| 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 | 39.1 | Very low | 38.8 | Very low | 230 Ų | 230 | 153.9 Ų | 153.9 | 100% | 1.133 | 85% | 0.85 | S | S | * | * | 0 | 73.2 | 0 | -56.2 | -167 | 178.2 | 0 | 0 | 106.9 | |||||
| 2 | T | 38.1 | Very low | 38.8 | Very low | 144 Ų | 144 | 150 Ų | 150 | 88% | 0.883 | 83% | 0.834 | S | S | * | * | 52.2 | 121 | 89.6 | 59.6 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 3 | G | 39.5 | Very low | 38.4 | Very low | 82 Ų | 82 | 150.2 Ų | 150.2 | 85% | 0.845 | 83% | 0.827 | S | S | * | * | cis | -152.5 | 160 | 30 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 4 | K | 38.4 | Very low | 38.2 | Very low | 199 Ų | 199 | 147.3 Ų | 147.3 | 87% | 0.865 | 82% | 0.823 | S | S | * | * | trans | -81.8 | 156.1 | 172.9 | -61.7 | 170.4 | 173.5 | 178.9 | 0 | 110.3 | ||||
| 5 | L | 39.2 | Very low | 38.4 | Very low | 172 Ų | 172 | 144.8 Ų | 144.8 | 90% | 0.901 | 82% | 0.82 | S | S | * | * | trans | -171.6 | 90.9 | 142.9 | -100.2 | 149.8 | 0 | 0 | 0 | 105.9 | ||||
| 6 | A | 38.7 | Very low | 38.3 | Very low | 72 Ų | 72 | 144.3 Ų | 144.3 | 60% | 0.595 | 81% | 0.813 | S | S | * | * | 77.7 | 112.5 | 78.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 7 | E | 36.5 | Very low | 38 | Very low | 175 Ų | 175 | 145.4 Ų | 145.4 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | trans | 65.8 | 110.8 | 138.9 | -61.4 | -179.6 | 142.6 | 0 | 0 | 119.4 | ||||
| 8 | K | 41.5 | Very low | 37.9 | Very low | 204 Ų | 204 | 146 Ų | 146 | 89% | 0.887 | 82% | 0.817 | S | S | * | * | 171.4 | 103.8 | 105.1 | -87.6 | 173.6 | -173.8 | -173.7 | 0 | 110.8 | |||||
| 9 | L | 34.7 | Very low | 37.9 | Very low | 168 Ų | 168 | 147.8 Ų | 147.8 | 88% | 0.88 | 82% | 0.818 | S | S | * | * | trans | -91.1 | 177.2 | 154.4 | -85.2 | 160.2 | 0 | 0 | 0 | 107.7 | ||||
| 10 | P | 41.1 | Very low | 37.8 | Very low | 108 Ų | 108 | 148.7 Ų | 148.7 | 70% | 0.701 | 82% | 0.82 | S | S | * | * | cis | -134.4 | 156.5 | -36.9 | 32.7 | -16.5 | 0 | 0 | 0 | 111.5 | ||||
| 11 | V | 39.6 | Very low | 37.5 | Very low | 139 Ų | 139 | 147.1 Ų | 147.1 | 84% | 0.842 | 82% | 0.817 | S | S | * | * | trans | -140.6 | 127.9 | 158.6 | -169.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 12 | T | 39.4 | Very low | 37 | Very low | 107 Ų | 107 | 143.1 Ų | 143.1 | 66% | 0.656 | 80% | 0.801 | S | S | * | * | trans | -51.2 | 127.9 | -177.3 | 47.8 | 0 | 0 | 0 | 0 | 115.4 | S14 | T12-S14 PolarHBondContact O-N 3.16Å; T12-S14 VanDerWaalsContact O-N 3.15Å | ||
| 13 | M | 34.1 | Very low | 36.6 | Very low | 152 Ų | 152 | 143.3 Ų | 143.3 | 75% | 0.749 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -84.4 | 44.3 | 167.2 | -68.7 | -131.3 | 70.1 | 0 | 0 | 112.7 | L16 | M13-L16 HydrophobicContact CE-CB 4.25Å; M13-L16 HydrophobicContact CE-CD1 3.51Å; M13-L16 HydrophobicContact CE-CG 4.35Å |
| 14 | S | 35.2 | Very low | 36.3 | Very low | 110 Ų | 110 | 147.5 Ų | 147.5 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | -100.4 | 12.5 | 170.7 | -59 | 0 | 0 | 0 | 0 | 113 | T12 | T12-S14 PolarHBondContact O-N 3.16Å; T12-S14 VanDerWaalsContact O-N 3.15Å | ||
| 15 | S | 40.9 | Very low | 35.9 | Very low | 110 Ų | 110 | 148.6 Ų | 148.6 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -122.3 | 14.4 | -176.1 | -81.6 | 0 | 0 | 0 | 0 | 115.5 | ||
| 16 | L | 36.6 | Very low | 35.9 | Very low | 137 Ų | 137 | 146 Ų | 146 | 72% | 0.717 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -121.1 | 23.7 | 176.7 | -80.7 | 173.6 | 0 | 0 | 0 | 114.5 | M13 | M13-L16 HydrophobicContact CE-CB 4.25Å; M13-L16 HydrophobicContact CE-CD1 3.51Å; M13-L16 HydrophobicContact CE-CG 4.35Å |
| 17 | L | 33.4 | Very low | 35.6 | Very low | 162 Ų | 162 | 149.9 Ų | 149.9 | 85% | 0.848 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -118.5 | 27.8 | 174.9 | -73.6 | 179.2 | 0 | 0 | 0 | 113.9 | ||
| 18 | N | 36 | Very low | 35.2 | Very low | 157 Ų | 157 | 149.3 Ų | 149.3 | 84% | 0.84 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -138.2 | 69.5 | 174.3 | -85.2 | -36.8 | 0 | 0 | 0 | 110 | ||
| 19 | Q | 39.1 | Very low | 34.8 | Very low | 180 Ų | 180 | 147.8 Ų | 147.8 | 84% | 0.841 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -167.5 | 116.3 | 159.5 | -107.8 | 164.3 | 15 | 0 | 0 | 108.8 | ||
| 20 | L | 34.1 | Very low | 34.6 | Very low | 166 Ų | 166 | 145.2 Ų | 145.2 | 87% | 0.869 | 79% | 0.788 | S | S | * | * | trans | 102 | 142 | 156.7 | -60.2 | 154 | 0 | 0 | 0 | 117.4 | ||||
| 21 | P | 32.4 | Very low | 33.9 | Very low | 116 Ų | 116 | 146.3 Ų | 146.3 | 75% | 0.753 | 80% | 0.798 | S | S | * | * | -110.7 | 170.8 | -123.1 | 39 | -33 | 0 | 0 | 0 | 114.9 | |||||
| 22 | D | 29.5 | Very low | 33.5 | Very low | 146 Ų | 146 | 143.7 Ų | 143.7 | 78% | 0.781 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -48.8 | 143.2 | 176.6 | -61.7 | -56.6 | 0 | 0 | 0 | 114.5 | ||
| 23 | N | 28.4 | Very low | 33.1 | Very low | 147 Ų | 147 | 145.9 Ų | 145.9 | 79% | 0.786 | 80% | 0.798 | S | S | * | * | trans | 82.3 | 102.9 | 169.2 | -47.8 | -70.1 | 0 | 0 | 0 | 116 | ||||
| 24 | L | 33.1 | Very low | 32.8 | Very low | 171 Ų | 171 | 146.5 Ų | 146.5 | 90% | 0.895 | 81% | 0.805 | S | S | * | * | trans | -170.1 | 104.3 | 142 | -95.5 | 135.2 | 0 | 0 | 0 | 109.3 | ||||
| 25 | Y | 31.6 | Very low | 32.4 | Very low | 222 Ų | 222 | 148.2 Ų | 148.2 | 87% | 0.871 | 80% | 0.804 | S | S | * | * | trans | -65.3 | 144.2 | 157.8 | -115.2 | -99.9 | 0 | 0 | 0 | 108.4 | ||||
| 26 | P | 38.9 | Very low | 32 | Very low | 116 Ų | 116 | 153.2 Ų | 153.2 | 75% | 0.753 | 81% | 0.813 | S | S | * | * | trans | -132.9 | 133.4 | 140 | 12.3 | 9.8 | 0 | 0 | 0 | 113.1 | ||||
| 27 | E | 31.1 | Very low | 31.7 | Very low | 155 Ų | 155 | 152.5 Ų | 152.5 | 72% | 0.724 | 82% | 0.819 | S | S | * | * | trans | -55 | 155.3 | 159.8 | -80 | -105.1 | 126.5 | 0 | 0 | 112.9 | ||||
| 28 | E | 29.7 | Very low | 31.5 | Very low | 162 Ų | 162 | 148.5 Ų | 148.5 | 76% | 0.757 | 82% | 0.817 | S | S | * | * | trans | 64.8 | 118.4 | 157.4 | -65.8 | -177 | -168.9 | 0 | 0 | 118.4 | ||||
| 29 | I | 32.3 | Very low | 31.4 | Very low | 172 Ų | 172 | 146.6 Ų | 146.6 | 88% | 0.882 | 82% | 0.816 | S | S | * | * | trans | -167.4 | 144.6 | 132.6 | -91.5 | 149.1 | 0 | 0 | 0 | 109.7 | ||||
| 30 | P | 31.2 | Very low | 30.9 | Very low | 114 Ų | 114 | 142.7 Ų | 142.7 | 74% | 0.74 | 81% | 0.809 | S | S | * | * | trans | -96.9 | 158.2 | -150.2 | -0.9 | 22.9 | 0 | 0 | 0 | 115.2 | A32 | P30-A32 PolarHBondContact O-N 2.73Š| ||
| 31 | S | 26.2 | Very low | 30.7 | Very low | 131 Ų | 131 | 142 Ų | 142 | 92% | 0.916 | 81% | 0.805 | S | S | * | * | trans | -54.7 | 118.3 | 165.4 | -53.3 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 32 | A | 31.4 | Very low | 30.7 | Very low | 85 Ų | 85 | 141.9 Ų | 141.9 | 70% | 0.702 | 81% | 0.808 | S | S | * | * | trans | -153.8 | 125.4 | 161.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | P30 | P30-A32 PolarHBondContact O-N 2.73Š| ||
| 33 | L | 31 | Very low | 30.7 | Very low | 153 Ų | 153 | 141.6 Ų | 141.6 | 80% | 0.801 | 81% | 0.811 | S | S | * | * | trans | 86.2 | 81.1 | 151.8 | -57.1 | 168.5 | 0 | 0 | 0 | 118.5 | ||||
| 34 | N | 27.1 | Very low | 30.8 | Very low | 165 Ų | 165 | 140.7 Ų | 140.7 | 88% | 0.882 | 81% | 0.81 | S | S | * | * | trans | -52.7 | 124.4 | 134.1 | -75.8 | -42.3 | 0 | 0 | 0 | 109.6 | ||||
| 35 | L | 26.9 | Very low | 30.6 | Very low | 146 Ų | 146 | 139 Ų | 139 | 76% | 0.764 | 80% | 0.798 | S | S | * | * | trans | -161.5 | 81.1 | 158.8 | -132.2 | 97.2 | 0 | 0 | 0 | 109.8 | ||||
| 36 | F | 31.7 | Very low | 30.4 | Very low | 215 Ų | 215 | 137.7 Ų | 137.7 | 94% | 0.943 | 79% | 0.792 | S | S | * | * | trans | -153.7 | 111.2 | 147.2 | -96.4 | -70.1 | 0 | 0 | 0 | 109.9 | ||||
| 37 | S | 30 | Very low | 29.9 | Very low | 122 Ų | 122 | 140.1 Ų | 140.1 | 85% | 0.853 | 80% | 0.799 | S | S | * | * | trans | -65 | 126.7 | 170.8 | 49.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 38 | G | 30.5 | Very low | 29.9 | Very low | 77 Ų | 77 | 139.3 Ų | 139.3 | 79% | 0.794 | 80% | 0.795 | S | S | * | * | trans | -127.2 | 115.9 | 168.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 39 | S | 32.9 | Very low | 29.9 | Very low | 118 Ų | 118 | 138 Ų | 138 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | trans | -64.8 | 153 | 173.5 | 57.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 40 | S | 28.7 | Very low | 29.8 | Very low | 98 Ų | 98 | 134.6 Ų | 134.6 | 69% | 0.685 | 79% | 0.788 | S | S | * | * | trans | -47.2 | 132.7 | 169.4 | 49.6 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 41 | D | 31 | Very low | 29.6 | Very low | 150 Ų | 150 | 134.3 Ų | 134.3 | 80% | 0.802 | 79% | 0.785 | S | S | * | * | trans | 164.3 | 92.5 | 130.6 | -78.9 | -15.8 | 0 | 0 | 0 | 110.3 | ||||
| 42 | S | 31.7 | Very low | 29.7 | Very low | 115 Ų | 115 | 136.8 Ų | 136.8 | 80% | 0.804 | 78% | 0.782 | S | S | * | * | trans | -175.6 | 110.9 | 137.5 | 45 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 43 | V | 29.2 | Very low | 29.5 | Very low | 139 Ų | 139 | 140.6 Ų | 140.6 | 84% | 0.842 | 79% | 0.79 | S | S | * | * | trans | -57.7 | 150.1 | 153.6 | 174.2 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 44 | V | 31.5 | Very low | 29.6 | Very low | 128 Ų | 128 | 140 Ų | 140 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | trans | 93.7 | 116.3 | 179.8 | -165.2 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 45 | H | 28.6 | Very low | 29.9 | Very low | 137 Ų | 137 | 141 Ų | 141 | 63% | 0.634 | 79% | 0.794 | S | S | * | * | trans | 120 | 53.6 | 156.4 | -135.5 | -71.7 | 0 | 0 | 0 | 118 | ||||
| 46 | Y | 27.3 | Very low | 29.9 | Very low | 193 Ų | 193 | 141.3 Ų | 141.3 | 76% | 0.757 | 80% | 0.797 | S | S | * | * | trans | -132.1 | 67.9 | 166.4 | -112.3 | -109.1 | 0 | 0 | 0 | 111.6 | M49 | Y46-M49 HydrophobicContact CD1-CE 3.53Å; Y46-M49 HydrophobicContact CE1-CE 2.94Å; Y46-M49 HydrophobicContact CE1-SD 4.21Å; Y46-M49 HydrophobicContact CE2-CE 4.38Å; Y46-M49 HydrophobicContact CG-CE 4.48Å | ||
| 47 | N | 28.9 | Very low | 30 | Very low | 168 Ų | 168 | 139.1 Ų | 139.1 | 90% | 0.898 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -144.9 | 20.5 | 161.4 | -95.6 | -27.4 | 0 | 0 | 0 | 112.2 | ||
| 48 | Q | 31.2 | Very low | 30 | Very low | 138 Ų | 138 | 136 Ų | 136 | 65% | 0.645 | 78% | 0.78 | S | S | * | * | trans | -135.4 | 60.5 | -170.7 | -161.2 | 94.3 | 21.4 | 0 | 0 | 112.4 | ||||
| 49 | M | 27.9 | Very low | 30 | Very low | 135 Ų | 135 | 140.2 Ų | 140.2 | 67% | 0.665 | 78% | 0.783 | S | S | * | * | trans | -150.6 | 44.1 | 167.2 | 46.8 | 178.3 | -168.6 | 0 | 0 | 111.7 | Y46 | Y46-M49 HydrophobicContact CD1-CE 3.53Å; Y46-M49 HydrophobicContact CE1-CE 2.94Å; Y46-M49 HydrophobicContact CE1-SD 4.21Å; Y46-M49 HydrophobicContact CE2-CE 4.38Å; Y46-M49 HydrophobicContact CG-CE 4.48Å | ||
| 50 | A | 30.1 | Very low | 30 | Very low | 99 Ų | 99 | 140.7 Ų | 140.7 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -115.3 | 43 | 164 | 0 | 0 | 0 | 0 | 0 | 110 | ||
| 51 | T | 27.6 | Very low | 29.9 | Very low | 109 Ų | 109 | 144 Ų | 144 | 67% | 0.669 | 79% | 0.791 | S | S | * | * | trans | -154.6 | 53.3 | 176.1 | 56.5 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 52 | E | 27.7 | Very low | 30 | Very low | 182 Ų | 182 | 146.1 Ų | 146.1 | 85% | 0.85 | 80% | 0.797 | S | S | * | * | trans | -145.3 | 87 | 163.5 | -68.9 | -169.8 | 176.7 | 0 | 0 | 107.9 | ||||
| 53 | N | 29 | Very low | 30.1 | Very low | 166 Ų | 166 | 150.3 Ų | 150.3 | 89% | 0.888 | 80% | 0.801 | S | S | * | * | trans | 175 | 58.1 | 159.1 | -84.4 | -28.1 | 0 | 0 | 0 | 108.9 | ||||
| 54 | V | 31.3 | Very low | 30.3 | Very low | 141 Ų | 141 | 149.5 Ų | 149.5 | 86% | 0.855 | 80% | 0.798 | S | S | * | * | trans | -136.9 | 108.2 | 158.4 | -178.5 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 55 | M | 33.4 | Very low | 30.2 | Very low | 184 Ų | 184 | 150.7 Ų | 150.7 | 91% | 0.906 | 80% | 0.8 | S | S | * | * | trans | -74.2 | 137.8 | 165.6 | -73.6 | -148 | -66 | 0 | 0 | 109.5 | ||||
| 56 | D | 28.5 | Very low | 30.3 | Very low | 153 Ų | 153 | 149.5 Ų | 149.5 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -45.7 | 133 | 178.6 | -71.4 | -57.8 | 0 | 0 | 0 | 115.3 | ||||
| 57 | I | 32.9 | Very low | 30.3 | Very low | 170 Ų | 170 | 148.9 Ų | 148.9 | 87% | 0.872 | 81% | 0.809 | S | S | * | * | trans | -135.9 | 114.2 | 130.8 | -58.2 | -177.5 | 0 | 0 | 0 | 106.3 | ||||
| 58 | G | 29.9 | Very low | 30.3 | Very low | 56 Ų | 56 | 149.1 Ų | 149.1 | 58% | 0.577 | 81% | 0.809 | S | S | * | * | trans | -72.3 | 166.5 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 59 | L | 31.7 | Very low | 30.1 | Very low | 165 Ų | 165 | 148.2 Ų | 148.2 | 86% | 0.864 | 82% | 0.818 | S | S | * | * | 178.7 | 140.5 | 108 | -90.5 | 167.5 | 0 | 0 | 0 | 110.2 | |||||
| 60 | T | 31.5 | Very low | 30.1 | Very low | 129 Ų | 129 | 152.4 Ų | 152.4 | 79% | 0.791 | 83% | 0.828 | S | S | * | * | trans | 69.6 | 104 | 159.6 | 59.2 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 61 | N | 27.5 | Very low | 29.9 | Very low | 166 Ų | 166 | 153.2 Ų | 153.2 | 89% | 0.888 | 83% | 0.827 | S | S | * | * | trans | -39.7 | 125.6 | 152.1 | -66.8 | -66.3 | 0 | 0 | 0 | 112.8 | ||||
| 62 | E | 33.2 | Very low | 29.8 | Very low | 196 Ų | 196 | 151 Ų | 151 | 92% | 0.916 | 83% | 0.827 | S | S | * | * | trans | -145.6 | 143.5 | 133 | -73.6 | -141 | 122.1 | 0 | 0 | 109.3 | ||||
| 63 | K | 33.8 | Very low | 29.7 | Very low | 203 Ų | 203 | 147.7 Ų | 147.7 | 88% | 0.883 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 135.2 | -161.1 | -155.4 | 175.5 | -172.1 | 178.8 | 0 | 110.8 | N65 | K63-N65 PolarHBondContact O-N 3.14Š|
| 64 | P | 33.9 | Very low | 29.6 | Very low | 122 Ų | 122 | 149 Ų | 149 | 79% | 0.792 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 122.6 | 177.5 | 29.4 | -29.1 | 0 | 0 | 0 | 110.9 | ||
| 65 | N | 27.7 | Very low | 29.4 | Very low | 153 Ų | 153 | 150.8 Ų | 150.8 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 129 | 172 | -161.8 | 17 | 0 | 0 | 0 | 109.6 | K63 | K63-N65 PolarHBondContact O-N 3.14Š|
| 66 | P | 31.3 | Very low | 29.3 | Very low | 111 Ų | 111 | 147 Ų | 147 | 72% | 0.721 | 81% | 0.81 | S | S | * | * | trans | -95.3 | 102.9 | 176.9 | 33.8 | -24.1 | 0 | 0 | 0 | 109.4 | ||||
| 67 | E | 28.2 | Very low | 29.3 | Very low | 181 Ų | 181 | 143.5 Ų | 143.5 | 85% | 0.846 | 80% | 0.802 | S | S | * | * | trans | -178.3 | 149.6 | 152.3 | -107.6 | -178.5 | 175.4 | 0 | 0 | 110 | ||||
| 68 | L | 27.7 | Very low | 29.3 | Very low | 173 Ų | 173 | 142 Ų | 142 | 91% | 0.906 | 80% | 0.803 | S | S | * | * | trans | 90.1 | 82.9 | 179 | -55.6 | 157.6 | 0 | 0 | 0 | 116.7 | ||||
| 69 | S | 28.2 | Very low | 29.4 | Very low | 119 Ų | 119 | 142.6 Ų | 142.6 | 83% | 0.832 | 81% | 0.81 | S | S | * | * | trans | -150.3 | 99.8 | 133.8 | 43.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 70 | Y | 26.4 | Very low | 29.3 | Very low | 222 Ų | 222 | 141.6 Ų | 141.6 | 87% | 0.871 | 81% | 0.805 | S | S | * | * | trans | 25.7 | 101.8 | 147 | -157.7 | -102.8 | 0 | 0 | 0 | 118.8 | ||||
| 71 | S | 25.9 | Very low | 29.1 | Very low | 116 Ų | 116 | 145.3 Ų | 145.3 | 81% | 0.811 | 81% | 0.811 | S | S | * | * | trans | -90.9 | 100.8 | 163.5 | 47.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 72 | G | 26.2 | Very low | 29.1 | Very low | 64 Ų | 64 | 143 Ų | 143 | 66% | 0.66 | 80% | 0.802 | S | S | * | * | trans | -91.7 | 97.4 | 163.9 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 73 | S | 25.9 | Very low | 28.8 | Very low | 112 Ų | 112 | 139 Ų | 139 | 78% | 0.783 | 79% | 0.791 | S | S | * | * | trans | -87.5 | 114.6 | 171.7 | 46.1 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 74 | F | 26.9 | Very low | 28.4 | Very low | 193 Ų | 193 | 134.7 Ų | 134.7 | 85% | 0.846 | 78% | 0.782 | S | S | * | * | trans | -108.3 | 110.4 | 166.2 | -160.8 | -95 | 0 | 0 | 0 | 107 | P76 | F74-P76 WeakPolarHBondContact O-CD 3.41Š| ||
| 75 | Q | 27.5 | Very low | 28 | Very low | 178 Ų | 178 | 137.5 Ų | 137.5 | 83% | 0.832 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -80 | 118.4 | 174.3 | -69.3 | -175.5 | -54.6 | 0 | 0 | 109 | ||
| 76 | P | 30.6 | Very low | 27.8 | Very low | 105 Ų | 105 | 138.1 Ų | 138.1 | 68% | 0.682 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 133.3 | 165.5 | 22.9 | -13.8 | 0 | 0 | 0 | 109.9 | F74 | F74-P76 WeakPolarHBondContact O-CD 3.41Š|
| 77 | A | 28.9 | Very low | 27.5 | Very low | 79 Ų | 79 | 134.7 Ų | 134.7 | 65% | 0.653 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 149 | 178 | 0 | 0 | 0 | 0 | 0 | 113.1 | G79 | A77-G79 PolarHBondContact O-N 2.9Š|
| 78 | P | 33 | Very low | 27.4 | Very low | 138 Ų | 138 | 136.3 Ų | 136.3 | 90% | 0.896 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.3 | 123.1 | 179.4 | 28.9 | -32.4 | 0 | 0 | 0 | 110 | ||
| 79 | G | 31.6 | Very low | 27.3 | Very low | 70 Ų | 70 | 134.1 Ų | 134.1 | 72% | 0.722 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 154.8 | -16.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | A77 | A77-G79 PolarHBondContact O-N 2.9Š|
| 80 | N | 29.9 | Very low | 27.2 | Very low | 143 Ų | 143 | 132.9 Ų | 132.9 | 77% | 0.765 | 75% | 0.75 | S | S | * | * | trans | -115.4 | 117.6 | -171.4 | -54.5 | -2.7 | 0 | 0 | 0 | 109.2 | T82 | N80-T82 PolarHBondContact O-N 3.38Š| ||
| 81 | K | 27.9 | Very low | 27.3 | Very low | 208 Ų | 208 | 130.3 Ų | 130.3 | 90% | 0.904 | 74% | 0.743 | S | S | * | * | trans | -56.9 | 102.6 | 173 | -64 | 174 | -177.2 | 175.4 | 0 | 108.5 | V83 | K81-V83 PolarHBondContact O-N 3.36Å; K81-V83 VanDerWaalsContact O-N 3.1Å | ||
| 82 | T | 27.2 | Very low | 27.2 | Very low | 116 Ų | 116 | 132.2 Ų | 132.2 | 71% | 0.712 | 75% | 0.745 | S | S | * | * | trans | -68.7 | 104.5 | 169.5 | 43.9 | 0 | 0 | 0 | 0 | 108.2 | N80 T84 | N80-T82 PolarHBondContact O-N 3.38Å; T82-T84 PolarHBondContact O-N 3.31Å | ||
| 83 | V | 25.7 | Very low | 27.4 | Very low | 112 Ų | 112 | 132.8 Ų | 132.8 | 68% | 0.679 | 74% | 0.739 | S | S | * | * | trans | -74.6 | 102.1 | 166.1 | -178.6 | 0 | 0 | 0 | 0 | 106.9 | K81 Y85 | K81-V83 PolarHBondContact O-N 3.36Å; K81-V83 VanDerWaalsContact O-N 3.1Å; V83-Y85 HydrophobicContact CG1-CD2 3.78Å; V83-Y85 HydrophobicContact CG1-CE2 4.16Å; V83-Y85 PolarHBondContact O-N 2.78Å | ||
| 84 | T | 26.4 | Very low | 27.4 | Very low | 114 Ų | 114 | 133.1 Ų | 133.1 | 70% | 0.699 | 74% | 0.738 | S | S | * | * | trans | -68.4 | 100.3 | 168.9 | -39.2 | 0 | 0 | 0 | 0 | 108 | T82 L86 | T82-T84 PolarHBondContact O-N 3.31Å; T84-L86 VanDerWaalsContact C-N 3.28Å; T84-L86 PolarHBondContact O-N 3.28Å | ||
| 85 | Y | 24.4 | Very low | 27.7 | Very low | 181 Ų | 181 | 126 Ų | 126 | 71% | 0.71 | 71% | 0.712 | S | S | * | * | trans | -75.5 | 80.7 | 174.3 | -119.6 | -110.3 | 0 | 0 | 0 | 109.4 | V83 G87 F89 | V83-Y85 HydrophobicContact CG1-CD2 3.78Å; V83-Y85 HydrophobicContact CG1-CE2 4.16Å; V83-Y85 PolarHBondContact O-N 2.78Å; Y85-G87 PolarHBondContact O-N 2.98Å; Y85-G87 VanDerWaalsContact O-N 3.13Å; Y85-F89 AromaticContact CD1-CE2 3.62Å; Y85-F89 HydrophobicContact CD1-CE2 3.62Å; Y85-F89 HydrophobicContact CD1-CZ 4.19Å; Y85-F89 HydrophobicContact CE1-CD2 4.42Å; Y85-F89 AromaticContact CE1-CE2 3.21Å; Y85-F89 HydrophobicContact CE1-CE2 3.21Å; Y85-F89 AromaticContact CE1-CZ 3.37Å; Y85-F89 HydrophobicContact CE1-CZ 3.37Å | ||
| 86 | L | 23.9 | Very low | 27.9 | Very low | 165 Ų | 165 | 123.6 Ų | 123.6 | 86% | 0.864 | 71% | 0.705 | S | S | * | * | trans | -82.2 | 64.7 | 159.7 | -83.2 | 167.7 | 0 | 0 | 0 | 108.6 | T84 | T84-L86 VanDerWaalsContact C-N 3.28Å; T84-L86 PolarHBondContact O-N 3.28Å | ||
| 87 | G | 25.4 | Very low | 27.9 | Very low | 39 Ų | 39 | 127.5 Ų | 127.5 | 40% | 0.402 | 71% | 0.706 | S | S | . | * | trans | -97.3 | 93.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112 | Y85 F89 | Y85-G87 PolarHBondContact O-N 2.98Å; Y85-G87 VanDerWaalsContact O-N 3.13Å; G87-F89 WeakPolarHBondContact O-CD2 3.38Å; G87-F89 PolarHBondContact O-N 3.35Å | ||
| 88 | K | 26.2 | Very low | 27.9 | Very low | 216 Ų | 216 | 129.6 Ų | 129.6 | 94% | 0.939 | 72% | 0.715 | S | S | * | * | trans | -67.2 | 85.8 | 152.8 | -73.9 | 179 | 178.9 | 175.8 | 0 | 107.4 | A90 | K88-A90 PolarHBondContact O-N 3.33Š| ||
| 89 | F | 26.1 | Very low | 27.9 | Very low | 127 Ų | 127 | 130.1 Ų | 130.1 | 56% | 0.557 | 71% | 0.705 | S | S | * | * | trans | -81 | 98.2 | 170.9 | -73.5 | -83.1 | 0 | 0 | 0 | 109.1 | Y85 G87 F91 | Y85-F89 AromaticContact CD1-CE2 3.62Å; Y85-F89 HydrophobicContact CD1-CE2 3.62Å; Y85-F89 HydrophobicContact CD1-CZ 4.19Å; Y85-F89 HydrophobicContact CE1-CD2 4.42Å; Y85-F89 AromaticContact CE1-CE2 3.21Å; Y85-F89 HydrophobicContact CE1-CE2 3.21Å; Y85-F89 AromaticContact CE1-CZ 3.37Å; Y85-F89 HydrophobicContact CE1-CZ 3.37Å; G87-F89 WeakPolarHBondContact O-CD2 3.38Å; G87-F89 PolarHBondContact O-N 3.35Å; F89-F91 VanDerWaalsContact C-N 3.25Å; F89-F91 HydrophobicContact CB-CD2 3.97Å; F89-F91 HydrophobicContact CB-CE2 4.09Å; F89-F91 PolarHBondContact O-N 3.4Å | ||
| 90 | A | 25.9 | Very low | 27.7 | Very low | 92 Ų | 92 | 133.9 Ų | 133.9 | 76% | 0.76 | 71% | 0.709 | S | S | * | * | trans | -61.7 | 96 | 150.9 | 0 | 0 | 0 | 0 | 0 | 106.9 | K88 D92 | K88-A90 PolarHBondContact O-N 3.33Å; A90-D92 VanDerWaalsContact C-N 3.3Å; A90-D92 PolarHBondContact O-N 3.1Å | ||
| 91 | F | 27 | Very low | 27.7 | Very low | 168 Ų | 168 | 132.7 Ų | 132.7 | 74% | 0.737 | 70% | 0.702 | S | S | * | * | trans | -71.9 | 93.3 | 166.3 | -96.4 | -88.5 | 0 | 0 | 0 | 107.8 | F89 S93 | F89-F91 VanDerWaalsContact C-N 3.25Å; F89-F91 HydrophobicContact CB-CD2 3.97Å; F89-F91 HydrophobicContact CB-CE2 4.09Å; F89-F91 PolarHBondContact O-N 3.4Å; F91-S93 PolarHBondContact O-N 3.19Å | ||
| 92 | D | 25.4 | Very low | 27.7 | Very low | 156 Ų | 156 | 130.6 Ų | 130.6 | 83% | 0.834 | 70% | 0.699 | S | S | * | * | trans | -62.6 | 84.9 | 152.6 | -91.4 | -48.9 | 0 | 0 | 0 | 107.7 | A90 P94 | A90-D92 VanDerWaalsContact C-N 3.3Å; A90-D92 PolarHBondContact O-N 3.1Å; D92-P94 WeakPolarHBondContact O-CD 3.37Å | ||
| 93 | S | 30 | Very low | 27.9 | Very low | 77 Ų | 77 | 132.5 Ų | 132.5 | 54% | 0.538 | 70% | 0.704 | S | S | . | * | trans | -86.6 | 111.2 | 170.9 | -111.5 | 0 | 0 | 0 | 0 | 108.5 | F91 S95 | F91-S93 PolarHBondContact O-N 3.19Å; S93-S95 PolarHBondContact O-N 2.92Å; S93-S95 PolarHBondContact O-OG 3.45Å | ||
| 94 | P | 26.3 | Very low | 28 | Very low | 118 Ų | 118 | 131.6 Ų | 131.6 | 77% | 0.766 | 70% | 0.703 | S | S | * | * | trans | -75.2 | 71.6 | 178.3 | 32.6 | -33.8 | 0 | 0 | 0 | 109.3 | D92 | D92-P94 WeakPolarHBondContact O-CD 3.37Š| ||
| 95 | S | 33.1 | Very low | 28.1 | Very low | 43 Ų | 43 | 133.9 Ų | 133.9 | 30% | 0.301 | 71% | 0.71 | S | S | . | * | trans | -118.8 | 57.8 | -173.7 | 57.3 | 0 | 0 | 0 | 0 | 110.9 | S93 K303 | S93-S95 PolarHBondContact O-N 2.92Å; S93-S95 PolarHBondContact O-OG 3.45Å; S95-K303 PolarHBondContact O-NZ 3.02Å; S95-K303 PolarHBondContact OG-NZ 3.37Å | ||
| 96 | N | 31.9 | Very low | 28.4 | Very low | 128 Ų | 128 | 134.6 Ų | 134.6 | 68% | 0.684 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -167.5 | 13.1 | 157.5 | -103.2 | -10.6 | 0 | 0 | 0 | 116 | C98 | N96-C98 VanDerWaalsContact C-N 3.31Å; N96-C98 PolarHBondContact O-N 3.03Å |
| 97 | W | 29.8 | Very low | 28.7 | Very low | 188 Ų | 188 | 132.2 Ų | 132.2 | 71% | 0.712 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | -13.1 | -178.8 | -137 | -58.2 | 0 | 0 | 0 | 114.5 | ||
| 98 | C | 29.3 | Very low | 29 | Very low | 123 Ų | 123 | 135.4 Ų | 135.4 | 83% | 0.831 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.9 | 18.5 | -166.9 | -67 | 0 | 0 | 0 | 0 | 116.9 | N96 | N96-C98 VanDerWaalsContact C-N 3.31Å; N96-C98 PolarHBondContact O-N 3.03Å |
| 99 | Q | 32.4 | Very low | 29.3 | Very low | 148 Ų | 148 | 129 Ų | 129 | 69% | 0.692 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -123.7 | -1.9 | -178 | -85.3 | 174.9 | -20.8 | 0 | 0 | 117.8 | ||
| 100 | D | 28.5 | Very low | 29.9 | Very low | 150 Ų | 150 | 130.3 Ų | 130.3 | 80% | 0.802 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -141.2 | 19.6 | -178.5 | -79.1 | -42.7 | 0 | 0 | 0 | 116.3 | ||
| 101 | N | 28.7 | Very low | 30.4 | Very low | 117 Ų | 117 | 133.8 Ų | 133.8 | 63% | 0.626 | 75% | 0.753 | S | S | * | * | trans | -137 | 41.4 | 179.8 | -78.2 | -43.6 | 0 | 0 | 0 | 115 | ||||
| 102 | I | 28.9 | Very low | 30.8 | Very low | 164 Ų | 164 | 129.6 Ų | 129.6 | 84% | 0.841 | 76% | 0.756 | S | S | * | * | trans | -107.8 | 79.1 | 162.5 | -56.1 | 175.9 | 0 | 0 | 0 | 107.3 | ||||
| 103 | I | 29.9 | Very low | 31.4 | Very low | 156 Ų | 156 | 128.8 Ų | 128.8 | 80% | 0.8 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -173.8 | 126 | 157.6 | -83.3 | 137.5 | 0 | 0 | 0 | 104.2 | ||
| 104 | S | 28.8 | Very low | 31.9 | Very low | 94 Ų | 94 | 130.5 Ų | 130.5 | 66% | 0.657 | 77% | 0.766 | S | S | * | * | S | Bend | trans | 97.8 | 77.5 | -174.8 | -73.4 | 0 | 0 | 0 | 0 | 116.2 | ||
| 105 | L | 28.9 | Very low | 32.5 | Very low | 162 Ų | 162 | 130.4 Ų | 130.4 | 85% | 0.848 | 77% | 0.766 | S | S | * | * | S | Bend | trans | 168.2 | 61.6 | 135.6 | -88.6 | 164.1 | 0 | 0 | 0 | 109.2 | ||
| 106 | M | 29.2 | Very low | 32.7 | Very low | 195 Ų | 195 | 132.6 Ų | 132.6 | 96% | 0.961 | 79% | 0.787 | S | S | * | * | trans | -139.8 | 28.5 | 167.7 | -71 | -61.6 | -80.1 | 0 | 0 | 111.6 | ||||
| 107 | S | 31.2 | Very low | 33.1 | Very low | 116 Ų | 116 | 132.6 Ų | 132.6 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | trans | -119.9 | 71.1 | 179.9 | 60.1 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 108 | A | 31.2 | Very low | 33.5 | Very low | 105 Ų | 105 | 127.7 Ų | 127.7 | 87% | 0.868 | 80% | 0.804 | S | S | * | * | trans | -167.3 | 97.3 | 155.7 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 109 | G | 33.2 | Very low | 33.6 | Very low | 81 Ų | 81 | 126.2 Ų | 126.2 | 84% | 0.835 | 80% | 0.801 | S | S | * | * | trans | 163.6 | 52.5 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 110 | I | 37.9 | Very low | 33.8 | Very low | 155 Ų | 155 | 126.9 Ų | 126.9 | 80% | 0.795 | 81% | 0.809 | S | S | * | * | trans | -103.7 | 117.2 | 159.8 | -38.4 | -177.2 | 0 | 0 | 0 | 102.8 | ||||
| 111 | L | 36.5 | Very low | 34.1 | Very low | 166 Ų | 166 | 124.2 Ų | 124.2 | 87% | 0.869 | 80% | 0.802 | S | S | * | * | -174.7 | 147.6 | 71.5 | -78.7 | 158.9 | 0 | 0 | 0 | 108.6 | |||||
| 112 | G | 35.4 | Very low | 34.3 | Very low | 79 Ų | 79 | 124.6 Ų | 124.6 | 81% | 0.814 | 81% | 0.808 | S | S | * | * | trans | 111.2 | 85 | 145.5 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 113 | V | 38.3 | Very low | 34.7 | Very low | 140 Ų | 140 | 125.3 Ų | 125.3 | 85% | 0.848 | 81% | 0.808 | S | S | * | * | trans | -113.2 | 145.9 | 149.4 | 180 | 0 | 0 | 0 | 0 | 102.8 | ||||
| 114 | P | 39.9 | Very low | 34.8 | Very low | 113 Ų | 113 | 123.8 Ų | 123.8 | 73% | 0.734 | 81% | 0.806 | S | S | * | * | cis | -152.2 | -152.7 | 38.9 | 37.9 | -10.5 | 0 | 0 | 0 | 113.9 | ||||
| 115 | P | 40.5 | Very low | 35.3 | Very low | 116 Ų | 116 | 124.1 Ų | 124.1 | 75% | 0.753 | 81% | 0.809 | S | S | * | * | -132.1 | 176.4 | -79.8 | 41.7 | -24.4 | 0 | 0 | 0 | 114.4 | |||||
| 116 | A | 35.9 | Very low | 35.6 | Very low | 89 Ų | 89 | 122.9 Ų | 122.9 | 74% | 0.736 | 81% | 0.808 | S | S | * | * | trans | 56.6 | 112.1 | 149.1 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 117 | S | 41.3 | Very low | 36 | Very low | 127 Ų | 127 | 118 Ų | 118 | 89% | 0.888 | 80% | 0.799 | S | S | * | * | 161.2 | 140.5 | 120.1 | -69.4 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 118 | G | 37.1 | Very low | 36.3 | Very low | 85 Ų | 85 | 118.5 Ų | 118.5 | 88% | 0.876 | 80% | 0.802 | S | S | * | * | trans | 113.1 | 116 | 151.7 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 119 | A | 32.8 | Very low | 36.5 | Very low | 93 Ų | 93 | 122.2 Ų | 122.2 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | trans | -76.6 | 155.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 120 | L | 35.2 | Very low | 37 | Very low | 162 Ų | 162 | 125.3 Ų | 125.3 | 85% | 0.848 | 81% | 0.806 | S | S | * | * | trans | 161.4 | 108.6 | 138.9 | -114.9 | 56.3 | 0 | 0 | 0 | 107.6 | ||||
| 121 | S | 34.9 | Very low | 36.9 | Very low | 94 Ų | 94 | 126.9 Ų | 126.9 | 66% | 0.657 | 81% | 0.81 | S | S | * | * | 73.9 | 116.8 | 86.5 | -64.9 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 122 | T | 32.4 | Very low | 37.1 | Very low | 125 Ų | 125 | 124.5 Ų | 124.5 | 77% | 0.767 | 80% | 0.804 | S | S | * | * | trans | 66 | 134.6 | 140.4 | 58.4 | 0 | 0 | 0 | 0 | 117 | ||||
| 123 | Q | 39.1 | Very low | 37.5 | Very low | 178 Ų | 178 | 127 Ų | 127 | 83% | 0.832 | 81% | 0.806 | S | S | * | * | cis | -159.1 | 156.8 | 46.4 | -70.5 | 175.8 | 20.5 | 0 | 0 | 112.1 | ||||
| 124 | T | 32.1 | Very low | 37.2 | Very low | 124 Ų | 124 | 129.5 Ų | 129.5 | 76% | 0.761 | 81% | 0.809 | S | S | * | * | trans | -45.3 | 155.4 | 161.9 | 32.6 | 0 | 0 | 0 | 0 | 117 | ||||
| 125 | S | 38.5 | Very low | 37.2 | Very low | 102 Ų | 102 | 127.6 Ų | 127.6 | 71% | 0.713 | 81% | 0.809 | S | S | * | * | 164.5 | 104.3 | 124 | -71.1 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 126 | T | 34.8 | Very low | 36.9 | Very low | 135 Ų | 135 | 128.8 Ų | 128.8 | 83% | 0.828 | 81% | 0.809 | S | S | * | * | 82 | 136.4 | 99.9 | 58.5 | 0 | 0 | 0 | 0 | 117.6 | |||||
| 127 | A | 38.1 | Very low | 37.2 | Very low | 93 Ų | 93 | 131.6 Ų | 131.6 | 77% | 0.769 | 82% | 0.817 | S | S | * | * | trans | 85.2 | 105.9 | 152.9 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 128 | S | 37.7 | Very low | 36.9 | Very low | 126 Ų | 126 | 134.3 Ų | 134.3 | 88% | 0.881 | 82% | 0.816 | S | S | * | * | 173.2 | 144.3 | 85.5 | -101.3 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 129 | M | 35.4 | Very low | 36.8 | Very low | 183 Ų | 183 | 134.1 Ų | 134.1 | 90% | 0.901 | 81% | 0.806 | S | S | * | * | trans | -77.1 | 142.8 | -173.1 | -64.2 | 165.6 | 156.1 | 0 | 0 | 113.8 | ||||
| 130 | V | 43.4 | Very low | 36.9 | Very low | 146 Ų | 146 | 137.6 Ų | 137.6 | 89% | 0.885 | 81% | 0.808 | S | S | * | * | trans | -152.9 | 121.5 | 138.3 | 179.3 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 131 | Q | 36.4 | Very low | 36.9 | Very low | 188 Ų | 188 | 140.2 Ų | 140.2 | 88% | 0.879 | 81% | 0.808 | S | S | * | * | trans | -107.8 | 154.5 | 171.5 | -76 | 179.5 | -69.7 | 0 | 0 | 110.8 | ||||
| 132 | P | 41.1 | Very low | 37 | Very low | 116 Ų | 116 | 141.1 Ų | 141.1 | 75% | 0.753 | 81% | 0.812 | S | S | * | * | trans | -119.5 | 164.9 | 147.1 | 32.3 | -17 | 0 | 0 | 0 | 112.3 | ||||
| 133 | P | 41.8 | Very low | 36.9 | Very low | 132 Ų | 132 | 140.1 Ų | 140.1 | 86% | 0.857 | 82% | 0.816 | S | S | * | * | trans | -89.7 | 159 | -148.2 | 34.9 | -35 | 0 | 0 | 0 | 115.7 | ||||
| 134 | Q | 33.8 | Very low | 36.6 | Very low | 193 Ų | 193 | 139.3 Ų | 139.3 | 90% | 0.902 | 82% | 0.817 | S | S | * | * | trans | -76.9 | 148.5 | 175.2 | -65.8 | 176 | -54.9 | 0 | 0 | 112.5 | ||||
| 135 | G | 39.8 | Very low | 36.7 | Very low | 72 Ų | 72 | 138.1 Ų | 138.1 | 74% | 0.742 | 81% | 0.812 | S | S | * | * | trans | -152.8 | 129.7 | 161.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 136 | D | 34.3 | Very low | 36.4 | Very low | 141 Ų | 141 | 139 Ų | 139 | 75% | 0.754 | 81% | 0.814 | S | S | * | * | trans | -89.4 | 146.4 | -152.6 | -43.8 | -68.3 | 0 | 0 | 0 | 114.2 | ||||
| 137 | V | 41.7 | Very low | 36.1 | Very low | 148 Ų | 148 | 143.8 Ų | 143.8 | 90% | 0.897 | 82% | 0.819 | S | S | * | * | -176.4 | 130.6 | 118.4 | -96.5 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 138 | E | 34 | Very low | 35.6 | Very low | 185 Ų | 185 | 144.3 Ų | 144.3 | 86% | 0.864 | 82% | 0.817 | S | S | * | * | trans | -35.8 | 133.8 | 171 | -83.7 | 169.1 | 99.6 | 0 | 0 | 117.5 | ||||
| 139 | A | 35.8 | Very low | 35.1 | Very low | 80 Ų | 80 | 145.7 Ų | 145.7 | 66% | 0.661 | 81% | 0.814 | S | S | * | * | 87.5 | 107.3 | 79.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 140 | M | 35.4 | Very low | 34.7 | Very low | 167 Ų | 167 | 142 Ų | 142 | 82% | 0.823 | 81% | 0.806 | S | S | * | * | 179.4 | 129.7 | 129.1 | -129.9 | 75.9 | 175.8 | 0 | 0 | 110.3 | |||||
| 141 | Y | 34.3 | Very low | 34 | Very low | 216 Ų | 216 | 138.6 Ų | 138.6 | 85% | 0.847 | 80% | 0.8 | S | S | * | * | trans | 94.9 | 126 | 168.2 | -72.8 | -88.2 | 0 | 0 | 0 | 120.4 | ||||
| 142 | P | 36.5 | Very low | 33.6 | Very low | 113 Ų | 113 | 136.5 Ų | 136.5 | 73% | 0.734 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -79 | 144.1 | -176 | 34.3 | -33.6 | 0 | 0 | 0 | 111.7 | L144 | P142-L144 PolarHBondContact O-N 3.37Š|
| 143 | A | 32.2 | Very low | 33.1 | Very low | 104 Ų | 104 | 137.9 Ų | 137.9 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 117.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 144 | L | 31.8 | Very low | 32.5 | Very low | 161 Ų | 161 | 141.8 Ų | 141.8 | 84% | 0.843 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 142.6 | 162.6 | -76.7 | 167.5 | 0 | 0 | 0 | 109.9 | P142 | P142-L144 PolarHBondContact O-N 3.37Š|
| 145 | P | 33.5 | Very low | 32.3 | Very low | 100 Ų | 100 | 136.9 Ų | 136.9 | 65% | 0.649 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 154.3 | -177 | 28.8 | -34.6 | 0 | 0 | 0 | 112.1 | Y147 | P145-Y147 PolarHBondContact O-N 3.14Š|
| 146 | P | 31.8 | Very low | 31.7 | Very low | 119 Ų | 119 | 141.7 Ų | 141.7 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 116.7 | -179.9 | 28.9 | -31.6 | 0 | 0 | 0 | 109.8 | S148 | P146-S148 PolarHBondContact O-N 3.49Š|
| 147 | Y | 28.9 | Very low | 31.6 | Very low | 237 Ų | 237 | 140.7 Ų | 140.7 | 93% | 0.929 | 79% | 0.786 | S | S | * | * | trans | -59.3 | 103.5 | 172.5 | -97.9 | -92 | 0 | 0 | 0 | 110.2 | P145 | P145-Y147 PolarHBondContact O-N 3.14Š| ||
| 148 | S | 28.3 | Very low | 31 | Very low | 104 Ų | 104 | 139.9 Ų | 139.9 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | trans | -99 | 136.3 | 159.5 | -63.7 | 0 | 0 | 0 | 0 | 108.6 | P146 | P146-S148 PolarHBondContact O-N 3.49Š| ||
| 149 | N | 27.2 | Very low | 30.8 | Very low | 154 Ų | 154 | 136 Ų | 136 | 82% | 0.824 | 77% | 0.774 | S | S | * | * | trans | 90 | 160.4 | 155.8 | -133.3 | 0.6 | 0 | 0 | 0 | 118.8 | ||||
| 150 | C | 26.3 | Very low | 30.4 | Very low | 106 Ų | 106 | 141.8 Ų | 141.8 | 72% | 0.716 | 79% | 0.785 | S | S | * | * | trans | 99.5 | 66.3 | 167.6 | -50.9 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 151 | G | 28.7 | Very low | 30.2 | Very low | 74 Ų | 74 | 142.1 Ų | 142.1 | 76% | 0.763 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -102.8 | 36.3 | 154.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 152 | D | 28.7 | Very low | 30 | Very low | 144 Ų | 144 | 138.5 Ų | 138.5 | 77% | 0.77 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -167.7 | 115.7 | 171.3 | -86.1 | -45.3 | 0 | 0 | 0 | 105.8 | ||
| 153 | L | 29.7 | Very low | 30 | Very low | 145 Ų | 145 | 139.3 Ų | 139.3 | 76% | 0.759 | 79% | 0.785 | S | S | * | * | trans | 153.1 | 108.6 | 154 | -80.7 | 179.6 | 0 | 0 | 0 | 109.4 | ||||
| 154 | Y | 30.6 | Very low | 30.3 | Very low | 214 Ų | 214 | 141.9 Ų | 141.9 | 84% | 0.839 | 78% | 0.779 | S | S | * | * | trans | 79.6 | 125.4 | 159.7 | -61.4 | -74.3 | 0 | 0 | 0 | 121 | ||||
| 155 | S | 29 | Very low | 30.3 | Very low | 91 Ų | 91 | 138.2 Ų | 138.2 | 64% | 0.636 | 78% | 0.78 | S | S | * | * | trans | -69 | 135.7 | 157.5 | -51.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 156 | E | 27.6 | Very low | 30.4 | Very low | 172 Ų | 172 | 139.9 Ų | 139.9 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | -179.9 | 141.9 | 130.2 | -77.7 | -119.1 | 134.7 | 0 | 0 | 107.4 | V158 | E156-V158 PolarHBondContact O-N 3.37Š| ||
| 157 | P | 32.4 | Very low | 30.6 | Very low | 121 Ų | 121 | 140.3 Ų | 140.3 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | trans | -75.5 | 114.1 | 178.9 | 30.1 | -30.5 | 0 | 0 | 0 | 109.9 | S159 | P157-S159 PolarHBondContact O-N 2.98Š| ||
| 158 | V | 28.7 | Very low | 30.7 | Very low | 131 Ų | 131 | 132.3 Ų | 132.3 | 79% | 0.794 | 78% | 0.775 | S | S | * | * | trans | -78.9 | 114.4 | 173.1 | -161 | 0 | 0 | 0 | 0 | 108.3 | E156 | E156-V158 PolarHBondContact O-N 3.37Š| ||
| 159 | S | 28.7 | Very low | 31 | Very low | 104 Ų | 104 | 134.9 Ų | 134.9 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | trans | -75.4 | 122 | 170.8 | -57.2 | 0 | 0 | 0 | 0 | 108.6 | P157 | P157-S159 PolarHBondContact O-N 2.98Š| ||
| 160 | F | 28.9 | Very low | 31.1 | Very low | 201 Ų | 201 | 132.6 Ų | 132.6 | 88% | 0.882 | 78% | 0.783 | S | S | * | * | trans | -84.2 | 113.3 | 169.8 | -111.9 | -96.3 | 0 | 0 | 0 | 108.6 | ||||
| 161 | H | 30.3 | Very low | 31.4 | Very low | 173 Ų | 173 | 138 Ų | 138 | 80% | 0.801 | 79% | 0.79 | S | S | * | * | trans | -79.9 | 125.7 | 162.3 | -100.3 | -87.3 | 0 | 0 | 0 | 108.4 | ||||
| 162 | D | 30.2 | Very low | 31.4 | Very low | 141 Ų | 141 | 137.8 Ų | 137.8 | 75% | 0.754 | 78% | 0.776 | S | S | * | * | trans | -65.6 | 134.2 | 165.2 | -88.4 | -52.6 | 0 | 0 | 0 | 110 | Q164 | D162-Q164 PolarHBondContact O-N 3.44Å; D162-Q164 VanDerWaalsContact O-N 3.14Å | ||
| 163 | P | 36.8 | Very low | 31.7 | Very low | 130 Ų | 130 | 137.2 Ų | 137.2 | 84% | 0.844 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -77 | 11.8 | -178.4 | -11.9 | 28 | 0 | 0 | 0 | 115.2 | ||
| 164 | Q | 37.5 | Very low | 32 | Very low | 158 Ų | 158 | 137.1 Ų | 137.1 | 74% | 0.738 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -123.3 | 97.5 | -179.8 | -66 | -175.7 | -5.1 | 0 | 0 | 108.9 | D162 N166 | D162-Q164 PolarHBondContact O-N 3.44Å; D162-Q164 VanDerWaalsContact O-N 3.14Å; Q164-N166 PolarHBondContact O-N 3.07Å |
| 165 | G | 31.7 | Very low | 32.2 | Very low | 83 Ų | 83 | 134.4 Ų | 134.4 | 86% | 0.856 | 78% | 0.776 | S | S | * | * | trans | -65.9 | 58.7 | -175 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 166 | N | 36.1 | Very low | 32.5 | Very low | 136 Ų | 136 | 141.3 Ų | 141.3 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | trans | -102.1 | 121.8 | 168.5 | -78.2 | -43.1 | 0 | 0 | 0 | 109.8 | Q164 G168 | Q164-N166 PolarHBondContact O-N 3.07Å; N166-G168 VanDerWaalsContact C-N 3.26Å; N166-G168 PolarHBondContact O-N 2.89Å | ||
| 167 | P | 35.8 | Very low | 32.9 | Very low | 127 Ų | 127 | 141.6 Ų | 141.6 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | trans | -72.2 | 85.1 | 166.9 | 28.7 | -29.4 | 0 | 0 | 0 | 108.8 | L169 | P167-L169 PolarHBondContact O-N 3.45Å; P167-L169 VanDerWaalsContact O-N 3.16Å | ||
| 168 | G | 32 | Very low | 33 | Very low | 69 Ų | 69 | 141.7 Ų | 141.7 | 71% | 0.711 | 80% | 0.795 | S | S | * | * | trans | -80.4 | 91.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | N166 | N166-G168 VanDerWaalsContact C-N 3.26Å; N166-G168 PolarHBondContact O-N 2.89Å | ||
| 169 | L | 33.5 | Very low | 33.2 | Very low | 159 Ų | 159 | 140 Ų | 140 | 83% | 0.832 | 80% | 0.795 | S | S | * | * | trans | 31.2 | 117.2 | 151.5 | -58.2 | 176.3 | 0 | 0 | 0 | 119.3 | P167 Y171 | P167-L169 PolarHBondContact O-N 3.45Å; P167-L169 VanDerWaalsContact O-N 3.16Å; L169-Y171 PolarHBondContact O-N 3.13Å | ||
| 170 | A | 31.1 | Very low | 33.5 | Very low | 106 Ų | 106 | 144.8 Ų | 144.8 | 88% | 0.876 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 124.1 | 166.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 171 | Y | 30.8 | Very low | 33.8 | Very low | 220 Ų | 220 | 140.9 Ų | 140.9 | 86% | 0.863 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -95.2 | 117.2 | 167.9 | -124 | -92.3 | 0 | 0 | 0 | 109.3 | L169 | L169-Y171 PolarHBondContact O-N 3.13Š|
| 172 | S | 30.4 | Very low | 33.9 | Very low | 68 Ų | 68 | 137.5 Ų | 137.5 | 48% | 0.476 | 80% | 0.799 | S | S | . | * | P | Polyproline II helix | trans | -82.3 | 129.8 | 174.8 | -168.6 | 0 | 0 | 0 | 0 | 110.4 | Q174 | S172-Q174 VanDerWaalsContact C-N 3.32Å; S172-Q174 PolarHBondContact O-N 3.35Å; S172-Q174 PolarHBondContact OG-OE1 2.91Å |
| 173 | P | 34.4 | Very low | 34.1 | Very low | 132 Ų | 132 | 138.9 Ų | 138.9 | 86% | 0.857 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -79.4 | 65.6 | 179.4 | -10.9 | 27.9 | 0 | 0 | 0 | 113.3 | ||
| 174 | Q | 35.5 | Very low | 33.8 | Very low | 143 Ų | 143 | 139.8 Ų | 139.8 | 67% | 0.668 | 80% | 0.803 | S | S | * | * | trans | -121 | -6.9 | -178.5 | -90.3 | 140.9 | -3.2 | 0 | 0 | 117 | S172 | S172-Q174 VanDerWaalsContact C-N 3.32Å; S172-Q174 PolarHBondContact O-N 3.35Å; S172-Q174 PolarHBondContact OG-OE1 2.91Å | ||
| 175 | D | 35.1 | Very low | 33.6 | Very low | 157 Ų | 157 | 136.7 Ų | 136.7 | 84% | 0.84 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -97.9 | 9.3 | -177.8 | -65.4 | -45.9 | 0 | 0 | 0 | 115.5 | ||
| 176 | Y | 34.1 | Very low | 33.5 | Very low | 236 Ų | 236 | 140.3 Ų | 140.3 | 93% | 0.925 | 80% | 0.799 | S | S | * | * | trans | -91.6 | 9.6 | 179.9 | -140.5 | -93.4 | 0 | 0 | 0 | 114.9 | ||||
| 177 | Q | 36.6 | Very low | 33.4 | Very low | 178 Ų | 178 | 141.9 Ų | 141.9 | 83% | 0.832 | 81% | 0.807 | S | S | * | * | trans | -103.2 | 63.7 | 179.4 | -79.5 | 172.8 | -7.9 | 0 | 0 | 111.9 | ||||
| 178 | S | 34.8 | Very low | 32.9 | Very low | 124 Ų | 124 | 144.4 Ų | 144.4 | 87% | 0.867 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -166.3 | 58.3 | 164.7 | -80.8 | 0 | 0 | 0 | 0 | 112.1 | ||
| 179 | A | 33.1 | Very low | 32.8 | Very low | 96 Ų | 96 | 146.4 Ų | 146.4 | 79% | 0.793 | 81% | 0.805 | S | S | * | * | trans | -160.3 | 78.1 | 161.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 180 | K | 34.2 | Very low | 32.4 | Very low | 204 Ų | 204 | 147.3 Ų | 147.3 | 89% | 0.887 | 81% | 0.807 | S | S | * | * | trans | -118.6 | 98.1 | 176.3 | -154.1 | -177.4 | -167.4 | -178.1 | 0 | 108.1 | ||||
| 181 | P | 34.9 | Very low | 32.2 | Very low | 118 Ų | 118 | 148.1 Ų | 148.1 | 77% | 0.766 | 80% | 0.796 | S | S | * | * | trans | -82.6 | 130.9 | 158.1 | 0.8 | 18.2 | 0 | 0 | 0 | 108 | L183 | P181-L183 PolarHBondContact O-N 3.1Š| ||
| 182 | A | 32.5 | Very low | 32.1 | Very low | 103 Ų | 103 | 142 Ų | 142 | 85% | 0.851 | 78% | 0.783 | S | S | * | * | trans | -57.8 | 121.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 183 | L | 35.9 | Very low | 31.8 | Very low | 169 Ų | 169 | 144.9 Ų | 144.9 | 89% | 0.885 | 79% | 0.793 | S | S | * | * | trans | -89.4 | 113.2 | 165.8 | -140.3 | 100.8 | 0 | 0 | 0 | 107.1 | P181 | P181-L183 PolarHBondContact O-N 3.1Š| ||
| 184 | D | 29.7 | Very low | 31.5 | Very low | 149 Ų | 149 | 147.9 Ų | 147.9 | 80% | 0.797 | 79% | 0.789 | S | S | * | * | trans | -55.9 | 135.8 | 174.1 | -163.3 | -5.3 | 0 | 0 | 0 | 110.3 | N186 | D184-N186 PolarHBondContact O-N 2.98Š| ||
| 185 | S | 32.7 | Very low | 31.2 | Very low | 93 Ų | 93 | 147.2 Ų | 147.2 | 65% | 0.65 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -85.2 | 104.4 | 179.9 | -57.7 | 0 | 0 | 0 | 0 | 106.7 | ||
| 186 | N | 30.7 | Very low | 30.9 | Very low | 159 Ų | 159 | 145.9 Ų | 145.9 | 85% | 0.85 | 78% | 0.782 | S | S | * | * | trans | 159.3 | 78.1 | 151.8 | -78.4 | -33.4 | 0 | 0 | 0 | 111.1 | D184 | D184-N186 PolarHBondContact O-N 2.98Š| ||
| 187 | L | 32.5 | Very low | 30.7 | Very low | 169 Ų | 169 | 144.2 Ų | 144.2 | 89% | 0.885 | 78% | 0.775 | S | S | * | * | trans | -156.1 | 79.1 | 157 | -149.1 | 70.7 | 0 | 0 | 0 | 110.7 | ||||
| 188 | F | 26.4 | Very low | 30.5 | Very low | 180 Ų | 180 | 141.9 Ų | 141.9 | 79% | 0.789 | 76% | 0.764 | S | S | * | * | trans | -99.3 | 136.8 | 157.2 | -86.8 | -84.1 | 0 | 0 | 0 | 107.2 | I191 | F188-I191 HydrophobicContact CE1-CD1 4.19Š| ||
| 189 | P | 29.4 | Very low | 30.3 | Very low | 111 Ų | 111 | 143.4 Ų | 143.4 | 72% | 0.721 | 76% | 0.757 | S | S | * | * | -147.9 | 161.1 | 95.8 | 36.1 | -18 | 0 | 0 | 0 | 116.1 | |||||
| 190 | M | 25.5 | Very low | 30.2 | Very low | 178 Ų | 178 | 143.9 Ų | 143.9 | 88% | 0.877 | 75% | 0.752 | S | S | * | * | trans | 90.3 | 75.8 | 160.4 | -52.7 | -141.6 | 155.2 | 0 | 0 | 118.5 | ||||
| 191 | I | 26.9 | Very low | 30.1 | Very low | 124 Ų | 124 | 140.9 Ų | 140.9 | 64% | 0.636 | 75% | 0.746 | S | S | * | * | trans | -85.6 | 123.6 | 151.8 | -57.8 | 167.2 | 0 | 0 | 0 | 107.2 | F188 | F188-I191 HydrophobicContact CE1-CD1 4.19Š| ||
| 192 | P | 28.4 | Very low | 30.2 | Very low | 90 Ų | 90 | 141.9 Ų | 141.9 | 58% | 0.584 | 75% | 0.745 | S | S | * | * | trans | -87 | 112.6 | 157.9 | 2.9 | 15.5 | 0 | 0 | 0 | 108.2 | Y194 | P192-Y194 VanDerWaalsContact C-N 3.33Å; P192-Y194 HydrophobicContact CB-CD2 4.13Å; P192-Y194 HydrophobicContact CB-CE2 3.76Å; P192-Y194 HydrophobicContact CG-CE2 4.37Å; P192-Y194 PolarHBondContact O-N 3.1Å | ||
| 193 | D | 25.1 | Very low | 30.2 | Very low | 130 Ų | 130 | 145 Ų | 145 | 70% | 0.695 | 74% | 0.744 | S | S | * | * | trans | -56.5 | 90 | 167.8 | -74.5 | -51.1 | 0 | 0 | 0 | 110.7 | N195 | D193-N195 PolarHBondContact O-N 3.13Å; D193-N195 VanDerWaalsContact O-N 3.17Å | ||
| 194 | Y | 27.8 | Very low | 30.1 | Very low | 195 Ų | 195 | 139.8 Ų | 139.8 | 77% | 0.765 | 73% | 0.731 | S | S | * | * | trans | -88.5 | 77 | 160.9 | -72.4 | -68.2 | 0 | 0 | 0 | 108.9 | P192 L196 | P192-Y194 VanDerWaalsContact C-N 3.33Å; P192-Y194 HydrophobicContact CB-CD2 4.13Å; P192-Y194 HydrophobicContact CB-CE2 3.76Å; P192-Y194 HydrophobicContact CG-CE2 4.37Å; P192-Y194 PolarHBondContact O-N 3.1Å; Y194-L196 PolarHBondContact O-N 3.45Å | ||
| 195 | N | 28.9 | Very low | 30.3 | Very low | 129 Ų | 129 | 138.9 Ų | 138.9 | 69% | 0.69 | 74% | 0.736 | S | S | * | * | trans | -45.2 | 126.2 | 171 | -93 | -45.7 | 0 | 0 | 0 | 111.5 | D193 Y197 | D193-N195 PolarHBondContact O-N 3.13Å; D193-N195 VanDerWaalsContact O-N 3.17Å; N195-Y197 PolarHBondContact O-N 2.88Å; N195-Y197 VanDerWaalsContact O-N 3.14Å | ||
| 196 | L | 29.4 | Very low | 30.5 | Very low | 129 Ų | 129 | 141.8 Ų | 141.8 | 68% | 0.675 | 74% | 0.743 | S | S | * | * | trans | -24 | 111.1 | 148.1 | -84 | 65.3 | 0 | 0 | 0 | 111.1 | Y194 H198 | Y194-L196 PolarHBondContact O-N 3.45Å; L196-H198 HydrophobicContact CB-CB 4.22Å; L196-H198 HydrophobicContact CD2-CB 4.33Å; L196-H198 VanDerWaalsContact CD2-CD2 3.45Å; L196-H198 WeakPolarHBondContact CD2-CD2 3.41Å; L196-H198 PolarHBondContact O-N 2.73Å | ||
| 197 | Y | 29 | Very low | 30.9 | Very low | 201 Ų | 201 | 139.4 Ų | 139.4 | 79% | 0.788 | 74% | 0.736 | S | S | * | * | trans | -72.8 | 66 | 146.3 | -95.2 | -88.9 | 0 | 0 | 0 | 108 | N195 | N195-Y197 PolarHBondContact O-N 2.88Å; N195-Y197 VanDerWaalsContact O-N 3.14Å | ||
| 198 | H | 32.7 | Very low | 30.8 | Very low | 129 Ų | 129 | 140.8 Ų | 140.8 | 60% | 0.597 | 74% | 0.738 | S | S | * | * | trans | -86.6 | 104.6 | 151.5 | -92.4 | -94.2 | 0 | 0 | 0 | 105.6 | L196 P200 | L196-H198 HydrophobicContact CB-CB 4.22Å; L196-H198 HydrophobicContact CD2-CB 4.33Å; L196-H198 VanDerWaalsContact CD2-CD2 3.45Å; L196-H198 WeakPolarHBondContact CD2-CD2 3.41Å; L196-H198 PolarHBondContact O-N 2.73Å; H198-P200 WeakPolarHBondContact O-CD 3.49Å | ||
| 199 | H | 31.1 | Very low | 31.5 | Very low | 156 Ų | 156 | 140.7 Ų | 140.7 | 72% | 0.722 | 74% | 0.74 | S | S | * | * | trans | -59.4 | 119.8 | 163.4 | -107.4 | -76 | 0 | 0 | 0 | 107.5 | N201 | H199-N201 PolarHBondContact O-N 2.76Å; H199-N201 VanDerWaalsContact O-N 3.07Å | ||
| 200 | P | 30 | Very low | 31.8 | Very low | 105 Ų | 105 | 145 Ų | 145 | 68% | 0.682 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -84.5 | 30.7 | -169.4 | 33.9 | -34.9 | 0 | 0 | 0 | 114 | H198 | H198-P200 WeakPolarHBondContact O-CD 3.49Š|
| 201 | N | 33.6 | Very low | 32.3 | Very low | 142 Ų | 142 | 142 Ų | 142 | 76% | 0.759 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -124.9 | 28 | -168.7 | -71 | -6.2 | 0 | 0 | 0 | 115.6 | H199 | H199-N201 PolarHBondContact O-N 2.76Å; H199-N201 VanDerWaalsContact O-N 3.07Å |
| 202 | D | 35.7 | Very low | 32.7 | Very low | 138 Ų | 138 | 146.2 Ų | 146.2 | 74% | 0.738 | 76% | 0.755 | S | S | * | * | trans | -143.7 | 30.2 | 175.6 | -134.1 | -2.4 | 0 | 0 | 0 | 113.2 | G204 | D202-G204 VanDerWaalsContact C-N 3.33Å; D202-G204 PolarHBondContact O-N 3.29Å; D202-G204 VanDerWaalsContact O-N 3.16Å | ||
| 203 | M | 33.3 | Very low | 32.9 | Very low | 169 Ų | 169 | 150.9 Ų | 150.9 | 83% | 0.833 | 77% | 0.769 | S | S | * | * | trans | -86 | 75.7 | 174.5 | -64.8 | -64.3 | -168.5 | 0 | 0 | 109.7 | ||||
| 204 | G | 34.2 | Very low | 33.3 | Very low | 60 Ų | 60 | 148.1 Ų | 148.1 | 62% | 0.619 | 77% | 0.772 | S | S | * | * | trans | -73.8 | 128.6 | 157.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | D202 I206 | D202-G204 VanDerWaalsContact C-N 3.33Å; D202-G204 PolarHBondContact O-N 3.29Å; D202-G204 VanDerWaalsContact O-N 3.16Å; G204-I206 PolarHBondContact O-N 2.82Å | ||
| 205 | S | 33.4 | Very low | 33.6 | Very low | 130 Ų | 130 | 147.4 Ų | 147.4 | 91% | 0.909 | 78% | 0.777 | S | S | * | * | trans | -36.6 | 118.8 | -175.2 | -35.6 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 206 | I | 37.6 | Very low | 33.8 | Very low | 153 Ų | 153 | 148.2 Ų | 148.2 | 79% | 0.785 | 78% | 0.782 | S | S | * | * | trans | -128.6 | 134.5 | 165.6 | -57.3 | 177.4 | 0 | 0 | 0 | 108.7 | G204 | G204-I206 PolarHBondContact O-N 2.82Š| ||
| 207 | P | 38 | Very low | 34.3 | Very low | 109 Ų | 109 | 147.9 Ų | 147.9 | 71% | 0.708 | 79% | 0.787 | S | S | * | * | trans | -70.2 | 151.6 | -169.8 | -12.4 | 28.1 | 0 | 0 | 0 | 113.3 | H209 | P207-H209 PolarHBondContact O-N 3.5Å; P207-H209 VanDerWaalsContact O-N 3.14Å | ||
| 208 | E | 30.9 | Very low | 34.9 | Very low | 199 Ų | 199 | 143.4 Ų | 143.4 | 93% | 0.93 | 78% | 0.776 | S | S | * | * | trans | -42.7 | 108.7 | 176.2 | -62.2 | 179.7 | 138.3 | 0 | 0 | 113.3 | ||||
| 209 | H | 40.3 | Very low | 35.1 | Very low | 178 Ų | 178 | 147 Ų | 147 | 82% | 0.824 | 78% | 0.784 | S | S | * | * | trans | -104.5 | 119.4 | 161.2 | -89 | -83.3 | 0 | 0 | 0 | 108.9 | P207 | P207-H209 PolarHBondContact O-N 3.5Å; P207-H209 VanDerWaalsContact O-N 3.14Å | ||
| 210 | K | 36.9 | Very low | 35.5 | Very low | 201 Ų | 201 | 145.3 Ų | 145.3 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | trans | -48.1 | 131.4 | 177.7 | -87.7 | 166.2 | 174.4 | 171.8 | 0 | 111.6 | F212 | K210-F212 PolarHBondContact O-N 2.78Š| ||
| 211 | P | 34.9 | Very low | 35.7 | Very low | 114 Ų | 114 | 146.2 Ų | 146.2 | 74% | 0.74 | 78% | 0.783 | S | S | * | * | trans | -61.9 | 128.6 | 173.8 | -14.9 | 27.1 | 0 | 0 | 0 | 109.9 | Q213 | P211-Q213 PolarHBondContact O-N 3.41Š| ||
| 212 | F | 35.1 | Very low | 36 | Very low | 213 Ų | 213 | 144.5 Ų | 144.5 | 93% | 0.934 | 78% | 0.78 | S | S | * | * | trans | -66.2 | 104.3 | 168.6 | -135 | -92.8 | 0 | 0 | 0 | 107.8 | K210 G214 | K210-F212 PolarHBondContact O-N 2.78Å; F212-G214 PolarHBondContact O-N 3.12Å | ||
| 213 | Q | 32.6 | Very low | 36 | Very low | 188 Ų | 188 | 143.6 Ų | 143.6 | 88% | 0.879 | 78% | 0.782 | S | S | * | * | trans | -73 | 114.9 | 170.3 | -66.1 | 178 | -9.2 | 0 | 0 | 107.4 | P211 | P211-Q213 PolarHBondContact O-N 3.41Š| ||
| 214 | G | 33.8 | Very low | 36.7 | Very low | 73 Ų | 73 | 138.8 Ų | 138.8 | 75% | 0.753 | 76% | 0.763 | S | S | * | * | trans | 162.3 | -1.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 118.1 | F212 | F212-G214 PolarHBondContact O-N 3.12Š| ||
| 215 | M | 34.7 | Very low | 37.7 | Very low | 179 Ų | 179 | 142.1 Ų | 142.1 | 88% | 0.882 | 77% | 0.765 | S | S | * | * | trans | -132 | 114.6 | 169.8 | -69.7 | -179 | 179.7 | 0 | 0 | 109.2 | ||||
| 216 | D | 33.6 | Very low | 38.9 | Very low | 147 Ų | 147 | 139 Ų | 139 | 79% | 0.786 | 74% | 0.741 | S | S | * | * | trans | -51.4 | 140.4 | 172.8 | -67.6 | -54.6 | 0 | 0 | 0 | 109.9 | I218 | D216-I218 PolarHBondContact O-N 3.46Š| ||
| 217 | P | 38.7 | Very low | 40.1 | Very low | 122 Ų | 122 | 131.7 Ų | 131.7 | 79% | 0.792 | 70% | 0.704 | S | S | * | * | trans | -50.5 | 116.5 | 169.5 | -20.1 | 28.8 | 0 | 0 | 0 | 108.1 | R219 | P217-R219 PolarHBondContact O-N 3Š| ||
| 218 | I | 41.1 | Very low | 41.4 | Very low | 107 Ų | 107 | 129 Ų | 129 | 55% | 0.549 | 68% | 0.683 | S | S | . | * | trans | -52.8 | 106.5 | -179.3 | -62.7 | 176.6 | 0 | 0 | 0 | 107.1 | D216 V220 I324 | D216-I218 PolarHBondContact O-N 3.46Å; I218-V220 PolarHBondContact O-N 3.3Å; I218-I324 HydrophobicContact CD1-CD1 4.43Å | ||
| 219 | R | 38.6 | Very low | 42.9 | Very low | 204 Ų | 204 | 124.1 Ų | 124.1 | 77% | 0.77 | 66% | 0.66 | S | S | * | * | trans | -53.1 | 103 | 168.1 | -92.8 | -172.3 | -178.7 | -178.8 | 0.2 | 107.2 | P217 N221 | P217-R219 PolarHBondContact O-N 3Å; R219-N221 PolarHBondContact O-N 3.1Å; R219-N221 VanDerWaalsContact O-N 3.11Å | ||
| 220 | V | 39.4 | Very low | 43.9 | Very low | 120 Ų | 120 | 118 Ų | 118 | 73% | 0.727 | 64% | 0.635 | S | S | * | * | trans | -73.9 | 95.1 | 167.6 | -174 | 0 | 0 | 0 | 0 | 105.9 | I218 | I218-V220 PolarHBondContact O-N 3.3Š| ||
| 221 | N | 34.5 | Very low | 45.1 | Very low | 124 Ų | 124 | 109.2 Ų | 109.2 | 66% | 0.663 | 60% | 0.598 | S | S | * | * | trans | -104.6 | 153.4 | 172.1 | -99.9 | -32.5 | 0 | 0 | 0 | 108.9 | R219 | R219-N221 PolarHBondContact O-N 3.1Å; R219-N221 VanDerWaalsContact O-N 3.11Å | ||
| 222 | P | 39.5 | Very low | 46.5 | Very low | 106 Ų | 106 | 108.2 Ų | 108.2 | 69% | 0.688 | 58% | 0.582 | S | S | * | * | cis | -116.2 | -169 | -33.5 | 42.3 | -26.9 | 0 | 0 | 0 | 108.5 | ||||
| 223 | P | 36.1 | Very low | 47.5 | Very low | 119 Ų | 119 | 99.7 Ų | 99.7 | 77% | 0.773 | 55% | 0.551 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 142.8 | -169.2 | 28.9 | -31.6 | 0 | 0 | 0 | 111.8 | ||
| 224 | P | 47 | Very low | 48.6 | Very low | 69 Ų | 69 | 97.7 Ų | 97.7 | 45% | 0.448 | 54% | 0.539 | S | S | . | . | P | Polyproline II helix | trans | -75.2 | 133.3 | -177.1 | 30.6 | -31.6 | 0 | 0 | 0 | 109.9 | T226 | P224-T226 PolarHBondContact O-N 3.24Å; P224-T226 VanDerWaalsContact O-N 3.17Å |
| 225 | I | 54.4 | Low | 49.8 | Very low | 129 Ų | 129 | 99 Ų | 99 | 66% | 0.662 | 52% | 0.524 | S | S | * | . | P | Polyproline II helix | trans | -49.6 | 124.7 | 154 | -60.6 | 169.7 | 0 | 0 | 0 | 106.3 | P227 | I225-P227 WeakPolarHBondContact O-CD 3.48Š|
| 226 | T | 59.3 | Low | 50.8 | Low | 64 Ų | 64 | 95.9 Ų | 95.9 | 39% | 0.393 | 51% | 0.511 | S | S | . | . | P | Polyproline II helix | trans | -68.7 | 129.6 | -174.3 | 59.6 | 0 | 0 | 0 | 0 | 108.8 | P224 L228 E229 T230 | P224-T226 PolarHBondContact O-N 3.24Å; P224-T226 VanDerWaalsContact O-N 3.17Å; T226-L228 PolarHBondContact O-N 3.29Å; T226-E229 PolarHBondContact O-N 3.44Å; T226-E229 VanDerWaalsContact OG1-CG 3.23Å; T226-E229 WeakPolarHBondContact OG1-CG 3.45Å; T226-T230 PolarHBondContact O-N 3.41Å |
| 227 | P | 63.7 | Low | 51.7 | Low | 1 Ų | 1 | 95.4 Ų | 95.4 | 1% | 0.006 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -54.1 | -24.7 | 174 | -28.1 | 33.7 | 0 | 0 | 0 | 113.2 | I225 T230 I231 T293 L296 R297 | I225-P227 WeakPolarHBondContact O-CD 3.48Å; P227-T230 PolarHBondContact O-N 3.24Å; P227-I231 VanDerWaalsContact O-CG1 3.25Å; P227-I231 WeakPolarHBondContact O-CG1 3.37Å; P227-I231 PolarHBondContact O-N 3.16Å; P227-T293 HydrophobicContact CG-CG2 4.27Å; P227-L296 HydrophobicContact CB-CB 3.85Å; P227-R297 HydrophobicContact CB-CG 4.35Å; P227-R297 HydrophobicContact CG-CG 3.53Å |
| 228 | L | 64.8 | Low | 52.2 | Low | 53 Ų | 53 | 97.5 Ų | 97.5 | 28% | 0.277 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.1 | -44.9 | 176.5 | -169.1 | 67.9 | 0 | 0 | 0 | 111.6 | T226 T230 I231 K232 L296 | T226-L228 PolarHBondContact O-N 3.29Å; L228-T230 VanDerWaalsContact C-N 3.32Å; L228-T230 PolarHBondContact O-N 3.19Å; L228-I231 PolarHBondContact O-N 3.41Å; L228-K232 HydrophobicContact CG-CD 4.47Å; L228-K232 WeakPolarHBondContact O-CB 3.18Å; L228-K232 VanDerWaalsContact O-CG 3.31Å; L228-K232 WeakPolarHBondContact O-CG 3.33Å; L228-K232 PolarHBondContact O-N 2.82Å; L228-L296 HydrophobicContact CB-CD1 4.16Å; L228-L296 HydrophobicContact CD1-CD1 3.59Å; L228-L296 HydrophobicContact CG-CD1 4.5Å |
| 229 | E | 62.4 | Low | 52.3 | Low | 96 Ų | 96 | 98.9 Ų | 98.9 | 45% | 0.449 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -68.2 | -33.7 | 176.2 | -67.9 | -53.7 | 123.3 | 0 | 0 | 111.5 | T226 K232 A233 | T226-E229 PolarHBondContact O-N 3.44Å; T226-E229 VanDerWaalsContact OG1-CG 3.23Å; T226-E229 WeakPolarHBondContact OG1-CG 3.45Å; E229-K232 WeakPolarHBondContact OE1-CD 3.39Å; E229-K232 IonicContact OE1-NZ 3.92Å; E229-K232 PolarHBondContact OE1-NZ 3.24Å; E229-A233 WeakPolarHBondContact O-CB 3.5Å; E229-A233 PolarHBondContact O-N 3.46Å |
| 230 | T | 60.8 | Low | 52.3 | Low | 48 Ų | 48 | 95.9 Ų | 95.9 | 29% | 0.294 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.6 | -46.1 | 171.4 | -47.2 | 0 | 0 | 0 | 0 | 111.3 | T226 P227 L228 A233 F234 T300 | T226-T230 PolarHBondContact O-N 3.41Å; P227-T230 PolarHBondContact O-N 3.24Å; L228-T230 VanDerWaalsContact C-N 3.32Å; L228-T230 PolarHBondContact O-N 3.19Å; T230-A233 PolarHBondContact O-N 2.94Å; T230-F234 HydrophobicContact CG2-CD2 3.96Å; T230-F234 HydrophobicContact CG2-CE2 3.92Å; T230-F234 VanDerWaalsContact O-CD2 3.24Å; T230-F234 WeakPolarHBondContact O-CD2 3.27Å; T230-F234 PolarHBondContact O-N 2.95Å; T230-T300 HydrophobicContact CG2-CG2 4.37Å |
| 231 | I | 61.8 | Low | 52.1 | Low | 18 Ų | 18 | 96.2 Ų | 96.2 | 9% | 0.092 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -69.2 | -40.3 | -179.6 | -68.2 | 168.7 | 0 | 0 | 0 | 111.6 | P227 L228 F234 K235 P278 L296 T300 | P227-I231 VanDerWaalsContact O-CG1 3.25Å; P227-I231 WeakPolarHBondContact O-CG1 3.37Å; P227-I231 PolarHBondContact O-N 3.16Å; L228-I231 PolarHBondContact O-N 3.41Å; I231-F234 PolarHBondContact O-N 3.29Å; I231-K235 PolarHBondContact O-N 3.47Å; I231-P278 HydrophobicContact CG2-CG 4.19Å; I231-L296 HydrophobicContact CD1-CB 3.59Å; I231-L296 HydrophobicContact CD1-CD1 4Å; I231-L296 HydrophobicContact CD1-CD2 3.24Å; I231-L296 HydrophobicContact CD1-CG 3.74Å; I231-T300 HydrophobicContact CD1-CG2 3.86Å; I231-T300 HydrophobicContact CG1-CG2 3.53Å |
| 232 | K | 64.4 | Low | 52.1 | Low | 92 Ų | 92 | 93.4 Ų | 93.4 | 40% | 0.4 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.8 | -47.9 | 172.6 | -73 | 175.7 | -177.1 | 171.2 | 0 | 110.8 | L228 E229 F234 K235 D236 | L228-K232 HydrophobicContact CG-CD 4.47Å; L228-K232 WeakPolarHBondContact O-CB 3.18Å; L228-K232 VanDerWaalsContact O-CG 3.31Å; L228-K232 WeakPolarHBondContact O-CG 3.33Å; L228-K232 PolarHBondContact O-N 2.82Å; E229-K232 WeakPolarHBondContact OE1-CD 3.39Å; E229-K232 IonicContact OE1-NZ 3.92Å; E229-K232 PolarHBondContact OE1-NZ 3.24Å; K232-F234 VanDerWaalsContact C-N 3.25Å; K232-F234 PolarHBondContact O-N 3.21Å; K232-K235 CarbonylContact O-C 3.56Å; K232-K235 WeakPolarHBondContact O-CA 3.27Å; K232-K235 WeakPolarHBondContact O-CB 3.28Å; K232-K235 PolarHBondContact O-N 2.84Å; K232-D236 PolarHBondContact O-N 2.81Å |
| 233 | A | 57.3 | Low | 52 | Low | 34 Ų | 34 | 98.8 Ų | 98.8 | 28% | 0.281 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.6 | -34.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | E229 T230 K237 | E229-A233 WeakPolarHBondContact O-CB 3.5Å; E229-A233 PolarHBondContact O-N 3.46Å; T230-A233 PolarHBondContact O-N 2.94Å; A233-K237 WeakPolarHBondContact O-CB 3.4Å; A233-K237 WeakPolarHBondContact O-CG 3.4Å; A233-K237 PolarHBondContact O-N 3.12Å |
| 234 | F | 54.5 | Low | 51.9 | Low | 146 Ų | 146 | 96.5 Ų | 96.5 | 64% | 0.64 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -69.1 | -33.8 | 172.5 | -94 | -77.3 | 0 | 0 | 0 | 113 | T230 I231 K232 Q238 | T230-F234 HydrophobicContact CG2-CD2 3.96Å; T230-F234 HydrophobicContact CG2-CE2 3.92Å; T230-F234 VanDerWaalsContact O-CD2 3.24Å; T230-F234 WeakPolarHBondContact O-CD2 3.27Å; T230-F234 PolarHBondContact O-N 2.95Å; I231-F234 PolarHBondContact O-N 3.29Å; K232-F234 VanDerWaalsContact C-N 3.25Å; K232-F234 PolarHBondContact O-N 3.21Å; F234-Q238 WeakPolarHBondContact O-CG 3.01Å |
| 235 | K | 58.6 | Low | 51.2 | Low | 100 Ų | 100 | 99 Ų | 99 | 44% | 0.435 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -71.2 | -42.6 | 174.5 | -72.4 | -166.7 | 177.7 | -159 | 0 | 111.7 | I231 K232 P278 | I231-K235 PolarHBondContact O-N 3.47Å; K232-K235 CarbonylContact O-C 3.56Å; K232-K235 WeakPolarHBondContact O-CA 3.27Å; K232-K235 WeakPolarHBondContact O-CB 3.28Å; K232-K235 PolarHBondContact O-N 2.84Å; K235-P278 VanDerWaalsContact CE-O 3.27Å; K235-P278 WeakPolarHBondContact CE-O 3.34Å; K235-P278 PolarHBondContact NZ-O 3.07Å |
| 236 | D | 55.6 | Low | 50.4 | Low | 115 Ų | 115 | 100.3 Ų | 100.3 | 62% | 0.615 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -77.1 | -32.1 | -176.4 | -60.4 | -27.9 | 0 | 0 | 0 | 112.5 | K232 Q238 I239 | K232-D236 PolarHBondContact O-N 2.81Å; D236-Q238 VanDerWaalsContact C-N 3.29Å; D236-Q238 PolarHBondContact O-N 2.87Å; D236-I239 PolarHBondContact O-N 3.08Å |
| 237 | K | 52.9 | Low | 49.6 | Very low | 136 Ų | 136 | 103.1 Ų | 103.1 | 59% | 0.591 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.3 | -1.4 | 178.9 | -67.3 | 178.8 | 179.1 | -175.5 | 0 | 115.1 | A233 I239 H240 | A233-K237 WeakPolarHBondContact O-CB 3.4Å; A233-K237 WeakPolarHBondContact O-CG 3.4Å; A233-K237 PolarHBondContact O-N 3.12Å; K237-I239 PolarHBondContact O-N 3.36Å; K237-H240 WeakPolarHBondContact CG-NE2 3.45Å; K237-H240 PolarHBondContact O-CD2 3.2Å; K237-H240 VanDerWaalsContact O-CD2 3.24Å |
| 238 | Q | 49.8 | Very low | 48.4 | Very low | 166 Ų | 166 | 111.1 Ų | 111.1 | 78% | 0.776 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | 0.7 | 166.4 | -71.1 | -85 | 10.7 | 0 | 0 | 112 | F234 D236 | F234-Q238 WeakPolarHBondContact O-CG 3.01Å; D236-Q238 VanDerWaalsContact C-N 3.29Å; D236-Q238 PolarHBondContact O-N 2.87Å |
| 239 | I | 42 | Very low | 47 | Very low | 137 Ų | 137 | 113.5 Ų | 113.5 | 70% | 0.703 | 62% | 0.621 | S | S | * | * | trans | -122.2 | 71.9 | 175.6 | -46.6 | 174.5 | 0 | 0 | 0 | 108.6 | D236 K237 | D236-I239 PolarHBondContact O-N 3.08Å; K237-I239 PolarHBondContact O-N 3.36Å | ||
| 240 | H | 39.8 | Very low | 45.8 | Very low | 141 Ų | 141 | 114 Ų | 114 | 65% | 0.653 | 63% | 0.633 | S | S | * | * | trans | -108.1 | 113.2 | 167.4 | -81.6 | -63.5 | 0 | 0 | 0 | 110.2 | K237 | K237-H240 WeakPolarHBondContact CG-NE2 3.45Å; K237-H240 PolarHBondContact O-CD2 3.2Å; K237-H240 VanDerWaalsContact O-CD2 3.24Å | ||
| 241 | P | 34.4 | Very low | 44.7 | Very low | 126 Ų | 126 | 119 Ų | 119 | 82% | 0.818 | 66% | 0.657 | S | S | * | * | trans | -77 | 121.2 | 164.8 | 30.5 | -26.6 | 0 | 0 | 0 | 108.6 | ||||
| 242 | G | 34.2 | Very low | 43.2 | Very low | 65 Ų | 65 | 123.8 Ų | 123.8 | 67% | 0.67 | 69% | 0.687 | S | S | * | * | trans | 93.1 | 70.2 | 158.6 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 243 | F | 37.3 | Very low | 41.9 | Very low | 219 Ų | 219 | 126.9 Ų | 126.9 | 96% | 0.961 | 71% | 0.707 | S | S | * | * | trans | -143.1 | 128.3 | 143.8 | -97.2 | -82.2 | 0 | 0 | 0 | 109.6 | S245 | F243-S245 PolarHBondContact O-N 3.06Š| ||
| 244 | G | 36 | Very low | 40.8 | Very low | 71 Ų | 71 | 132.7 Ų | 132.7 | 73% | 0.732 | 73% | 0.726 | S | S | * | * | trans | -59.3 | 127.6 | -169 | 0 | 0 | 0 | 0 | 0 | 114.9 | L246 | G244-L246 PolarHBondContact O-N 2.93Š| ||
| 245 | S | 31.6 | Very low | 39.8 | Very low | 123 Ų | 123 | 131.6 Ų | 131.6 | 86% | 0.86 | 73% | 0.734 | S | S | * | * | trans | 32.9 | 75.9 | 133.4 | -47.2 | 0 | 0 | 0 | 0 | 118.3 | F243 | F243-S245 PolarHBondContact O-N 3.06Š| ||
| 246 | L | 38.3 | Very low | 39 | Very low | 156 Ų | 156 | 133.7 Ų | 133.7 | 82% | 0.817 | 75% | 0.748 | S | S | * | * | trans | -121 | 122.6 | 139.3 | -96.3 | 164.8 | 0 | 0 | 0 | 107.3 | G244 Q248 | G244-L246 PolarHBondContact O-N 2.93Å; L246-Q248 PolarHBondContact O-N 2.88Å | ||
| 247 | P | 40.8 | Very low | 38.1 | Very low | 122 Ų | 122 | 137.3 Ų | 137.3 | 79% | 0.792 | 75% | 0.753 | S | S | * | * | trans | -69.6 | 102 | -179.3 | 28.1 | -29.9 | 0 | 0 | 0 | 108.1 | ||||
| 248 | Q | 38.9 | Very low | 37.5 | Very low | 169 Ų | 169 | 136.7 Ų | 136.7 | 79% | 0.79 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 129.8 | 164.7 | -66.7 | -158.1 | -4.6 | 0 | 0 | 108 | L246 | L246-Q248 PolarHBondContact O-N 2.88Š|
| 249 | P | 35.8 | Very low | 37.1 | Very low | 104 Ų | 104 | 137 Ų | 137 | 68% | 0.675 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 143.4 | 173.5 | 25.1 | -32.3 | 0 | 0 | 0 | 108.5 | L251 | P249-L251 PolarHBondContact O-N 3.46Å; P249-L251 VanDerWaalsContact O-N 3.09Å |
| 250 | P | 37.7 | Very low | 37.4 | Very low | 107 Ų | 107 | 138.8 Ų | 138.8 | 70% | 0.695 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 125.6 | 178.8 | 21.4 | -28.7 | 0 | 0 | 0 | 107.6 | T252 | P250-T252 HydrophobicContact CG-CG2 4.45Å; P250-T252 PolarHBondContact O-N 3.2Å |
| 251 | L | 37.6 | Very low | 37.3 | Very low | 153 Ų | 153 | 140.7 Ų | 140.7 | 80% | 0.801 | 76% | 0.762 | S | S | * | * | trans | -60.3 | 89.3 | 166.2 | -68.1 | 176.5 | 0 | 0 | 0 | 106.3 | P249 L253 | P249-L251 PolarHBondContact O-N 3.46Å; P249-L251 VanDerWaalsContact O-N 3.09Å; L251-L253 PolarHBondContact O-N 3.3Å | ||
| 252 | T | 30.1 | Very low | 37.9 | Very low | 118 Ų | 118 | 140.3 Ų | 140.3 | 72% | 0.724 | 76% | 0.76 | S | S | * | * | trans | -70.2 | 80 | 171.7 | 49.2 | 0 | 0 | 0 | 0 | 106.2 | P250 K254 | P250-T252 HydrophobicContact CG-CG2 4.45Å; P250-T252 PolarHBondContact O-N 3.2Å; T252-K254 VanDerWaalsContact C-N 3.34Å; T252-K254 PolarHBondContact O-N 3.4Å | ||
| 253 | L | 37.4 | Very low | 38.5 | Very low | 157 Ų | 157 | 141 Ų | 141 | 82% | 0.822 | 75% | 0.748 | S | S | * | * | trans | -58.7 | 105 | 166.3 | -74 | 173.7 | 0 | 0 | 0 | 105.9 | L251 | L251-L253 PolarHBondContact O-N 3.3Š| ||
| 254 | K | 33.2 | Very low | 38.9 | Very low | 155 Ų | 155 | 141.2 Ų | 141.2 | 67% | 0.674 | 74% | 0.743 | S | S | * | * | trans | -49.3 | 132.6 | 175.4 | -69.3 | 177.3 | 179.2 | 175.8 | 0 | 107.6 | T252 I256 | T252-K254 VanDerWaalsContact C-N 3.34Å; T252-K254 PolarHBondContact O-N 3.4Å; K254-I256 PolarHBondContact O-N 3.29Å | ||
| 255 | P | 33.4 | Very low | 39.4 | Very low | 124 Ų | 124 | 143.4 Ų | 143.4 | 81% | 0.805 | 74% | 0.744 | S | S | * | * | trans | -49 | 119 | 177.7 | -26.8 | 32.8 | 0 | 0 | 0 | 109.7 | R257 | P255-R257 PolarHBondContact O-N 2.71Š| ||
| 256 | I | 42.7 | Very low | 40.4 | Very low | 143 Ų | 143 | 140 Ų | 140 | 73% | 0.733 | 72% | 0.72 | S | S | * | * | trans | -62 | 112.7 | 172.4 | -61.2 | 173.2 | 0 | 0 | 0 | 105.3 | K254 | K254-I256 PolarHBondContact O-N 3.29Š| ||
| 257 | R | 37.3 | Very low | 41.2 | Very low | 191 Ų | 191 | 142.8 Ų | 142.8 | 72% | 0.721 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 131.7 | 176.1 | -75.5 | -173.6 | -177.1 | -172.5 | 0.6 | 108.3 | P255 R259 | P255-R257 PolarHBondContact O-N 2.71Å; R257-R259 PolarHBondContact O-N 2.74Å |
| 258 | P | 38.7 | Very low | 41.9 | Very low | 124 Ų | 124 | 139.6 Ų | 139.6 | 81% | 0.805 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 128.7 | 172.4 | -23.3 | 31.3 | 0 | 0 | 0 | 108.8 | K260 | P258-K260 PolarHBondContact O-N 3.3Å; P258-K260 VanDerWaalsContact O-N 3.09Å |
| 259 | R | 42.9 | Very low | 42.9 | Very low | 172 Ų | 172 | 135.8 Ų | 135.8 | 65% | 0.649 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 121.7 | 174.2 | -99.2 | -175.9 | 168.7 | -137.6 | -7 | 108 | R257 Y261 R284 | R257-R259 PolarHBondContact O-N 2.74Å; R259-Y261 PolarHBondContact O-N 3.45Å; R259-R284 VanDerWaalsContact NH1-NH2 3.11Å |
| 260 | K | 47.2 | Very low | 44 | Very low | 175 Ų | 175 | 136.9 Ų | 136.9 | 76% | 0.761 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -58.3 | -11.6 | 174.4 | -159.5 | 174 | -176.3 | -179.7 | 0 | 113.5 | P258 | P258-K260 PolarHBondContact O-N 3.3Å; P258-K260 VanDerWaalsContact O-N 3.09Å |
| 261 | Y | 37 | Very low | 45.1 | Very low | 180 Ų | 180 | 140.7 Ų | 140.7 | 71% | 0.706 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -127.6 | 105.6 | 173.3 | -64 | -80.6 | 0 | 0 | 0 | 109.4 | R259 | R259-Y261 PolarHBondContact O-N 3.45Š|
| 262 | P | 46.8 | Very low | 46.6 | Very low | 118 Ų | 118 | 139 Ų | 139 | 77% | 0.766 | 69% | 0.69 | S | S | * | * | trans | -58.1 | 146.9 | 164.9 | 24.4 | -29 | 0 | 0 | 0 | 108.4 | R264 | P262-R264 PolarHBondContact O-N 2.87Š| ||
| 263 | N | 47.1 | Very low | 49 | Very low | 80 Ų | 80 | 135.3 Ų | 135.3 | 43% | 0.428 | 66% | 0.662 | S | S | . | * | trans | -37.5 | 133.6 | -170.1 | -75.8 | -65.7 | 0 | 0 | 0 | 113.6 | ||||
| 264 | R | 45.7 | Very low | 51.1 | Low | 223 Ų | 223 | 132 Ų | 132 | 84% | 0.842 | 65% | 0.651 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 126 | 165.2 | -172.3 | 179 | -147.2 | -138.7 | 1.7 | 107.5 | P262 S266 | P262-R264 PolarHBondContact O-N 2.87Å; R264-S266 PolarHBondContact O-N 2.8Å |
| 265 | P | 47.3 | Very low | 53.5 | Low | 117 Ų | 117 | 127.7 Ų | 127.7 | 76% | 0.76 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 118.8 | 177.3 | -24.6 | 32 | 0 | 0 | 0 | 108.6 | ||
| 266 | S | 52.6 | Low | 56.1 | Low | 51 Ų | 51 | 124.2 Ų | 124.2 | 36% | 0.357 | 62% | 0.615 | S | S | . | * | P | Polyproline II helix | trans | -67.2 | 138.9 | 170.5 | -60.4 | 0 | 0 | 0 | 0 | 106.7 | R264 T268 R273 | R264-S266 PolarHBondContact O-N 2.8Å; S266-T268 PolarHBondContact O-N 3.38Å; S266-R273 PolarHBondContact OG-NH1 2.89Å |
| 267 | K | 54.9 | Low | 58.4 | Low | 216 Ų | 216 | 118.1 Ų | 118.1 | 94% | 0.939 | 58% | 0.584 | S | S | * | * | S | Bend | trans | -65.3 | -8.5 | -178.6 | -72.6 | -175.4 | 175.7 | -173.1 | 0 | 113.3 | ||
| 268 | T | 56 | Low | 60.8 | Low | 54 Ų | 54 | 110.9 Ų | 110.9 | 33% | 0.331 | 56% | 0.562 | S | S | . | * | S | Bend | trans | -95.8 | 132.3 | 178 | 54 | 0 | 0 | 0 | 0 | 109.9 | S266 | S266-T268 PolarHBondContact O-N 3.38Š|
| 269 | P | 59.1 | Low | 63 | Low | 90 Ų | 90 | 105.9 Ų | 105.9 | 58% | 0.584 | 53% | 0.531 | S | S | * | . | trans | -49.8 | 142.1 | 172.9 | -25.7 | 34.5 | 0 | 0 | 0 | 111.8 | H271 E272 | P269-H271 PolarHBondContact O-N 3.27Å; P269-E272 PolarHBondContact O-N 3.5Å | ||
| 270 | L | 60.1 | Low | 64.9 | Low | 127 Ų | 127 | 105.5 Ų | 105.5 | 67% | 0.665 | 54% | 0.537 | S | S | * | . | G | 310 helix | trans | -56.8 | -25.8 | -177.5 | -77.7 | 169.3 | 0 | 0 | 0 | 113.5 | E272 R273 | L270-E272 PolarHBondContact O-N 3.18Å; L270-R273 PolarHBondContact O-N 3.3Å |
| 271 | H | 60.3 | Low | 66.8 | Low | 186 Ų | 186 | 100.5 Ų | 100.5 | 86% | 0.861 | 54% | 0.535 | S | S | * | . | G | 310 helix | trans | -61.1 | -24.6 | 176.7 | -177.6 | 66.3 | 0 | 0 | 0 | 113 | P269 R273 | P269-H271 PolarHBondContact O-N 3.27Å; H271-R273 VanDerWaalsContact C-N 3.32Å; H271-R273 PolarHBondContact O-N 3.49Å |
| 272 | E | 68.6 | Low | 69.1 | Low | 118 Ų | 118 | 93 Ų | 93 | 55% | 0.551 | 51% | 0.509 | S | S | * | . | G | 310 helix | trans | -93.6 | 16.9 | -176.5 | -152.6 | 173.3 | -168.9 | 0 | 0 | 113 | P269 L270 P274 S287 | P269-E272 PolarHBondContact O-N 3.5Å; L270-E272 PolarHBondContact O-N 3.18Å; E272-P274 VanDerWaalsContact C-CD 3.46Å; E272-P274 WeakPolarHBondContact O-CD 3.11Å; E272-S287 WeakPolarHBondContact O-CA 3.33Å; E272-S287 WeakPolarHBondContact O-CB 3.39Å |
| 273 | R | 79.9 | Confident | 71 | Confident | 40 Ų | 40 | 94.3 Ų | 94.3 | 15% | 0.151 | 51% | 0.509 | C | S | . | . | trans | -120.3 | 74.1 | -179.7 | -55.8 | -177.2 | 82.5 | 176.1 | 11.4 | 111.8 | S266 L270 H271 H275 R285 F286 | S266-R273 PolarHBondContact OG-NH1 2.89Å; L270-R273 PolarHBondContact O-N 3.3Å; H271-R273 VanDerWaalsContact C-N 3.32Å; H271-R273 PolarHBondContact O-N 3.49Å; R273-H275 VanDerWaalsContact C-N 3.27Å; R273-H275 PolarHBondContact O-N 2.94Å; R273-R285 HydrophobicContact CB-CB 3.89Å; R273-R285 PolarHBondContact NE-O 3.17Å; R273-R285 PolarHBondContact NH2-O 2.97Å; R273-R285 PolarHBondContact O-NE 3.13Å; R273-R285 PolarHBondContact O-NH2 3.26Å; R273-R285 VanDerWaalsContact O-NH2 3.13Å; R273-F286 CarbonylContact C-O 3.58Å; R273-F286 VanDerWaalsContact C-O 3.29Å; R273-F286 VanDerWaalsContact CA-O 3.27Å; R273-F286 WeakPolarHBondContact CA-O 3.29Å | ||
| 274 | P | 81.9 | Confident | 72.9 | Confident | 88 Ų | 88 | 94 Ų | 94 | 57% | 0.571 | 50% | 0.502 | S | S | * | . | trans | -65.9 | -29.6 | -176 | -19.1 | 32.4 | 0 | 0 | 0 | 112.9 | E272 A276 | E272-P274 VanDerWaalsContact C-CD 3.46Å; E272-P274 WeakPolarHBondContact O-CD 3.11Å; P274-A276 PolarHBondContact O-N 3.4Å | ||
| 275 | H | 84.8 | Confident | 75 | Confident | 64 Ų | 64 | 88.7 Ų | 88.7 | 30% | 0.296 | 48% | 0.482 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.3 | 92.7 | -168.5 | -60.2 | -68.5 | 0 | 0 | 0 | 111.8 | R273 R285 F286 S289 L292 | R273-H275 VanDerWaalsContact C-N 3.27Å; R273-H275 PolarHBondContact O-N 2.94Å; H275-R285 CarbonylContact O-C 3.55Å; H275-R285 WeakPolarHBondContact O-CA 3.29Å; H275-F286 HydrophobicContact CB-CB 4.21Å; H275-F286 WeakPolarHBondContact CB-O 3.46Å; H275-F286 PolarHBondContact N-O 3.17Å; H275-F286 VanDerWaalsContact N-O 3.09Å; H275-F286 PolarHBondContact O-N 3.01Å; H275-S289 PolarHBondContact CD2-N 3.04Å; H275-S289 VanDerWaalsContact CD2-N 3.26Å; H275-S289 PolarHBondContact NE2-N 3.42Å; H275-L292 HydrophobicContact CB-CB 3.97Å; H275-L292 HydrophobicContact CB-CD2 3.82Å; H275-L292 HydrophobicContact CB-CG 4.47Å |
| 276 | A | 87.4 | Confident | 76.9 | Confident | 52 Ų | 52 | 84.1 Ų | 84.1 | 43% | 0.43 | 45% | 0.45 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.6 | 147.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | P274 P278 R285 L292 | P274-A276 PolarHBondContact O-N 3.4Å; A276-P278 WeakPolarHBondContact O-CD 3.42Å; A276-R285 HydrophobicContact CB-CG 4.23Å; A276-L292 WeakPolarHBondContact O-CD2 3.21Å |
| 277 | C | 90.2 | Very high | 78.6 | Confident | 14 Ų | 14 | 83.8 Ų | 83.8 | 10% | 0.095 | 45% | 0.448 | C | S | . | . | trans | -70.6 | 124.6 | 170.8 | -170.9 | 0 | 0 | 0 | 0 | 110.2 | A279 C282 R284 L292 H295 H299 | C277-A279 PolarHBondContact O-N 3.15Å; C277-C282 HydrophobicContact CB-CB 4.1Å; C277-R284 WeakPolarHBondContact CB-O 3.32Å; C277-R284 PolarHBondContact N-O 3.49Å; C277-L292 HydrophobicContact CB-CD1 4.31Å; C277-H295 VanDerWaalsContact SG-CD2 3.55Å; C277-H295 PolarHBondContact SG-NE2 2.94Å; C277-H299 PolarHBondContact SG-NE2 3.34Å; C277-H299 VanDerWaalsContact SG-NE2 3.4Å | ||
| 278 | P | 87.7 | Confident | 80.1 | Confident | 39 Ų | 39 | 78.8 Ų | 78.8 | 25% | 0.253 | 42% | 0.424 | S | S | . | . | trans | -79.5 | 1.4 | 177.7 | 33 | -37.8 | 0 | 0 | 0 | 113.9 | I231 K235 A276 L296 | I231-P278 HydrophobicContact CG2-CG 4.19Å; K235-P278 VanDerWaalsContact CE-O 3.27Å; K235-P278 WeakPolarHBondContact CE-O 3.34Å; K235-P278 PolarHBondContact NZ-O 3.07Å; A276-P278 WeakPolarHBondContact O-CD 3.42Å; P278-L296 HydrophobicContact CG-CD2 3.91Å | ||
| 279 | A | 85.7 | Confident | 81.6 | Confident | 19 Ų | 19 | 79.5 Ų | 79.5 | 16% | 0.157 | 43% | 0.43 | C | S | . | . | S | Bend | trans | -82.9 | 131.4 | -177.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | C277 G281 C282 H299 | C277-A279 PolarHBondContact O-N 3.15Å; A279-G281 PolarHBondContact O-N 3.37Å; A279-C282 HydrophobicContact CB-CB 4.24Å; A279-C282 WeakPolarHBondContact O-CB 3.39Å; A279-C282 PolarHBondContact O-N 2.84Å; A279-C282 VanDerWaalsContact O-N 3.08Å; A279-H299 HydrophobicContact CB-CB 4.5Å |
| 280 | E | 83.6 | Confident | 82.8 | Confident | 164 Ų | 164 | 77.5 Ų | 77.5 | 77% | 0.766 | 42% | 0.415 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.6 | 129.1 | 176.7 | -58.5 | -53.8 | 130.9 | 0 | 0 | 110.9 | ||
| 281 | G | 86.2 | Confident | 84.1 | Confident | 71 Ų | 71 | 74.2 Ų | 74.2 | 73% | 0.732 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 81 | 12.4 | -176.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | A279 | A279-G281 PolarHBondContact O-N 3.37Š|
| 282 | C | 86 | Confident | 85.5 | Confident | 22 Ų | 22 | 66 Ų | 66 | 15% | 0.149 | 36% | 0.359 | C | S | . | . | trans | -117 | 103.1 | 175.2 | -162.9 | 0 | 0 | 0 | 0 | 113.8 | C277 A279 R284 H295 | C277-C282 HydrophobicContact CB-CB 4.1Å; A279-C282 HydrophobicContact CB-CB 4.24Å; A279-C282 WeakPolarHBondContact O-CB 3.39Å; A279-C282 PolarHBondContact O-N 2.84Å; A279-C282 VanDerWaalsContact O-N 3.08Å; C282-R284 PolarHBondContact O-N 3.21Å; C282-R284 VanDerWaalsContact O-N 3.11Å; C282-H295 VanDerWaalsContact SG-CE1 3.59Å; C282-H295 PolarHBondContact SG-NE2 3.13Å | ||
| 283 | D | 86.7 | Confident | 86.3 | Confident | 146 Ų | 146 | 62 Ų | 62 | 78% | 0.781 | 34% | 0.342 | S | S | * | . | trans | -84.1 | 23.5 | 179.2 | -51 | -44.5 | 0 | 0 | 0 | 113.9 | ||||
| 284 | R | 86.7 | Confident | 86.6 | Confident | 72 Ų | 72 | 64 Ų | 64 | 27% | 0.272 | 35% | 0.35 | S | S | . | . | trans | -86.5 | 126.4 | -177.5 | -72.6 | -161.5 | 173.2 | 176 | 5.2 | 111.5 | R259 C277 C282 F286 | R259-R284 VanDerWaalsContact NH1-NH2 3.11Å; C277-R284 WeakPolarHBondContact CB-O 3.32Å; C277-R284 PolarHBondContact N-O 3.49Å; C282-R284 PolarHBondContact O-N 3.21Å; C282-R284 VanDerWaalsContact O-N 3.11Å; R284-F286 HydrophobicContact CB-CE2 3.78Å; R284-F286 HydrophobicContact CB-CZ 3.79Å | ||
| 285 | R | 90.3 | Very high | 86.9 | Confident | 113 Ų | 113 | 60.5 Ų | 60.5 | 43% | 0.426 | 33% | 0.326 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.4 | 154.9 | 169.5 | -56.8 | -177.5 | 66.6 | 153.8 | 3.7 | 109.9 | R273 H275 A276 | R273-R285 HydrophobicContact CB-CB 3.89Å; R273-R285 PolarHBondContact NE-O 3.17Å; R273-R285 PolarHBondContact NH2-O 2.97Å; R273-R285 PolarHBondContact O-NE 3.13Å; R273-R285 PolarHBondContact O-NH2 3.26Å; R273-R285 VanDerWaalsContact O-NH2 3.13Å; H275-R285 CarbonylContact O-C 3.55Å; H275-R285 WeakPolarHBondContact O-CA 3.29Å; A276-R285 HydrophobicContact CB-CG 4.23Å |
| 286 | F | 87 | Confident | 87.1 | Confident | 20 Ų | 20 | 57.4 Ų | 57.4 | 9% | 0.088 | 31% | 0.312 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.9 | 147.7 | -178.2 | -59.1 | -86.3 | 0 | 0 | 0 | 110 | R273 H275 R284 R288 E291 L292 H295 | R273-F286 CarbonylContact C-O 3.58Å; R273-F286 VanDerWaalsContact C-O 3.29Å; R273-F286 VanDerWaalsContact CA-O 3.27Å; R273-F286 WeakPolarHBondContact CA-O 3.29Å; H275-F286 HydrophobicContact CB-CB 4.21Å; H275-F286 WeakPolarHBondContact CB-O 3.46Å; H275-F286 PolarHBondContact N-O 3.17Å; H275-F286 VanDerWaalsContact N-O 3.09Å; H275-F286 PolarHBondContact O-N 3.01Å; R284-F286 HydrophobicContact CB-CE2 3.78Å; R284-F286 HydrophobicContact CB-CZ 3.79Å; F286-R288 VanDerWaalsContact C-N 3.35Å; F286-E291 HydrophobicContact CB-CB 3.99Å; F286-E291 HydrophobicContact CD1-CB 3.68Å; F286-E291 HydrophobicContact CG-CB 4.07Å; F286-L292 HydrophobicContact CB-CB 4.27Å; F286-L292 HydrophobicContact CD2-CB 3.86Å; F286-L292 HydrophobicContact CD2-CD1 3.84Å; F286-L292 HydrophobicContact CD2-CG 4.46Å; F286-L292 HydrophobicContact CE2-CD1 4.04Å; F286-L292 HydrophobicContact CG-CB 4.24Å; F286-H295 HydrophobicContact CE1-CB 3.9Å; F286-H295 HydrophobicContact CE2-CB 3.71Å; F286-H295 AromaticContact CE2-CD2 3.23Å; F286-H295 WeakPolarHBondContact CE2-CD2 3.5Å; F286-H295 AromaticContact CE2-CG 3.51Å; F286-H295 AromaticContact CE2-NE2 3.98Å; F286-H295 HydrophobicContact CZ-CB 3.3Å; F286-H295 AromaticContact CZ-CD2 3.4Å; F286-H295 VanDerWaalsContact CZ-CD2 3.4Å; F286-H295 WeakPolarHBondContact CZ-CD2 3.48Å; F286-H295 AromaticContact CZ-CG 3.18Å; F286-H295 AromaticContact CZ-ND1 3.79Å |
| 287 | S | 88.7 | Confident | 87.1 | Confident | 45 Ų | 45 | 56.6 Ų | 56.6 | 32% | 0.315 | 30% | 0.297 | S | S | . | . | S | Bend | trans | -78 | -25 | 175.9 | 48.5 | 0 | 0 | 0 | 0 | 111.9 | E272 | E272-S287 WeakPolarHBondContact O-CA 3.33Å; E272-S287 WeakPolarHBondContact O-CB 3.39Å |
| 288 | R | 86.3 | Confident | 86.9 | Confident | 111 Ų | 111 | 61.3 Ų | 61.3 | 42% | 0.419 | 32% | 0.32 | S | S | . | . | S | Bend | trans | -125.6 | 146.8 | -178.4 | -62.9 | 168.4 | 49.3 | 153.5 | 1.1 | 112.5 | F286 D290 E291 L292 | F286-R288 VanDerWaalsContact C-N 3.35Å; R288-D290 VanDerWaalsContact C-N 3.33Å; R288-D290 VanDerWaalsContact CB-OD1 3.25Å; R288-D290 WeakPolarHBondContact CB-OD1 3.49Å; R288-D290 IonicContact CZ-OD1 2.76Å; R288-D290 VanDerWaalsContact CZ-OD1 3.25Å; R288-D290 IonicContact NE-OD1 2.83Å; R288-D290 PolarHBondContact NE-OD1 3.29Å; R288-D290 IonicContact NH2-OD1 3.15Å; R288-D290 PolarHBondContact NH2-OD1 3.16Å; R288-D290 IonicContact NH2-OD2 2.71Å; R288-D290 PolarHBondContact O-N 2.78Å; R288-E291 HydrophobicContact CB-CG 4.16Å; R288-E291 PolarHBondContact O-N 2.79Å; R288-L292 PolarHBondContact O-N 3.21Å |
| 289 | S | 85.9 | Confident | 86.8 | Confident | 68 Ų | 68 | 63.3 Ų | 63.3 | 48% | 0.476 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -65.2 | -32.6 | 179.1 | 60.7 | 0 | 0 | 0 | 0 | 113 | H275 E291 L292 T293 | H275-S289 PolarHBondContact CD2-N 3.04Å; H275-S289 VanDerWaalsContact CD2-N 3.26Å; H275-S289 PolarHBondContact NE2-N 3.42Å; S289-E291 VanDerWaalsContact C-N 3.34Å; S289-L292 PolarHBondContact O-N 3.31Å; S289-T293 WeakPolarHBondContact O-CB 3.43Å; S289-T293 PolarHBondContact O-N 2.85Å; S289-T293 PolarHBondContact O-OG1 2.84Å |
| 290 | D | 84.9 | Confident | 86.8 | Confident | 48 Ų | 48 | 64.6 Ų | 64.6 | 26% | 0.257 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -69.6 | -32.1 | 177.5 | 71.2 | -81.5 | 0 | 0 | 0 | 112.4 | R288 T293 R294 | R288-D290 VanDerWaalsContact C-N 3.33Å; R288-D290 VanDerWaalsContact CB-OD1 3.25Å; R288-D290 WeakPolarHBondContact CB-OD1 3.49Å; R288-D290 IonicContact CZ-OD1 2.76Å; R288-D290 VanDerWaalsContact CZ-OD1 3.25Å; R288-D290 IonicContact NE-OD1 2.83Å; R288-D290 PolarHBondContact NE-OD1 3.29Å; R288-D290 IonicContact NH2-OD1 3.15Å; R288-D290 PolarHBondContact NH2-OD1 3.16Å; R288-D290 IonicContact NH2-OD2 2.71Å; R288-D290 PolarHBondContact O-N 2.78Å; D290-T293 PolarHBondContact O-N 3.11Å; D290-R294 VanDerWaalsContact O-CB 3.26Å; D290-R294 WeakPolarHBondContact O-CB 3.34Å; D290-R294 PolarHBondContact O-N 3.4Å; D290-R294 IonicContact OD2-NH2 2.74Å; D290-R294 PolarHBondContact OD2-NH2 3.39Å |
| 291 | E | 87.7 | Confident | 86.8 | Confident | 58 Ų | 58 | 59 Ų | 59 | 27% | 0.271 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -69.1 | -43.7 | 173.8 | -66.2 | -177.4 | 171.2 | 0 | 0 | 111.2 | F286 R288 S289 R294 H295 | F286-E291 HydrophobicContact CB-CB 3.99Å; F286-E291 HydrophobicContact CD1-CB 3.68Å; F286-E291 HydrophobicContact CG-CB 4.07Å; R288-E291 HydrophobicContact CB-CG 4.16Å; R288-E291 PolarHBondContact O-N 2.79Å; S289-E291 VanDerWaalsContact C-N 3.34Å; E291-R294 PolarHBondContact O-N 3.03Å; E291-H295 VanDerWaalsContact O-CB 3.3Å; E291-H295 WeakPolarHBondContact O-CB 3.42Å; E291-H295 PolarHBondContact O-N 2.93Å |
| 292 | L | 88.4 | Confident | 86.6 | Confident | 15 Ų | 15 | 59 Ų | 59 | 8% | 0.079 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.2 | -50.3 | 171.9 | 172.8 | 61.2 | 0 | 0 | 0 | 110.1 | H275 A276 C277 F286 R288 S289 R294 H295 L296 | H275-L292 HydrophobicContact CB-CB 3.97Å; H275-L292 HydrophobicContact CB-CD2 3.82Å; H275-L292 HydrophobicContact CB-CG 4.47Å; A276-L292 WeakPolarHBondContact O-CD2 3.21Å; C277-L292 HydrophobicContact CB-CD1 4.31Å; F286-L292 HydrophobicContact CB-CB 4.27Å; F286-L292 HydrophobicContact CD2-CB 3.86Å; F286-L292 HydrophobicContact CD2-CD1 3.84Å; F286-L292 HydrophobicContact CD2-CG 4.46Å; F286-L292 HydrophobicContact CE2-CD1 4.04Å; F286-L292 HydrophobicContact CG-CB 4.24Å; R288-L292 PolarHBondContact O-N 3.21Å; S289-L292 PolarHBondContact O-N 3.31Å; L292-R294 VanDerWaalsContact C-N 3.27Å; L292-R294 PolarHBondContact O-N 3.29Å; L292-H295 CarbonylContact O-C 3.29Å; L292-H295 WeakPolarHBondContact O-CA 3.32Å; L292-H295 WeakPolarHBondContact O-CB 3.45Å; L292-H295 PolarHBondContact O-N 2.78Å; L292-L296 HydrophobicContact CD1-CD1 4.22Å; L292-L296 HydrophobicContact CD1-CD2 4.17Å; L292-L296 HydrophobicContact CD1-CG 3.98Å; L292-L296 HydrophobicContact CG-CD1 4.08Å; L292-L296 HydrophobicContact CG-CG 4.28Å; L292-L296 VanDerWaalsContact O-CG 3.29Å; L292-L296 WeakPolarHBondContact O-CG 3.39Å; L292-L296 PolarHBondContact O-N 2.97Å |
| 293 | T | 86.8 | Confident | 86.7 | Confident | 34 Ų | 34 | 60.7 Ų | 60.7 | 21% | 0.209 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -57 | -41.2 | 179.7 | -58.5 | 0 | 0 | 0 | 0 | 112 | P227 S289 D290 L296 | P227-T293 HydrophobicContact CG-CG2 4.27Å; S289-T293 WeakPolarHBondContact O-CB 3.43Å; S289-T293 PolarHBondContact O-N 2.85Å; S289-T293 PolarHBondContact O-OG1 2.84Å; D290-T293 PolarHBondContact O-N 3.11Å; T293-L296 PolarHBondContact O-N 3.16Å |
| 294 | R | 85.9 | Confident | 86.6 | Confident | 82 Ų | 82 | 56.3 Ų | 56.3 | 31% | 0.309 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -68.2 | -39.4 | 175.3 | -168.2 | -169.3 | -40.8 | 157.7 | 10.8 | 112 | D290 E291 L292 L296 R297 R316 | D290-R294 VanDerWaalsContact O-CB 3.26Å; D290-R294 WeakPolarHBondContact O-CB 3.34Å; D290-R294 PolarHBondContact O-N 3.4Å; D290-R294 IonicContact OD2-NH2 2.74Å; D290-R294 PolarHBondContact OD2-NH2 3.39Å; E291-R294 PolarHBondContact O-N 3.03Å; L292-R294 VanDerWaalsContact C-N 3.27Å; L292-R294 PolarHBondContact O-N 3.29Å; R294-L296 VanDerWaalsContact C-N 3.35Å; R294-R297 WeakPolarHBondContact O-CB 3.46Å; R294-R297 PolarHBondContact O-N 3.15Å; R294-R316 HydrophobicContact CG-CG 4.02Å |
| 295 | H | 88.7 | Confident | 86.7 | Confident | 13 Ų | 13 | 55 Ų | 55 | 6% | 0.06 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -64.3 | -39.9 | 175.4 | 168.3 | 60.9 | 0 | 0 | 0 | 112 | C277 C282 F286 E291 L292 R297 I298 H299 | C277-H295 VanDerWaalsContact SG-CD2 3.55Å; C277-H295 PolarHBondContact SG-NE2 2.94Å; C282-H295 VanDerWaalsContact SG-CE1 3.59Å; C282-H295 PolarHBondContact SG-NE2 3.13Å; F286-H295 HydrophobicContact CE1-CB 3.9Å; F286-H295 HydrophobicContact CE2-CB 3.71Å; F286-H295 AromaticContact CE2-CD2 3.23Å; F286-H295 WeakPolarHBondContact CE2-CD2 3.5Å; F286-H295 AromaticContact CE2-CG 3.51Å; F286-H295 AromaticContact CE2-NE2 3.98Å; F286-H295 HydrophobicContact CZ-CB 3.3Å; F286-H295 AromaticContact CZ-CD2 3.4Å; F286-H295 VanDerWaalsContact CZ-CD2 3.4Å; F286-H295 WeakPolarHBondContact CZ-CD2 3.48Å; F286-H295 AromaticContact CZ-CG 3.18Å; F286-H295 AromaticContact CZ-ND1 3.79Å; E291-H295 VanDerWaalsContact O-CB 3.3Å; E291-H295 WeakPolarHBondContact O-CB 3.42Å; E291-H295 PolarHBondContact O-N 2.93Å; L292-H295 CarbonylContact O-C 3.29Å; L292-H295 WeakPolarHBondContact O-CA 3.32Å; L292-H295 WeakPolarHBondContact O-CB 3.45Å; L292-H295 PolarHBondContact O-N 2.78Å; H295-R297 PolarHBondContact O-N 2.89Å; H295-R297 VanDerWaalsContact O-N 3.16Å; H295-I298 WeakPolarHBondContact O-CB 3.44Å; H295-I298 WeakPolarHBondContact O-CG1 3.36Å; H295-I298 PolarHBondContact O-N 3.43Å; H295-H299 AromaticContact CE1-NE2 3.51Å; H295-H299 AromaticContact NE2-CD2 3.89Å; H295-H299 AromaticContact NE2-NE2 3.33Å; H295-H299 PolarHBondContact NE2-NE2 2.89Å |
| 296 | L | 87.5 | Confident | 86.7 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -59.6 | -27.1 | 178.2 | -71.9 | 175.2 | 0 | 0 | 0 | 113.1 | P227 L228 I231 P278 L292 T293 R294 I298 H299 T300 | P227-L296 HydrophobicContact CB-CB 3.85Å; L228-L296 HydrophobicContact CB-CD1 4.16Å; L228-L296 HydrophobicContact CD1-CD1 3.59Å; L228-L296 HydrophobicContact CG-CD1 4.5Å; I231-L296 HydrophobicContact CD1-CB 3.59Å; I231-L296 HydrophobicContact CD1-CD1 4Å; I231-L296 HydrophobicContact CD1-CD2 3.24Å; I231-L296 HydrophobicContact CD1-CG 3.74Å; P278-L296 HydrophobicContact CG-CD2 3.91Å; L292-L296 HydrophobicContact CD1-CD1 4.22Å; L292-L296 HydrophobicContact CD1-CD2 4.17Å; L292-L296 HydrophobicContact CD1-CG 3.98Å; L292-L296 HydrophobicContact CG-CD1 4.08Å; L292-L296 HydrophobicContact CG-CG 4.28Å; L292-L296 VanDerWaalsContact O-CG 3.29Å; L292-L296 WeakPolarHBondContact O-CG 3.39Å; L292-L296 PolarHBondContact O-N 2.97Å; T293-L296 PolarHBondContact O-N 3.16Å; R294-L296 VanDerWaalsContact C-N 3.35Å; L296-I298 PolarHBondContact O-N 3.49Å; L296-I298 VanDerWaalsContact O-N 3.15Å; L296-H299 PolarHBondContact O-N 2.7Å; L296-T300 PolarHBondContact O-N 3.29Å; L296-T300 PolarHBondContact O-OG1 3.01Å |
| 297 | R | 87.3 | Confident | 86.8 | Confident | 35 Ų | 35 | 53.2 Ų | 53.2 | 13% | 0.132 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -59.4 | -23.3 | 171.9 | -61 | 179.6 | -170.6 | 173.6 | 0.5 | 113.4 | P227 R294 H295 T300 G301 H302 S315 | P227-R297 HydrophobicContact CB-CG 4.35Å; P227-R297 HydrophobicContact CG-CG 3.53Å; R294-R297 WeakPolarHBondContact O-CB 3.46Å; R294-R297 PolarHBondContact O-N 3.15Å; H295-R297 PolarHBondContact O-N 2.89Å; H295-R297 VanDerWaalsContact O-N 3.16Å; R297-T300 WeakPolarHBondContact CA-OG1 3.49Å; R297-G301 CarbonylContact O-C 3.44Å; R297-G301 WeakPolarHBondContact O-CA 3.35Å; R297-G301 PolarHBondContact O-N 3.21Å; R297-H302 PolarHBondContact O-N 2.86Å; R297-S315 WeakPolarHBondContact CD-O 3.49Å; R297-S315 PolarHBondContact NH1-O 3.19Å |
| 298 | I | 86.8 | Confident | 86.9 | Confident | 113 Ų | 113 | 60.1 Ų | 60.1 | 58% | 0.579 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -72.2 | -37.7 | 176 | -56.8 | 174.3 | 0 | 0 | 0 | 110 | H295 L296 | H295-I298 WeakPolarHBondContact O-CB 3.44Å; H295-I298 WeakPolarHBondContact O-CG1 3.36Å; H295-I298 PolarHBondContact O-N 3.43Å; L296-I298 PolarHBondContact O-N 3.49Å; L296-I298 VanDerWaalsContact O-N 3.15Å |
| 299 | H | 86.3 | Confident | 87.1 | Confident | 81 Ų | 81 | 60 Ų | 60 | 38% | 0.375 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -75 | -40.6 | 177.9 | -67 | -66.3 | 0 | 0 | 0 | 112.1 | C277 A279 H295 L296 G301 | C277-H299 PolarHBondContact SG-NE2 3.34Å; C277-H299 VanDerWaalsContact SG-NE2 3.4Å; A279-H299 HydrophobicContact CB-CB 4.5Å; H295-H299 AromaticContact CE1-NE2 3.51Å; H295-H299 AromaticContact NE2-CD2 3.89Å; H295-H299 AromaticContact NE2-NE2 3.33Å; H295-H299 PolarHBondContact NE2-NE2 2.89Å; L296-H299 PolarHBondContact O-N 2.7Å; H299-G301 VanDerWaalsContact C-N 3.34Å |
| 300 | T | 84.4 | Confident | 87.3 | Confident | 46 Ų | 46 | 59.6 Ų | 59.6 | 28% | 0.282 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -81.7 | -12.7 | 179.7 | 59.8 | 0 | 0 | 0 | 0 | 113.8 | T230 I231 L296 R297 H302 | T230-T300 HydrophobicContact CG2-CG2 4.37Å; I231-T300 HydrophobicContact CD1-CG2 3.86Å; I231-T300 HydrophobicContact CG1-CG2 3.53Å; L296-T300 PolarHBondContact O-N 3.29Å; L296-T300 PolarHBondContact O-OG1 3.01Å; R297-T300 WeakPolarHBondContact CA-OG1 3.49Å; T300-H302 PolarHBondContact O-N 2.99Å; T300-H302 WeakPolarHBondContact OG1-CB 3.36Å; T300-H302 PolarHBondContact OG1-N 2.87Å |
| 301 | G | 84.6 | Confident | 87.6 | Confident | 47 Ų | 47 | 62.7 Ų | 62.7 | 49% | 0.485 | 31% | 0.313 | S | S | . | . | trans | 67.2 | 8.9 | -169.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | R297 H299 K303 | R297-G301 CarbonylContact O-C 3.44Å; R297-G301 WeakPolarHBondContact O-CA 3.35Å; R297-G301 PolarHBondContact O-N 3.21Å; H299-G301 VanDerWaalsContact C-N 3.34Å; G301-K303 WeakPolarHBondContact O-CG 3.34Å; G301-K303 PolarHBondContact O-N 2.86Å | ||
| 302 | H | 82.1 | Confident | 87.6 | Confident | 70 Ų | 70 | 65.7 Ų | 65.7 | 32% | 0.324 | 32% | 0.322 | S | S | . | . | trans | -67.4 | 119.2 | -174.5 | -174.4 | -117.7 | 0 | 0 | 0 | 112 | R297 T300 | R297-H302 PolarHBondContact O-N 2.86Å; T300-H302 PolarHBondContact O-N 2.99Å; T300-H302 WeakPolarHBondContact OG1-CB 3.36Å; T300-H302 PolarHBondContact OG1-N 2.87Å | ||
| 303 | K | 87.2 | Confident | 87.6 | Confident | 58 Ų | 58 | 66.8 Ų | 66.8 | 25% | 0.252 | 33% | 0.331 | S | S | . | . | trans | -125.4 | 82.1 | -175.4 | -71.3 | 169.8 | 173.4 | -160.1 | 0 | 110.5 | S95 G301 F305 S313 F314 | S95-K303 PolarHBondContact O-NZ 3.02Å; S95-K303 PolarHBondContact OG-NZ 3.37Å; G301-K303 WeakPolarHBondContact O-CG 3.34Å; G301-K303 PolarHBondContact O-N 2.86Å; K303-F305 VanDerWaalsContact C-N 3.26Å; K303-F305 PolarHBondContact O-N 3.43Å; K303-S313 WeakPolarHBondContact CD-O 3.44Å; K303-F314 CarbonylContact C-O 3.48Å; K303-F314 VanDerWaalsContact C-O 3.25Å; K303-F314 WeakPolarHBondContact CA-O 3.38Å | ||
| 304 | P | 86.2 | Confident | 87.6 | Confident | 53 Ų | 53 | 66.7 Ų | 66.7 | 34% | 0.344 | 33% | 0.328 | S | S | . | . | trans | -72.5 | -15.3 | -172.2 | 27.1 | -33.2 | 0 | 0 | 0 | 114.2 | ||||
| 305 | F | 88 | Confident | 87.6 | Confident | 44 Ų | 44 | 64.4 Ų | 64.4 | 19% | 0.193 | 32% | 0.324 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.4 | 107 | -173.5 | -58.8 | -74.9 | 0 | 0 | 0 | 111 | K303 S313 F314 R316 S317 L320 | K303-F305 VanDerWaalsContact C-N 3.26Å; K303-F305 PolarHBondContact O-N 3.43Å; F305-S313 CarbonylContact O-C 3.6Å; F305-S313 WeakPolarHBondContact O-CA 3.07Å; F305-F314 HydrophobicContact CB-CB 4.26Å; F305-F314 WeakPolarHBondContact CB-O 3.48Å; F305-F314 PolarHBondContact N-O 2.87Å; F305-F314 PolarHBondContact O-N 3.29Å; F305-R316 VanDerWaalsContact CD2-CA 3.49Å; F305-S317 VanDerWaalsContact CD2-N 3.31Å; F305-S317 VanDerWaalsContact CE2-N 3.28Å; F305-L320 HydrophobicContact CB-CB 4.01Å; F305-L320 HydrophobicContact CB-CD2 3.82Å |
| 306 | Q | 89.8 | Confident | 87.5 | Confident | 94 Ų | 94 | 67.5 Ų | 67.5 | 44% | 0.439 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 135 | -178.9 | -167.5 | 171 | 32 | 0 | 0 | 112.2 | M311 | Q306-M311 WeakPolarHBondContact CG-O 3.45Å; Q306-M311 PolarHBondContact NE2-O 2.71Å |
| 307 | C | 90.2 | Very high | 87.5 | Confident | 2 Ų | 2 | 70.5 Ų | 70.5 | 1% | 0.014 | 36% | 0.356 | C | S | . | . | trans | -73.5 | 124 | 169.4 | -176.6 | 0 | 0 | 0 | 0 | 109.8 | I309 M311 R312 F314 L320 H327 | C307-I309 PolarHBondContact O-N 3.29Å; C307-I309 PolarHBondContact SG-N 3.05Å; C307-M311 WeakPolarHBondContact O-CA 3.34Å; C307-M311 PolarHBondContact O-N 3.38Å; C307-R312 PolarHBondContact N-O 2.76Å; C307-F314 HydrophobicContact CB-CE2 4.34Å; C307-L320 HydrophobicContact CB-CD1 3.72Å; C307-H327 PolarHBondContact SG-NE2 3.07Å | ||
| 308 | R | 91 | Very high | 87.5 | Confident | 190 Ų | 190 | 71.8 Ų | 71.8 | 72% | 0.717 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.3 | -13.9 | 178.1 | -62.5 | -174.5 | -177.1 | 179.3 | 1.9 | 114.1 | ||
| 309 | I | 88.7 | Confident | 87.6 | Confident | 110 Ų | 110 | 70 Ų | 70 | 56% | 0.564 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | -47.2 | -178.1 | -58.2 | 172.3 | 0 | 0 | 0 | 110.7 | C307 H327 | C307-I309 PolarHBondContact O-N 3.29Å; C307-I309 PolarHBondContact SG-N 3.05Å; I309-H327 HydrophobicContact CD1-CB 3.53Å; I309-H327 HydrophobicContact CG2-CB 4.45Å |
| 310 | C | 91.5 | Very high | 87.9 | Confident | 59 Ų | 59 | 67.3 Ų | 67.3 | 40% | 0.399 | 34% | 0.343 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -119.2 | 7 | -177.7 | 68.9 | 0 | 0 | 0 | 0 | 114.2 | R312 H323 | C310-R312 PolarHBondContact O-N 3.27Å; C310-R312 VanDerWaalsContact SG-CB 3.58Å; C310-H323 PolarHBondContact SG-NE2 2.82Å |
| 311 | M | 90.4 | Very high | 88.1 | Confident | 112 Ų | 112 | 68.6 Ų | 68.6 | 55% | 0.552 | 35% | 0.351 | S | S | * | . | trans | 59.6 | 12.2 | 179.3 | -56.9 | -55.3 | -77.9 | 0 | 0 | 115.5 | Q306 C307 | Q306-M311 WeakPolarHBondContact CG-O 3.45Å; Q306-M311 PolarHBondContact NE2-O 2.71Å; C307-M311 WeakPolarHBondContact O-CA 3.34Å; C307-M311 PolarHBondContact O-N 3.38Å | ||
| 312 | R | 87.7 | Confident | 88.3 | Confident | 122 Ų | 122 | 68 Ų | 68 | 46% | 0.46 | 34% | 0.338 | S | S | . | . | trans | -72.6 | 130.4 | 177.2 | -169.7 | 169.7 | -177.9 | 166.1 | 1.6 | 111.3 | C307 C310 F314 | C307-R312 PolarHBondContact N-O 2.76Å; C310-R312 PolarHBondContact O-N 3.27Å; C310-R312 VanDerWaalsContact SG-CB 3.58Å; R312-F314 HydrophobicContact CB-CE2 4.06Å; R312-F314 HydrophobicContact CB-CZ 4.28Å; R312-F314 HydrophobicContact CG-CE2 3.99Å; R312-F314 HydrophobicContact CG-CZ 3.86Å; R312-F314 WeakPolarHBondContact O-CD2 3.49Å; R312-F314 VanDerWaalsContact O-CE2 3.29Å; R312-F314 WeakPolarHBondContact O-CE2 3.32Å | ||
| 313 | S | 88.3 | Confident | 88.7 | Confident | 38 Ų | 38 | 65.9 Ų | 65.9 | 27% | 0.266 | 33% | 0.328 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.6 | 144.1 | -179.7 | -50.8 | 0 | 0 | 0 | 0 | 113 | K303 F305 | K303-S313 WeakPolarHBondContact CD-O 3.44Å; F305-S313 CarbonylContact O-C 3.6Å; F305-S313 WeakPolarHBondContact O-CA 3.07Å |
| 314 | F | 87 | Confident | 88.9 | Confident | 31 Ų | 31 | 65.2 Ų | 65.2 | 14% | 0.136 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.7 | 146.8 | -176.7 | -60.8 | -89.2 | 0 | 0 | 0 | 110.5 | K303 F305 C307 R312 R316 H319 L320 H323 | K303-F314 CarbonylContact C-O 3.48Å; K303-F314 VanDerWaalsContact C-O 3.25Å; K303-F314 WeakPolarHBondContact CA-O 3.38Å; F305-F314 HydrophobicContact CB-CB 4.26Å; F305-F314 WeakPolarHBondContact CB-O 3.48Å; F305-F314 PolarHBondContact N-O 2.87Å; F305-F314 PolarHBondContact O-N 3.29Å; C307-F314 HydrophobicContact CB-CE2 4.34Å; R312-F314 HydrophobicContact CB-CE2 4.06Å; R312-F314 HydrophobicContact CB-CZ 4.28Å; R312-F314 HydrophobicContact CG-CE2 3.99Å; R312-F314 HydrophobicContact CG-CZ 3.86Å; R312-F314 WeakPolarHBondContact O-CD2 3.49Å; R312-F314 VanDerWaalsContact O-CE2 3.29Å; R312-F314 WeakPolarHBondContact O-CE2 3.32Å; F314-R316 VanDerWaalsContact C-N 3.32Å; F314-H319 HydrophobicContact CB-CB 4.32Å; F314-H319 HydrophobicContact CD1-CB 3.98Å; F314-H319 HydrophobicContact CG-CB 4.43Å; F314-L320 HydrophobicContact CB-CB 4.35Å; F314-L320 HydrophobicContact CD2-CB 4.03Å; F314-L320 HydrophobicContact CD2-CD1 3.81Å; F314-L320 HydrophobicContact CE2-CD1 4Å; F314-L320 HydrophobicContact CG-CB 4.33Å; F314-H323 HydrophobicContact CE1-CB 3.96Å; F314-H323 HydrophobicContact CE2-CB 3.92Å; F314-H323 AromaticContact CE2-CD2 3.32Å; F314-H323 WeakPolarHBondContact CE2-CD2 3.41Å; F314-H323 AromaticContact CE2-CG 3.63Å; F314-H323 HydrophobicContact CZ-CB 3.45Å; F314-H323 VanDerWaalsContact CZ-CB 3.45Å; F314-H323 AromaticContact CZ-CD2 3.39Å; F314-H323 WeakPolarHBondContact CZ-CD2 3.24Å; F314-H323 AromaticContact CZ-CG 3.2Å; F314-H323 AromaticContact CZ-ND1 3.77Å; F314-H323 AromaticContact CZ-NE2 3.98Å |
| 315 | S | 86.8 | Confident | 89.1 | Confident | 34 Ų | 34 | 65.2 Ų | 65.2 | 24% | 0.238 | 32% | 0.32 | C | S | . | . | S | Bend | trans | -79.8 | -14.8 | 178.5 | 58 | 0 | 0 | 0 | 0 | 113.5 | R297 | R297-S315 WeakPolarHBondContact CD-O 3.49Å; R297-S315 PolarHBondContact NH1-O 3.19Å |
| 316 | R | 85.9 | Confident | 89.2 | Confident | 79 Ų | 79 | 67.7 Ų | 67.7 | 30% | 0.298 | 34% | 0.339 | S | S | . | . | S | Bend | trans | -137.6 | 146.9 | -178.3 | -58.8 | 170.1 | 45.3 | 161.5 | -0.5 | 111.8 | R294 F305 F314 D318 H319 L320 | R294-R316 HydrophobicContact CG-CG 4.02Å; F305-R316 VanDerWaalsContact CD2-CA 3.49Å; F314-R316 VanDerWaalsContact C-N 3.32Å; R316-D318 WeakPolarHBondContact CB-OD1 3.33Å; R316-D318 IonicContact CZ-OD1 3.25Å; R316-D318 IonicContact CZ-OD2 2.9Å; R316-D318 IonicContact NE-OD1 2.9Å; R316-D318 PolarHBondContact NE-OD1 3.14Å; R316-D318 IonicContact NE-OD2 3.49Å; R316-D318 VanDerWaalsContact NH2-CG 3.32Å; R316-D318 IonicContact NH2-OD1 3.59Å; R316-D318 PolarHBondContact NH2-OD1 2.9Å; R316-D318 IonicContact NH2-OD2 2.87Å; R316-D318 PolarHBondContact NH2-OD2 3.3Å; R316-H319 HydrophobicContact CB-CB 4.48Å; R316-H319 WeakPolarHBondContact CD-NE2 3.22Å; R316-H319 PolarHBondContact O-N 3.2Å; R316-L320 PolarHBondContact O-N 3.23Å |
| 317 | S | 87.5 | Confident | 89.2 | Confident | 62 Ų | 62 | 66.7 Ų | 66.7 | 43% | 0.434 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -67.8 | -41.4 | -178.5 | 51.3 | 0 | 0 | 0 | 0 | 112.2 | F305 H319 L320 T321 | F305-S317 VanDerWaalsContact CD2-N 3.31Å; F305-S317 VanDerWaalsContact CE2-N 3.28Å; S317-H319 PolarHBondContact O-N 3.43Å; S317-L320 CarbonylContact O-C 3.55Å; S317-L320 WeakPolarHBondContact O-CA 3.38Å; S317-L320 WeakPolarHBondContact O-CB 3.49Å; S317-L320 PolarHBondContact O-N 3.41Å; S317-T321 PolarHBondContact O-N 2.9Å; S317-T321 PolarHBondContact O-OG1 3.35Å |
| 318 | D | 87.5 | Confident | 89.2 | Confident | 62 Ų | 62 | 69.9 Ų | 69.9 | 33% | 0.332 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -59.9 | -36.5 | 177.8 | 62.8 | -52.4 | 0 | 0 | 0 | 111.9 | R316 T321 T322 | R316-D318 WeakPolarHBondContact CB-OD1 3.33Å; R316-D318 IonicContact CZ-OD1 3.25Å; R316-D318 IonicContact CZ-OD2 2.9Å; R316-D318 IonicContact NE-OD1 2.9Å; R316-D318 PolarHBondContact NE-OD1 3.14Å; R316-D318 IonicContact NE-OD2 3.49Å; R316-D318 VanDerWaalsContact NH2-CG 3.32Å; R316-D318 IonicContact NH2-OD1 3.59Å; R316-D318 PolarHBondContact NH2-OD1 2.9Å; R316-D318 IonicContact NH2-OD2 2.87Å; R316-D318 PolarHBondContact NH2-OD2 3.3Å; D318-T321 PolarHBondContact O-N 3.03Å; D318-T322 WeakPolarHBondContact O-CG2 3.4Å; D318-T322 PolarHBondContact O-N 2.95Å; D318-T322 PolarHBondContact O-OG1 2.69Å |
| 319 | H | 89.7 | Confident | 89 | Confident | 75 Ų | 75 | 63.2 Ų | 63.2 | 35% | 0.347 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -65.7 | -43.7 | 173.5 | -63.1 | -14.1 | 0 | 0 | 0 | 111.7 | F314 R316 S317 T322 H323 | F314-H319 HydrophobicContact CB-CB 4.32Å; F314-H319 HydrophobicContact CD1-CB 3.98Å; F314-H319 HydrophobicContact CG-CB 4.43Å; R316-H319 HydrophobicContact CB-CB 4.48Å; R316-H319 WeakPolarHBondContact CD-NE2 3.22Å; R316-H319 PolarHBondContact O-N 3.2Å; S317-H319 PolarHBondContact O-N 3.43Å; H319-T322 PolarHBondContact O-N 3.09Å; H319-T322 PolarHBondContact O-OG1 2.78Å; H319-H323 VanDerWaalsContact O-CB 3.29Å; H319-H323 WeakPolarHBondContact O-CB 3.26Å; H319-H323 PolarHBondContact O-N 2.89Å |
| 320 | L | 90.6 | Very high | 89.1 | Confident | 25 Ų | 25 | 63.3 Ų | 63.3 | 13% | 0.131 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -60.1 | -45.9 | 173.3 | 173.9 | 62.1 | 0 | 0 | 0 | 111.3 | F305 C307 F314 R316 S317 T322 H323 I324 | F305-L320 HydrophobicContact CB-CB 4.01Å; F305-L320 HydrophobicContact CB-CD2 3.82Å; C307-L320 HydrophobicContact CB-CD1 3.72Å; F314-L320 HydrophobicContact CB-CB 4.35Å; F314-L320 HydrophobicContact CD2-CB 4.03Å; F314-L320 HydrophobicContact CD2-CD1 3.81Å; F314-L320 HydrophobicContact CE2-CD1 4Å; F314-L320 HydrophobicContact CG-CB 4.33Å; R316-L320 PolarHBondContact O-N 3.23Å; S317-L320 CarbonylContact O-C 3.55Å; S317-L320 WeakPolarHBondContact O-CA 3.38Å; S317-L320 WeakPolarHBondContact O-CB 3.49Å; S317-L320 PolarHBondContact O-N 3.41Å; L320-T322 PolarHBondContact O-N 3.38Å; L320-H323 CarbonylContact O-C 3.31Å; L320-H323 WeakPolarHBondContact O-CB 3.33Å; L320-H323 PolarHBondContact O-N 3.15Å; L320-H323 VanDerWaalsContact O-N 3.12Å; L320-I324 HydrophobicContact CD1-CD1 3.98Å; L320-I324 HydrophobicContact CD1-CG1 4.04Å; L320-I324 HydrophobicContact CG-CD1 3.89Å; L320-I324 HydrophobicContact CG-CG1 4.39Å; L320-I324 WeakPolarHBondContact O-CG1 3.25Å; L320-I324 PolarHBondContact O-N 3.02Å |
| 321 | T | 89.9 | Confident | 89 | Confident | 73 Ų | 73 | 65.4 Ų | 65.4 | 45% | 0.448 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -59.8 | -47 | 177.6 | -54.3 | 0 | 0 | 0 | 0 | 111.5 | S317 D318 H323 I324 R325 | S317-T321 PolarHBondContact O-N 2.9Å; S317-T321 PolarHBondContact O-OG1 3.35Å; D318-T321 PolarHBondContact O-N 3.03Å; T321-H323 PolarHBondContact O-N 3.37Å; T321-I324 PolarHBondContact O-N 3.19Å; T321-R325 PolarHBondContact O-N 2.95Å |
| 322 | T | 89.4 | Confident | 89 | Confident | 36 Ų | 36 | 63.7 Ų | 63.7 | 22% | 0.221 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -65.3 | -30.3 | 176.6 | 58.9 | 0 | 0 | 0 | 0 | 112.7 | D318 H319 L320 R344 | D318-T322 WeakPolarHBondContact O-CG2 3.4Å; D318-T322 PolarHBondContact O-N 2.95Å; D318-T322 PolarHBondContact O-OG1 2.69Å; H319-T322 PolarHBondContact O-N 3.09Å; H319-T322 PolarHBondContact O-OG1 2.78Å; L320-T322 PolarHBondContact O-N 3.38Å; T322-R344 HydrophobicContact CG2-CG 3.79Å |
| 323 | H | 90.3 | Very high | 89.1 | Confident | 24 Ų | 24 | 60.9 Ų | 60.9 | 11% | 0.111 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -72 | -40.1 | 173.9 | 171 | 62.7 | 0 | 0 | 0 | 111.9 | C310 F314 H319 L320 T321 R325 T326 H327 | C310-H323 PolarHBondContact SG-NE2 2.82Å; F314-H323 HydrophobicContact CE1-CB 3.96Å; F314-H323 HydrophobicContact CE2-CB 3.92Å; F314-H323 AromaticContact CE2-CD2 3.32Å; F314-H323 WeakPolarHBondContact CE2-CD2 3.41Å; F314-H323 AromaticContact CE2-CG 3.63Å; F314-H323 HydrophobicContact CZ-CB 3.45Å; F314-H323 VanDerWaalsContact CZ-CB 3.45Å; F314-H323 AromaticContact CZ-CD2 3.39Å; F314-H323 WeakPolarHBondContact CZ-CD2 3.24Å; F314-H323 AromaticContact CZ-CG 3.2Å; F314-H323 AromaticContact CZ-ND1 3.77Å; F314-H323 AromaticContact CZ-NE2 3.98Å; H319-H323 VanDerWaalsContact O-CB 3.29Å; H319-H323 WeakPolarHBondContact O-CB 3.26Å; H319-H323 PolarHBondContact O-N 2.89Å; L320-H323 CarbonylContact O-C 3.31Å; L320-H323 WeakPolarHBondContact O-CB 3.33Å; L320-H323 PolarHBondContact O-N 3.15Å; L320-H323 VanDerWaalsContact O-N 3.12Å; T321-H323 PolarHBondContact O-N 3.37Å; H323-R325 PolarHBondContact O-N 2.85Å; H323-T326 WeakPolarHBondContact O-CB 3.34Å; H323-T326 PolarHBondContact O-N 2.9Å; H323-T326 PolarHBondContact O-OG1 3.3Å; H323-H327 AromaticContact CE1-NE2 3.45Å; H323-H327 PolarHBondContact CE1-NE2 3.49Å; H323-H327 AromaticContact NE2-CD2 3.84Å; H323-H327 AromaticContact NE2-NE2 3.13Å; H323-H327 PolarHBondContact NE2-NE2 3.42Å; H323-H327 VanDerWaalsContact NE2-NE2 3.13Å |
| 324 | I | 90.1 | Very high | 89.2 | Confident | 44 Ų | 44 | 61.4 Ų | 61.4 | 23% | 0.226 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -58.9 | -34.4 | 176.5 | -69.8 | 165.4 | 0 | 0 | 0 | 110.9 | I218 L320 T321 T326 H327 T328 | I218-I324 HydrophobicContact CD1-CD1 4.43Å; L320-I324 HydrophobicContact CD1-CD1 3.98Å; L320-I324 HydrophobicContact CD1-CG1 4.04Å; L320-I324 HydrophobicContact CG-CD1 3.89Å; L320-I324 HydrophobicContact CG-CG1 4.39Å; L320-I324 WeakPolarHBondContact O-CG1 3.25Å; L320-I324 PolarHBondContact O-N 3.02Å; T321-I324 PolarHBondContact O-N 3.19Å; I324-T326 PolarHBondContact O-N 3.02Å; I324-T326 VanDerWaalsContact O-N 3.13Å; I324-H327 WeakPolarHBondContact O-CA 3.2Å; I324-H327 WeakPolarHBondContact O-CB 3.36Å; I324-H327 PolarHBondContact O-N 3.09Å; I324-T328 HydrophobicContact CG2-CG2 4.2Å; I324-T328 PolarHBondContact O-N 3.03Å; I324-T328 VanDerWaalsContact O-N 3.07Å |
| 325 | R | 91 | Very high | 89.5 | Confident | 53 Ų | 53 | 60 Ų | 60 | 20% | 0.2 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -59.8 | -21.8 | 173.2 | -64.9 | -178.3 | 179.8 | 150.1 | 5.5 | 114.1 | T321 H323 H327 T328 G329 E330 A343 | T321-R325 PolarHBondContact O-N 2.95Å; H323-R325 PolarHBondContact O-N 2.85Å; R325-H327 VanDerWaalsContact C-N 3.3Å; R325-T328 WeakPolarHBondContact CA-OG1 3.3Å; R325-G329 WeakPolarHBondContact O-CA 3.44Å; R325-G329 PolarHBondContact O-N 2.92Å; R325-E330 HydrophobicContact CB-CB 4.43Å; R325-E330 HydrophobicContact CG-CB 4.16Å; R325-E330 PolarHBondContact O-N 3.17Å; R325-A343 HydrophobicContact CB-CB 4.34Å; R325-A343 WeakPolarHBondContact CD-O 3.29Å; R325-A343 PolarHBondContact NH1-O 3.17Å |
| 326 | T | 90.4 | Very high | 89.7 | Confident | 96 Ų | 96 | 65.4 Ų | 65.4 | 59% | 0.589 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -74.9 | -23.9 | 173.6 | 72.4 | 0 | 0 | 0 | 0 | 112.3 | H323 I324 | H323-T326 WeakPolarHBondContact O-CB 3.34Å; H323-T326 PolarHBondContact O-N 2.9Å; H323-T326 PolarHBondContact O-OG1 3.3Å; I324-T326 PolarHBondContact O-N 3.02Å; I324-T326 VanDerWaalsContact O-N 3.13Å |
| 327 | H | 89 | Confident | 89.8 | Confident | 73 Ų | 73 | 66.7 Ų | 66.7 | 34% | 0.338 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -84.2 | -42.8 | 173.6 | -63.5 | -61.7 | 0 | 0 | 0 | 111.7 | C307 I309 H323 I324 R325 | C307-H327 PolarHBondContact SG-NE2 3.07Å; I309-H327 HydrophobicContact CD1-CB 3.53Å; I309-H327 HydrophobicContact CG2-CB 4.45Å; H323-H327 AromaticContact CE1-NE2 3.45Å; H323-H327 PolarHBondContact CE1-NE2 3.49Å; H323-H327 AromaticContact NE2-CD2 3.84Å; H323-H327 AromaticContact NE2-NE2 3.13Å; H323-H327 PolarHBondContact NE2-NE2 3.42Å; H323-H327 VanDerWaalsContact NE2-NE2 3.13Å; I324-H327 WeakPolarHBondContact O-CA 3.2Å; I324-H327 WeakPolarHBondContact O-CB 3.36Å; I324-H327 PolarHBondContact O-N 3.09Å; R325-H327 VanDerWaalsContact C-N 3.3Å |
| 328 | T | 90 | Very high | 90 | Very high | 69 Ų | 69 | 66.8 Ų | 66.8 | 42% | 0.423 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -80.6 | -16.6 | -178.2 | 61.8 | 0 | 0 | 0 | 0 | 113.5 | I324 R325 E330 | I324-T328 HydrophobicContact CG2-CG2 4.2Å; I324-T328 PolarHBondContact O-N 3.03Å; I324-T328 VanDerWaalsContact O-N 3.07Å; R325-T328 WeakPolarHBondContact CA-OG1 3.3Å; T328-E330 PolarHBondContact O-N 3.02Å; T328-E330 WeakPolarHBondContact OG1-CG 3.4Å; T328-E330 PolarHBondContact OG1-N 3.49Å |
| 329 | G | 88.3 | Confident | 90.1 | Very high | 50 Ų | 50 | 66.1 Ų | 66.1 | 52% | 0.515 | 37% | 0.37 | S | S | . | . | trans | 72.7 | 8.6 | -174.4 | 0 | 0 | 0 | 0 | 0 | 114 | R325 K331 | R325-G329 WeakPolarHBondContact O-CA 3.44Å; R325-G329 PolarHBondContact O-N 2.92Å; G329-K331 PolarHBondContact O-N 3.26Å | ||
| 330 | E | 89.1 | Confident | 90.1 | Very high | 113 Ų | 113 | 70.1 Ų | 70.1 | 53% | 0.528 | 38% | 0.382 | S | S | . | . | trans | -63.7 | 127.5 | -179.4 | -78 | -179.4 | -171.6 | 0 | 0 | 112.6 | R325 T328 | R325-E330 HydrophobicContact CB-CB 4.43Å; R325-E330 HydrophobicContact CG-CB 4.16Å; R325-E330 PolarHBondContact O-N 3.17Å; T328-E330 PolarHBondContact O-N 3.02Å; T328-E330 WeakPolarHBondContact OG1-CG 3.4Å; T328-E330 PolarHBondContact OG1-N 3.49Å | ||
| 331 | K | 90.5 | Very high | 90.2 | Very high | 102 Ų | 102 | 75.3 Ų | 75.3 | 44% | 0.443 | 40% | 0.404 | S | S | . | . | trans | -129.5 | 78.8 | 178.6 | -65 | 175.4 | -176.1 | 180 | 0 | 110.3 | G329 F333 K341 F342 | G329-K331 PolarHBondContact O-N 3.26Å; K331-F333 VanDerWaalsContact C-N 3.28Å; K331-F333 PolarHBondContact O-N 3.38Å; K331-K341 HydrophobicContact CB-CB 3.58Å; K331-K341 HydrophobicContact CD-CB 4.39Å; K331-F342 CarbonylContact C-O 3.46Å; K331-F342 VanDerWaalsContact C-O 3.31Å; K331-F342 WeakPolarHBondContact CA-O 3.43Å | ||
| 332 | P | 89.5 | Confident | 90.1 | Very high | 76 Ų | 76 | 73 Ų | 73 | 49% | 0.494 | 39% | 0.388 | S | S | . | . | trans | -72.6 | -17.8 | -173.2 | 26.1 | -32.6 | 0 | 0 | 0 | 113.9 | ||||
| 333 | F | 90.6 | Very high | 90.1 | Very high | 64 Ų | 64 | 72.3 Ų | 72.3 | 28% | 0.281 | 39% | 0.385 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 100.4 | -172.4 | -58.3 | -71.7 | 0 | 0 | 0 | 112 | K331 K341 F342 S345 R348 | K331-F333 VanDerWaalsContact C-N 3.28Å; K331-F333 PolarHBondContact O-N 3.38Å; F333-K341 CarbonylContact O-C 3.25Å; F333-K341 WeakPolarHBondContact O-CA 3.49Å; F333-F342 HydrophobicContact CB-CB 4.36Å; F333-F342 PolarHBondContact N-O 3.5Å; F333-F342 VanDerWaalsContact N-O 3.08Å; F333-F342 PolarHBondContact O-N 3.01Å; F333-S345 VanDerWaalsContact CD2-N 3.3Å; F333-S345 VanDerWaalsContact CE2-N 3.35Å; F333-R348 HydrophobicContact CB-CB 4.02Å; F333-R348 HydrophobicContact CB-CG 4.43Å |
| 334 | A | 90.7 | Very high | 90 | Very high | 48 Ų | 48 | 76.6 Ų | 76.6 | 40% | 0.397 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.6 | 139.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | R340 K341 R348 | A334-R340 CarbonylContact C-O 3.54Å; A334-R340 WeakPolarHBondContact CA-O 3.25Å; A334-K341 HydrophobicContact CB-CG 4.26Å; A334-R348 WeakPolarHBondContact O-CD 3.23Å |
| 335 | C | 92.3 | Very high | 90 | Very high | 2 Ų | 2 | 76.4 Ų | 76.4 | 1% | 0.014 | 40% | 0.403 | C | S | . | . | trans | -74.9 | 128.8 | 170.2 | -179.9 | 0 | 0 | 0 | 0 | 110.7 | F337 C338 G339 R340 F342 R348 H351 | C335-F337 VanDerWaalsContact C-N 3.26Å; C335-F337 PolarHBondContact O-N 2.9Å; C335-C338 PolarHBondContact O-N 3.29Å; C335-G339 VanDerWaalsContact O-CA 3.27Å; C335-G339 WeakPolarHBondContact O-CA 3.42Å; C335-G339 PolarHBondContact O-N 3.16Å; C335-R340 PolarHBondContact N-O 3.06Å; C335-F342 HydrophobicContact CB-CE2 4.14Å; C335-R348 HydrophobicContact CB-CG 4.39Å; C335-H351 VanDerWaalsContact SG-CD2 3.58Å | ||
| 336 | E | 90.9 | Very high | 89.9 | Confident | 147 Ų | 147 | 78.3 Ų | 78.3 | 69% | 0.687 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.8 | -27.7 | 179.8 | -69.5 | 150.2 | -129.4 | 0 | 0 | 113.5 | R348 | E336-R348 IonicContact OE1-CZ 3.4Å; E336-R348 IonicContact OE1-NH1 3.29Å; E336-R348 PolarHBondContact OE1-NH1 2.85Å |
| 337 | F | 88.4 | Confident | 89.9 | Confident | 107 Ų | 107 | 75.8 Ų | 75.8 | 47% | 0.469 | 40% | 0.399 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.9 | -26.5 | -177.2 | -60 | -70.2 | 0 | 0 | 0 | 114.2 | C335 A352 H355 L356 | C335-F337 VanDerWaalsContact C-N 3.26Å; C335-F337 PolarHBondContact O-N 2.9Å; F337-A352 HydrophobicContact CD2-CB 4.4Å; F337-A352 HydrophobicContact CE2-CB 4.3Å; F337-H355 HydrophobicContact CB-CB 3.84Å; F337-H355 HydrophobicContact CD1-CB 4.36Å; F337-H355 HydrophobicContact CD2-CB 3.58Å; F337-H355 AromaticContact CD2-CD2 3.86Å; F337-H355 AromaticContact CD2-CG 3.94Å; F337-H355 HydrophobicContact CE2-CB 4.22Å; F337-H355 HydrophobicContact CG-CB 3.67Å; F337-H355 AromaticContact CG-CG 3.9Å; F337-L356 HydrophobicContact CZ-CD2 4.06Å |
| 338 | C | 92.1 | Very high | 90.2 | Very high | 64 Ų | 64 | 74.1 Ų | 74.1 | 43% | 0.432 | 39% | 0.39 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -139.3 | -1 | -172.9 | 70 | 0 | 0 | 0 | 0 | 115.2 | C335 R340 H351 H355 | C335-C338 PolarHBondContact O-N 3.29Å; C338-R340 PolarHBondContact O-N 2.9Å; C338-R340 VanDerWaalsContact O-N 3.1Å; C338-R340 VanDerWaalsContact SG-CB 3.52Å; C338-R340 PolarHBondContact SG-N 3Å; C338-H351 PolarHBondContact SG-NE2 3.4Å; C338-H355 PolarHBondContact SG-NE2 2.94Å; C338-H355 VanDerWaalsContact SG-NE2 3.41Å |
| 339 | G | 89.7 | Confident | 90.2 | Very high | 47 Ų | 47 | 76.2 Ų | 76.2 | 49% | 0.485 | 39% | 0.393 | S | S | . | . | trans | 71.8 | -3.9 | -178.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | C335 K341 | C335-G339 VanDerWaalsContact O-CA 3.27Å; C335-G339 WeakPolarHBondContact O-CA 3.42Å; C335-G339 PolarHBondContact O-N 3.16Å; G339-K341 PolarHBondContact O-N 2.81Å | ||
| 340 | R | 90 | Very high | 90.4 | Very high | 159 Ų | 159 | 81.5 Ų | 81.5 | 60% | 0.6 | 40% | 0.397 | S | S | * | . | trans | -61.9 | 127.3 | -178.2 | -172 | 170.1 | -179.9 | 175.1 | 1.5 | 110.9 | A334 C335 C338 F342 | A334-R340 CarbonylContact C-O 3.54Å; A334-R340 WeakPolarHBondContact CA-O 3.25Å; C335-R340 PolarHBondContact N-O 3.06Å; C338-R340 PolarHBondContact O-N 2.9Å; C338-R340 VanDerWaalsContact O-N 3.1Å; C338-R340 VanDerWaalsContact SG-CB 3.52Å; C338-R340 PolarHBondContact SG-N 3Å; R340-F342 HydrophobicContact CB-CE2 3.97Å; R340-F342 HydrophobicContact CB-CZ 4.15Å; R340-F342 HydrophobicContact CG-CE1 4.43Å; R340-F342 HydrophobicContact CG-CE2 3.93Å; R340-F342 HydrophobicContact CG-CZ 3.74Å; R340-F342 VanDerWaalsContact O-CD2 3.27Å; R340-F342 WeakPolarHBondContact O-CD2 3.08Å; R340-F342 WeakPolarHBondContact O-CE2 3.14Å | ||
| 341 | K | 92.1 | Very high | 90.5 | Very high | 135 Ų | 135 | 77.5 Ų | 77.5 | 59% | 0.587 | 38% | 0.378 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -91 | 141.3 | -177.8 | -58 | -174.3 | -179.1 | 179.4 | 0 | 112.1 | K331 F333 A334 G339 | K331-K341 HydrophobicContact CB-CB 3.58Å; K331-K341 HydrophobicContact CD-CB 4.39Å; F333-K341 CarbonylContact O-C 3.25Å; F333-K341 WeakPolarHBondContact O-CA 3.49Å; A334-K341 HydrophobicContact CB-CG 4.26Å; G339-K341 PolarHBondContact O-N 2.81Å |
| 342 | F | 88.8 | Confident | 90.6 | Very high | 25 Ų | 25 | 73.3 Ų | 73.3 | 11% | 0.11 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.3 | 151.4 | -178.1 | -61.4 | -85.6 | 0 | 0 | 0 | 111.3 | K331 F333 C335 R340 E347 R348 H351 | K331-F342 CarbonylContact C-O 3.46Å; K331-F342 VanDerWaalsContact C-O 3.31Å; K331-F342 WeakPolarHBondContact CA-O 3.43Å; F333-F342 HydrophobicContact CB-CB 4.36Å; F333-F342 PolarHBondContact N-O 3.5Å; F333-F342 VanDerWaalsContact N-O 3.08Å; F333-F342 PolarHBondContact O-N 3.01Å; C335-F342 HydrophobicContact CB-CE2 4.14Å; R340-F342 HydrophobicContact CB-CE2 3.97Å; R340-F342 HydrophobicContact CB-CZ 4.15Å; R340-F342 HydrophobicContact CG-CE1 4.43Å; R340-F342 HydrophobicContact CG-CE2 3.93Å; R340-F342 HydrophobicContact CG-CZ 3.74Å; R340-F342 VanDerWaalsContact O-CD2 3.27Å; R340-F342 WeakPolarHBondContact O-CD2 3.08Å; R340-F342 WeakPolarHBondContact O-CE2 3.14Å; F342-E347 HydrophobicContact CB-CB 4.07Å; F342-E347 HydrophobicContact CD1-CB 3.84Å; F342-E347 HydrophobicContact CG-CB 4.18Å; F342-R348 HydrophobicContact CB-CB 4.24Å; F342-R348 HydrophobicContact CD2-CB 3.77Å; F342-R348 HydrophobicContact CD2-CG 4.07Å; F342-R348 HydrophobicContact CG-CB 4.21Å; F342-H351 HydrophobicContact CE1-CB 4.07Å; F342-H351 HydrophobicContact CE2-CB 3.92Å; F342-H351 AromaticContact CE2-CD2 3.6Å; F342-H351 AromaticContact CE2-CG 3.8Å; F342-H351 HydrophobicContact CZ-CB 3.47Å; F342-H351 VanDerWaalsContact CZ-CB 3.47Å; F342-H351 AromaticContact CZ-CD2 3.52Å; F342-H351 AromaticContact CZ-CG 3.29Å; F342-H351 AromaticContact CZ-ND1 3.8Å |
| 343 | A | 88.6 | Confident | 90.7 | Very high | 20 Ų | 20 | 76 Ų | 76 | 17% | 0.165 | 37% | 0.367 | C | S | . | . | S | Bend | trans | -80.3 | -26 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | R325 E347 | R325-A343 HydrophobicContact CB-CB 4.34Å; R325-A343 WeakPolarHBondContact CD-O 3.29Å; R325-A343 PolarHBondContact NH1-O 3.17Å; A343-E347 PolarHBondContact N-OE2 2.84Å |
| 344 | R | 88.1 | Confident | 90.7 | Very high | 115 Ų | 115 | 77 Ų | 77 | 43% | 0.434 | 37% | 0.374 | S | S | . | . | S | Bend | trans | -121.9 | 146.1 | 177.2 | -62.9 | -176.1 | -74.4 | -176 | -4.5 | 112.3 | T322 D346 E347 R348 | T322-R344 HydrophobicContact CG2-CG 3.79Å; R344-D346 VanDerWaalsContact C-N 3.28Å; R344-D346 PolarHBondContact O-N 3.33Å; R344-E347 HydrophobicContact CB-CB 4.47Å; R344-E347 HydrophobicContact CB-CG 4.03Å; R344-E347 IonicContact CZ-OE1 2.78Å; R344-E347 PolarHBondContact N-OE2 3.4Å; R344-E347 IonicContact NE-OE1 3.52Å; R344-E347 PolarHBondContact NE-OE1 3.34Å; R344-E347 IonicContact NH2-OE1 2.71Å; R344-E347 PolarHBondContact NH2-OE1 3.26Å; R344-E347 WeakPolarHBondContact O-CB 3.13Å; R344-E347 PolarHBondContact O-N 3.23Å; R344-R348 PolarHBondContact O-N 3.26Å |
| 345 | S | 89.9 | Confident | 90.6 | Very high | 39 Ų | 39 | 76.4 Ų | 76.4 | 27% | 0.273 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -65.4 | -33.7 | 178.2 | 63 | 0 | 0 | 0 | 0 | 111.8 | F333 E347 R348 K349 | F333-S345 VanDerWaalsContact CD2-N 3.3Å; F333-S345 VanDerWaalsContact CE2-N 3.35Å; S345-E347 VanDerWaalsContact C-N 3.34Å; S345-E347 PolarHBondContact O-N 3Å; S345-R348 WeakPolarHBondContact O-CB 3.31Å; S345-R348 PolarHBondContact O-N 3.33Å; S345-K349 WeakPolarHBondContact O-CG 3.48Å; S345-K349 PolarHBondContact O-N 3.47Å |
| 346 | D | 90.1 | Very high | 90.5 | Very high | 93 Ų | 93 | 80.2 Ų | 80.2 | 50% | 0.497 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -66.6 | -35.3 | 178.2 | -49.3 | -52.5 | 0 | 0 | 0 | 112.4 | R344 K349 R350 | R344-D346 VanDerWaalsContact C-N 3.28Å; R344-D346 PolarHBondContact O-N 3.33Å; D346-K349 PolarHBondContact O-N 3.42Å; D346-R350 WeakPolarHBondContact O-CB 3.45Å; D346-R350 PolarHBondContact O-N 2.76Å |
| 347 | E | 90.5 | Very high | 90.2 | Very high | 43 Ų | 43 | 79.8 Ų | 79.8 | 20% | 0.201 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65.8 | -47.1 | 174.7 | -68.3 | 166.4 | 177 | 0 | 0 | 110.4 | F342 A343 R344 S345 K349 R350 H351 | F342-E347 HydrophobicContact CB-CB 4.07Å; F342-E347 HydrophobicContact CD1-CB 3.84Å; F342-E347 HydrophobicContact CG-CB 4.18Å; A343-E347 PolarHBondContact N-OE2 2.84Å; R344-E347 HydrophobicContact CB-CB 4.47Å; R344-E347 HydrophobicContact CB-CG 4.03Å; R344-E347 IonicContact CZ-OE1 2.78Å; R344-E347 PolarHBondContact N-OE2 3.4Å; R344-E347 IonicContact NE-OE1 3.52Å; R344-E347 PolarHBondContact NE-OE1 3.34Å; R344-E347 IonicContact NH2-OE1 2.71Å; R344-E347 PolarHBondContact NH2-OE1 3.26Å; R344-E347 WeakPolarHBondContact O-CB 3.13Å; R344-E347 PolarHBondContact O-N 3.23Å; S345-E347 VanDerWaalsContact C-N 3.34Å; S345-E347 PolarHBondContact O-N 3Å; E347-K349 PolarHBondContact O-N 2.8Å; E347-R350 PolarHBondContact O-N 3.43Å; E347-H351 WeakPolarHBondContact O-CB 3.45Å; E347-H351 PolarHBondContact O-N 3.39Å |
| 348 | R | 93.9 | Very high | 90 | Very high | 39 Ų | 39 | 79.4 Ų | 79.4 | 15% | 0.147 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -56.8 | -47.8 | 172.7 | -174.1 | -153.9 | 66.9 | 113.9 | -8.7 | 111.1 | F333 A334 C335 E336 F342 R344 S345 R350 H351 A352 | F333-R348 HydrophobicContact CB-CB 4.02Å; F333-R348 HydrophobicContact CB-CG 4.43Å; A334-R348 WeakPolarHBondContact O-CD 3.23Å; C335-R348 HydrophobicContact CB-CG 4.39Å; E336-R348 IonicContact OE1-CZ 3.4Å; E336-R348 IonicContact OE1-NH1 3.29Å; E336-R348 PolarHBondContact OE1-NH1 2.85Å; F342-R348 HydrophobicContact CB-CB 4.24Å; F342-R348 HydrophobicContact CD2-CB 3.77Å; F342-R348 HydrophobicContact CD2-CG 4.07Å; F342-R348 HydrophobicContact CG-CB 4.21Å; R344-R348 PolarHBondContact O-N 3.26Å; S345-R348 WeakPolarHBondContact O-CB 3.31Å; S345-R348 PolarHBondContact O-N 3.33Å; R348-R350 PolarHBondContact O-N 3.26Å; R348-H351 PolarHBondContact O-N 3.24Å; R348-A352 WeakPolarHBondContact O-CB 3.45Å; R348-A352 PolarHBondContact O-N 2.84Å |
| 349 | K | 91.5 | Very high | 89.4 | Confident | 113 Ų | 113 | 83.6 Ų | 83.6 | 49% | 0.491 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -61.4 | -44 | 178.6 | -75.3 | 175.9 | -179.6 | 177.7 | 0 | 111.8 | S345 D346 E347 H351 A352 K353 | S345-K349 WeakPolarHBondContact O-CG 3.48Å; S345-K349 PolarHBondContact O-N 3.47Å; D346-K349 PolarHBondContact O-N 3.42Å; E347-K349 PolarHBondContact O-N 2.8Å; K349-H351 VanDerWaalsContact C-N 3.32Å; K349-A352 PolarHBondContact O-N 2.85Å; K349-K353 PolarHBondContact O-N 3.26Å |
| 350 | R | 91.8 | Very high | 88.8 | Confident | 161 Ų | 161 | 87.5 Ų | 87.5 | 61% | 0.608 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -63.4 | -41.1 | 177 | -167.3 | -173.4 | -55.1 | 115 | 3.9 | 111 | D346 E347 R348 K353 | D346-R350 WeakPolarHBondContact O-CB 3.45Å; D346-R350 PolarHBondContact O-N 2.76Å; E347-R350 PolarHBondContact O-N 3.43Å; R348-R350 PolarHBondContact O-N 3.26Å; R350-K353 PolarHBondContact O-N 2.75Å |
| 351 | H | 91.9 | Very high | 88.1 | Confident | 28 Ų | 28 | 86.8 Ų | 86.8 | 13% | 0.13 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -66.1 | -43.2 | 175.4 | 177.3 | 74.9 | 0 | 0 | 0 | 112.4 | C335 C338 F342 E347 R348 K349 K353 I354 H355 | C335-H351 VanDerWaalsContact SG-CD2 3.58Å; C338-H351 PolarHBondContact SG-NE2 3.4Å; F342-H351 HydrophobicContact CE1-CB 4.07Å; F342-H351 HydrophobicContact CE2-CB 3.92Å; F342-H351 AromaticContact CE2-CD2 3.6Å; F342-H351 AromaticContact CE2-CG 3.8Å; F342-H351 HydrophobicContact CZ-CB 3.47Å; F342-H351 VanDerWaalsContact CZ-CB 3.47Å; F342-H351 AromaticContact CZ-CD2 3.52Å; F342-H351 AromaticContact CZ-CG 3.29Å; F342-H351 AromaticContact CZ-ND1 3.8Å; E347-H351 WeakPolarHBondContact O-CB 3.45Å; E347-H351 PolarHBondContact O-N 3.39Å; R348-H351 PolarHBondContact O-N 3.24Å; K349-H351 VanDerWaalsContact C-N 3.32Å; H351-K353 PolarHBondContact O-N 3.03Å; H351-I354 WeakPolarHBondContact O-CB 3.23Å; H351-I354 WeakPolarHBondContact O-CG1 3.38Å; H351-I354 PolarHBondContact O-N 3.24Å; H351-H355 AromaticContact CD2-NE2 3.69Å; H351-H355 AromaticContact CE1-NE2 3.67Å; H351-H355 AromaticContact NE2-CD2 3.78Å; H351-H355 AromaticContact NE2-NE2 3Å; H351-H355 PolarHBondContact NE2-NE2 2.98Å |
| 352 | A | 91.1 | Very high | 87 | Confident | 15 Ų | 15 | 88.1 Ų | 88.1 | 12% | 0.124 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -57.7 | -32.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | F337 R348 K349 I354 H355 L356 | F337-A352 HydrophobicContact CD2-CB 4.4Å; F337-A352 HydrophobicContact CE2-CB 4.3Å; R348-A352 WeakPolarHBondContact O-CB 3.45Å; R348-A352 PolarHBondContact O-N 2.84Å; K349-A352 PolarHBondContact O-N 2.85Å; A352-I354 PolarHBondContact O-N 2.94Å; A352-H355 WeakPolarHBondContact O-CB 3.45Å; A352-H355 PolarHBondContact O-N 2.84Å; A352-H355 VanDerWaalsContact O-N 3.13Å; A352-L356 PolarHBondContact O-N 2.99Å |
| 353 | K | 91.9 | Very high | 85.9 | Confident | 133 Ų | 133 | 90.2 Ų | 90.2 | 58% | 0.578 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -61.7 | -26.4 | 173.6 | -68.2 | 178.8 | -178.9 | -173.4 | 0 | 113.6 | K349 R350 H351 H355 K357 | K349-K353 PolarHBondContact O-N 3.26Å; R350-K353 PolarHBondContact O-N 2.75Å; H351-K353 PolarHBondContact O-N 3.03Å; K353-H355 VanDerWaalsContact C-N 3.34Å; K353-K357 VanDerWaalsContact O-CG 3.32Å; K353-K357 WeakPolarHBondContact O-CG 3.48Å; K353-K357 PolarHBondContact O-N 3.06Å |
| 354 | I | 91.2 | Very high | 84.5 | Confident | 84 Ų | 84 | 97.1 Ų | 97.1 | 43% | 0.431 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -65.8 | -42.7 | 176.1 | -56.4 | 172.6 | 0 | 0 | 0 | 109.3 | H351 A352 K357 Q358 | H351-I354 WeakPolarHBondContact O-CB 3.23Å; H351-I354 WeakPolarHBondContact O-CG1 3.38Å; H351-I354 PolarHBondContact O-N 3.24Å; A352-I354 PolarHBondContact O-N 2.94Å; I354-K357 PolarHBondContact O-N 3.24Å; I354-Q358 WeakPolarHBondContact O-CB 3.42Å; I354-Q358 VanDerWaalsContact O-CG 3.28Å; I354-Q358 WeakPolarHBondContact O-CG 3.48Å; I354-Q358 PolarHBondContact O-N 3.36Å |
| 355 | H | 89 | Confident | 83.3 | Confident | 35 Ų | 35 | 101.2 Ų | 101.2 | 16% | 0.162 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -66.5 | -41 | 177.3 | -63.7 | -63.5 | 0 | 0 | 0 | 112.5 | F337 C338 H351 A352 K353 K357 Q358 K359 | F337-H355 HydrophobicContact CB-CB 3.84Å; F337-H355 HydrophobicContact CD1-CB 4.36Å; F337-H355 HydrophobicContact CD2-CB 3.58Å; F337-H355 AromaticContact CD2-CD2 3.86Å; F337-H355 AromaticContact CD2-CG 3.94Å; F337-H355 HydrophobicContact CE2-CB 4.22Å; F337-H355 HydrophobicContact CG-CB 3.67Å; F337-H355 AromaticContact CG-CG 3.9Å; C338-H355 PolarHBondContact SG-NE2 2.94Å; C338-H355 VanDerWaalsContact SG-NE2 3.41Å; H351-H355 AromaticContact CD2-NE2 3.69Å; H351-H355 AromaticContact CE1-NE2 3.67Å; H351-H355 AromaticContact NE2-CD2 3.78Å; H351-H355 AromaticContact NE2-NE2 3Å; H351-H355 PolarHBondContact NE2-NE2 2.98Å; A352-H355 WeakPolarHBondContact O-CB 3.45Å; A352-H355 PolarHBondContact O-N 2.84Å; A352-H355 VanDerWaalsContact O-N 3.13Å; K353-H355 VanDerWaalsContact C-N 3.34Å; H355-K357 PolarHBondContact O-N 3.37Å; H355-Q358 PolarHBondContact O-N 2.85Å; H355-K359 WeakPolarHBondContact O-CB 3.41Å; H355-K359 PolarHBondContact O-N 2.83Å |
| 356 | L | 88.5 | Confident | 81.7 | Confident | 83 Ų | 83 | 102.3 Ų | 102.3 | 44% | 0.435 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.4 | -47.4 | 174.4 | -66.9 | 173.3 | 0 | 0 | 0 | 111.4 | F337 A352 Q358 K359 E360 | F337-L356 HydrophobicContact CZ-CD2 4.06Å; A352-L356 PolarHBondContact O-N 2.99Å; L356-Q358 VanDerWaalsContact C-N 3.3Å; L356-Q358 PolarHBondContact O-N 2.72Å; L356-K359 WeakPolarHBondContact O-CB 3.27Å; L356-K359 PolarHBondContact O-N 3.36Å; L356-K359 VanDerWaalsContact O-N 3.15Å; L356-E360 WeakPolarHBondContact O-CG 3.32Å; L356-E360 PolarHBondContact O-N 3.33Å |
| 357 | K | 86.4 | Confident | 79.5 | Confident | 138 Ų | 138 | 101 Ų | 101 | 60% | 0.6 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.8 | -35.4 | 175.6 | -71.9 | 179.4 | 178 | -168.4 | 0 | 113 | K353 I354 H355 K361 | K353-K357 VanDerWaalsContact O-CG 3.32Å; K353-K357 WeakPolarHBondContact O-CG 3.48Å; K353-K357 PolarHBondContact O-N 3.06Å; I354-K357 PolarHBondContact O-N 3.24Å; H355-K357 PolarHBondContact O-N 3.37Å; K357-K361 WeakPolarHBondContact O-CG 3.27Å; K357-K361 PolarHBondContact O-N 2.75Å; K357-K361 VanDerWaalsContact O-N 3.16Å |
| 358 | Q | 82.7 | Confident | 77.6 | Confident | 99 Ų | 99 | 102.9 Ų | 102.9 | 46% | 0.463 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -70.1 | -36.4 | 175.2 | -74.6 | 177.7 | 4.8 | 0 | 0 | 111.9 | I354 H355 L356 K362 | I354-Q358 WeakPolarHBondContact O-CB 3.42Å; I354-Q358 VanDerWaalsContact O-CG 3.28Å; I354-Q358 WeakPolarHBondContact O-CG 3.48Å; I354-Q358 PolarHBondContact O-N 3.36Å; H355-Q358 PolarHBondContact O-N 2.85Å; L356-Q358 VanDerWaalsContact C-N 3.3Å; L356-Q358 PolarHBondContact O-N 2.72Å; Q358-K362 WeakPolarHBondContact O-CG 3.34Å; Q358-K362 PolarHBondContact O-N 2.83Å; Q358-K362 VanDerWaalsContact O-N 3.1Å |
| 359 | K | 79.4 | Confident | 75.6 | Confident | 151 Ų | 151 | 107 Ų | 107 | 66% | 0.657 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -65.2 | -44.4 | 175.3 | -171.4 | 179.8 | 177.9 | -178.1 | 0 | 111.3 | H355 L356 K362 A363 | H355-K359 WeakPolarHBondContact O-CB 3.41Å; H355-K359 PolarHBondContact O-N 2.83Å; L356-K359 WeakPolarHBondContact O-CB 3.27Å; L356-K359 PolarHBondContact O-N 3.36Å; L356-K359 VanDerWaalsContact O-N 3.15Å; K359-K362 PolarHBondContact O-N 3.23Å; K359-A363 PolarHBondContact O-N 3.05Å |
| 360 | E | 78.3 | Confident | 73.6 | Confident | 129 Ų | 129 | 106.7 Ų | 106.7 | 60% | 0.603 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -58.7 | -48.1 | 174.9 | -70.7 | 168.3 | 169.8 | 0 | 0 | 111.5 | L356 K362 A363 E364 | L356-E360 WeakPolarHBondContact O-CG 3.32Å; L356-E360 PolarHBondContact O-N 3.33Å; E360-K362 VanDerWaalsContact C-N 3.29Å; E360-K362 PolarHBondContact O-N 3.09Å; E360-A363 PolarHBondContact O-N 3.41Å; E360-A363 VanDerWaalsContact O-N 3.17Å; E360-E364 PolarHBondContact O-N 3.08Å |
| 361 | K | 74.1 | Confident | 71.5 | Confident | 145 Ų | 145 | 104.1 Ų | 104.1 | 63% | 0.63 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -62.2 | -31.9 | 177.1 | -73.8 | -177.7 | 177.6 | -167.8 | 0 | 114 | K357 K365 | K357-K361 WeakPolarHBondContact O-CG 3.27Å; K357-K361 PolarHBondContact O-N 2.75Å; K357-K361 VanDerWaalsContact O-N 3.16Å; K361-K365 PolarHBondContact O-N 3.11Å |
| 362 | K | 69.1 | Low | 69.9 | Low | 162 Ų | 162 | 107 Ų | 107 | 70% | 0.704 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -75.7 | -34.7 | 176.3 | -75.7 | -178.2 | 178.3 | -175 | 0 | 111.9 | Q358 K359 E360 K365 G366 | Q358-K362 WeakPolarHBondContact O-CG 3.34Å; Q358-K362 PolarHBondContact O-N 2.83Å; Q358-K362 VanDerWaalsContact O-N 3.1Å; K359-K362 PolarHBondContact O-N 3.23Å; E360-K362 VanDerWaalsContact C-N 3.29Å; E360-K362 PolarHBondContact O-N 3.09Å; K362-K365 PolarHBondContact O-N 3.35Å; K362-G366 PolarHBondContact O-N 3.13Å; K362-G366 VanDerWaalsContact O-N 3.16Å |
| 363 | A | 65.1 | Low | 68.1 | Low | 69 Ų | 69 | 111.4 Ų | 111.4 | 57% | 0.57 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -67 | -37.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | K359 E360 K365 G366 G367 | K359-A363 PolarHBondContact O-N 3.05Å; E360-A363 PolarHBondContact O-N 3.41Å; E360-A363 VanDerWaalsContact O-N 3.17Å; A363-K365 VanDerWaalsContact C-N 3.31Å; A363-K365 PolarHBondContact O-N 3.25Å; A363-G366 PolarHBondContact O-N 3Å; A363-G367 PolarHBondContact O-N 3.31Å |
| 364 | E | 61.2 | Low | 66.5 | Low | 166 Ų | 166 | 109.8 Ų | 109.8 | 78% | 0.776 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -69.1 | -27.5 | 178.2 | -150.4 | 178.4 | 171.6 | 0 | 0 | 112.9 | E360 | E360-E364 PolarHBondContact O-N 3.08Å |
| 365 | K | 61.2 | Low | 64.6 | Low | 200 Ų | 200 | 110.8 Ų | 110.8 | 87% | 0.87 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.8 | -5.8 | 174.2 | -70.3 | -172.3 | 177.2 | -170.2 | 0 | 114.5 | K361 K362 A363 | K361-K365 PolarHBondContact O-N 3.11Å; K362-K365 PolarHBondContact O-N 3.35Å; A363-K365 VanDerWaalsContact C-N 3.31Å; A363-K365 PolarHBondContact O-N 3.25Å |
| 366 | G | 56.1 | Low | 63 | Low | 63 Ų | 63 | 115.3 Ų | 115.3 | 65% | 0.649 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -108.5 | 4.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | K362 A363 A368 | K362-G366 PolarHBondContact O-N 3.13Å; K362-G366 VanDerWaalsContact O-N 3.16Å; A363-G366 PolarHBondContact O-N 3Å; G366-A368 PolarHBondContact O-N 3.05Å |
| 367 | G | 44.6 | Very low | 61.6 | Low | 66 Ų | 66 | 118.4 Ų | 118.4 | 68% | 0.68 | 71% | 0.711 | S | S | * | * | trans | -88.4 | 68.2 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | A363 | A363-G367 PolarHBondContact O-N 3.31Š| ||
| 368 | A | 50.9 | Low | 60 | Low | 82 Ų | 82 | 116.7 Ų | 116.7 | 68% | 0.678 | 72% | 0.716 | S | S | * | * | trans | -143.4 | 99.7 | 152 | 0 | 0 | 0 | 0 | 0 | 108 | G366 S370 | G366-A368 PolarHBondContact O-N 3.05Å; A368-S370 PolarHBondContact O-N 3.35Å | ||
| 369 | P | 51.9 | Low | 58.6 | Low | 126 Ų | 126 | 119.8 Ų | 119.8 | 82% | 0.818 | 74% | 0.735 | S | S | * | * | trans | -64.2 | 114.2 | 151 | 28.7 | -27.1 | 0 | 0 | 0 | 105.1 | A371 | P369-A371 PolarHBondContact O-N 3.31Š| ||
| 370 | S | 48.7 | Very low | 57.7 | Low | 105 Ų | 105 | 116.7 Ų | 116.7 | 73% | 0.734 | 74% | 0.738 | S | S | * | * | trans | -60.2 | 93.8 | 168.2 | 49.4 | 0 | 0 | 0 | 0 | 107.9 | A368 S372 | A368-S370 PolarHBondContact O-N 3.35Å; S370-S372 PolarHBondContact O-N 3.15Å | ||
| 371 | A | 49.5 | Very low | 56.7 | Low | 108 Ų | 108 | 116 Ų | 116 | 89% | 0.893 | 74% | 0.744 | S | S | * | * | trans | -68.9 | 79.4 | 159.9 | 0 | 0 | 0 | 0 | 0 | 107.1 | P369 | P369-A371 PolarHBondContact O-N 3.31Š| ||
| 372 | S | 56.9 | Low | 56 | Low | 88 Ų | 88 | 115.4 Ų | 115.4 | 62% | 0.615 | 75% | 0.752 | S | S | * | * | trans | -109.8 | 108 | 169.8 | 54.6 | 0 | 0 | 0 | 0 | 109.2 | S370 | S370-S372 PolarHBondContact O-N 3.15Š| ||
| 373 | S | 54.5 | Low | 55.2 | Low | 108 Ų | 108 | 113.9 Ų | 113.9 | 76% | 0.755 | 76% | 0.757 | S | S | * | * | trans | 65.1 | 98.2 | 144.6 | 62.9 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 374 | A | 56.7 | Low | 55.2 | Low | 98 Ų | 98 | 116.5 Ų | 116.5 | 81% | 0.81 | 77% | 0.766 | S | S | * | * | 46.8 | 157.6 | 113 | 0 | 0 | 0 | 0 | 0 | 121.7 | |||||
| 375 | P | 51.7 | Low | 55.3 | Low | 106 Ų | 106 | 114.6 Ų | 114.6 | 69% | 0.688 | 77% | 0.766 | S | S | * | * | cis | -124.3 | 177.4 | -31.3 | 36.4 | -19.1 | 0 | 0 | 0 | 111.6 | ||||
| 376 | P | 55.6 | Low | 54.5 | Low | 130 Ų | 130 | 111.4 Ų | 111.4 | 84% | 0.844 | 77% | 0.767 | S | S | * | * | trans | -77.8 | 133.8 | 179.4 | 32.5 | -31.4 | 0 | 0 | 0 | 110.1 | ||||
| 377 | V | 60 | Low | 54.6 | Low | 147 Ų | 147 | 116.8 Ų | 116.8 | 89% | 0.891 | 81% | 0.805 | S | S | * | * | trans | -125.7 | 130.3 | 164.1 | -94.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 378 | S | 51.9 | Low | 55.1 | Low | 102 Ų | 102 | 119.4 Ų | 119.4 | 71% | 0.713 | 81% | 0.812 | S | S | * | * | trans | -87.1 | 172.8 | -169.7 | -176 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 379 | L | 52.6 | Low | 55.4 | Low | 165 Ų | 165 | 121.3 Ų | 121.3 | 86% | 0.864 | 82% | 0.819 | S | S | * | * | trans | 87.2 | 128 | 163.2 | -52.3 | 159.4 | 0 | 0 | 0 | 114.5 | ||||
| 380 | A | 60.8 | Low | 55.6 | Low | 85 Ų | 85 | 121.1 Ų | 121.1 | 70% | 0.702 | 82% | 0.819 | S | S | * | * | cis | -167.8 | 175.7 | 2 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 381 | P | 58.3 | Low | 56 | Low | 114 Ų | 114 | 122 Ų | 122 | 74% | 0.74 | 82% | 0.824 | S | S | * | * | trans | -88.8 | 146.5 | -165.7 | 35.7 | -30.8 | 0 | 0 | 0 | 112.4 | ||||
| 382 | V | 59.1 | Low | 56.4 | Low | 133 Ų | 133 | 122.9 Ų | 122.9 | 81% | 0.806 | 82% | 0.819 | S | S | * | * | trans | -125.4 | 98.6 | 159.6 | -174.8 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 383 | V | 51.7 | Low | 56.3 | Low | 131 Ų | 131 | 125.2 Ų | 125.2 | 79% | 0.794 | 83% | 0.833 | S | S | * | * | trans | -58.5 | 125.5 | 157.8 | -124.6 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 384 | T | 65.5 | Low | 56.5 | Low | 123 Ų | 123 | 126.4 Ų | 126.4 | 76% | 0.755 | 84% | 0.839 | S | S | * | * | trans | -140.7 | 120.4 | 155.8 | -58.5 | 0 | 0 | 0 | 0 | 108 | ||||
| 385 | T | 63.3 | Low | 56.5 | Low | 127 Ų | 127 | 128.6 Ų | 128.6 | 78% | 0.779 | 84% | 0.841 | S | S | * | * | trans | -65.3 | 150.2 | -171 | 42.6 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 386 | C | 43.9 | Very low | 56.9 | Low | 133 Ų | 133 | 130.5 Ų | 130.5 | 90% | 0.899 | 85% | 0.853 | S | S | * | * | trans | -59.5 | 150.8 | 164.5 | -59.2 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 387 | A | 59.7 | Low | 57 | Low | 176 Ų | 176 | 130.5 Ų | 130.5 | 100% | 1.455 | 85% | 0.854 | S | S | * | * | trans | -106.3 | 0 | 154.7 | 0 | 0 | 0 | 0 | 0 | 108.9 |
Retrieved 387 of 387 residues in 45 ms
(Link to these results)