 PolarHBondContact O-N 3.14Å; D394-K397 PolarHBondContact O-N 2.9Å; D394-K397 IonicContact OD1-NZ 2.69Å; D394-K397 PolarHBondContact OD1-NZ 3.27Å |
| 395 | W | 62.6 | Low | 77.3 | Confident | 221 Ų | 221 | 111.9 Ų | 111.9 | 84% | 0.837 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.9 | -9.1 | 164.7 | -77.9 | -19.5 | 0 | 0 | 0 | 114.6 | K391 | K391-W395 PolarHBondContact O-N 2.99Å; K391-W395 VanDerWaalsContact O-N 3.1Å |
| 396 | G | 57.5 | Low | 76.3 | Confident | 71 Ų | 71 | 116.3 Ų | 116.3 | 73% | 0.732 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.9 | 3.7 | 171.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | L393 D394 | L393-G396 PolarHBondContact O-N 2.9Å; D394-G396 PolarHBondContact O-N 3.14Å |
| 397 | K | 58 | Low | 75.2 | Confident | 151 Ų | 151 | 117 Ų | 117 | 66% | 0.657 | 62% | 0.622 | S | S | * | * | trans | -121.4 | 135.1 | -177.4 | -63.5 | 169.7 | -165.2 | 151.5 | 0 | 111 | D394 | D394-K397 PolarHBondContact O-N 2.9Å; D394-K397 IonicContact OD1-NZ 2.69Å; D394-K397 PolarHBondContact OD1-NZ 3.27Å | ||
| 398 | S | 47.7 | Very low | 73.9 | Confident | 203 Ų | 203 | 118.1 Ų | 118.1 | 100% | 1.42 | 63% | 0.633 | S | S | * | * | trans | -62.4 | 0 | -166.8 | -53.8 | 0 | 0 | 0 | 0 | 115.9 |
Retrieved 398 of 398 residues in 417.9 ms
(Link to these results)