| 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 | E | 38.6 | Very low | 37.5 | Very low | 237 Ų | 237 | 152.1 Ų | 152.1 | 100% | 1.107 | 82% | 0.817 | S | S | * | * | 0 | 76.8 | 0 | -65.9 | 176.9 | 170.5 | 0 | 0 | 105.3 | |||||
| 2 | E | 37.8 | Very low | 37.8 | Very low | 175 Ų | 175 | 153.9 Ų | 153.9 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | 78.7 | 98.2 | 99.3 | -76.5 | -172.6 | -178.7 | 0 | 0 | 110.1 | |||||
| 3 | E | 42.1 | Very low | 38.1 | Very low | 166 Ų | 166 | 156.2 Ų | 156.2 | 78% | 0.776 | 82% | 0.819 | S | S | * | * | 80 | 132.2 | 91.8 | -75.9 | -167.1 | -162 | 0 | 0 | 111.3 | |||||
| 4 | E | 43 | Very low | 38.2 | Very low | 157 Ų | 157 | 157.8 Ų | 157.8 | 73% | 0.734 | 82% | 0.821 | S | S | * | * | -155.7 | 135.8 | 50 | -98.4 | -175.4 | 130.1 | 0 | 0 | 110.4 | |||||
| 5 | Q | 42.1 | Very low | 38.8 | Very low | 160 Ų | 160 | 156.7 Ų | 156.7 | 75% | 0.748 | 82% | 0.824 | S | S | * | * | 67 | 135.3 | 95.1 | -62.6 | -178.3 | 42.6 | 0 | 0 | 115.3 | |||||
| 6 | G | 32.7 | Very low | 38.6 | Very low | 82 Ų | 82 | 154.9 Ų | 154.9 | 85% | 0.845 | 82% | 0.821 | S | S | * | * | cis | -163.8 | -177.5 | 4.8 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 7 | G | 34 | Very low | 38.9 | Very low | 69 Ų | 69 | 152.2 Ų | 152.2 | 71% | 0.711 | 82% | 0.817 | S | S | * | * | cis | 150.8 | 118.2 | 7.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 8 | M | 34.2 | Very low | 38.8 | Very low | 192 Ų | 192 | 147.8 Ų | 147.8 | 95% | 0.946 | 81% | 0.814 | S | S | * | * | trans | 64.9 | 150.7 | 158.3 | -74.3 | 141.2 | 169.8 | 0 | 0 | 118.2 | ||||
| 9 | D | 33.1 | Very low | 39.2 | Very low | 152 Ų | 152 | 149.1 Ų | 149.1 | 81% | 0.813 | 81% | 0.814 | S | S | * | * | cis | -158.4 | 171.4 | 18.3 | -157.6 | 6.1 | 0 | 0 | 0 | 111.9 | ||||
| 10 | R | 41.5 | Very low | 39.7 | Very low | 219 Ų | 219 | 151.5 Ų | 151.5 | 83% | 0.826 | 82% | 0.819 | S | S | * | * | trans | -103.7 | 162.5 | -167.5 | 179.9 | -176 | 178.5 | -178.5 | -0.4 | 112.3 | ||||
| 11 | G | 33.3 | Very low | 40.4 | Very low | 64 Ų | 64 | 149.3 Ų | 149.3 | 66% | 0.66 | 81% | 0.807 | S | S | * | * | trans | 128.9 | 104.9 | 159.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 12 | E | 41 | Very low | 41.4 | Very low | 174 Ų | 174 | 147 Ų | 147 | 81% | 0.813 | 80% | 0.796 | S | S | * | * | 64.8 | 117.1 | 79.9 | -76.6 | -176.6 | -163.7 | 0 | 0 | 115.6 | |||||
| 13 | E | 42.7 | Very low | 42.3 | Very low | 183 Ų | 183 | 140.8 Ų | 140.8 | 86% | 0.855 | 78% | 0.779 | S | S | * | * | trans | 44.6 | 123.8 | 153.6 | -54.6 | -163.7 | 175.4 | 0 | 0 | 121.7 | ||||
| 14 | E | 38.2 | Very low | 43.1 | Very low | 179 Ų | 179 | 137.7 Ų | 137.7 | 84% | 0.836 | 77% | 0.765 | S | S | * | * | -177.5 | 131.5 | 113.3 | -108.5 | -173.6 | 161.6 | 0 | 0 | 111.8 | |||||
| 15 | T | 47.2 | Very low | 44.4 | Very low | 141 Ų | 141 | 135.2 Ų | 135.2 | 87% | 0.865 | 76% | 0.757 | S | S | * | * | trans | -77.5 | 116.7 | 165.9 | 49.8 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 16 | V | 36.6 | Very low | 45.9 | Very low | 128 Ų | 128 | 131.4 Ų | 131.4 | 78% | 0.776 | 74% | 0.739 | S | S | * | * | trans | -115.8 | 108 | 164 | 166.2 | 0 | 0 | 0 | 0 | 109 | ||||
| 17 | S | 43.3 | Very low | 48 | Very low | 109 Ų | 109 | 136.7 Ų | 136.7 | 76% | 0.762 | 73% | 0.733 | S | S | * | * | trans | -71.5 | 114.5 | 163.4 | -178.6 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 18 | G | 36.5 | Very low | 50.2 | Low | 74 Ų | 74 | 138.7 Ų | 138.7 | 76% | 0.763 | 72% | 0.723 | S | S | * | * | trans | -115 | 90.8 | 168.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 19 | E | 48 | Very low | 52.3 | Low | 172 Ų | 172 | 136.5 Ų | 136.5 | 80% | 0.804 | 70% | 0.704 | S | S | * | * | trans | -72.8 | 127.2 | 156.7 | -71.2 | 179.8 | 147 | 0 | 0 | 107.4 | ||||
| 20 | E | 47.6 | Very low | 54.7 | Low | 196 Ų | 196 | 134.5 Ų | 134.5 | 92% | 0.916 | 69% | 0.69 | S | S | * | * | 167.6 | 138.3 | 129.5 | -88.4 | 173 | -165.8 | 0 | 0 | 112 | |||||
| 21 | D | 55.9 | Low | 56.8 | Low | 107 Ų | 107 | 131.7 Ų | 131.7 | 57% | 0.572 | 68% | 0.683 | S | S | * | * | trans | 100.2 | 50.2 | 158.8 | -146.6 | 19 | 0 | 0 | 0 | 121.2 | G23 | D21-G23 VanDerWaalsContact C-N 3.25Š| ||
| 22 | E | 57.9 | Low | 59.1 | Low | 187 Ų | 187 | 133.8 Ų | 133.8 | 87% | 0.874 | 68% | 0.679 | S | S | * | * | trans | -82 | 5.5 | 160.5 | -70.7 | -168 | 158 | 0 | 0 | 113.7 | ||||
| 23 | G | 57.6 | Low | 61.1 | Low | 46 Ų | 46 | 129.8 Ų | 129.8 | 47% | 0.474 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -85.5 | -28.1 | -172.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | D21 | D21-G23 VanDerWaalsContact C-N 3.25Å |
| 24 | E | 59.7 | Low | 63 | Low | 101 Ų | 101 | 127.7 Ų | 127.7 | 47% | 0.472 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -77.6 | -33.1 | -179.1 | -77.8 | -155.2 | 153.2 | 0 | 0 | 113.7 | R27 K28 | E24-R27 PolarHBondContact O-N 2.76Å; E24-K28 WeakPolarHBondContact O-CG 3.36Å; E24-K28 PolarHBondContact O-N 2.75Å; E24-K28 WeakPolarHBondContact OE2-CE 3.22Å; E24-K28 IonicContact OE2-NZ 2.76Å; E24-K28 PolarHBondContact OE2-NZ 3.32Å |
| 25 | D | 68.9 | Low | 65.1 | Low | 104 Ų | 104 | 121.5 Ų | 121.5 | 56% | 0.556 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -72.7 | -33.1 | -171.5 | -74 | -18.9 | 0 | 0 | 0 | 112.7 | R27 K28 R29 | D25-R27 VanDerWaalsContact C-N 3.34Å; D25-R27 PolarHBondContact O-N 3.01Å; D25-K28 PolarHBondContact O-N 3.17Å; D25-K28 IonicContact OD1-NZ 3.77Å; D25-R29 WeakPolarHBondContact O-CB 3.46Å; D25-R29 PolarHBondContact O-N 3.47Å |
| 26 | E | 74.1 | Confident | 66.6 | Low | 80 Ų | 80 | 119.8 Ų | 119.8 | 37% | 0.374 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -69.9 | -32.9 | 175.4 | -171.5 | 54 | -142.5 | 0 | 0 | 111.5 | R29 Q30 | E26-R29 PolarHBondContact O-N 3.48Å; E26-R29 IonicContact OE1-NH1 3.6Å; E26-R29 IonicContact OE2-CZ 3.93Å; E26-R29 IonicContact OE2-NH1 2.88Å; E26-R29 PolarHBondContact OE2-NH1 2.9Å; E26-Q30 VanDerWaalsContact O-CG 3.28Å; E26-Q30 WeakPolarHBondContact O-CG 3.35Å; E26-Q30 PolarHBondContact O-N 3.4Å; E26-Q30 PolarHBondContact OE1-NE2 3.22Å |
| 27 | R | 76.3 | Confident | 68.4 | Low | 193 Ų | 193 | 123.9 Ų | 123.9 | 73% | 0.728 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -70.7 | -40.3 | 174.3 | -65.5 | -177.6 | -178.6 | -165 | 1.4 | 111.9 | E24 D25 R29 Q30 K31 | E24-R27 PolarHBondContact O-N 2.76Å; D25-R27 VanDerWaalsContact C-N 3.34Å; D25-R27 PolarHBondContact O-N 3.01Å; R27-R29 VanDerWaalsContact C-N 3.33Å; R27-Q30 PolarHBondContact O-N 3.01Å; R27-K31 PolarHBondContact O-N 2.94Å; R27-K31 VanDerWaalsContact O-N 3.1Å |
| 28 | K | 80.4 | Confident | 69.9 | Low | 112 Ų | 112 | 123.4 Ų | 123.4 | 49% | 0.487 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -63.5 | -40.9 | 174.2 | -69.1 | 166.7 | -169 | 158.9 | 0 | 110.6 | E24 D25 K31 L32 | E24-K28 WeakPolarHBondContact O-CG 3.36Å; E24-K28 PolarHBondContact O-N 2.75Å; E24-K28 WeakPolarHBondContact OE2-CE 3.22Å; E24-K28 IonicContact OE2-NZ 2.76Å; E24-K28 PolarHBondContact OE2-NZ 3.32Å; D25-K28 PolarHBondContact O-N 3.17Å; D25-K28 IonicContact OD1-NZ 3.77Å; K28-K31 PolarHBondContact O-N 3.32Å; K28-L32 PolarHBondContact O-N 3.41Å |
| 29 | R | 79.4 | Confident | 71.6 | Confident | 145 Ų | 145 | 127.1 Ų | 127.1 | 55% | 0.547 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -64.4 | -41.1 | 176.4 | -173.9 | 177.8 | 173.6 | -134.8 | 2.9 | 113 | D25 E26 R27 L32 L33 | D25-R29 WeakPolarHBondContact O-CB 3.46Å; D25-R29 PolarHBondContact O-N 3.47Å; E26-R29 PolarHBondContact O-N 3.48Å; E26-R29 IonicContact OE1-NH1 3.6Å; E26-R29 IonicContact OE2-CZ 3.93Å; E26-R29 IonicContact OE2-NH1 2.88Å; E26-R29 PolarHBondContact OE2-NH1 2.9Å; R27-R29 VanDerWaalsContact C-N 3.33Å; R29-L32 WeakPolarHBondContact O-CB 3.28Å; R29-L32 PolarHBondContact O-N 2.88Å; R29-L33 WeakPolarHBondContact O-CG 3.49Å; R29-L33 PolarHBondContact O-N 3.3Å |
| 30 | Q | 83.3 | Confident | 72.2 | Confident | 111 Ų | 111 | 121.7 Ų | 121.7 | 52% | 0.519 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -66.6 | -41.6 | 175.8 | -73 | 173.6 | 18.9 | 0 | 0 | 112.2 | E26 R27 L32 L33 E34 | E26-Q30 VanDerWaalsContact O-CG 3.28Å; E26-Q30 WeakPolarHBondContact O-CG 3.35Å; E26-Q30 PolarHBondContact O-N 3.4Å; E26-Q30 PolarHBondContact OE1-NE2 3.22Å; R27-Q30 PolarHBondContact O-N 3.01Å; Q30-L32 VanDerWaalsContact C-N 3.31Å; Q30-L32 PolarHBondContact O-N 3.39Å; Q30-L33 PolarHBondContact O-N 3.06Å; Q30-E34 PolarHBondContact O-N 3.45Å |
| 31 | K | 85.6 | Confident | 72.7 | Confident | 160 Ų | 160 | 115.3 Ų | 115.3 | 70% | 0.696 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -60.2 | -38.5 | 172.4 | -95.6 | 178.2 | 175.4 | 174.3 | 0 | 112.8 | R27 K28 E34 A35 | R27-K31 PolarHBondContact O-N 2.94Å; R27-K31 VanDerWaalsContact O-N 3.1Å; K28-K31 PolarHBondContact O-N 3.32Å; K31-E34 PolarHBondContact O-N 3.48Å; K31-A35 WeakPolarHBondContact O-CB 3.42Å; K31-A35 PolarHBondContact O-N 2.95Å |
| 32 | L | 81.5 | Confident | 73.1 | Confident | 107 Ų | 107 | 120.2 Ų | 120.2 | 56% | 0.56 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -65 | -44.2 | 175.9 | -174.9 | 73.9 | 0 | 0 | 0 | 111.7 | K28 R29 Q30 E34 A35 I36 | K28-L32 PolarHBondContact O-N 3.41Å; R29-L32 WeakPolarHBondContact O-CB 3.28Å; R29-L32 PolarHBondContact O-N 2.88Å; Q30-L32 VanDerWaalsContact C-N 3.31Å; Q30-L32 PolarHBondContact O-N 3.39Å; L32-E34 VanDerWaalsContact C-N 3.33Å; L32-E34 PolarHBondContact O-N 3.1Å; L32-A35 PolarHBondContact O-N 3.47Å; L32-I36 HydrophobicContact CG-CD1 4.12Å; L32-I36 VanDerWaalsContact O-CG1 3.29Å; L32-I36 WeakPolarHBondContact O-CG1 3.35Å; L32-I36 PolarHBondContact O-N 3.48Å |
| 33 | L | 82.3 | Confident | 73.2 | Confident | 91 Ų | 91 | 122.6 Ų | 122.6 | 48% | 0.476 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -65.6 | -36.3 | 178 | -71 | 172.6 | 0 | 0 | 0 | 112.3 | R29 Q30 R37 | R29-L33 WeakPolarHBondContact O-CG 3.49Å; R29-L33 PolarHBondContact O-N 3.3Å; Q30-L33 PolarHBondContact O-N 3.06Å; L33-R37 WeakPolarHBondContact O-CG 3.29Å; L33-R37 PolarHBondContact O-N 3.46Å |
| 34 | E | 82.8 | Confident | 73.3 | Confident | 139 Ų | 139 | 130.2 Ų | 130.2 | 65% | 0.65 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -69 | -41 | 174.4 | -167.5 | 172.1 | -166.9 | 0 | 0 | 111.7 | Q30 K31 L32 I36 R37 S38 | Q30-E34 PolarHBondContact O-N 3.45Å; K31-E34 PolarHBondContact O-N 3.48Å; L32-E34 VanDerWaalsContact C-N 3.33Å; L32-E34 PolarHBondContact O-N 3.1Å; E34-I36 PolarHBondContact O-N 2.97Å; E34-R37 PolarHBondContact O-N 2.96Å; E34-S38 PolarHBondContact O-N 2.9Å |
| 35 | A | 83.4 | Confident | 73.3 | Confident | 49 Ų | 49 | 135 Ų | 135 | 41% | 0.405 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -61.1 | -43.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | K31 L32 R37 S38 L39 | K31-A35 WeakPolarHBondContact O-CB 3.42Å; K31-A35 PolarHBondContact O-N 2.95Å; L32-A35 PolarHBondContact O-N 3.47Å; A35-R37 VanDerWaalsContact C-N 3.35Å; A35-R37 PolarHBondContact O-N 3.44Å; A35-S38 PolarHBondContact O-N 3.42Å; A35-S38 VanDerWaalsContact O-N 3.17Å; A35-S38 PolarHBondContact O-OG 3.26Å; A35-L39 PolarHBondContact O-N 3.48Å |
| 36 | I | 77.9 | Confident | 72.6 | Confident | 104 Ų | 104 | 134.7 Ų | 134.7 | 53% | 0.533 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -63.3 | -40.3 | 175.5 | -68.4 | 165.9 | 0 | 0 | 0 | 111.2 | L32 E34 S38 L39 G40 | L32-I36 HydrophobicContact CG-CD1 4.12Å; L32-I36 VanDerWaalsContact O-CG1 3.29Å; L32-I36 WeakPolarHBondContact O-CG1 3.35Å; L32-I36 PolarHBondContact O-N 3.48Å; E34-I36 PolarHBondContact O-N 2.97Å; I36-S38 VanDerWaalsContact C-N 3.32Å; I36-S38 PolarHBondContact O-N 3.03Å; I36-L39 PolarHBondContact O-N 3.05Å; I36-G40 PolarHBondContact O-N 3Å |
| 37 | R | 74.1 | Confident | 71.7 | Confident | 215 Ų | 215 | 138.8 Ų | 138.8 | 81% | 0.811 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -64 | -36.4 | 174.2 | -76.9 | 175 | 176 | -174.4 | 0.5 | 112.2 | L33 E34 A35 | L33-R37 WeakPolarHBondContact O-CG 3.29Å; L33-R37 PolarHBondContact O-N 3.46Å; E34-R37 PolarHBondContact O-N 2.96Å; A35-R37 VanDerWaalsContact C-N 3.35Å; A35-R37 PolarHBondContact O-N 3.44Å |
| 38 | S | 75.4 | Confident | 70.7 | Confident | 98 Ų | 98 | 133.1 Ų | 133.1 | 69% | 0.685 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -74.6 | -26.9 | 179 | 76.7 | 0 | 0 | 0 | 0 | 114 | E34 A35 I36 G40 | E34-S38 PolarHBondContact O-N 2.9Å; A35-S38 PolarHBondContact O-N 3.42Å; A35-S38 VanDerWaalsContact O-N 3.17Å; A35-S38 PolarHBondContact O-OG 3.26Å; I36-S38 VanDerWaalsContact C-N 3.32Å; I36-S38 PolarHBondContact O-N 3.03Å; S38-G40 VanDerWaalsContact C-N 3.34Å |
| 39 | L | 71.3 | Confident | 69.3 | Low | 152 Ų | 152 | 136.8 Ų | 136.8 | 80% | 0.796 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -80.3 | -17 | 179.5 | -159.1 | 67.3 | 0 | 0 | 0 | 112.8 | A35 I36 G41 | A35-L39 PolarHBondContact O-N 3.48Å; I36-L39 PolarHBondContact O-N 3.05Å; L39-G41 VanDerWaalsContact C-N 3.28Å; L39-G41 PolarHBondContact O-N 3.21Å |
| 40 | G | 61.6 | Low | 68 | Low | 59 Ų | 59 | 140.8 Ų | 140.8 | 61% | 0.608 | 72% | 0.721 | S | S | * | * | trans | -73.3 | 73.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | I36 S38 | I36-G40 PolarHBondContact O-N 3Å; S38-G40 VanDerWaalsContact C-N 3.34Å | ||
| 41 | G | 57.8 | Low | 66.6 | Low | 62 Ų | 62 | 140.4 Ų | 140.4 | 64% | 0.639 | 73% | 0.731 | S | S | * | * | trans | -50.3 | 140.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L39 R43 | L39-G41 VanDerWaalsContact C-N 3.28Å; L39-G41 PolarHBondContact O-N 3.21Å; G41-R43 PolarHBondContact O-N 3.16Å | ||
| 42 | K | 63.3 | Low | 65.2 | Low | 209 Ų | 209 | 140.7 Ų | 140.7 | 91% | 0.909 | 74% | 0.735 | S | S | * | * | trans | -34.7 | 104 | -177.5 | -64.2 | 172.1 | -178.7 | 175.4 | 0 | 113 | K44 | K42-K44 PolarHBondContact O-N 2.88Å; K42-K44 VanDerWaalsContact O-N 3.16Å | ||
| 43 | R | 60.9 | Low | 63.7 | Low | 238 Ų | 238 | 139.9 Ų | 139.9 | 90% | 0.898 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 116.9 | 165.6 | -73.7 | -174.6 | -78 | 161.9 | -4.5 | 108.3 | G41 K45 | G41-R43 PolarHBondContact O-N 3.16Å; R43-K45 PolarHBondContact O-N 3.25Å |
| 44 | K | 60.5 | Low | 62.3 | Low | 205 Ų | 205 | 139.2 Ų | 139.2 | 89% | 0.891 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 124.8 | 167.2 | -70.8 | -177.1 | 176.5 | 179.5 | 0 | 107.3 | K42 A46 | K42-K44 PolarHBondContact O-N 2.88Å; K42-K44 VanDerWaalsContact O-N 3.16Å; K44-A46 PolarHBondContact O-N 3.14Å; K44-A46 VanDerWaalsContact O-N 3.14Å |
| 45 | K | 59.3 | Low | 61.1 | Low | 203 Ų | 203 | 136.1 Ų | 136.1 | 88% | 0.883 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 116.7 | 170.9 | -74.6 | 179 | 175.5 | 179 | 0 | 107.4 | R43 L47 | R43-K45 PolarHBondContact O-N 3.25Å; K45-L47 PolarHBondContact O-N 3.29Å |
| 46 | A | 54.8 | Low | 59.9 | Low | 96 Ų | 96 | 139.5 Ų | 139.5 | 79% | 0.793 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 124.3 | 161.9 | 0 | 0 | 0 | 0 | 0 | 107 | K44 G48 | K44-A46 PolarHBondContact O-N 3.14Å; K44-A46 VanDerWaalsContact O-N 3.14Å; A46-G48 PolarHBondContact O-N 3.25Å |
| 47 | L | 53.7 | Low | 58.4 | Low | 166 Ų | 166 | 142.8 Ų | 142.8 | 87% | 0.869 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 123.3 | 169.2 | -77.9 | 157.3 | 0 | 0 | 0 | 107.1 | K45 E49 | K45-L47 PolarHBondContact O-N 3.29Å; L47-E49 PolarHBondContact O-N 3.05Å |
| 48 | G | 55.7 | Low | 57.9 | Low | 75 Ų | 75 | 134.2 Ų | 134.2 | 77% | 0.773 | 75% | 0.752 | S | S | * | * | trans | -65.7 | 105.9 | 173 | 0 | 0 | 0 | 0 | 0 | 108.6 | A46 R50 | A46-G48 PolarHBondContact O-N 3.25Å; G48-R50 PolarHBondContact O-N 3.04Å | ||
| 49 | E | 51.8 | Low | 57.4 | Low | 189 Ų | 189 | 139.5 Ų | 139.5 | 88% | 0.883 | 77% | 0.766 | S | S | * | * | trans | -62.9 | 106.1 | 160.6 | -70.5 | 178.7 | 174.9 | 0 | 0 | 106.8 | L47 S51 | L47-E49 PolarHBondContact O-N 3.05Å; E49-S51 PolarHBondContact O-N 3.26Å | ||
| 50 | R | 50.7 | Low | 57.2 | Low | 228 Ų | 228 | 140.3 Ų | 140.3 | 86% | 0.86 | 76% | 0.763 | S | S | * | * | trans | -65.8 | 89.4 | 162.2 | -85.9 | -178.2 | 169.1 | 171.9 | -4.5 | 107.3 | G48 E52 | G48-R50 PolarHBondContact O-N 3.04Å; R50-E52 VanDerWaalsContact C-N 3.33Å; R50-E52 PolarHBondContact O-N 2.9Å | ||
| 51 | S | 53.7 | Low | 56.9 | Low | 104 Ų | 104 | 142.8 Ų | 142.8 | 73% | 0.727 | 77% | 0.771 | S | S | * | * | trans | -73.8 | 95.7 | 151.4 | 169.8 | 0 | 0 | 0 | 0 | 106.2 | E49 A53 | E49-S51 PolarHBondContact O-N 3.26Å; S51-A53 PolarHBondContact O-N 2.89Å | ||
| 52 | E | 56.4 | Low | 57 | Low | 166 Ų | 166 | 143.7 Ų | 143.7 | 78% | 0.776 | 76% | 0.764 | S | S | * | * | trans | -65.3 | 110.5 | 155.4 | -65 | -176.9 | -174.5 | 0 | 0 | 105.4 | R50 A54 | R50-E52 VanDerWaalsContact C-N 3.33Å; R50-E52 PolarHBondContact O-N 2.9Å; E52-A54 VanDerWaalsContact C-N 3.33Å; E52-A54 PolarHBondContact O-N 3.18Å | ||
| 53 | A | 49.6 | Very low | 56.8 | Low | 89 Ų | 89 | 139 Ų | 139 | 74% | 0.736 | 75% | 0.748 | S | S | * | * | trans | -63.6 | 99 | 172.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | S51 G55 | S51-A53 PolarHBondContact O-N 2.89Å; A53-G55 VanDerWaalsContact C-N 3.26Å; A53-G55 PolarHBondContact O-N 2.81Å | ||
| 54 | A | 54.4 | Low | 56.6 | Low | 78 Ų | 78 | 131.5 Ų | 131.5 | 65% | 0.645 | 73% | 0.731 | S | S | * | * | trans | -58.9 | 100.6 | 157.5 | 0 | 0 | 0 | 0 | 0 | 105.9 | E52 H56 | E52-A54 VanDerWaalsContact C-N 3.33Å; E52-A54 PolarHBondContact O-N 3.18Å; A54-H56 VanDerWaalsContact C-N 3.32Å; A54-H56 PolarHBondContact O-N 2.88Å | ||
| 55 | G | 57.4 | Low | 56.3 | Low | 74 Ų | 74 | 129.1 Ų | 129.1 | 76% | 0.763 | 73% | 0.728 | S | S | * | * | trans | -63.5 | 92.4 | -177.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | A53 | A53-G55 VanDerWaalsContact C-N 3.26Å; A53-G55 PolarHBondContact O-N 2.81Å | ||
| 56 | H | 57.5 | Low | 56.1 | Low | 120 Ų | 120 | 123 Ų | 123 | 56% | 0.556 | 72% | 0.722 | S | S | * | * | trans | 74.1 | 88.1 | 166.3 | -141.4 | 78.5 | 0 | 0 | 0 | 115.9 | A54 | A54-H56 VanDerWaalsContact C-N 3.32Å; A54-H56 PolarHBondContact O-N 2.88Å | ||
| 57 | M | 47.6 | Very low | 56.2 | Low | 172 Ų | 172 | 120.6 Ų | 120.6 | 85% | 0.847 | 71% | 0.707 | S | S | * | * | trans | -92.5 | 104.7 | 158.7 | -65.9 | -177 | 70.7 | 0 | 0 | 108.6 | ||||
| 58 | S | 61.8 | Low | 56.4 | Low | 35 Ų | 35 | 120 Ų | 120 | 25% | 0.245 | 71% | 0.713 | C | S | . | * | trans | -77.3 | 124.3 | 164.1 | 140.8 | 0 | 0 | 0 | 0 | 108.3 | F60 S61 V62 | S58-F60 PolarHBondContact O-N 3.11Å; S58-F60 PolarHBondContact OG-N 3.16Å; S58-S61 PolarHBondContact O-N 2.88Å; S58-S61 PolarHBondContact OG-N 2.85Å; S58-V62 WeakPolarHBondContact CB-O 3.37Å; S58-V62 PolarHBondContact OG-N 3.17Å; S58-V62 PolarHBondContact OG-O 2.95Å | ||
| 59 | E | 65.2 | Low | 56.5 | Low | 210 Ų | 210 | 119.3 Ų | 119.3 | 98% | 0.981 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.9 | -21.1 | 175 | -64.4 | -179.5 | 177.7 | 0 | 0 | 113.4 | ||
| 60 | F | 66.8 | Low | 57.2 | Low | 169 Ų | 169 | 117.5 Ų | 117.5 | 74% | 0.741 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.1 | 11.4 | 178.3 | -154.4 | -103.3 | 0 | 0 | 0 | 114 | S58 V62 | S58-F60 PolarHBondContact O-N 3.11Å; S58-F60 PolarHBondContact OG-N 3.16Å; F60-V62 HydrophobicContact CD1-CG2 3.83Å; F60-V62 PolarHBondContact O-N 3.48Å; F60-V62 VanDerWaalsContact O-N 3.15Å |
| 61 | S | 56.5 | Low | 58.2 | Low | 111 Ų | 111 | 110.8 Ų | 110.8 | 78% | 0.776 | 68% | 0.679 | S | S | * | * | S | Bend | trans | 54.5 | 27.5 | -178.4 | 57.3 | 0 | 0 | 0 | 0 | 115.7 | S58 | S58-S61 PolarHBondContact O-N 2.88Å; S58-S61 PolarHBondContact OG-N 2.85Å |
| 62 | V | 59.8 | Low | 59.2 | Low | 81 Ų | 81 | 111.4 Ų | 111.4 | 49% | 0.491 | 67% | 0.671 | S | S | . | * | trans | -108.5 | 100.8 | 173.8 | -178 | 0 | 0 | 0 | 0 | 108.3 | S58 F60 | S58-V62 WeakPolarHBondContact CB-O 3.37Å; S58-V62 PolarHBondContact OG-N 3.17Å; S58-V62 PolarHBondContact OG-O 2.95Å; F60-V62 HydrophobicContact CD1-CG2 3.83Å; F60-V62 PolarHBondContact O-N 3.48Å; F60-V62 VanDerWaalsContact O-N 3.15Å | ||
| 63 | N | 59 | Low | 60.1 | Low | 109 Ų | 109 | 107.7 Ų | 107.7 | 58% | 0.583 | 66% | 0.656 | S | S | * | * | trans | -85.9 | 125 | 176.2 | -67 | -27.5 | 0 | 0 | 0 | 109.3 | D65 | N63-D65 VanDerWaalsContact C-N 3.27Å; N63-D65 PolarHBondContact O-N 3.32Å | ||
| 64 | P | 57.3 | Low | 61.4 | Low | 82 Ų | 82 | 105.8 Ų | 105.8 | 53% | 0.532 | 64% | 0.637 | S | S | . | * | trans | -78.1 | -10 | -178.4 | 30.6 | -34.4 | 0 | 0 | 0 | 113.8 | ||||
| 65 | D | 53.3 | Low | 62.6 | Low | 155 Ų | 155 | 106.9 Ų | 106.9 | 83% | 0.829 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -102.2 | 108.9 | -170.2 | -138 | 8.8 | 0 | 0 | 0 | 112.3 | N63 | N63-D65 VanDerWaalsContact C-N 3.27Å; N63-D65 PolarHBondContact O-N 3.32Å |
| 66 | G | 55.8 | Low | 63.6 | Low | 73 Ų | 73 | 107.9 Ų | 107.9 | 75% | 0.753 | 62% | 0.619 | S | S | * | * | S | Bend | trans | 91.3 | -0.2 | 148.5 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||
| 67 | G | 56.6 | Low | 64.6 | Low | 46 Ų | 46 | 102.7 Ų | 102.7 | 47% | 0.474 | 60% | 0.595 | S | S | . | * | S | Bend | trans | -100.2 | 162.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | G69 | G67-G69 PolarHBondContact O-N 3.48Š|
| 68 | P | 57.3 | Low | 66 | Low | 154 Ų | 154 | 96 Ų | 96 | 100% | 1 | 57% | 0.57 | S | S | * | * | S | Bend | trans | -66.8 | 24.2 | 177.1 | 30.3 | -36.6 | 0 | 0 | 0 | 114.8 | ||
| 69 | G | 58 | Low | 66.7 | Low | 60 Ų | 60 | 97.5 Ų | 97.5 | 62% | 0.619 | 58% | 0.58 | S | S | * | * | trans | -124.6 | 37.3 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | G67 V71 | G67-G69 PolarHBondContact O-N 3.48Å; G69-V71 PolarHBondContact O-N 3.25Å; G69-V71 VanDerWaalsContact O-N 3.07Å | ||
| 70 | K | 67.5 | Low | 67 | Low | 151 Ų | 151 | 89.9 Ų | 89.9 | 66% | 0.657 | 55% | 0.546 | S | S | * | . | trans | -68.6 | 104.9 | 166.4 | -69.6 | -169.9 | -179.2 | -171.1 | 0 | 107.9 | Q72 | K70-Q72 PolarHBondContact O-N 2.74Š| ||
| 71 | V | 70.6 | Confident | 67.2 | Low | 88 Ų | 88 | 86.4 Ų | 86.4 | 53% | 0.533 | 53% | 0.532 | S | S | . | . | trans | -62.3 | 108.6 | -180 | -175.7 | 0 | 0 | 0 | 0 | 108.7 | G69 D75 L76 | G69-V71 PolarHBondContact O-N 3.25Å; G69-V71 VanDerWaalsContact O-N 3.07Å; V71-D75 HydrophobicContact CG1-CB 4.45Å; V71-L76 HydrophobicContact CG1-CD1 3.88Å; V71-L76 HydrophobicContact CG1-CD2 3.72Å; V71-L76 HydrophobicContact CG1-CG 3.55Å | ||
| 72 | Q | 74.4 | Confident | 68.1 | Low | 117 Ų | 117 | 89.9 Ų | 89.9 | 55% | 0.547 | 53% | 0.533 | S | S | . | . | trans | -78.5 | 154.1 | 176.9 | -69.4 | -72.7 | -9.9 | 0 | 0 | 109.9 | K70 S74 D75 L76 | K70-Q72 PolarHBondContact O-N 2.74Å; Q72-S74 VanDerWaalsContact CB-OG 3.25Å; Q72-S74 WeakPolarHBondContact CB-OG 3.28Å; Q72-S74 PolarHBondContact O-N 3.35Å; Q72-S74 VanDerWaalsContact O-N 3.14Å; Q72-D75 PolarHBondContact O-N 3.39Å; Q72-L76 PolarHBondContact O-N 3.41Å | ||
| 73 | L | 75.9 | Confident | 68.7 | Low | 88 Ų | 88 | 89.1 Ų | 89.1 | 46% | 0.461 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -54.7 | -33.4 | 173.8 | -84.1 | 162 | 0 | 0 | 0 | 111.6 | D75 L76 I77 | L73-D75 VanDerWaalsContact C-N 3.29Å; L73-D75 PolarHBondContact O-N 3.45Å; L73-L76 PolarHBondContact O-N 3.21Å; L73-I77 HydrophobicContact CB-CD1 4.37Å; L73-I77 WeakPolarHBondContact O-CB 3.33Å; L73-I77 VanDerWaalsContact O-CD1 3.3Å; L73-I77 WeakPolarHBondContact O-CD1 3.25Å; L73-I77 WeakPolarHBondContact O-CG1 3.44Å; L73-I77 PolarHBondContact O-N 2.94Å |
| 74 | S | 76.9 | Confident | 69.1 | Low | 48 Ų | 48 | 89.5 Ų | 89.5 | 34% | 0.336 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -56.5 | -39.3 | 174.5 | 51.3 | 0 | 0 | 0 | 0 | 113.6 | Q72 G78 | Q72-S74 VanDerWaalsContact CB-OG 3.25Å; Q72-S74 WeakPolarHBondContact CB-OG 3.28Å; Q72-S74 PolarHBondContact O-N 3.35Å; Q72-S74 VanDerWaalsContact O-N 3.14Å; S74-G78 PolarHBondContact O-N 2.96Å; S74-G78 VanDerWaalsContact O-N 3.15Å |
| 75 | D | 79.9 | Confident | 70 | Confident | 101 Ų | 101 | 90.2 Ų | 90.2 | 54% | 0.54 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -76.2 | -35.1 | -174 | -59.4 | -8.4 | 0 | 0 | 0 | 110.7 | V71 Q72 L73 | V71-D75 HydrophobicContact CG1-CB 4.45Å; Q72-D75 PolarHBondContact O-N 3.39Å; L73-D75 VanDerWaalsContact C-N 3.29Å; L73-D75 PolarHBondContact O-N 3.45Å |
| 76 | L | 77.5 | Confident | 71.1 | Confident | 96 Ų | 96 | 84.2 Ų | 84.2 | 50% | 0.503 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -71.9 | -41.8 | 174.7 | -64.8 | 169.3 | 0 | 0 | 0 | 111.4 | V71 Q72 L73 G78 S79 L80 | V71-L76 HydrophobicContact CG1-CD1 3.88Å; V71-L76 HydrophobicContact CG1-CD2 3.72Å; V71-L76 HydrophobicContact CG1-CG 3.55Å; Q72-L76 PolarHBondContact O-N 3.41Å; L73-L76 PolarHBondContact O-N 3.21Å; L76-G78 PolarHBondContact O-N 2.93Å; L76-S79 PolarHBondContact O-N 3.23Å; L76-S79 PolarHBondContact O-OG 3Å; L76-L80 PolarHBondContact O-N 3.46Å |
| 77 | I | 78.7 | Confident | 72.5 | Confident | 11 Ų | 11 | 84.8 Ų | 84.8 | 6% | 0.056 | 51% | 0.513 | C | S | . | . | H | α-helix | trans | -63.7 | -40.1 | 179.5 | -68.6 | 164.6 | 0 | 0 | 0 | 111.2 | L73 S79 L80 E81 L94 Q98 | L73-I77 HydrophobicContact CB-CD1 4.37Å; L73-I77 WeakPolarHBondContact O-CB 3.33Å; L73-I77 VanDerWaalsContact O-CD1 3.3Å; L73-I77 WeakPolarHBondContact O-CD1 3.25Å; L73-I77 WeakPolarHBondContact O-CG1 3.44Å; L73-I77 PolarHBondContact O-N 2.94Å; I77-S79 VanDerWaalsContact C-N 3.29Å; I77-S79 PolarHBondContact O-N 2.94Å; I77-L80 WeakPolarHBondContact O-CB 3.46Å; I77-L80 PolarHBondContact O-N 2.93Å; I77-L80 VanDerWaalsContact O-N 3.1Å; I77-E81 HydrophobicContact CG2-CG 4.44Å; I77-E81 WeakPolarHBondContact O-CG 3.42Å; I77-E81 PolarHBondContact O-N 2.92Å; I77-L94 HydrophobicContact CD1-CB 3.96Å; I77-L94 WeakPolarHBondContact CD1-O 3.47Å; I77-L94 HydrophobicContact CG1-CB 4.02Å; I77-Q98 HydrophobicContact CD1-CB 3.97Å; I77-Q98 HydrophobicContact CD1-CG 4.41Å |
| 78 | G | 76.6 | Confident | 73.6 | Confident | 30 Ų | 30 | 85.8 Ų | 85.8 | 31% | 0.309 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.8 | -29.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | S74 L76 | S74-G78 PolarHBondContact O-N 2.96Å; S74-G78 VanDerWaalsContact O-N 3.15Å; L76-G78 PolarHBondContact O-N 2.93Å |
| 79 | S | 77 | Confident | 74.9 | Confident | 67 Ų | 67 | 86.7 Ų | 86.7 | 47% | 0.469 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -76.2 | -36.2 | 171.9 | 73.9 | 0 | 0 | 0 | 0 | 112.1 | L76 I77 K82 | L76-S79 PolarHBondContact O-N 3.23Å; L76-S79 PolarHBondContact O-OG 3Å; I77-S79 VanDerWaalsContact C-N 3.29Å; I77-S79 PolarHBondContact O-N 2.94Å; S79-K82 PolarHBondContact O-N 3.05Å |
| 80 | L | 71.4 | Confident | 76 | Confident | 50 Ų | 50 | 85.5 Ų | 85.5 | 26% | 0.262 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -71.7 | -30.6 | -177.8 | -162 | 71.5 | 0 | 0 | 0 | 113 | L76 I77 K82 T83 V86 L94 | L76-L80 PolarHBondContact O-N 3.46Å; I77-L80 WeakPolarHBondContact O-CB 3.46Å; I77-L80 PolarHBondContact O-N 2.93Å; I77-L80 VanDerWaalsContact O-N 3.1Å; L80-K82 PolarHBondContact O-N 2.67Å; L80-T83 PolarHBondContact O-N 3.42Å; L80-T83 PolarHBondContact O-OG1 3.43Å; L80-V86 HydrophobicContact CD1-CB 4.45Å; L80-V86 HydrophobicContact CD1-CG1 4.46Å; L80-V86 HydrophobicContact CD1-CG2 3.4Å; L80-V86 HydrophobicContact CD2-CG1 4.1Å; L80-V86 HydrophobicContact CD2-CG2 4.48Å; L80-V86 HydrophobicContact CG-CB 4.37Å; L80-V86 HydrophobicContact CG-CG1 4.17Å; L80-V86 HydrophobicContact CG-CG2 3.78Å; L80-L94 HydrophobicContact CD2-CD1 3.36Å |
| 81 | E | 70.6 | Confident | 76.6 | Confident | 96 Ų | 96 | 81 Ų | 81 | 45% | 0.449 | 47% | 0.465 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.9 | -30.1 | 172.6 | -73.1 | -169.4 | 153 | 0 | 0 | 112.8 | I77 K95 | I77-E81 HydrophobicContact CG2-CG 4.44Å; I77-E81 WeakPolarHBondContact O-CG 3.42Å; I77-E81 PolarHBondContact O-N 2.92Å; E81-K95 WeakPolarHBondContact OE1-CE 3.33Å; E81-K95 IonicContact OE1-NZ 3.37Å; E81-K95 PolarHBondContact OE1-NZ 3.43Å |
| 82 | K | 75.7 | Confident | 77.3 | Confident | 184 Ų | 184 | 83.7 Ų | 83.7 | 80% | 0.8 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.5 | -20.4 | 178.2 | -60.7 | 174.9 | -175.6 | 176.5 | 0 | 112.6 | S79 L80 | S79-K82 PolarHBondContact O-N 3.05Å; L80-K82 PolarHBondContact O-N 2.67Å |
| 83 | T | 73.7 | Confident | 77.8 | Confident | 65 Ų | 65 | 84 Ų | 84 | 40% | 0.399 | 47% | 0.472 | S | S | . | . | trans | -87.7 | 113.5 | 175.8 | 62.2 | 0 | 0 | 0 | 0 | 110.5 | L80 A85 R91 | L80-T83 PolarHBondContact O-N 3.42Å; L80-T83 PolarHBondContact O-OG1 3.43Å; T83-A85 VanDerWaalsContact C-N 3.27Å; T83-A85 PolarHBondContact O-N 3.31Å; T83-R91 PolarHBondContact O-NH2 3.41Å | ||
| 84 | S | 66.4 | Low | 78.1 | Confident | 118 Ų | 118 | 82 Ų | 82 | 83% | 0.825 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.8 | -17.4 | -176.9 | 57.2 | 0 | 0 | 0 | 0 | 114.1 | V86 | S84-V86 VanDerWaalsContact C-N 3.25Å; S84-V86 PolarHBondContact O-N 2.94Å |
| 85 | A | 76.9 | Confident | 78.3 | Confident | 97 Ų | 97 | 84.1 Ų | 84.1 | 80% | 0.802 | 46% | 0.464 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.4 | -9.9 | -176.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | T83 | T83-A85 VanDerWaalsContact C-N 3.27Å; T83-A85 PolarHBondContact O-N 3.31Å |
| 86 | V | 74.8 | Confident | 78.5 | Confident | 28 Ų | 28 | 84.3 Ų | 84.3 | 17% | 0.17 | 47% | 0.465 | C | S | . | . | S | Bend | trans | -86.9 | 139.5 | -176.3 | 179.6 | 0 | 0 | 0 | 0 | 110.4 | L80 S84 S90 R91 | L80-V86 HydrophobicContact CD1-CB 4.45Å; L80-V86 HydrophobicContact CD1-CG1 4.46Å; L80-V86 HydrophobicContact CD1-CG2 3.4Å; L80-V86 HydrophobicContact CD2-CG1 4.1Å; L80-V86 HydrophobicContact CD2-CG2 4.48Å; L80-V86 HydrophobicContact CG-CB 4.37Å; L80-V86 HydrophobicContact CG-CG1 4.17Å; L80-V86 HydrophobicContact CG-CG2 3.78Å; S84-V86 VanDerWaalsContact C-N 3.25Å; S84-V86 PolarHBondContact O-N 2.94Å; V86-S90 VanDerWaalsContact CG1-OG 3.29Å; V86-S90 WeakPolarHBondContact CG1-OG 3.44Å; V86-R91 HydrophobicContact CG1-CG 4.17Å; V86-R91 PolarHBondContact O-NH1 3.41Å; V86-R91 PolarHBondContact O-NH2 2.86Å |
| 87 | P | 85.1 | Confident | 78.6 | Confident | 86 Ų | 86 | 84.2 Ų | 84.2 | 56% | 0.558 | 47% | 0.465 | S | S | * | . | trans | -64.7 | 146.9 | 176.3 | -24.7 | 34.7 | 0 | 0 | 0 | 113.9 | K89 S90 R91 | P87-K89 PolarHBondContact O-N 3.25Å; P87-S90 PolarHBondContact O-N 3.36Å; P87-S90 PolarHBondContact O-OG 3.2Å; P87-R91 PolarHBondContact O-N 3.13Å | ||
| 88 | A | 80.6 | Confident | 78.6 | Confident | 66 Ų | 66 | 87.6 Ų | 87.6 | 55% | 0.545 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.3 | -26.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | K92 | A88-K92 WeakPolarHBondContact O-CG 3.43Å; A88-K92 PolarHBondContact O-N 2.94Å |
| 89 | K | 84.2 | Confident | 78.8 | Confident | 174 Ų | 174 | 93.1 Ų | 93.1 | 76% | 0.757 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -68.9 | -44.4 | 178.8 | -68.5 | -177.8 | 179.4 | 178.9 | 0 | 112.4 | P87 R91 K92 Q93 | P87-K89 PolarHBondContact O-N 3.25Å; K89-R91 VanDerWaalsContact C-N 3.34Å; K89-K92 PolarHBondContact O-N 2.82Å; K89-Q93 WeakPolarHBondContact O-CG 3.31Å; K89-Q93 PolarHBondContact O-N 3.26Å |
| 90 | S | 81.6 | Confident | 78.7 | Confident | 34 Ų | 34 | 92.4 Ų | 92.4 | 24% | 0.238 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -67.6 | -35.1 | 177.6 | 50.5 | 0 | 0 | 0 | 0 | 111.5 | V86 P87 K92 Q93 L94 | V86-S90 VanDerWaalsContact CG1-OG 3.29Å; V86-S90 WeakPolarHBondContact CG1-OG 3.44Å; P87-S90 PolarHBondContact O-N 3.36Å; P87-S90 PolarHBondContact O-OG 3.2Å; S90-K92 PolarHBondContact O-N 3.29Å; S90-Q93 PolarHBondContact O-N 3.45Å; S90-L94 WeakPolarHBondContact O-CB 3.45Å; S90-L94 WeakPolarHBondContact O-CG 3.4Å; S90-L94 PolarHBondContact O-N 2.93Å |
| 91 | R | 81.1 | Confident | 78.6 | Confident | 56 Ų | 56 | 98.5 Ų | 98.5 | 21% | 0.211 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -59.8 | -42.5 | 171.4 | -66.5 | -165.1 | -170.1 | 85.8 | -1.8 | 112.6 | T83 V86 P87 K89 K95 | T83-R91 PolarHBondContact O-NH2 3.41Å; V86-R91 HydrophobicContact CG1-CG 4.17Å; V86-R91 PolarHBondContact O-NH1 3.41Å; V86-R91 PolarHBondContact O-NH2 2.86Å; P87-R91 PolarHBondContact O-N 3.13Å; K89-R91 VanDerWaalsContact C-N 3.34Å; R91-K95 WeakPolarHBondContact O-CG 3.38Å; R91-K95 PolarHBondContact O-N 3.01Å |
| 92 | K | 83.9 | Confident | 78.6 | Confident | 145 Ų | 145 | 103 Ų | 103 | 63% | 0.63 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -66.6 | -41.5 | 176.5 | -70.2 | -179.5 | -177.9 | -173.3 | 0 | 112.3 | A88 K89 S90 K95 N96 | A88-K92 WeakPolarHBondContact O-CG 3.43Å; A88-K92 PolarHBondContact O-N 2.94Å; K89-K92 PolarHBondContact O-N 2.82Å; S90-K92 PolarHBondContact O-N 3.29Å; K92-K95 PolarHBondContact O-N 3.19Å; K92-N96 VanDerWaalsContact O-CG 3.26Å; K92-N96 PolarHBondContact O-N 2.82Å; K92-N96 PolarHBondContact O-OD1 3.47Å |
| 93 | Q | 84.6 | Confident | 78.7 | Confident | 125 Ų | 125 | 100.2 Ų | 100.2 | 58% | 0.584 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -62.9 | -43.6 | 175.9 | -72.6 | 172.5 | -29.1 | 0 | 0 | 111.7 | K89 S90 N96 L97 | K89-Q93 WeakPolarHBondContact O-CG 3.31Å; K89-Q93 PolarHBondContact O-N 3.26Å; S90-Q93 PolarHBondContact O-N 3.45Å; Q93-N96 PolarHBondContact O-N 2.88Å; Q93-L97 VanDerWaalsContact O-CG 3.3Å; Q93-L97 WeakPolarHBondContact O-CG 3.03Å; Q93-L97 PolarHBondContact O-N 3.29Å |
| 94 | L | 82.3 | Confident | 79.1 | Confident | 45 Ų | 45 | 104.7 Ų | 104.7 | 24% | 0.236 | 56% | 0.56 | C | S | . | * | H | α-helix | trans | -64.4 | -39.3 | 176.7 | -74.5 | 168.6 | 0 | 0 | 0 | 112.5 | I77 L80 S90 L97 Q98 | I77-L94 HydrophobicContact CD1-CB 3.96Å; I77-L94 WeakPolarHBondContact CD1-O 3.47Å; I77-L94 HydrophobicContact CG1-CB 4.02Å; L80-L94 HydrophobicContact CD2-CD1 3.36Å; S90-L94 WeakPolarHBondContact O-CB 3.45Å; S90-L94 WeakPolarHBondContact O-CG 3.4Å; S90-L94 PolarHBondContact O-N 2.93Å; L94-L97 PolarHBondContact O-N 2.85Å; L94-Q98 WeakPolarHBondContact O-CB 3.18Å; L94-Q98 PolarHBondContact O-N 3.5Å |
| 95 | K | 82.1 | Confident | 79.9 | Confident | 92 Ų | 92 | 107.1 Ų | 107.1 | 40% | 0.4 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.3 | -40.3 | 171.8 | -73.2 | -175.9 | -176.8 | -161.5 | 0 | 112.3 | E81 R91 K92 L97 Q98 L99 | E81-K95 WeakPolarHBondContact OE1-CE 3.33Å; E81-K95 IonicContact OE1-NZ 3.37Å; E81-K95 PolarHBondContact OE1-NZ 3.43Å; R91-K95 WeakPolarHBondContact O-CG 3.38Å; R91-K95 PolarHBondContact O-N 3.01Å; K92-K95 PolarHBondContact O-N 3.19Å; K95-L97 VanDerWaalsContact C-N 3.35Å; K95-Q98 WeakPolarHBondContact O-CB 3.41Å; K95-Q98 PolarHBondContact O-N 2.96Å; K95-L99 WeakPolarHBondContact O-CG 3.32Å; K95-L99 PolarHBondContact O-N 3.37Å |
| 96 | N | 84.2 | Confident | 80.4 | Confident | 105 Ų | 105 | 107.3 Ų | 107.3 | 56% | 0.561 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -65.7 | -38.7 | 175.6 | -70.6 | -5.1 | 0 | 0 | 0 | 111.9 | K92 Q93 L99 S100 | K92-N96 VanDerWaalsContact O-CG 3.26Å; K92-N96 PolarHBondContact O-N 2.82Å; K92-N96 PolarHBondContact O-OD1 3.47Å; Q93-N96 PolarHBondContact O-N 2.88Å; N96-L99 PolarHBondContact O-N 3.31Å; N96-S100 PolarHBondContact O-N 3.46Å; N96-S100 PolarHBondContact O-OG 3.27Å |
| 97 | L | 79.8 | Confident | 81.1 | Confident | 95 Ų | 95 | 111.6 Ų | 111.6 | 50% | 0.497 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -68 | -34.4 | 174.6 | -69.8 | 171.7 | 0 | 0 | 0 | 112.3 | Q93 L94 K95 L99 S100 | Q93-L97 VanDerWaalsContact O-CG 3.3Å; Q93-L97 WeakPolarHBondContact O-CG 3.03Å; Q93-L97 PolarHBondContact O-N 3.29Å; L94-L97 PolarHBondContact O-N 2.85Å; K95-L97 VanDerWaalsContact C-N 3.35Å; L97-L99 VanDerWaalsContact C-N 3.32Å; L97-S100 WeakPolarHBondContact CA-OG 3.28Å; L97-S100 CarbonylContact O-C 3.32Å; L97-S100 PolarHBondContact O-N 3.48Å; L97-S100 PolarHBondContact O-OG 3Å |
| 98 | Q | 79 | Confident | 81.5 | Confident | 82 Ų | 82 | 111.9 Ų | 111.9 | 38% | 0.383 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -65.5 | -35.5 | 172.6 | -172.4 | -178.2 | 3.8 | 0 | 0 | 112 | I77 L94 K95 | I77-Q98 HydrophobicContact CD1-CB 3.97Å; I77-Q98 HydrophobicContact CD1-CG 4.41Å; L94-Q98 WeakPolarHBondContact O-CB 3.18Å; L94-Q98 PolarHBondContact O-N 3.5Å; K95-Q98 WeakPolarHBondContact O-CB 3.41Å; K95-Q98 PolarHBondContact O-N 2.96Å |
| 99 | L | 80.1 | Confident | 82.2 | Confident | 146 Ų | 146 | 111.7 Ų | 111.7 | 76% | 0.764 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -75.3 | -31.2 | 175.4 | -68.5 | 169.9 | 0 | 0 | 0 | 112.5 | K95 N96 L97 E101 | K95-L99 WeakPolarHBondContact O-CG 3.32Å; K95-L99 PolarHBondContact O-N 3.37Å; N96-L99 PolarHBondContact O-N 3.31Å; L97-L99 VanDerWaalsContact C-N 3.32Å; L99-E101 PolarHBondContact O-N 3.31Å |
| 100 | S | 74.9 | Confident | 82.8 | Confident | 51 Ų | 51 | 111.3 Ų | 111.3 | 36% | 0.357 | 57% | 0.572 | S | S | . | * | trans | -93.1 | 86.4 | 173.1 | 67.2 | 0 | 0 | 0 | 0 | 110.1 | N96 L97 K102 | N96-S100 PolarHBondContact O-N 3.46Å; N96-S100 PolarHBondContact O-OG 3.27Å; L97-S100 WeakPolarHBondContact CA-OG 3.28Å; L97-S100 CarbonylContact O-C 3.32Å; L97-S100 PolarHBondContact O-N 3.48Å; L97-S100 PolarHBondContact O-OG 3Å; S100-K102 PolarHBondContact O-N 2.89Å | ||
| 101 | E | 68.4 | Low | 83.5 | Confident | 179 Ų | 179 | 117 Ų | 117 | 84% | 0.836 | 60% | 0.595 | S | S | * | * | trans | -62.4 | 12.2 | 171.1 | -63.7 | -175.9 | 166.1 | 0 | 0 | 114 | L99 T103 | L99-E101 PolarHBondContact O-N 3.31Å; E101-T103 VanDerWaalsContact C-N 3.32Å; E101-T103 PolarHBondContact O-N 2.91Å | ||
| 102 | K | 72.1 | Confident | 84.2 | Confident | 189 Ų | 189 | 118.9 Ų | 118.9 | 82% | 0.822 | 61% | 0.606 | S | S | * | * | trans | -75.2 | 86.8 | 178.4 | -63 | -173.8 | -178 | -175.8 | 0 | 109.1 | S100 | S100-K102 PolarHBondContact O-N 2.89Š| ||
| 103 | T | 77.1 | Confident | 84.8 | Confident | 126 Ų | 126 | 114.1 Ų | 114.1 | 77% | 0.773 | 59% | 0.589 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 137.3 | 164.3 | -55.9 | 0 | 0 | 0 | 0 | 108.2 | E101 E105 | E101-T103 VanDerWaalsContact C-N 3.32Å; E101-T103 PolarHBondContact O-N 2.91Å; T103-E105 PolarHBondContact O-N 3.05Å |
| 104 | I | 81.4 | Confident | 85.4 | Confident | 159 Ų | 159 | 113.2 Ų | 113.2 | 82% | 0.815 | 59% | 0.585 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 121.4 | 173.6 | -59.3 | 172.6 | 0 | 0 | 0 | 106.9 | ||
| 105 | E | 84 | Confident | 86.1 | Confident | 169 Ų | 169 | 118.6 Ų | 118.6 | 79% | 0.79 | 60% | 0.602 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 145.4 | 177.6 | -66.1 | 176.7 | -175.9 | 0 | 0 | 110.1 | T103 | T103-E105 PolarHBondContact O-N 3.05Š|
| 106 | S | 87.2 | Confident | 86.9 | Confident | 102 Ų | 102 | 118.2 Ų | 118.2 | 71% | 0.713 | 60% | 0.604 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 133.3 | 173.9 | 179.7 | 0 | 0 | 0 | 0 | 109 | L108 | S106-L108 PolarHBondContact O-N 3.39Š|
| 107 | P | 90.1 | Very high | 87.5 | Confident | 117 Ų | 117 | 119.4 Ų | 119.4 | 76% | 0.76 | 61% | 0.606 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 132.5 | 177.8 | 24.7 | -33.9 | 0 | 0 | 0 | 109.6 | ||
| 108 | L | 92.1 | Very high | 88.4 | Confident | 92 Ų | 92 | 121.7 Ų | 121.7 | 48% | 0.482 | 61% | 0.608 | S | S | . | * | P | Polyproline II helix | trans | -64.7 | 165.5 | 175.7 | -67.5 | 167.1 | 0 | 0 | 0 | 110.9 | S106 E112 T113 I116 | S106-L108 PolarHBondContact O-N 3.39Å; L108-E112 HydrophobicContact CB-CB 4.12Å; L108-T113 HydrophobicContact CB-CG2 3.82Å; L108-I116 HydrophobicContact CD1-CD1 3.57Å |
| 109 | S | 96.5 | Very high | 89.3 | Confident | 63 Ų | 63 | 121.4 Ų | 121.4 | 44% | 0.441 | 61% | 0.609 | S | S | . | * | P | Polyproline II helix | trans | -58.5 | 148.4 | 173.3 | 176.7 | 0 | 0 | 0 | 0 | 110.7 | Q111 E112 T113 | S109-Q111 PolarHBondContact O-N 3.48Å; S109-Q111 VanDerWaalsContact O-N 3.17Å; S109-E112 PolarHBondContact N-OE2 2.9Å; S109-E112 WeakPolarHBondContact O-CB 3.22Å; S109-E112 PolarHBondContact O-N 3.18Å; S109-T113 PolarHBondContact O-N 3.47Å |
| 110 | K | 95.8 | Very high | 90.1 | Very high | 165 Ų | 165 | 119 Ų | 119 | 72% | 0.717 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -51.2 | -44.6 | 179 | -67 | -174.4 | 179.5 | -177.1 | 0 | 111.8 | E112 T113 E114 | K110-E112 VanDerWaalsContact C-N 3.31Å; K110-E112 PolarHBondContact O-N 2.83Å; K110-T113 WeakPolarHBondContact CA-OG1 3.4Å; K110-T113 PolarHBondContact O-N 2.88Å; K110-T113 PolarHBondContact O-OG1 3.27Å; K110-E114 WeakPolarHBondContact O-CB 3.26Å; K110-E114 WeakPolarHBondContact O-CG 3.36Å; K110-E114 PolarHBondContact O-N 3.3Å |
| 111 | Q | 97.2 | Very high | 91.3 | Very high | 153 Ų | 153 | 119.2 Ų | 119.2 | 72% | 0.715 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -60.8 | -38.9 | 179.1 | -65.8 | -179 | -8.3 | 0 | 0 | 112.8 | S109 R115 | S109-Q111 PolarHBondContact O-N 3.48Å; S109-Q111 VanDerWaalsContact O-N 3.17Å; Q111-R115 WeakPolarHBondContact O-CB 3.36Å; Q111-R115 PolarHBondContact O-N 3.15Å |
| 112 | E | 96.3 | Very high | 92.7 | Very high | 97 Ų | 97 | 117.7 Ų | 117.7 | 45% | 0.453 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -71.4 | -43.2 | 178.2 | -64.4 | 171.5 | 153.4 | 0 | 0 | 110.7 | L108 S109 K110 E114 R115 I116 | L108-E112 HydrophobicContact CB-CB 4.12Å; S109-E112 PolarHBondContact N-OE2 2.9Å; S109-E112 WeakPolarHBondContact O-CB 3.22Å; S109-E112 PolarHBondContact O-N 3.18Å; K110-E112 VanDerWaalsContact C-N 3.31Å; K110-E112 PolarHBondContact O-N 2.83Å; E112-E114 PolarHBondContact O-N 3.02Å; E112-R115 WeakPolarHBondContact O-CB 3.18Å; E112-R115 PolarHBondContact O-N 2.93Å; E112-I116 VanDerWaalsContact O-CG1 3.31Å; E112-I116 WeakPolarHBondContact O-CG1 3.33Å; E112-I116 PolarHBondContact O-N 2.78Å |
| 113 | T | 95.8 | Very high | 93.9 | Very high | 45 Ų | 45 | 114.6 Ų | 114.6 | 28% | 0.276 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -62.6 | -42.9 | 176.2 | 62.2 | 0 | 0 | 0 | 0 | 112.1 | L108 S109 K110 R115 I116 Q117 | L108-T113 HydrophobicContact CB-CG2 3.82Å; S109-T113 PolarHBondContact O-N 3.47Å; K110-T113 WeakPolarHBondContact CA-OG1 3.4Å; K110-T113 PolarHBondContact O-N 2.88Å; K110-T113 PolarHBondContact O-OG1 3.27Å; T113-R115 VanDerWaalsContact C-N 3.32Å; T113-R115 PolarHBondContact O-N 3.2Å; T113-I116 PolarHBondContact O-N 3.34Å; T113-Q117 WeakPolarHBondContact O-CB 3.1Å; T113-Q117 VanDerWaalsContact O-CG 3.25Å; T113-Q117 WeakPolarHBondContact O-CG 3.35Å; T113-Q117 PolarHBondContact O-N 3.21Å |
| 114 | E | 96.9 | Very high | 94.9 | Very high | 105 Ų | 105 | 114.9 Ų | 114.9 | 49% | 0.491 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.4 | -36.6 | 176.3 | -73.7 | 171.8 | -168.6 | 0 | 0 | 111.4 | K110 E112 Q117 R118 | K110-E114 WeakPolarHBondContact O-CB 3.26Å; K110-E114 WeakPolarHBondContact O-CG 3.36Å; K110-E114 PolarHBondContact O-N 3.3Å; E112-E114 PolarHBondContact O-N 3.02Å; E114-Q117 PolarHBondContact O-N 3.49Å; E114-R118 WeakPolarHBondContact O-CB 3.28Å; E114-R118 WeakPolarHBondContact O-CG 3.21Å; E114-R118 PolarHBondContact O-N 3.31Å; E114-R118 PolarHBondContact O-NE 3.49Å |
| 115 | R | 98 | Very high | 95.7 | Very high | 159 Ų | 159 | 109.6 Ų | 109.6 | 60% | 0.6 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -61.3 | -50.7 | 172.7 | -174.1 | -178.1 | -176.7 | -173 | 3.4 | 111.3 | Q111 E112 T113 Q117 R118 D119 | Q111-R115 WeakPolarHBondContact O-CB 3.36Å; Q111-R115 PolarHBondContact O-N 3.15Å; E112-R115 WeakPolarHBondContact O-CB 3.18Å; E112-R115 PolarHBondContact O-N 2.93Å; T113-R115 VanDerWaalsContact C-N 3.32Å; T113-R115 PolarHBondContact O-N 3.2Å; R115-Q117 VanDerWaalsContact C-N 3.31Å; R115-Q117 PolarHBondContact O-N 3.42Å; R115-R118 PolarHBondContact O-N 3.21Å; R115-D119 VanDerWaalsContact O-CG 3.26Å; R115-D119 PolarHBondContact O-N 2.86Å |
| 116 | I | 97.3 | Very high | 96.4 | Very high | 84 Ų | 84 | 103.6 Ų | 103.6 | 43% | 0.431 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.6 | -43.3 | 178.2 | -66.8 | 164.1 | 0 | 0 | 0 | 110.6 | L108 E112 T113 R118 D119 M120 | L108-I116 HydrophobicContact CD1-CD1 3.57Å; E112-I116 VanDerWaalsContact O-CG1 3.31Å; E112-I116 WeakPolarHBondContact O-CG1 3.33Å; E112-I116 PolarHBondContact O-N 2.78Å; T113-I116 PolarHBondContact O-N 3.34Å; I116-R118 VanDerWaalsContact C-N 3.34Å; I116-R118 PolarHBondContact O-N 3.25Å; I116-D119 PolarHBondContact O-N 2.89Å; I116-M120 HydrophobicContact CG2-CG 4.23Å; I116-M120 WeakPolarHBondContact O-CB 3.4Å; I116-M120 WeakPolarHBondContact O-CG 3.24Å; I116-M120 PolarHBondContact O-N 3.44Å |
| 117 | Q | 97.8 | Very high | 96.9 | Very high | 130 Ų | 130 | 101.7 Ų | 101.7 | 61% | 0.607 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.9 | -41.7 | 177.7 | -75.2 | 175.5 | 13.2 | 0 | 0 | 112.1 | T113 E114 R115 M120 A121 | T113-Q117 WeakPolarHBondContact O-CB 3.1Å; T113-Q117 VanDerWaalsContact O-CG 3.25Å; T113-Q117 WeakPolarHBondContact O-CG 3.35Å; T113-Q117 PolarHBondContact O-N 3.21Å; E114-Q117 PolarHBondContact O-N 3.49Å; R115-Q117 VanDerWaalsContact C-N 3.31Å; R115-Q117 PolarHBondContact O-N 3.42Å; Q117-M120 PolarHBondContact O-N 3.13Å; Q117-A121 VanDerWaalsContact O-CB 3.26Å; Q117-A121 WeakPolarHBondContact O-CB 3.49Å; Q117-A121 PolarHBondContact O-N 3.03Å |
| 118 | R | 98.1 | Very high | 97.2 | Very high | 143 Ų | 143 | 101.3 Ų | 101.3 | 54% | 0.54 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.4 | -43.9 | 174.7 | -77.8 | -176.8 | -77.9 | 99.9 | -8.3 | 111.8 | E114 R115 I116 M120 A121 F122 | E114-R118 WeakPolarHBondContact O-CB 3.28Å; E114-R118 WeakPolarHBondContact O-CG 3.21Å; E114-R118 PolarHBondContact O-N 3.31Å; E114-R118 PolarHBondContact O-NE 3.49Å; R115-R118 PolarHBondContact O-N 3.21Å; I116-R118 VanDerWaalsContact C-N 3.34Å; I116-R118 PolarHBondContact O-N 3.25Å; R118-M120 VanDerWaalsContact C-N 3.35Å; R118-M120 PolarHBondContact O-N 3.42Å; R118-A121 PolarHBondContact O-N 2.77Å; R118-F122 WeakPolarHBondContact O-CB 3.22Å; R118-F122 PolarHBondContact O-N 2.66Å |
| 119 | D | 98.2 | Very high | 97.5 | Very high | 75 Ų | 75 | 101.3 Ų | 101.3 | 40% | 0.401 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.9 | -42.4 | 178.8 | -65.5 | -16.8 | 0 | 0 | 0 | 110.9 | R115 I116 F122 Q123 | R115-D119 VanDerWaalsContact O-CG 3.26Å; R115-D119 PolarHBondContact O-N 2.86Å; I116-D119 PolarHBondContact O-N 2.89Å; D119-F122 PolarHBondContact O-N 3.27Å; D119-Q123 WeakPolarHBondContact O-CG 3.36Å; D119-Q123 PolarHBondContact O-N 3.13Å |
| 120 | M | 98.1 | Very high | 97.5 | Very high | 95 Ų | 95 | 101.2 Ų | 101.2 | 47% | 0.468 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.8 | -40.4 | 175.2 | -68.9 | -67.2 | -68.9 | 0 | 0 | 112.3 | I116 Q117 R118 Q123 K124 | I116-M120 HydrophobicContact CG2-CG 4.23Å; I116-M120 WeakPolarHBondContact O-CB 3.4Å; I116-M120 WeakPolarHBondContact O-CG 3.24Å; I116-M120 PolarHBondContact O-N 3.44Å; Q117-M120 PolarHBondContact O-N 3.13Å; R118-M120 VanDerWaalsContact C-N 3.35Å; R118-M120 PolarHBondContact O-N 3.42Å; M120-Q123 PolarHBondContact O-N 3.35Å; M120-K124 WeakPolarHBondContact O-CG 3.38Å; M120-K124 PolarHBondContact O-N 2.98Å; M120-K124 VanDerWaalsContact O-N 3.14Å |
| 121 | A | 98.3 | Very high | 97.6 | Very high | 56 Ų | 56 | 102.4 Ų | 102.4 | 46% | 0.463 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.7 | -41.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q117 R118 K124 A125 | Q117-A121 VanDerWaalsContact O-CB 3.26Å; Q117-A121 WeakPolarHBondContact O-CB 3.49Å; Q117-A121 PolarHBondContact O-N 3.03Å; R118-A121 PolarHBondContact O-N 2.77Å; A121-K124 PolarHBondContact O-N 3.4Å; A121-A125 WeakPolarHBondContact O-CB 3.49Å; A121-A125 PolarHBondContact O-N 3.42Å |
| 122 | F | 98.1 | Very high | 97.5 | Very high | 148 Ų | 148 | 103 Ų | 103 | 65% | 0.649 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.1 | -47.4 | 175.2 | 175.7 | -97.3 | 0 | 0 | 0 | 111.3 | R118 D119 K124 A125 A126 | R118-F122 WeakPolarHBondContact O-CB 3.22Å; R118-F122 PolarHBondContact O-N 2.66Å; D119-F122 PolarHBondContact O-N 3.27Å; F122-K124 VanDerWaalsContact C-N 3.29Å; F122-K124 PolarHBondContact O-N 3.37Å; F122-A125 PolarHBondContact O-N 2.99Å; F122-A126 HydrophobicContact CE1-CB 4.47Å; F122-A126 VanDerWaalsContact O-CB 3.24Å; F122-A126 WeakPolarHBondContact O-CB 3.3Å; F122-A126 PolarHBondContact O-N 3.05Å |
| 123 | Q | 98.2 | Very high | 97.6 | Very high | 123 Ų | 123 | 101.6 Ų | 101.6 | 58% | 0.575 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -58.5 | -42 | 177.1 | -72.7 | 175.5 | 11.2 | 0 | 0 | 112.1 | D119 M120 S127 | D119-Q123 WeakPolarHBondContact O-CG 3.36Å; D119-Q123 PolarHBondContact O-N 3.13Å; M120-Q123 PolarHBondContact O-N 3.35Å; Q123-S127 WeakPolarHBondContact O-CB 3.4Å; Q123-S127 PolarHBondContact O-N 3.14Å |
| 124 | K | 98.1 | Very high | 97.6 | Very high | 133 Ų | 133 | 101.8 Ų | 101.8 | 58% | 0.578 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.1 | -50.5 | 176 | -71.7 | 176.1 | -178.6 | -179.8 | 0 | 111.6 | M120 A121 F122 A126 S127 E128 | M120-K124 WeakPolarHBondContact O-CG 3.38Å; M120-K124 PolarHBondContact O-N 2.98Å; M120-K124 VanDerWaalsContact O-N 3.14Å; A121-K124 PolarHBondContact O-N 3.4Å; F122-K124 VanDerWaalsContact C-N 3.29Å; F122-K124 PolarHBondContact O-N 3.37Å; K124-A126 VanDerWaalsContact C-N 3.32Å; K124-A126 PolarHBondContact O-N 3.2Å; K124-S127 WeakPolarHBondContact O-CB 3.33Å; K124-S127 PolarHBondContact O-N 2.91Å; K124-S127 VanDerWaalsContact O-N 3.13Å; K124-S127 PolarHBondContact O-OG 3.05Å; K124-E128 PolarHBondContact O-N 2.89Å |
| 125 | A | 98.2 | Very high | 97.5 | Very high | 47 Ų | 47 | 99.8 Ų | 99.8 | 39% | 0.388 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.9 | -42.3 | 178 | 0 | 0 | 0 | 0 | 0 | 111.7 | A121 F122 S127 E128 V129 | A121-A125 WeakPolarHBondContact O-CB 3.49Å; A121-A125 PolarHBondContact O-N 3.42Å; F122-A125 PolarHBondContact O-N 2.99Å; A125-S127 VanDerWaalsContact C-N 3.32Å; A125-S127 PolarHBondContact O-N 3.3Å; A125-E128 PolarHBondContact O-N 3.14Å; A125-E128 VanDerWaalsContact O-N 3.13Å; A125-V129 WeakPolarHBondContact O-CG2 3.43Å; A125-V129 PolarHBondContact O-N 3.34Å |
| 126 | A | 97.9 | Very high | 97.4 | Very high | 43 Ų | 43 | 95.9 Ų | 95.9 | 36% | 0.355 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61 | -41.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | F122 K124 E128 V129 S130 | F122-A126 HydrophobicContact CE1-CB 4.47Å; F122-A126 VanDerWaalsContact O-CB 3.24Å; F122-A126 WeakPolarHBondContact O-CB 3.3Å; F122-A126 PolarHBondContact O-N 3.05Å; K124-A126 VanDerWaalsContact C-N 3.32Å; K124-A126 PolarHBondContact O-N 3.2Å; A126-E128 VanDerWaalsContact C-N 3.3Å; A126-E128 PolarHBondContact O-N 2.91Å; A126-V129 PolarHBondContact O-N 2.85Å; A126-S130 WeakPolarHBondContact O-CB 3.33Å; A126-S130 PolarHBondContact O-N 3.22Å |
| 127 | S | 97.3 | Very high | 97.4 | Very high | 62 Ų | 62 | 95.2 Ų | 95.2 | 43% | 0.434 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.6 | -31 | 175.8 | 79.8 | 0 | 0 | 0 | 0 | 113.2 | Q123 K124 A125 | Q123-S127 WeakPolarHBondContact O-CB 3.4Å; Q123-S127 PolarHBondContact O-N 3.14Å; K124-S127 WeakPolarHBondContact O-CB 3.33Å; K124-S127 PolarHBondContact O-N 2.91Å; K124-S127 VanDerWaalsContact O-N 3.13Å; K124-S127 PolarHBondContact O-OG 3.05Å; A125-S127 VanDerWaalsContact C-N 3.32Å; A125-S127 PolarHBondContact O-N 3.3Å |
| 128 | E | 97.6 | Very high | 97.3 | Very high | 110 Ų | 110 | 95.4 Ų | 95.4 | 51% | 0.514 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -76.8 | -42.4 | 176 | -70.8 | -179.3 | 172.6 | 0 | 0 | 112 | K124 A125 A126 S130 R131 | K124-E128 PolarHBondContact O-N 2.89Å; A125-E128 PolarHBondContact O-N 3.14Å; A125-E128 VanDerWaalsContact O-N 3.13Å; A126-E128 VanDerWaalsContact C-N 3.3Å; A126-E128 PolarHBondContact O-N 2.91Å; E128-S130 VanDerWaalsContact C-N 3.32Å; E128-S130 PolarHBondContact O-N 3.11Å; E128-R131 WeakPolarHBondContact O-CB 3.45Å; E128-R131 PolarHBondContact O-N 3.47Å |
| 129 | V | 97.4 | Very high | 97.2 | Very high | 92 Ų | 92 | 91.1 Ų | 91.1 | 56% | 0.558 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -63.3 | -40.1 | 175.3 | 175.1 | 0 | 0 | 0 | 0 | 110.5 | A125 A126 R131 W132 | A125-V129 WeakPolarHBondContact O-CG2 3.43Å; A125-V129 PolarHBondContact O-N 3.34Å; A126-V129 PolarHBondContact O-N 2.85Å; V129-R131 PolarHBondContact O-N 3.5Å; V129-R131 VanDerWaalsContact O-N 3.11Å; V129-W132 WeakPolarHBondContact O-CB 3.39Å; V129-W132 PolarHBondContact O-N 3.04Å |
| 130 | S | 97.5 | Very high | 97.1 | Very high | 61 Ų | 61 | 94.7 Ų | 94.7 | 43% | 0.427 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.6 | -22.7 | 178.8 | -176.5 | 0 | 0 | 0 | 0 | 113.6 | A126 E128 W132 D133 | A126-S130 WeakPolarHBondContact O-CB 3.33Å; A126-S130 PolarHBondContact O-N 3.22Å; E128-S130 VanDerWaalsContact C-N 3.32Å; E128-S130 PolarHBondContact O-N 3.11Å; S130-W132 PolarHBondContact O-N 2.93Å; S130-W132 VanDerWaalsContact O-N 3.14Å; S130-D133 VanDerWaalsContact CA-OD2 3.26Å; S130-D133 WeakPolarHBondContact CA-OD2 3.37Å; S130-D133 WeakPolarHBondContact CB-OD2 3.26Å; S130-D133 VanDerWaalsContact O-CB 3.27Å; S130-D133 WeakPolarHBondContact O-CB 3.35Å; S130-D133 PolarHBondContact O-N 3.47Å; S130-D133 PolarHBondContact OG-OD2 3.35Å |
| 131 | R | 97.1 | Very high | 97 | Very high | 190 Ų | 190 | 99.8 Ų | 99.8 | 72% | 0.717 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.3 | -24.7 | 171.8 | -59.9 | 176 | -175.2 | 174.4 | 2.9 | 112.5 | E128 V129 | E128-R131 WeakPolarHBondContact O-CB 3.45Å; E128-R131 PolarHBondContact O-N 3.47Å; V129-R131 PolarHBondContact O-N 3.5Å; V129-R131 VanDerWaalsContact O-N 3.11Å |
| 132 | W | 96.5 | Very high | 96.9 | Very high | 165 Ų | 165 | 99.2 Ų | 99.2 | 63% | 0.625 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.8 | -8.8 | 178.8 | -62.7 | 91.1 | 0 | 0 | 0 | 113.5 | V129 S130 G134 V135 I136 | V129-W132 WeakPolarHBondContact O-CB 3.39Å; V129-W132 PolarHBondContact O-N 3.04Å; S130-W132 PolarHBondContact O-N 2.93Å; S130-W132 VanDerWaalsContact O-N 3.14Å; W132-G134 PolarHBondContact O-N 3.44Å; W132-V135 HydrophobicContact CE3-CG2 4.47Å; W132-V135 PolarHBondContact O-N 2.85Å; W132-I136 HydrophobicContact CB-CD1 4.33Å; W132-I136 WeakPolarHBondContact O-CG1 3.39Å; W132-I136 PolarHBondContact O-N 3.1Å |
| 133 | D | 96.9 | Very high | 96.8 | Very high | 68 Ų | 68 | 102 Ų | 102 | 36% | 0.364 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -55.8 | -39.9 | -178.6 | -67.7 | -22.2 | 0 | 0 | 0 | 111.5 | S130 V135 I136 I137 | S130-D133 VanDerWaalsContact CA-OD2 3.26Å; S130-D133 WeakPolarHBondContact CA-OD2 3.37Å; S130-D133 WeakPolarHBondContact CB-OD2 3.26Å; S130-D133 VanDerWaalsContact O-CB 3.27Å; S130-D133 WeakPolarHBondContact O-CB 3.35Å; S130-D133 PolarHBondContact O-N 3.47Å; S130-D133 PolarHBondContact OG-OD2 3.35Å; D133-V135 PolarHBondContact O-N 3.49Å; D133-I136 PolarHBondContact O-N 3Å; D133-I137 WeakPolarHBondContact O-CB 3.27Å; D133-I137 WeakPolarHBondContact O-CD1 3.33Å; D133-I137 WeakPolarHBondContact O-CG1 3.39Å; D133-I137 PolarHBondContact O-N 3.47Å |
| 134 | G | 96.8 | Very high | 96.5 | Very high | 49 Ų | 49 | 103.3 Ų | 103.3 | 51% | 0.505 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.6 | -42.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | W132 Q138 | W132-G134 PolarHBondContact O-N 3.44Å; G134-Q138 WeakPolarHBondContact O-CB 3.38Å; G134-Q138 PolarHBondContact O-N 3.27Å |
| 135 | V | 95.2 | Very high | 96.3 | Very high | 62 Ų | 62 | 100.4 Ų | 100.4 | 38% | 0.376 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -69.9 | -40.1 | 178.1 | -179 | 0 | 0 | 0 | 0 | 110.5 | W132 D133 Q138 N139 | W132-V135 HydrophobicContact CE3-CG2 4.47Å; W132-V135 PolarHBondContact O-N 2.85Å; D133-V135 PolarHBondContact O-N 3.49Å; V135-Q138 PolarHBondContact O-N 3.29Å; V135-N139 WeakPolarHBondContact O-CB 3.49Å; V135-N139 VanDerWaalsContact O-CG 3.25Å; V135-N139 PolarHBondContact O-N 3.42Å |
| 136 | I | 95.8 | Very high | 96 | Very high | 78 Ų | 78 | 103.7 Ų | 103.7 | 40% | 0.4 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.8 | -48.3 | 177.3 | -65.1 | 166 | 0 | 0 | 0 | 110.3 | W132 D133 Q138 N139 Q140 | W132-I136 HydrophobicContact CB-CD1 4.33Å; W132-I136 WeakPolarHBondContact O-CG1 3.39Å; W132-I136 PolarHBondContact O-N 3.1Å; D133-I136 PolarHBondContact O-N 3Å; I136-Q138 VanDerWaalsContact C-N 3.32Å; I136-Q138 PolarHBondContact O-N 3.44Å; I136-N139 PolarHBondContact O-N 3.17Å; I136-Q140 HydrophobicContact CG2-CG 4.41Å; I136-Q140 WeakPolarHBondContact O-CB 3.47Å; I136-Q140 WeakPolarHBondContact O-CG 3.19Å; I136-Q140 PolarHBondContact O-N 2.91Å |
| 137 | I | 97.2 | Very high | 95.6 | Very high | 70 Ų | 70 | 109 Ų | 109 | 36% | 0.359 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.1 | -42.1 | 178.1 | -68.6 | 165.4 | 0 | 0 | 0 | 110.6 | D133 N139 Q140 R141 | D133-I137 WeakPolarHBondContact O-CB 3.27Å; D133-I137 WeakPolarHBondContact O-CD1 3.33Å; D133-I137 WeakPolarHBondContact O-CG1 3.39Å; D133-I137 PolarHBondContact O-N 3.47Å; I137-N139 VanDerWaalsContact C-N 3.34Å; I137-N139 PolarHBondContact O-N 3.07Å; I137-Q140 PolarHBondContact O-N 2.77Å; I137-R141 HydrophobicContact CG2-CG 4.34Å; I137-R141 VanDerWaalsContact CG2-CZ 3.46Å; I137-R141 WeakPolarHBondContact O-CB 3.4Å; I137-R141 VanDerWaalsContact O-CG 3.27Å; I137-R141 WeakPolarHBondContact O-CG 3.3Å; I137-R141 PolarHBondContact O-N 3.03Å |
| 138 | Q | 95.8 | Very high | 95.3 | Very high | 134 Ų | 134 | 110.2 Ų | 110.2 | 63% | 0.626 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -60.7 | -44.4 | 176.1 | -176.9 | 176.9 | -2.2 | 0 | 0 | 111.4 | G134 V135 I136 R141 A142 | G134-Q138 WeakPolarHBondContact O-CB 3.38Å; G134-Q138 PolarHBondContact O-N 3.27Å; V135-Q138 PolarHBondContact O-N 3.29Å; I136-Q138 VanDerWaalsContact C-N 3.32Å; I136-Q138 PolarHBondContact O-N 3.44Å; Q138-R141 PolarHBondContact O-N 3.3Å; Q138-A142 PolarHBondContact O-N 2.8Å |
| 139 | N | 95.1 | Very high | 94.7 | Very high | 52 Ų | 52 | 109.3 Ų | 109.3 | 28% | 0.278 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -67.9 | -35.6 | 177.6 | -70.9 | -11 | 0 | 0 | 0 | 112.5 | V135 I136 I137 A142 L145 | V135-N139 WeakPolarHBondContact O-CB 3.49Å; V135-N139 VanDerWaalsContact O-CG 3.25Å; V135-N139 PolarHBondContact O-N 3.42Å; I136-N139 PolarHBondContact O-N 3.17Å; I137-N139 VanDerWaalsContact C-N 3.34Å; I137-N139 PolarHBondContact O-N 3.07Å; N139-A142 PolarHBondContact O-N 3.03Å; N139-L145 HydrophobicContact CB-CD1 4.47Å; N139-L145 HydrophobicContact CB-CD2 4.3Å |
| 140 | Q | 95.8 | Very high | 93.9 | Very high | 150 Ų | 150 | 112 Ų | 112 | 70% | 0.701 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -69.1 | -33.2 | 175 | -75.2 | 178.2 | 2.1 | 0 | 0 | 112.9 | I136 I137 | I136-Q140 HydrophobicContact CG2-CG 4.41Å; I136-Q140 WeakPolarHBondContact O-CB 3.47Å; I136-Q140 WeakPolarHBondContact O-CG 3.19Å; I136-Q140 PolarHBondContact O-N 2.91Å; I137-Q140 PolarHBondContact O-N 2.77Å |
| 141 | R | 96.9 | Very high | 93 | Very high | 203 Ų | 203 | 115.2 Ų | 115.2 | 77% | 0.766 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -81.9 | -16.7 | 177.4 | -71.3 | 177 | -177.6 | 174.8 | 3.3 | 113.2 | I137 Q138 E143 | I137-R141 HydrophobicContact CG2-CG 4.34Å; I137-R141 VanDerWaalsContact CG2-CZ 3.46Å; I137-R141 WeakPolarHBondContact O-CB 3.4Å; I137-R141 VanDerWaalsContact O-CG 3.27Å; I137-R141 WeakPolarHBondContact O-CG 3.3Å; I137-R141 PolarHBondContact O-N 3.03Å; Q138-R141 PolarHBondContact O-N 3.3Å; R141-E143 PolarHBondContact O-N 3.43Å |
| 142 | A | 95.5 | Very high | 92.1 | Very high | 43 Ų | 43 | 113.1 Ų | 113.1 | 36% | 0.355 | 57% | 0.567 | S | S | . | * | trans | -70.8 | 128 | 179.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | Q138 N139 Q144 L145 | Q138-A142 PolarHBondContact O-N 2.8Å; N139-A142 PolarHBondContact O-N 3.03Å; A142-Q144 VanDerWaalsContact C-N 3.31Å; A142-Q144 PolarHBondContact O-N 2.7Å; A142-L145 HydrophobicContact CB-CD2 3.79Å | ||
| 143 | E | 95.3 | Very high | 91.1 | Very high | 206 Ų | 206 | 111 Ų | 111 | 96% | 0.963 | 58% | 0.575 | S | S | * | * | S | Bend | trans | -67.2 | -33 | 178.6 | -63.7 | 179.2 | 170.2 | 0 | 0 | 112.4 | R141 | R141-E143 PolarHBondContact O-N 3.43Š|
| 144 | Q | 93.7 | Very high | 89.7 | Confident | 151 Ų | 151 | 112.7 Ų | 112.7 | 71% | 0.706 | 60% | 0.598 | S | S | * | * | trans | -137 | 131.9 | 177.4 | -172.6 | 176.4 | 10 | 0 | 0 | 110.5 | A142 L146 | A142-Q144 VanDerWaalsContact C-N 3.31Å; A142-Q144 PolarHBondContact O-N 2.7Å; Q144-L146 HydrophobicContact CG-CD2 4.2Å | ||
| 145 | L | 93.4 | Very high | 88.7 | Confident | 73 Ų | 73 | 112.7 Ų | 112.7 | 38% | 0.382 | 60% | 0.598 | S | S | . | * | trans | -107.4 | 124.5 | 170.1 | -63.2 | 176.4 | 0 | 0 | 0 | 109 | N139 A142 F147 | N139-L145 HydrophobicContact CB-CD1 4.47Å; N139-L145 HydrophobicContact CB-CD2 4.3Å; A142-L145 HydrophobicContact CB-CD2 3.79Å; L145-F147 HydrophobicContact CB-CE2 3.85Å; L145-F147 HydrophobicContact CB-CZ 4.22Å; L145-F147 HydrophobicContact CD1-CZ 4.39Å | ||
| 146 | L | 90.6 | Very high | 87.6 | Confident | 116 Ų | 116 | 116.1 Ų | 116.1 | 61% | 0.607 | 62% | 0.622 | S | S | * | * | trans | -101.7 | 122.9 | 176.2 | -64.6 | 177.4 | 0 | 0 | 0 | 109.4 | Q144 | Q144-L146 HydrophobicContact CG-CD2 4.2Š| ||
| 147 | F | 91.4 | Very high | 86.4 | Confident | 154 Ų | 154 | 119 Ų | 119 | 68% | 0.675 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -106.1 | 140.5 | 176.4 | -67.4 | -77.5 | 0 | 0 | 0 | 110.5 | L145 L149 | L145-F147 HydrophobicContact CB-CE2 3.85Å; L145-F147 HydrophobicContact CB-CZ 4.22Å; L145-F147 HydrophobicContact CD1-CZ 4.39Å; F147-L149 HydrophobicContact CD1-CB 4.1Å; F147-L149 HydrophobicContact CE1-CB 4.15Å |
| 148 | P | 90.4 | Very high | 85.4 | Confident | 88 Ų | 88 | 119.6 Ų | 119.6 | 57% | 0.571 | 64% | 0.639 | S | S | * | * | S | Bend | cis | -75.5 | 136.7 | 6.8 | 27.7 | -31.4 | 0 | 0 | 0 | 113.3 | Q151 | P148-Q151 HydrophobicContact CG-CG 4.31Å; P148-Q151 WeakPolarHBondContact O-CG 3.27Å; P148-Q151 PolarHBondContact O-NE2 3.3Å |
| 149 | L | 84.1 | Confident | 84.2 | Confident | 90 Ų | 90 | 118.5 Ų | 118.5 | 47% | 0.471 | 64% | 0.642 | S | S | . | * | S | Bend | trans | -72 | -38.7 | -175.6 | -174.9 | 63.8 | 0 | 0 | 0 | 112.3 | F147 Q151 | F147-L149 HydrophobicContact CD1-CB 4.1Å; F147-L149 HydrophobicContact CE1-CB 4.15Å; L149-Q151 PolarHBondContact O-N 2.98Å |
| 150 | N | 81.8 | Confident | 83.1 | Confident | 150 Ų | 150 | 123.6 Ų | 123.6 | 80% | 0.802 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -93.9 | 74.3 | 175.2 | -63.3 | -26.9 | 0 | 0 | 0 | 109 | D152 | N150-D152 PolarHBondContact O-N 2.98Š|
| 151 | Q | 78.3 | Confident | 81.8 | Confident | 127 Ų | 127 | 125.2 Ų | 125.2 | 59% | 0.593 | 66% | 0.663 | S | S | * | * | trans | -70.9 | 129.2 | 172.1 | -57.4 | -169 | -3.4 | 0 | 0 | 108.6 | P148 L149 | P148-Q151 HydrophobicContact CG-CG 4.31Å; P148-Q151 WeakPolarHBondContact O-CG 3.27Å; P148-Q151 PolarHBondContact O-NE2 3.3Å; L149-Q151 PolarHBondContact O-N 2.98Å | ||
| 152 | D | 76.9 | Confident | 80.4 | Confident | 147 Ų | 147 | 120.3 Ų | 120.3 | 79% | 0.786 | 65% | 0.652 | S | S | * | * | trans | -53.7 | 138.8 | 162.9 | -77.2 | -33.4 | 0 | 0 | 0 | 107.9 | N150 A154 | N150-D152 PolarHBondContact O-N 2.98Å; D152-A154 PolarHBondContact O-N 2.97Å | ||
| 153 | P | 76.1 | Confident | 79.3 | Confident | 120 Ų | 120 | 123 Ų | 123 | 78% | 0.779 | 66% | 0.664 | S | S | * | * | trans | -54 | 112.6 | -176 | 22.2 | -33.2 | 0 | 0 | 0 | 109 | G155 | P153-G155 PolarHBondContact O-N 3.36Š| ||
| 154 | A | 68 | Low | 78.2 | Confident | 103 Ų | 103 | 119.4 Ų | 119.4 | 85% | 0.851 | 66% | 0.656 | S | S | * | * | trans | -68.5 | 99.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 107.7 | D152 | D152-A154 PolarHBondContact O-N 2.97Š| ||
| 155 | G | 74.8 | Confident | 77.2 | Confident | 50 Ų | 50 | 115 Ų | 115 | 52% | 0.515 | 65% | 0.65 | S | S | . | * | S | Bend | trans | 179.3 | 161 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | P153 K157 | P153-G155 PolarHBondContact O-N 3.36Å; G155-K157 PolarHBondContact O-N 3.4Å |
| 156 | P | 72.3 | Confident | 76.6 | Confident | 133 Ų | 133 | 119 Ų | 119 | 86% | 0.864 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 123.3 | 171.5 | 25 | -31.7 | 0 | 0 | 0 | 108.5 | ||
| 157 | K | 70.9 | Confident | 76.3 | Confident | 140 Ų | 140 | 121.5 Ų | 121.5 | 61% | 0.609 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 137.9 | 175 | -66.4 | 178.6 | -178.8 | 176.4 | 0 | 107.9 | G155 V159 L162 | G155-K157 PolarHBondContact O-N 3.4Å; K157-V159 PolarHBondContact O-N 3.41Å; K157-L162 HydrophobicContact CB-CD2 4.25Å; K157-L162 HydrophobicContact CB-CG 4.46Å |
| 158 | P | 76.1 | Confident | 76.1 | Confident | 81 Ų | 81 | 115.2 Ų | 115.2 | 53% | 0.526 | 64% | 0.643 | S | S | . | * | P | Polyproline II helix | trans | -46.7 | 134.9 | 176.5 | -28 | 33.8 | 0 | 0 | 0 | 110.1 | E160 R161 L162 | P158-E160 PolarHBondContact O-N 2.78Å; P158-R161 WeakPolarHBondContact O-CB 3.32Å; P158-R161 PolarHBondContact O-N 3.43Å; P158-L162 PolarHBondContact O-N 3.14Å |
| 159 | V | 71.3 | Confident | 75.9 | Confident | 111 Ų | 111 | 121.5 Ų | 121.5 | 67% | 0.673 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -51.7 | -35.4 | -174.5 | 176.9 | 0 | 0 | 0 | 0 | 111.1 | K157 R161 L162 V163 | K157-V159 PolarHBondContact O-N 3.41Å; V159-R161 VanDerWaalsContact C-N 3.29Å; V159-R161 PolarHBondContact O-N 3.17Å; V159-L162 WeakPolarHBondContact O-CB 3.49Å; V159-L162 PolarHBondContact O-N 3.46Å; V159-V163 HydrophobicContact CG1-CG2 4.23Å; V159-V163 WeakPolarHBondContact O-CG2 3.33Å; V159-V163 PolarHBondContact O-N 2.94Å |
| 160 | E | 71.4 | Confident | 76.3 | Confident | 159 Ų | 159 | 119.9 Ų | 119.9 | 74% | 0.743 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -51.7 | -42.9 | 173.2 | -62.7 | 170.6 | -174.4 | 0 | 0 | 113.3 | P158 L162 V163 V164 | P158-E160 PolarHBondContact O-N 2.78Å; E160-L162 VanDerWaalsContact C-N 3.32Å; E160-L162 PolarHBondContact O-N 3.38Å; E160-V163 PolarHBondContact O-N 3.45Å; E160-V164 VanDerWaalsContact O-CG2 3.3Å; E160-V164 WeakPolarHBondContact O-CG2 3.3Å; E160-V164 PolarHBondContact O-N 3.32Å |
| 161 | R | 68 | Low | 76.8 | Confident | 184 Ų | 184 | 117.3 Ų | 117.3 | 69% | 0.694 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -72.5 | -26.4 | 179.8 | -134.6 | 176.3 | -170.7 | 179.2 | 1.8 | 112.4 | P158 V159 | P158-R161 WeakPolarHBondContact O-CB 3.32Å; P158-R161 PolarHBondContact O-N 3.43Å; V159-R161 VanDerWaalsContact C-N 3.29Å; V159-R161 PolarHBondContact O-N 3.17Å |
| 162 | L | 67.6 | Low | 77.4 | Confident | 100 Ų | 100 | 116.6 Ų | 116.6 | 52% | 0.524 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -76.6 | -40 | 175.5 | -61.1 | 174.9 | 0 | 0 | 0 | 111.2 | K157 P158 V159 E160 G165 W166 | K157-L162 HydrophobicContact CB-CD2 4.25Å; K157-L162 HydrophobicContact CB-CG 4.46Å; P158-L162 PolarHBondContact O-N 3.14Å; V159-L162 WeakPolarHBondContact O-CB 3.49Å; V159-L162 PolarHBondContact O-N 3.46Å; E160-L162 VanDerWaalsContact C-N 3.32Å; E160-L162 PolarHBondContact O-N 3.38Å; L162-G165 PolarHBondContact O-N 2.69Å; L162-W166 PolarHBondContact O-N 2.85Å |
| 163 | V | 73.4 | Confident | 77.9 | Confident | 99 Ų | 99 | 112.6 Ų | 112.6 | 60% | 0.6 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -65.4 | -39.3 | 178.3 | 178.7 | 0 | 0 | 0 | 0 | 111.2 | V159 E160 G165 W166 | V159-V163 HydrophobicContact CG1-CG2 4.23Å; V159-V163 WeakPolarHBondContact O-CG2 3.33Å; V159-V163 PolarHBondContact O-N 2.94Å; E160-V163 PolarHBondContact O-N 3.45Å; V163-G165 PolarHBondContact O-N 3.09Å; V163-W166 PolarHBondContact O-N 3.43Å |
| 164 | V | 72.8 | Confident | 78.6 | Confident | 131 Ų | 131 | 111.9 Ų | 111.9 | 79% | 0.794 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -63.2 | -28.6 | 178.2 | 172.6 | 0 | 0 | 0 | 0 | 112.9 | E160 | E160-V164 VanDerWaalsContact O-CG2 3.3Å; E160-V164 WeakPolarHBondContact O-CG2 3.3Å; E160-V164 PolarHBondContact O-N 3.32Å |
| 165 | G | 72.1 | Confident | 79.7 | Confident | 58 Ų | 58 | 112.9 Ų | 112.9 | 60% | 0.598 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.1 | -2.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | L162 V163 | L162-G165 PolarHBondContact O-N 2.69Å; V163-G165 PolarHBondContact O-N 3.09Å |
| 166 | W | 81.4 | Confident | 80.2 | Confident | 158 Ų | 158 | 114.4 Ų | 114.4 | 60% | 0.598 | 59% | 0.586 | S | S | * | * | trans | -76.6 | 131.9 | -174.9 | -173.5 | 86.5 | 0 | 0 | 0 | 111.2 | L162 V163 F177 | L162-W166 PolarHBondContact O-N 2.85Å; V163-W166 PolarHBondContact O-N 3.43Å; W166-F177 HydrophobicContact CZ3-CD2 4.4Å | ||
| 167 | K | 83.9 | Confident | 80.8 | Confident | 169 Ų | 169 | 113.5 Ų | 113.5 | 74% | 0.735 | 57% | 0.569 | S | S | * | * | trans | -134.4 | 138.8 | 178 | -65.9 | -177.3 | 178.6 | -179 | 0 | 109 | R169 | K167-R169 PolarHBondContact O-N 3.13Š| ||
| 168 | A | 87.3 | Confident | 81.5 | Confident | 21 Ų | 21 | 109.8 Ų | 109.8 | 17% | 0.174 | 56% | 0.56 | C | S | . | * | trans | -60.2 | 123 | 172 | 0 | 0 | 0 | 0 | 0 | 110.6 | E173 Q174 F177 | A168-E173 HydrophobicContact CB-CB 3.65Å; A168-Q174 HydrophobicContact CB-CG 3.91Å; A168-F177 HydrophobicContact CB-CB 4.25Å | ||
| 169 | R | 86.5 | Confident | 82 | Confident | 220 Ų | 220 | 111 Ų | 111 | 83% | 0.83 | 56% | 0.562 | S | S | * | * | trans | -105.5 | -37.2 | -178.8 | -66.7 | -175.3 | -177.5 | -170.8 | 0.1 | 112.1 | K167 E173 | K167-R169 PolarHBondContact O-N 3.13Å; R169-E173 PolarHBondContact N-OE2 3.39Å | ||
| 170 | T | 92.6 | Very high | 82.4 | Confident | 57 Ų | 57 | 110 Ų | 110 | 35% | 0.35 | 55% | 0.552 | S | S | . | * | S | Bend | trans | -83 | 151.9 | -178.9 | 67.9 | 0 | 0 | 0 | 0 | 111 | L172 E173 Q174 | T170-L172 PolarHBondContact O-N 3.25Å; T170-E173 VanDerWaalsContact CG2-OE1 3.28Å; T170-E173 WeakPolarHBondContact CG2-OE1 3.1Å; T170-E173 PolarHBondContact N-OE2 3.24Å; T170-E173 VanDerWaalsContact N-OE2 3.16Å; T170-E173 PolarHBondContact O-N 3.35Å; T170-E173 VanDerWaalsContact O-N 3.11Å; T170-E173 VanDerWaalsContact OG1-CB 3.28Å; T170-E173 WeakPolarHBondContact OG1-CB 3.4Å; T170-E173 WeakPolarHBondContact OG1-CG 3.41Å; T170-E173 PolarHBondContact OG1-N 3.25Å; T170-E173 VanDerWaalsContact OG1-N 3.13Å; T170-E173 PolarHBondContact OG1-OE1 2.89Å; T170-Q174 WeakPolarHBondContact O-CG 3.38Å; T170-Q174 PolarHBondContact O-N 3.42Å |
| 171 | P | 91.5 | Very high | 82.7 | Confident | 96 Ų | 96 | 105.7 Ų | 105.7 | 62% | 0.623 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -58.2 | -39.2 | 178.5 | 22.7 | -33.1 | 0 | 0 | 0 | 111.2 | Q174 E175 | P171-Q174 PolarHBondContact O-N 3.38Å; P171-E175 WeakPolarHBondContact O-CG 3.24Å; P171-E175 PolarHBondContact O-N 3.25Å |
| 172 | L | 90.3 | Very high | 83.4 | Confident | 111 Ų | 111 | 100.7 Ų | 100.7 | 58% | 0.581 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.2 | -43.6 | 174.5 | 178.6 | 140.3 | 0 | 0 | 0 | 112.4 | T170 Q174 E175 I176 | T170-L172 PolarHBondContact O-N 3.25Å; L172-Q174 VanDerWaalsContact C-N 3.3Å; L172-Q174 PolarHBondContact O-N 2.64Å; L172-E175 PolarHBondContact O-N 3.01Å; L172-I176 HydrophobicContact CD2-CD1 3.4Å; L172-I176 VanDerWaalsContact CD2-CD1 3.4Å; L172-I176 HydrophobicContact CG-CD1 3.88Å; L172-I176 WeakPolarHBondContact O-CB 3.3Å; L172-I176 WeakPolarHBondContact O-CD1 3.25Å; L172-I176 WeakPolarHBondContact O-CG1 3.44Å; L172-I176 PolarHBondContact O-N 2.83Å |
| 173 | E | 87.1 | Confident | 83.9 | Confident | 63 Ų | 63 | 101 Ų | 101 | 29% | 0.294 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.9 | -35.6 | 174.7 | -75.5 | 156.2 | -147.4 | 0 | 0 | 112.5 | A168 R169 T170 F177 | A168-E173 HydrophobicContact CB-CB 3.65Å; R169-E173 PolarHBondContact N-OE2 3.39Å; T170-E173 VanDerWaalsContact CG2-OE1 3.28Å; T170-E173 WeakPolarHBondContact CG2-OE1 3.1Å; T170-E173 PolarHBondContact N-OE2 3.24Å; T170-E173 VanDerWaalsContact N-OE2 3.16Å; T170-E173 PolarHBondContact O-N 3.35Å; T170-E173 VanDerWaalsContact O-N 3.11Å; T170-E173 VanDerWaalsContact OG1-CB 3.28Å; T170-E173 WeakPolarHBondContact OG1-CB 3.4Å; T170-E173 WeakPolarHBondContact OG1-CG 3.41Å; T170-E173 PolarHBondContact OG1-N 3.25Å; T170-E173 VanDerWaalsContact OG1-N 3.13Å; T170-E173 PolarHBondContact OG1-OE1 2.89Å; E173-F177 VanDerWaalsContact O-CB 3.22Å; E173-F177 WeakPolarHBondContact O-CB 3.46Å; E173-F177 PolarHBondContact O-N 3Å |
| 174 | Q | 91.4 | Very high | 83.3 | Confident | 106 Ų | 106 | 105.2 Ų | 105.2 | 50% | 0.495 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -69 | -43.5 | 178.6 | -70.7 | 172.5 | 9.8 | 0 | 0 | 111 | A168 T170 P171 L172 F177 S178 | A168-Q174 HydrophobicContact CB-CG 3.91Å; T170-Q174 WeakPolarHBondContact O-CG 3.38Å; T170-Q174 PolarHBondContact O-N 3.42Å; P171-Q174 PolarHBondContact O-N 3.38Å; L172-Q174 VanDerWaalsContact C-N 3.3Å; L172-Q174 PolarHBondContact O-N 2.64Å; Q174-F177 PolarHBondContact O-N 3.04Å; Q174-S178 VanDerWaalsContact O-CB 3.32Å; Q174-S178 WeakPolarHBondContact O-CB 3.18Å; Q174-S178 PolarHBondContact O-N 3.32Å; Q174-S178 PolarHBondContact O-OG 3.47Å |
| 175 | E | 90.3 | Very high | 82.6 | Confident | 124 Ų | 124 | 104 Ų | 104 | 58% | 0.579 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -59.4 | -50.3 | 172.5 | -73.8 | 175.5 | -171 | 0 | 0 | 110.5 | P171 L172 F177 S178 L179 | P171-E175 WeakPolarHBondContact O-CG 3.24Å; P171-E175 PolarHBondContact O-N 3.25Å; L172-E175 PolarHBondContact O-N 3.01Å; E175-F177 PolarHBondContact O-N 3.1Å; E175-S178 PolarHBondContact O-N 3.02Å; E175-S178 PolarHBondContact O-OG 3.22Å; E175-L179 VanDerWaalsContact O-CG 3.28Å; E175-L179 WeakPolarHBondContact O-CG 3.29Å; E175-L179 PolarHBondContact O-N 2.81Å |
| 176 | I | 85.2 | Confident | 81.5 | Confident | 81 Ų | 81 | 106.7 Ų | 106.7 | 42% | 0.415 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -59.4 | -45.3 | 177.9 | -69.2 | 168 | 0 | 0 | 0 | 111.4 | L172 S178 L179 L180 | L172-I176 HydrophobicContact CD2-CD1 3.4Å; L172-I176 VanDerWaalsContact CD2-CD1 3.4Å; L172-I176 HydrophobicContact CG-CD1 3.88Å; L172-I176 WeakPolarHBondContact O-CB 3.3Å; L172-I176 WeakPolarHBondContact O-CD1 3.25Å; L172-I176 WeakPolarHBondContact O-CG1 3.44Å; L172-I176 PolarHBondContact O-N 2.83Å; I176-S178 VanDerWaalsContact C-N 3.35Å; I176-S178 PolarHBondContact O-N 3.45Å; I176-L179 PolarHBondContact O-N 3.34Å; I176-L180 HydrophobicContact CG2-CD1 3.65Å; I176-L180 HydrophobicContact CG2-CG 4.23Å; I176-L180 WeakPolarHBondContact O-CB 3.32Å; I176-L180 WeakPolarHBondContact O-CG 3.27Å; I176-L180 PolarHBondContact O-N 2.9Å |
| 177 | F | 85 | Confident | 80 | Confident | 115 Ų | 115 | 106.7 Ų | 106.7 | 50% | 0.504 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.9 | -38.8 | 177.8 | -174.6 | -97 | 0 | 0 | 0 | 112.1 | W166 A168 E173 Q174 E175 L180 S181 | W166-F177 HydrophobicContact CZ3-CD2 4.4Å; A168-F177 HydrophobicContact CB-CB 4.25Å; E173-F177 VanDerWaalsContact O-CB 3.22Å; E173-F177 WeakPolarHBondContact O-CB 3.46Å; E173-F177 PolarHBondContact O-N 3Å; Q174-F177 PolarHBondContact O-N 3.04Å; E175-F177 PolarHBondContact O-N 3.1Å; F177-L180 PolarHBondContact O-N 3.25Å; F177-S181 VanDerWaalsContact O-CB 3.3Å; F177-S181 WeakPolarHBondContact O-CB 3.48Å; F177-S181 PolarHBondContact O-N 2.87Å; F177-S181 PolarHBondContact O-OG 3.32Å |
| 178 | S | 87.3 | Confident | 78.3 | Confident | 61 Ų | 61 | 104.3 Ų | 104.3 | 43% | 0.427 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.7 | -41.4 | 175.5 | 76.6 | 0 | 0 | 0 | 0 | 111.6 | Q174 E175 I176 S181 A182 | Q174-S178 VanDerWaalsContact O-CB 3.32Å; Q174-S178 WeakPolarHBondContact O-CB 3.18Å; Q174-S178 PolarHBondContact O-N 3.32Å; Q174-S178 PolarHBondContact O-OG 3.47Å; E175-S178 PolarHBondContact O-N 3.02Å; E175-S178 PolarHBondContact O-OG 3.22Å; I176-S178 VanDerWaalsContact C-N 3.35Å; I176-S178 PolarHBondContact O-N 3.45Å; S178-S181 WeakPolarHBondContact CA-OG 3.42Å; S178-S181 PolarHBondContact O-OG 3.33Å; S178-S181 VanDerWaalsContact O-OG 3.05Å; S178-A182 VanDerWaalsContact O-CB 3.22Å; S178-A182 WeakPolarHBondContact O-CB 3.35Å; S178-A182 PolarHBondContact O-N 3.21Å |
| 179 | L | 85.6 | Confident | 76.3 | Confident | 108 Ų | 108 | 109.4 Ų | 109.4 | 57% | 0.565 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -68.2 | -43 | 177.3 | -68.9 | 173.4 | 0 | 0 | 0 | 111.9 | E175 I176 N183 | E175-L179 VanDerWaalsContact O-CG 3.28Å; E175-L179 WeakPolarHBondContact O-CG 3.29Å; E175-L179 PolarHBondContact O-N 2.81Å; I176-L179 PolarHBondContact O-N 3.34Å; L179-N183 PolarHBondContact O-N 2.95Å; L179-N183 VanDerWaalsContact O-N 3.1Å; L179-N183 PolarHBondContact O-ND2 3.4Å |
| 180 | L | 80.2 | Confident | 74.9 | Confident | 88 Ų | 88 | 103 Ų | 103 | 46% | 0.461 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -66.7 | -41.3 | 178.2 | -72.8 | 171 | 0 | 0 | 0 | 112.3 | I176 F177 K184 | I176-L180 HydrophobicContact CG2-CD1 3.65Å; I176-L180 HydrophobicContact CG2-CG 4.23Å; I176-L180 WeakPolarHBondContact O-CB 3.32Å; I176-L180 WeakPolarHBondContact O-CG 3.27Å; I176-L180 PolarHBondContact O-N 2.9Å; F177-L180 PolarHBondContact O-N 3.25Å; L180-K184 PolarHBondContact O-N 2.86Å |
| 181 | S | 78.2 | Confident | 73 | Confident | 69 Ų | 69 | 107.1 Ų | 107.1 | 48% | 0.483 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -70.4 | -35.9 | 177.3 | 57.1 | 0 | 0 | 0 | 0 | 112.6 | F177 S178 | F177-S181 VanDerWaalsContact O-CB 3.3Å; F177-S181 WeakPolarHBondContact O-CB 3.48Å; F177-S181 PolarHBondContact O-N 2.87Å; F177-S181 PolarHBondContact O-OG 3.32Å; S178-S181 WeakPolarHBondContact CA-OG 3.42Å; S178-S181 PolarHBondContact O-OG 3.33Å; S178-S181 VanDerWaalsContact O-OG 3.05Å |
| 182 | A | 82.4 | Confident | 70.9 | Confident | 79 Ų | 79 | 105.7 Ų | 105.7 | 65% | 0.653 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -66.2 | -40.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | S178 | S178-A182 VanDerWaalsContact O-CB 3.22Å; S178-A182 WeakPolarHBondContact O-CB 3.35Å; S178-A182 PolarHBondContact O-N 3.21Å |
| 183 | N | 76.5 | Confident | 69.5 | Low | 106 Ų | 106 | 103.8 Ų | 103.8 | 57% | 0.567 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -84.6 | -8 | -176.9 | -87.4 | -62.6 | 0 | 0 | 0 | 114.9 | L179 Q185 | L179-N183 PolarHBondContact O-N 2.95Å; L179-N183 VanDerWaalsContact O-N 3.1Å; L179-N183 PolarHBondContact O-ND2 3.4Å; N183-Q185 HydrophobicContact CB-CB 4.33Å; N183-Q185 PolarHBondContact O-N 3.4Å |
| 184 | K | 61.8 | Low | 68.2 | Low | 188 Ų | 188 | 106.1 Ų | 106.1 | 82% | 0.817 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 41.9 | 40.1 | -177.5 | -65.1 | -177.7 | -179.2 | 175.8 | 0 | 112.9 | L180 P186 | L180-K184 PolarHBondContact O-N 2.86Å; K184-P186 WeakPolarHBondContact O-CD 3.46Å |
| 185 | Q | 57.8 | Low | 66.6 | Low | 107 Ų | 107 | 104.6 Ų | 104.6 | 50% | 0.5 | 60% | 0.595 | S | S | . | * | trans | -81.4 | 126.9 | -164.1 | -138.7 | 164.3 | -14.9 | 0 | 0 | 109.9 | N183 L187 | N183-Q185 HydrophobicContact CB-CB 4.33Å; N183-Q185 PolarHBondContact O-N 3.4Å; Q185-L187 PolarHBondContact O-N 3.15Å | ||
| 186 | P | 48.3 | Very low | 64.9 | Low | 113 Ų | 113 | 103 Ų | 103 | 73% | 0.734 | 59% | 0.587 | S | S | * | * | trans | -62.9 | 123.9 | 160.2 | 25.7 | -28.9 | 0 | 0 | 0 | 107.6 | K184 T188 | K184-P186 WeakPolarHBondContact O-CD 3.46Å; P186-T188 VanDerWaalsContact C-N 3.31Å; P186-T188 PolarHBondContact O-N 2.98Å | ||
| 187 | L | 51.7 | Low | 63.7 | Low | 158 Ų | 158 | 102.9 Ų | 102.9 | 83% | 0.827 | 59% | 0.585 | S | S | * | * | S | Bend | trans | -68.1 | 84.4 | -177.9 | -163 | 94.3 | 0 | 0 | 0 | 109.8 | Q185 | Q185-L187 PolarHBondContact O-N 3.15Š|
| 188 | T | 47.8 | Very low | 62.6 | Low | 119 Ų | 119 | 100.2 Ų | 100.2 | 73% | 0.73 | 58% | 0.584 | S | S | * | * | trans | -170.7 | 92.8 | 152.3 | -55.7 | 0 | 0 | 0 | 0 | 108.6 | P186 | P186-T188 VanDerWaalsContact C-N 3.31Å; P186-T188 PolarHBondContact O-N 2.98Å | ||
| 189 | D | 45.1 | Very low | 61.1 | Low | 128 Ų | 128 | 101 Ų | 101 | 68% | 0.684 | 59% | 0.59 | S | S | * | * | trans | -113.9 | 124.7 | 141.4 | -79.9 | -35.5 | 0 | 0 | 0 | 105.5 | V191 | D189-V191 PolarHBondContact O-N 3.3Š| ||
| 190 | P | 56.1 | Low | 59.7 | Low | 86 Ų | 86 | 99 Ų | 99 | 56% | 0.558 | 58% | 0.582 | S | S | * | * | trans | -66.6 | 126.9 | -177.5 | 26.5 | -31.6 | 0 | 0 | 0 | 109.4 | L192 | P190-L192 PolarHBondContact O-N 2.96Å; P190-L192 VanDerWaalsContact O-N 3.09Å | ||
| 191 | V | 53.5 | Low | 58.7 | Low | 143 Ų | 143 | 101.9 Ų | 101.9 | 87% | 0.867 | 59% | 0.591 | S | S | * | * | S | Bend | trans | -64.4 | -13.3 | -176.2 | 177.4 | 0 | 0 | 0 | 0 | 112.5 | D189 | D189-V191 PolarHBondContact O-N 3.3Š|
| 192 | L | 47.7 | Very low | 57.9 | Low | 67 Ų | 67 | 102 Ų | 102 | 35% | 0.351 | 60% | 0.596 | S | S | . | * | S | Bend | trans | -113.4 | 139.1 | -177.8 | -108.5 | 68 | 0 | 0 | 0 | 112 | P190 E196 E197 V200 | P190-L192 PolarHBondContact O-N 2.96Å; P190-L192 VanDerWaalsContact O-N 3.09Å; L192-E196 HydrophobicContact CB-CB 4.24Å; L192-E196 HydrophobicContact CD2-CB 3.76Å; L192-E196 HydrophobicContact CG-CB 3.65Å; L192-E197 HydrophobicContact CB-CG 3.64Å; L192-E197 HydrophobicContact CD2-CG 4.43Å; L192-V200 HydrophobicContact CD2-CB 4.43Å; L192-V200 HydrophobicContact CD2-CG2 3.78Å |
| 193 | T | 59.8 | Low | 56.6 | Low | 71 Ų | 71 | 105.1 Ų | 105.1 | 44% | 0.436 | 60% | 0.599 | S | S | . | * | trans | -67.6 | 153.1 | 171.6 | 63.4 | 0 | 0 | 0 | 0 | 110.6 | A195 E196 E197 | T193-A195 PolarHBondContact O-N 3.43Å; T193-E196 WeakPolarHBondContact CB-OE2 3.48Å; T193-E196 WeakPolarHBondContact CG2-OE2 3.48Å; T193-E196 PolarHBondContact N-OE2 2.87Å; T193-E196 WeakPolarHBondContact O-CA 3.49Å; T193-E196 PolarHBondContact O-N 3.21Å; T193-E196 WeakPolarHBondContact OG1-CG 3.35Å; T193-E196 PolarHBondContact OG1-N 3.32Å; T193-E196 PolarHBondContact OG1-OE2 2.86Å; T193-E197 PolarHBondContact O-N 3.05Å | ||
| 194 | P | 61.3 | Low | 55.9 | Low | 111 Ų | 111 | 102.2 Ų | 102.2 | 72% | 0.721 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -60 | -22.5 | -177 | 22.3 | -33.8 | 0 | 0 | 0 | 113.6 | A198 | P194-A198 WeakPolarHBondContact O-CB 3.49Å; P194-A198 PolarHBondContact O-N 3.06Å |
| 195 | A | 57.1 | Low | 56.1 | Low | 74 Ų | 74 | 100 Ų | 100 | 61% | 0.612 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -75.3 | -40.3 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | T193 A198 S199 | T193-A195 PolarHBondContact O-N 3.43Å; A195-A198 PolarHBondContact O-N 2.9Å; A195-S199 PolarHBondContact O-N 3.02Å |
| 196 | E | 55.7 | Low | 57 | Low | 91 Ų | 91 | 101.9 Ų | 101.9 | 43% | 0.425 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -71.2 | -39.6 | 176.1 | -68.7 | 161.8 | 157.9 | 0 | 0 | 110.9 | L192 T193 A198 S199 V200 | L192-E196 HydrophobicContact CB-CB 4.24Å; L192-E196 HydrophobicContact CD2-CB 3.76Å; L192-E196 HydrophobicContact CG-CB 3.65Å; T193-E196 WeakPolarHBondContact CB-OE2 3.48Å; T193-E196 WeakPolarHBondContact CG2-OE2 3.48Å; T193-E196 PolarHBondContact N-OE2 2.87Å; T193-E196 WeakPolarHBondContact O-CA 3.49Å; T193-E196 PolarHBondContact O-N 3.21Å; T193-E196 WeakPolarHBondContact OG1-CG 3.35Å; T193-E196 PolarHBondContact OG1-N 3.32Å; T193-E196 PolarHBondContact OG1-OE2 2.86Å; E196-A198 VanDerWaalsContact C-N 3.28Å; E196-A198 PolarHBondContact O-N 3.25Å; E196-S199 WeakPolarHBondContact CA-OG 3.43Å; E196-S199 PolarHBondContact O-N 3.38Å; E196-S199 VanDerWaalsContact O-N 3.11Å; E196-S199 PolarHBondContact O-OG 3.21Å; E196-V200 WeakPolarHBondContact O-CG2 3.36Å; E196-V200 PolarHBondContact O-N 3.25Å |
| 197 | E | 59.2 | Low | 58.4 | Low | 78 Ų | 78 | 100.6 Ų | 100.6 | 36% | 0.364 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -61.2 | -37.5 | 173.1 | -65.6 | -168.7 | 161.1 | 0 | 0 | 112.1 | L192 T193 K201 | L192-E197 HydrophobicContact CB-CG 3.64Å; L192-E197 HydrophobicContact CD2-CG 4.43Å; T193-E197 PolarHBondContact O-N 3.05Å; E197-K201 WeakPolarHBondContact O-CB 3.37Å; E197-K201 PolarHBondContact O-N 2.71Å |
| 198 | A | 62.4 | Low | 59.5 | Low | 59 Ų | 59 | 94.7 Ų | 94.7 | 49% | 0.488 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -68.1 | -35.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | P194 A195 E196 A202 | P194-A198 WeakPolarHBondContact O-CB 3.49Å; P194-A198 PolarHBondContact O-N 3.06Å; A195-A198 PolarHBondContact O-N 2.9Å; E196-A198 VanDerWaalsContact C-N 3.28Å; E196-A198 PolarHBondContact O-N 3.25Å; A198-A202 VanDerWaalsContact O-CB 3.31Å; A198-A202 WeakPolarHBondContact O-CB 3.22Å; A198-A202 PolarHBondContact O-N 3.11Å; A198-A202 VanDerWaalsContact O-N 3.09Å |
| 199 | S | 55.8 | Low | 61 | Low | 77 Ų | 77 | 95.9 Ų | 95.9 | 54% | 0.538 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -73.6 | -37.3 | 177.1 | 74.5 | 0 | 0 | 0 | 0 | 113.4 | A195 E196 A202 | A195-S199 PolarHBondContact O-N 3.02Å; E196-S199 WeakPolarHBondContact CA-OG 3.43Å; E196-S199 PolarHBondContact O-N 3.38Å; E196-S199 VanDerWaalsContact O-N 3.11Å; E196-S199 PolarHBondContact O-OG 3.21Å; S199-A202 PolarHBondContact O-N 2.91Å |
| 200 | V | 56 | Low | 62.9 | Low | 66 Ų | 66 | 94.3 Ų | 94.3 | 40% | 0.4 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -72.4 | -38.3 | 173.9 | 174.9 | 0 | 0 | 0 | 0 | 110.3 | L192 E196 A202 | L192-V200 HydrophobicContact CD2-CB 4.43Å; L192-V200 HydrophobicContact CD2-CG2 3.78Å; E196-V200 WeakPolarHBondContact O-CG2 3.36Å; E196-V200 PolarHBondContact O-N 3.25Å; V200-A202 PolarHBondContact O-N 3.12Å |
| 201 | K | 58.4 | Low | 64 | Low | 149 Ų | 149 | 97.6 Ų | 97.6 | 65% | 0.648 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.6 | -20.8 | 169.5 | -98.7 | 171.3 | 173.5 | 157.7 | 0 | 114.1 | E197 M203 | E197-K201 WeakPolarHBondContact O-CB 3.37Å; E197-K201 PolarHBondContact O-N 2.71Å; K201-M203 PolarHBondContact O-N 3.16Å |
| 202 | A | 60.9 | Low | 65 | Low | 73 Ų | 73 | 99.1 Ų | 99.1 | 60% | 0.603 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.1 | 16.4 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | A198 S199 V200 | A198-A202 VanDerWaalsContact O-CB 3.31Å; A198-A202 WeakPolarHBondContact O-CB 3.22Å; A198-A202 PolarHBondContact O-N 3.11Å; A198-A202 VanDerWaalsContact O-N 3.09Å; S199-A202 PolarHBondContact O-N 2.91Å; V200-A202 PolarHBondContact O-N 3.12Å |
| 203 | M | 54.8 | Low | 66.8 | Low | 144 Ų | 144 | 97.6 Ų | 97.6 | 71% | 0.709 | 53% | 0.525 | S | S | * | . | trans | 95.7 | 99.6 | 158.1 | -51.8 | -83.6 | -89.7 | 0 | 0 | 116.2 | K201 A208 | K201-M203 PolarHBondContact O-N 3.16Å; M203-A208 HydrophobicContact CE-CB 3.92Å; M203-A208 HydrophobicContact SD-CB 4.25Å | ||
| 204 | S | 63.8 | Low | 68 | Low | 44 Ų | 44 | 99.1 Ų | 99.1 | 31% | 0.308 | 53% | 0.527 | S | S | . | . | trans | -82.5 | 140.8 | 146.2 | 76.5 | 0 | 0 | 0 | 0 | 109.4 | E206 E207 A208 | S204-E206 PolarHBondContact O-N 2.88Å; S204-E206 VanDerWaalsContact O-N 3.12Å; S204-E207 PolarHBondContact O-N 3.28Å; S204-E207 VanDerWaalsContact OG-CB 3.32Å; S204-E207 WeakPolarHBondContact OG-CB 3.36Å; S204-E207 VanDerWaalsContact OG-CG 3.24Å; S204-E207 WeakPolarHBondContact OG-CG 3.16Å; S204-E207 PolarHBondContact OG-N 3.21Å; S204-E207 VanDerWaalsContact OG-N 3.13Å; S204-E207 PolarHBondContact OG-OE1 2.88Å; S204-A208 PolarHBondContact O-N 3.47Å; S204-A208 VanDerWaalsContact O-N 3.16Å | ||
| 205 | L | 65.9 | Low | 69.1 | Low | 143 Ų | 143 | 98.6 Ų | 98.6 | 75% | 0.749 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -58 | -26.6 | 177.3 | -69.7 | 174.1 | 0 | 0 | 0 | 112.1 | K209 | L205-K209 WeakPolarHBondContact O-CB 3.49Å; L205-K209 WeakPolarHBondContact O-CD 3.47Å; L205-K209 WeakPolarHBondContact O-CG 3.32Å; L205-K209 PolarHBondContact O-N 3.28Å |
| 206 | E | 76.1 | Confident | 70.2 | Confident | 145 Ų | 145 | 100.3 Ų | 100.3 | 68% | 0.678 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -76.3 | -44.8 | -178.7 | -62.3 | -174.9 | 170.6 | 0 | 0 | 111.5 | S204 A208 K209 I210 | S204-E206 PolarHBondContact O-N 2.88Å; S204-E206 VanDerWaalsContact O-N 3.12Å; E206-A208 PolarHBondContact O-N 3.44Å; E206-K209 WeakPolarHBondContact O-CB 3.45Å; E206-K209 PolarHBondContact O-N 3.19Å; E206-I210 VanDerWaalsContact O-CG1 3.27Å; E206-I210 WeakPolarHBondContact O-CG1 3.48Å; E206-I210 PolarHBondContact O-N 3.29Å |
| 207 | E | 77.4 | Confident | 71.8 | Confident | 87 Ų | 87 | 102.8 Ų | 102.8 | 41% | 0.407 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.3 | -37.5 | 175.6 | -75.4 | 171.9 | -142.3 | 0 | 0 | 112.5 | S204 K209 I210 R211 | S204-E207 PolarHBondContact O-N 3.28Å; S204-E207 VanDerWaalsContact OG-CB 3.32Å; S204-E207 WeakPolarHBondContact OG-CB 3.36Å; S204-E207 VanDerWaalsContact OG-CG 3.24Å; S204-E207 WeakPolarHBondContact OG-CG 3.16Å; S204-E207 PolarHBondContact OG-N 3.21Å; S204-E207 VanDerWaalsContact OG-N 3.13Å; S204-E207 PolarHBondContact OG-OE1 2.88Å; E207-K209 VanDerWaalsContact C-N 3.3Å; E207-K209 PolarHBondContact O-N 2.83Å; E207-I210 PolarHBondContact O-N 3.23Å; E207-R211 WeakPolarHBondContact O-CB 3.38Å; E207-R211 PolarHBondContact O-N 3.38Å |
| 208 | A | 74.9 | Confident | 73 | Confident | 34 Ų | 34 | 101 Ų | 101 | 28% | 0.281 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63 | -37.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | M203 S204 E206 R212 | M203-A208 HydrophobicContact CE-CB 3.92Å; M203-A208 HydrophobicContact SD-CB 4.25Å; S204-A208 PolarHBondContact O-N 3.47Å; S204-A208 VanDerWaalsContact O-N 3.16Å; E206-A208 PolarHBondContact O-N 3.44Å; A208-R212 VanDerWaalsContact O-CB 3.24Å; A208-R212 WeakPolarHBondContact O-CB 3.31Å; A208-R212 PolarHBondContact O-N 3.48Å |
| 209 | K | 79.6 | Confident | 74.1 | Confident | 144 Ų | 144 | 106.7 Ų | 106.7 | 63% | 0.626 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -67.8 | -42.2 | 173.7 | -75.1 | 168.5 | -174 | 177 | 0 | 111.7 | L205 E206 E207 R212 A213 | L205-K209 WeakPolarHBondContact O-CB 3.49Å; L205-K209 WeakPolarHBondContact O-CD 3.47Å; L205-K209 WeakPolarHBondContact O-CG 3.32Å; L205-K209 PolarHBondContact O-N 3.28Å; E206-K209 WeakPolarHBondContact O-CB 3.45Å; E206-K209 PolarHBondContact O-N 3.19Å; E207-K209 VanDerWaalsContact C-N 3.3Å; E207-K209 PolarHBondContact O-N 2.83Å; K209-R212 PolarHBondContact O-N 3.06Å; K209-A213 WeakPolarHBondContact O-CB 3.34Å; K209-A213 PolarHBondContact O-N 2.8Å |
| 210 | I | 84.9 | Confident | 75.7 | Confident | 94 Ų | 94 | 104.9 Ų | 104.9 | 48% | 0.482 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.7 | -51.5 | 177.7 | -68.5 | 163.3 | 0 | 0 | 0 | 110.3 | E206 E207 R212 A213 E214 | E206-I210 VanDerWaalsContact O-CG1 3.27Å; E206-I210 WeakPolarHBondContact O-CG1 3.48Å; E206-I210 PolarHBondContact O-N 3.29Å; E207-I210 PolarHBondContact O-N 3.23Å; I210-R212 VanDerWaalsContact C-N 3.28Å; I210-R212 PolarHBondContact O-N 2.75Å; I210-A213 CarbonylContact O-C 3.59Å; I210-A213 WeakPolarHBondContact O-CB 3.36Å; I210-A213 PolarHBondContact O-N 2.69Å; I210-E214 HydrophobicContact CG2-CG 4.31Å; I210-E214 WeakPolarHBondContact CG2-OE1 3.46Å; I210-E214 WeakPolarHBondContact O-CB 3.25Å; I210-E214 VanDerWaalsContact O-CG 3.32Å; I210-E214 WeakPolarHBondContact O-CG 3.3Å; I210-E214 PolarHBondContact O-N 3.09Å |
| 211 | R | 78.2 | Confident | 77.4 | Confident | 156 Ų | 156 | 107.4 Ų | 107.4 | 59% | 0.589 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -55.8 | -41.7 | 174.9 | -84.1 | -86.5 | 179.1 | 85.7 | 1.1 | 112.2 | E207 E214 L215 | E207-R211 WeakPolarHBondContact O-CB 3.38Å; E207-R211 PolarHBondContact O-N 3.38Å; R211-E214 PolarHBondContact O-N 3.02Å; R211-L215 WeakPolarHBondContact O-CB 2.85Å; R211-L215 VanDerWaalsContact O-CG 3.27Å; R211-L215 WeakPolarHBondContact O-CG 3.46Å; R211-L215 PolarHBondContact O-N 2.88Å |
| 212 | R | 75.8 | Confident | 78.9 | Confident | 174 Ų | 174 | 106.2 Ų | 106.2 | 66% | 0.657 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65.4 | -43 | 176.2 | -176.7 | 175.1 | 178.8 | 150.4 | -1.4 | 111.6 | A208 K209 I210 L215 Q216 | A208-R212 VanDerWaalsContact O-CB 3.24Å; A208-R212 WeakPolarHBondContact O-CB 3.31Å; A208-R212 PolarHBondContact O-N 3.48Å; K209-R212 PolarHBondContact O-N 3.06Å; I210-R212 VanDerWaalsContact C-N 3.28Å; I210-R212 PolarHBondContact O-N 2.75Å; R212-L215 PolarHBondContact O-N 3.44Å; R212-Q216 WeakPolarHBondContact O-CB 3.24Å; R212-Q216 VanDerWaalsContact O-CG 3.25Å; R212-Q216 WeakPolarHBondContact O-CG 3.38Å; R212-Q216 PolarHBondContact O-N 3.44Å |
| 213 | A | 84.2 | Confident | 80.2 | Confident | 36 Ų | 36 | 105.8 Ų | 105.8 | 30% | 0.298 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.6 | -40.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | K209 I210 Q216 K217 | K209-A213 WeakPolarHBondContact O-CB 3.34Å; K209-A213 PolarHBondContact O-N 2.8Å; I210-A213 CarbonylContact O-C 3.59Å; I210-A213 WeakPolarHBondContact O-CB 3.36Å; I210-A213 PolarHBondContact O-N 2.69Å; A213-Q216 PolarHBondContact O-N 2.9Å; A213-K217 WeakPolarHBondContact O-CB 3.27Å; A213-K217 VanDerWaalsContact O-CG 3.26Å; A213-K217 WeakPolarHBondContact O-CG 3.34Å; A213-K217 PolarHBondContact O-N 3.39Å |
| 214 | E | 85.3 | Confident | 82 | Confident | 103 Ų | 103 | 106.8 Ų | 106.8 | 48% | 0.481 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.1 | -46.6 | 174 | -72.9 | 172.2 | 175 | 0 | 0 | 111.6 | I210 R211 Q216 K217 A218 | I210-E214 HydrophobicContact CG2-CG 4.31Å; I210-E214 WeakPolarHBondContact CG2-OE1 3.46Å; I210-E214 WeakPolarHBondContact O-CB 3.25Å; I210-E214 VanDerWaalsContact O-CG 3.32Å; I210-E214 WeakPolarHBondContact O-CG 3.3Å; I210-E214 PolarHBondContact O-N 3.09Å; R211-E214 PolarHBondContact O-N 3.02Å; E214-Q216 VanDerWaalsContact C-N 3.33Å; E214-Q216 PolarHBondContact O-N 2.82Å; E214-K217 PolarHBondContact O-N 2.9Å; E214-A218 WeakPolarHBondContact O-CB 3.47Å; E214-A218 PolarHBondContact O-N 2.89Å |
| 215 | L | 84.7 | Confident | 83.5 | Confident | 99 Ų | 99 | 112.8 Ų | 112.8 | 52% | 0.518 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.9 | -38.8 | 175.6 | -76.8 | 171.7 | 0 | 0 | 0 | 112.1 | R211 R212 A218 R219 | R211-L215 WeakPolarHBondContact O-CB 2.85Å; R211-L215 VanDerWaalsContact O-CG 3.27Å; R211-L215 WeakPolarHBondContact O-CG 3.46Å; R211-L215 PolarHBondContact O-N 2.88Å; R212-L215 PolarHBondContact O-N 3.44Å; L215-A218 PolarHBondContact O-N 2.93Å; L215-R219 WeakPolarHBondContact O-CB 3.43Å; L215-R219 VanDerWaalsContact O-CG 3.3Å; L215-R219 WeakPolarHBondContact O-CG 3.26Å; L215-R219 PolarHBondContact O-N 3.46Å |
| 216 | Q | 79.7 | Confident | 84.7 | Confident | 111 Ų | 111 | 110.2 Ų | 110.2 | 52% | 0.519 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.1 | -45.1 | 174.3 | -77.6 | 176.4 | -18.4 | 0 | 0 | 111.5 | R212 A213 E214 R219 A220 | R212-Q216 WeakPolarHBondContact O-CB 3.24Å; R212-Q216 VanDerWaalsContact O-CG 3.25Å; R212-Q216 WeakPolarHBondContact O-CG 3.38Å; R212-Q216 PolarHBondContact O-N 3.44Å; A213-Q216 PolarHBondContact O-N 2.9Å; E214-Q216 VanDerWaalsContact C-N 3.33Å; E214-Q216 PolarHBondContact O-N 2.82Å; Q216-R219 PolarHBondContact O-N 3.29Å; Q216-A220 WeakPolarHBondContact O-CB 3.4Å; Q216-A220 PolarHBondContact O-N 3.26Å |
| 217 | K | 89 | Confident | 85.5 | Confident | 143 Ų | 143 | 105.8 Ų | 105.8 | 62% | 0.622 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.5 | -45.4 | 174.6 | -73.7 | 172.1 | -178 | 178.5 | 0 | 111.4 | A213 E214 A220 L221 | A213-K217 WeakPolarHBondContact O-CB 3.27Å; A213-K217 VanDerWaalsContact O-CG 3.26Å; A213-K217 WeakPolarHBondContact O-CG 3.34Å; A213-K217 PolarHBondContact O-N 3.39Å; E214-K217 PolarHBondContact O-N 2.9Å; K217-A220 PolarHBondContact O-N 2.95Å; K217-L221 WeakPolarHBondContact O-CB 3.42Å; K217-L221 VanDerWaalsContact O-CG 3.31Å; K217-L221 WeakPolarHBondContact O-CG 3.31Å; K217-L221 PolarHBondContact O-N 3.2Å |
| 218 | A | 85.5 | Confident | 86.2 | Confident | 41 Ų | 41 | 107.8 Ų | 107.8 | 34% | 0.339 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.3 | -44.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112 | E214 L215 A220 L221 Q222 | E214-A218 WeakPolarHBondContact O-CB 3.47Å; E214-A218 PolarHBondContact O-N 2.89Å; L215-A218 PolarHBondContact O-N 2.93Å; A218-A220 PolarHBondContact O-N 3.48Å; A218-L221 PolarHBondContact O-N 3.14Å; A218-Q222 WeakPolarHBondContact O-CB 3.24Å; A218-Q222 WeakPolarHBondContact O-CG 3.15Å; A218-Q222 PolarHBondContact O-N 3.36Å |
| 219 | R | 85.5 | Confident | 87.1 | Confident | 178 Ų | 178 | 107.7 Ų | 107.7 | 67% | 0.672 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.8 | -42.3 | 174.9 | -75.2 | 177.8 | -174.9 | -179.3 | 2.6 | 112.1 | L215 Q216 Q222 S223 | L215-R219 WeakPolarHBondContact O-CB 3.43Å; L215-R219 VanDerWaalsContact O-CG 3.3Å; L215-R219 WeakPolarHBondContact O-CG 3.26Å; L215-R219 PolarHBondContact O-N 3.46Å; Q216-R219 PolarHBondContact O-N 3.29Å; R219-Q222 PolarHBondContact O-N 3.27Å; R219-S223 WeakPolarHBondContact O-CB 3.36Å; R219-S223 PolarHBondContact O-N 3.49Å |
| 220 | A | 89.3 | Confident | 87.6 | Confident | 39 Ų | 39 | 107.2 Ų | 107.2 | 32% | 0.322 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.1 | -44.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q216 K217 A218 Q222 S223 Y224 | Q216-A220 WeakPolarHBondContact O-CB 3.4Å; Q216-A220 PolarHBondContact O-N 3.26Å; K217-A220 PolarHBondContact O-N 2.95Å; A218-A220 PolarHBondContact O-N 3.48Å; A220-Q222 PolarHBondContact O-N 3.34Å; A220-S223 WeakPolarHBondContact O-CB 3.37Å; A220-S223 PolarHBondContact O-N 3.48Å; A220-Y224 HydrophobicContact CB-CE2 4.38Å; A220-Y224 VanDerWaalsContact O-CD2 3.24Å; A220-Y224 WeakPolarHBondContact O-CD2 3.33Å; A220-Y224 PolarHBondContact O-N 3.39Å |
| 221 | L | 92.4 | Very high | 87.6 | Confident | 119 Ų | 119 | 111.5 Ų | 111.5 | 62% | 0.623 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.9 | -43.8 | 176.6 | -73.2 | 174.1 | 0 | 0 | 0 | 112.4 | K217 A218 S223 Y224 Y225 | K217-L221 WeakPolarHBondContact O-CB 3.42Å; K217-L221 VanDerWaalsContact O-CG 3.31Å; K217-L221 WeakPolarHBondContact O-CG 3.31Å; K217-L221 PolarHBondContact O-N 3.2Å; A218-L221 PolarHBondContact O-N 3.14Å; L221-S223 VanDerWaalsContact C-N 3.35Å; L221-Y224 PolarHBondContact O-N 3.41Å; L221-Y225 WeakPolarHBondContact O-CB 3.32Å; L221-Y225 PolarHBondContact O-N 3.47Å |
| 222 | Q | 88.9 | Confident | 87.8 | Confident | 123 Ų | 123 | 108 Ų | 108 | 58% | 0.575 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.2 | -46 | 174.1 | -74.6 | 174.8 | -12.9 | 0 | 0 | 111 | A218 R219 A220 Y224 Y225 E226 | A218-Q222 WeakPolarHBondContact O-CB 3.24Å; A218-Q222 WeakPolarHBondContact O-CG 3.15Å; A218-Q222 PolarHBondContact O-N 3.36Å; R219-Q222 PolarHBondContact O-N 3.27Å; A220-Q222 PolarHBondContact O-N 3.34Å; Q222-Y224 PolarHBondContact O-N 3.41Å; Q222-Y225 PolarHBondContact O-N 2.93Å; Q222-E226 WeakPolarHBondContact O-CG 3.47Å; Q222-E226 PolarHBondContact O-N 3.24Å |
| 223 | S | 88.6 | Confident | 88.4 | Confident | 65 Ų | 65 | 108.3 Ų | 108.3 | 46% | 0.455 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.6 | -44.3 | 176.9 | -176 | 0 | 0 | 0 | 0 | 112.5 | R219 A220 L221 Y225 E226 A227 | R219-S223 WeakPolarHBondContact O-CB 3.36Å; R219-S223 PolarHBondContact O-N 3.49Å; A220-S223 WeakPolarHBondContact O-CB 3.37Å; A220-S223 PolarHBondContact O-N 3.48Å; L221-S223 VanDerWaalsContact C-N 3.35Å; S223-Y225 PolarHBondContact O-N 3.44Å; S223-E226 PolarHBondContact O-N 3.37Å; S223-A227 WeakPolarHBondContact O-CB 3.45Å; S223-A227 PolarHBondContact O-N 2.93Å |
| 224 | Y | 92.2 | Very high | 88.5 | Confident | 165 Ų | 165 | 111.8 Ų | 111.8 | 65% | 0.647 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.8 | -41.3 | 175.7 | -67.2 | -39.9 | 0 | 0 | 0 | 112.5 | A220 L221 Q222 A227 K228 | A220-Y224 HydrophobicContact CB-CE2 4.38Å; A220-Y224 VanDerWaalsContact O-CD2 3.24Å; A220-Y224 WeakPolarHBondContact O-CD2 3.33Å; A220-Y224 PolarHBondContact O-N 3.39Å; L221-Y224 PolarHBondContact O-N 3.41Å; Q222-Y224 PolarHBondContact O-N 3.41Å; Y224-A227 PolarHBondContact O-N 2.85Å; Y224-K228 WeakPolarHBondContact O-CB 3.45Å; Y224-K228 PolarHBondContact O-N 3.21Å |
| 225 | Y | 94.6 | Very high | 88.3 | Confident | 170 Ų | 170 | 111.2 Ų | 111.2 | 67% | 0.667 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.4 | -45 | 176.4 | -174.6 | -98.8 | 0 | 0 | 0 | 111.3 | L221 Q222 S223 A227 K228 A229 | L221-Y225 WeakPolarHBondContact O-CB 3.32Å; L221-Y225 PolarHBondContact O-N 3.47Å; Q222-Y225 PolarHBondContact O-N 2.93Å; S223-Y225 PolarHBondContact O-N 3.44Å; Y225-A227 PolarHBondContact O-N 3.5Å; Y225-K228 PolarHBondContact O-N 2.94Å; Y225-A229 WeakPolarHBondContact O-CB 3.35Å; Y225-A229 PolarHBondContact O-N 3.5Å |
| 226 | E | 92.1 | Very high | 88.1 | Confident | 89 Ų | 89 | 113.5 Ų | 113.5 | 42% | 0.416 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.6 | -44.2 | 174.9 | -72.8 | -177.6 | -162.4 | 0 | 0 | 112.2 | Q222 S223 K228 A229 R230 | Q222-E226 WeakPolarHBondContact O-CG 3.47Å; Q222-E226 PolarHBondContact O-N 3.24Å; S223-E226 PolarHBondContact O-N 3.37Å; E226-K228 VanDerWaalsContact C-N 3.35Å; E226-K228 PolarHBondContact O-N 2.89Å; E226-A229 PolarHBondContact O-N 3.33Å; E226-R230 WeakPolarHBondContact O-CB 3.33Å; E226-R230 VanDerWaalsContact O-CG 3.31Å; E226-R230 WeakPolarHBondContact O-CG 3.47Å; E226-R230 PolarHBondContact O-N 3.35Å; E226-R230 IonicContact OE2-CZ 3.8Å; E226-R230 IonicContact OE2-NH1 2.69Å; E226-R230 PolarHBondContact OE2-NH1 3.19Å; E226-R230 IonicContact OE2-NH2 3.69Å; E226-R230 PolarHBondContact OE2-NH2 3.49Å |
| 227 | A | 92.3 | Very high | 88.1 | Confident | 51 Ų | 51 | 110.6 Ų | 110.6 | 42% | 0.421 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62 | -43.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | S223 Y224 Y225 R230 R231 | S223-A227 WeakPolarHBondContact O-CB 3.45Å; S223-A227 PolarHBondContact O-N 2.93Å; Y224-A227 PolarHBondContact O-N 2.85Å; Y225-A227 PolarHBondContact O-N 3.5Å; A227-R230 PolarHBondContact O-N 3.38Å; A227-R231 WeakPolarHBondContact O-CB 3.48Å; A227-R231 PolarHBondContact O-N 2.87Å |
| 228 | K | 93.4 | Very high | 87.8 | Confident | 129 Ų | 129 | 110.1 Ų | 110.1 | 56% | 0.561 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.8 | -46.5 | 174.1 | -171.9 | -177.5 | -178.3 | -173.2 | 0 | 111.1 | Y224 Y225 E226 R230 R231 E232 | Y224-K228 WeakPolarHBondContact O-CB 3.45Å; Y224-K228 PolarHBondContact O-N 3.21Å; Y225-K228 PolarHBondContact O-N 2.94Å; E226-K228 VanDerWaalsContact C-N 3.35Å; E226-K228 PolarHBondContact O-N 2.89Å; K228-R230 PolarHBondContact O-N 2.85Å; K228-R231 WeakPolarHBondContact O-CB 3.38Å; K228-R231 PolarHBondContact O-N 2.83Å; K228-E232 WeakPolarHBondContact CE-OE1 3.38Å; K228-E232 WeakPolarHBondContact O-CB 3.31Å; K228-E232 WeakPolarHBondContact O-CG 3.41Å; K228-E232 PolarHBondContact O-N 3.31Å |
| 229 | A | 92.3 | Very high | 87.8 | Confident | 32 Ų | 32 | 115.4 Ų | 115.4 | 26% | 0.264 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.8 | -41.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y225 E226 E232 R233 | Y225-A229 WeakPolarHBondContact O-CB 3.35Å; Y225-A229 PolarHBondContact O-N 3.5Å; E226-A229 PolarHBondContact O-N 3.33Å; A229-E232 PolarHBondContact O-N 3.12Å; A229-R233 VanDerWaalsContact O-CB 3.31Å; A229-R233 WeakPolarHBondContact O-CB 3.38Å; A229-R233 PolarHBondContact O-N 2.72Å |
| 230 | R | 90.1 | Very high | 87.8 | Confident | 135 Ų | 135 | 113.6 Ų | 113.6 | 51% | 0.509 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.6 | -44.8 | 172.6 | -74 | -176.5 | -170.4 | 101.6 | 8.5 | 110.5 | E226 A227 K228 R233 K234 | E226-R230 WeakPolarHBondContact O-CB 3.33Å; E226-R230 VanDerWaalsContact O-CG 3.31Å; E226-R230 WeakPolarHBondContact O-CG 3.47Å; E226-R230 PolarHBondContact O-N 3.35Å; E226-R230 IonicContact OE2-CZ 3.8Å; E226-R230 IonicContact OE2-NH1 2.69Å; E226-R230 PolarHBondContact OE2-NH1 3.19Å; E226-R230 IonicContact OE2-NH2 3.69Å; E226-R230 PolarHBondContact OE2-NH2 3.49Å; A227-R230 PolarHBondContact O-N 3.38Å; K228-R230 PolarHBondContact O-N 2.85Å; R230-R233 PolarHBondContact O-N 2.8Å; R230-K234 WeakPolarHBondContact O-CB 3.49Å; R230-K234 WeakPolarHBondContact O-CG 3.31Å; R230-K234 PolarHBondContact O-N 3.17Å |
| 231 | R | 85.2 | Confident | 87.4 | Confident | 183 Ų | 183 | 116.1 Ų | 116.1 | 69% | 0.691 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62.9 | -47.6 | 176.8 | -174.2 | 179.1 | -175.1 | 160.8 | 1.9 | 111.8 | A227 K228 R233 K234 I235 | A227-R231 WeakPolarHBondContact O-CB 3.48Å; A227-R231 PolarHBondContact O-N 2.87Å; K228-R231 WeakPolarHBondContact O-CB 3.38Å; K228-R231 PolarHBondContact O-N 2.83Å; R231-R233 VanDerWaalsContact C-N 3.35Å; R231-R233 PolarHBondContact O-N 3.37Å; R231-K234 CarbonylContact O-C 3.58Å; R231-K234 PolarHBondContact O-N 3.23Å; R231-I235 HydrophobicContact CG-CD1 3.9Å; R231-I235 HydrophobicContact CG-CG1 4.44Å; R231-I235 VanDerWaalsContact O-CG1 3.28Å; R231-I235 WeakPolarHBondContact O-CG1 3.34Å; R231-I235 PolarHBondContact O-N 3.49Å |
| 232 | E | 82.6 | Confident | 87.1 | Confident | 82 Ų | 82 | 117.1 Ų | 117.1 | 38% | 0.383 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.3 | -40.7 | 177.6 | -74.4 | 178.6 | -168.3 | 0 | 0 | 112 | K228 A229 I235 K236 | K228-E232 WeakPolarHBondContact CE-OE1 3.38Å; K228-E232 WeakPolarHBondContact O-CB 3.31Å; K228-E232 WeakPolarHBondContact O-CG 3.41Å; K228-E232 PolarHBondContact O-N 3.31Å; A229-E232 PolarHBondContact O-N 3.12Å; E232-I235 PolarHBondContact O-N 3.5Å; E232-K236 WeakPolarHBondContact O-CB 3.45Å; E232-K236 WeakPolarHBondContact O-CG 3.37Å; E232-K236 PolarHBondContact O-N 3.48Å |
| 233 | R | 89.1 | Confident | 86.9 | Confident | 181 Ų | 181 | 115.6 Ų | 115.6 | 68% | 0.683 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.3 | -45.3 | 173.4 | -169.1 | -175 | -62.3 | 157.6 | 0.4 | 111.1 | A229 R230 R231 K236 S237 | A229-R233 VanDerWaalsContact O-CB 3.31Å; A229-R233 WeakPolarHBondContact O-CB 3.38Å; A229-R233 PolarHBondContact O-N 2.72Å; R230-R233 PolarHBondContact O-N 2.8Å; R231-R233 VanDerWaalsContact C-N 3.35Å; R231-R233 PolarHBondContact O-N 3.37Å; R233-K236 PolarHBondContact O-N 3.4Å; R233-S237 WeakPolarHBondContact O-CB 3.28Å; R233-S237 PolarHBondContact O-N 3.13Å; R233-S237 PolarHBondContact O-OG 2.74Å |
| 234 | K | 86.9 | Confident | 86.8 | Confident | 109 Ų | 109 | 115.1 Ų | 115.1 | 47% | 0.474 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.3 | -40.1 | 174.2 | -74.4 | -178.4 | 179.7 | -174 | 0 | 112 | R230 R231 S237 K238 | R230-K234 WeakPolarHBondContact O-CB 3.49Å; R230-K234 WeakPolarHBondContact O-CG 3.31Å; R230-K234 PolarHBondContact O-N 3.17Å; R231-K234 CarbonylContact O-C 3.58Å; R231-K234 PolarHBondContact O-N 3.23Å; K234-S237 WeakPolarHBondContact CA-OG 3.25Å; K234-S237 PolarHBondContact O-OG 2.94Å; K234-K238 VanDerWaalsContact O-CB 3.3Å; K234-K238 WeakPolarHBondContact O-CB 3.35Å; K234-K238 VanDerWaalsContact O-CG 3.23Å; K234-K238 WeakPolarHBondContact O-CG 3.44Å; K234-K238 PolarHBondContact O-N 3.22Å |
| 235 | I | 81.1 | Confident | 86.5 | Confident | 91 Ų | 91 | 110.8 Ų | 110.8 | 47% | 0.467 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.7 | -46.2 | 177.2 | -71.9 | 166.1 | 0 | 0 | 0 | 110.3 | R231 E232 K238 K239 | R231-I235 HydrophobicContact CG-CD1 3.9Å; R231-I235 HydrophobicContact CG-CG1 4.44Å; R231-I235 VanDerWaalsContact O-CG1 3.28Å; R231-I235 WeakPolarHBondContact O-CG1 3.34Å; R231-I235 PolarHBondContact O-N 3.49Å; E232-I235 PolarHBondContact O-N 3.5Å; I235-K238 PolarHBondContact O-N 2.9Å; I235-K239 VanDerWaalsContact O-CB 3.25Å; I235-K239 WeakPolarHBondContact O-CB 3.47Å; I235-K239 PolarHBondContact O-N 3.5Å |
| 236 | K | 79.6 | Confident | 86.2 | Confident | 147 Ų | 147 | 110.1 Ų | 110.1 | 64% | 0.639 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -66.8 | -38.7 | 179.3 | -70.4 | 174.5 | -177.3 | 175.5 | 0 | 111.6 | E232 R233 Y240 | E232-K236 WeakPolarHBondContact O-CB 3.45Å; E232-K236 WeakPolarHBondContact O-CG 3.37Å; E232-K236 PolarHBondContact O-N 3.48Å; R233-K236 PolarHBondContact O-N 3.4Å; K236-Y240 WeakPolarHBondContact O-CB 3.23Å; K236-Y240 PolarHBondContact O-N 3.44Å |
| 237 | S | 79.4 | Confident | 85.9 | Confident | 50 Ų | 50 | 107.8 Ų | 107.8 | 35% | 0.35 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -68.5 | -44 | 174.9 | 67.5 | 0 | 0 | 0 | 0 | 112.4 | R233 K234 Y240 H241 | R233-S237 WeakPolarHBondContact O-CB 3.28Å; R233-S237 PolarHBondContact O-N 3.13Å; R233-S237 PolarHBondContact O-OG 2.74Å; K234-S237 WeakPolarHBondContact CA-OG 3.25Å; K234-S237 PolarHBondContact O-OG 2.94Å; S237-Y240 PolarHBondContact O-N 2.81Å; S237-H241 PolarHBondContact O-CD2 3.43Å; S237-H241 PolarHBondContact O-N 2.89Å |
| 238 | K | 82.2 | Confident | 85.7 | Confident | 134 Ų | 134 | 110.9 Ų | 110.9 | 58% | 0.583 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.3 | -46.7 | 175.4 | -74.6 | -177.7 | 179 | -165.7 | 0 | 112 | K234 I235 H241 K242 | K234-K238 VanDerWaalsContact O-CB 3.3Å; K234-K238 WeakPolarHBondContact O-CB 3.35Å; K234-K238 VanDerWaalsContact O-CG 3.23Å; K234-K238 WeakPolarHBondContact O-CG 3.44Å; K234-K238 PolarHBondContact O-N 3.22Å; I235-K238 PolarHBondContact O-N 2.9Å; K238-H241 PolarHBondContact O-N 2.88Å; K238-K242 WeakPolarHBondContact O-CB 3.48Å; K238-K242 PolarHBondContact O-N 3.28Å |
| 239 | K | 86.4 | Confident | 85.2 | Confident | 151 Ų | 151 | 112.1 Ų | 112.1 | 66% | 0.657 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.1 | -42.1 | 177.3 | -173.9 | 171.3 | -179.2 | 175.6 | 0 | 111.1 | I235 K242 V243 | I235-K239 VanDerWaalsContact O-CB 3.25Å; I235-K239 WeakPolarHBondContact O-CB 3.47Å; I235-K239 PolarHBondContact O-N 3.5Å; K239-K242 PolarHBondContact O-N 3.4Å; K239-V243 VanDerWaalsContact O-CG2 3.31Å; K239-V243 WeakPolarHBondContact O-CG2 3.46Å; K239-V243 PolarHBondContact O-N 3.42Å |
| 240 | Y | 85 | Confident | 85 | Confident | 140 Ų | 140 | 117 Ų | 117 | 55% | 0.549 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -58.4 | -51.9 | 174.5 | 174.3 | -98.5 | 0 | 0 | 0 | 111.2 | K236 S237 K242 V243 Q244 | K236-Y240 WeakPolarHBondContact O-CB 3.23Å; K236-Y240 PolarHBondContact O-N 3.44Å; S237-Y240 PolarHBondContact O-N 2.81Å; Y240-K242 PolarHBondContact O-N 3.49Å; Y240-V243 PolarHBondContact O-N 3.34Å; Y240-Q244 HydrophobicContact CE1-CB 4.46Å; Y240-Q244 VanDerWaalsContact O-CB 3.25Å; Y240-Q244 WeakPolarHBondContact O-CB 3.3Å; Y240-Q244 PolarHBondContact O-N 3.44Å |
| 241 | H | 81 | Confident | 85 | Confident | 93 Ų | 93 | 116.3 Ų | 116.3 | 43% | 0.431 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.6 | -34.3 | 178.9 | -68.2 | -56.6 | 0 | 0 | 0 | 112.9 | S237 K238 Q244 N245 | S237-H241 PolarHBondContact O-CD2 3.43Å; S237-H241 PolarHBondContact O-N 2.89Å; K238-H241 PolarHBondContact O-N 2.88Å; H241-Q244 PolarHBondContact ND1-OE1 2.87Å; H241-Q244 VanDerWaalsContact ND1-OE1 3.14Å; H241-Q244 PolarHBondContact O-N 2.92Å; H241-N245 WeakPolarHBondContact O-CB 3.11Å; H241-N245 PolarHBondContact O-N 3.47Å; H241-N245 PolarHBondContact O-ND2 2.88Å |
| 242 | K | 85.6 | Confident | 85 | Confident | 140 Ų | 140 | 111.8 Ų | 111.8 | 61% | 0.609 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -60.8 | -45.9 | 172.7 | -169.7 | 170.6 | -174.4 | 167.2 | 0 | 110.6 | K238 K239 Y240 K246 E336 | K238-K242 WeakPolarHBondContact O-CB 3.48Å; K238-K242 PolarHBondContact O-N 3.28Å; K239-K242 PolarHBondContact O-N 3.4Å; Y240-K242 PolarHBondContact O-N 3.49Å; K242-K246 VanDerWaalsContact O-CB 3.3Å; K242-K246 WeakPolarHBondContact O-CB 3.25Å; K242-K246 PolarHBondContact O-N 3.48Å; K242-E336 IonicContact NZ-OE1 3.23Å; K242-E336 PolarHBondContact NZ-OE1 3.2Å |
| 243 | V | 85.7 | Confident | 85.2 | Confident | 91 Ų | 91 | 111.2 Ų | 111.2 | 55% | 0.552 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -68.5 | -44.2 | 177.5 | 173.6 | 0 | 0 | 0 | 0 | 111.5 | K239 Y240 K246 A247 | K239-V243 VanDerWaalsContact O-CG2 3.31Å; K239-V243 WeakPolarHBondContact O-CG2 3.46Å; K239-V243 PolarHBondContact O-N 3.42Å; Y240-V243 PolarHBondContact O-N 3.34Å; V243-K246 PolarHBondContact O-N 3.26Å; V243-A247 WeakPolarHBondContact O-CB 3.31Å; V243-A247 PolarHBondContact O-N 3.15Å |
| 244 | Q | 87.2 | Confident | 85.3 | Confident | 55 Ų | 55 | 107.9 Ų | 107.9 | 26% | 0.257 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.4 | -45.7 | 178.9 | -171.3 | -171.3 | 19.9 | 0 | 0 | 111.3 | Y240 H241 K246 A247 K248 | Y240-Q244 HydrophobicContact CE1-CB 4.46Å; Y240-Q244 VanDerWaalsContact O-CB 3.25Å; Y240-Q244 WeakPolarHBondContact O-CB 3.3Å; Y240-Q244 PolarHBondContact O-N 3.44Å; H241-Q244 PolarHBondContact ND1-OE1 2.87Å; H241-Q244 VanDerWaalsContact ND1-OE1 3.14Å; H241-Q244 PolarHBondContact O-N 2.92Å; Q244-K246 VanDerWaalsContact C-N 3.33Å; Q244-K246 PolarHBondContact O-N 3.04Å; Q244-A247 PolarHBondContact O-N 2.8Å; Q244-K248 WeakPolarHBondContact O-CG 3.41Å; Q244-K248 PolarHBondContact O-N 3.48Å |
| 245 | N | 84.8 | Confident | 85.3 | Confident | 73 Ų | 73 | 108.6 Ų | 108.6 | 39% | 0.39 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.9 | -34 | 177.6 | -68.6 | -11 | 0 | 0 | 0 | 111.5 | H241 R249 | H241-N245 WeakPolarHBondContact O-CB 3.11Å; H241-N245 PolarHBondContact O-N 3.47Å; H241-N245 PolarHBondContact O-ND2 2.88Å; N245-R249 WeakPolarHBondContact O-CB 3.44Å; N245-R249 WeakPolarHBondContact O-CG 3.13Å; N245-R249 PolarHBondContact O-N 3.28Å |
| 246 | K | 87.5 | Confident | 85.6 | Confident | 156 Ų | 156 | 105.5 Ų | 105.5 | 68% | 0.678 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -66.3 | -39.9 | 171.6 | -172.1 | 172.4 | -175 | 170.2 | 0 | 111.6 | K242 V243 Q244 K250 | K242-K246 VanDerWaalsContact O-CB 3.3Å; K242-K246 WeakPolarHBondContact O-CB 3.25Å; K242-K246 PolarHBondContact O-N 3.48Å; V243-K246 PolarHBondContact O-N 3.26Å; Q244-K246 VanDerWaalsContact C-N 3.33Å; Q244-K246 PolarHBondContact O-N 3.04Å; K246-K250 WeakPolarHBondContact O-CB 3.3Å; K246-K250 PolarHBondContact O-N 3.48Å |
| 247 | A | 87.4 | Confident | 85.9 | Confident | 41 Ų | 41 | 102.4 Ų | 102.4 | 34% | 0.339 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.2 | -49.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | V243 Q244 R249 K250 E251 | V243-A247 WeakPolarHBondContact O-CB 3.31Å; V243-A247 PolarHBondContact O-N 3.15Å; Q244-A247 PolarHBondContact O-N 2.8Å; A247-R249 VanDerWaalsContact C-N 3.34Å; A247-R249 PolarHBondContact O-N 2.9Å; A247-K250 CarbonylContact O-C 3.58Å; A247-K250 WeakPolarHBondContact O-CA 3.19Å; A247-K250 WeakPolarHBondContact O-CB 3.39Å; A247-K250 PolarHBondContact O-N 3.5Å; A247-E251 WeakPolarHBondContact O-CG 3.39Å; A247-E251 PolarHBondContact O-N 3.01Å |
| 248 | K | 87 | Confident | 86.5 | Confident | 115 Ų | 115 | 104.5 Ų | 104.5 | 50% | 0.5 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -56.4 | -44.5 | 175.3 | -73 | 179.7 | 175.9 | -174.7 | 0 | 112.4 | Q244 K250 E251 F252 | Q244-K248 WeakPolarHBondContact O-CG 3.41Å; Q244-K248 PolarHBondContact O-N 3.48Å; K248-K250 VanDerWaalsContact C-N 3.34Å; K248-K250 PolarHBondContact O-N 3.35Å; K248-E251 PolarHBondContact O-N 3.03Å; K248-F252 WeakPolarHBondContact O-CB 3.41Å; K248-F252 PolarHBondContact O-N 3.23Å |
| 249 | R | 83.1 | Confident | 86.6 | Confident | 155 Ų | 155 | 101.2 Ų | 101.2 | 59% | 0.585 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -60.3 | -43 | 174.1 | -82.3 | -173.5 | -98.4 | 168.7 | -15.3 | 112.1 | N245 A247 F252 L253 | N245-R249 WeakPolarHBondContact O-CB 3.44Å; N245-R249 WeakPolarHBondContact O-CG 3.13Å; N245-R249 PolarHBondContact O-N 3.28Å; A247-R249 VanDerWaalsContact C-N 3.34Å; A247-R249 PolarHBondContact O-N 2.9Å; R249-F252 PolarHBondContact O-N 3.39Å; R249-L253 WeakPolarHBondContact O-CG 3.4Å; R249-L253 PolarHBondContact O-N 2.88Å |
| 250 | K | 88.3 | Confident | 86.7 | Confident | 135 Ų | 135 | 97 Ų | 97 | 59% | 0.587 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -65.9 | -38.3 | 177.3 | -170.6 | 176.7 | -175.9 | 176.3 | 0 | 112.3 | K246 A247 K248 K254 | K246-K250 WeakPolarHBondContact O-CB 3.3Å; K246-K250 PolarHBondContact O-N 3.48Å; A247-K250 CarbonylContact O-C 3.58Å; A247-K250 WeakPolarHBondContact O-CA 3.19Å; A247-K250 WeakPolarHBondContact O-CB 3.39Å; A247-K250 PolarHBondContact O-N 3.5Å; K248-K250 VanDerWaalsContact C-N 3.34Å; K248-K250 PolarHBondContact O-N 3.35Å; K250-K254 VanDerWaalsContact O-CG 3.27Å; K250-K254 WeakPolarHBondContact O-CG 3.42Å; K250-K254 PolarHBondContact O-N 2.91Å |
| 251 | E | 89.5 | Confident | 86.9 | Confident | 121 Ų | 121 | 98.2 Ų | 98.2 | 57% | 0.565 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -65 | -44.9 | 174.1 | -72.8 | 165 | -172.1 | 0 | 0 | 111.2 | A247 K248 L253 K254 H255 | A247-E251 WeakPolarHBondContact O-CG 3.39Å; A247-E251 PolarHBondContact O-N 3.01Å; K248-E251 PolarHBondContact O-N 3.03Å; E251-L253 PolarHBondContact O-N 3.11Å; E251-K254 PolarHBondContact O-N 2.88Å; E251-H255 PolarHBondContact O-N 3.37Å |
| 252 | F | 86.1 | Confident | 87.3 | Confident | 87 Ų | 87 | 100.4 Ų | 100.4 | 38% | 0.382 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -58.5 | -47.1 | 175.3 | -174.5 | -83.7 | 0 | 0 | 0 | 111.8 | K248 R249 K254 H255 F256 M274 L325 | K248-F252 WeakPolarHBondContact O-CB 3.41Å; K248-F252 PolarHBondContact O-N 3.23Å; R249-F252 PolarHBondContact O-N 3.39Å; F252-K254 VanDerWaalsContact C-N 3.34Å; F252-K254 PolarHBondContact O-N 2.87Å; F252-H255 PolarHBondContact O-N 3.48Å; F252-F256 HydrophobicContact CE1-CB 4.49Å; F252-F256 WeakPolarHBondContact O-CB 3.43Å; F252-F256 PolarHBondContact O-N 3.27Å; F252-M274 HydrophobicContact CZ-CE 4.08Å; F252-M274 HydrophobicContact CZ-SD 3.84Å; F252-L325 HydrophobicContact CD1-CD2 3.72Å; F252-L325 HydrophobicContact CE1-CD1 3.52Å; F252-L325 HydrophobicContact CE1-CD2 3.3Å; F252-L325 HydrophobicContact CE1-CG 3.92Å; F252-L325 HydrophobicContact CZ-CD1 3.73Å; F252-L325 HydrophobicContact CZ-CD2 4.27Å; F252-L325 HydrophobicContact CZ-CG 4.46Å |
| 253 | L | 86.6 | Confident | 87.6 | Confident | 70 Ų | 70 | 98.4 Ų | 98.4 | 37% | 0.366 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.4 | -40.9 | 176.8 | -72.8 | 170.3 | 0 | 0 | 0 | 112.2 | R249 E251 F256 D257 | R249-L253 WeakPolarHBondContact O-CG 3.4Å; R249-L253 PolarHBondContact O-N 2.88Å; E251-L253 PolarHBondContact O-N 3.11Å; L253-F256 PolarHBondContact O-N 3.38Å; L253-D257 WeakPolarHBondContact O-CB 3.45Å; L253-D257 VanDerWaalsContact O-CG 3.26Å; L253-D257 PolarHBondContact O-N 3.41Å |
| 254 | K | 90.3 | Very high | 87.7 | Confident | 112 Ų | 112 | 98 Ų | 98 | 49% | 0.487 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.5 | -46 | 176.1 | -74.9 | 172.8 | 174.5 | -168.9 | 0 | 112.4 | K250 E251 F252 F256 D257 E258 | K250-K254 VanDerWaalsContact O-CG 3.27Å; K250-K254 WeakPolarHBondContact O-CG 3.42Å; K250-K254 PolarHBondContact O-N 2.91Å; E251-K254 PolarHBondContact O-N 2.88Å; F252-K254 VanDerWaalsContact C-N 3.34Å; F252-K254 PolarHBondContact O-N 2.87Å; K254-F256 VanDerWaalsContact C-N 3.28Å; K254-F256 PolarHBondContact O-N 2.86Å; K254-D257 PolarHBondContact O-N 2.74Å; K254-E258 WeakPolarHBondContact O-CB 3.48Å; K254-E258 VanDerWaalsContact O-CG 3.27Å; K254-E258 WeakPolarHBondContact O-CG 3.27Å; K254-E258 PolarHBondContact O-N 3.18Å |
| 255 | H | 87.9 | Confident | 87.8 | Confident | 123 Ų | 123 | 98.4 Ų | 98.4 | 57% | 0.569 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -62.7 | -38.5 | 175.6 | -98.4 | -6.9 | 0 | 0 | 0 | 111.7 | E251 F252 E258 M259 | E251-H255 PolarHBondContact O-N 3.37Å; F252-H255 PolarHBondContact O-N 3.48Å; H255-E258 IonicContact CE1-OE2 3.51Å; H255-E258 IonicContact ND1-OE2 2.9Å; H255-E258 PolarHBondContact ND1-OE2 3.44Å; H255-E258 PolarHBondContact O-N 3.23Å; H255-M259 WeakPolarHBondContact O-CG 3.37Å; H255-M259 PolarHBondContact O-N 2.98Å |
| 256 | F | 86.4 | Confident | 88 | Confident | 26 Ų | 26 | 98.1 Ų | 98.1 | 11% | 0.114 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -63.2 | -45.6 | 173.8 | -168.8 | -96.1 | 0 | 0 | 0 | 111.6 | F252 L253 K254 E258 M259 V260 A267 L271 | F252-F256 HydrophobicContact CE1-CB 4.49Å; F252-F256 WeakPolarHBondContact O-CB 3.43Å; F252-F256 PolarHBondContact O-N 3.27Å; L253-F256 PolarHBondContact O-N 3.38Å; K254-F256 VanDerWaalsContact C-N 3.28Å; K254-F256 PolarHBondContact O-N 2.86Å; F256-E258 VanDerWaalsContact C-N 3.31Å; F256-E258 PolarHBondContact O-N 3.44Å; F256-M259 HydrophobicContact CD2-CE 4.18Å; F256-M259 PolarHBondContact O-N 2.83Å; F256-V260 HydrophobicContact CD1-CG2 4.01Å; F256-V260 HydrophobicContact CE1-CG2 3.72Å; F256-V260 HydrophobicContact CZ-CG2 4.22Å; F256-V260 VanDerWaalsContact O-CG2 3.29Å; F256-V260 WeakPolarHBondContact O-CG2 3.38Å; F256-V260 PolarHBondContact O-N 3.04Å; F256-A267 HydrophobicContact CE2-CB 4.41Å; F256-A267 HydrophobicContact CZ-CB 4.42Å; F256-L271 HydrophobicContact CZ-CD1 4.42Å |
| 257 | D | 87.4 | Confident | 88 | Confident | 83 Ų | 83 | 90.8 Ų | 90.8 | 44% | 0.444 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -62 | -36.8 | 175.4 | -72.3 | -15.9 | 0 | 0 | 0 | 112.4 | L253 K254 K261 | L253-D257 WeakPolarHBondContact O-CB 3.45Å; L253-D257 VanDerWaalsContact O-CG 3.26Å; L253-D257 PolarHBondContact O-N 3.41Å; K254-D257 PolarHBondContact O-N 2.74Å; D257-K261 WeakPolarHBondContact O-CB 3.05Å; D257-K261 WeakPolarHBondContact O-CD 3.39Å; D257-K261 WeakPolarHBondContact O-CG 3.27Å; D257-K261 PolarHBondContact O-N 2.76Å |
| 258 | E | 90.1 | Very high | 88 | Confident | 94 Ų | 94 | 93.9 Ų | 93.9 | 44% | 0.439 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -65.7 | -45.6 | 173.9 | -73.9 | 163.3 | -175.2 | 0 | 0 | 111.2 | K254 H255 F256 V260 K261 L262 | K254-E258 WeakPolarHBondContact O-CB 3.48Å; K254-E258 VanDerWaalsContact O-CG 3.27Å; K254-E258 WeakPolarHBondContact O-CG 3.27Å; K254-E258 PolarHBondContact O-N 3.18Å; H255-E258 IonicContact CE1-OE2 3.51Å; H255-E258 IonicContact ND1-OE2 2.9Å; H255-E258 PolarHBondContact ND1-OE2 3.44Å; H255-E258 PolarHBondContact O-N 3.23Å; F256-E258 VanDerWaalsContact C-N 3.31Å; F256-E258 PolarHBondContact O-N 3.44Å; E258-V260 VanDerWaalsContact C-N 3.34Å; E258-V260 PolarHBondContact O-N 2.81Å; E258-K261 PolarHBondContact O-N 3.05Å; E258-L262 WeakPolarHBondContact O-CG 3.47Å; E258-L262 PolarHBondContact O-N 3.14Å |
| 259 | M | 85.3 | Confident | 88.2 | Confident | 64 Ų | 64 | 93.7 Ų | 93.7 | 32% | 0.315 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -61.1 | -41.4 | 174.8 | -73.4 | -172.8 | -68.5 | 0 | 0 | 111.9 | H255 F256 K261 L262 D263 A267 | H255-M259 WeakPolarHBondContact O-CG 3.37Å; H255-M259 PolarHBondContact O-N 2.98Å; F256-M259 HydrophobicContact CD2-CE 4.18Å; F256-M259 PolarHBondContact O-N 2.83Å; M259-K261 VanDerWaalsContact C-N 3.32Å; M259-K261 PolarHBondContact O-N 3.48Å; M259-L262 PolarHBondContact O-N 3.41Å; M259-D263 CarbonylContact O-C 3.28Å; M259-D263 VanDerWaalsContact O-C 3.28Å; M259-D263 PolarHBondContact O-N 3.27Å; M259-D263 VanDerWaalsContact O-O 3.05Å; M259-A267 HydrophobicContact CB-CB 4.29Å |
| 260 | V | 87.4 | Confident | 88.4 | Confident | 64 Ų | 64 | 89.7 Ų | 89.7 | 39% | 0.388 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -62.9 | -38.6 | 176.1 | 171 | 0 | 0 | 0 | 0 | 111.8 | F256 E258 A267 | F256-V260 HydrophobicContact CD1-CG2 4.01Å; F256-V260 HydrophobicContact CE1-CG2 3.72Å; F256-V260 HydrophobicContact CZ-CG2 4.22Å; F256-V260 VanDerWaalsContact O-CG2 3.29Å; F256-V260 WeakPolarHBondContact O-CG2 3.38Å; F256-V260 PolarHBondContact O-N 3.04Å; E258-V260 VanDerWaalsContact C-N 3.34Å; E258-V260 PolarHBondContact O-N 2.81Å; V260-A267 HydrophobicContact CB-CB 4.37Å; V260-A267 HydrophobicContact CG2-CB 3.54Å |
| 261 | K | 89.4 | Confident | 88.4 | Confident | 165 Ų | 165 | 85.6 Ų | 85.6 | 72% | 0.717 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -72.7 | -37 | 179.5 | -74.2 | 167 | -171 | 169.8 | 0 | 113.1 | D257 E258 M259 | D257-K261 WeakPolarHBondContact O-CB 3.05Å; D257-K261 WeakPolarHBondContact O-CD 3.39Å; D257-K261 WeakPolarHBondContact O-CG 3.27Å; D257-K261 PolarHBondContact O-N 2.76Å; E258-K261 PolarHBondContact O-N 3.05Å; M259-K261 VanDerWaalsContact C-N 3.32Å; M259-K261 PolarHBondContact O-N 3.48Å |
| 262 | L | 91 | Very high | 88.4 | Confident | 139 Ų | 139 | 84.4 Ų | 84.4 | 73% | 0.728 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -77.5 | -53.9 | 179.5 | -66.4 | 174.3 | 0 | 0 | 0 | 110.5 | E258 M259 | E258-L262 WeakPolarHBondContact O-CG 3.47Å; E258-L262 PolarHBondContact O-N 3.14Å; M259-L262 PolarHBondContact O-N 3.41Å |
| 263 | D | 90.5 | Very high | 88.6 | Confident | 97 Ų | 97 | 85.5 Ų | 85.5 | 52% | 0.519 | 44% | 0.439 | S | S | . | . | trans | -146.1 | 97.1 | -174.3 | -70.9 | -49 | 0 | 0 | 0 | 111.9 | M259 A265 V266 A267 | M259-D263 CarbonylContact O-C 3.28Å; M259-D263 VanDerWaalsContact O-C 3.28Å; M259-D263 PolarHBondContact O-N 3.27Å; M259-D263 VanDerWaalsContact O-O 3.05Å; D263-A265 PolarHBondContact O-N 2.81Å; D263-V266 HydrophobicContact CB-CB 4Å; D263-V266 HydrophobicContact CB-CG2 3.77Å; D263-V266 PolarHBondContact O-N 2.87Å; D263-A267 PolarHBondContact O-N 3.38Å | ||
| 264 | P | 88.3 | Confident | 88.7 | Confident | 84 Ų | 84 | 85 Ų | 85 | 55% | 0.545 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -64.5 | -27.1 | -176.8 | 24.7 | -34 | 0 | 0 | 0 | 113.4 | L268 | P264-L268 WeakPolarHBondContact O-CG 3.27Å; P264-L268 PolarHBondContact O-N 3.31Å |
| 265 | A | 89.9 | Confident | 88.7 | Confident | 63 Ų | 63 | 82.3 Ų | 82.3 | 52% | 0.521 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -67.5 | -42.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | D263 L268 E269 | D263-A265 PolarHBondContact O-N 2.81Å; A265-L268 PolarHBondContact O-N 3.05Å; A265-E269 WeakPolarHBondContact O-CG 3.47Å; A265-E269 PolarHBondContact O-N 2.97Å; A265-E269 VanDerWaalsContact O-N 3.09Å |
| 266 | V | 89.1 | Confident | 88.9 | Confident | 67 Ų | 67 | 81 Ų | 81 | 41% | 0.406 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -67.2 | -39.4 | 179.5 | 178.2 | 0 | 0 | 0 | 0 | 110.7 | D263 L268 E269 E270 | D263-V266 HydrophobicContact CB-CB 4Å; D263-V266 HydrophobicContact CB-CG2 3.77Å; D263-V266 PolarHBondContact O-N 2.87Å; V266-L268 VanDerWaalsContact C-N 3.34Å; V266-L268 PolarHBondContact O-N 3.22Å; V266-E269 PolarHBondContact O-N 3.48Å; V266-E270 PolarHBondContact O-N 3Å |
| 267 | A | 87.4 | Confident | 89.1 | Confident | 2 Ų | 2 | 81.1 Ų | 81.1 | 2% | 0.017 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -62.9 | -38.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | F256 M259 V260 D263 E270 L271 | F256-A267 HydrophobicContact CE2-CB 4.41Å; F256-A267 HydrophobicContact CZ-CB 4.42Å; M259-A267 HydrophobicContact CB-CB 4.29Å; V260-A267 HydrophobicContact CB-CB 4.37Å; V260-A267 HydrophobicContact CG2-CB 3.54Å; D263-A267 PolarHBondContact O-N 3.38Å; A267-E270 PolarHBondContact O-N 3.02Å; A267-L271 PolarHBondContact O-N 2.84Å; A267-L271 VanDerWaalsContact O-N 3.08Å |
| 268 | L | 87.4 | Confident | 89.3 | Confident | 106 Ų | 106 | 79.4 Ų | 79.4 | 56% | 0.555 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -67.9 | -40.2 | 175.6 | -73.3 | 174.1 | 0 | 0 | 0 | 112.3 | P264 A265 V266 E270 L271 N272 | P264-L268 WeakPolarHBondContact O-CG 3.27Å; P264-L268 PolarHBondContact O-N 3.31Å; A265-L268 PolarHBondContact O-N 3.05Å; V266-L268 VanDerWaalsContact C-N 3.34Å; V266-L268 PolarHBondContact O-N 3.22Å; L268-E270 VanDerWaalsContact C-N 3.34Å; L268-L271 PolarHBondContact O-N 2.89Å; L268-N272 WeakPolarHBondContact O-CB 3.19Å; L268-N272 PolarHBondContact O-N 3.18Å; L268-N272 PolarHBondContact O-ND2 3.06Å |
| 269 | E | 90.1 | Very high | 89.4 | Confident | 110 Ų | 110 | 79.8 Ų | 79.8 | 51% | 0.514 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.9 | -42.2 | 174.7 | -72.8 | 179.7 | -172 | 0 | 0 | 111.9 | A265 V266 N272 K273 | A265-E269 WeakPolarHBondContact O-CG 3.47Å; A265-E269 PolarHBondContact O-N 2.97Å; A265-E269 VanDerWaalsContact O-N 3.09Å; V266-E269 PolarHBondContact O-N 3.48Å; E269-N272 PolarHBondContact O-N 2.83Å; E269-K273 VanDerWaalsContact O-CG 3.3Å; E269-K273 WeakPolarHBondContact O-CG 3.4Å; E269-K273 PolarHBondContact O-N 3.21Å |
| 270 | E | 87.9 | Confident | 89.7 | Confident | 71 Ų | 71 | 82.6 Ų | 82.6 | 33% | 0.332 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -66.4 | -40.2 | 179.1 | -158.9 | 63.1 | -169.1 | 0 | 0 | 111.9 | V266 A267 L268 K273 M274 | V266-E270 PolarHBondContact O-N 3Å; A267-E270 PolarHBondContact O-N 3.02Å; L268-E270 VanDerWaalsContact C-N 3.34Å; E270-K273 PolarHBondContact O-N 3.39Å; E270-K273 WeakPolarHBondContact OE2-CD 3.41Å; E270-K273 IonicContact OE2-NZ 2.85Å; E270-K273 PolarHBondContact OE2-NZ 2.95Å; E270-M274 HydrophobicContact CG-CE 4.48Å; E270-M274 WeakPolarHBondContact O-CE 3.33Å; E270-M274 WeakPolarHBondContact O-CG 3.19Å; E270-M274 PolarHBondContact O-N 3.47Å; E270-M274 VanDerWaalsContact O-N 3.11Å |
| 271 | L | 87.3 | Confident | 89.9 | Confident | 49 Ų | 49 | 79.9 Ų | 79.9 | 26% | 0.257 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -58.4 | -48.9 | 171.3 | -162.6 | 176.5 | 0 | 0 | 0 | 110.9 | F256 A267 L268 K273 M274 E275 | F256-L271 HydrophobicContact CZ-CD1 4.42Å; A267-L271 PolarHBondContact O-N 2.84Å; A267-L271 VanDerWaalsContact O-N 3.08Å; L268-L271 PolarHBondContact O-N 2.89Å; L271-K273 VanDerWaalsContact C-N 3.34Å; L271-K273 PolarHBondContact O-N 2.83Å; L271-M274 PolarHBondContact O-N 3.02Å; L271-E275 HydrophobicContact CD2-CG 3.85Å; L271-E275 PolarHBondContact O-N 2.88Å |
| 272 | N | 89.8 | Confident | 89.8 | Confident | 96 Ų | 96 | 78.7 Ų | 78.7 | 51% | 0.513 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -62.2 | -39 | 179.7 | -72.1 | -25 | 0 | 0 | 0 | 112.4 | L268 E269 M274 E275 L276 | L268-N272 WeakPolarHBondContact O-CB 3.19Å; L268-N272 PolarHBondContact O-N 3.18Å; L268-N272 PolarHBondContact O-ND2 3.06Å; E269-N272 PolarHBondContact O-N 2.83Å; N272-M274 VanDerWaalsContact C-N 3.35Å; N272-M274 PolarHBondContact O-N 3.46Å; N272-E275 PolarHBondContact O-N 3.34Å; N272-L276 WeakPolarHBondContact O-CB 3.48Å; N272-L276 VanDerWaalsContact O-CG 3.25Å; N272-L276 WeakPolarHBondContact O-CG 3.48Å; N272-L276 PolarHBondContact O-N 3.44Å |
| 273 | K | 91.3 | Very high | 89.8 | Confident | 111 Ų | 111 | 79 Ų | 79 | 48% | 0.483 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -61.1 | -43.1 | 174.5 | -71.6 | 172.7 | -153.6 | 157.5 | 0 | 111.7 | E269 E270 L271 L276 A277 | E269-K273 VanDerWaalsContact O-CG 3.3Å; E269-K273 WeakPolarHBondContact O-CG 3.4Å; E269-K273 PolarHBondContact O-N 3.21Å; E270-K273 PolarHBondContact O-N 3.39Å; E270-K273 WeakPolarHBondContact OE2-CD 3.41Å; E270-K273 IonicContact OE2-NZ 2.85Å; E270-K273 PolarHBondContact OE2-NZ 2.95Å; L271-K273 VanDerWaalsContact C-N 3.34Å; L271-K273 PolarHBondContact O-N 2.83Å; K273-L276 PolarHBondContact O-N 2.89Å; K273-A277 WeakPolarHBondContact O-CB 3.34Å; K273-A277 PolarHBondContact O-N 2.94Å |
| 274 | M | 88.4 | Confident | 89.8 | Confident | 59 Ų | 59 | 76.8 Ų | 76.8 | 29% | 0.291 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -65.1 | -43.5 | 177.9 | -70.3 | -176.4 | -72.1 | 0 | 0 | 112.2 | F252 E270 L271 N272 A277 R278 L325 | F252-M274 HydrophobicContact CZ-CE 4.08Å; F252-M274 HydrophobicContact CZ-SD 3.84Å; E270-M274 HydrophobicContact CG-CE 4.48Å; E270-M274 WeakPolarHBondContact O-CE 3.33Å; E270-M274 WeakPolarHBondContact O-CG 3.19Å; E270-M274 PolarHBondContact O-N 3.47Å; E270-M274 VanDerWaalsContact O-N 3.11Å; L271-M274 PolarHBondContact O-N 3.02Å; N272-M274 VanDerWaalsContact C-N 3.35Å; N272-M274 PolarHBondContact O-N 3.46Å; M274-A277 PolarHBondContact O-N 3.22Å; M274-R278 WeakPolarHBondContact O-CB 3.41Å; M274-R278 PolarHBondContact O-N 3.32Å; M274-L325 HydrophobicContact CE-CD1 3.1Å; M274-L325 HydrophobicContact SD-CD1 3.44Å; M274-L325 WeakPolarHBondContact SD-CD1 3.42Å |
| 275 | E | 89.6 | Confident | 89.8 | Confident | 55 Ų | 55 | 77.7 Ų | 77.7 | 26% | 0.257 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -69.3 | -35.5 | 176.6 | -73.2 | -70.5 | 178.9 | 0 | 0 | 112.5 | L271 N272 R278 M279 | L271-E275 HydrophobicContact CD2-CG 3.85Å; L271-E275 PolarHBondContact O-N 2.88Å; N272-E275 PolarHBondContact O-N 3.34Å; E275-R278 WeakPolarHBondContact O-CB 3.46Å; E275-R278 PolarHBondContact O-N 2.87Å; E275-R278 IonicContact OE1-NH1 3.64Å; E275-R278 IonicContact OE2-NH1 3.23Å; E275-R278 PolarHBondContact OE2-NH1 3.23Å; E275-R278 VanDerWaalsContact OE2-NH1 3.09Å; E275-M279 WeakPolarHBondContact O-CB 3.33Å; E275-M279 WeakPolarHBondContact O-CG 3.25Å; E275-M279 PolarHBondContact O-N 3.41Å |
| 276 | L | 92.2 | Very high | 89.7 | Confident | 95 Ų | 95 | 81.6 Ų | 81.6 | 50% | 0.497 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -63.9 | -43.7 | 172.5 | -75.8 | 175 | 0 | 0 | 0 | 111.6 | N272 K273 R278 M279 Q280 | N272-L276 WeakPolarHBondContact O-CB 3.48Å; N272-L276 VanDerWaalsContact O-CG 3.25Å; N272-L276 WeakPolarHBondContact O-CG 3.48Å; N272-L276 PolarHBondContact O-N 3.44Å; K273-L276 PolarHBondContact O-N 2.89Å; L276-R278 VanDerWaalsContact C-N 3.29Å; L276-R278 PolarHBondContact O-N 3.26Å; L276-M279 PolarHBondContact O-N 3.39Å; L276-Q280 WeakPolarHBondContact O-CB 3.43Å; L276-Q280 VanDerWaalsContact O-CG 3.22Å; L276-Q280 WeakPolarHBondContact O-CG 3.24Å; L276-Q280 PolarHBondContact O-N 2.84Å |
| 277 | A | 91.5 | Very high | 89.7 | Confident | 30 Ų | 30 | 80.9 Ų | 80.9 | 25% | 0.248 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -61 | -40.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | K273 M274 Q280 E281 L321 | K273-A277 WeakPolarHBondContact O-CB 3.34Å; K273-A277 PolarHBondContact O-N 2.94Å; M274-A277 PolarHBondContact O-N 3.22Å; A277-Q280 PolarHBondContact O-N 3.46Å; A277-E281 WeakPolarHBondContact O-CB 3.28Å; A277-E281 PolarHBondContact O-N 3.06Å; A277-L321 HydrophobicContact CB-CD2 4.03Å |
| 278 | R | 91.6 | Very high | 89.6 | Confident | 47 Ų | 47 | 84.2 Ų | 84.2 | 18% | 0.177 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -64 | -44.7 | 174.4 | -179.2 | 166.4 | -179.1 | -119 | -1.8 | 113.3 | M274 E275 L276 E281 R282 L321 T322 | M274-R278 WeakPolarHBondContact O-CB 3.41Å; M274-R278 PolarHBondContact O-N 3.32Å; E275-R278 WeakPolarHBondContact O-CB 3.46Å; E275-R278 PolarHBondContact O-N 2.87Å; E275-R278 IonicContact OE1-NH1 3.64Å; E275-R278 IonicContact OE2-NH1 3.23Å; E275-R278 PolarHBondContact OE2-NH1 3.23Å; E275-R278 VanDerWaalsContact OE2-NH1 3.09Å; L276-R278 VanDerWaalsContact C-N 3.29Å; L276-R278 PolarHBondContact O-N 3.26Å; R278-E281 PolarHBondContact O-N 2.87Å; R278-R282 WeakPolarHBondContact O-CB 3.48Å; R278-R282 VanDerWaalsContact O-CG 3.3Å; R278-R282 WeakPolarHBondContact O-CG 3.37Å; R278-R282 PolarHBondContact O-N 3.25Å; R278-L321 WeakPolarHBondContact CA-O 3.25Å; R278-L321 WeakPolarHBondContact CB-O 3.34Å; R278-T322 PolarHBondContact NE-O 2.73Å |
| 279 | M | 91.2 | Very high | 89.5 | Confident | 101 Ų | 101 | 82.4 Ų | 82.4 | 50% | 0.498 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -62.3 | -45.3 | 174.5 | -76.5 | 177.6 | 53.4 | 0 | 0 | 111.2 | E275 L276 E281 R282 M283 | E275-M279 WeakPolarHBondContact O-CB 3.33Å; E275-M279 WeakPolarHBondContact O-CG 3.25Å; E275-M279 PolarHBondContact O-N 3.41Å; L276-M279 PolarHBondContact O-N 3.39Å; M279-E281 PolarHBondContact O-N 2.91Å; M279-R282 PolarHBondContact O-N 2.96Å; M279-M283 HydrophobicContact CB-CE 4.5Å; M279-M283 WeakPolarHBondContact O-CB 3.42Å; M279-M283 WeakPolarHBondContact O-CG 3.3Å; M279-M283 PolarHBondContact O-N 3.31Å |
| 280 | Q | 92.1 | Very high | 89.3 | Confident | 123 Ų | 123 | 81.1 Ų | 81.1 | 58% | 0.575 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -62.4 | -41.5 | 177.7 | -73.8 | 175.1 | 3.3 | 0 | 0 | 111.7 | L276 A277 S284 | L276-Q280 WeakPolarHBondContact O-CB 3.43Å; L276-Q280 VanDerWaalsContact O-CG 3.22Å; L276-Q280 WeakPolarHBondContact O-CG 3.24Å; L276-Q280 PolarHBondContact O-N 2.84Å; A277-Q280 PolarHBondContact O-N 3.46Å; Q280-S284 WeakPolarHBondContact O-CB 3.27Å; Q280-S284 PolarHBondContact O-N 3.05Å; Q280-S284 PolarHBondContact O-OG 2.75Å |
| 281 | E | 91.2 | Very high | 89.3 | Confident | 7 Ų | 7 | 79.8 Ų | 79.8 | 3% | 0.033 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -68.3 | -40.8 | 177.3 | -177.1 | 55.8 | -156.7 | 0 | 0 | 112 | A277 R278 M279 L285 H287 N318 L321 T322 | A277-E281 WeakPolarHBondContact O-CB 3.28Å; A277-E281 PolarHBondContact O-N 3.06Å; R278-E281 PolarHBondContact O-N 2.87Å; M279-E281 PolarHBondContact O-N 2.91Å; E281-L285 WeakPolarHBondContact O-CA 3.36Å; E281-L285 PolarHBondContact O-N 3.47Å; E281-H287 VanDerWaalsContact CD-ND1 3.28Å; E281-H287 WeakPolarHBondContact OE1-CA 3.39Å; E281-H287 VanDerWaalsContact OE1-CB 3.24Å; E281-H287 WeakPolarHBondContact OE1-CB 3.45Å; E281-H287 IonicContact OE1-CG 2.73Å; E281-H287 PolarHBondContact OE1-N 2.99Å; E281-H287 IonicContact OE1-ND1 3.09Å; E281-H287 PolarHBondContact OE1-ND1 3.38Å; E281-H287 IonicContact OE2-CE1 3.57Å; E281-H287 IonicContact OE2-CG 3.55Å; E281-H287 IonicContact OE2-ND1 2.88Å; E281-H287 PolarHBondContact OE2-ND1 2.88Å; E281-N318 PolarHBondContact OE1-ND2 3.46Å; E281-L321 HydrophobicContact CB-CB 3.96Å; E281-L321 HydrophobicContact CB-CD1 4.37Å; E281-L321 HydrophobicContact CG-CB 3.94Å; E281-L321 HydrophobicContact CG-CD1 4.24Å; E281-T322 HydrophobicContact CB-CG2 4.41Å; E281-T322 HydrophobicContact CG-CG2 3.8Å |
| 282 | R | 88.4 | Confident | 89.5 | Confident | 141 Ų | 141 | 86.8 Ų | 86.8 | 53% | 0.532 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -66.3 | -38.1 | 175.6 | -73.7 | -178.6 | 121.1 | 87.6 | 4 | 112.9 | R278 M279 T322 | R278-R282 WeakPolarHBondContact O-CB 3.48Å; R278-R282 VanDerWaalsContact O-CG 3.3Å; R278-R282 WeakPolarHBondContact O-CG 3.37Å; R278-R282 PolarHBondContact O-N 3.25Å; M279-R282 PolarHBondContact O-N 2.96Å; R282-T322 PolarHBondContact NH1-O 3.37Å |
| 283 | M | 91.4 | Very high | 89.5 | Confident | 146 Ų | 146 | 88.5 Ų | 88.5 | 72% | 0.719 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -73.7 | -41.1 | 176.9 | -75.9 | -164 | -75.5 | 0 | 0 | 112.4 | M279 | M279-M283 HydrophobicContact CB-CE 4.5Å; M279-M283 WeakPolarHBondContact O-CB 3.42Å; M279-M283 WeakPolarHBondContact O-CG 3.3Å; M279-M283 PolarHBondContact O-N 3.31Å |
| 284 | S | 89.4 | Confident | 89.5 | Confident | 50 Ų | 50 | 83.2 Ų | 83.2 | 35% | 0.35 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -89.7 | -19.5 | -173.3 | 70.7 | 0 | 0 | 0 | 0 | 114.3 | Q280 K286 | Q280-S284 WeakPolarHBondContact O-CB 3.27Å; Q280-S284 PolarHBondContact O-N 3.05Å; Q280-S284 PolarHBondContact O-OG 2.75Å; S284-K286 PolarHBondContact O-N 3.41Å; S284-K286 WeakPolarHBondContact OG-CD 3.11Å; S284-K286 WeakPolarHBondContact OG-CG 3.17Å |
| 285 | L | 87.8 | Confident | 89.5 | Confident | 102 Ų | 102 | 85.9 Ų | 85.9 | 53% | 0.534 | 42% | 0.416 | S | S | . | . | trans | 49.1 | 29.6 | -178.8 | -60.7 | 170.1 | 0 | 0 | 0 | 113.3 | E281 Q288 | E281-L285 WeakPolarHBondContact O-CA 3.36Å; E281-L285 PolarHBondContact O-N 3.47Å; L285-Q288 HydrophobicContact CB-CB 4.46Å; L285-Q288 HydrophobicContact CB-CG 4.11Å; L285-Q288 HydrophobicContact CD2-CG 3.93Å; L285-Q288 WeakPolarHBondContact O-CB 3.44Å; L285-Q288 PolarHBondContact O-N 3.2Å | ||
| 286 | K | 87.6 | Confident | 89.6 | Confident | 145 Ų | 145 | 86.2 Ų | 86.2 | 63% | 0.63 | 42% | 0.424 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.3 | -41.4 | -169.3 | -80.2 | 174.3 | -179.4 | -179.3 | 0 | 113.3 | S284 Q288 | S284-K286 PolarHBondContact O-N 3.41Å; S284-K286 WeakPolarHBondContact OG-CD 3.11Å; S284-K286 WeakPolarHBondContact OG-CG 3.17Å; K286-Q288 VanDerWaalsContact C-N 3.3Å |
| 287 | H | 89.8 | Confident | 89.6 | Confident | 53 Ų | 53 | 84.1 Ų | 84.1 | 25% | 0.245 | 41% | 0.411 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.9 | 12.7 | -178.6 | -53 | 93 | 0 | 0 | 0 | 112.4 | E281 Q314 N318 | E281-H287 VanDerWaalsContact CD-ND1 3.28Å; E281-H287 WeakPolarHBondContact OE1-CA 3.39Å; E281-H287 VanDerWaalsContact OE1-CB 3.24Å; E281-H287 WeakPolarHBondContact OE1-CB 3.45Å; E281-H287 IonicContact OE1-CG 2.73Å; E281-H287 PolarHBondContact OE1-N 2.99Å; E281-H287 IonicContact OE1-ND1 3.09Å; E281-H287 PolarHBondContact OE1-ND1 3.38Å; E281-H287 IonicContact OE2-CE1 3.57Å; E281-H287 IonicContact OE2-CG 3.55Å; E281-H287 IonicContact OE2-ND1 2.88Å; E281-H287 PolarHBondContact OE2-ND1 2.88Å; H287-Q314 HydrophobicContact CB-CG 4.18Å; H287-N318 HydrophobicContact CB-CB 3.79Å |
| 288 | Q | 85.2 | Confident | 89.6 | Confident | 71 Ų | 71 | 85.6 Ų | 85.6 | 33% | 0.332 | 42% | 0.417 | S | S | . | . | S | Bend | trans | -78.6 | 154.9 | 167.9 | -65.9 | -64.8 | -16 | 0 | 0 | 111.3 | L285 K286 S290 Q314 N318 | L285-Q288 HydrophobicContact CB-CB 4.46Å; L285-Q288 HydrophobicContact CB-CG 4.11Å; L285-Q288 HydrophobicContact CD2-CG 3.93Å; L285-Q288 WeakPolarHBondContact O-CB 3.44Å; L285-Q288 PolarHBondContact O-N 3.2Å; K286-Q288 VanDerWaalsContact C-N 3.3Å; Q288-S290 PolarHBondContact O-N 3.48Å; Q288-Q314 PolarHBondContact O-NE2 3.14Å; Q288-N318 PolarHBondContact NE2-ND2 3.46Å; Q288-N318 VanDerWaalsContact NE2-ND2 3.16Å; Q288-N318 PolarHBondContact NE2-OD1 3.3Å; Q288-N318 VanDerWaalsContact NE2-OD1 3.09Å |
| 289 | N | 86.8 | Confident | 89.6 | Confident | 69 Ų | 69 | 88.9 Ų | 88.9 | 37% | 0.369 | 44% | 0.437 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | 22.2 | 178.7 | -163.9 | 13 | 0 | 0 | 0 | 114 | A294 V298 M311 | N289-A294 VanDerWaalsContact OD1-CB 3.25Å; N289-A294 WeakPolarHBondContact OD1-CB 3.4Å; N289-V298 WeakPolarHBondContact ND2-CG2 3.41Å; N289-V298 WeakPolarHBondContact OD1-CG2 3.46Å; N289-M311 HydrophobicContact CB-CE 4.47Å; N289-M311 WeakPolarHBondContact OD1-CE 3.29Å |
| 290 | S | 85.6 | Confident | 89.6 | Confident | 82 Ų | 82 | 88.8 Ų | 88.8 | 57% | 0.573 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.3 | -23.4 | -177.3 | -172.7 | 0 | 0 | 0 | 0 | 113 | Q288 K295 | Q288-S290 PolarHBondContact O-N 3.48Å; S290-K295 WeakPolarHBondContact O-CE 3.41Å; S290-K295 PolarHBondContact O-NZ 3.08Å; S290-K295 VanDerWaalsContact O-NZ 3.12Å |
| 291 | S | 88 | Confident | 89.5 | Confident | 44 Ų | 44 | 83.7 Ų | 83.7 | 31% | 0.308 | 42% | 0.415 | S | S | . | . | S | Bend | trans | -68 | 151 | -175.6 | 78 | 0 | 0 | 0 | 0 | 112.5 | W293 A294 K295 | S291-W293 PolarHBondContact O-N 3.43Å; S291-A294 PolarHBondContact O-N 2.82Å; S291-A294 VanDerWaalsContact O-N 3.16Å; S291-A294 WeakPolarHBondContact OG-CB 3.33Å; S291-A294 PolarHBondContact OG-N 3.19Å; S291-A294 VanDerWaalsContact OG-N 3.16Å; S291-K295 WeakPolarHBondContact O-CG 3.3Å; S291-K295 PolarHBondContact O-N 3.34Å |
| 292 | K | 90.4 | Very high | 89.5 | Confident | 196 Ų | 196 | 90.7 Ų | 90.7 | 85% | 0.852 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -58.4 | -34.3 | 177 | -68.2 | -175.2 | -177.4 | 179.9 | 0 | 112.1 | S296 | K292-S296 WeakPolarHBondContact O-CB 3.41Å; K292-S296 PolarHBondContact O-N 3.31Å; K292-S296 VanDerWaalsContact O-N 3.07Å |
| 293 | W | 90 | Very high | 89.7 | Confident | 131 Ų | 131 | 93.7 Ų | 93.7 | 50% | 0.496 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -64.8 | -48.4 | 175 | 179.3 | 89.3 | 0 | 0 | 0 | 111.8 | S291 S296 K297 A310 Q314 | S291-W293 PolarHBondContact O-N 3.43Å; W293-S296 PolarHBondContact O-N 2.94Å; W293-K297 HydrophobicContact CD2-CG 4.22Å; W293-K297 HydrophobicContact CH2-CG 4.39Å; W293-K297 HydrophobicContact CZ2-CG 4Å; W293-K297 PolarHBondContact O-N 3.46Å; W293-A310 HydrophobicContact CH2-CB 4.07Å; W293-A310 HydrophobicContact CZ2-CB 4.32Å; W293-Q314 HydrophobicContact CZ3-CB 4.4Å; W293-Q314 HydrophobicContact CZ3-CG 4.45Å |
| 294 | A | 90.8 | Very high | 89.8 | Confident | 0 Ų | 0 | 89.3 Ų | 89.3 | 0% | 0 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -63.5 | -45.1 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | N289 S291 S296 K297 V298 M311 | N289-A294 VanDerWaalsContact OD1-CB 3.25Å; N289-A294 WeakPolarHBondContact OD1-CB 3.4Å; S291-A294 PolarHBondContact O-N 2.82Å; S291-A294 VanDerWaalsContact O-N 3.16Å; S291-A294 WeakPolarHBondContact OG-CB 3.33Å; S291-A294 PolarHBondContact OG-N 3.19Å; S291-A294 VanDerWaalsContact OG-N 3.16Å; A294-S296 VanDerWaalsContact C-N 3.33Å; A294-S296 PolarHBondContact O-N 3.39Å; A294-K297 PolarHBondContact O-N 3.46Å; A294-K297 VanDerWaalsContact O-N 3.17Å; A294-V298 VanDerWaalsContact O-CG2 3.24Å; A294-V298 WeakPolarHBondContact O-CG2 3.45Å; A294-V298 PolarHBondContact O-N 2.89Å; A294-M311 HydrophobicContact CB-CE 4.45Å; A294-M311 HydrophobicContact CB-SD 4.15Å |
| 295 | K | 89.8 | Confident | 89.9 | Confident | 115 Ų | 115 | 93 Ų | 93 | 50% | 0.5 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -57.7 | -42 | 174.7 | -70.2 | 173.7 | 178.8 | 166.3 | 0 | 113 | S290 S291 I299 | S290-K295 WeakPolarHBondContact O-CE 3.41Å; S290-K295 PolarHBondContact O-NZ 3.08Å; S290-K295 VanDerWaalsContact O-NZ 3.12Å; S291-K295 WeakPolarHBondContact O-CG 3.3Å; S291-K295 PolarHBondContact O-N 3.34Å; K295-I299 WeakPolarHBondContact O-CG1 3.35Å; K295-I299 PolarHBondContact O-N 3.09Å |
| 296 | S | 91.7 | Very high | 90.1 | Very high | 62 Ų | 62 | 95 Ų | 95 | 43% | 0.434 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -64.7 | -47.3 | 175.3 | -178.2 | 0 | 0 | 0 | 0 | 111.4 | K292 W293 A294 V298 I299 M300 | K292-S296 WeakPolarHBondContact O-CB 3.41Å; K292-S296 PolarHBondContact O-N 3.31Å; K292-S296 VanDerWaalsContact O-N 3.07Å; W293-S296 PolarHBondContact O-N 2.94Å; A294-S296 VanDerWaalsContact C-N 3.33Å; A294-S296 PolarHBondContact O-N 3.39Å; S296-V298 VanDerWaalsContact C-N 3.32Å; S296-V298 PolarHBondContact O-N 2.83Å; S296-I299 PolarHBondContact O-N 3.35Å; S296-I299 VanDerWaalsContact O-N 3.14Å; S296-M300 WeakPolarHBondContact O-CG 3.27Å; S296-M300 PolarHBondContact O-N 2.88Å |
| 297 | K | 92.5 | Very high | 90.4 | Very high | 52 Ų | 52 | 88.1 Ų | 88.1 | 23% | 0.226 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -65.7 | -30.5 | 178.7 | -75 | -66.8 | -172.1 | 179.7 | 0 | 113.3 | W293 A294 M300 A301 A307 M311 | W293-K297 HydrophobicContact CD2-CG 4.22Å; W293-K297 HydrophobicContact CH2-CG 4.39Å; W293-K297 HydrophobicContact CZ2-CG 4Å; W293-K297 PolarHBondContact O-N 3.46Å; A294-K297 PolarHBondContact O-N 3.46Å; A294-K297 VanDerWaalsContact O-N 3.17Å; K297-M300 CarbonylContact O-C 3.59Å; K297-M300 PolarHBondContact O-N 3.09Å; K297-A301 WeakPolarHBondContact O-CB 3.49Å; K297-A301 PolarHBondContact O-N 3.16Å; K297-A307 HydrophobicContact CD-CB 3.77Å; K297-M311 HydrophobicContact CB-CG 3.89Å; K297-M311 HydrophobicContact CB-SD 3.86Å |
| 298 | V | 90.8 | Very high | 90.5 | Very high | 61 Ų | 61 | 91.7 Ų | 91.7 | 37% | 0.37 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -61.5 | -43 | 171.1 | 170 | 0 | 0 | 0 | 0 | 111.7 | N289 A294 S296 M300 A301 M311 | N289-V298 WeakPolarHBondContact ND2-CG2 3.41Å; N289-V298 WeakPolarHBondContact OD1-CG2 3.46Å; A294-V298 VanDerWaalsContact O-CG2 3.24Å; A294-V298 WeakPolarHBondContact O-CG2 3.45Å; A294-V298 PolarHBondContact O-N 2.89Å; S296-V298 VanDerWaalsContact C-N 3.32Å; S296-V298 PolarHBondContact O-N 2.83Å; V298-M300 VanDerWaalsContact C-N 3.35Å; V298-A301 PolarHBondContact O-N 2.91Å; V298-M311 HydrophobicContact CG2-CE 3.6Å; V298-M311 HydrophobicContact CG2-CG 4.48Å; V298-M311 HydrophobicContact CG2-SD 3.94Å |
| 299 | I | 91.3 | Very high | 90.9 | Very high | 116 Ų | 116 | 94 Ų | 94 | 60% | 0.595 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -65.8 | -43 | 177.5 | -63.2 | 166.1 | 0 | 0 | 0 | 109.8 | K295 S296 | K295-I299 WeakPolarHBondContact O-CG1 3.35Å; K295-I299 PolarHBondContact O-N 3.09Å; S296-I299 PolarHBondContact O-N 3.35Å; S296-I299 VanDerWaalsContact O-N 3.14Å |
| 300 | M | 90.8 | Very high | 91.1 | Very high | 98 Ų | 98 | 91.7 Ų | 91.7 | 48% | 0.483 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -73 | -26.9 | 179.5 | -58.6 | -157.7 | 93.9 | 0 | 0 | 113.6 | S296 K297 V298 K302 Y303 D304 A307 | S296-M300 WeakPolarHBondContact O-CG 3.27Å; S296-M300 PolarHBondContact O-N 2.88Å; K297-M300 CarbonylContact O-C 3.59Å; K297-M300 PolarHBondContact O-N 3.09Å; V298-M300 VanDerWaalsContact C-N 3.35Å; M300-K302 PolarHBondContact O-N 2.98Å; M300-Y303 PolarHBondContact O-N 3.43Å; M300-D304 PolarHBondContact O-N 3Å; M300-A307 HydrophobicContact CB-CB 3.96Å |
| 301 | A | 91.4 | Very high | 91.3 | Very high | 16 Ų | 16 | 88.5 Ų | 88.5 | 13% | 0.132 | 41% | 0.413 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.5 | -13.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | K297 V298 Y303 A307 R308 | K297-A301 WeakPolarHBondContact O-CB 3.49Å; K297-A301 PolarHBondContact O-N 3.16Å; V298-A301 PolarHBondContact O-N 2.91Å; A301-Y303 VanDerWaalsContact C-N 3.33Å; A301-A307 HydrophobicContact CB-CB 4.38Å; A301-R308 HydrophobicContact CB-CB 4.15Å; A301-R308 PolarHBondContact O-NE 3.44Å; A301-R308 PolarHBondContact O-NH2 2.96Å |
| 302 | K | 90 | Very high | 91.5 | Very high | 154 Ų | 154 | 91.7 Ų | 91.7 | 67% | 0.67 | 42% | 0.423 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67 | -35.9 | 169.4 | -65.8 | -173.2 | 178.8 | -173.5 | 0 | 112 | M300 | M300-K302 PolarHBondContact O-N 2.98Š|
| 303 | Y | 92.1 | Very high | 91.5 | Very high | 204 Ų | 204 | 88.1 Ų | 88.1 | 80% | 0.8 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -112.4 | -24.1 | -170.6 | -53.8 | -71.2 | 0 | 0 | 0 | 113.4 | M300 A301 | M300-Y303 PolarHBondContact O-N 3.43Å; A301-Y303 VanDerWaalsContact C-N 3.33Å |
| 304 | D | 94.1 | Very high | 91.6 | Very high | 54 Ų | 54 | 82.7 Ų | 82.7 | 29% | 0.289 | 39% | 0.39 | S | S | . | . | trans | -120.4 | 127.7 | -175.3 | 179.3 | 15.5 | 0 | 0 | 0 | 111.7 | M300 E306 A307 R308 | M300-D304 PolarHBondContact O-N 3Å; D304-E306 PolarHBondContact OD1-N 3.36Å; D304-A307 HydrophobicContact CB-CB 4Å; D304-A307 PolarHBondContact OD2-N 2.65Å; D304-R308 PolarHBondContact O-N 3.46Å | ||
| 305 | E | 92 | Very high | 91.5 | Very high | 129 Ų | 129 | 86 Ų | 86 | 60% | 0.603 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -71.6 | -32.2 | 177.8 | -64.3 | -171 | 173.8 | 0 | 0 | 112.3 | R308 K309 | E305-R308 WeakPolarHBondContact O-CB 3.17Å; E305-R308 PolarHBondContact O-N 2.94Å; E305-K309 WeakPolarHBondContact O-CG 3.41Å; E305-K309 PolarHBondContact O-N 2.9Å |
| 306 | E | 92.6 | Very high | 91.5 | Very high | 143 Ų | 143 | 84.5 Ų | 84.5 | 67% | 0.668 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -68.6 | -41 | 178.6 | -62.3 | -175 | 174.3 | 0 | 0 | 110.5 | D304 R308 K309 A310 | D304-E306 PolarHBondContact OD1-N 3.36Å; E306-R308 VanDerWaalsContact C-N 3.27Å; E306-R308 PolarHBondContact O-N 2.89Å; E306-K309 PolarHBondContact O-N 3.44Å; E306-A310 WeakPolarHBondContact O-CB 3.24Å; E306-A310 PolarHBondContact O-N 3.49Å |
| 307 | A | 92.5 | Very high | 91.4 | Very high | 0 Ų | 0 | 85.5 Ų | 85.5 | 0% | 0 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -59.6 | -37.7 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | K297 M300 A301 D304 M311 | K297-A307 HydrophobicContact CD-CB 3.77Å; M300-A307 HydrophobicContact CB-CB 3.96Å; A301-A307 HydrophobicContact CB-CB 4.38Å; D304-A307 HydrophobicContact CB-CB 4Å; D304-A307 PolarHBondContact OD2-N 2.65Å; A307-M311 WeakPolarHBondContact O-CG 3.4Å; A307-M311 PolarHBondContact O-N 2.89Å; A307-M311 VanDerWaalsContact O-N 3.08Å |
| 308 | R | 91.4 | Very high | 91.4 | Very high | 128 Ų | 128 | 83.8 Ų | 83.8 | 48% | 0.483 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -68.2 | -43.3 | 176.4 | -163.3 | 179.4 | -60.5 | 142.7 | 3.5 | 112.2 | A301 D304 E305 E306 M311 Q312 | A301-R308 HydrophobicContact CB-CB 4.15Å; A301-R308 PolarHBondContact O-NE 3.44Å; A301-R308 PolarHBondContact O-NH2 2.96Å; D304-R308 PolarHBondContact O-N 3.46Å; E305-R308 WeakPolarHBondContact O-CB 3.17Å; E305-R308 PolarHBondContact O-N 2.94Å; E306-R308 VanDerWaalsContact C-N 3.27Å; E306-R308 PolarHBondContact O-N 2.89Å; R308-M311 PolarHBondContact O-N 3.46Å; R308-Q312 PolarHBondContact O-N 3.22Å |
| 309 | K | 93.5 | Very high | 91.2 | Very high | 120 Ų | 120 | 87 Ų | 87 | 52% | 0.522 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.9 | -44 | 175.4 | -71.1 | 171.2 | -173.3 | 166.7 | 0 | 111.6 | E305 E306 M311 Q312 Q313 | E305-K309 WeakPolarHBondContact O-CG 3.41Å; E305-K309 PolarHBondContact O-N 2.9Å; E306-K309 PolarHBondContact O-N 3.44Å; K309-M311 VanDerWaalsContact C-N 3.35Å; K309-M311 PolarHBondContact O-N 3.21Å; K309-Q312 PolarHBondContact O-N 2.86Å; K309-Q313 WeakPolarHBondContact O-CG 3.24Å; K309-Q313 PolarHBondContact O-N 3.09Å |
| 310 | A | 92.5 | Very high | 91.1 | Very high | 21 Ų | 21 | 87.4 Ų | 87.4 | 17% | 0.174 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -63.2 | -39.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | W293 E306 Q313 Q314 | W293-A310 HydrophobicContact CH2-CB 4.07Å; W293-A310 HydrophobicContact CZ2-CB 4.32Å; E306-A310 WeakPolarHBondContact O-CB 3.24Å; E306-A310 PolarHBondContact O-N 3.49Å; A310-Q313 PolarHBondContact O-N 3.08Å; A310-Q314 PolarHBondContact O-N 2.91Å |
| 311 | M | 89.9 | Confident | 91 | Very high | 15 Ų | 15 | 84.9 Ų | 84.9 | 7% | 0.074 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -64 | -42.6 | 172.8 | -80.3 | -59.3 | -52.2 | 0 | 0 | 112.2 | N289 A294 K297 V298 A307 R308 K309 Q314 L315 | N289-M311 HydrophobicContact CB-CE 4.47Å; N289-M311 WeakPolarHBondContact OD1-CE 3.29Å; A294-M311 HydrophobicContact CB-CE 4.45Å; A294-M311 HydrophobicContact CB-SD 4.15Å; K297-M311 HydrophobicContact CB-CG 3.89Å; K297-M311 HydrophobicContact CB-SD 3.86Å; V298-M311 HydrophobicContact CG2-CE 3.6Å; V298-M311 HydrophobicContact CG2-CG 4.48Å; V298-M311 HydrophobicContact CG2-SD 3.94Å; A307-M311 WeakPolarHBondContact O-CG 3.4Å; A307-M311 PolarHBondContact O-N 2.89Å; A307-M311 VanDerWaalsContact O-N 3.08Å; R308-M311 PolarHBondContact O-N 3.46Å; K309-M311 VanDerWaalsContact C-N 3.35Å; K309-M311 PolarHBondContact O-N 3.21Å; M311-Q314 PolarHBondContact O-N 3.08Å; M311-L315 WeakPolarHBondContact O-CG 3.39Å; M311-L315 PolarHBondContact O-N 3.48Å; M311-L315 VanDerWaalsContact O-N 3.08Å |
| 312 | Q | 90.8 | Very high | 90.7 | Very high | 110 Ų | 110 | 85.7 Ų | 85.7 | 51% | 0.514 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -63.4 | -44.3 | 177.4 | -174.9 | 178.7 | -16.3 | 0 | 0 | 111.4 | R308 K309 Q314 L315 E316 | R308-Q312 PolarHBondContact O-N 3.22Å; K309-Q312 PolarHBondContact O-N 2.86Å; Q312-Q314 VanDerWaalsContact C-N 3.33Å; Q312-Q314 PolarHBondContact O-N 2.96Å; Q312-L315 PolarHBondContact O-N 3.39Å; Q312-E316 HydrophobicContact CG-CG 4.41Å; Q312-E316 WeakPolarHBondContact CG-OE1 3.34Å; Q312-E316 PolarHBondContact NE2-OE1 3.06Å; Q312-E316 WeakPolarHBondContact O-CB 3.36Å; Q312-E316 WeakPolarHBondContact O-CG 3.41Å; Q312-E316 PolarHBondContact O-N 3.33Å |
| 313 | Q | 92 | Very high | 90.4 | Very high | 121 Ų | 121 | 84.4 Ų | 84.4 | 57% | 0.565 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -59.7 | -42.1 | 175.5 | -73.7 | 172 | -7.9 | 0 | 0 | 111.8 | K309 A310 L315 E316 M317 | K309-Q313 WeakPolarHBondContact O-CG 3.24Å; K309-Q313 PolarHBondContact O-N 3.09Å; A310-Q313 PolarHBondContact O-N 3.08Å; Q313-L315 VanDerWaalsContact C-N 3.35Å; Q313-L315 PolarHBondContact O-N 3.37Å; Q313-E316 PolarHBondContact O-N 2.92Å; Q313-M317 WeakPolarHBondContact O-CB 3.39Å; Q313-M317 VanDerWaalsContact O-CG 3.27Å; Q313-M317 WeakPolarHBondContact O-CG 3.45Å; Q313-M317 PolarHBondContact O-N 3.03Å |
| 314 | Q | 90.9 | Very high | 89.8 | Confident | 17 Ų | 17 | 80 Ų | 80 | 8% | 0.079 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -61.7 | -43 | 176.2 | -167.5 | -170.6 | 8.8 | 0 | 0 | 111.7 | H287 Q288 W293 A310 M311 Q312 M317 N318 | H287-Q314 HydrophobicContact CB-CG 4.18Å; Q288-Q314 PolarHBondContact O-NE2 3.14Å; W293-Q314 HydrophobicContact CZ3-CB 4.4Å; W293-Q314 HydrophobicContact CZ3-CG 4.45Å; A310-Q314 PolarHBondContact O-N 2.91Å; M311-Q314 PolarHBondContact O-N 3.08Å; Q312-Q314 VanDerWaalsContact C-N 3.33Å; Q312-Q314 PolarHBondContact O-N 2.96Å; Q314-M317 PolarHBondContact O-N 2.98Å; Q314-N318 PolarHBondContact O-N 3.36Å |
| 315 | L | 89.3 | Confident | 88.6 | Confident | 71 Ų | 71 | 80 Ų | 80 | 37% | 0.372 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -69.3 | -35 | 177 | -68.1 | 174.3 | 0 | 0 | 0 | 112.5 | M311 Q312 Q313 N318 K319 | M311-L315 WeakPolarHBondContact O-CG 3.39Å; M311-L315 PolarHBondContact O-N 3.48Å; M311-L315 VanDerWaalsContact O-N 3.08Å; Q312-L315 PolarHBondContact O-N 3.39Å; Q313-L315 VanDerWaalsContact C-N 3.35Å; Q313-L315 PolarHBondContact O-N 3.37Å; L315-N318 PolarHBondContact O-N 2.84Å; L315-K319 VanDerWaalsContact O-CG 3.28Å; L315-K319 WeakPolarHBondContact O-CG 3.49Å; L315-K319 PolarHBondContact O-N 3.17Å |
| 316 | E | 90.3 | Very high | 87 | Confident | 82 Ų | 82 | 77.3 Ų | 77.3 | 38% | 0.383 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.3 | -47.7 | 172.9 | -76 | 170.3 | -177 | 0 | 0 | 110.6 | Q312 Q313 N318 K319 E320 | Q312-E316 HydrophobicContact CG-CG 4.41Å; Q312-E316 WeakPolarHBondContact CG-OE1 3.34Å; Q312-E316 PolarHBondContact NE2-OE1 3.06Å; Q312-E316 WeakPolarHBondContact O-CB 3.36Å; Q312-E316 WeakPolarHBondContact O-CG 3.41Å; Q312-E316 PolarHBondContact O-N 3.33Å; Q313-E316 PolarHBondContact O-N 2.92Å; E316-N318 VanDerWaalsContact C-N 3.3Å; E316-N318 PolarHBondContact O-N 3.34Å; E316-K319 WeakPolarHBondContact O-CB 3.37Å; E316-K319 PolarHBondContact O-N 3.27Å; E316-K319 VanDerWaalsContact O-N 3.09Å; E316-E320 WeakPolarHBondContact O-CG 3.42Å; E316-E320 PolarHBondContact O-N 3.07Å |
| 317 | M | 89.8 | Confident | 85.3 | Confident | 84 Ų | 84 | 73.7 Ų | 73.7 | 41% | 0.414 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -57.5 | -42 | 173.5 | -71.1 | -64.1 | -61.3 | 0 | 0 | 111.9 | Q313 Q314 E320 L321 | Q313-M317 WeakPolarHBondContact O-CB 3.39Å; Q313-M317 VanDerWaalsContact O-CG 3.27Å; Q313-M317 WeakPolarHBondContact O-CG 3.45Å; Q313-M317 PolarHBondContact O-N 3.03Å; Q314-M317 PolarHBondContact O-N 2.98Å; M317-E320 PolarHBondContact O-N 2.84Å; M317-L321 WeakPolarHBondContact O-CB 3.22Å; M317-L321 VanDerWaalsContact O-CG 3.24Å; M317-L321 WeakPolarHBondContact O-CG 3.45Å; M317-L321 PolarHBondContact O-N 3.31Å |
| 318 | N | 90.8 | Very high | 83.5 | Confident | 15 Ų | 15 | 79.3 Ų | 79.3 | 8% | 0.08 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -63.3 | -43.7 | 175.7 | -173.1 | -99.3 | 0 | 0 | 0 | 111.8 | E281 H287 Q288 Q314 L315 E316 T322 | E281-N318 PolarHBondContact OE1-ND2 3.46Å; H287-N318 HydrophobicContact CB-CB 3.79Å; Q288-N318 PolarHBondContact NE2-ND2 3.46Å; Q288-N318 VanDerWaalsContact NE2-ND2 3.16Å; Q288-N318 PolarHBondContact NE2-OD1 3.3Å; Q288-N318 VanDerWaalsContact NE2-OD1 3.09Å; Q314-N318 PolarHBondContact O-N 3.36Å; L315-N318 PolarHBondContact O-N 2.84Å; E316-N318 VanDerWaalsContact C-N 3.3Å; E316-N318 PolarHBondContact O-N 3.34Å; N318-T322 VanDerWaalsContact O-CB 3.3Å; N318-T322 WeakPolarHBondContact O-CB 3.38Å; N318-T322 VanDerWaalsContact O-CG2 3.27Å; N318-T322 WeakPolarHBondContact O-CG2 3.47Å; N318-T322 PolarHBondContact O-N 3.16Å; N318-T322 PolarHBondContact O-OG1 3.16Å |
| 319 | K | 88.1 | Confident | 81.5 | Confident | 128 Ų | 128 | 81.4 Ų | 81.4 | 56% | 0.557 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -63.4 | -43.7 | 176.8 | -72.9 | 174 | -174.9 | -177.7 | 0 | 111.4 | L315 E316 T322 Q323 | L315-K319 VanDerWaalsContact O-CG 3.28Å; L315-K319 WeakPolarHBondContact O-CG 3.49Å; L315-K319 PolarHBondContact O-N 3.17Å; E316-K319 WeakPolarHBondContact O-CB 3.37Å; E316-K319 PolarHBondContact O-N 3.27Å; E316-K319 VanDerWaalsContact O-N 3.09Å; K319-T322 PolarHBondContact O-N 2.99Å; K319-Q323 VanDerWaalsContact O-CB 3.27Å; K319-Q323 WeakPolarHBondContact O-CB 3.49Å; K319-Q323 WeakPolarHBondContact O-CG 3.4Å; K319-Q323 PolarHBondContact O-N 3.12Å; K319-Q323 PolarHBondContact O-NE2 2.84Å |
| 320 | E | 87.9 | Confident | 79.6 | Confident | 125 Ų | 125 | 80.1 Ų | 80.1 | 58% | 0.584 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -63 | -44.9 | 179 | -72.7 | 175.9 | -178.2 | 0 | 0 | 111.6 | E316 M317 | E316-E320 WeakPolarHBondContact O-CG 3.42Å; E316-E320 PolarHBondContact O-N 3.07Å; M317-E320 PolarHBondContact O-N 2.84Å |
| 321 | L | 89 | Confident | 77.3 | Confident | 46 Ų | 46 | 84.8 Ų | 84.8 | 24% | 0.241 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -72.9 | -28.8 | 179.5 | -66.5 | 171.5 | 0 | 0 | 0 | 113.1 | A277 R278 E281 M317 | A277-L321 HydrophobicContact CB-CD2 4.03Å; R278-L321 WeakPolarHBondContact CA-O 3.25Å; R278-L321 WeakPolarHBondContact CB-O 3.34Å; E281-L321 HydrophobicContact CB-CB 3.96Å; E281-L321 HydrophobicContact CB-CD1 4.37Å; E281-L321 HydrophobicContact CG-CB 3.94Å; E281-L321 HydrophobicContact CG-CD1 4.24Å; M317-L321 WeakPolarHBondContact O-CB 3.22Å; M317-L321 VanDerWaalsContact O-CG 3.24Å; M317-L321 WeakPolarHBondContact O-CG 3.45Å; M317-L321 PolarHBondContact O-N 3.31Å |
| 322 | T | 85.1 | Confident | 74.8 | Confident | 32 Ų | 32 | 91.1 Ų | 91.1 | 20% | 0.196 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -96.4 | -12.5 | -176.2 | 60 | 0 | 0 | 0 | 0 | 114.8 | R278 E281 R282 N318 K319 K324 | R278-T322 PolarHBondContact NE-O 2.73Å; E281-T322 HydrophobicContact CB-CG2 4.41Å; E281-T322 HydrophobicContact CG-CG2 3.8Å; R282-T322 PolarHBondContact NH1-O 3.37Å; N318-T322 VanDerWaalsContact O-CB 3.3Å; N318-T322 WeakPolarHBondContact O-CB 3.38Å; N318-T322 VanDerWaalsContact O-CG2 3.27Å; N318-T322 WeakPolarHBondContact O-CG2 3.47Å; N318-T322 PolarHBondContact O-N 3.16Å; N318-T322 PolarHBondContact O-OG1 3.16Å; K319-T322 PolarHBondContact O-N 2.99Å; T322-K324 PolarHBondContact O-N 3.03Å |
| 323 | Q | 84.1 | Confident | 72.6 | Confident | 128 Ų | 128 | 93 Ų | 93 | 60% | 0.598 | 48% | 0.477 | S | S | * | . | P | Polyproline II helix | trans | -61.3 | 126.1 | 175.5 | -91.3 | 166.6 | 58.9 | 0 | 0 | 110.6 | K319 | K319-Q323 VanDerWaalsContact O-CB 3.27Å; K319-Q323 WeakPolarHBondContact O-CB 3.49Å; K319-Q323 WeakPolarHBondContact O-CG 3.4Å; K319-Q323 PolarHBondContact O-N 3.12Å; K319-Q323 PolarHBondContact O-NE2 2.84Å |
| 324 | K | 79.1 | Confident | 70.4 | Confident | 112 Ų | 112 | 94.1 Ų | 94.1 | 49% | 0.487 | 49% | 0.487 | S | S | . | . | P | Polyproline II helix | trans | -81.6 | 135.7 | 169.8 | -165.7 | 178.5 | 178.1 | -171.1 | 0 | 108.2 | T322 I326 | T322-K324 PolarHBondContact O-N 3.03Å; K324-I326 PolarHBondContact O-N 2.85Å |
| 325 | L | 68.5 | Low | 68.3 | Low | 52 Ų | 52 | 100.2 Ų | 100.2 | 27% | 0.272 | 52% | 0.52 | S | S | . | . | P | Polyproline II helix | trans | -68.6 | 117.2 | 168.8 | -104 | 158 | 0 | 0 | 0 | 110.2 | F252 M274 T327 | F252-L325 HydrophobicContact CD1-CD2 3.72Å; F252-L325 HydrophobicContact CE1-CD1 3.52Å; F252-L325 HydrophobicContact CE1-CD2 3.3Å; F252-L325 HydrophobicContact CE1-CG 3.92Å; F252-L325 HydrophobicContact CZ-CD1 3.73Å; F252-L325 HydrophobicContact CZ-CD2 4.27Å; F252-L325 HydrophobicContact CZ-CG 4.46Å; M274-L325 HydrophobicContact CE-CD1 3.1Å; M274-L325 HydrophobicContact SD-CD1 3.44Å; M274-L325 WeakPolarHBondContact SD-CD1 3.42Å; L325-T327 PolarHBondContact O-N 3.37Å |
| 326 | I | 59.9 | Low | 66.4 | Low | 74 Ų | 74 | 105.2 Ų | 105.2 | 38% | 0.379 | 54% | 0.541 | S | S | . | . | trans | -77.2 | 99.3 | 171.3 | -56.5 | 167.9 | 0 | 0 | 0 | 106.6 | K324 | K324-I326 PolarHBondContact O-N 2.85Š| ||
| 327 | T | 56.9 | Low | 64.2 | Low | 67 Ų | 67 | 104.3 Ų | 104.3 | 41% | 0.411 | 55% | 0.554 | S | S | . | * | trans | -77.2 | 154.5 | 165.2 | 3.2 | 0 | 0 | 0 | 0 | 108.5 | L325 L329 N330 | L325-T327 PolarHBondContact O-N 3.37Å; T327-L329 PolarHBondContact O-N 2.95Å; T327-N330 PolarHBondContact O-N 2.88Å | ||
| 328 | P | 54.5 | Low | 62.3 | Low | 117 Ų | 117 | 107.8 Ų | 107.8 | 76% | 0.76 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.8 | -5.4 | -172.7 | 28.8 | -34.7 | 0 | 0 | 0 | 114 | ||
| 329 | L | 49.5 | Very low | 60.3 | Low | 172 Ų | 172 | 114.8 Ų | 114.8 | 90% | 0.901 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -11.1 | 173.7 | -162 | 69.7 | 0 | 0 | 0 | 113.2 | T327 | T327-L329 PolarHBondContact O-N 2.95Š|
| 330 | N | 51.9 | Low | 58.2 | Low | 94 Ų | 94 | 116.2 Ų | 116.2 | 50% | 0.503 | 62% | 0.623 | S | S | . | * | S | Bend | trans | -118.5 | 23 | -175.1 | -159.3 | 65.1 | 0 | 0 | 0 | 112.6 | T327 N332 | T327-N330 PolarHBondContact O-N 2.88Å; N330-N332 VanDerWaalsContact C-N 3.3Å; N330-N332 PolarHBondContact O-N 3.49Å |
| 331 | D | 44.2 | Very low | 56 | Low | 119 Ų | 119 | 114 Ų | 114 | 64% | 0.636 | 62% | 0.62 | S | S | * | * | trans | -80.6 | 73.2 | -179.1 | -154.7 | 30.6 | 0 | 0 | 0 | 110.1 | ||||
| 332 | N | 39 | Very low | 54.1 | Low | 147 Ų | 147 | 119 Ų | 119 | 79% | 0.786 | 65% | 0.647 | S | S | * | * | trans | -104.3 | 117.2 | 158.5 | -111.9 | -2.7 | 0 | 0 | 0 | 106.8 | N330 D334 | N330-N332 VanDerWaalsContact C-N 3.3Å; N330-N332 PolarHBondContact O-N 3.49Å; N332-D334 VanDerWaalsContact C-N 3.29Å; N332-D334 PolarHBondContact O-N 3.44Å | ||
| 333 | D | 44.6 | Very low | 51.9 | Low | 151 Ų | 151 | 123.9 Ų | 123.9 | 81% | 0.807 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -58.6 | 66.5 | -174.4 | -82.8 | -55.2 | 0 | 0 | 0 | 114.7 | ||
| 334 | D | 44.3 | Very low | 49.9 | Very low | 144 Ų | 144 | 124.4 Ų | 124.4 | 77% | 0.77 | 68% | 0.677 | S | S | * | * | trans | -138.6 | 44.7 | -176.4 | -89.3 | -39.8 | 0 | 0 | 0 | 114.9 | N332 | N332-D334 VanDerWaalsContact C-N 3.29Å; N332-D334 PolarHBondContact O-N 3.44Å | ||
| 335 | D | 48.3 | Very low | 48.3 | Very low | 145 Ų | 145 | 126.1 Ų | 126.1 | 78% | 0.775 | 69% | 0.692 | S | S | * | * | trans | -117.2 | 40.8 | 167.9 | -93.5 | -39.2 | 0 | 0 | 0 | 112.3 | G337 | D335-G337 VanDerWaalsContact C-N 3.3Š| ||
| 336 | E | 48.3 | Very low | 47.3 | Very low | 176 Ų | 176 | 129 Ų | 129 | 82% | 0.822 | 71% | 0.707 | S | S | * | * | trans | -93.1 | 24.7 | 164.2 | -77.1 | -107.6 | 146.6 | 0 | 0 | 111.7 | K242 | K242-E336 IonicContact NZ-OE1 3.23Å; K242-E336 PolarHBondContact NZ-OE1 3.2Å | ||
| 337 | G | 44.1 | Very low | 46.5 | Very low | 63 Ų | 63 | 129.9 Ų | 129.9 | 65% | 0.649 | 73% | 0.726 | S | S | * | * | trans | -104.1 | -28.3 | -167.8 | 0 | 0 | 0 | 0 | 0 | 118.8 | D335 | D335-G337 VanDerWaalsContact C-N 3.3Š| ||
| 338 | D | 49.7 | Very low | 45.9 | Very low | 156 Ų | 156 | 132.4 Ų | 132.4 | 83% | 0.834 | 74% | 0.741 | S | S | * | * | trans | -117.9 | 43.9 | -159 | -117.4 | 16 | 0 | 0 | 0 | 115.3 | ||||
| 339 | L | 49.5 | Very low | 45.8 | Very low | 163 Ų | 163 | 133.7 Ų | 133.7 | 85% | 0.853 | 74% | 0.742 | S | S | * | * | trans | -98.4 | 75 | 162.8 | -74.4 | 165.4 | 0 | 0 | 0 | 108.9 | P341 | L339-P341 WeakPolarHBondContact O-CD 3.44Š| ||
| 340 | L | 44.7 | Very low | 45.7 | Very low | 157 Ų | 157 | 128.3 Ų | 128.3 | 82% | 0.822 | 73% | 0.727 | S | S | * | * | trans | -49.3 | 113.9 | 158.8 | -89.3 | 164 | 0 | 0 | 0 | 107.3 | D342 | L340-D342 PolarHBondContact O-N 3.43Š| ||
| 341 | P | 41.3 | Very low | 45.5 | Very low | 78 Ų | 78 | 134.8 Ų | 134.8 | 51% | 0.506 | 75% | 0.745 | S | S | . | * | trans | -65.3 | 123.7 | -176.5 | -15.5 | 28.3 | 0 | 0 | 0 | 108 | L339 F343 | L339-P341 WeakPolarHBondContact O-CD 3.44Å; P341-F343 HydrophobicContact CB-CB 4.3Å; P341-F343 HydrophobicContact CB-CD2 3.25Å; P341-F343 HydrophobicContact CB-CE2 3.87Å; P341-F343 HydrophobicContact CB-CG 4.17Å; P341-F343 PolarHBondContact O-N 3.31Å | ||
| 342 | D | 48 | Very low | 45.6 | Very low | 153 Ų | 153 | 134.1 Ų | 134.1 | 82% | 0.818 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.4 | 24.6 | 170.4 | -167.8 | 32.3 | 0 | 0 | 0 | 113.1 | L340 | L340-D342 PolarHBondContact O-N 3.43Š|
| 343 | F | 40.2 | Very low | 46.5 | Very low | 133 Ų | 133 | 131.7 Ų | 131.7 | 58% | 0.583 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.8 | -6.3 | -179.7 | -68.6 | -103.5 | 0 | 0 | 0 | 112.1 | P341 N345 | P341-F343 HydrophobicContact CB-CB 4.3Å; P341-F343 HydrophobicContact CB-CD2 3.25Å; P341-F343 HydrophobicContact CB-CE2 3.87Å; P341-F343 HydrophobicContact CB-CG 4.17Å; P341-F343 PolarHBondContact O-N 3.31Å; F343-N345 PolarHBondContact O-N 2.97Å; F343-N345 VanDerWaalsContact O-N 3.11Å |
| 344 | V | 41.9 | Very low | 47.5 | Very low | 139 Ų | 139 | 129.5 Ų | 129.5 | 84% | 0.842 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.7 | -2.2 | -178.4 | -154.2 | 0 | 0 | 0 | 0 | 112.4 | ||
| 345 | N | 46.1 | Very low | 48.2 | Very low | 148 Ų | 148 | 125.9 Ų | 125.9 | 79% | 0.791 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.6 | 1.9 | -179.4 | -141.5 | 22.9 | 0 | 0 | 0 | 115.3 | F343 | F343-N345 PolarHBondContact O-N 2.97Å; F343-N345 VanDerWaalsContact O-N 3.11Å |
| 346 | D | 46.1 | Very low | 49.1 | Very low | 113 Ų | 113 | 123.1 Ų | 123.1 | 60% | 0.604 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -95.8 | 103.8 | 164.1 | -105.7 | -16.1 | 0 | 0 | 0 | 106.6 | V348 | D346-V348 PolarHBondContact O-N 3.41Š|
| 347 | A | 44.2 | Very low | 49.6 | Very low | 93 Ų | 93 | 125.9 Ų | 125.9 | 77% | 0.769 | 71% | 0.711 | S | S | * | * | trans | -59 | 102.7 | 170 | 0 | 0 | 0 | 0 | 0 | 108.1 | D349 | A347-D349 PolarHBondContact O-N 3.39Š| ||
| 348 | V | 44.5 | Very low | 50 | Low | 120 Ų | 120 | 128.6 Ų | 128.6 | 73% | 0.727 | 71% | 0.709 | S | S | * | * | trans | -68.6 | 103.8 | 170.9 | -177.6 | 0 | 0 | 0 | 0 | 106.1 | D346 G350 | D346-V348 PolarHBondContact O-N 3.41Å; V348-G350 PolarHBondContact O-N 2.94Å | ||
| 349 | D | 51.9 | Low | 50.2 | Low | 144 Ų | 144 | 127.4 Ų | 127.4 | 77% | 0.77 | 70% | 0.696 | S | S | * | * | trans | -55.6 | 108.5 | 167.8 | -77.7 | -37.9 | 0 | 0 | 0 | 107.9 | A347 R351 | A347-D349 PolarHBondContact O-N 3.39Å; D349-R351 PolarHBondContact O-N 3.45Å | ||
| 350 | G | 46.6 | Very low | 50 | Low | 58 Ų | 58 | 123.4 Ų | 123.4 | 60% | 0.598 | 69% | 0.694 | S | S | * | * | trans | -67.5 | 62.9 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | V348 | V348-G350 PolarHBondContact O-N 2.94Š| ||
| 351 | R | 49 | Very low | 50.1 | Low | 231 Ų | 231 | 125 Ų | 125 | 87% | 0.872 | 69% | 0.694 | S | S | * | * | trans | -119.2 | 36.1 | 174.8 | -73.8 | -175.7 | 177.2 | 175.3 | 1.2 | 111.9 | D349 A353 | D349-R351 PolarHBondContact O-N 3.45Å; R351-A353 PolarHBondContact O-N 3.49Å | ||
| 352 | D | 45.3 | Very low | 50.1 | Low | 105 Ų | 105 | 129.1 Ų | 129.1 | 56% | 0.561 | 71% | 0.712 | S | S | * | * | trans | -75.4 | 108.3 | 161 | -164.2 | -13.3 | 0 | 0 | 0 | 108.4 | S354 | D352-S354 PolarHBondContact O-N 3.11Å; D352-S354 PolarHBondContact OD1-N 3.17Å; D352-S354 VanDerWaalsContact OD1-N 3.14Å | ||
| 353 | A | 57.6 | Low | 49.7 | Very low | 95 Ų | 95 | 126.2 Ų | 126.2 | 79% | 0.785 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.7 | -11.7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | R351 | R351-A353 PolarHBondContact O-N 3.49Š|
| 354 | S | 66.8 | Low | 49.9 | Very low | 106 Ų | 106 | 123.7 Ų | 123.7 | 74% | 0.741 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.1 | -5.3 | -171.8 | -163.4 | 0 | 0 | 0 | 0 | 115.2 | D352 | D352-S354 PolarHBondContact O-N 3.11Å; D352-S354 PolarHBondContact OD1-N 3.17Å; D352-S354 VanDerWaalsContact OD1-N 3.14Å |
| 355 | N | 57.8 | Low | 49.9 | Very low | 67 Ų | 67 | 125 Ų | 125 | 36% | 0.358 | 70% | 0.7 | S | S | . | * | trans | -125.3 | 102.8 | -178.4 | -166.5 | -5.2 | 0 | 0 | 0 | 112.5 | W357 M358 | N355-W357 VanDerWaalsContact C-N 3.32Å; N355-W357 PolarHBondContact O-N 3.36Å; N355-W357 PolarHBondContact OD1-N 3.45Å; N355-M358 HydrophobicContact CB-CG 4.28Å; N355-M358 PolarHBondContact O-N 2.85Å | ||
| 356 | P | 67.3 | Low | 49.7 | Very low | 88 Ų | 88 | 123.7 Ų | 123.7 | 57% | 0.571 | 69% | 0.693 | S | S | * | * | G | 310 helix | trans | -70.1 | -22.6 | -176.8 | 26.6 | -32 | 0 | 0 | 0 | 113.9 | M358 K359 | P356-M358 VanDerWaalsContact C-N 3.33Å; P356-M358 PolarHBondContact O-N 3.02Å; P356-K359 PolarHBondContact O-N 3.33Å |
| 357 | W | 58.2 | Low | 49.5 | Very low | 233 Ų | 233 | 121.5 Ų | 121.5 | 88% | 0.883 | 69% | 0.686 | S | S | * | * | G | 310 helix | trans | -77.7 | -14.5 | 180 | -83.1 | -80.3 | 0 | 0 | 0 | 114.6 | N355 K359 | N355-W357 VanDerWaalsContact C-N 3.32Å; N355-W357 PolarHBondContact O-N 3.36Å; N355-W357 PolarHBondContact OD1-N 3.45Å; W357-K359 VanDerWaalsContact C-N 3.29Å |
| 358 | M | 52.8 | Low | 49.4 | Very low | 121 Ų | 121 | 122.4 Ų | 122.4 | 60% | 0.596 | 68% | 0.678 | S | S | * | * | G | 310 helix | trans | -81.7 | -8.8 | 174.4 | -75.4 | -92.1 | -61.2 | 0 | 0 | 112.9 | N355 P356 G360 | N355-M358 HydrophobicContact CB-CG 4.28Å; N355-M358 PolarHBondContact O-N 2.85Å; P356-M358 VanDerWaalsContact C-N 3.33Å; P356-M358 PolarHBondContact O-N 3.02Å; M358-G360 VanDerWaalsContact C-N 3.34Å; M358-G360 PolarHBondContact O-N 2.87Å; M358-G360 VanDerWaalsContact O-N 3.17Å |
| 359 | K | 54.9 | Low | 49.5 | Very low | 130 Ų | 130 | 120.5 Ų | 120.5 | 57% | 0.565 | 67% | 0.667 | S | S | * | * | trans | -87.7 | 79.3 | 175.2 | -60.3 | -174.8 | -173.8 | 177 | 0 | 108.1 | P356 W357 K361 | P356-K359 PolarHBondContact O-N 3.33Å; W357-K359 VanDerWaalsContact C-N 3.29Å; K359-K361 PolarHBondContact O-N 2.86Å | ||
| 360 | G | 45.5 | Very low | 49.1 | Very low | 79 Ų | 79 | 118.2 Ų | 118.2 | 81% | 0.814 | 66% | 0.658 | S | S | * | * | trans | -61.5 | 83.4 | 167.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | M358 | M358-G360 VanDerWaalsContact C-N 3.34Å; M358-G360 PolarHBondContact O-N 2.87Å; M358-G360 VanDerWaalsContact O-N 3.17Å | ||
| 361 | K | 46.1 | Very low | 49.2 | Very low | 190 Ų | 190 | 119.8 Ų | 119.8 | 83% | 0.826 | 66% | 0.656 | S | S | * | * | trans | -92.5 | 95.4 | 160.4 | -63.8 | -158.2 | -179.9 | -168.8 | 0 | 106.2 | K359 T363 | K359-K361 PolarHBondContact O-N 2.86Å; K361-T363 PolarHBondContact O-N 3.31Å; K361-T363 VanDerWaalsContact O-N 3.13Å | ||
| 362 | L | 41.8 | Very low | 49.1 | Very low | 166 Ų | 166 | 115.8 Ų | 115.8 | 87% | 0.869 | 65% | 0.647 | S | S | * | * | trans | -62.7 | 109.7 | 158.2 | -81.9 | 161 | 0 | 0 | 0 | 106.4 | A364 | L362-A364 PolarHBondContact O-N 2.83Š| ||
| 363 | T | 39.1 | Very low | 49.2 | Very low | 92 Ų | 92 | 113.5 Ų | 113.5 | 56% | 0.564 | 64% | 0.643 | S | S | * | * | trans | 16.4 | 97.9 | 157.3 | 48.9 | 0 | 0 | 0 | 0 | 115.8 | K361 E365 | K361-T363 PolarHBondContact O-N 3.31Å; K361-T363 VanDerWaalsContact O-N 3.13Å; T363-E365 PolarHBondContact O-N 2.88Å | ||
| 364 | A | 44.7 | Very low | 48.6 | Very low | 80 Ų | 80 | 111.9 Ų | 111.9 | 66% | 0.661 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.2 | 19.4 | 163.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | L362 S367 | L362-A364 PolarHBondContact O-N 2.83Å; A364-S367 PolarHBondContact O-OG 3.43Å |
| 365 | E | 40.9 | Very low | 47.6 | Very low | 166 Ų | 166 | 113.2 Ų | 113.2 | 78% | 0.776 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94 | 3.3 | 177.1 | -68.3 | -170.7 | 166.9 | 0 | 0 | 113 | T363 | T363-E365 PolarHBondContact O-N 2.88Š|
| 366 | L | 43.2 | Very low | 47.2 | Very low | 121 Ų | 121 | 112.7 Ų | 112.7 | 63% | 0.634 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -104.6 | -3.3 | 177.1 | -80.7 | 165 | 0 | 0 | 0 | 113.9 | T369 V370 | L366-T369 PolarHBondContact O-OG1 3.02Å; L366-V370 WeakPolarHBondContact O-CG2 3.36Å |
| 367 | S | 42.1 | Very low | 46.4 | Very low | 67 Ų | 67 | 112.6 Ų | 112.6 | 47% | 0.469 | 63% | 0.626 | S | S | . | * | S | Bend | trans | -87.3 | -25.2 | 176.6 | 52.7 | 0 | 0 | 0 | 0 | 113.4 | A364 | A364-S367 PolarHBondContact O-OG 3.43Š|
| 368 | D | 42.1 | Very low | 45.7 | Very low | 112 Ų | 112 | 105.6 Ų | 105.6 | 60% | 0.599 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -82.8 | -22.9 | -175.1 | -64.6 | -0.5 | 0 | 0 | 0 | 111.4 | T371 | D368-T371 PolarHBondContact O-OG1 2.9Å; D368-T371 VanDerWaalsContact O-OG1 3.12Å |
| 369 | T | 45.1 | Very low | 45.4 | Very low | 79 Ų | 79 | 106.8 Ų | 106.8 | 49% | 0.485 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -80.5 | -19 | 174.7 | 55.8 | 0 | 0 | 0 | 0 | 113.6 | L366 A373 | L366-T369 PolarHBondContact O-OG1 3.02Å; T369-A373 WeakPolarHBondContact O-CB 3.18Å; T369-A373 PolarHBondContact O-N 2.97Å |
| 370 | V | 45 | Very low | 45.1 | Very low | 96 Ų | 96 | 107.5 Ų | 107.5 | 58% | 0.582 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -85 | -28 | 178.3 | 179.6 | 0 | 0 | 0 | 0 | 111.2 | L366 A374 | L366-V370 WeakPolarHBondContact O-CG2 3.36Å; V370-A374 WeakPolarHBondContact O-CB 3.3Å; V370-A374 PolarHBondContact O-N 3.4Å; V370-A374 VanDerWaalsContact O-N 3.15Å |
| 371 | T | 47.2 | Very low | 45.2 | Very low | 92 Ų | 92 | 109.9 Ų | 109.9 | 56% | 0.564 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -76.3 | -34.1 | 174.7 | 47.8 | 0 | 0 | 0 | 0 | 112.7 | D368 Q375 | D368-T371 PolarHBondContact O-OG1 2.9Å; D368-T371 VanDerWaalsContact O-OG1 3.12Å; T371-Q375 PolarHBondContact O-N 3.43Å |
| 372 | E | 47.2 | Very low | 45.3 | Very low | 147 Ų | 147 | 108.1 Ų | 108.1 | 69% | 0.687 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -70.7 | -38.3 | 173.9 | -113.5 | 173.8 | 175.8 | 0 | 0 | 112.1 | A374 Q375 A376 | E372-A374 PolarHBondContact O-N 3.28Å; E372-Q375 PolarHBondContact O-N 3.09Å; E372-A376 PolarHBondContact O-N 3.32Å |
| 373 | A | 48.3 | Very low | 45.5 | Very low | 57 Ų | 57 | 107.3 Ų | 107.3 | 47% | 0.471 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -70 | -29.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | T369 V377 | T369-A373 WeakPolarHBondContact O-CB 3.18Å; T369-A373 PolarHBondContact O-N 2.97Å; A373-V377 WeakPolarHBondContact O-CG2 3.37Å; A373-V377 PolarHBondContact O-N 3.25Å |
| 374 | A | 45.1 | Very low | 45.7 | Very low | 60 Ų | 60 | 107.2 Ų | 107.2 | 50% | 0.496 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -75.5 | -24.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | V370 E372 | V370-A374 WeakPolarHBondContact O-CB 3.3Å; V370-A374 PolarHBondContact O-N 3.4Å; V370-A374 VanDerWaalsContact O-N 3.15Å; E372-A374 PolarHBondContact O-N 3.28Å |
| 375 | Q | 45.9 | Very low | 45.6 | Very low | 135 Ų | 135 | 110.6 Ų | 110.6 | 63% | 0.631 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -80.1 | -34.2 | 176.3 | -123.4 | 168.3 | -21.6 | 0 | 0 | 112.3 | T371 E372 C378 E379 | T371-Q375 PolarHBondContact O-N 3.43Å; E372-Q375 PolarHBondContact O-N 3.09Å; Q375-C378 PolarHBondContact O-N 3.24Å; Q375-E379 PolarHBondContact O-N 3.26Å |
| 376 | A | 48 | Very low | 45.8 | Very low | 55 Ų | 55 | 107.8 Ų | 107.8 | 46% | 0.455 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -68.9 | -30.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | E372 E380 | E372-A376 PolarHBondContact O-N 3.32Å; A376-E380 PolarHBondContact O-N 3.21Å |
| 377 | V | 50.1 | Low | 46 | Very low | 86 Ų | 86 | 107.6 Ų | 107.6 | 52% | 0.521 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -76.3 | -24.6 | 177.9 | 176.8 | 0 | 0 | 0 | 0 | 112.1 | A373 | A373-V377 WeakPolarHBondContact O-CG2 3.37Å; A373-V377 PolarHBondContact O-N 3.25Å |
| 378 | C | 44.8 | Very low | 46.3 | Very low | 86 Ų | 86 | 113 Ų | 113 | 58% | 0.581 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -79.2 | -25 | 175.2 | -71.9 | 0 | 0 | 0 | 0 | 113.5 | Q375 | Q375-C378 PolarHBondContact O-N 3.24Å |
| 379 | E | 46.2 | Very low | 46.6 | Very low | 147 Ų | 147 | 113.2 Ų | 113.2 | 69% | 0.687 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -79.9 | -30.1 | 176.4 | -70.1 | -178.6 | 170.6 | 0 | 0 | 112.2 | Q375 E383 | Q375-E379 PolarHBondContact O-N 3.26Å; E379-E383 PolarHBondContact O-N 3.19Å |
| 380 | E | 48.3 | Very low | 46.7 | Very low | 144 Ų | 144 | 117.9 Ų | 117.9 | 67% | 0.673 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -74.8 | -24.7 | 175.3 | -71 | -167.4 | 166.1 | 0 | 0 | 113.7 | A376 C384 | A376-E380 PolarHBondContact O-N 3.21Å; E380-C384 PolarHBondContact O-N 3.26Å; E380-C384 PolarHBondContact O-SG 2.68Å |
| 381 | E | 48.7 | Very low | 46.5 | Very low | 129 Ų | 129 | 126.3 Ų | 126.3 | 60% | 0.603 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -78.4 | -25.4 | 175.4 | -73 | -165.9 | 172.7 | 0 | 0 | 113.2 | ||
| 382 | E | 46.5 | Very low | 46.4 | Very low | 153 Ų | 153 | 128.1 Ų | 128.1 | 72% | 0.715 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -78 | -31.1 | 172.1 | -71.6 | -161 | 165.7 | 0 | 0 | 112.2 | ||
| 383 | E | 46.2 | Very low | 46.4 | Very low | 149 Ų | 149 | 127.1 Ų | 127.1 | 70% | 0.696 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -76.4 | -27.4 | 176.8 | -142.8 | 172.6 | -161.8 | 0 | 0 | 112.6 | E379 | E379-E383 PolarHBondContact O-N 3.19Å |
| 384 | C | 43.6 | Very low | 46.3 | Very low | 91 Ų | 91 | 130.9 Ų | 130.9 | 62% | 0.615 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -74.2 | -26.4 | 172.9 | -76.1 | 0 | 0 | 0 | 0 | 114.1 | E380 | E380-C384 PolarHBondContact O-N 3.26Å; E380-C384 PolarHBondContact O-SG 2.68Å |
| 385 | Q | 43.1 | Very low | 46.4 | Very low | 151 Ų | 151 | 135.1 Ų | 135.1 | 71% | 0.706 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -79.9 | -18.3 | 178.7 | -79.2 | -176 | 16 | 0 | 0 | 114 | ||
| 386 | V | 45.3 | Very low | 46.4 | Very low | 107 Ų | 107 | 135.1 Ų | 135.1 | 65% | 0.648 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -80.6 | -22.6 | 178.5 | 179.5 | 0 | 0 | 0 | 0 | 111.9 | ||
| 387 | V | 47.4 | Very low | 46.3 | Very low | 116 Ų | 116 | 140.5 Ų | 140.5 | 70% | 0.703 | 72% | 0.721 | S | S | * | * | H | α-helix | trans | -86.4 | -18.4 | -176.7 | -174.2 | 0 | 0 | 0 | 0 | 113.4 | T389 | V387-T389 PolarHBondContact O-N 2.86Å |
| 388 | E | 47.3 | Very low | 46 | Very low | 180 Ų | 180 | 144.4 Ų | 144.4 | 84% | 0.841 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.8 | 9.3 | 178.8 | -72.8 | -164.9 | 156.9 | 0 | 0 | 114.9 | ||
| 389 | T | 49.5 | Very low | 46.1 | Very low | 118 Ų | 118 | 148.8 Ų | 148.8 | 72% | 0.724 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.8 | 7.9 | 179.2 | 57 | 0 | 0 | 0 | 0 | 115.6 | V387 | V387-T389 PolarHBondContact O-N 2.86Š|
| 390 | E | 46.7 | Very low | 46.1 | Very low | 176 Ų | 176 | 149 Ų | 149 | 82% | 0.822 | 75% | 0.752 | S | S | * | * | trans | -129.2 | 73.7 | 171.4 | -67 | -167 | 161.8 | 0 | 0 | 111.8 | ||||
| 391 | E | 40.5 | Very low | 45.9 | Very low | 274 Ų | 274 | 149.5 Ų | 149.5 | 100% | 1.28 | 76% | 0.759 | S | S | * | * | trans | -149.1 | 0 | 146.9 | -91.9 | -161.3 | 159.1 | 0 | 0 | 111.2 |
Retrieved 391 of 391 residues in 377.6 ms
(Link to these results)