| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.2 | Very low | 36.7 | Very low | 234 Ų | 234 | 133.8 Ų | 133.8 | 100% | 1.153 | 78% | 0.783 | S | S | * | * | 0 | 129 | 0 | -77.3 | 175.5 | 169.2 | 0 | 0 | 108 | |||||
| 2 | T | 37.9 | Very low | 36.6 | Very low | 129 Ų | 129 | 132.7 Ų | 132.7 | 79% | 0.791 | 78% | 0.779 | S | S | * | * | trans | 56.3 | 100.1 | 158.2 | 54.8 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 3 | V | 33.6 | Very low | 36.3 | Very low | 130 Ų | 130 | 129.8 Ų | 129.8 | 79% | 0.788 | 77% | 0.77 | S | S | * | * | 75.2 | 121.2 | 95.8 | -137.3 | 0 | 0 | 0 | 0 | 116.8 | |||||
| 4 | S | 31.1 | Very low | 36 | Very low | 96 Ų | 96 | 127 Ų | 127 | 67% | 0.671 | 76% | 0.761 | S | S | * | * | trans | 79.1 | 115 | 131.5 | -100.1 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 5 | T | 37.4 | Very low | 35.7 | Very low | 115 Ų | 115 | 128.4 Ų | 128.4 | 71% | 0.706 | 76% | 0.763 | S | S | * | * | 49.3 | 110.6 | 120.5 | 48.8 | 0 | 0 | 0 | 0 | 120.3 | |||||
| 6 | V | 37.2 | Very low | 35.6 | Very low | 122 Ų | 122 | 126.1 Ų | 126.1 | 74% | 0.739 | 76% | 0.755 | S | S | * | * | 78.2 | 123.7 | 91.1 | 175.9 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 7 | L | 34.2 | Very low | 35.2 | Very low | 170 Ų | 170 | 129.5 Ų | 129.5 | 89% | 0.89 | 76% | 0.764 | S | S | * | * | trans | -175.3 | 117.5 | 131.4 | -95.9 | 156.9 | 0 | 0 | 0 | 110.8 | ||||
| 8 | T | 37.3 | Very low | 35.1 | Very low | 120 Ų | 120 | 128.3 Ų | 128.3 | 74% | 0.736 | 76% | 0.764 | S | S | * | * | trans | -84.5 | -169.9 | 164.4 | 52 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 9 | P | 52.9 | Low | 35.1 | Very low | 111 Ų | 111 | 127.9 Ų | 127.9 | 72% | 0.721 | 77% | 0.768 | S | S | * | * | cis | -133.1 | -163.2 | -30 | 25.4 | -1 | 0 | 0 | 0 | 112.1 | ||||
| 10 | S | 32.9 | Very low | 34.9 | Very low | 101 Ų | 101 | 125.5 Ų | 125.5 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | trans | 110.1 | 141 | 147.1 | -75.7 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 11 | M | 31.5 | Very low | 35.4 | Very low | 144 Ų | 144 | 130.1 Ų | 130.1 | 71% | 0.709 | 78% | 0.775 | S | S | * | * | cis | -174 | 153.6 | -8.4 | -105.9 | -80.8 | 96.6 | 0 | 0 | 105 | ||||
| 12 | T | 34.7 | Very low | 35.1 | Very low | 120 Ų | 120 | 124.8 Ų | 124.8 | 74% | 0.736 | 76% | 0.759 | S | S | * | * | trans | 64.4 | 139.4 | 148.4 | 54.8 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 13 | S | 32.7 | Very low | 35.3 | Very low | 95 Ų | 95 | 122.7 Ų | 122.7 | 66% | 0.664 | 75% | 0.75 | S | S | * | * | cis | -179.9 | 149.3 | 8.4 | 39 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 14 | S | 31.9 | Very low | 35.4 | Very low | 91 Ų | 91 | 124.9 Ų | 124.9 | 64% | 0.636 | 76% | 0.756 | S | S | * | * | trans | 69.9 | 129.9 | 133.3 | 58.5 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 15 | N | 32.1 | Very low | 35.5 | Very low | 148 Ų | 148 | 126.7 Ų | 126.7 | 79% | 0.791 | 76% | 0.758 | S | S | * | * | trans | 77.6 | 149.4 | 140.1 | -66.5 | 7.9 | 0 | 0 | 0 | 118 | ||||
| 16 | S | 33.8 | Very low | 35.6 | Very low | 91 Ų | 91 | 127.7 Ų | 127.7 | 64% | 0.636 | 76% | 0.759 | S | S | * | * | cis | 179.4 | 142.7 | -17.3 | -95.8 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 17 | M | 28.6 | Very low | 35.5 | Very low | 184 Ų | 184 | 130.5 Ų | 130.5 | 91% | 0.906 | 76% | 0.764 | S | S | * | * | trans | 56.4 | 124.5 | 145.8 | -57.7 | -174.3 | 83.4 | 0 | 0 | 121.9 | ||||
| 18 | S | 34.4 | Very low | 35.8 | Very low | 109 Ų | 109 | 127 Ų | 127 | 76% | 0.762 | 76% | 0.755 | S | S | * | * | 159.9 | 108.9 | 114.9 | -169.7 | 0 | 0 | 0 | 0 | 108.8 | |||||
| 19 | S | 34.8 | Very low | 35.8 | Very low | 121 Ų | 121 | 127.5 Ų | 127.5 | 85% | 0.846 | 75% | 0.748 | S | S | * | * | 57.3 | 116.7 | 79 | 172.9 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 20 | G | 31.6 | Very low | 35.2 | Very low | 78 Ų | 78 | 129.4 Ų | 129.4 | 80% | 0.804 | 75% | 0.752 | S | S | * | * | trans | 163.7 | 87.5 | 164.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 21 | Y | 44.3 | Very low | 35.6 | Very low | 223 Ų | 223 | 130.9 Ų | 130.9 | 88% | 0.875 | 75% | 0.746 | S | S | * | * | trans | -75.5 | 155.4 | 169.1 | -138.5 | -98.9 | 0 | 0 | 0 | 110.9 | ||||
| 22 | C | 32.5 | Very low | 36.1 | Very low | 122 Ų | 122 | 129.9 Ų | 129.9 | 82% | 0.824 | 75% | 0.749 | S | S | * | * | trans | 162 | 99 | 146.6 | -93 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 23 | S | 42.9 | Very low | 36.2 | Very low | 85 Ų | 85 | 132.7 Ų | 132.7 | 59% | 0.594 | 75% | 0.751 | S | S | * | * | 54.9 | 105.4 | 80.8 | -147.2 | 0 | 0 | 0 | 0 | 113 | |||||
| 24 | L | 35.2 | Very low | 36.6 | Very low | 177 Ų | 177 | 138 Ų | 138 | 93% | 0.927 | 76% | 0.762 | S | S | * | * | trans | -147.9 | 89 | 149.1 | -109.1 | 160.3 | 0 | 0 | 0 | 107.1 | ||||
| 25 | D | 33.3 | Very low | 37.1 | Very low | 133 Ų | 133 | 139.5 Ų | 139.5 | 71% | 0.711 | 77% | 0.768 | S | S | * | * | trans | -61 | 157.8 | 153.3 | -73.7 | -70.4 | 0 | 0 | 0 | 110.3 | ||||
| 26 | D | 37.9 | Very low | 37.3 | Very low | 137 Ų | 137 | 136 Ų | 136 | 73% | 0.733 | 76% | 0.76 | S | S | * | * | trans | 79.8 | 92.2 | 143.1 | -128.2 | 20.2 | 0 | 0 | 0 | 119.3 | ||||
| 27 | E | 36.4 | Very low | 37.4 | Very low | 180 Ų | 180 | 141.7 Ų | 141.7 | 84% | 0.841 | 77% | 0.773 | S | S | * | * | -152.6 | 60.9 | 129.4 | -104.3 | -174.2 | 129.9 | 0 | 0 | 108 | E29 | E27-E29 PolarHBondContact O-N 3.3Š| |||
| 28 | S | 40.9 | Very low | 38.1 | Very low | 98 Ų | 98 | 138.4 Ų | 138.4 | 69% | 0.685 | 76% | 0.764 | S | S | * | * | trans | -81.6 | 78.2 | 158.9 | 55.2 | 0 | 0 | 0 | 0 | 108.4 | D30 | S28-D30 VanDerWaalsContact C-N 3.28Å; S28-D30 PolarHBondContact O-N 3.46Å | ||
| 29 | E | 37.6 | Very low | 38.1 | Very low | 130 Ų | 130 | 139 Ų | 139 | 61% | 0.607 | 77% | 0.768 | S | S | * | * | trans | -73.2 | 95.5 | 158.7 | -67 | -166 | 134.1 | 0 | 0 | 107.6 | E27 F31 | E27-E29 PolarHBondContact O-N 3.3Å; E29-F31 HydrophobicContact CB-CD2 3.71Å; E29-F31 HydrophobicContact CB-CE2 3.37Å; E29-F31 HydrophobicContact CB-CZ 4.07Å; E29-F31 HydrophobicContact CG-CE2 4.17Å; E29-F31 PolarHBondContact O-N 3.24Å; E29-F31 WeakPolarHBondContact OE2-CE2 3.39Å; E29-F31 WeakPolarHBondContact OE2-CZ 3.44Å | ||
| 30 | D | 40.2 | Very low | 38.2 | Very low | 150 Ų | 150 | 142.9 Ų | 142.9 | 80% | 0.802 | 77% | 0.77 | S | S | * | * | trans | -60.4 | 75.8 | 166 | -128.8 | -3.1 | 0 | 0 | 0 | 108.6 | S28 T32 | S28-D30 VanDerWaalsContact C-N 3.28Å; S28-D30 PolarHBondContact O-N 3.46Å; D30-T32 VanDerWaalsContact C-N 3.27Å; D30-T32 PolarHBondContact O-N 3.48Å | ||
| 31 | F | 40.4 | Very low | 38.4 | Very low | 132 Ų | 132 | 148.4 Ų | 148.4 | 58% | 0.579 | 77% | 0.772 | S | S | * | * | trans | -76 | 88.4 | 169.5 | -74.6 | -73.3 | 0 | 0 | 0 | 108.3 | E29 F33 | E29-F31 HydrophobicContact CB-CD2 3.71Å; E29-F31 HydrophobicContact CB-CE2 3.37Å; E29-F31 HydrophobicContact CB-CZ 4.07Å; E29-F31 HydrophobicContact CG-CE2 4.17Å; E29-F31 PolarHBondContact O-N 3.24Å; E29-F31 WeakPolarHBondContact OE2-CE2 3.39Å; E29-F31 WeakPolarHBondContact OE2-CZ 3.44Å; F31-F33 VanDerWaalsContact C-N 3.32Å; F31-F33 HydrophobicContact CB-CE2 4.11Å; F31-F33 HydrophobicContact CB-CZ 4.08Å; F31-F33 WeakPolarHBondContact O-CD2 3.35Å; F31-F33 WeakPolarHBondContact O-CE2 3.34Å; F31-F33 PolarHBondContact O-N 3.34Å | ||
| 32 | T | 41.9 | Very low | 37.9 | Very low | 124 Ų | 124 | 149.3 Ų | 149.3 | 76% | 0.761 | 77% | 0.774 | S | S | * | * | trans | -58.5 | 96.2 | 163.6 | 53.3 | 0 | 0 | 0 | 0 | 108.5 | D30 F34 | D30-T32 VanDerWaalsContact C-N 3.27Å; D30-T32 PolarHBondContact O-N 3.48Å; T32-F34 PolarHBondContact O-N 3.05Å; T32-F34 VanDerWaalsContact O-N 3.1Å | ||
| 33 | F | 36.2 | Very low | 38.3 | Very low | 179 Ų | 179 | 153.3 Ų | 153.3 | 79% | 0.785 | 78% | 0.777 | S | S | * | * | trans | -68.8 | 108.1 | 169.3 | -64.2 | -78.7 | 0 | 0 | 0 | 108 | F31 T35 | F31-F33 VanDerWaalsContact C-N 3.32Å; F31-F33 HydrophobicContact CB-CE2 4.11Å; F31-F33 HydrophobicContact CB-CZ 4.08Å; F31-F33 WeakPolarHBondContact O-CD2 3.35Å; F31-F33 WeakPolarHBondContact O-CE2 3.34Å; F31-F33 PolarHBondContact O-N 3.34Å; F33-T35 VanDerWaalsContact C-N 3.29Å; F33-T35 PolarHBondContact O-N 2.72Å; F33-T35 PolarHBondContact O-OG1 3.39Å | ||
| 34 | F | 40.8 | Very low | 37.9 | Very low | 205 Ų | 205 | 155.2 Ų | 155.2 | 90% | 0.899 | 79% | 0.788 | S | S | * | * | trans | -74.1 | 84.1 | 173.7 | -162.6 | -93.2 | 0 | 0 | 0 | 108.6 | T32 A36 | T32-F34 PolarHBondContact O-N 3.05Å; T32-F34 VanDerWaalsContact O-N 3.1Å; F34-A36 PolarHBondContact O-N 3.34Å | ||
| 35 | T | 42.4 | Very low | 37.9 | Very low | 123 Ų | 123 | 156.7 Ų | 156.7 | 76% | 0.755 | 79% | 0.787 | S | S | * | * | trans | -77.8 | 111.4 | 169.4 | 0 | 0 | 0 | 0 | 0 | 108.2 | F33 K37 | F33-T35 VanDerWaalsContact C-N 3.29Å; F33-T35 PolarHBondContact O-N 2.72Å; F33-T35 PolarHBondContact O-OG1 3.39Å; T35-K37 PolarHBondContact O-N 3.47Å; T35-K37 VanDerWaalsContact O-N 3.09Å | ||
| 36 | A | 36.4 | Very low | 37.9 | Very low | 75 Ų | 75 | 159.8 Ų | 159.8 | 62% | 0.62 | 80% | 0.796 | S | S | * | * | trans | -57.1 | 115.5 | 164.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | F34 T38 | F34-A36 PolarHBondContact O-N 3.34Å; A36-T38 PolarHBondContact O-N 3.03Å | ||
| 37 | K | 36.5 | Very low | 37.7 | Very low | 211 Ų | 211 | 157.5 Ų | 157.5 | 92% | 0.917 | 80% | 0.797 | S | S | * | * | trans | -71.6 | 99.3 | 174.1 | -78.6 | -175.1 | 168.4 | 174 | 0 | 108.4 | T35 | T35-K37 PolarHBondContact O-N 3.47Å; T35-K37 VanDerWaalsContact O-N 3.09Å | ||
| 38 | T | 43 | Very low | 37.9 | Very low | 115 Ų | 115 | 154.9 Ų | 154.9 | 71% | 0.706 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -91.5 | 123.4 | 165.9 | 62.9 | 0 | 0 | 0 | 0 | 108.4 | A36 | A36-T38 PolarHBondContact O-N 3.03Š|
| 39 | S | 34.9 | Very low | 37.5 | Very low | 122 Ų | 122 | 160.3 Ų | 160.3 | 85% | 0.853 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 133.5 | 178.5 | -139.5 | 0 | 0 | 0 | 0 | 109.4 | ||
| 40 | F | 36.3 | Very low | 37.3 | Very low | 201 Ų | 201 | 163 Ų | 163 | 88% | 0.882 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 146 | -172.1 | -74 | -89.3 | 0 | 0 | 0 | 114.4 | ||
| 41 | F | 36 | Very low | 36.9 | Very low | 194 Ų | 194 | 161 Ų | 161 | 85% | 0.851 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 146.1 | -177.6 | -70.7 | -96.5 | 0 | 0 | 0 | 116.3 | ||
| 42 | R | 34.6 | Very low | 36.5 | Very low | 243 Ų | 243 | 163.9 Ų | 163.9 | 92% | 0.917 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -101.6 | 129.2 | 145 | -88.3 | -172.8 | -179.9 | 179.1 | 1.8 | 109.2 | ||
| 43 | K | 40.8 | Very low | 36.3 | Very low | 205 Ų | 205 | 164.5 Ų | 164.5 | 89% | 0.891 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -82.6 | 139.8 | 172.8 | -77.4 | 177.2 | 173 | 175.5 | 0 | 111.6 | ||
| 44 | P | 35.1 | Very low | 36.1 | Very low | 126 Ų | 126 | 163.6 Ų | 163.6 | 82% | 0.818 | 83% | 0.832 | S | S | * | * | trans | -111.9 | 155.1 | 145.8 | 21.4 | -3.6 | 0 | 0 | 0 | 112.2 | ||||
| 45 | K | 33.8 | Very low | 36.3 | Very low | 208 Ų | 208 | 163.1 Ų | 163.1 | 90% | 0.904 | 83% | 0.832 | S | S | * | * | trans | -80 | 145.7 | -172.2 | -66.9 | 171.1 | 175.7 | 175 | 0 | 111.9 | ||||
| 46 | H | 33.2 | Very low | 35.9 | Very low | 197 Ų | 197 | 163.6 Ų | 163.6 | 91% | 0.912 | 83% | 0.826 | S | S | * | * | trans | -60.5 | 141.4 | 173.7 | -94.4 | -86.4 | 0 | 0 | 0 | 113.9 | ||||
| 47 | A | 34.7 | Very low | 36.1 | Very low | 90 Ų | 90 | 167.4 Ų | 167.4 | 74% | 0.744 | 83% | 0.831 | S | S | * | * | trans | -144.7 | 145.7 | 148.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 48 | P | 39.7 | Very low | 36.4 | Very low | 124 Ų | 124 | 167.2 Ų | 167.2 | 81% | 0.805 | 83% | 0.833 | S | S | * | * | trans | -91.3 | 138.2 | -168.9 | 34.9 | -30.5 | 0 | 0 | 0 | 111.6 | ||||
| 49 | K | 33.8 | Very low | 36.2 | Very low | 213 Ų | 213 | 170.9 Ų | 170.9 | 93% | 0.926 | 83% | 0.834 | S | S | * | * | trans | -142.6 | 147.5 | 159.7 | -88.6 | -170 | 178.5 | 177.2 | 0 | 112.3 | ||||
| 50 | Q | 32.6 | Very low | 36.2 | Very low | 186 Ų | 186 | 169.3 Ų | 169.3 | 87% | 0.869 | 84% | 0.837 | S | S | * | * | trans | -73.9 | 163.4 | -161 | -69.3 | 164.1 | -38.3 | 0 | 0 | 114.3 | ||||
| 51 | S | 32.5 | Very low | 35.9 | Very low | 108 Ų | 108 | 162.2 Ų | 162.2 | 76% | 0.755 | 82% | 0.821 | S | S | * | * | trans | -26.4 | 135.4 | 166.7 | 54.6 | 0 | 0 | 0 | 0 | 117 | ||||
| 52 | E | 32 | Very low | 36.2 | Very low | 192 Ų | 192 | 157.4 Ų | 157.4 | 90% | 0.897 | 82% | 0.817 | S | S | * | * | trans | -158.5 | 125.7 | 134.7 | -108.1 | 167 | -158.1 | 0 | 0 | 109 | ||||
| 53 | T | 37.3 | Very low | 37.2 | Very low | 137 Ų | 137 | 152.7 Ų | 152.7 | 84% | 0.84 | 81% | 0.805 | S | S | * | * | trans | -56.4 | 128.9 | 167.7 | 21.5 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 54 | K | 31.1 | Very low | 38.8 | Very low | 161 Ų | 161 | 151.7 Ų | 151.7 | 70% | 0.7 | 80% | 0.803 | S | S | * | * | trans | -148 | 97 | 155.2 | -112.6 | -176.7 | 176 | -131.2 | 0 | 109.8 | E56 | K54-E56 IonicContact NZ-OE1 2.92Å; K54-E56 PolarHBondContact NZ-OE1 3.09Å; K54-E56 IonicContact NZ-OE2 3.41Å; K54-E56 PolarHBondContact NZ-OE2 3.44Å; K54-E56 PolarHBondContact O-N 3.2Å | ||
| 55 | E | 44.9 | Very low | 41.1 | Very low | 195 Ų | 195 | 147.5 Ų | 147.5 | 91% | 0.911 | 77% | 0.774 | S | S | * | * | trans | -72.4 | 98.4 | 157.1 | -66.7 | 176.7 | 165.3 | 0 | 0 | 107.4 | ||||
| 56 | E | 35.3 | Very low | 43.7 | Very low | 132 Ų | 132 | 140.3 Ų | 140.3 | 62% | 0.617 | 75% | 0.75 | S | S | * | * | trans | -161.1 | 125.4 | 173.5 | -90.7 | 177.7 | -173.8 | 0 | 0 | 104.5 | K54 | K54-E56 IonicContact NZ-OE1 2.92Å; K54-E56 PolarHBondContact NZ-OE1 3.09Å; K54-E56 IonicContact NZ-OE2 3.41Å; K54-E56 PolarHBondContact NZ-OE2 3.44Å; K54-E56 PolarHBondContact O-N 3.2Å | ||
| 57 | E | 40.4 | Very low | 46.4 | Very low | 155 Ų | 155 | 136.7 Ų | 136.7 | 72% | 0.724 | 73% | 0.733 | S | S | * | * | cis | -156.8 | 117 | 10.7 | -87.8 | 174.7 | 131.9 | 0 | 0 | 107.5 | R59 | E57-R59 HydrophobicContact CB-CB 4.19Å; E57-R59 HydrophobicContact CG-CB 4.33Å; E57-R59 PolarHBondContact O-N 3.43Å | ||
| 58 | E | 41.6 | Very low | 49.1 | Very low | 208 Ų | 208 | 140.2 Ų | 140.2 | 97% | 0.972 | 74% | 0.735 | S | S | * | * | trans | -86.8 | 73.5 | 147.1 | -166.1 | -174.6 | -172.8 | 0 | 0 | 106.3 | ||||
| 59 | R | 40 | Very low | 51.7 | Low | 192 Ų | 192 | 139 Ų | 139 | 73% | 0.725 | 72% | 0.718 | S | S | * | * | trans | -130.6 | 56.1 | 175 | -142.3 | 178.7 | -170 | -147.7 | -0.1 | 110.6 | E57 G61 | E57-R59 HydrophobicContact CB-CB 4.19Å; E57-R59 HydrophobicContact CG-CB 4.33Å; E57-R59 PolarHBondContact O-N 3.43Å; R59-G61 PolarHBondContact O-N 3Å | ||
| 60 | G | 34 | Very low | 54.6 | Low | 89 Ų | 89 | 129.4 Ų | 129.4 | 92% | 0.918 | 68% | 0.677 | S | S | * | * | trans | -73.4 | 48.8 | 157 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 61 | G | 31.7 | Very low | 57.6 | Low | 52 Ų | 52 | 124.9 Ų | 124.9 | 54% | 0.536 | 66% | 0.656 | S | S | . | * | trans | -78.4 | 119.6 | 167.3 | 0 | 0 | 0 | 0 | 0 | 107.1 | R59 E63 | R59-G61 PolarHBondContact O-N 3Å; G61-E63 VanDerWaalsContact C-N 3.27Å; G61-E63 PolarHBondContact O-N 3.32Å | ||
| 62 | A | 41.6 | Very low | 60.7 | Low | 93 Ų | 93 | 122.4 Ų | 122.4 | 77% | 0.769 | 64% | 0.642 | S | S | * | * | trans | -58.8 | 92.2 | 171.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | E64 | A62-E64 VanDerWaalsContact C-N 3.28Å; A62-E64 PolarHBondContact O-N 2.97Å | ||
| 63 | E | 56.3 | Low | 63.8 | Low | 143 Ų | 143 | 116.9 Ų | 116.9 | 67% | 0.668 | 62% | 0.615 | S | S | * | * | trans | -69.5 | 97.1 | 163.1 | -70.8 | -164.8 | 164.8 | 0 | 0 | 106.6 | G61 L65 K203 | G61-E63 VanDerWaalsContact C-N 3.27Å; G61-E63 PolarHBondContact O-N 3.32Å; E63-L65 PolarHBondContact O-N 2.73Å; E63-K203 PolarHBondContact O-NZ 2.99Å | ||
| 64 | E | 73.2 | Confident | 66.7 | Low | 184 Ų | 184 | 110.8 Ų | 110.8 | 86% | 0.86 | 58% | 0.577 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 118.4 | 163.6 | -76.3 | -176.3 | 159.7 | 0 | 0 | 107.2 | A62 | A62-E64 VanDerWaalsContact C-N 3.28Å; A62-E64 PolarHBondContact O-N 2.97Å |
| 65 | L | 82.5 | Confident | 69.8 | Low | 39 Ų | 39 | 108.5 Ų | 108.5 | 20% | 0.204 | 57% | 0.569 | C | S | . | * | P | Polyproline II helix | trans | -67.3 | 138.2 | 175.2 | -65.4 | 169.3 | 0 | 0 | 0 | 108.2 | E63 E69 V70 K73 K203 | E63-L65 PolarHBondContact O-N 2.73Å; L65-E69 WeakPolarHBondContact CA-OE2 3.34Å; L65-E69 HydrophobicContact CB-CB 4.31Å; L65-E69 HydrophobicContact CD2-CB 4.43Å; L65-V70 HydrophobicContact CB-CG2 3.64Å; L65-V70 HydrophobicContact CD1-CG2 4.22Å; L65-K73 HydrophobicContact CD1-CD 4.18Å; L65-K203 HydrophobicContact CD1-CG 4.01Å |
| 66 | S | 89.6 | Confident | 72.4 | Confident | 56 Ų | 56 | 102.5 Ų | 102.5 | 39% | 0.392 | 55% | 0.549 | S | S | . | . | P | Polyproline II helix | trans | -65.9 | 159.1 | 170.5 | 74.4 | 0 | 0 | 0 | 0 | 110.6 | E68 E69 V70 | S66-E68 VanDerWaalsContact C-N 3.26Å; S66-E68 PolarHBondContact O-N 3.23Å; S66-E69 PolarHBondContact N-OE2 3.49Å; S66-E69 WeakPolarHBondContact O-CB 3.5Å; S66-E69 PolarHBondContact O-N 2.96Å; S66-E69 VanDerWaalsContact O-N 3.1Å; S66-E69 VanDerWaalsContact OG-CG 3.26Å; S66-E69 WeakPolarHBondContact OG-CG 3.2Å; S66-E69 PolarHBondContact OG-N 3.09Å; S66-V70 WeakPolarHBondContact O-CG2 3.42Å; S66-V70 PolarHBondContact O-N 3.26Å |
| 67 | E | 88.9 | Confident | 75.3 | Confident | 122 Ų | 122 | 97.1 Ų | 97.1 | 57% | 0.57 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -58.6 | -39.7 | 179.3 | -169.6 | 176.2 | -178.8 | 0 | 0 | 111.9 | E69 V70 Q71 | E67-E69 PolarHBondContact O-N 2.99Å; E67-V70 PolarHBondContact O-N 3.05Å; E67-Q71 PolarHBondContact O-N 3.36Å |
| 68 | E | 91.9 | Very high | 78.1 | Confident | 164 Ų | 164 | 92.4 Ų | 92.4 | 77% | 0.766 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.3 | -40.6 | 175.6 | -62.9 | -179.1 | 179.5 | 0 | 0 | 111.9 | S66 Q71 A72 | S66-E68 VanDerWaalsContact C-N 3.26Å; S66-E68 PolarHBondContact O-N 3.23Å; E68-Q71 PolarHBondContact O-N 2.98Å; E68-A72 WeakPolarHBondContact O-CB 3.31Å; E68-A72 PolarHBondContact O-N 3.28Å |
| 69 | E | 93.9 | Very high | 80.8 | Confident | 98 Ų | 98 | 86.7 Ų | 86.7 | 46% | 0.458 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -67.2 | -39.8 | 175.8 | -74 | 172.2 | 169.1 | 0 | 0 | 112.2 | L65 S66 E67 A72 K73 | L65-E69 WeakPolarHBondContact CA-OE2 3.34Å; L65-E69 HydrophobicContact CB-CB 4.31Å; L65-E69 HydrophobicContact CD2-CB 4.43Å; S66-E69 PolarHBondContact N-OE2 3.49Å; S66-E69 WeakPolarHBondContact O-CB 3.5Å; S66-E69 PolarHBondContact O-N 2.96Å; S66-E69 VanDerWaalsContact O-N 3.1Å; S66-E69 VanDerWaalsContact OG-CG 3.26Å; S66-E69 WeakPolarHBondContact OG-CG 3.2Å; S66-E69 PolarHBondContact OG-N 3.09Å; E67-E69 PolarHBondContact O-N 2.99Å; E69-A72 PolarHBondContact O-N 3.06Å; E69-K73 WeakPolarHBondContact O-CB 3.39Å; E69-K73 WeakPolarHBondContact O-CG 3.01Å; E69-K73 PolarHBondContact O-N 3.43Å |
| 70 | V | 95.2 | Very high | 83.5 | Confident | 12 Ų | 12 | 83.4 Ų | 83.4 | 7% | 0.073 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -60.9 | -48 | 175.5 | 171.4 | 0 | 0 | 0 | 0 | 109.7 | L65 S66 E67 K73 I74 L88 F94 L202 | L65-V70 HydrophobicContact CB-CG2 3.64Å; L65-V70 HydrophobicContact CD1-CG2 4.22Å; S66-V70 WeakPolarHBondContact O-CG2 3.42Å; S66-V70 PolarHBondContact O-N 3.26Å; E67-V70 PolarHBondContact O-N 3.05Å; V70-K73 PolarHBondContact O-N 3.3Å; V70-I74 HydrophobicContact CG1-CD1 3.73Å; V70-I74 HydrophobicContact CG1-CG1 4.39Å; V70-I74 WeakPolarHBondContact O-CB 3.15Å; V70-I74 VanDerWaalsContact O-CG1 3.31Å; V70-I74 WeakPolarHBondContact O-CG1 3.41Å; V70-I74 PolarHBondContact O-N 3.02Å; V70-L88 HydrophobicContact CG1-CD1 4.1Å; V70-F94 HydrophobicContact CG1-CD1 3.62Å; V70-F94 HydrophobicContact CG1-CE1 3.8Å; V70-F94 HydrophobicContact CG1-CG 4.38Å; V70-F94 HydrophobicContact CG2-CE1 4.46Å; V70-L202 HydrophobicContact CG1-CD2 4.15Å |
| 71 | Q | 96.3 | Very high | 86.4 | Confident | 91 Ų | 91 | 81 Ų | 81 | 43% | 0.425 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -59.2 | -51.5 | 178.3 | -176.4 | 178.3 | -16.5 | 0 | 0 | 111.5 | E67 E68 K73 I74 E75 L88 | E67-Q71 PolarHBondContact O-N 3.36Å; E68-Q71 PolarHBondContact O-N 2.98Å; Q71-K73 VanDerWaalsContact C-N 3.3Å; Q71-K73 PolarHBondContact O-N 3.43Å; Q71-I74 PolarHBondContact O-N 3.48Å; Q71-I74 VanDerWaalsContact O-N 3.13Å; Q71-E75 WeakPolarHBondContact CG-OE1 3.34Å; Q71-E75 PolarHBondContact NE2-OE1 2.8Å; Q71-E75 WeakPolarHBondContact O-CG 3.49Å; Q71-E75 PolarHBondContact O-N 2.93Å; Q71-L88 HydrophobicContact CB-CD2 3.96Å; Q71-L88 HydrophobicContact CG-CD2 4.06Å |
| 72 | A | 96.8 | Very high | 89.2 | Confident | 56 Ų | 56 | 84.5 Ų | 84.5 | 46% | 0.463 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -60.4 | -39.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | E68 E69 S76 | E68-A72 WeakPolarHBondContact O-CB 3.31Å; E68-A72 PolarHBondContact O-N 3.28Å; E69-A72 PolarHBondContact O-N 3.06Å; A72-S76 WeakPolarHBondContact O-CB 3.2Å; A72-S76 PolarHBondContact O-N 2.96Å |
| 73 | K | 97.2 | Very high | 91.6 | Very high | 75 Ų | 75 | 86.9 Ų | 86.9 | 33% | 0.326 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -67.9 | -38.8 | 175.5 | -76.1 | -167 | 178.7 | -153.1 | 0 | 112.4 | L65 E69 V70 Q71 S76 Y77 L202 | L65-K73 HydrophobicContact CD1-CD 4.18Å; E69-K73 WeakPolarHBondContact O-CB 3.39Å; E69-K73 WeakPolarHBondContact O-CG 3.01Å; E69-K73 PolarHBondContact O-N 3.43Å; V70-K73 PolarHBondContact O-N 3.3Å; Q71-K73 VanDerWaalsContact C-N 3.3Å; Q71-K73 PolarHBondContact O-N 3.43Å; K73-S76 PolarHBondContact O-N 2.93Å; K73-Y77 VanDerWaalsContact O-CB 3.22Å; K73-Y77 WeakPolarHBondContact O-CB 3.38Å; K73-Y77 PolarHBondContact O-N 3.3Å; K73-L202 HydrophobicContact CB-CD1 3.7Å; K73-L202 HydrophobicContact CB-CD2 4.24Å; K73-L202 HydrophobicContact CB-CG 3.89Å; K73-L202 HydrophobicContact CD-CG 4.43Å |
| 74 | I | 97.9 | Very high | 93.4 | Very high | 9 Ų | 9 | 83 Ų | 83 | 5% | 0.046 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -64.8 | -43 | 177.3 | -73.5 | 171.9 | 0 | 0 | 0 | 110.2 | V70 Q71 Y77 N78 M86 L88 F94 L202 | V70-I74 HydrophobicContact CG1-CD1 3.73Å; V70-I74 HydrophobicContact CG1-CG1 4.39Å; V70-I74 WeakPolarHBondContact O-CB 3.15Å; V70-I74 VanDerWaalsContact O-CG1 3.31Å; V70-I74 WeakPolarHBondContact O-CG1 3.41Å; V70-I74 PolarHBondContact O-N 3.02Å; Q71-I74 PolarHBondContact O-N 3.48Å; Q71-I74 VanDerWaalsContact O-N 3.13Å; I74-Y77 PolarHBondContact O-N 3.06Å; I74-N78 VanDerWaalsContact O-CB 3.29Å; I74-N78 WeakPolarHBondContact O-CB 3.32Å; I74-N78 PolarHBondContact O-N 2.99Å; I74-M86 HydrophobicContact CG1-CB 4.14Å; I74-M86 HydrophobicContact CG2-CB 4.11Å; I74-L88 HydrophobicContact CD1-CB 4.01Å; I74-L88 HydrophobicContact CD1-CD1 4.11Å; I74-F94 HydrophobicContact CD1-CB 3.66Å; I74-F94 HydrophobicContact CD1-CD1 4.41Å; I74-F94 HydrophobicContact CD1-CD2 4.26Å; I74-F94 HydrophobicContact CD1-CG 3.89Å; I74-L202 HydrophobicContact CG1-CD1 3.79Å; I74-L202 HydrophobicContact CG1-CD2 4.06Å |
| 75 | E | 97.7 | Very high | 94.4 | Very high | 114 Ų | 114 | 75.2 Ų | 75.2 | 53% | 0.533 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -60.4 | -47.2 | 175.8 | -71 | 174.5 | -167.1 | 0 | 0 | 111.3 | Q71 Y77 N78 A79 | Q71-E75 WeakPolarHBondContact CG-OE1 3.34Å; Q71-E75 PolarHBondContact NE2-OE1 2.8Å; Q71-E75 WeakPolarHBondContact O-CG 3.49Å; Q71-E75 PolarHBondContact O-N 2.93Å; E75-Y77 PolarHBondContact O-N 2.95Å; E75-N78 PolarHBondContact O-N 3.33Å; E75-A79 WeakPolarHBondContact O-CB 3.36Å; E75-A79 PolarHBondContact O-N 3.42Å |
| 76 | S | 97.7 | Very high | 95.2 | Very high | 69 Ų | 69 | 73.4 Ų | 73.4 | 48% | 0.483 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -62.7 | -39.2 | 175.7 | -179.3 | 0 | 0 | 0 | 0 | 113.1 | A72 K73 Q80 | A72-S76 WeakPolarHBondContact O-CB 3.2Å; A72-S76 PolarHBondContact O-N 2.96Å; K73-S76 PolarHBondContact O-N 2.93Å; S76-Q80 PolarHBondContact O-NE2 3.15Å; S76-Q80 VanDerWaalsContact O-NE2 3.1Å |
| 77 | Y | 98 | Very high | 95.5 | Very high | 19 Ų | 19 | 75.6 Ų | 75.6 | 8% | 0.075 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -64.3 | -49.8 | 176.2 | -173.2 | -78.6 | 0 | 0 | 0 | 110.7 | K73 I74 E75 A79 Q80 V81 M86 R201 G205 P206 | K73-Y77 VanDerWaalsContact O-CB 3.22Å; K73-Y77 WeakPolarHBondContact O-CB 3.38Å; K73-Y77 PolarHBondContact O-N 3.3Å; I74-Y77 PolarHBondContact O-N 3.06Å; E75-Y77 PolarHBondContact O-N 2.95Å; Y77-A79 VanDerWaalsContact C-N 3.29Å; Y77-A79 PolarHBondContact O-N 2.7Å; Y77-Q80 PolarHBondContact O-N 2.87Å; Y77-Q80 VanDerWaalsContact O-N 3.11Å; Y77-V81 HydrophobicContact CD1-CG2 4.17Å; Y77-V81 HydrophobicContact CE1-CG1 4.21Å; Y77-V81 HydrophobicContact CE1-CG2 4.11Å; Y77-M86 HydrophobicContact CD1-CE 4.43Å; Y77-M86 HydrophobicContact CD1-CG 4.13Å; Y77-M86 HydrophobicContact CD2-CE 3.99Å; Y77-M86 HydrophobicContact CE1-CE 4.16Å; Y77-M86 HydrophobicContact CE1-CG 4.19Å; Y77-M86 HydrophobicContact CE2-CE 3.68Å; Y77-M86 HydrophobicContact CG-CE 4.37Å; Y77-R201 HydrophobicContact CE2-CG 4.1Å; Y77-G205 VanDerWaalsContact CE2-C 3.43Å; Y77-P206 HydrophobicContact CD2-CB 4.39Å; Y77-P206 HydrophobicContact CD2-CG 4.49Å; Y77-P206 HydrophobicContact CE1-CB 4.24Å; Y77-P206 HydrophobicContact CE2-CB 3.81Å; Y77-P206 HydrophobicContact CE2-CG 4.36Å; Y77-P206 VanDerWaalsContact CE2-N 3.34Å |
| 78 | N | 98 | Very high | 95.9 | Very high | 55 Ų | 55 | 72.8 Ų | 72.8 | 29% | 0.294 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -67.3 | -28.9 | -177.3 | -72.1 | -9.4 | 0 | 0 | 0 | 112.6 | I74 E75 Q80 V81 G85 M86 | I74-N78 VanDerWaalsContact O-CB 3.29Å; I74-N78 WeakPolarHBondContact O-CB 3.32Å; I74-N78 PolarHBondContact O-N 2.99Å; E75-N78 PolarHBondContact O-N 3.33Å; N78-Q80 PolarHBondContact O-N 2.93Å; N78-V81 PolarHBondContact O-N 3.46Å; N78-G85 WeakPolarHBondContact OD1-CA 3.42Å; N78-M86 PolarHBondContact ND2-O 3.42Å; N78-M86 PolarHBondContact OD1-N 3.49Å |
| 79 | A | 97.8 | Very high | 96.1 | Very high | 89 Ų | 89 | 67 Ų | 67 | 74% | 0.736 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -64.8 | -23.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | E75 Y77 | E75-A79 WeakPolarHBondContact O-CB 3.36Å; E75-A79 PolarHBondContact O-N 3.42Å; Y77-A79 VanDerWaalsContact C-N 3.29Å; Y77-A79 PolarHBondContact O-N 2.7Å |
| 80 | Q | 96.6 | Very high | 96 | Very high | 123 Ų | 123 | 67.8 Ų | 67.8 | 58% | 0.575 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.2 | -10.5 | -177.8 | -69 | 173.4 | 60.5 | 0 | 0 | 113.5 | S76 Y77 N78 P206 | S76-Q80 PolarHBondContact O-NE2 3.15Å; S76-Q80 VanDerWaalsContact O-NE2 3.1Å; Y77-Q80 PolarHBondContact O-N 2.87Å; Y77-Q80 VanDerWaalsContact O-N 3.11Å; N78-Q80 PolarHBondContact O-N 2.93Å; Q80-P206 HydrophobicContact CB-CG 3.73Å |
| 81 | V | 95.3 | Very high | 95.8 | Very high | 37 Ų | 37 | 73.1 Ų | 73.1 | 22% | 0.224 | 43% | 0.434 | C | S | . | . | trans | -122 | 136.8 | -176.5 | -60.2 | 0 | 0 | 0 | 0 | 111.4 | Y77 N78 P206 | Y77-V81 HydrophobicContact CD1-CG2 4.17Å; Y77-V81 HydrophobicContact CE1-CG1 4.21Å; Y77-V81 HydrophobicContact CE1-CG2 4.11Å; N78-V81 PolarHBondContact O-N 3.46Å; V81-P206 HydrophobicContact CG1-CB 3.37Å; V81-P206 HydrophobicContact CG1-CG 3.89Å | ||
| 82 | S | 91.5 | Very high | 95.5 | Very high | 126 Ų | 126 | 69.8 Ų | 69.8 | 88% | 0.881 | 42% | 0.424 | S | S | * | . | S | Bend | trans | -84.1 | -26 | 175.6 | 57.7 | 0 | 0 | 0 | 0 | 112.9 | ||
| 83 | E | 91.8 | Very high | 95.4 | Very high | 144 Ų | 144 | 68.8 Ų | 68.8 | 67% | 0.673 | 41% | 0.413 | S | S | * | . | S | Bend | trans | -141.3 | 160.2 | -179.3 | -63.8 | -177.3 | 174.5 | 0 | 0 | 109 | G85 | E83-G85 VanDerWaalsContact C-N 3.33Å; E83-G85 PolarHBondContact O-N 2.93Å |
| 84 | N | 93.3 | Very high | 95.4 | Very high | 61 Ų | 61 | 65.6 Ų | 65.6 | 33% | 0.326 | 40% | 0.399 | S | S | . | . | S | Bend | trans | 64.1 | 32.4 | 176.2 | -47.5 | -41.1 | 0 | 0 | 0 | 114.7 | F97 Q145 | N84-F97 HydrophobicContact CB-CB 4.13Å; N84-F97 HydrophobicContact CB-CD2 3.6Å; N84-F97 HydrophobicContact CB-CE2 4.21Å; N84-F97 HydrophobicContact CB-CG 3.95Å; N84-Q145 VanDerWaalsContact CG-NE2 3.27Å; N84-Q145 PolarHBondContact ND2-NE2 3Å |
| 85 | G | 95.4 | Very high | 95.5 | Very high | 20 Ų | 20 | 67.3 Ų | 67.3 | 21% | 0.206 | 41% | 0.41 | C | S | . | . | trans | -62.7 | 173.9 | 170.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | N78 E83 | N78-G85 WeakPolarHBondContact OD1-CA 3.42Å; E83-G85 VanDerWaalsContact C-N 3.33Å; E83-G85 PolarHBondContact O-N 2.93Å | ||
| 86 | M | 97.9 | Very high | 95.5 | Very high | 2 Ų | 2 | 61.9 Ų | 61.9 | 1% | 0.01 | 39% | 0.385 | C | S | . | . | trans | -97.3 | 148.4 | 175 | -59.3 | -164.2 | -172.4 | 0 | 0 | 111.3 | I74 Y77 N78 F94 T95 L198 R201 L202 | I74-M86 HydrophobicContact CG1-CB 4.14Å; I74-M86 HydrophobicContact CG2-CB 4.11Å; Y77-M86 HydrophobicContact CD1-CE 4.43Å; Y77-M86 HydrophobicContact CD1-CG 4.13Å; Y77-M86 HydrophobicContact CD2-CE 3.99Å; Y77-M86 HydrophobicContact CE1-CE 4.16Å; Y77-M86 HydrophobicContact CE1-CG 4.19Å; Y77-M86 HydrophobicContact CE2-CE 3.68Å; Y77-M86 HydrophobicContact CG-CE 4.37Å; N78-M86 PolarHBondContact ND2-O 3.42Å; N78-M86 PolarHBondContact OD1-N 3.49Å; M86-F94 HydrophobicContact SD-CD2 3.97Å; M86-F94 HydrophobicContact SD-CE2 3.99Å; M86-T95 CarbonylContact C-O 3.57Å; M86-T95 WeakPolarHBondContact CA-O 3.34Å; M86-T95 WeakPolarHBondContact CB-O 3.47Å; M86-L198 HydrophobicContact CE-CD1 4.03Å; M86-L198 HydrophobicContact SD-CD1 4.4Å; M86-L198 HydrophobicContact SD-CG 4.49Å; M86-R201 HydrophobicContact CE-CB 4.2Å; M86-R201 HydrophobicContact CE-CG 3.77Å; M86-L202 HydrophobicContact CE-CB 4Å; M86-L202 HydrophobicContact CE-CD1 4.35Å; M86-L202 HydrophobicContact SD-CB 3.98Å; M86-L202 HydrophobicContact SD-CD1 3.77Å; M86-L202 HydrophobicContact SD-CG 4.33Å | ||
| 87 | N | 97.4 | Very high | 95.5 | Very high | 102 Ų | 102 | 61.5 Ų | 61.5 | 55% | 0.545 | 38% | 0.375 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.1 | 125.6 | 177.8 | -63.2 | -59.5 | 0 | 0 | 0 | 109.7 | F94 T95 | N87-F94 CarbonylContact O-C 3.59Å; N87-F94 WeakPolarHBondContact O-CA 3.48Å; N87-F94 VanDerWaalsContact O-CB 3.25Å; N87-F94 WeakPolarHBondContact O-CB 3.32Å; N87-T95 PolarHBondContact N-O 3.26Å; N87-T95 PolarHBondContact O-N 3.16Å |
| 88 | L | 96.9 | Very high | 95.5 | Very high | 63 Ų | 63 | 60.7 Ų | 60.7 | 33% | 0.33 | 37% | 0.371 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.7 | 132.6 | 172.8 | -174.8 | 64.3 | 0 | 0 | 0 | 109.7 | V70 Q71 I74 F94 | V70-L88 HydrophobicContact CG1-CD1 4.1Å; Q71-L88 HydrophobicContact CB-CD2 3.96Å; Q71-L88 HydrophobicContact CG-CD2 4.06Å; I74-L88 HydrophobicContact CD1-CB 4.01Å; I74-L88 HydrophobicContact CD1-CD1 4.11Å; L88-F94 HydrophobicContact CD1-CB 4.29Å |
| 89 | A | 95.6 | Very high | 95.4 | Very high | 43 Ų | 43 | 63.6 Ų | 63.6 | 36% | 0.355 | 38% | 0.382 | S | S | . | . | trans | -96.4 | 164.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111 | D91 G92 S93 | A89-D91 VanDerWaalsContact CB-OD1 3.32Å; A89-D91 WeakPolarHBondContact CB-OD1 3.37Å; A89-D91 PolarHBondContact O-N 3.49Å; A89-G92 PolarHBondContact O-N 2.96Å; A89-G92 VanDerWaalsContact O-N 3.16Å; A89-S93 WeakPolarHBondContact CB-O 3.49Å; A89-S93 PolarHBondContact N-O 2.95Å | ||
| 90 | A | 91.8 | Very high | 95.4 | Very high | 113 Ų | 113 | 59.4 Ų | 59.4 | 93% | 0.934 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.3 | -14 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | G92 | A90-G92 VanDerWaalsContact C-N 3.35Š|
| 91 | D | 91.1 | Very high | 95.3 | Very high | 125 Ų | 125 | 56.1 Ų | 56.1 | 67% | 0.668 | 33% | 0.331 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.5 | 9.8 | 177 | 65.2 | -8.9 | 0 | 0 | 0 | 112.8 | A89 S93 | A89-D91 VanDerWaalsContact CB-OD1 3.32Å; A89-D91 WeakPolarHBondContact CB-OD1 3.37Å; A89-D91 PolarHBondContact O-N 3.49Å; D91-S93 PolarHBondContact O-N 2.89Å; D91-S93 VanDerWaalsContact OD1-CB 3.24Å; D91-S93 WeakPolarHBondContact OD1-CB 3.38Å; D91-S93 PolarHBondContact OD1-N 3.45Å; D91-S93 PolarHBondContact OD1-OG 3.11Å; D91-S93 PolarHBondContact OD2-OG 3.34Å |
| 92 | G | 89.6 | Confident | 95 | Very high | 21 Ų | 21 | 54.4 Ų | 54.4 | 22% | 0.216 | 32% | 0.321 | C | S | . | . | S | Bend | trans | 77.7 | -6 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | A89 A90 | A89-G92 PolarHBondContact O-N 2.96Å; A89-G92 VanDerWaalsContact O-N 3.16Å; A90-G92 VanDerWaalsContact C-N 3.35Å |
| 93 | S | 95.2 | Very high | 94.8 | Very high | 34 Ų | 34 | 52.9 Ų | 52.9 | 24% | 0.238 | 30% | 0.296 | C | S | . | . | trans | -72.7 | 156.2 | 171.8 | 77.1 | 0 | 0 | 0 | 0 | 110.4 | A89 D91 | A89-S93 WeakPolarHBondContact CB-O 3.49Å; A89-S93 PolarHBondContact N-O 2.95Å; D91-S93 PolarHBondContact O-N 2.89Å; D91-S93 VanDerWaalsContact OD1-CB 3.24Å; D91-S93 WeakPolarHBondContact OD1-CB 3.38Å; D91-S93 PolarHBondContact OD1-N 3.45Å; D91-S93 PolarHBondContact OD1-OG 3.11Å; D91-S93 PolarHBondContact OD2-OG 3.34Å | ||
| 94 | F | 97.8 | Very high | 94.2 | Very high | 9 Ų | 9 | 46.4 Ų | 46.4 | 4% | 0.039 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.2 | 154.7 | 177.7 | 60.4 | -85.7 | 0 | 0 | 0 | 111.5 | V70 I74 M86 N87 L88 G149 S150 L198 V199 L202 | V70-F94 HydrophobicContact CG1-CD1 3.62Å; V70-F94 HydrophobicContact CG1-CE1 3.8Å; V70-F94 HydrophobicContact CG1-CG 4.38Å; V70-F94 HydrophobicContact CG2-CE1 4.46Å; I74-F94 HydrophobicContact CD1-CB 3.66Å; I74-F94 HydrophobicContact CD1-CD1 4.41Å; I74-F94 HydrophobicContact CD1-CD2 4.26Å; I74-F94 HydrophobicContact CD1-CG 3.89Å; M86-F94 HydrophobicContact SD-CD2 3.97Å; M86-F94 HydrophobicContact SD-CE2 3.99Å; N87-F94 CarbonylContact O-C 3.59Å; N87-F94 WeakPolarHBondContact O-CA 3.48Å; N87-F94 VanDerWaalsContact O-CB 3.25Å; N87-F94 WeakPolarHBondContact O-CB 3.32Å; L88-F94 HydrophobicContact CD1-CB 4.29Å; F94-G149 CarbonylContact O-C 3.51Å; F94-G149 WeakPolarHBondContact O-CA 3.3Å; F94-S150 VanDerWaalsContact CD1-CB 3.46Å; F94-S150 PolarHBondContact N-OG 2.91Å; F94-S150 WeakPolarHBondContact O-CB 3.42Å; F94-S150 PolarHBondContact O-N 3.28Å; F94-L198 HydrophobicContact CD2-CD2 3.62Å; F94-L198 HydrophobicContact CD2-CG 4.15Å; F94-L198 HydrophobicContact CE2-CB 4.49Å; F94-L198 HydrophobicContact CE2-CD2 3.71Å; F94-L198 HydrophobicContact CE2-CG 3.77Å; F94-V199 HydrophobicContact CZ-CG2 3.93Å; F94-L202 HydrophobicContact CD2-CD2 4.47Å; F94-L202 HydrophobicContact CE1-CD2 4.15Å; F94-L202 HydrophobicContact CE2-CB 4.21Å; F94-L202 HydrophobicContact CE2-CD2 3.79Å; F94-L202 HydrophobicContact CZ-CB 4.42Å; F94-L202 HydrophobicContact CZ-CD2 3.61Å |
| 95 | T | 98.6 | Very high | 92.6 | Very high | 45 Ų | 45 | 46.1 Ų | 46.1 | 28% | 0.276 | 27% | 0.268 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.7 | 157.4 | 176.7 | 75.5 | 0 | 0 | 0 | 0 | 110.6 | M86 N87 H147 I148 | M86-T95 CarbonylContact C-O 3.57Å; M86-T95 WeakPolarHBondContact CA-O 3.34Å; M86-T95 WeakPolarHBondContact CB-O 3.47Å; N87-T95 PolarHBondContact N-O 3.26Å; N87-T95 PolarHBondContact O-N 3.16Å; T95-H147 WeakPolarHBondContact CB-NE2 3.25Å; T95-H147 PolarHBondContact OG1-CE1 3.12Å; T95-H147 PolarHBondContact OG1-NE2 2.94Å; T95-H147 VanDerWaalsContact OG1-NE2 3.07Å; T95-I148 WeakPolarHBondContact CA-O 3.37Å; T95-I148 WeakPolarHBondContact CB-O 3.39Å |
| 96 | G | 98.1 | Very high | 90.8 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.288 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -178.3 | -169.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | H147 I148 | G96-H147 WeakPolarHBondContact O-CA 3.31Å; G96-H147 PolarHBondContact O-CD2 2.85Å; G96-H147 VanDerWaalsContact O-CD2 3.23Å; G96-I148 PolarHBondContact N-O 3.37Å; G96-I148 PolarHBondContact O-N 3.29Å |
| 97 | F | 98.1 | Very high | 88.9 | Confident | 60 Ų | 60 | 56.5 Ų | 56.5 | 26% | 0.263 | 31% | 0.311 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | 141.8 | -175.8 | -61.6 | -94.5 | 0 | 0 | 0 | 111.7 | N84 Q145 I146 H147 | N84-F97 HydrophobicContact CB-CB 4.13Å; N84-F97 HydrophobicContact CB-CD2 3.6Å; N84-F97 HydrophobicContact CB-CE2 4.21Å; N84-F97 HydrophobicContact CB-CG 3.95Å; F97-Q145 HydrophobicContact CB-CG 4.19Å; F97-Q145 HydrophobicContact CD1-CG 4.1Å; F97-I146 VanDerWaalsContact CA-O 3.31Å; F97-I146 WeakPolarHBondContact CA-O 3.37Å; F97-H147 HydrophobicContact CD1-CB 3.94Å; F97-H147 HydrophobicContact CE1-CB 3.71Å; F97-H147 AromaticContact CE1-CD2 4Å; F97-H147 AromaticContact CE2-CD2 3.8Å; F97-H147 HydrophobicContact CZ-CB 4.28Å; F97-H147 AromaticContact CZ-CD2 3.74Å |
| 98 | I | 97.7 | Very high | 86.8 | Confident | 2 Ų | 2 | 51.8 Ų | 51.8 | 1% | 0.01 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.2 | 149.5 | 163.7 | 66 | 167.4 | 0 | 0 | 0 | 109.9 | V100 Q145 I146 I148 V157 P197 L198 R201 F213 | I98-V100 HydrophobicContact CD1-CG2 3.88Å; I98-V100 HydrophobicContact CG1-CG2 4.21Å; I98-Q145 WeakPolarHBondContact O-CA 3.24Å; I98-I146 HydrophobicContact CD1-CD1 4.08Å; I98-I146 HydrophobicContact CD1-CG1 4.22Å; I98-I146 HydrophobicContact CG1-CD1 3.99Å; I98-I146 HydrophobicContact CG1-CG1 3.56Å; I98-I146 PolarHBondContact N-O 2.93Å; I98-I146 PolarHBondContact O-N 3.05Å; I98-I148 HydrophobicContact CD1-CD1 3.62Å; I98-I148 HydrophobicContact CG1-CD1 3.85Å; I98-I148 HydrophobicContact CG1-CG1 4.39Å; I98-I148 HydrophobicContact CG2-CD1 4.1Å; I98-V157 HydrophobicContact CD1-CG1 4.48Å; I98-V157 HydrophobicContact CD1-CG2 4.5Å; I98-P197 HydrophobicContact CD1-CB 3.86Å; I98-L198 HydrophobicContact CG2-CD1 4.02Å; I98-R201 HydrophobicContact CG2-CB 3.99Å; I98-R201 HydrophobicContact CG2-CG 4.22Å; I98-F213 HydrophobicContact CB-CD2 4.04Å; I98-F213 HydrophobicContact CB-CE2 4.03Å; I98-F213 HydrophobicContact CD1-CD2 4.16Å; I98-F213 HydrophobicContact CD1-CE2 4.34Å; I98-F213 HydrophobicContact CG2-CD2 4.4Å; I98-F213 HydrophobicContact CG2-CE2 3.87Å |
| 99 | K | 96.7 | Very high | 84.9 | Confident | 117 Ų | 117 | 50.2 Ų | 50.2 | 51% | 0.509 | 28% | 0.279 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.1 | 128.2 | 169.4 | -68.4 | 179 | -178.7 | 174.7 | 0 | 108.7 | V143 K144 Q145 | K99-V143 HydrophobicContact CB-CG1 4.15Å; K99-K144 WeakPolarHBondContact CA-O 3.45Å; K99-Q145 HydrophobicContact CG-CB 4.24Å; K99-Q145 HydrophobicContact CG-CG 4.15Å |
| 100 | V | 96.6 | Very high | 82.9 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 27% | 0.269 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.1 | 124.8 | 177.5 | -174.7 | 0 | 0 | 0 | 0 | 108.6 | I98 L102 V143 K144 V157 L161 L176 F213 L215 | I98-V100 HydrophobicContact CD1-CG2 3.88Å; I98-V100 HydrophobicContact CG1-CG2 4.21Å; V100-L102 WeakPolarHBondContact O-CD1 3.28Å; V100-V143 WeakPolarHBondContact O-CA 3.23Å; V100-K144 PolarHBondContact N-O 2.87Å; V100-K144 PolarHBondContact O-N 3.33Å; V100-V157 HydrophobicContact CG2-CG1 4.42Å; V100-L161 HydrophobicContact CB-CD1 3.94Å; V100-L161 HydrophobicContact CG1-CD1 3.67Å; V100-L161 HydrophobicContact CG2-CD1 4.08Å; V100-L176 HydrophobicContact CG1-CD1 3.64Å; V100-L176 HydrophobicContact CG2-CD1 4.49Å; V100-F213 CarbonylContact C-O 3.6Å; V100-F213 WeakPolarHBondContact CA-O 3.31Å; V100-F213 HydrophobicContact CB-CB 4.48Å; V100-F213 HydrophobicContact CG1-CB 4.44Å; V100-F213 HydrophobicContact CG2-CB 4.06Å; V100-L215 HydrophobicContact CG1-CB 3.92Å |
| 101 | H | 93.9 | Very high | 80.9 | Confident | 55 Ų | 55 | 48.4 Ų | 48.4 | 26% | 0.255 | 25% | 0.245 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -84.7 | 125.1 | 172.1 | -70 | -122.3 | 0 | 0 | 0 | 108.7 | F213 V214 L215 | H101-F213 PolarHBondContact N-O 3.11Å; H101-V214 HydrophobicContact CB-CG1 4.33Å; H101-V214 HydrophobicContact CB-CG2 4.19Å; H101-V214 CarbonylContact O-C 3.59Å; H101-V214 VanDerWaalsContact O-CA 3.31Å; H101-V214 WeakPolarHBondContact O-CA 3.25Å; H101-L215 PolarHBondContact O-N 3.32Å |
| 102 | L | 90.3 | Very high | 78.7 | Confident | 1 Ų | 1 | 43.9 Ų | 43.9 | 1% | 0.005 | 23% | 0.228 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -96.6 | 112.6 | 177.6 | -72.3 | 80.9 | 0 | 0 | 0 | 108.6 | V100 L138 C142 K144 F165 L215 | V100-L102 WeakPolarHBondContact O-CD1 3.28Å; L102-L138 HydrophobicContact CB-CD2 3.95Å; L102-L138 HydrophobicContact CD2-CD2 3.56Å; L102-L138 HydrophobicContact CG-CD2 4.41Å; L102-C142 HydrophobicContact CB-CB 4.33Å; L102-C142 WeakPolarHBondContact CB-O 3.26Å; L102-C142 WeakPolarHBondContact CD1-O 3.28Å; L102-C142 PolarHBondContact N-O 2.97Å; L102-K144 HydrophobicContact CD1-CB 3.88Å; L102-F165 HydrophobicContact CD1-CE2 4.01Å; L102-F165 HydrophobicContact CD1-CZ 4.39Å; L102-F165 HydrophobicContact CD2-CD2 3.34Å; L102-F165 HydrophobicContact CD2-CE2 3.26Å; L102-F165 HydrophobicContact CD2-CG 4.11Å; L102-F165 HydrophobicContact CD2-CZ 3.92Å; L102-F165 HydrophobicContact CG-CE2 4.31Å; L102-L215 HydrophobicContact CD2-CD2 4.27Å; L102-L215 HydrophobicContact CG-CB 4.43Å; L102-L215 HydrophobicContact CG-CD2 4.22Å |
| 103 | R | 86.5 | Confident | 76.7 | Confident | 94 Ų | 94 | 50.2 Ų | 50.2 | 36% | 0.355 | 26% | 0.257 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.5 | 75.9 | 174.3 | -70.9 | -169.5 | 176.8 | 168.8 | 8 | 108.7 | D141 V214 L215 K216 | R103-D141 IonicContact NE-OD1 3.04Å; R103-D141 PolarHBondContact NE-OD1 3.45Å; R103-V214 HydrophobicContact CB-CG1 4.3Å; R103-V214 HydrophobicContact CG-CG1 4.05Å; R103-L215 PolarHBondContact N-O 3.46Å; R103-K216 HydrophobicContact CB-CG 4.25Å |
| 104 | L | 80 | Confident | 74.5 | Confident | 8 Ų | 8 | 58.6 Ų | 58.6 | 4% | 0.042 | 28% | 0.284 | C | S | . | . | trans | -99.3 | 117.2 | 177.3 | -50.6 | -172.3 | 0 | 0 | 0 | 107.9 | V108 L138 V167 F174 L215 E217 | L104-V108 HydrophobicContact CB-CG2 4.49Å; L104-V108 HydrophobicContact CD1-CG2 4.21Å; L104-L138 HydrophobicContact CD1-CD2 3.92Å; L104-L138 HydrophobicContact CG-CD2 4.38Å; L104-V167 HydrophobicContact CD1-CG2 4.31Å; L104-F174 HydrophobicContact CD1-CE1 4.26Å; L104-F174 HydrophobicContact CD2-CD1 3.73Å; L104-F174 HydrophobicContact CD2-CE1 3.69Å; L104-L215 HydrophobicContact CD2-CD2 4.47Å; L104-L215 HydrophobicContact CD2-CG 4.4Å; L104-E217 HydrophobicContact CD2-CG 4.39Å | ||
| 105 | S | 59.5 | Low | 71.8 | Confident | 54 Ų | 54 | 60.8 Ų | 60.8 | 38% | 0.378 | 31% | 0.309 | S | S | . | . | trans | -91 | -21 | -170.3 | 15.7 | 0 | 0 | 0 | 0 | 112.8 | E217 E219 | S105-E217 PolarHBondContact N-OE1 2.78Å; S105-E219 WeakPolarHBondContact CB-OE1 3.5Å; S105-E219 PolarHBondContact OG-OE1 2.98Å | ||
| 106 | R | 58.4 | Low | 69.3 | Low | 164 Ų | 164 | 70.3 Ų | 70.3 | 62% | 0.619 | 34% | 0.34 | S | S | * | . | S | Bend | trans | -99 | 150.8 | -178.3 | -63.9 | -173 | -177.6 | -133.4 | -2 | 112 | V108 E217 | R106-V108 WeakPolarHBondContact O-CG2 3.46Å; R106-V108 PolarHBondContact O-N 3.01Å; R106-V108 VanDerWaalsContact O-N 3.09Å; R106-E217 VanDerWaalsContact CD-OE2 3.25Å; R106-E217 WeakPolarHBondContact CD-OE2 3.32Å; R106-E217 VanDerWaalsContact CG-OE2 3.28Å; R106-E217 WeakPolarHBondContact CG-OE2 3.48Å; R106-E217 PolarHBondContact N-OE1 3.1Å; R106-E217 VanDerWaalsContact N-OE1 3.12Å; R106-E217 IonicContact NE-OE2 3.47Å |
| 107 | P | 56.8 | Low | 66.2 | Low | 76 Ų | 76 | 74.2 Ų | 74.2 | 49% | 0.494 | 37% | 0.372 | S | S | . | . | P | Polyproline II helix | trans | -60.7 | 118.4 | 166.6 | 28.3 | -34.1 | 0 | 0 | 0 | 107.8 | ||
| 108 | V | 54.2 | Low | 63.7 | Low | 4 Ų | 4 | 77.3 Ų | 77.3 | 2% | 0.024 | 40% | 0.398 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.7 | 140.3 | -174.9 | -179 | 0 | 0 | 0 | 0 | 108.8 | L104 R106 V110 S135 F136 V167 | L104-V108 HydrophobicContact CB-CG2 4.49Å; L104-V108 HydrophobicContact CD1-CG2 4.21Å; R106-V108 WeakPolarHBondContact O-CG2 3.46Å; R106-V108 PolarHBondContact O-N 3.01Å; R106-V108 VanDerWaalsContact O-N 3.09Å; V108-V110 PolarHBondContact O-N 3.5Å; V108-S135 CarbonylContact O-C 3.53Å; V108-S135 WeakPolarHBondContact O-CA 3.29Å; V108-F136 PolarHBondContact N-O 3.4Å; V108-F136 PolarHBondContact O-N 3.36Å; V108-V167 HydrophobicContact CG1-CB 3.6Å; V108-V167 HydrophobicContact CG1-CG1 3.29Å; V108-V167 HydrophobicContact CG1-CG2 3.65Å |
| 109 | T | 55.7 | Low | 61 | Low | 30 Ų | 30 | 82.4 Ų | 82.4 | 18% | 0.184 | 43% | 0.434 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75 | 120.4 | 172.3 | -50.3 | 0 | 0 | 0 | 0 | 109.1 | R133 L168 | T109-R133 HydrophobicContact CG2-CB 3.62Å; T109-R133 HydrophobicContact CG2-CG 3.35Å; T109-L168 HydrophobicContact CG2-CD1 3.98Å; T109-L168 WeakPolarHBondContact O-CB 3.37Å; T109-L168 VanDerWaalsContact O-CG 3.32Å; T109-L168 WeakPolarHBondContact O-CG 3.47Å; T109-L168 PolarHBondContact O-N 3.31Å |
| 110 | V | 53.9 | Low | 58.6 | Low | 23 Ų | 23 | 85.6 Ų | 85.6 | 14% | 0.139 | 45% | 0.451 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.7 | 145.9 | 178.3 | 174.5 | 0 | 0 | 0 | 0 | 109.5 | V108 G112 T134 F136 M166 | V108-V110 PolarHBondContact O-N 3.5Å; V110-G112 PolarHBondContact O-N 3.4Å; V110-T134 PolarHBondContact N-O 2.99Å; V110-T134 VanDerWaalsContact N-O 3.11Å; V110-F136 HydrophobicContact CB-CD2 4.49Å; V110-F136 HydrophobicContact CG2-CB 4.32Å; V110-M166 WeakPolarHBondContact CA-O 3.46Å; V110-M166 HydrophobicContact CB-CB 4.42Å; V110-M166 HydrophobicContact CG1-CB 3.55Å; V110-M166 HydrophobicContact CG1-CE 4.05Å; V110-M166 HydrophobicContact CG1-CG 4.44Å; V110-M166 HydrophobicContact CG1-SD 4.16Å; V110-M166 HydrophobicContact CG2-CB 4.43Å |
| 111 | E | 49.8 | Very low | 55.8 | Low | 94 Ų | 94 | 93.6 Ų | 93.6 | 44% | 0.439 | 49% | 0.494 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.5 | 121.1 | 167.7 | -73 | -172.7 | 173 | 0 | 0 | 109.3 | M166 L168 | E111-M166 HydrophobicContact CB-CE 3.77Å; E111-M166 VanDerWaalsContact O-CE 3.32Å; E111-M166 WeakPolarHBondContact O-CE 3.3Å; E111-L168 HydrophobicContact CG-CD1 4.01Å; E111-L168 HydrophobicContact CG-CD2 4.17Å |
| 112 | G | 45.3 | Very low | 53.5 | Low | 30 Ų | 30 | 99.6 Ų | 99.6 | 31% | 0.309 | 52% | 0.522 | S | S | . | . | trans | -58.1 | 138.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | V110 R114 | V110-G112 PolarHBondContact O-N 3.4Å; G112-R114 PolarHBondContact O-N 2.94Å; G112-R114 VanDerWaalsContact O-N 3.15Å | ||
| 113 | D | 48.6 | Very low | 50.8 | Low | 154 Ų | 154 | 107.3 Ų | 107.3 | 82% | 0.824 | 56% | 0.563 | S | S | * | * | trans | -45.7 | 117.5 | 177.5 | -176.7 | 28 | 0 | 0 | 0 | 111.1 | G115 | D113-G115 PolarHBondContact O-N 3.35Š| ||
| 114 | R | 48.7 | Very low | 48.6 | Very low | 210 Ų | 210 | 106.4 Ų | 106.4 | 79% | 0.792 | 58% | 0.583 | S | S | * | * | trans | -78.3 | 72.9 | 165.8 | -68.6 | -164.8 | -165.4 | -165.4 | 8.1 | 107.9 | G112 R116 | G112-R114 PolarHBondContact O-N 2.94Å; G112-R114 VanDerWaalsContact O-N 3.15Å; R114-R116 PolarHBondContact O-N 2.95Å | ||
| 115 | G | 40.4 | Very low | 46.5 | Very low | 56 Ų | 56 | 115.1 Ų | 115.1 | 58% | 0.577 | 62% | 0.624 | S | S | * | * | trans | -51.8 | 108.8 | 163 | 0 | 0 | 0 | 0 | 0 | 108.8 | D113 A117 | D113-G115 PolarHBondContact O-N 3.35Å; G115-A117 PolarHBondContact O-N 2.76Å; G115-A117 VanDerWaalsContact O-N 3.09Å | ||
| 116 | R | 45.3 | Very low | 45.8 | Very low | 244 Ų | 244 | 122.2 Ų | 122.2 | 92% | 0.921 | 65% | 0.651 | S | S | * | * | trans | -63.2 | 103.1 | 175 | -177.7 | -178.1 | -172.3 | 175 | 1.8 | 108.7 | R114 | R114-R116 PolarHBondContact O-N 2.95Š| ||
| 117 | A | 34.8 | Very low | 44.6 | Very low | 82 Ų | 82 | 117.4 Ų | 117.4 | 68% | 0.678 | 65% | 0.652 | S | S | * | * | trans | -121.3 | 118.1 | 158.7 | 0 | 0 | 0 | 0 | 0 | 108 | G115 | G115-A117 PolarHBondContact O-N 2.76Å; G115-A117 VanDerWaalsContact O-N 3.09Å | ||
| 118 | P | 45.1 | Very low | 44 | Very low | 125 Ų | 125 | 122.8 Ų | 122.8 | 81% | 0.812 | 67% | 0.668 | S | S | * | * | trans | -87.4 | 109.2 | 165.7 | 31.9 | -22.5 | 0 | 0 | 0 | 107.7 | ||||
| 119 | S | 40.6 | Very low | 43.4 | Very low | 110 Ų | 110 | 133.5 Ų | 133.5 | 77% | 0.769 | 71% | 0.708 | S | S | * | * | trans | -147.4 | 119.3 | 155.7 | 54.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 120 | E | 45.5 | Very low | 42.8 | Very low | 184 Ų | 184 | 137.2 Ų | 137.2 | 86% | 0.86 | 73% | 0.73 | S | S | * | * | trans | -53.9 | 136.3 | 175.8 | -60.7 | 161.8 | 138.9 | 0 | 0 | 110.1 | ||||
| 121 | D | 37.8 | Very low | 42.7 | Very low | 167 Ų | 167 | 142.2 Ų | 142.2 | 89% | 0.893 | 75% | 0.752 | S | S | * | * | trans | -168.1 | 136.5 | 132.8 | -92.5 | -30.1 | 0 | 0 | 0 | 110.3 | ||||
| 122 | Q | 46.3 | Very low | 42.7 | Very low | 181 Ų | 181 | 146.2 Ų | 146.2 | 85% | 0.846 | 77% | 0.768 | S | S | * | * | trans | -74.2 | 135.1 | -179.7 | -67.9 | 166.7 | 75.3 | 0 | 0 | 110.1 | ||||
| 123 | D | 34.4 | Very low | 43 | Very low | 163 Ų | 163 | 152.4 Ų | 152.4 | 87% | 0.872 | 78% | 0.782 | S | S | * | * | 179.3 | 147.4 | 117.5 | -101.5 | -29.8 | 0 | 0 | 0 | 111.5 | |||||
| 124 | G | 40 | Very low | 43.2 | Very low | 75 Ų | 75 | 147.4 Ų | 147.4 | 77% | 0.773 | 76% | 0.757 | S | S | * | * | trans | -78.5 | 137.9 | -168.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 125 | E | 34.8 | Very low | 43.4 | Very low | 191 Ų | 191 | 141.5 Ų | 141.5 | 89% | 0.893 | 75% | 0.748 | S | S | * | * | trans | -162.2 | 147.4 | 140.2 | -147.9 | 169 | 140.9 | 0 | 0 | 107.8 | G127 | E125-G127 PolarHBondContact O-N 3.5Š| ||
| 126 | Q | 45.3 | Very low | 44.3 | Very low | 204 Ų | 204 | 144.7 Ų | 144.7 | 95% | 0.953 | 75% | 0.747 | S | S | * | * | trans | -66.8 | 74 | 177.6 | -82.6 | 166.4 | -1 | 0 | 0 | 110.9 | K128 | Q126-K128 PolarHBondContact O-N 3.04Š| ||
| 127 | G | 33.4 | Very low | 44.7 | Very low | 62 Ų | 62 | 139.1 Ų | 139.1 | 64% | 0.639 | 73% | 0.726 | S | S | * | * | trans | -80.7 | 105.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | E125 R129 | E125-G127 PolarHBondContact O-N 3.5Å; G127-R129 PolarHBondContact O-N 3.17Å | ||
| 128 | K | 45.3 | Very low | 46.1 | Very low | 190 Ų | 190 | 136.5 Ų | 136.5 | 83% | 0.826 | 70% | 0.701 | S | S | * | * | trans | -28.6 | 106 | 160.9 | -155.1 | 178.2 | -168.7 | 179.9 | 0 | 109.5 | Q126 T130 | Q126-K128 PolarHBondContact O-N 3.04Å; K128-T130 PolarHBondContact O-N 2.98Å | ||
| 129 | R | 41.2 | Very low | 46.8 | Very low | 228 Ų | 228 | 134.9 Ų | 134.9 | 86% | 0.86 | 69% | 0.69 | S | S | * | * | trans | -64.7 | 85.5 | 171.8 | -69.3 | -177.1 | 179.1 | -162.2 | -0.6 | 106.8 | G127 E131 | G127-R129 PolarHBondContact O-N 3.17Å; R129-E131 PolarHBondContact O-N 3.09Å | ||
| 130 | T | 43.1 | Very low | 47.7 | Very low | 108 Ų | 108 | 133.5 Ų | 133.5 | 66% | 0.663 | 68% | 0.68 | S | S | * | * | trans | -67.4 | 97.5 | 163.4 | 44.9 | 0 | 0 | 0 | 0 | 104.5 | K128 K132 | K128-T130 PolarHBondContact O-N 2.98Å; T130-K132 PolarHBondContact O-N 3.12Å | ||
| 131 | E | 51.3 | Low | 48.7 | Very low | 129 Ų | 129 | 129.3 Ų | 129.3 | 60% | 0.603 | 66% | 0.664 | S | S | * | * | trans | -43.8 | 114.5 | 160.5 | -84.3 | 171.7 | 179.6 | 0 | 0 | 106.1 | R129 R133 | R129-E131 PolarHBondContact O-N 3.09Å; E131-R133 PolarHBondContact O-N 3.48Å | ||
| 132 | K | 50.3 | Low | 51 | Low | 177 Ų | 177 | 122.8 Ų | 122.8 | 77% | 0.77 | 63% | 0.631 | S | S | * | * | trans | -67 | 80.1 | 172.6 | -71.8 | 178 | 179.4 | 175.9 | 0 | 106.1 | T130 T134 | T130-K132 PolarHBondContact O-N 3.12Å; K132-T134 PolarHBondContact O-N 2.97Å | ||
| 133 | R | 52.1 | Low | 53.2 | Low | 161 Ų | 161 | 117.5 Ų | 117.5 | 61% | 0.608 | 61% | 0.611 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -65.9 | 100.1 | 171.5 | -87.9 | -173.1 | 158.3 | -172.1 | -9.9 | 106.5 | T109 E131 | T109-R133 HydrophobicContact CG2-CB 3.62Å; T109-R133 HydrophobicContact CG2-CG 3.35Å; E131-R133 PolarHBondContact O-N 3.48Å |
| 134 | T | 51.3 | Low | 56 | Low | 48 Ų | 48 | 112.7 Ų | 112.7 | 29% | 0.294 | 58% | 0.582 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -95.1 | 123.8 | 172.7 | 46 | 0 | 0 | 0 | 0 | 107.8 | V110 K132 F136 | V110-T134 PolarHBondContact N-O 2.99Å; V110-T134 VanDerWaalsContact N-O 3.11Å; K132-T134 PolarHBondContact O-N 2.97Å; T134-F136 VanDerWaalsContact CB-CE2 3.46Å; T134-F136 HydrophobicContact CG2-CE2 4.23Å; T134-F136 PolarHBondContact O-N 2.82Å; T134-F136 WeakPolarHBondContact OG1-CD2 3.4Å; T134-F136 WeakPolarHBondContact OG1-CE2 3.42Å |
| 135 | S | 53.9 | Low | 58.6 | Low | 86 Ų | 86 | 112.7 Ų | 112.7 | 60% | 0.601 | 56% | 0.562 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -78.8 | 101.3 | 174.6 | 64.7 | 0 | 0 | 0 | 0 | 107.9 | V108 | V108-S135 CarbonylContact O-C 3.53Å; V108-S135 WeakPolarHBondContact O-CA 3.29Å |
| 136 | F | 57.9 | Low | 61.6 | Low | 124 Ų | 124 | 104.7 Ų | 104.7 | 54% | 0.544 | 53% | 0.526 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 138.9 | 176 | -82.9 | -78.4 | 0 | 0 | 0 | 109.8 | V108 V110 T134 L138 | V108-F136 PolarHBondContact N-O 3.4Å; V108-F136 PolarHBondContact O-N 3.36Å; V110-F136 HydrophobicContact CB-CD2 4.49Å; V110-F136 HydrophobicContact CG2-CB 4.32Å; T134-F136 VanDerWaalsContact CB-CE2 3.46Å; T134-F136 HydrophobicContact CG2-CE2 4.23Å; T134-F136 PolarHBondContact O-N 2.82Å; T134-F136 WeakPolarHBondContact OG1-CD2 3.4Å; T134-F136 WeakPolarHBondContact OG1-CE2 3.42Å; F136-L138 PolarHBondContact O-N 3.41Å |
| 137 | Y | 55.2 | Low | 64.1 | Low | 126 Ų | 126 | 99.8 Ų | 99.8 | 49% | 0.494 | 50% | 0.502 | S | S | . | . | P | Polyproline II helix | trans | -78.7 | 120.9 | 170.5 | -156.4 | -105.3 | 0 | 0 | 0 | 107.9 | ||
| 138 | L | 62.7 | Low | 67.2 | Low | 28 Ų | 28 | 97.6 Ų | 97.6 | 15% | 0.147 | 48% | 0.476 | C | S | . | . | P | Polyproline II helix | trans | -65.5 | 132.4 | 162.6 | -173.2 | 69.7 | 0 | 0 | 0 | 106.7 | L102 L104 F136 S140 C142 F165 | L102-L138 HydrophobicContact CB-CD2 3.95Å; L102-L138 HydrophobicContact CD2-CD2 3.56Å; L102-L138 HydrophobicContact CG-CD2 4.41Å; L104-L138 HydrophobicContact CD1-CD2 3.92Å; L104-L138 HydrophobicContact CG-CD2 4.38Å; F136-L138 PolarHBondContact O-N 3.41Å; L138-S140 PolarHBondContact O-N 3.43Å; L138-S140 VanDerWaalsContact O-N 3.12Å; L138-C142 HydrophobicContact CD2-CB 4.33Å; L138-C142 HydrophobicContact CG-CB 4.42Å; L138-F165 HydrophobicContact CD1-CB 4.24Å; L138-F165 HydrophobicContact CD1-CD1 3.26Å; L138-F165 HydrophobicContact CD1-CE1 3.73Å; L138-F165 HydrophobicContact CD1-CG 3.96Å; L138-F165 HydrophobicContact CD2-CD1 4.21Å; L138-F165 HydrophobicContact CD2-CE1 4.5Å; L138-F165 HydrophobicContact CD2-CG 4.27Å; L138-F165 HydrophobicContact CG-CD1 4.39Å |
| 139 | P | 59.6 | Low | 69.7 | Low | 91 Ų | 91 | 89.5 Ų | 89.5 | 59% | 0.591 | 45% | 0.446 | S | S | * | . | P | Polyproline II helix | trans | -49.3 | 125.2 | 177.6 | -27 | 34.4 | 0 | 0 | 0 | 110.4 | D141 C142 | P139-D141 PolarHBondContact O-N 2.89Å; P139-C142 PolarHBondContact O-N 3.25Å |
| 140 | S | 59.7 | Low | 72.4 | Confident | 80 Ų | 80 | 79.2 Ų | 79.2 | 56% | 0.559 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.9 | 133 | 177.5 | 50.7 | 0 | 0 | 0 | 0 | 109.3 | L138 | L138-S140 PolarHBondContact O-N 3.43Å; L138-S140 VanDerWaalsContact O-N 3.12Å |
| 141 | D | 67.9 | Low | 75 | Confident | 96 Ų | 96 | 80.2 Ų | 80.2 | 51% | 0.513 | 41% | 0.41 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 64.9 | 41.7 | -177.5 | -62.1 | -45.9 | 0 | 0 | 0 | 115.3 | R103 P139 V143 | R103-D141 IonicContact NE-OD1 3.04Å; R103-D141 PolarHBondContact NE-OD1 3.45Å; P139-D141 PolarHBondContact O-N 2.89Å; D141-V143 PolarHBondContact O-N 3.05Å |
| 142 | C | 85.3 | Confident | 77.2 | Confident | 31 Ų | 31 | 75.6 Ų | 75.6 | 21% | 0.209 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.9 | 123.9 | 167.1 | -174.9 | 0 | 0 | 0 | 0 | 110.7 | L102 L138 P139 | L102-C142 HydrophobicContact CB-CB 4.33Å; L102-C142 WeakPolarHBondContact CB-O 3.26Å; L102-C142 WeakPolarHBondContact CD1-O 3.28Å; L102-C142 PolarHBondContact N-O 2.97Å; L138-C142 HydrophobicContact CD2-CB 4.33Å; L138-C142 HydrophobicContact CG-CB 4.42Å; P139-C142 PolarHBondContact O-N 3.25Å |
| 143 | V | 91.8 | Very high | 79.5 | Confident | 69 Ų | 69 | 68.7 Ų | 68.7 | 42% | 0.418 | 36% | 0.363 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.7 | 126.4 | 171.1 | -176 | 0 | 0 | 0 | 0 | 109.5 | K99 V100 D141 | K99-V143 HydrophobicContact CB-CG1 4.15Å; V100-V143 WeakPolarHBondContact O-CA 3.23Å; D141-V143 PolarHBondContact O-N 3.05Å |
| 144 | K | 93.4 | Very high | 81.7 | Confident | 62 Ų | 62 | 61 Ų | 61 | 27% | 0.27 | 33% | 0.334 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 121.9 | 175.2 | -161.4 | 70.8 | -172.3 | -171.5 | 0 | 112.3 | K99 V100 L102 I146 L161 K164 F165 | K99-K144 WeakPolarHBondContact CA-O 3.45Å; V100-K144 PolarHBondContact N-O 2.87Å; V100-K144 PolarHBondContact O-N 3.33Å; L102-K144 HydrophobicContact CD1-CB 3.88Å; K144-I146 HydrophobicContact CG-CG2 3.92Å; K144-L161 HydrophobicContact CB-CD2 4.03Å; K144-L161 HydrophobicContact CG-CD2 4.05Å; K144-K164 HydrophobicContact CD-CD 4.45Å; K144-K164 HydrophobicContact CG-CD 4.48Å; K144-F165 HydrophobicContact CB-CE2 4.13Å; K144-F165 HydrophobicContact CB-CZ 4.16Å; K144-F165 HydrophobicContact CD-CE2 4.25Å; K144-F165 HydrophobicContact CD-CZ 3.84Å; K144-F165 HydrophobicContact CG-CE2 4.17Å; K144-F165 HydrophobicContact CG-CZ 4.22Å |
| 145 | Q | 96 | Very high | 84 | Confident | 75 Ų | 75 | 60.3 Ų | 60.3 | 35% | 0.35 | 33% | 0.331 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.6 | 130.2 | 165.2 | -165 | 172.7 | 17.9 | 0 | 0 | 109.9 | N84 F97 I98 K99 | N84-Q145 VanDerWaalsContact CG-NE2 3.27Å; N84-Q145 PolarHBondContact ND2-NE2 3Å; F97-Q145 HydrophobicContact CB-CG 4.19Å; F97-Q145 HydrophobicContact CD1-CG 4.1Å; I98-Q145 WeakPolarHBondContact O-CA 3.24Å; K99-Q145 HydrophobicContact CG-CB 4.24Å; K99-Q145 HydrophobicContact CG-CG 4.15Å |
| 146 | I | 97.3 | Very high | 86.1 | Confident | 24 Ų | 24 | 61 Ų | 61 | 12% | 0.123 | 33% | 0.325 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.9 | 143.8 | 178.3 | 60.4 | 174.2 | 0 | 0 | 0 | 109.9 | F97 I98 K144 I148 V157 L161 | F97-I146 VanDerWaalsContact CA-O 3.31Å; F97-I146 WeakPolarHBondContact CA-O 3.37Å; I98-I146 HydrophobicContact CD1-CD1 4.08Å; I98-I146 HydrophobicContact CD1-CG1 4.22Å; I98-I146 HydrophobicContact CG1-CD1 3.99Å; I98-I146 HydrophobicContact CG1-CG1 3.56Å; I98-I146 PolarHBondContact N-O 2.93Å; I98-I146 PolarHBondContact O-N 3.05Å; K144-I146 HydrophobicContact CG-CG2 3.92Å; I146-I148 HydrophobicContact CB-CG2 4.46Å; I146-I148 HydrophobicContact CD1-CG2 3.79Å; I146-I148 HydrophobicContact CG1-CG2 3.98Å; I146-V157 HydrophobicContact CD1-CG1 3.92Å; I146-V157 HydrophobicContact CD1-CG2 4.33Å; I146-L161 HydrophobicContact CG2-CD2 4.03Å |
| 147 | H | 97.9 | Very high | 88 | Confident | 100 Ų | 100 | 55.3 Ų | 55.3 | 46% | 0.463 | 30% | 0.3 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.7 | 125.1 | 171.4 | -176.7 | -109.4 | 0 | 0 | 0 | 108.6 | T95 G96 F97 | T95-H147 WeakPolarHBondContact CB-NE2 3.25Å; T95-H147 PolarHBondContact OG1-CE1 3.12Å; T95-H147 PolarHBondContact OG1-NE2 2.94Å; T95-H147 VanDerWaalsContact OG1-NE2 3.07Å; G96-H147 WeakPolarHBondContact O-CA 3.31Å; G96-H147 PolarHBondContact O-CD2 2.85Å; G96-H147 VanDerWaalsContact O-CD2 3.23Å; F97-H147 HydrophobicContact CD1-CB 3.94Å; F97-H147 HydrophobicContact CE1-CB 3.71Å; F97-H147 AromaticContact CE1-CD2 4Å; F97-H147 AromaticContact CE2-CD2 3.8Å; F97-H147 HydrophobicContact CZ-CB 4.28Å; F97-H147 AromaticContact CZ-CD2 3.74Å |
| 148 | I | 98.4 | Very high | 90 | Very high | 17 Ų | 17 | 49.5 Ų | 49.5 | 9% | 0.087 | 28% | 0.278 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.3 | 166.9 | -174.8 | 59.8 | 169.2 | 0 | 0 | 0 | 110.5 | T95 G96 I98 I146 T152 V157 P197 L198 | T95-I148 WeakPolarHBondContact CA-O 3.37Å; T95-I148 WeakPolarHBondContact CB-O 3.39Å; G96-I148 PolarHBondContact N-O 3.37Å; G96-I148 PolarHBondContact O-N 3.29Å; I98-I148 HydrophobicContact CD1-CD1 3.62Å; I98-I148 HydrophobicContact CG1-CD1 3.85Å; I98-I148 HydrophobicContact CG1-CG1 4.39Å; I98-I148 HydrophobicContact CG2-CD1 4.1Å; I146-I148 HydrophobicContact CB-CG2 4.46Å; I146-I148 HydrophobicContact CD1-CG2 3.79Å; I146-I148 HydrophobicContact CG1-CG2 3.98Å; I148-T152 HydrophobicContact CB-CG2 4.09Å; I148-T152 HydrophobicContact CG2-CG2 4.1Å; I148-V157 HydrophobicContact CD1-CG2 4.35Å; I148-P197 HydrophobicContact CD1-CB 4.38Å; I148-L198 HydrophobicContact CD1-CB 3.84Å; I148-L198 HydrophobicContact CD1-CD1 4.48Å; I148-L198 HydrophobicContact CG1-CB 4.04Å; I148-L198 HydrophobicContact CG1-CD1 4.08Å; I148-L198 HydrophobicContact CG1-CG 4.42Å; I148-L198 WeakPolarHBondContact O-CD2 3.38Å |
| 149 | G | 98.3 | Very high | 91.6 | Very high | 19 Ų | 19 | 52.9 Ų | 52.9 | 20% | 0.196 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.8 | 167.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | F94 L151 T152 | F94-G149 CarbonylContact O-C 3.51Å; F94-G149 WeakPolarHBondContact O-CA 3.3Å; G149-L151 PolarHBondContact O-N 3.38Å; G149-T152 PolarHBondContact N-OG1 3.09Å; G149-T152 WeakPolarHBondContact O-CB 3.42Å; G149-T152 PolarHBondContact O-N 3Å; G149-T152 VanDerWaalsContact O-N 3.08Å; G149-T152 PolarHBondContact O-OG1 3.06Å |
| 150 | S | 97.6 | Very high | 93.3 | Very high | 12 Ų | 12 | 50.5 Ų | 50.5 | 8% | 0.084 | 29% | 0.285 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.3 | -30.2 | 178.4 | 56.6 | 0 | 0 | 0 | 0 | 112.7 | F94 H196 | F94-S150 VanDerWaalsContact CD1-CB 3.46Å; F94-S150 PolarHBondContact N-OG 2.91Å; F94-S150 WeakPolarHBondContact O-CB 3.42Å; F94-S150 PolarHBondContact O-N 3.28Å; S150-H196 WeakPolarHBondContact O-CB 3.42Å |
| 151 | L | 97.1 | Very high | 94.9 | Very high | 130 Ų | 130 | 46.8 Ų | 46.8 | 68% | 0.681 | 26% | 0.258 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.5 | -9.3 | 176.7 | -59.8 | 179.6 | 0 | 0 | 0 | 113.7 | G149 T153 H196 | G149-L151 PolarHBondContact O-N 3.38Å; L151-T153 PolarHBondContact O-N 2.99Å; L151-T153 VanDerWaalsContact O-N 3.13Å; L151-H196 PolarHBondContact O-CE1 2.63Å; L151-H196 PolarHBondContact O-ND1 3.33Å; L151-H196 VanDerWaalsContact O-ND1 3.16Å |
| 152 | T | 98.6 | Very high | 96 | Very high | 32 Ų | 32 | 42.4 Ų | 42.4 | 20% | 0.196 | 24% | 0.235 | C | C | . | . | trans | -62.8 | 120.8 | 180 | -56.6 | 0 | 0 | 0 | 0 | 109.6 | I148 G149 E156 V157 P197 | I148-T152 HydrophobicContact CB-CG2 4.09Å; I148-T152 HydrophobicContact CG2-CG2 4.1Å; G149-T152 PolarHBondContact N-OG1 3.09Å; G149-T152 WeakPolarHBondContact O-CB 3.42Å; G149-T152 PolarHBondContact O-N 3Å; G149-T152 VanDerWaalsContact O-N 3.08Å; G149-T152 PolarHBondContact O-OG1 3.06Å; T152-E156 WeakPolarHBondContact CA-OE2 3.49Å; T152-E156 HydrophobicContact CG2-CB 4.03Å; T152-V157 HydrophobicContact CG2-CG2 3.92Å; T152-P197 VanDerWaalsContact O-CD 3.27Å; T152-P197 WeakPolarHBondContact O-CD 3.4Å | ||
| 153 | T | 98.6 | Very high | 96.3 | Very high | 31 Ų | 31 | 49.3 Ų | 49.3 | 19% | 0.19 | 26% | 0.261 | C | S | . | . | trans | -83.4 | 160.2 | -177.2 | 61 | 0 | 0 | 0 | 0 | 111.8 | L151 S155 E156 V157 E195 | L151-T153 PolarHBondContact O-N 2.99Å; L151-T153 VanDerWaalsContact O-N 3.13Å; T153-S155 PolarHBondContact O-N 3.1Å; T153-E156 PolarHBondContact N-OE2 3.15Å; T153-E156 PolarHBondContact O-N 2.93Å; T153-E156 VanDerWaalsContact O-N 3.15Å; T153-E156 VanDerWaalsContact OG1-CG 3.3Å; T153-E156 WeakPolarHBondContact OG1-CG 3.42Å; T153-E156 PolarHBondContact OG1-N 3.35Å; T153-E156 PolarHBondContact OG1-OE2 2.82Å; T153-V157 WeakPolarHBondContact O-CG2 3.4Å; T153-V157 PolarHBondContact O-N 3.36Å; T153-E195 CarbonylContact C-O 3.49Å; T153-E195 VanDerWaalsContact CA-O 3.31Å; T153-E195 WeakPolarHBondContact CA-O 3.16Å | ||
| 154 | T | 98.4 | Very high | 96.1 | Very high | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -56.4 | -40 | 172.7 | -62.5 | 0 | 0 | 0 | 0 | 111.3 | E156 V157 I158 L176 L191 P192 L193 E195 | T154-E156 PolarHBondContact O-N 3.39Å; T154-V157 PolarHBondContact O-N 2.96Å; T154-I158 HydrophobicContact CG2-CD1 4.06Å; T154-I158 VanDerWaalsContact O-CG1 3.29Å; T154-I158 WeakPolarHBondContact O-CG1 3.31Å; T154-I158 PolarHBondContact O-N 3Å; T154-L176 HydrophobicContact CG2-CB 3.7Å; T154-L176 HydrophobicContact CG2-CD2 4.04Å; T154-L176 HydrophobicContact CG2-CG 4.49Å; T154-L191 HydrophobicContact CG2-CB 3.86Å; T154-P192 VanDerWaalsContact CB-O 3.28Å; T154-P192 WeakPolarHBondContact CB-O 3.47Å; T154-P192 PolarHBondContact OG1-O 2.95Å; T154-L193 PolarHBondContact N-O 3.27Å; T154-E195 PolarHBondContact N-O 3.31Å; T154-E195 WeakPolarHBondContact OG1-CB 3.46Å; T154-E195 PolarHBondContact OG1-O 3.46Å |
| 155 | S | 97.8 | Very high | 95.7 | Very high | 34 Ų | 34 | 50.2 Ų | 50.2 | 24% | 0.238 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -57.5 | -47.1 | 174.6 | -173.6 | 0 | 0 | 0 | 0 | 112.6 | T153 I158 Q159 L193 | T153-S155 PolarHBondContact O-N 3.1Å; S155-I158 PolarHBondContact O-N 3.37Å; S155-Q159 VanDerWaalsContact O-CG 3.3Å; S155-Q159 WeakPolarHBondContact O-CG 3.25Å; S155-Q159 PolarHBondContact O-N 3.29Å; S155-Q159 PolarHBondContact OG-NE2 3.18Å; S155-Q159 VanDerWaalsContact OG-NE2 3.14Å; S155-L193 PolarHBondContact N-O 2.76Å; S155-L193 VanDerWaalsContact N-O 3.09Å |
| 156 | E | 98.4 | Very high | 95.1 | Very high | 101 Ų | 101 | 50.9 Ų | 50.9 | 47% | 0.472 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -66.9 | -37.8 | 179.4 | -70.2 | 166.5 | 134.1 | 0 | 0 | 112 | T152 T153 T154 Q159 G160 | T152-E156 WeakPolarHBondContact CA-OE2 3.49Å; T152-E156 HydrophobicContact CG2-CB 4.03Å; T153-E156 PolarHBondContact N-OE2 3.15Å; T153-E156 PolarHBondContact O-N 2.93Å; T153-E156 VanDerWaalsContact O-N 3.15Å; T153-E156 VanDerWaalsContact OG1-CG 3.3Å; T153-E156 WeakPolarHBondContact OG1-CG 3.42Å; T153-E156 PolarHBondContact OG1-N 3.35Å; T153-E156 PolarHBondContact OG1-OE2 2.82Å; T154-E156 PolarHBondContact O-N 3.39Å; E156-Q159 PolarHBondContact O-N 2.93Å; E156-G160 PolarHBondContact O-N 2.71Å |
| 157 | V | 98.3 | Very high | 94.5 | Very high | 4 Ų | 4 | 50.3 Ų | 50.3 | 2% | 0.024 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.1 | -47.3 | 174 | 172.4 | 0 | 0 | 0 | 0 | 110.8 | I98 V100 I146 I148 T152 T153 T154 G160 L161 L176 P197 | I98-V157 HydrophobicContact CD1-CG1 4.48Å; I98-V157 HydrophobicContact CD1-CG2 4.5Å; V100-V157 HydrophobicContact CG2-CG1 4.42Å; I146-V157 HydrophobicContact CD1-CG1 3.92Å; I146-V157 HydrophobicContact CD1-CG2 4.33Å; I148-V157 HydrophobicContact CD1-CG2 4.35Å; T152-V157 HydrophobicContact CG2-CG2 3.92Å; T153-V157 WeakPolarHBondContact O-CG2 3.4Å; T153-V157 PolarHBondContact O-N 3.36Å; T154-V157 PolarHBondContact O-N 2.96Å; V157-G160 PolarHBondContact O-N 3.48Å; V157-L161 HydrophobicContact CG1-CD1 3.81Å; V157-L161 HydrophobicContact CG1-CG 4.42Å; V157-L161 WeakPolarHBondContact O-CB 3.4Å; V157-L161 VanDerWaalsContact O-CG 3.25Å; V157-L161 WeakPolarHBondContact O-CG 3.29Å; V157-L161 PolarHBondContact O-N 3.41Å; V157-L176 HydrophobicContact CB-CD2 4.35Å; V157-L176 HydrophobicContact CG1-CD2 3.9Å; V157-P197 HydrophobicContact CG2-CG 4.08Å |
| 158 | I | 96.6 | Very high | 93.7 | Very high | 4 Ų | 4 | 48.6 Ų | 48.6 | 2% | 0.021 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -58.8 | -55 | 177.3 | -66.5 | 164 | 0 | 0 | 0 | 109.6 | T154 S155 G160 L161 L162 P171 F174 L176 L193 L215 | T154-I158 HydrophobicContact CG2-CD1 4.06Å; T154-I158 VanDerWaalsContact O-CG1 3.29Å; T154-I158 WeakPolarHBondContact O-CG1 3.31Å; T154-I158 PolarHBondContact O-N 3Å; S155-I158 PolarHBondContact O-N 3.37Å; I158-G160 VanDerWaalsContact C-N 3.34Å; I158-G160 PolarHBondContact O-N 3.08Å; I158-L161 PolarHBondContact O-N 2.76Å; I158-L162 HydrophobicContact CG2-CD1 3.76Å; I158-L162 HydrophobicContact CG2-CG 4.29Å; I158-L162 VanDerWaalsContact O-CG 3.25Å; I158-L162 WeakPolarHBondContact O-CG 3.29Å; I158-L162 PolarHBondContact O-N 2.92Å; I158-P171 HydrophobicContact CG2-CB 4.35Å; I158-F174 HydrophobicContact CG2-CB 4.04Å; I158-L176 HydrophobicContact CD1-CB 4.24Å; I158-L176 HydrophobicContact CG1-CB 4.11Å; I158-L193 HydrophobicContact CD1-CD2 3.8Å; I158-L215 HydrophobicContact CB-CD1 4.39Å; I158-L215 HydrophobicContact CG1-CD1 3.85Å; I158-L215 HydrophobicContact CG2-CD1 4.21Å |
| 159 | Q | 95.8 | Very high | 93 | Very high | 99 Ų | 99 | 49.8 Ų | 49.8 | 46% | 0.463 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -59.3 | -43.6 | -178.5 | -69.3 | 175.6 | 29.3 | 0 | 0 | 112.5 | S155 E156 L162 K163 P171 | S155-Q159 VanDerWaalsContact O-CG 3.3Å; S155-Q159 WeakPolarHBondContact O-CG 3.25Å; S155-Q159 PolarHBondContact O-N 3.29Å; S155-Q159 PolarHBondContact OG-NE2 3.18Å; S155-Q159 VanDerWaalsContact OG-NE2 3.14Å; E156-Q159 PolarHBondContact O-N 2.93Å; Q159-L162 PolarHBondContact O-N 3.34Å; Q159-K163 VanDerWaalsContact O-CB 3.31Å; Q159-K163 WeakPolarHBondContact O-CB 3.13Å; Q159-K163 PolarHBondContact O-N 3.35Å; Q159-P171 HydrophobicContact CG-CB 4.24Å; Q159-P171 HydrophobicContact CG-CG 4.23Å |
| 160 | G | 95.4 | Very high | 92.4 | Very high | 41 Ų | 41 | 52.5 Ų | 52.5 | 42% | 0.423 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -64 | -40.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | E156 V157 I158 K164 | E156-G160 PolarHBondContact O-N 2.71Å; V157-G160 PolarHBondContact O-N 3.48Å; I158-G160 VanDerWaalsContact C-N 3.34Å; I158-G160 PolarHBondContact O-N 3.08Å; G160-K164 VanDerWaalsContact O-CB 3.23Å; G160-K164 WeakPolarHBondContact O-CB 3.25Å; G160-K164 PolarHBondContact O-N 3.49Å |
| 161 | L | 94.1 | Very high | 92 | Very high | 1 Ų | 1 | 54.4 Ų | 54.4 | 1% | 0.005 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -67.4 | -48.9 | 175.6 | -71.7 | 171.6 | 0 | 0 | 0 | 111.4 | V100 K144 I146 V157 I158 K163 K164 F165 L215 | V100-L161 HydrophobicContact CB-CD1 3.94Å; V100-L161 HydrophobicContact CG1-CD1 3.67Å; V100-L161 HydrophobicContact CG2-CD1 4.08Å; K144-L161 HydrophobicContact CB-CD2 4.03Å; K144-L161 HydrophobicContact CG-CD2 4.05Å; I146-L161 HydrophobicContact CG2-CD2 4.03Å; V157-L161 HydrophobicContact CG1-CD1 3.81Å; V157-L161 HydrophobicContact CG1-CG 4.42Å; V157-L161 WeakPolarHBondContact O-CB 3.4Å; V157-L161 VanDerWaalsContact O-CG 3.25Å; V157-L161 WeakPolarHBondContact O-CG 3.29Å; V157-L161 PolarHBondContact O-N 3.41Å; I158-L161 PolarHBondContact O-N 2.76Å; L161-K163 VanDerWaalsContact C-N 3.33Å; L161-K163 PolarHBondContact O-N 2.96Å; L161-K164 WeakPolarHBondContact O-CB 3.45Å; L161-K164 PolarHBondContact O-N 3.42Å; L161-K164 VanDerWaalsContact O-N 3.1Å; L161-F165 HydrophobicContact CD2-CE2 4.32Å; L161-F165 VanDerWaalsContact O-CD2 3.24Å; L161-F165 WeakPolarHBondContact O-CD2 3.45Å; L161-F165 PolarHBondContact O-N 2.86Å; L161-L215 HydrophobicContact CB-CD2 4.07Å; L161-L215 HydrophobicContact CD1-CD2 4.14Å |
| 162 | L | 91.3 | Very high | 91.6 | Very high | 4 Ų | 4 | 58 Ų | 58 | 2% | 0.021 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -57.7 | -47.1 | 178.6 | -65.9 | 177.7 | 0 | 0 | 0 | 111.1 | I158 Q159 K164 F165 M166 V167 P171 F174 L215 | I158-L162 HydrophobicContact CG2-CD1 3.76Å; I158-L162 HydrophobicContact CG2-CG 4.29Å; I158-L162 VanDerWaalsContact O-CG 3.25Å; I158-L162 WeakPolarHBondContact O-CG 3.29Å; I158-L162 PolarHBondContact O-N 2.92Å; Q159-L162 PolarHBondContact O-N 3.34Å; L162-K164 VanDerWaalsContact C-N 3.34Å; L162-K164 PolarHBondContact O-N 3Å; L162-F165 CarbonylContact O-C 3.45Å; L162-F165 PolarHBondContact O-N 3.31Å; L162-M166 PolarHBondContact O-N 2.8Å; L162-V167 HydrophobicContact CB-CB 3.95Å; L162-V167 HydrophobicContact CB-CG1 4.44Å; L162-V167 HydrophobicContact CB-CG2 4.49Å; L162-V167 HydrophobicContact CD2-CB 3.78Å; L162-V167 HydrophobicContact CD2-CG1 3.66Å; L162-V167 HydrophobicContact CD2-CG2 3.91Å; L162-V167 HydrophobicContact CG-CB 4.42Å; L162-V167 HydrophobicContact CG-CG1 4.49Å; L162-V167 PolarHBondContact O-N 2.76Å; L162-P171 HydrophobicContact CD1-CB 3.93Å; L162-P171 HydrophobicContact CD1-CG 4.14Å; L162-F174 HydrophobicContact CD1-CB 4.44Å; L162-F174 HydrophobicContact CD1-CD2 3.44Å; L162-F174 VanDerWaalsContact CD1-CD2 3.44Å; L162-F174 HydrophobicContact CD1-CE2 3.83Å; L162-F174 HydrophobicContact CD1-CG 4.02Å; L162-F174 HydrophobicContact CD2-CD1 3.91Å; L162-F174 HydrophobicContact CD2-CD2 3.8Å; L162-F174 HydrophobicContact CD2-CE1 3.89Å; L162-F174 HydrophobicContact CD2-CE2 3.78Å; L162-F174 HydrophobicContact CD2-CG 3.86Å; L162-F174 HydrophobicContact CD2-CZ 3.83Å; L162-F174 HydrophobicContact CG-CD2 4.27Å; L162-F174 HydrophobicContact CG-CE2 4.48Å; L162-L215 HydrophobicContact CD2-CD2 4.26Å |
| 163 | K | 90.6 | Very high | 91.1 | Very high | 176 Ų | 176 | 61.7 Ų | 61.7 | 77% | 0.765 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -59.2 | -43.5 | 174.8 | -176.2 | 177.2 | -178.9 | 177.7 | 0 | 112.4 | Q159 L161 F165 M166 | Q159-K163 VanDerWaalsContact O-CB 3.31Å; Q159-K163 WeakPolarHBondContact O-CB 3.13Å; Q159-K163 PolarHBondContact O-N 3.35Å; L161-K163 VanDerWaalsContact C-N 3.33Å; L161-K163 PolarHBondContact O-N 2.96Å; K163-F165 VanDerWaalsContact C-N 3.28Å; K163-F165 PolarHBondContact O-N 2.94Å; K163-M166 PolarHBondContact O-N 3.38Å |
| 164 | K | 89 | Confident | 90.8 | Very high | 113 Ų | 113 | 60.5 Ų | 60.5 | 49% | 0.491 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -63.1 | -34.5 | -179.4 | -175.9 | 168.6 | -158.3 | 164.2 | 0 | 113 | K144 G160 L161 L162 M166 | K144-K164 HydrophobicContact CD-CD 4.45Å; K144-K164 HydrophobicContact CG-CD 4.48Å; G160-K164 VanDerWaalsContact O-CB 3.23Å; G160-K164 WeakPolarHBondContact O-CB 3.25Å; G160-K164 PolarHBondContact O-N 3.49Å; L161-K164 WeakPolarHBondContact O-CB 3.45Å; L161-K164 PolarHBondContact O-N 3.42Å; L161-K164 VanDerWaalsContact O-N 3.1Å; L162-K164 VanDerWaalsContact C-N 3.34Å; L162-K164 PolarHBondContact O-N 3Å; K164-M166 VanDerWaalsContact C-N 3.32Å |
| 165 | F | 84.5 | Confident | 90.5 | Very high | 38 Ų | 38 | 60.6 Ų | 60.6 | 17% | 0.167 | 30% | 0.295 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96 | 12.1 | 176 | -68.4 | -75.6 | 0 | 0 | 0 | 112.7 | L102 L138 K144 L161 L162 K163 V167 | L102-F165 HydrophobicContact CD1-CE2 4.01Å; L102-F165 HydrophobicContact CD1-CZ 4.39Å; L102-F165 HydrophobicContact CD2-CD2 3.34Å; L102-F165 HydrophobicContact CD2-CE2 3.26Å; L102-F165 HydrophobicContact CD2-CG 4.11Å; L102-F165 HydrophobicContact CD2-CZ 3.92Å; L102-F165 HydrophobicContact CG-CE2 4.31Å; L138-F165 HydrophobicContact CD1-CB 4.24Å; L138-F165 HydrophobicContact CD1-CD1 3.26Å; L138-F165 HydrophobicContact CD1-CE1 3.73Å; L138-F165 HydrophobicContact CD1-CG 3.96Å; L138-F165 HydrophobicContact CD2-CD1 4.21Å; L138-F165 HydrophobicContact CD2-CE1 4.5Å; L138-F165 HydrophobicContact CD2-CG 4.27Å; L138-F165 HydrophobicContact CG-CD1 4.39Å; K144-F165 HydrophobicContact CB-CE2 4.13Å; K144-F165 HydrophobicContact CB-CZ 4.16Å; K144-F165 HydrophobicContact CD-CE2 4.25Å; K144-F165 HydrophobicContact CD-CZ 3.84Å; K144-F165 HydrophobicContact CG-CE2 4.17Å; K144-F165 HydrophobicContact CG-CZ 4.22Å; L161-F165 HydrophobicContact CD2-CE2 4.32Å; L161-F165 VanDerWaalsContact O-CD2 3.24Å; L161-F165 WeakPolarHBondContact O-CD2 3.45Å; L161-F165 PolarHBondContact O-N 2.86Å; L162-F165 CarbonylContact O-C 3.45Å; L162-F165 PolarHBondContact O-N 3.31Å; K163-F165 VanDerWaalsContact C-N 3.28Å; K163-F165 PolarHBondContact O-N 2.94Å; F165-V167 HydrophobicContact CB-CG2 4Å; F165-V167 PolarHBondContact O-N 3.14Å |
| 166 | M | 84 | Confident | 90.5 | Very high | 88 Ų | 88 | 59 Ų | 59 | 43% | 0.433 | 28% | 0.284 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.7 | 31.4 | 177.5 | -56.4 | 177.5 | 65.2 | 0 | 0 | 113.6 | V110 E111 L162 K163 K164 L168 | V110-M166 WeakPolarHBondContact CA-O 3.46Å; V110-M166 HydrophobicContact CB-CB 4.42Å; V110-M166 HydrophobicContact CG1-CB 3.55Å; V110-M166 HydrophobicContact CG1-CE 4.05Å; V110-M166 HydrophobicContact CG1-CG 4.44Å; V110-M166 HydrophobicContact CG1-SD 4.16Å; V110-M166 HydrophobicContact CG2-CB 4.43Å; E111-M166 HydrophobicContact CB-CE 3.77Å; E111-M166 VanDerWaalsContact O-CE 3.32Å; E111-M166 WeakPolarHBondContact O-CE 3.3Å; L162-M166 PolarHBondContact O-N 2.8Å; K163-M166 PolarHBondContact O-N 3.38Å; K164-M166 VanDerWaalsContact C-N 3.32Å; M166-L168 PolarHBondContact O-N 3.46Å |
| 167 | V | 84.1 | Confident | 90.3 | Very high | 12 Ų | 12 | 55.3 Ų | 55.3 | 7% | 0.073 | 27% | 0.266 | C | S | . | . | trans | -72.4 | 115.9 | 175.9 | 178.5 | 0 | 0 | 0 | 0 | 109.6 | L104 V108 L162 F165 D169 F174 | L104-V167 HydrophobicContact CD1-CG2 4.31Å; V108-V167 HydrophobicContact CG1-CB 3.6Å; V108-V167 HydrophobicContact CG1-CG1 3.29Å; V108-V167 HydrophobicContact CG1-CG2 3.65Å; L162-V167 HydrophobicContact CB-CB 3.95Å; L162-V167 HydrophobicContact CB-CG1 4.44Å; L162-V167 HydrophobicContact CB-CG2 4.49Å; L162-V167 HydrophobicContact CD2-CB 3.78Å; L162-V167 HydrophobicContact CD2-CG1 3.66Å; L162-V167 HydrophobicContact CD2-CG2 3.91Å; L162-V167 HydrophobicContact CG-CB 4.42Å; L162-V167 HydrophobicContact CG-CG1 4.49Å; L162-V167 PolarHBondContact O-N 2.76Å; F165-V167 HydrophobicContact CB-CG2 4Å; F165-V167 PolarHBondContact O-N 3.14Å; V167-D169 HydrophobicContact CG1-CB 3.99Å; V167-F174 HydrophobicContact CG1-CE2 4.01Å; V167-F174 HydrophobicContact CG1-CZ 3.65Å | ||
| 168 | L | 81.7 | Confident | 90.2 | Very high | 64 Ų | 64 | 59.1 Ų | 59.1 | 34% | 0.335 | 28% | 0.28 | S | S | . | . | trans | -89.6 | -4.6 | -179.2 | -60.7 | -178.6 | 0 | 0 | 0 | 114.3 | T109 E111 M166 | T109-L168 HydrophobicContact CG2-CD1 3.98Å; T109-L168 WeakPolarHBondContact O-CB 3.37Å; T109-L168 VanDerWaalsContact O-CG 3.32Å; T109-L168 WeakPolarHBondContact O-CG 3.47Å; T109-L168 PolarHBondContact O-N 3.31Å; E111-L168 HydrophobicContact CG-CD1 4.01Å; E111-L168 HydrophobicContact CG-CD2 4.17Å; M166-L168 PolarHBondContact O-N 3.46Å | ||
| 169 | D | 84 | Confident | 90 | Very high | 43 Ų | 43 | 60.1 Ų | 60.1 | 23% | 0.23 | 28% | 0.284 | C | S | . | . | S | Bend | trans | -66.4 | 153 | 176.3 | -80.9 | -88.7 | 0 | 0 | 0 | 112.3 | V167 P171 K173 F174 | V167-D169 HydrophobicContact CG1-CB 3.99Å; D169-P171 WeakPolarHBondContact O-CD 3.33Å; D169-K173 HydrophobicContact CB-CD 4.32Å; D169-K173 IonicContact OD1-NZ 3.46Å; D169-K173 PolarHBondContact OD1-NZ 2.89Å; D169-F174 HydrophobicContact CB-CE2 3.65Å; D169-F174 HydrophobicContact CB-CZ 3.84Å |
| 170 | D | 85.1 | Confident | 89.8 | Confident | 76 Ų | 76 | 57.8 Ų | 57.8 | 41% | 0.406 | 28% | 0.277 | S | S | . | . | trans | -58.6 | 125.2 | 177.6 | -175.9 | -24.3 | 0 | 0 | 0 | 110 | R172 K173 F174 | D170-R172 PolarHBondContact O-N 2.78Å; D170-R172 VanDerWaalsContact OD1-CB 3.28Å; D170-R172 WeakPolarHBondContact OD1-CB 3.46Å; D170-R172 VanDerWaalsContact OD1-CG 3.26Å; D170-R172 WeakPolarHBondContact OD1-CG 3.39Å; D170-R172 PolarHBondContact OD1-N 2.98Å; D170-K173 HydrophobicContact CB-CG 4.31Å; D170-K173 VanDerWaalsContact O-CB 3.29Å; D170-K173 WeakPolarHBondContact O-CB 3.31Å; D170-K173 PolarHBondContact O-N 3.27Å; D170-F174 WeakPolarHBondContact O-CD2 3.33Å | ||
| 171 | P | 89.5 | Confident | 89.3 | Confident | 52 Ų | 52 | 60.3 Ų | 60.3 | 34% | 0.338 | 28% | 0.278 | S | S | . | . | G | 310 helix | trans | -51.6 | -26.6 | 176.6 | -28.1 | 35.1 | 0 | 0 | 0 | 114.6 | I158 Q159 L162 D169 K173 F174 | I158-P171 HydrophobicContact CG2-CB 4.35Å; Q159-P171 HydrophobicContact CG-CB 4.24Å; Q159-P171 HydrophobicContact CG-CG 4.23Å; L162-P171 HydrophobicContact CD1-CB 3.93Å; L162-P171 HydrophobicContact CD1-CG 4.14Å; D169-P171 WeakPolarHBondContact O-CD 3.33Å; P171-K173 PolarHBondContact O-N 3.47Å; P171-F174 PolarHBondContact O-N 2.92Å |
| 172 | R | 88.4 | Confident | 88.6 | Confident | 206 Ų | 206 | 68 Ų | 68 | 78% | 0.777 | 31% | 0.306 | S | S | * | . | G | 310 helix | trans | -66.2 | -20.1 | 176.6 | -62.9 | 172 | -179.7 | -169.6 | 0.7 | 113.2 | D170 F174 N218 | D170-R172 PolarHBondContact O-N 2.78Å; D170-R172 VanDerWaalsContact OD1-CB 3.28Å; D170-R172 WeakPolarHBondContact OD1-CB 3.46Å; D170-R172 VanDerWaalsContact OD1-CG 3.26Å; D170-R172 WeakPolarHBondContact OD1-CG 3.39Å; D170-R172 PolarHBondContact OD1-N 2.98Å; R172-F174 PolarHBondContact O-N 2.99Å; R172-N218 PolarHBondContact O-ND2 2.76Å |
| 173 | K | 88 | Confident | 88 | Confident | 108 Ų | 108 | 74.7 Ų | 74.7 | 47% | 0.47 | 34% | 0.342 | S | S | . | . | G | 310 helix | trans | -74.4 | -5.2 | 171.3 | -63 | -175.3 | -173.6 | 177.6 | 0 | 112.7 | D169 D170 P171 E217 N218 | D169-K173 HydrophobicContact CB-CD 4.32Å; D169-K173 IonicContact OD1-NZ 3.46Å; D169-K173 PolarHBondContact OD1-NZ 2.89Å; D170-K173 HydrophobicContact CB-CG 4.31Å; D170-K173 VanDerWaalsContact O-CB 3.29Å; D170-K173 WeakPolarHBondContact O-CB 3.31Å; D170-K173 PolarHBondContact O-N 3.27Å; P171-K173 PolarHBondContact O-N 3.47Å; K173-E217 CarbonylContact O-C 3.59Å; K173-E217 WeakPolarHBondContact O-CA 3.47Å; K173-N218 PolarHBondContact O-N 2.94Å |
| 174 | F | 91 | Very high | 87.4 | Confident | 6 Ų | 6 | 69.2 Ų | 69.2 | 3% | 0.026 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.4 | 157.8 | -179 | -55.7 | -91.7 | 0 | 0 | 0 | 110.6 | L104 I158 L162 V167 D169 D170 P171 R172 L215 K216 E217 N218 | L104-F174 HydrophobicContact CD1-CE1 4.26Å; L104-F174 HydrophobicContact CD2-CD1 3.73Å; L104-F174 HydrophobicContact CD2-CE1 3.69Å; I158-F174 HydrophobicContact CG2-CB 4.04Å; L162-F174 HydrophobicContact CD1-CB 4.44Å; L162-F174 HydrophobicContact CD1-CD2 3.44Å; L162-F174 VanDerWaalsContact CD1-CD2 3.44Å; L162-F174 HydrophobicContact CD1-CE2 3.83Å; L162-F174 HydrophobicContact CD1-CG 4.02Å; L162-F174 HydrophobicContact CD2-CD1 3.91Å; L162-F174 HydrophobicContact CD2-CD2 3.8Å; L162-F174 HydrophobicContact CD2-CE1 3.89Å; L162-F174 HydrophobicContact CD2-CE2 3.78Å; L162-F174 HydrophobicContact CD2-CG 3.86Å; L162-F174 HydrophobicContact CD2-CZ 3.83Å; L162-F174 HydrophobicContact CG-CD2 4.27Å; L162-F174 HydrophobicContact CG-CE2 4.48Å; V167-F174 HydrophobicContact CG1-CE2 4.01Å; V167-F174 HydrophobicContact CG1-CZ 3.65Å; D169-F174 HydrophobicContact CB-CE2 3.65Å; D169-F174 HydrophobicContact CB-CZ 3.84Å; D170-F174 WeakPolarHBondContact O-CD2 3.33Å; P171-F174 PolarHBondContact O-N 2.92Å; R172-F174 PolarHBondContact O-N 2.99Å; F174-L215 HydrophobicContact CB-CD1 4.13Å; F174-K216 CarbonylContact C-O 3.44Å; F174-K216 VanDerWaalsContact CA-O 3.29Å; F174-K216 WeakPolarHBondContact CA-O 3.41Å; F174-E217 HydrophobicContact CD1-CG 3.75Å; F174-E217 HydrophobicContact CE1-CG 3.4Å; F174-E217 VanDerWaalsContact CE1-CG 3.4Å; F174-E217 HydrophobicContact CZ-CG 4.22Å; F174-N218 PolarHBondContact O-ND2 3.13Å |
| 175 | A | 93.9 | Very high | 87.1 | Confident | 2 Ų | 2 | 69.4 Ų | 69.4 | 2% | 0.017 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.7 | 145.7 | 171.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | Y177 K190 K216 N218 | A175-Y177 HydrophobicContact CB-CD2 4.31Å; A175-Y177 HydrophobicContact CB-CE2 3.62Å; A175-K190 HydrophobicContact CB-CD 3.93Å; A175-K190 HydrophobicContact CB-CG 4.08Å; A175-K216 PolarHBondContact N-O 3.38Å; A175-K216 PolarHBondContact O-N 3.49Å; A175-N218 WeakPolarHBondContact CB-OD1 3.5Å |
| 176 | L | 96.1 | Very high | 87.1 | Confident | 0 Ų | 0 | 71.4 Ų | 71.4 | 0% | 0 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.5 | 129.7 | 170.4 | -165.3 | 67.9 | 0 | 0 | 0 | 108 | V100 T154 V157 I158 L191 P197 F213 L215 | V100-L176 HydrophobicContact CG1-CD1 3.64Å; V100-L176 HydrophobicContact CG2-CD1 4.49Å; T154-L176 HydrophobicContact CG2-CB 3.7Å; T154-L176 HydrophobicContact CG2-CD2 4.04Å; T154-L176 HydrophobicContact CG2-CG 4.49Å; V157-L176 HydrophobicContact CB-CD2 4.35Å; V157-L176 HydrophobicContact CG1-CD2 3.9Å; I158-L176 HydrophobicContact CD1-CB 4.24Å; I158-L176 HydrophobicContact CG1-CB 4.11Å; L176-L191 HydrophobicContact CB-CD1 4.48Å; L176-L191 HydrophobicContact CD2-CD1 3.97Å; L176-L191 HydrophobicContact CG-CD1 4.11Å; L176-L191 WeakPolarHBondContact O-CB 3.27Å; L176-L191 PolarHBondContact O-N 3.47Å; L176-P197 HydrophobicContact CD2-CG 3.94Å; L176-F213 HydrophobicContact CD1-CB 4.3Å; L176-F213 HydrophobicContact CD2-CD1 4.45Å; L176-L215 HydrophobicContact CD1-CB 4.26Å |
| 177 | Y | 95.3 | Very high | 87.3 | Confident | 24 Ų | 24 | 69.6 Ų | 69.6 | 9% | 0.094 | 34% | 0.343 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.6 | 143.8 | 177.2 | -67 | -100.9 | 0 | 0 | 0 | 109.2 | A175 F188 Q189 K190 F213 V214 K216 | A175-Y177 HydrophobicContact CB-CD2 4.31Å; A175-Y177 HydrophobicContact CB-CE2 3.62Å; Y177-F188 HydrophobicContact CD1-CB 4.05Å; Y177-Q189 CarbonylContact C-O 3.45Å; Y177-Q189 VanDerWaalsContact CA-O 3.25Å; Y177-Q189 WeakPolarHBondContact CA-O 3.37Å; Y177-K190 HydrophobicContact CD1-CB 4.01Å; Y177-K190 HydrophobicContact CE1-CB 3.66Å; Y177-K190 HydrophobicContact CE1-CG 4.38Å; Y177-F213 WeakPolarHBondContact O-CA 3.25Å; Y177-V214 PolarHBondContact N-O 3.19Å; Y177-V214 PolarHBondContact O-N 3.17Å; Y177-K216 HydrophobicContact CD2-CB 4.18Å; Y177-K216 HydrophobicContact CD2-CD 4.19Å; Y177-K216 HydrophobicContact CD2-CG 4.15Å; Y177-K216 HydrophobicContact CE2-CB 3.93Å; Y177-K216 HydrophobicContact CE2-CD 4.19Å; Y177-K216 HydrophobicContact CE2-CG 4.29Å |
| 178 | R | 95 | Very high | 87.5 | Confident | 85 Ų | 85 | 71.5 Ų | 71.5 | 32% | 0.321 | 35% | 0.35 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.1 | 130.6 | 154.8 | 61.9 | 178.5 | -172.7 | -170.3 | 5.9 | 108.6 | Q189 L191 L211 T212 | R178-Q189 HydrophobicContact CG-CB 3.85Å; R178-Q189 PolarHBondContact N-O 3.02Å; R178-Q189 PolarHBondContact O-N 3.32Å; R178-L191 HydrophobicContact CB-CD2 4.05Å; R178-L191 HydrophobicContact CB-CG 4.48Å; R178-L191 HydrophobicContact CG-CD2 3.91Å; R178-L211 HydrophobicContact CB-CD1 3.47Å; R178-L211 VanDerWaalsContact CB-CD1 3.47Å; R178-T212 CarbonylContact C-O 3.49Å |
| 179 | Q | 93.9 | Very high | 88 | Confident | 24 Ų | 24 | 73.1 Ų | 73.1 | 11% | 0.112 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.5 | 128.9 | 171.9 | 179.6 | -177.5 | -15.3 | 0 | 0 | 108.3 | D186 L187 F188 L211 T212 V214 | Q179-D186 HydrophobicContact CG-CB 4.38Å; Q179-D186 PolarHBondContact NE2-OD1 3.33Å; Q179-D186 PolarHBondContact NE2-OD2 3Å; Q179-L187 CarbonylContact C-O 3.34Å; Q179-L187 VanDerWaalsContact CA-O 3.24Å; Q179-L187 WeakPolarHBondContact CA-O 3.5Å; Q179-F188 HydrophobicContact CB-CD1 4.05Å; Q179-F188 HydrophobicContact CB-CE1 3.89Å; Q179-F188 HydrophobicContact CB-CZ 4.47Å; Q179-F188 VanDerWaalsContact CD-CZ 3.44Å; Q179-F188 HydrophobicContact CG-CD1 4.27Å; Q179-F188 HydrophobicContact CG-CE1 3.84Å; Q179-F188 HydrophobicContact CG-CE2 4.41Å; Q179-F188 HydrophobicContact CG-CZ 3.9Å; Q179-F188 VanDerWaalsContact OE1-CE1 3.24Å; Q179-L211 WeakPolarHBondContact O-CA 3.11Å; Q179-T212 PolarHBondContact N-O 3.3Å; Q179-T212 PolarHBondContact O-N 2.94Å; Q179-V214 HydrophobicContact CB-CG2 4.17Å |
| 180 | T | 89.9 | Confident | 88.4 | Confident | 51 Ų | 51 | 75.2 Ų | 75.2 | 31% | 0.313 | 36% | 0.363 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.8 | 148.6 | 172.8 | 60.6 | 0 | 0 | 0 | 0 | 109.6 | L187 Q210 | T180-L187 PolarHBondContact N-O 3.45Å; T180-L187 PolarHBondContact O-N 3.48Å; T180-Q210 WeakPolarHBondContact CG2-O 3.34Å |
| 181 | H | 85.4 | Confident | 88.9 | Confident | 94 Ų | 94 | 71.9 Ų | 71.9 | 44% | 0.435 | 35% | 0.345 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 118.5 | 178.1 | -165.4 | 71 | 0 | 0 | 0 | 110.2 | D186 | H181-D186 IonicContact CE1-OD1 3.05Å; H181-D186 IonicContact ND1-OD1 2.73Å; H181-D186 PolarHBondContact ND1-OD1 2.93Å |
| 182 | R | 78.8 | Confident | 89.2 | Confident | 162 Ų | 162 | 72.6 Ų | 72.6 | 61% | 0.611 | 35% | 0.35 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -138.6 | 131.2 | -179.9 | -170.7 | -174.8 | 170.8 | 170.5 | 5.2 | 110.5 | G184 Q185 L187 | R182-G184 PolarHBondContact O-N 2.9Å; R182-G184 VanDerWaalsContact O-N 3.11Å; R182-Q185 PolarHBondContact N-O 3.49Å; R182-Q185 PolarHBondContact O-N 3.29Å; R182-Q185 VanDerWaalsContact O-O 3.11Å; R182-L187 HydrophobicContact CB-CD1 3.82Å; R182-L187 HydrophobicContact CB-CG 4.5Å |
| 183 | D | 79.6 | Confident | 89.6 | Confident | 144 Ų | 144 | 67.6 Ų | 67.6 | 77% | 0.77 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.1 | 31.4 | 175.7 | -57.7 | -45.5 | 0 | 0 | 0 | 114.2 | Q185 | D183-Q185 VanDerWaalsContact C-N 3.32Š|
| 184 | G | 79.3 | Confident | 90 | Very high | 61 Ų | 61 | 66.7 Ų | 66.7 | 63% | 0.629 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79 | 10.6 | -177.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | R182 | R182-G184 PolarHBondContact O-N 2.9Å; R182-G184 VanDerWaalsContact O-N 3.11Å |
| 185 | Q | 81.8 | Confident | 90.3 | Very high | 118 Ų | 118 | 69.6 Ų | 69.6 | 55% | 0.551 | 36% | 0.359 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -121.5 | 144.7 | 178.6 | -63.4 | -175.7 | -3.2 | 0 | 0 | 111.5 | R182 D183 | R182-Q185 PolarHBondContact N-O 3.49Å; R182-Q185 PolarHBondContact O-N 3.29Å; R182-Q185 VanDerWaalsContact O-O 3.11Å; D183-Q185 VanDerWaalsContact C-N 3.32Å |
| 186 | D | 85 | Confident | 90.4 | Very high | 80 Ų | 80 | 72.5 Ų | 72.5 | 43% | 0.428 | 37% | 0.372 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.6 | 115.7 | 173.3 | -70.5 | -21.3 | 0 | 0 | 0 | 110.1 | Q179 H181 F188 | Q179-D186 HydrophobicContact CG-CB 4.38Å; Q179-D186 PolarHBondContact NE2-OD1 3.33Å; Q179-D186 PolarHBondContact NE2-OD2 3Å; H181-D186 IonicContact CE1-OD1 3.05Å; H181-D186 IonicContact ND1-OD1 2.73Å; H181-D186 PolarHBondContact ND1-OD1 2.93Å; D186-F188 HydrophobicContact CB-CE2 3.77Å; D186-F188 HydrophobicContact CB-CZ 4.34Å |
| 187 | L | 87.4 | Confident | 90.5 | Very high | 49 Ų | 49 | 72.5 Ų | 72.5 | 26% | 0.257 | 37% | 0.372 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.6 | 123.8 | 175.1 | -63 | 177.5 | 0 | 0 | 0 | 109.4 | Q179 T180 R182 | Q179-L187 CarbonylContact C-O 3.34Å; Q179-L187 VanDerWaalsContact CA-O 3.24Å; Q179-L187 WeakPolarHBondContact CA-O 3.5Å; T180-L187 PolarHBondContact N-O 3.45Å; T180-L187 PolarHBondContact O-N 3.48Å; R182-L187 HydrophobicContact CB-CD1 3.82Å; R182-L187 HydrophobicContact CB-CG 4.5Å |
| 188 | F | 89.4 | Confident | 90.7 | Very high | 53 Ų | 53 | 71.3 Ų | 71.3 | 23% | 0.232 | 37% | 0.367 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106 | 126.1 | 174.9 | -66.8 | -93.5 | 0 | 0 | 0 | 109.2 | Y177 Q179 D186 V214 | Y177-F188 HydrophobicContact CD1-CB 4.05Å; Q179-F188 HydrophobicContact CB-CD1 4.05Å; Q179-F188 HydrophobicContact CB-CE1 3.89Å; Q179-F188 HydrophobicContact CB-CZ 4.47Å; Q179-F188 VanDerWaalsContact CD-CZ 3.44Å; Q179-F188 HydrophobicContact CG-CD1 4.27Å; Q179-F188 HydrophobicContact CG-CE1 3.84Å; Q179-F188 HydrophobicContact CG-CE2 4.41Å; Q179-F188 HydrophobicContact CG-CZ 3.9Å; Q179-F188 VanDerWaalsContact OE1-CE1 3.24Å; D186-F188 HydrophobicContact CB-CE2 3.77Å; D186-F188 HydrophobicContact CB-CZ 4.34Å; F188-V214 HydrophobicContact CE1-CB 4.27Å; F188-V214 HydrophobicContact CE1-CG1 4.43Å; F188-V214 HydrophobicContact CE1-CG2 3.91Å |
| 189 | Q | 90.9 | Very high | 90.8 | Very high | 97 Ų | 97 | 68.8 Ų | 68.8 | 45% | 0.453 | 36% | 0.361 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.5 | 126.4 | 173.2 | -178.8 | 176.9 | 3.7 | 0 | 0 | 110.1 | Y177 R178 L191 | Y177-Q189 CarbonylContact C-O 3.45Å; Y177-Q189 VanDerWaalsContact CA-O 3.25Å; Y177-Q189 WeakPolarHBondContact CA-O 3.37Å; R178-Q189 HydrophobicContact CG-CB 3.85Å; R178-Q189 PolarHBondContact N-O 3.02Å; R178-Q189 PolarHBondContact O-N 3.32Å; Q189-L191 PolarHBondContact O-N 2.94Å |
| 190 | K | 93.1 | Very high | 91 | Very high | 87 Ų | 87 | 68.7 Ų | 68.7 | 38% | 0.378 | 36% | 0.361 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.8 | 131.1 | 177.4 | -176.6 | 163.9 | 176.1 | 164.3 | 0 | 110.6 | A175 Y177 N218 | A175-K190 HydrophobicContact CB-CD 3.93Å; A175-K190 HydrophobicContact CB-CG 4.08Å; Y177-K190 HydrophobicContact CD1-CB 4.01Å; Y177-K190 HydrophobicContact CE1-CB 3.66Å; Y177-K190 HydrophobicContact CE1-CG 4.38Å; K190-N218 PolarHBondContact NZ-OD1 3.35Å |
| 191 | L | 95.4 | Very high | 91.3 | Very high | 6 Ų | 6 | 67 Ų | 67 | 3% | 0.031 | 35% | 0.349 | C | S | . | . | P | Polyproline II helix | trans | -83.3 | 131.2 | 174.5 | -64.4 | 178.3 | 0 | 0 | 0 | 110.3 | T154 L176 R178 Q189 L200 F213 | T154-L191 HydrophobicContact CG2-CB 3.86Å; L176-L191 HydrophobicContact CB-CD1 4.48Å; L176-L191 HydrophobicContact CD2-CD1 3.97Å; L176-L191 HydrophobicContact CG-CD1 4.11Å; L176-L191 WeakPolarHBondContact O-CB 3.27Å; L176-L191 PolarHBondContact O-N 3.47Å; R178-L191 HydrophobicContact CB-CD2 4.05Å; R178-L191 HydrophobicContact CB-CG 4.48Å; R178-L191 HydrophobicContact CG-CD2 3.91Å; Q189-L191 PolarHBondContact O-N 2.94Å; L191-L200 HydrophobicContact CD1-CD1 4.04Å; L191-L200 HydrophobicContact CD2-CD1 3.57Å; L191-L200 HydrophobicContact CG-CD1 4.46Å; L191-F213 HydrophobicContact CD1-CD1 3.99Å; L191-F213 HydrophobicContact CD1-CE1 3.92Å |
| 192 | P | 95.4 | Very high | 91.9 | Very high | 68 Ų | 68 | 62.8 Ų | 62.8 | 44% | 0.442 | 33% | 0.33 | S | S | . | . | P | Polyproline II helix | trans | -52.9 | 144.7 | 165 | -23.4 | 27.9 | 0 | 0 | 0 | 111.7 | T154 S194 E195 | T154-P192 VanDerWaalsContact CB-O 3.28Å; T154-P192 WeakPolarHBondContact CB-O 3.47Å; T154-P192 PolarHBondContact OG1-O 2.95Å; P192-S194 PolarHBondContact O-N 3.45Å; P192-S194 VanDerWaalsContact O-N 3.15Å; P192-E195 HydrophobicContact CB-CG 3.96Å; P192-E195 HydrophobicContact CG-CG 3.85Å; P192-E195 WeakPolarHBondContact O-CB 3.33Å; P192-E195 PolarHBondContact O-N 3.34Å |
| 193 | L | 96.1 | Very high | 92.7 | Very high | 100 Ų | 100 | 59 Ų | 59 | 52% | 0.524 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.9 | -24.5 | -177.7 | -67.4 | -178.6 | 0 | 0 | 0 | 113.6 | T154 S155 I158 | T154-L193 PolarHBondContact N-O 3.27Å; S155-L193 PolarHBondContact N-O 2.76Å; S155-L193 VanDerWaalsContact N-O 3.09Å; I158-L193 HydrophobicContact CD1-CD2 3.8Å |
| 194 | S | 96.6 | Very high | 93.5 | Very high | 89 Ų | 89 | 53.9 Ų | 53.9 | 62% | 0.622 | 30% | 0.296 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.2 | -8.4 | 176.9 | 55 | 0 | 0 | 0 | 0 | 114.2 | P192 | P192-S194 PolarHBondContact O-N 3.45Å; P192-S194 VanDerWaalsContact O-N 3.15Å |
| 195 | E | 97.1 | Very high | 94.3 | Very high | 68 Ų | 68 | 51.6 Ų | 51.6 | 32% | 0.318 | 27% | 0.272 | S | S | . | . | trans | -65.4 | 158.3 | 176.6 | -82.9 | -65.2 | 165.5 | 0 | 0 | 111.9 | T153 T154 P192 P197 | T153-E195 CarbonylContact C-O 3.49Å; T153-E195 VanDerWaalsContact CA-O 3.31Å; T153-E195 WeakPolarHBondContact CA-O 3.16Å; T154-E195 PolarHBondContact N-O 3.31Å; T154-E195 WeakPolarHBondContact OG1-CB 3.46Å; T154-E195 PolarHBondContact OG1-O 3.46Å; P192-E195 HydrophobicContact CB-CG 3.96Å; P192-E195 HydrophobicContact CG-CG 3.85Å; P192-E195 WeakPolarHBondContact O-CB 3.33Å; P192-E195 PolarHBondContact O-N 3.34Å; E195-P197 WeakPolarHBondContact O-CD 3.38Å | ||
| 196 | H | 97.9 | Very high | 95 | Very high | 62 Ų | 62 | 47.4 Ų | 47.4 | 29% | 0.287 | 26% | 0.255 | S | S | . | . | trans | -112.9 | 97.5 | -179 | -61.6 | -68 | 0 | 0 | 0 | 111.4 | S150 L151 L198 V199 L200 | S150-H196 WeakPolarHBondContact O-CB 3.42Å; L151-H196 PolarHBondContact O-CE1 2.63Å; L151-H196 PolarHBondContact O-ND1 3.33Å; L151-H196 VanDerWaalsContact O-ND1 3.16Å; H196-L198 VanDerWaalsContact C-N 3.28Å; H196-L198 PolarHBondContact O-N 3.01Å; H196-L198 VanDerWaalsContact O-N 3.16Å; H196-V199 HydrophobicContact CB-CB 4.07Å; H196-V199 HydrophobicContact CB-CG2 3.67Å; H196-V199 WeakPolarHBondContact O-CB 3.45Å; H196-V199 PolarHBondContact O-N 3.09Å; H196-L200 PolarHBondContact O-N 3.3Å | ||
| 197 | P | 98.3 | Very high | 95.4 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -59 | -32 | -172.8 | -30 | 39.4 | 0 | 0 | 0 | 114.9 | I98 I148 T152 V157 L176 E195 L200 R201 F213 | I98-P197 HydrophobicContact CD1-CB 3.86Å; I148-P197 HydrophobicContact CD1-CB 4.38Å; T152-P197 VanDerWaalsContact O-CD 3.27Å; T152-P197 WeakPolarHBondContact O-CD 3.4Å; V157-P197 HydrophobicContact CG2-CG 4.08Å; L176-P197 HydrophobicContact CD2-CG 3.94Å; E195-P197 WeakPolarHBondContact O-CD 3.38Å; P197-L200 PolarHBondContact O-N 3.09Å; P197-R201 PolarHBondContact O-N 2.81Å; P197-F213 HydrophobicContact CB-CE1 4.09Å; P197-F213 HydrophobicContact CB-CZ 4.02Å; P197-F213 VanDerWaalsContact O-CZ 3.23Å; P197-F213 WeakPolarHBondContact O-CZ 3.37Å |
| 198 | L | 98.3 | Very high | 95.4 | Very high | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -68.5 | -37 | 177.4 | -166.6 | 68.7 | 0 | 0 | 0 | 111.9 | M86 F94 I98 I148 H196 R201 L202 | M86-L198 HydrophobicContact CE-CD1 4.03Å; M86-L198 HydrophobicContact SD-CD1 4.4Å; M86-L198 HydrophobicContact SD-CG 4.49Å; F94-L198 HydrophobicContact CD2-CD2 3.62Å; F94-L198 HydrophobicContact CD2-CG 4.15Å; F94-L198 HydrophobicContact CE2-CB 4.49Å; F94-L198 HydrophobicContact CE2-CD2 3.71Å; F94-L198 HydrophobicContact CE2-CG 3.77Å; I98-L198 HydrophobicContact CG2-CD1 4.02Å; I148-L198 HydrophobicContact CD1-CB 3.84Å; I148-L198 HydrophobicContact CD1-CD1 4.48Å; I148-L198 HydrophobicContact CG1-CB 4.04Å; I148-L198 HydrophobicContact CG1-CD1 4.08Å; I148-L198 HydrophobicContact CG1-CG 4.42Å; I148-L198 WeakPolarHBondContact O-CD2 3.38Å; H196-L198 VanDerWaalsContact C-N 3.28Å; H196-L198 PolarHBondContact O-N 3.01Å; H196-L198 VanDerWaalsContact O-N 3.16Å; L198-R201 WeakPolarHBondContact O-CB 3.48Å; L198-R201 PolarHBondContact O-N 2.95Å; L198-L202 PolarHBondContact O-N 3.15Å |
| 199 | V | 97.6 | Very high | 95.3 | Very high | 32 Ų | 32 | 51 Ų | 51 | 19% | 0.194 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64.6 | -42.7 | 175.3 | -178.7 | 0 | 0 | 0 | 0 | 110.2 | F94 H196 R201 L202 K203 | F94-V199 HydrophobicContact CZ-CG2 3.93Å; H196-V199 HydrophobicContact CB-CB 4.07Å; H196-V199 HydrophobicContact CB-CG2 3.67Å; H196-V199 WeakPolarHBondContact O-CB 3.45Å; H196-V199 PolarHBondContact O-N 3.09Å; V199-R201 VanDerWaalsContact C-N 3.31Å; V199-R201 PolarHBondContact O-N 2.79Å; V199-L202 PolarHBondContact O-N 3.33Å; V199-K203 HydrophobicContact CG1-CD 4.37Å; V199-K203 WeakPolarHBondContact O-CG 3.34Å; V199-K203 PolarHBondContact O-N 3.01Å |
| 200 | L | 97.5 | Very high | 95.4 | Very high | 21 Ų | 21 | 51.9 Ų | 51.9 | 11% | 0.11 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.8 | -41.3 | 174.4 | -62 | 178.1 | 0 | 0 | 0 | 111.6 | L191 H196 P197 K203 A204 L211 F213 | L191-L200 HydrophobicContact CD1-CD1 4.04Å; L191-L200 HydrophobicContact CD2-CD1 3.57Å; L191-L200 HydrophobicContact CG-CD1 4.46Å; H196-L200 PolarHBondContact O-N 3.3Å; P197-L200 PolarHBondContact O-N 3.09Å; L200-K203 PolarHBondContact O-N 2.95Å; L200-A204 WeakPolarHBondContact O-CB 3.43Å; L200-A204 PolarHBondContact O-N 2.84Å; L200-L211 HydrophobicContact CB-CD2 4.14Å; L200-L211 WeakPolarHBondContact O-CD2 3.35Å; L200-F213 HydrophobicContact CB-CE1 4.47Å; L200-F213 HydrophobicContact CB-CZ 4.19Å; L200-F213 HydrophobicContact CD1-CE1 4.4Å |
| 201 | R | 97.6 | Very high | 95.4 | Very high | 16 Ų | 16 | 48.1 Ų | 48.1 | 6% | 0.06 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.3 | -43.6 | 174.9 | -179.3 | 52.9 | 57 | -175.9 | 1.3 | 112.2 | Y77 M86 I98 P197 L198 V199 K203 A204 G205 L211 F213 | Y77-R201 HydrophobicContact CE2-CG 4.1Å; M86-R201 HydrophobicContact CE-CB 4.2Å; M86-R201 HydrophobicContact CE-CG 3.77Å; I98-R201 HydrophobicContact CG2-CB 3.99Å; I98-R201 HydrophobicContact CG2-CG 4.22Å; P197-R201 PolarHBondContact O-N 2.81Å; L198-R201 WeakPolarHBondContact O-CB 3.48Å; L198-R201 PolarHBondContact O-N 2.95Å; V199-R201 VanDerWaalsContact C-N 3.31Å; V199-R201 PolarHBondContact O-N 2.79Å; R201-K203 VanDerWaalsContact C-N 3.33Å; R201-A204 PolarHBondContact O-N 2.92Å; R201-G205 VanDerWaalsContact CD-O 3.24Å; R201-G205 WeakPolarHBondContact CD-O 3.31Å; R201-G205 PolarHBondContact NH1-O 3.29Å; R201-G205 PolarHBondContact O-N 3.47Å; R201-L211 PolarHBondContact NH1-O 3.26Å; R201-L211 PolarHBondContact NH2-O 3.06Å; R201-F213 HydrophobicContact CB-CE2 4.24Å; R201-F213 HydrophobicContact CB-CZ 4.5Å |
| 202 | L | 97.5 | Very high | 95.5 | Very high | 6 Ų | 6 | 48.9 Ų | 48.9 | 3% | 0.031 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -63.4 | -41.4 | 177.3 | -179.2 | 61.5 | 0 | 0 | 0 | 111.3 | V70 K73 I74 M86 F94 L198 V199 | V70-L202 HydrophobicContact CG1-CD2 4.15Å; K73-L202 HydrophobicContact CB-CD1 3.7Å; K73-L202 HydrophobicContact CB-CD2 4.24Å; K73-L202 HydrophobicContact CB-CG 3.89Å; K73-L202 HydrophobicContact CD-CG 4.43Å; I74-L202 HydrophobicContact CG1-CD1 3.79Å; I74-L202 HydrophobicContact CG1-CD2 4.06Å; M86-L202 HydrophobicContact CE-CB 4Å; M86-L202 HydrophobicContact CE-CD1 4.35Å; M86-L202 HydrophobicContact SD-CB 3.98Å; M86-L202 HydrophobicContact SD-CD1 3.77Å; M86-L202 HydrophobicContact SD-CG 4.33Å; F94-L202 HydrophobicContact CD2-CD2 4.47Å; F94-L202 HydrophobicContact CE1-CD2 4.15Å; F94-L202 HydrophobicContact CE2-CB 4.21Å; F94-L202 HydrophobicContact CE2-CD2 3.79Å; F94-L202 HydrophobicContact CZ-CB 4.42Å; F94-L202 HydrophobicContact CZ-CD2 3.61Å; L198-L202 PolarHBondContact O-N 3.15Å; V199-L202 PolarHBondContact O-N 3.33Å |
| 203 | K | 96.1 | Very high | 95.6 | Very high | 83 Ų | 83 | 45.7 Ų | 45.7 | 36% | 0.361 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -65 | -40 | 178.3 | -73.2 | -179.5 | 178.3 | -173.1 | 0 | 112.6 | E63 L65 V199 L200 R201 | E63-K203 PolarHBondContact O-NZ 2.99Å; L65-K203 HydrophobicContact CD1-CG 4.01Å; V199-K203 HydrophobicContact CG1-CD 4.37Å; V199-K203 WeakPolarHBondContact O-CG 3.34Å; V199-K203 PolarHBondContact O-N 3.01Å; L200-K203 PolarHBondContact O-N 2.95Å; R201-K203 VanDerWaalsContact C-N 3.33Å |
| 204 | A | 95.6 | Very high | 95.5 | Very high | 36 Ų | 36 | 40.9 Ų | 40.9 | 30% | 0.298 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -83.3 | -24.9 | -178.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | L200 R201 Q210 L211 | L200-A204 WeakPolarHBondContact O-CB 3.43Å; L200-A204 PolarHBondContact O-N 2.84Å; R201-A204 PolarHBondContact O-N 2.92Å; A204-Q210 HydrophobicContact CB-CB 4.43Å; A204-L211 HydrophobicContact CB-CB 3.63Å; A204-L211 HydrophobicContact CB-CD2 3.72Å; A204-L211 HydrophobicContact CB-CG 4.32Å |
| 205 | G | 95.9 | Very high | 95.4 | Very high | 13 Ų | 13 | 36.7 Ų | 36.7 | 13% | 0.134 | 20% | 0.195 | C | C | . | . | trans | 90.7 | -178.5 | -174.6 | 0 | 0 | 0 | 0 | 0 | 114 | Y77 R201 D207 | Y77-G205 VanDerWaalsContact CE2-C 3.43Å; R201-G205 VanDerWaalsContact CD-O 3.24Å; R201-G205 WeakPolarHBondContact CD-O 3.31Å; R201-G205 PolarHBondContact NH1-O 3.29Å; R201-G205 PolarHBondContact O-N 3.47Å; G205-D207 VanDerWaalsContact C-N 3.33Å | ||
| 206 | P | 95.9 | Very high | 95 | Very high | 29 Ų | 29 | 34.6 Ų | 34.6 | 19% | 0.188 | 19% | 0.185 | C | C | . | . | S | Bend | trans | -78.6 | -15.4 | -173.9 | 30.1 | -33.8 | 0 | 0 | 0 | 114.1 | Y77 Q80 V81 | Y77-P206 HydrophobicContact CD2-CB 4.39Å; Y77-P206 HydrophobicContact CD2-CG 4.49Å; Y77-P206 HydrophobicContact CE1-CB 4.24Å; Y77-P206 HydrophobicContact CE2-CB 3.81Å; Y77-P206 HydrophobicContact CE2-CG 4.36Å; Y77-P206 VanDerWaalsContact CE2-N 3.34Å; Q80-P206 HydrophobicContact CB-CG 3.73Å; V81-P206 HydrophobicContact CG1-CB 3.37Å; V81-P206 HydrophobicContact CG1-CG 3.89Å |
| 207 | D | 92.9 | Very high | 94.5 | Very high | 64 Ų | 64 | 32.9 Ų | 32.9 | 34% | 0.342 | 18% | 0.177 | S | C | . | . | trans | -65.9 | 121.8 | -177.3 | -178.2 | 8.1 | 0 | 0 | 0 | 111.7 | G205 E209 Q210 | G205-D207 VanDerWaalsContact C-N 3.33Å; D207-E209 PolarHBondContact O-N 2.86Å; D207-E209 WeakPolarHBondContact OD1-CB 3.28Å; D207-E209 PolarHBondContact OD1-N 3.47Å; D207-Q210 HydrophobicContact CB-CB 4.42Å; D207-Q210 HydrophobicContact CB-CG 3.89Å; D207-Q210 PolarHBondContact O-N 2.84Å | ||
| 208 | P | 88.3 | Confident | 93.4 | Very high | 80 Ų | 80 | 35 Ų | 35 | 52% | 0.519 | 19% | 0.188 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -65.7 | -23.7 | 176.6 | 27.5 | -35.8 | 0 | 0 | 0 | 113.9 | Q210 L211 T212 | P208-Q210 VanDerWaalsContact C-N 3.31Å; P208-L211 CarbonylContact O-C 3.51Å; P208-L211 PolarHBondContact O-N 3.06Å; P208-T212 PolarHBondContact O-OG1 3.47Å |
| 209 | E | 88.1 | Confident | 91.7 | Very high | 115 Ų | 115 | 39 Ų | 39 | 54% | 0.537 | 21% | 0.207 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -69.4 | -31.1 | 177.3 | -63.6 | -63.2 | 148.2 | 0 | 0 | 111.7 | D207 | D207-E209 PolarHBondContact O-N 2.86Å; D207-E209 WeakPolarHBondContact OD1-CB 3.28Å; D207-E209 PolarHBondContact OD1-N 3.47Å |
| 210 | Q | 91.6 | Very high | 89.6 | Confident | 115 Ų | 115 | 45 Ų | 45 | 54% | 0.537 | 24% | 0.244 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -74.7 | -35.5 | 176.7 | -62.8 | -56.3 | -43.4 | 0 | 0 | 112.4 | T180 A204 D207 P208 | T180-Q210 WeakPolarHBondContact CG2-O 3.34Å; A204-Q210 HydrophobicContact CB-CB 4.43Å; D207-Q210 HydrophobicContact CB-CB 4.42Å; D207-Q210 HydrophobicContact CB-CG 3.89Å; D207-Q210 PolarHBondContact O-N 2.84Å; P208-Q210 VanDerWaalsContact C-N 3.31Å |
| 211 | L | 94.8 | Very high | 87.6 | Confident | 8 Ų | 8 | 46.9 Ų | 46.9 | 4% | 0.042 | 27% | 0.268 | C | S | . | . | trans | -159.5 | 129 | -178 | 179.8 | 62.5 | 0 | 0 | 0 | 110.5 | R178 Q179 L200 R201 A204 P208 F213 | R178-L211 HydrophobicContact CB-CD1 3.47Å; R178-L211 VanDerWaalsContact CB-CD1 3.47Å; Q179-L211 WeakPolarHBondContact O-CA 3.11Å; L200-L211 HydrophobicContact CB-CD2 4.14Å; L200-L211 WeakPolarHBondContact O-CD2 3.35Å; R201-L211 PolarHBondContact NH1-O 3.26Å; R201-L211 PolarHBondContact NH2-O 3.06Å; A204-L211 HydrophobicContact CB-CB 3.63Å; A204-L211 HydrophobicContact CB-CD2 3.72Å; A204-L211 HydrophobicContact CB-CG 4.32Å; P208-L211 CarbonylContact O-C 3.51Å; P208-L211 PolarHBondContact O-N 3.06Å; L211-F213 HydrophobicContact CD1-CE1 4.41Å; L211-F213 HydrophobicContact CD2-CE1 4.17Å; L211-F213 HydrophobicContact CD2-CE2 4.2Å; L211-F213 HydrophobicContact CD2-CZ 3.66Å; L211-F213 HydrophobicContact CG-CE1 4.45Å; L211-F213 HydrophobicContact CG-CZ 4.21Å | ||
| 212 | T | 96.4 | Very high | 85.4 | Confident | 22 Ų | 22 | 52.1 Ų | 52.1 | 14% | 0.135 | 29% | 0.294 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.3 | 142.7 | 167.2 | -72.3 | 0 | 0 | 0 | 0 | 109.5 | R178 Q179 P208 V214 | R178-T212 CarbonylContact C-O 3.49Å; Q179-T212 PolarHBondContact N-O 3.3Å; Q179-T212 PolarHBondContact O-N 2.94Å; P208-T212 PolarHBondContact O-OG1 3.47Å; T212-V214 HydrophobicContact CG2-CG2 4.05Å |
| 213 | F | 97.4 | Very high | 83.9 | Confident | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.9 | 133.6 | 174.5 | -63.7 | -70.4 | 0 | 0 | 0 | 110.2 | I98 V100 H101 L176 Y177 L191 P197 L200 R201 L211 | I98-F213 HydrophobicContact CB-CD2 4.04Å; I98-F213 HydrophobicContact CB-CE2 4.03Å; I98-F213 HydrophobicContact CD1-CD2 4.16Å; I98-F213 HydrophobicContact CD1-CE2 4.34Å; I98-F213 HydrophobicContact CG2-CD2 4.4Å; I98-F213 HydrophobicContact CG2-CE2 3.87Å; V100-F213 CarbonylContact C-O 3.6Å; V100-F213 WeakPolarHBondContact CA-O 3.31Å; V100-F213 HydrophobicContact CB-CB 4.48Å; V100-F213 HydrophobicContact CG1-CB 4.44Å; V100-F213 HydrophobicContact CG2-CB 4.06Å; H101-F213 PolarHBondContact N-O 3.11Å; L176-F213 HydrophobicContact CD1-CB 4.3Å; L176-F213 HydrophobicContact CD2-CD1 4.45Å; Y177-F213 WeakPolarHBondContact O-CA 3.25Å; L191-F213 HydrophobicContact CD1-CD1 3.99Å; L191-F213 HydrophobicContact CD1-CE1 3.92Å; P197-F213 HydrophobicContact CB-CE1 4.09Å; P197-F213 HydrophobicContact CB-CZ 4.02Å; P197-F213 VanDerWaalsContact O-CZ 3.23Å; P197-F213 WeakPolarHBondContact O-CZ 3.37Å; L200-F213 HydrophobicContact CB-CE1 4.47Å; L200-F213 HydrophobicContact CB-CZ 4.19Å; L200-F213 HydrophobicContact CD1-CE1 4.4Å; R201-F213 HydrophobicContact CB-CE2 4.24Å; R201-F213 HydrophobicContact CB-CZ 4.5Å; L211-F213 HydrophobicContact CD1-CE1 4.41Å; L211-F213 HydrophobicContact CD2-CE1 4.17Å; L211-F213 HydrophobicContact CD2-CE2 4.2Å; L211-F213 HydrophobicContact CD2-CZ 3.66Å; L211-F213 HydrophobicContact CG-CE1 4.45Å; L211-F213 HydrophobicContact CG-CZ 4.21Å |
| 214 | V | 94.8 | Very high | 82.6 | Confident | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.9 | 120.7 | -178.6 | -170.9 | 0 | 0 | 0 | 0 | 110.1 | H101 R103 Y177 Q179 F188 T212 K216 | H101-V214 HydrophobicContact CB-CG1 4.33Å; H101-V214 HydrophobicContact CB-CG2 4.19Å; H101-V214 CarbonylContact O-C 3.59Å; H101-V214 VanDerWaalsContact O-CA 3.31Å; H101-V214 WeakPolarHBondContact O-CA 3.25Å; R103-V214 HydrophobicContact CB-CG1 4.3Å; R103-V214 HydrophobicContact CG-CG1 4.05Å; Y177-V214 PolarHBondContact N-O 3.19Å; Y177-V214 PolarHBondContact O-N 3.17Å; Q179-V214 HydrophobicContact CB-CG2 4.17Å; F188-V214 HydrophobicContact CE1-CB 4.27Å; F188-V214 HydrophobicContact CE1-CG1 4.43Å; F188-V214 HydrophobicContact CE1-CG2 3.91Å; T212-V214 HydrophobicContact CG2-CG2 4.05Å; V214-K216 HydrophobicContact CG1-CG 3.89Å |
| 215 | L | 93.8 | Very high | 81.9 | Confident | 0 Ų | 0 | 59.3 Ų | 59.3 | 0% | 0 | 32% | 0.321 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89 | 117.5 | 170.9 | -176.3 | 71.5 | 0 | 0 | 0 | 108.3 | V100 H101 L102 R103 L104 I158 L161 L162 F174 L176 | V100-L215 HydrophobicContact CG1-CB 3.92Å; H101-L215 PolarHBondContact O-N 3.32Å; L102-L215 HydrophobicContact CD2-CD2 4.27Å; L102-L215 HydrophobicContact CG-CB 4.43Å; L102-L215 HydrophobicContact CG-CD2 4.22Å; R103-L215 PolarHBondContact N-O 3.46Å; L104-L215 HydrophobicContact CD2-CD2 4.47Å; L104-L215 HydrophobicContact CD2-CG 4.4Å; I158-L215 HydrophobicContact CB-CD1 4.39Å; I158-L215 HydrophobicContact CG1-CD1 3.85Å; I158-L215 HydrophobicContact CG2-CD1 4.21Å; L161-L215 HydrophobicContact CB-CD2 4.07Å; L161-L215 HydrophobicContact CD1-CD2 4.14Å; L162-L215 HydrophobicContact CD2-CD2 4.26Å; F174-L215 HydrophobicContact CB-CD1 4.13Å; L176-L215 HydrophobicContact CD1-CB 4.26Å |
| 216 | K | 89.6 | Confident | 80.7 | Confident | 24 Ų | 24 | 65.6 Ų | 65.6 | 10% | 0.104 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.7 | 155.7 | 175.6 | -61.2 | -174.1 | 174.9 | -174.6 | 0 | 110.4 | R103 F174 A175 Y177 V214 E222 | R103-K216 HydrophobicContact CB-CG 4.25Å; F174-K216 CarbonylContact C-O 3.44Å; F174-K216 VanDerWaalsContact CA-O 3.29Å; F174-K216 WeakPolarHBondContact CA-O 3.41Å; A175-K216 PolarHBondContact N-O 3.38Å; A175-K216 PolarHBondContact O-N 3.49Å; Y177-K216 HydrophobicContact CD2-CB 4.18Å; Y177-K216 HydrophobicContact CD2-CD 4.19Å; Y177-K216 HydrophobicContact CD2-CG 4.15Å; Y177-K216 HydrophobicContact CE2-CB 3.93Å; Y177-K216 HydrophobicContact CE2-CD 4.19Å; Y177-K216 HydrophobicContact CE2-CG 4.29Å; V214-K216 HydrophobicContact CG1-CG 3.89Å; K216-E222 IonicContact NZ-OE2 3.92Å; K216-E222 PolarHBondContact NZ-OE2 3.43Å |
| 217 | E | 85.6 | Confident | 79.7 | Confident | 26 Ų | 26 | 68 Ų | 68 | 12% | 0.121 | 37% | 0.369 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -63.6 | 136.7 | 156.5 | -72 | 174.3 | -134.2 | 0 | 0 | 108.2 | L104 S105 R106 K173 F174 E219 | L104-E217 HydrophobicContact CD2-CG 4.39Å; S105-E217 PolarHBondContact N-OE1 2.78Å; R106-E217 VanDerWaalsContact CD-OE2 3.25Å; R106-E217 WeakPolarHBondContact CD-OE2 3.32Å; R106-E217 VanDerWaalsContact CG-OE2 3.28Å; R106-E217 WeakPolarHBondContact CG-OE2 3.48Å; R106-E217 PolarHBondContact N-OE1 3.1Å; R106-E217 VanDerWaalsContact N-OE1 3.12Å; R106-E217 IonicContact NE-OE2 3.47Å; K173-E217 CarbonylContact O-C 3.59Å; K173-E217 WeakPolarHBondContact O-CA 3.47Å; F174-E217 HydrophobicContact CD1-CG 3.75Å; F174-E217 HydrophobicContact CE1-CG 3.4Å; F174-E217 VanDerWaalsContact CE1-CG 3.4Å; F174-E217 HydrophobicContact CZ-CG 4.22Å; E217-E219 HydrophobicContact CB-CG 4.42Å; E217-E219 PolarHBondContact O-N 3.34Å |
| 218 | N | 77.2 | Confident | 78.9 | Confident | 45 Ų | 45 | 68.2 Ų | 68.2 | 24% | 0.241 | 37% | 0.367 | C | S | . | . | trans | -65.2 | 76.1 | 161.3 | -71.2 | -43.6 | 0 | 0 | 0 | 105.9 | R172 K173 F174 A175 K190 T220 | R172-N218 PolarHBondContact O-ND2 2.76Å; K173-N218 PolarHBondContact O-N 2.94Å; F174-N218 PolarHBondContact O-ND2 3.13Å; A175-N218 WeakPolarHBondContact CB-OD1 3.5Å; K190-N218 PolarHBondContact NZ-OD1 3.35Å; N218-T220 PolarHBondContact O-N 3.15Å; N218-T220 VanDerWaalsContact O-N 3.08Å | ||
| 219 | E | 61.4 | Low | 78.5 | Confident | 83 Ų | 83 | 67.1 Ų | 67.1 | 39% | 0.388 | 36% | 0.361 | S | S | . | . | trans | -59.4 | 119.1 | 167.5 | -72.6 | -167.9 | 176.7 | 0 | 0 | 105.9 | S105 E217 G221 E222 | S105-E219 WeakPolarHBondContact CB-OE1 3.5Å; S105-E219 PolarHBondContact OG-OE1 2.98Å; E217-E219 HydrophobicContact CB-CG 4.42Å; E217-E219 PolarHBondContact O-N 3.34Å; E219-G221 PolarHBondContact O-N 3.16Å; E219-E222 PolarHBondContact O-N 2.79Å | ||
| 220 | T | 54.4 | Low | 78.5 | Confident | 158 Ų | 158 | 66.7 Ų | 66.7 | 97% | 0.969 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66 | 16.4 | -178.5 | -10.4 | 0 | 0 | 0 | 0 | 112.4 | N218 | N218-T220 PolarHBondContact O-N 3.15Å; N218-T220 VanDerWaalsContact O-N 3.08Å |
| 221 | G | 53.8 | Low | 78.4 | Confident | 61 Ų | 61 | 65.5 Ų | 65.5 | 63% | 0.629 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -139.9 | -7.1 | -172.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | E219 V223 | E219-G221 PolarHBondContact O-N 3.16Å; G221-V223 PolarHBondContact O-N 3.02Å |
| 222 | E | 52.5 | Low | 78 | Confident | 127 Ų | 127 | 69.2 Ų | 69.2 | 59% | 0.593 | 39% | 0.386 | S | S | * | . | trans | -81.2 | 102.4 | 166.2 | -82.3 | -165.4 | 164.8 | 0 | 0 | 108.6 | K216 E219 | K216-E222 IonicContact NZ-OE2 3.92Å; K216-E222 PolarHBondContact NZ-OE2 3.43Å; E219-E222 PolarHBondContact O-N 2.79Å | ||
| 223 | V | 65.3 | Low | 77.7 | Confident | 62 Ų | 62 | 70.8 Ų | 70.8 | 38% | 0.376 | 39% | 0.393 | S | S | . | . | trans | -78.2 | 125 | 175.8 | 178.9 | 0 | 0 | 0 | 0 | 108.8 | G221 W225 F228 | G221-V223 PolarHBondContact O-N 3.02Å; V223-W225 HydrophobicContact CB-CD2 4.06Å; V223-W225 HydrophobicContact CB-CE3 4.44Å; V223-W225 HydrophobicContact CB-CH2 4.2Å; V223-W225 HydrophobicContact CB-CZ2 3.77Å; V223-W225 HydrophobicContact CG1-CD2 3.78Å; V223-W225 HydrophobicContact CG1-CE3 3.75Å; V223-W225 HydrophobicContact CG1-CG 4.43Å; V223-W225 HydrophobicContact CG1-CH2 4.03Å; V223-W225 HydrophobicContact CG1-CZ2 4.05Å; V223-W225 HydrophobicContact CG1-CZ3 3.88Å; V223-W225 HydrophobicContact CG2-CH2 4.38Å; V223-W225 HydrophobicContact CG2-CZ2 4.12Å; V223-W225 PolarHBondContact O-N 3.12Å; V223-W225 PolarHBondContact O-NE1 2.69Å; V223-F228 HydrophobicContact CG1-CD2 4.39Å; V223-F228 HydrophobicContact CG1-CE2 3.49Å; V223-F228 VanDerWaalsContact CG1-CE2 3.49Å; V223-F228 HydrophobicContact CG1-CZ 4.06Å | ||
| 224 | E | 69.6 | Low | 77.4 | Confident | 90 Ų | 90 | 76.7 Ų | 76.7 | 42% | 0.421 | 42% | 0.42 | S | S | . | . | trans | -71.8 | 75.8 | 173.5 | -69.9 | -169.9 | -128.7 | 0 | 0 | 110.3 | H226 A227 F228 | E224-H226 PolarHBondContact O-N 2.97Å; E224-A227 HydrophobicContact CB-CB 4.31Å; E224-A227 WeakPolarHBondContact O-CB 3.44Å; E224-A227 PolarHBondContact O-N 3.38Å; E224-F228 WeakPolarHBondContact O-CD2 3.23Å; E224-F228 WeakPolarHBondContact O-CE2 3.24Å | ||
| 225 | W | 79.6 | Confident | 77.4 | Confident | 123 Ų | 123 | 81.6 Ų | 81.6 | 47% | 0.466 | 45% | 0.447 | S | S | . | . | G | 310 helix | trans | -55.4 | -29.8 | -174 | -62.2 | 108.9 | 0 | 0 | 0 | 113.9 | V223 A227 F228 L233 F236 | V223-W225 HydrophobicContact CB-CD2 4.06Å; V223-W225 HydrophobicContact CB-CE3 4.44Å; V223-W225 HydrophobicContact CB-CH2 4.2Å; V223-W225 HydrophobicContact CB-CZ2 3.77Å; V223-W225 HydrophobicContact CG1-CD2 3.78Å; V223-W225 HydrophobicContact CG1-CE3 3.75Å; V223-W225 HydrophobicContact CG1-CG 4.43Å; V223-W225 HydrophobicContact CG1-CH2 4.03Å; V223-W225 HydrophobicContact CG1-CZ2 4.05Å; V223-W225 HydrophobicContact CG1-CZ3 3.88Å; V223-W225 HydrophobicContact CG2-CH2 4.38Å; V223-W225 HydrophobicContact CG2-CZ2 4.12Å; V223-W225 PolarHBondContact O-N 3.12Å; V223-W225 PolarHBondContact O-NE1 2.69Å; W225-A227 PolarHBondContact O-N 3.02Å; W225-F228 PolarHBondContact O-N 2.99Å; W225-L233 HydrophobicContact CB-CD2 4.17Å; W225-L233 HydrophobicContact CD2-CD2 4.47Å; W225-L233 HydrophobicContact CE3-CD2 3.67Å; W225-F236 HydrophobicContact CE3-CD2 4.21Å; W225-F236 HydrophobicContact CZ3-CB 4.22Å; W225-F236 AromaticContact CZ3-CD2 3.66Å; W225-F236 HydrophobicContact CZ3-CD2 3.66Å; W225-F236 HydrophobicContact CZ3-CE2 4.27Å; W225-F236 HydrophobicContact CZ3-CG 4.05Å |
| 226 | H | 72.7 | Confident | 77.4 | Confident | 146 Ų | 146 | 84.6 Ų | 84.6 | 68% | 0.676 | 46% | 0.46 | S | S | * | . | G | 310 helix | trans | -70.2 | -16.8 | 178.3 | -56 | 94.7 | 0 | 0 | 0 | 114 | E224 F228 | E224-H226 PolarHBondContact O-N 2.97Å; H226-F228 VanDerWaalsContact C-N 3.26Å |
| 227 | A | 73.3 | Confident | 77.5 | Confident | 79 Ų | 79 | 88.3 Ų | 88.3 | 65% | 0.653 | 48% | 0.48 | S | S | * | . | G | 310 helix | trans | -79.8 | -10.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | E224 W225 | E224-A227 HydrophobicContact CB-CB 4.31Å; E224-A227 WeakPolarHBondContact O-CB 3.44Å; E224-A227 PolarHBondContact O-N 3.38Å; W225-A227 PolarHBondContact O-N 3.02Å |
| 228 | F | 77 | Confident | 77.9 | Confident | 69 Ų | 69 | 91 Ų | 91 | 30% | 0.303 | 50% | 0.499 | S | S | . | . | S | Bend | trans | -97.1 | 143.1 | 178.3 | -59.6 | -86.9 | 0 | 0 | 0 | 110.7 | V223 E224 W225 H226 E232 L233 F236 | V223-F228 HydrophobicContact CG1-CD2 4.39Å; V223-F228 HydrophobicContact CG1-CE2 3.49Å; V223-F228 VanDerWaalsContact CG1-CE2 3.49Å; V223-F228 HydrophobicContact CG1-CZ 4.06Å; E224-F228 WeakPolarHBondContact O-CD2 3.23Å; E224-F228 WeakPolarHBondContact O-CE2 3.24Å; W225-F228 PolarHBondContact O-N 2.99Å; H226-F228 VanDerWaalsContact C-N 3.26Å; F228-E232 HydrophobicContact CB-CB 4.05Å; F228-E232 HydrophobicContact CD1-CB 4.4Å; F228-L233 HydrophobicContact CB-CD2 3.98Å; F228-L233 HydrophobicContact CB-CG 4.06Å; F228-F236 HydrophobicContact CB-CE2 4.2Å; F228-F236 AromaticContact CD1-CE2 3.57Å; F228-F236 HydrophobicContact CD1-CE2 3.57Å; F228-F236 AromaticContact CD1-CZ 3.76Å; F228-F236 HydrophobicContact CD1-CZ 3.76Å; F228-F236 HydrophobicContact CD2-CE2 4.28Å; F228-F236 AromaticContact CE1-CE2 3.94Å; F228-F236 HydrophobicContact CE1-CE2 3.94Å; F228-F236 AromaticContact CE1-CZ 3.77Å; F228-F236 HydrophobicContact CE1-CZ 3.77Å; F228-F236 AromaticContact CG-CE2 3.74Å; F228-F236 HydrophobicContact CG-CE2 3.74Å; F228-F236 HydrophobicContact CG-CZ 4.39Å; F228-F236 HydrophobicContact CZ-CE2 4.44Å; F228-F236 HydrophobicContact CZ-CZ 4.41Å |
| 229 | S | 79.1 | Confident | 78.7 | Confident | 56 Ų | 56 | 93.1 Ų | 93.1 | 39% | 0.392 | 51% | 0.509 | S | S | . | . | trans | -66.6 | 157.3 | 172.7 | 67.4 | 0 | 0 | 0 | 0 | 111.3 | P231 E232 L233 | S229-P231 VanDerWaalsContact C-CD 3.49Å; S229-P231 VanDerWaalsContact C-N 3.32Å; S229-E232 WeakPolarHBondContact CB-OE2 3.44Å; S229-E232 PolarHBondContact N-OE2 2.93Å; S229-E232 WeakPolarHBondContact O-CB 3.44Å; S229-E232 PolarHBondContact O-N 2.88Å; S229-E232 VanDerWaalsContact OG-CD 3.27Å; S229-E232 WeakPolarHBondContact OG-CG 3.44Å; S229-E232 PolarHBondContact OG-OE2 3.42Å; S229-L233 PolarHBondContact O-N 3.07Å | ||
| 230 | V | 88.6 | Confident | 80.1 | Confident | 107 Ų | 107 | 93.5 Ų | 93.5 | 65% | 0.648 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -53.3 | -42.7 | 177.8 | 178.8 | 0 | 0 | 0 | 0 | 112.7 | E232 L233 Q234 | V230-E232 PolarHBondContact O-N 3.03Å; V230-L233 PolarHBondContact O-N 3.05Å; V230-Q234 PolarHBondContact O-N 2.85Å |
| 231 | P | 89.4 | Confident | 82.1 | Confident | 89 Ų | 89 | 92.4 Ų | 92.4 | 58% | 0.578 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.2 | -36.7 | 175.1 | -24.7 | 35.7 | 0 | 0 | 0 | 114.5 | S229 Q234 N235 | S229-P231 VanDerWaalsContact C-CD 3.49Å; S229-P231 VanDerWaalsContact C-N 3.32Å; P231-Q234 WeakPolarHBondContact O-CB 3.41Å; P231-Q234 PolarHBondContact O-N 2.98Å; P231-N235 PolarHBondContact O-N 2.74Å |
| 232 | E | 86.8 | Confident | 84 | Confident | 87 Ų | 87 | 95.9 Ų | 95.9 | 41% | 0.407 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.6 | -44.1 | 176.8 | -70.6 | 166.4 | 133.4 | 0 | 0 | 110.8 | F228 S229 V230 Q234 N235 F236 | F228-E232 HydrophobicContact CB-CB 4.05Å; F228-E232 HydrophobicContact CD1-CB 4.4Å; S229-E232 WeakPolarHBondContact CB-OE2 3.44Å; S229-E232 PolarHBondContact N-OE2 2.93Å; S229-E232 WeakPolarHBondContact O-CB 3.44Å; S229-E232 PolarHBondContact O-N 2.88Å; S229-E232 VanDerWaalsContact OG-CD 3.27Å; S229-E232 WeakPolarHBondContact OG-CG 3.44Å; S229-E232 PolarHBondContact OG-OE2 3.42Å; V230-E232 PolarHBondContact O-N 3.03Å; E232-Q234 VanDerWaalsContact C-N 3.29Å; E232-Q234 PolarHBondContact O-N 3.36Å; E232-N235 WeakPolarHBondContact O-CB 3.44Å; E232-N235 PolarHBondContact O-N 3.04Å; E232-N235 VanDerWaalsContact O-N 3.12Å; E232-F236 HydrophobicContact CB-CE2 4.15Å; E232-F236 WeakPolarHBondContact O-CD2 3.45Å; E232-F236 WeakPolarHBondContact O-CG 3.33Å; E232-F236 PolarHBondContact O-N 3.32Å |
| 233 | L | 90.6 | Very high | 86 | Confident | 55 Ų | 55 | 93.4 Ų | 93.4 | 29% | 0.288 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -57.7 | -42.1 | 172.4 | -66.7 | 176.1 | 0 | 0 | 0 | 112.1 | W225 F228 S229 V230 N235 F236 L237 | W225-L233 HydrophobicContact CB-CD2 4.17Å; W225-L233 HydrophobicContact CD2-CD2 4.47Å; W225-L233 HydrophobicContact CE3-CD2 3.67Å; F228-L233 HydrophobicContact CB-CD2 3.98Å; F228-L233 HydrophobicContact CB-CG 4.06Å; S229-L233 PolarHBondContact O-N 3.07Å; V230-L233 PolarHBondContact O-N 3.05Å; L233-N235 VanDerWaalsContact C-N 3.34Å; L233-N235 PolarHBondContact O-N 3.23Å; L233-F236 HydrophobicContact CD2-CD2 4.21Å; L233-F236 PolarHBondContact O-N 2.75Å; L233-L237 WeakPolarHBondContact O-CG 3.47Å; L233-L237 PolarHBondContact O-N 2.86Å; L233-L237 VanDerWaalsContact O-N 3.11Å |
| 234 | Q | 91 | Very high | 87.4 | Confident | 123 Ų | 123 | 96.5 Ų | 96.5 | 58% | 0.575 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.8 | -41.3 | 175.7 | -156.8 | 90.6 | 19.9 | 0 | 0 | 111.8 | V230 P231 E232 L237 V238 | V230-Q234 PolarHBondContact O-N 2.85Å; P231-Q234 WeakPolarHBondContact O-CB 3.41Å; P231-Q234 PolarHBondContact O-N 2.98Å; E232-Q234 VanDerWaalsContact C-N 3.29Å; E232-Q234 PolarHBondContact O-N 3.36Å; Q234-L237 PolarHBondContact O-N 3.4Å; Q234-V238 WeakPolarHBondContact O-CG2 3.47Å; Q234-V238 PolarHBondContact O-N 3.25Å |
| 235 | N | 93.8 | Very high | 88.7 | Confident | 103 Ų | 103 | 94.5 Ų | 94.5 | 55% | 0.551 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63.5 | -43 | 175.6 | -92.8 | -38.2 | 0 | 0 | 0 | 112.1 | P231 E232 L233 L237 V238 I239 | P231-N235 PolarHBondContact O-N 2.74Å; E232-N235 WeakPolarHBondContact O-CB 3.44Å; E232-N235 PolarHBondContact O-N 3.04Å; E232-N235 VanDerWaalsContact O-N 3.12Å; L233-N235 VanDerWaalsContact C-N 3.34Å; L233-N235 PolarHBondContact O-N 3.23Å; N235-L237 VanDerWaalsContact C-N 3.28Å; N235-L237 PolarHBondContact O-N 3.19Å; N235-V238 PolarHBondContact O-N 3.33Å; N235-I239 WeakPolarHBondContact O-CG1 3.13Å; N235-I239 PolarHBondContact O-N 2.76Å |
| 236 | F | 93.1 | Very high | 89.5 | Confident | 63 Ų | 63 | 93.1 Ų | 93.1 | 28% | 0.276 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -59.5 | -40.6 | 176.3 | -60.6 | -47.5 | 0 | 0 | 0 | 111.6 | W225 F228 E232 L233 V238 I239 L240 | W225-F236 HydrophobicContact CE3-CD2 4.21Å; W225-F236 HydrophobicContact CZ3-CB 4.22Å; W225-F236 AromaticContact CZ3-CD2 3.66Å; W225-F236 HydrophobicContact CZ3-CD2 3.66Å; W225-F236 HydrophobicContact CZ3-CE2 4.27Å; W225-F236 HydrophobicContact CZ3-CG 4.05Å; F228-F236 HydrophobicContact CB-CE2 4.2Å; F228-F236 AromaticContact CD1-CE2 3.57Å; F228-F236 HydrophobicContact CD1-CE2 3.57Å; F228-F236 AromaticContact CD1-CZ 3.76Å; F228-F236 HydrophobicContact CD1-CZ 3.76Å; F228-F236 HydrophobicContact CD2-CE2 4.28Å; F228-F236 AromaticContact CE1-CE2 3.94Å; F228-F236 HydrophobicContact CE1-CE2 3.94Å; F228-F236 AromaticContact CE1-CZ 3.77Å; F228-F236 HydrophobicContact CE1-CZ 3.77Å; F228-F236 AromaticContact CG-CE2 3.74Å; F228-F236 HydrophobicContact CG-CE2 3.74Å; F228-F236 HydrophobicContact CG-CZ 4.39Å; F228-F236 HydrophobicContact CZ-CE2 4.44Å; F228-F236 HydrophobicContact CZ-CZ 4.41Å; E232-F236 HydrophobicContact CB-CE2 4.15Å; E232-F236 WeakPolarHBondContact O-CD2 3.45Å; E232-F236 WeakPolarHBondContact O-CG 3.33Å; E232-F236 PolarHBondContact O-N 3.32Å; L233-F236 HydrophobicContact CD2-CD2 4.21Å; L233-F236 PolarHBondContact O-N 2.75Å; F236-V238 PolarHBondContact O-N 3.08Å; F236-I239 PolarHBondContact O-N 3.16Å; F236-L240 WeakPolarHBondContact O-CB 3.24Å; F236-L240 VanDerWaalsContact O-CG 3.25Å; F236-L240 WeakPolarHBondContact O-CG 3.47Å; F236-L240 PolarHBondContact O-N 2.95Å |
| 237 | L | 92 | Very high | 90.5 | Very high | 102 Ų | 102 | 93.4 Ų | 93.4 | 53% | 0.534 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -60 | -43.7 | 175.3 | -69.5 | 174.8 | 0 | 0 | 0 | 112.4 | L233 Q234 N235 I239 L240 E241 | L233-L237 WeakPolarHBondContact O-CG 3.47Å; L233-L237 PolarHBondContact O-N 2.86Å; L233-L237 VanDerWaalsContact O-N 3.11Å; Q234-L237 PolarHBondContact O-N 3.4Å; N235-L237 VanDerWaalsContact C-N 3.28Å; N235-L237 PolarHBondContact O-N 3.19Å; L237-I239 PolarHBondContact O-N 3.04Å; L237-L240 PolarHBondContact O-N 3.37Å; L237-E241 WeakPolarHBondContact O-CB 3.25Å; L237-E241 PolarHBondContact O-N 3.44Å |
| 238 | V | 94.9 | Very high | 91.6 | Very high | 84 Ų | 84 | 92.9 Ų | 92.9 | 51% | 0.509 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.2 | -42.2 | 178.1 | 172.8 | 0 | 0 | 0 | 0 | 111.5 | Q234 N235 F236 K242 | Q234-V238 WeakPolarHBondContact O-CG2 3.47Å; Q234-V238 PolarHBondContact O-N 3.25Å; N235-V238 PolarHBondContact O-N 3.33Å; F236-V238 PolarHBondContact O-N 3.08Å; V238-K242 WeakPolarHBondContact O-CB 3.12Å; V238-K242 PolarHBondContact O-N 2.68Å; V238-K242 VanDerWaalsContact O-N 3.09Å |
| 239 | I | 93 | Very high | 92.6 | Very high | 88 Ų | 88 | 96 Ų | 96 | 45% | 0.451 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.6 | -47.2 | 177.2 | -66.3 | 165.6 | 0 | 0 | 0 | 110 | N235 F236 L237 E241 K242 E243 | N235-I239 WeakPolarHBondContact O-CG1 3.13Å; N235-I239 PolarHBondContact O-N 2.76Å; F236-I239 PolarHBondContact O-N 3.16Å; L237-I239 PolarHBondContact O-N 3.04Å; I239-E241 PolarHBondContact O-N 3.03Å; I239-K242 PolarHBondContact O-N 3.38Å; I239-E243 WeakPolarHBondContact O-CG 3.47Å; I239-E243 PolarHBondContact O-N 3.43Å |
| 240 | L | 92.3 | Very high | 93.4 | Very high | 91 Ų | 91 | 95.9 Ų | 95.9 | 48% | 0.476 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.1 | -42.9 | -179.6 | -71.5 | 170.6 | 0 | 0 | 0 | 112.3 | F236 L237 K242 E243 E244 | F236-L240 WeakPolarHBondContact O-CB 3.24Å; F236-L240 VanDerWaalsContact O-CG 3.25Å; F236-L240 WeakPolarHBondContact O-CG 3.47Å; F236-L240 PolarHBondContact O-N 2.95Å; L237-L240 PolarHBondContact O-N 3.37Å; L240-K242 VanDerWaalsContact C-N 3.32Å; L240-K242 PolarHBondContact O-N 3.01Å; L240-E243 PolarHBondContact O-N 2.99Å; L240-E244 WeakPolarHBondContact O-CB 3.19Å; L240-E244 PolarHBondContact O-N 3.38Å |
| 241 | E | 94.9 | Very high | 93.9 | Very high | 136 Ų | 136 | 95.7 Ų | 95.7 | 64% | 0.636 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.7 | -41.7 | 176.7 | -176.2 | 175.9 | -163.7 | 0 | 0 | 111.4 | L237 I239 E244 A245 | L237-E241 WeakPolarHBondContact O-CB 3.25Å; L237-E241 PolarHBondContact O-N 3.44Å; I239-E241 PolarHBondContact O-N 3.03Å; E241-E244 PolarHBondContact O-N 2.8Å; E241-A245 WeakPolarHBondContact O-CB 3.45Å; E241-A245 PolarHBondContact O-N 3.33Å |
| 242 | K | 95.4 | Very high | 94.3 | Very high | 134 Ų | 134 | 97.1 Ų | 97.1 | 58% | 0.583 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -63.3 | -47 | 176.1 | -175.6 | -177 | 173.4 | -170.8 | 0 | 111.5 | V238 I239 L240 E244 A245 E246 | V238-K242 WeakPolarHBondContact O-CB 3.12Å; V238-K242 PolarHBondContact O-N 2.68Å; V238-K242 VanDerWaalsContact O-N 3.09Å; I239-K242 PolarHBondContact O-N 3.38Å; L240-K242 VanDerWaalsContact C-N 3.32Å; L240-K242 PolarHBondContact O-N 3.01Å; K242-E244 VanDerWaalsContact C-N 3.34Å; K242-E244 PolarHBondContact O-N 3.39Å; K242-A245 PolarHBondContact O-N 2.97Å; K242-E246 WeakPolarHBondContact CE-OE1 3.44Å; K242-E246 WeakPolarHBondContact O-CG 3.5Å; K242-E246 PolarHBondContact O-N 2.9Å |
| 243 | E | 94.1 | Very high | 94.8 | Very high | 75 Ų | 75 | 98.5 Ų | 98.5 | 35% | 0.35 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.8 | -40.9 | 177.6 | -73.4 | -168.2 | -173.3 | 0 | 0 | 112.3 | I239 L240 E246 R247 | I239-E243 WeakPolarHBondContact O-CG 3.47Å; I239-E243 PolarHBondContact O-N 3.43Å; L240-E243 PolarHBondContact O-N 2.99Å; E243-E246 PolarHBondContact O-N 2.91Å; E243-R247 WeakPolarHBondContact O-CG 3.45Å; E243-R247 PolarHBondContact O-N 3.11Å; E243-R247 IonicContact OE2-CZ 2.76Å; E243-R247 IonicContact OE2-NH1 3.47Å; E243-R247 PolarHBondContact OE2-NH1 3.25Å; E243-R247 IonicContact OE2-NH2 3.73Å; E243-R247 PolarHBondContact OE2-NH2 2.91Å |
| 244 | E | 94.8 | Very high | 95.1 | Very high | 127 Ų | 127 | 103.8 Ų | 103.8 | 59% | 0.593 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -60.4 | -48.2 | 176 | -177.4 | 178.1 | -169.7 | 0 | 0 | 110.7 | L240 E241 K242 E246 R247 V248 | L240-E244 WeakPolarHBondContact O-CB 3.19Å; L240-E244 PolarHBondContact O-N 3.38Å; E241-E244 PolarHBondContact O-N 2.8Å; K242-E244 VanDerWaalsContact C-N 3.34Å; K242-E244 PolarHBondContact O-N 3.39Å; E244-E246 VanDerWaalsContact C-N 3.29Å; E244-E246 PolarHBondContact O-N 2.81Å; E244-R247 PolarHBondContact O-N 3.44Å; E244-R247 VanDerWaalsContact O-N 3.15Å; E244-V248 WeakPolarHBondContact O-CG2 3.36Å; E244-V248 PolarHBondContact O-N 2.92Å |
| 245 | A | 96.6 | Very high | 95.4 | Very high | 48 Ų | 48 | 105 Ų | 105 | 40% | 0.397 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.1 | -39 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | E241 K242 R249 | E241-A245 WeakPolarHBondContact O-CB 3.45Å; E241-A245 PolarHBondContact O-N 3.33Å; K242-A245 PolarHBondContact O-N 2.97Å; A245-R249 WeakPolarHBondContact O-CB 3.32Å; A245-R249 PolarHBondContact O-N 3.43Å |
| 246 | E | 96.6 | Very high | 95.6 | Very high | 93 Ų | 93 | 103.3 Ų | 103.3 | 44% | 0.435 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.8 | -42.8 | 174.8 | -74.9 | 175.9 | -171.2 | 0 | 0 | 112.1 | K242 E243 E244 R249 A250 | K242-E246 WeakPolarHBondContact CE-OE1 3.44Å; K242-E246 WeakPolarHBondContact O-CG 3.5Å; K242-E246 PolarHBondContact O-N 2.9Å; E243-E246 PolarHBondContact O-N 2.91Å; E244-E246 VanDerWaalsContact C-N 3.29Å; E244-E246 PolarHBondContact O-N 2.81Å; E246-R249 PolarHBondContact O-N 3.44Å; E246-A250 PolarHBondContact O-N 2.97Å |
| 247 | R | 93.4 | Very high | 95.8 | Very high | 152 Ų | 152 | 104.7 Ų | 104.7 | 57% | 0.574 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.9 | -45 | 175.6 | -73.9 | -175.1 | -175.6 | 96.4 | 4.9 | 112 | E243 E244 R249 A250 V251 | E243-R247 WeakPolarHBondContact O-CG 3.45Å; E243-R247 PolarHBondContact O-N 3.11Å; E243-R247 IonicContact OE2-CZ 2.76Å; E243-R247 IonicContact OE2-NH1 3.47Å; E243-R247 PolarHBondContact OE2-NH1 3.25Å; E243-R247 IonicContact OE2-NH2 3.73Å; E243-R247 PolarHBondContact OE2-NH2 2.91Å; E244-R247 PolarHBondContact O-N 3.44Å; E244-R247 VanDerWaalsContact O-N 3.15Å; R247-R249 VanDerWaalsContact C-N 3.32Å; R247-R249 PolarHBondContact O-N 2.91Å; R247-A250 PolarHBondContact O-N 2.87Å; R247-V251 WeakPolarHBondContact O-CG2 3.24Å; R247-V251 PolarHBondContact O-N 3.01Å |
| 248 | V | 96.8 | Very high | 96 | Very high | 69 Ų | 69 | 107.5 Ų | 107.5 | 42% | 0.418 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -58.6 | -46 | 176.2 | 171 | 0 | 0 | 0 | 0 | 110.4 | E244 A250 V251 Q252 | E244-V248 WeakPolarHBondContact O-CG2 3.36Å; E244-V248 PolarHBondContact O-N 2.92Å; V248-A250 PolarHBondContact O-N 3.25Å; V248-V251 PolarHBondContact O-N 3.35Å; V248-Q252 HydrophobicContact CG1-CG 4.37Å; V248-Q252 WeakPolarHBondContact O-CB 3.34Å; V248-Q252 VanDerWaalsContact O-CG 3.31Å; V248-Q252 WeakPolarHBondContact O-CG 3.22Å; V248-Q252 PolarHBondContact O-N 3.39Å |
| 249 | R | 97.5 | Very high | 96.1 | Very high | 133 Ų | 133 | 109.9 Ų | 109.9 | 50% | 0.502 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.6 | -44.1 | 178.2 | -169 | -174.8 | -61.6 | 121.6 | 1.9 | 111.7 | A245 E246 R247 V251 Q252 Q253 | A245-R249 WeakPolarHBondContact O-CB 3.32Å; A245-R249 PolarHBondContact O-N 3.43Å; E246-R249 PolarHBondContact O-N 3.44Å; R247-R249 VanDerWaalsContact C-N 3.32Å; R247-R249 PolarHBondContact O-N 2.91Å; R249-V251 PolarHBondContact O-N 2.78Å; R249-Q252 PolarHBondContact O-N 2.62Å; R249-Q253 WeakPolarHBondContact O-CB 3.31Å; R249-Q253 WeakPolarHBondContact O-CG 3.4Å; R249-Q253 PolarHBondContact O-N 3Å |
| 250 | A | 96.5 | Very high | 96.2 | Very high | 55 Ų | 55 | 110.7 Ų | 110.7 | 46% | 0.455 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.4 | -44.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112 | E246 R247 V248 Q253 K254 | E246-A250 PolarHBondContact O-N 2.97Å; R247-A250 PolarHBondContact O-N 2.87Å; V248-A250 PolarHBondContact O-N 3.25Å; A250-Q253 PolarHBondContact O-N 3.28Å; A250-K254 WeakPolarHBondContact O-CB 3.41Å; A250-K254 PolarHBondContact O-N 3.3Å |
| 251 | V | 97.7 | Very high | 96.4 | Very high | 102 Ų | 102 | 112.7 Ų | 112.7 | 62% | 0.618 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -62.8 | -45.3 | 176.8 | 172.8 | 0 | 0 | 0 | 0 | 111.1 | R247 V248 R249 Q253 K254 Y255 | R247-V251 WeakPolarHBondContact O-CG2 3.24Å; R247-V251 PolarHBondContact O-N 3.01Å; V248-V251 PolarHBondContact O-N 3.35Å; R249-V251 PolarHBondContact O-N 2.78Å; V251-Q253 PolarHBondContact O-N 3.26Å; V251-K254 PolarHBondContact O-N 2.94Å; V251-Y255 WeakPolarHBondContact O-CB 3.4Å; V251-Y255 PolarHBondContact O-N 2.85Å |
| 252 | Q | 97.6 | Very high | 96.4 | Very high | 120 Ų | 120 | 110.7 Ų | 110.7 | 56% | 0.561 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.2 | -41.8 | 178.2 | -73.8 | 176.4 | -6.8 | 0 | 0 | 112.4 | V248 R249 Y255 T256 | V248-Q252 HydrophobicContact CG1-CG 4.37Å; V248-Q252 WeakPolarHBondContact O-CB 3.34Å; V248-Q252 VanDerWaalsContact O-CG 3.31Å; V248-Q252 WeakPolarHBondContact O-CG 3.22Å; V248-Q252 PolarHBondContact O-N 3.39Å; R249-Q252 PolarHBondContact O-N 2.62Å; Q252-Y255 PolarHBondContact O-N 3.38Å; Q252-T256 WeakPolarHBondContact O-CB 3.29Å; Q252-T256 PolarHBondContact O-N 3.13Å; Q252-T256 PolarHBondContact O-OG1 3.2Å |
| 253 | Q | 97.3 | Very high | 96.4 | Very high | 116 Ų | 116 | 108.4 Ų | 108.4 | 54% | 0.542 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63 | -46.8 | 175.9 | -75.6 | 177.7 | -11.8 | 0 | 0 | 111.3 | R249 A250 V251 Y255 T256 I257 | R249-Q253 WeakPolarHBondContact O-CB 3.31Å; R249-Q253 WeakPolarHBondContact O-CG 3.4Å; R249-Q253 PolarHBondContact O-N 3Å; A250-Q253 PolarHBondContact O-N 3.28Å; V251-Q253 PolarHBondContact O-N 3.26Å; Q253-Y255 VanDerWaalsContact C-N 3.34Å; Q253-Y255 PolarHBondContact O-N 2.84Å; Q253-T256 PolarHBondContact O-N 2.9Å; Q253-T256 VanDerWaalsContact O-N 3.16Å; Q253-I257 WeakPolarHBondContact O-CG1 3.5Å; Q253-I257 PolarHBondContact O-N 2.97Å |
| 254 | K | 96.9 | Very high | 96.4 | Very high | 165 Ų | 165 | 110.2 Ų | 110.2 | 72% | 0.717 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59.1 | -45.2 | 177.5 | -170.3 | 175.3 | -178.5 | 177.2 | 0 | 111.6 | A250 V251 T256 I257 Y258 | A250-K254 WeakPolarHBondContact O-CB 3.41Å; A250-K254 PolarHBondContact O-N 3.3Å; V251-K254 PolarHBondContact O-N 2.94Å; K254-T256 PolarHBondContact O-N 3.16Å; K254-I257 PolarHBondContact O-N 3.4Å; K254-Y258 WeakPolarHBondContact O-CB 3.46Å; K254-Y258 PolarHBondContact O-N 2.8Å |
| 255 | Y | 97.7 | Very high | 96.3 | Very high | 148 Ų | 148 | 106.4 Ų | 106.4 | 58% | 0.58 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -60.6 | -44.3 | 175.3 | 177.7 | -99.5 | 0 | 0 | 0 | 112.1 | V251 Q252 Q253 I257 Y258 R259 | V251-Y255 WeakPolarHBondContact O-CB 3.4Å; V251-Y255 PolarHBondContact O-N 2.85Å; Q252-Y255 PolarHBondContact O-N 3.38Å; Q253-Y255 VanDerWaalsContact C-N 3.34Å; Q253-Y255 PolarHBondContact O-N 2.84Å; Y255-I257 PolarHBondContact O-N 3.38Å; Y255-Y258 PolarHBondContact O-N 2.98Å; Y255-R259 VanDerWaalsContact O-CB 3.31Å; Y255-R259 WeakPolarHBondContact O-CB 3.43Å; Y255-R259 PolarHBondContact O-N 2.79Å |
| 256 | T | 97.8 | Very high | 96 | Very high | 68 Ų | 68 | 109.9 Ų | 109.9 | 42% | 0.417 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.3 | -46.7 | 179.7 | -58.8 | 0 | 0 | 0 | 0 | 111.5 | Q252 Q253 K254 R259 Q260 | Q252-T256 WeakPolarHBondContact O-CB 3.29Å; Q252-T256 PolarHBondContact O-N 3.13Å; Q252-T256 PolarHBondContact O-OG1 3.2Å; Q253-T256 PolarHBondContact O-N 2.9Å; Q253-T256 VanDerWaalsContact O-N 3.16Å; K254-T256 PolarHBondContact O-N 3.16Å; T256-R259 PolarHBondContact O-N 3.35Å; T256-Q260 WeakPolarHBondContact O-CG 3.47Å; T256-Q260 PolarHBondContact O-N 3.11Å |
| 257 | I | 97.4 | Very high | 95.7 | Very high | 92 Ų | 92 | 112.8 Ų | 112.8 | 47% | 0.472 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.1 | -47.3 | 177.4 | -67.4 | 165.9 | 0 | 0 | 0 | 110.4 | Q253 K254 Y255 R259 Q260 K261 | Q253-I257 WeakPolarHBondContact O-CG1 3.5Å; Q253-I257 PolarHBondContact O-N 2.97Å; K254-I257 PolarHBondContact O-N 3.4Å; Y255-I257 PolarHBondContact O-N 3.38Å; I257-R259 PolarHBondContact O-N 3.31Å; I257-Q260 PolarHBondContact O-N 2.99Å; I257-K261 HydrophobicContact CG2-CD 4.49Å; I257-K261 WeakPolarHBondContact O-CG 3.48Å; I257-K261 PolarHBondContact O-N 2.81Å |
| 258 | Y | 97 | Very high | 95.1 | Very high | 161 Ų | 161 | 113.4 Ų | 113.4 | 63% | 0.631 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63.4 | -43.3 | -179.1 | -168.2 | -101.8 | 0 | 0 | 0 | 111.9 | K254 Y255 Q260 K261 L262 | K254-Y258 WeakPolarHBondContact O-CB 3.46Å; K254-Y258 PolarHBondContact O-N 2.8Å; Y255-Y258 PolarHBondContact O-N 2.98Å; Y258-Q260 VanDerWaalsContact C-N 3.34Å; Y258-Q260 PolarHBondContact O-N 3.47Å; Y258-K261 PolarHBondContact O-N 3.3Å; Y258-L262 PolarHBondContact O-N 2.97Å |
| 259 | R | 96.2 | Very high | 93.8 | Very high | 134 Ų | 134 | 118.3 Ų | 118.3 | 51% | 0.506 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -59.2 | -43.6 | 175.4 | -176.9 | -179.9 | 179.9 | -178.6 | 3.6 | 112 | Y255 T256 I257 L262 Q263 | Y255-R259 VanDerWaalsContact O-CB 3.31Å; Y255-R259 WeakPolarHBondContact O-CB 3.43Å; Y255-R259 PolarHBondContact O-N 2.79Å; T256-R259 PolarHBondContact O-N 3.35Å; I257-R259 PolarHBondContact O-N 3.31Å; R259-L262 PolarHBondContact O-N 3.33Å; R259-Q263 WeakPolarHBondContact O-CG 3.33Å; R259-Q263 PolarHBondContact O-N 3.33Å |
| 260 | Q | 96.5 | Very high | 92 | Very high | 105 Ų | 105 | 114.2 Ų | 114.2 | 49% | 0.491 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -62.4 | -45.2 | 177.3 | -76.2 | 176.5 | -8.2 | 0 | 0 | 111.9 | T256 I257 Y258 L262 Q263 Q264 | T256-Q260 WeakPolarHBondContact O-CG 3.47Å; T256-Q260 PolarHBondContact O-N 3.11Å; I257-Q260 PolarHBondContact O-N 2.99Å; Y258-Q260 VanDerWaalsContact C-N 3.34Å; Y258-Q260 PolarHBondContact O-N 3.47Å; Q260-L262 VanDerWaalsContact C-N 3.33Å; Q260-L262 PolarHBondContact O-N 3.42Å; Q260-Q263 PolarHBondContact O-N 2.99Å; Q260-Q264 WeakPolarHBondContact O-CG 3.35Å; Q260-Q264 PolarHBondContact O-N 3.45Å |
| 261 | K | 95.8 | Very high | 90.2 | Very high | 134 Ų | 134 | 121.4 Ų | 121.4 | 58% | 0.583 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -59.4 | -43.5 | 176 | -71.9 | -178 | 176.7 | -175 | 0 | 111.8 | I257 Y258 Q263 Q264 A265 | I257-K261 HydrophobicContact CG2-CD 4.49Å; I257-K261 WeakPolarHBondContact O-CG 3.48Å; I257-K261 PolarHBondContact O-N 2.81Å; Y258-K261 PolarHBondContact O-N 3.3Å; K261-Q263 PolarHBondContact O-N 3.5Å; K261-Q264 PolarHBondContact O-N 3.1Å; K261-A265 PolarHBondContact O-N 3.02Å |
| 262 | L | 95.1 | Very high | 89.8 | Confident | 94 Ų | 94 | 122.4 Ų | 122.4 | 49% | 0.492 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -63.4 | -41.8 | 178 | -169.9 | 68.2 | 0 | 0 | 0 | 111.8 | Y258 R259 Q260 A265 L266 | Y258-L262 PolarHBondContact O-N 2.97Å; R259-L262 PolarHBondContact O-N 3.33Å; Q260-L262 VanDerWaalsContact C-N 3.33Å; Q260-L262 PolarHBondContact O-N 3.42Å; L262-A265 PolarHBondContact O-N 3.03Å; L262-L266 HydrophobicContact CG-CD1 4.47Å; L262-L266 WeakPolarHBondContact O-CG 3.46Å; L262-L266 PolarHBondContact O-N 2.92Å |
| 263 | Q | 94.8 | Very high | 89.4 | Confident | 86 Ų | 86 | 122.5 Ų | 122.5 | 40% | 0.402 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -64.1 | -40.3 | 176.3 | -74.3 | 176.9 | -26.8 | 0 | 0 | 112.4 | R259 Q260 K261 L266 Q267 | R259-Q263 WeakPolarHBondContact O-CG 3.33Å; R259-Q263 PolarHBondContact O-N 3.33Å; Q260-Q263 PolarHBondContact O-N 2.99Å; K261-Q263 PolarHBondContact O-N 3.5Å; Q263-L266 PolarHBondContact O-N 2.97Å; Q263-Q267 WeakPolarHBondContact O-CG 3.44Å; Q263-Q267 PolarHBondContact O-N 2.91Å; Q263-Q267 VanDerWaalsContact O-N 3.09Å |
| 264 | Q | 93.5 | Very high | 88.9 | Confident | 112 Ų | 112 | 122.9 Ų | 122.9 | 52% | 0.523 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -63.6 | -44.5 | 175.3 | -72.4 | 173.7 | -3.3 | 0 | 0 | 111.7 | Q260 K261 L266 Q267 Q268 | Q260-Q264 WeakPolarHBondContact O-CG 3.35Å; Q260-Q264 PolarHBondContact O-N 3.45Å; K261-Q264 PolarHBondContact O-N 3.1Å; Q264-L266 VanDerWaalsContact C-N 3.33Å; Q264-L266 PolarHBondContact O-N 3.31Å; Q264-Q267 PolarHBondContact O-N 3.49Å; Q264-Q268 WeakPolarHBondContact O-CG 3.26Å; Q264-Q268 PolarHBondContact O-N 3.27Å |
| 265 | A | 92.9 | Very high | 88.5 | Confident | 48 Ų | 48 | 120.4 Ų | 120.4 | 40% | 0.397 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -61.2 | -41.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | K261 L262 Q267 Q268 H269 | K261-A265 PolarHBondContact O-N 3.02Å; L262-A265 PolarHBondContact O-N 3.03Å; A265-Q267 VanDerWaalsContact C-N 3.34Å; A265-Q267 PolarHBondContact O-N 3.1Å; A265-Q268 PolarHBondContact O-N 3.31Å; A265-H269 PolarHBondContact O-N 2.99Å |
| 266 | L | 91.8 | Very high | 87.9 | Confident | 121 Ų | 121 | 118.7 Ų | 118.7 | 63% | 0.634 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -64.5 | -36.4 | 175.8 | -73.3 | 169.9 | 0 | 0 | 0 | 112.7 | L262 Q263 Q264 H269 G270 | L262-L266 HydrophobicContact CG-CD1 4.47Å; L262-L266 WeakPolarHBondContact O-CG 3.46Å; L262-L266 PolarHBondContact O-N 2.92Å; Q263-L266 PolarHBondContact O-N 2.97Å; Q264-L266 VanDerWaalsContact C-N 3.33Å; Q264-L266 PolarHBondContact O-N 3.31Å; L266-H269 PolarHBondContact O-N 2.73Å; L266-G270 PolarHBondContact O-N 3.41Å |
| 267 | Q | 88.9 | Confident | 87.2 | Confident | 154 Ų | 154 | 122.1 Ų | 122.1 | 72% | 0.72 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -70.3 | -34.4 | 176.8 | -72.7 | 171.6 | 22 | 0 | 0 | 112.5 | Q263 Q264 A265 H269 | Q263-Q267 WeakPolarHBondContact O-CG 3.44Å; Q263-Q267 PolarHBondContact O-N 2.91Å; Q263-Q267 VanDerWaalsContact O-N 3.09Å; Q264-Q267 PolarHBondContact O-N 3.49Å; A265-Q267 VanDerWaalsContact C-N 3.34Å; A265-Q267 PolarHBondContact O-N 3.1Å; Q267-H269 VanDerWaalsContact C-N 3.28Å; Q267-H269 PolarHBondContact O-N 3.37Å |
| 268 | Q | 81.3 | Confident | 86.5 | Confident | 164 Ų | 164 | 124.2 Ų | 124.2 | 77% | 0.766 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -73.5 | -19.3 | 177.1 | -69.4 | -178.7 | 8.3 | 0 | 0 | 113.4 | Q264 A265 | Q264-Q268 WeakPolarHBondContact O-CG 3.26Å; Q264-Q268 PolarHBondContact O-N 3.27Å; A265-Q268 PolarHBondContact O-N 3.31Å |
| 269 | H | 69.7 | Low | 85.7 | Confident | 172 Ų | 172 | 121.4 Ų | 121.4 | 80% | 0.796 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.3 | 15.3 | 178.1 | -90.4 | -72 | 0 | 0 | 0 | 113.9 | A265 L266 Q267 | A265-H269 PolarHBondContact O-N 2.99Å; L266-H269 PolarHBondContact O-N 2.73Å; Q267-H269 VanDerWaalsContact C-N 3.28Å; Q267-H269 PolarHBondContact O-N 3.37Å |
| 270 | G | 60.7 | Low | 84.8 | Confident | 47 Ų | 47 | 120.3 Ų | 120.3 | 49% | 0.485 | 64% | 0.636 | S | S | . | * | trans | -69.2 | 145.2 | 168.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | L266 | L266-G270 PolarHBondContact O-N 3.41Š| ||
| 271 | P | 57 | Low | 83.8 | Confident | 207 Ų | 207 | 121.7 Ų | 121.7 | 100% | 1.344 | 65% | 0.649 | S | S | * | * | trans | -63.9 | 0 | -175.9 | 28.8 | -35.8 | 0 | 0 | 0 | 114.1 |
Retrieved 271 of 271 residues in 150.3 ms
(Link to these results)