| 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 | 58.3 | Low | 53.6 | Low | 231 Ų | 231 | 138.6 Ų | 138.6 | 100% | 1.138 | 85% | 0.849 | S | S | * | * | 0 | 86.4 | 0 | -64.2 | 161.9 | 167.5 | 0 | 0 | 106 | |||||
| 2 | M | 52.9 | Low | 54.4 | Low | 175 Ų | 175 | 134.3 Ų | 134.3 | 86% | 0.862 | 83% | 0.828 | S | S | * | * | 46 | 106 | 86.7 | -64.5 | 151.5 | 144.1 | 0 | 0 | 108.9 | |||||
| 3 | N | 53.5 | Low | 54.9 | Low | 147 Ų | 147 | 134.6 Ų | 134.6 | 79% | 0.786 | 82% | 0.821 | S | S | * | * | -163.9 | 127.1 | 75.4 | -64.6 | -14.6 | 0 | 0 | 0 | 108.4 | |||||
| 4 | S | 57.1 | Low | 55.2 | Low | 102 Ų | 102 | 136.6 Ų | 136.6 | 71% | 0.713 | 82% | 0.817 | S | S | * | * | 57 | 101 | 75.8 | -61.9 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 5 | R | 49.7 | Very low | 55.1 | Low | 241 Ų | 241 | 138.4 Ų | 138.4 | 91% | 0.909 | 81% | 0.813 | S | S | * | * | 93 | 122.6 | 93.8 | -81.5 | 177.7 | 177.5 | -170.9 | -0.4 | 112.8 | |||||
| 6 | G | 52.6 | Low | 55.5 | Low | 84 Ų | 84 | 135.3 Ų | 135.3 | 87% | 0.866 | 80% | 0.796 | S | S | * | * | trans | -163.6 | 82.6 | 169.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 7 | S | 54.7 | Low | 56 | Low | 121 Ų | 121 | 136.1 Ų | 136.1 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | trans | -93.8 | 160.4 | 177.8 | -53.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 8 | G | 53.9 | Low | 56.4 | Low | 75 Ų | 75 | 137.8 Ų | 137.8 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | trans | 98.5 | 141.8 | 160.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 9 | S | 51 | Low | 56.6 | Low | 121 Ų | 121 | 134.8 Ų | 134.8 | 85% | 0.846 | 79% | 0.788 | S | S | * | * | cis | -171 | 144 | 17.2 | 38.1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 10 | S | 49.6 | Very low | 56.6 | Low | 116 Ų | 116 | 137.8 Ų | 137.8 | 81% | 0.811 | 79% | 0.791 | S | S | * | * | trans | -54.2 | 146.7 | 166.2 | -44.2 | 0 | 0 | 0 | 0 | 114 | ||||
| 11 | S | 56.5 | Low | 56.7 | Low | 112 Ų | 112 | 135.7 Ų | 135.7 | 78% | 0.783 | 79% | 0.785 | S | S | * | * | trans | -159.4 | 99.9 | 153.4 | -80.1 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 12 | S | 62.9 | Low | 56.6 | Low | 86 Ų | 86 | 132.9 Ų | 132.9 | 60% | 0.601 | 77% | 0.769 | S | S | * | * | 69.3 | 127.4 | 79.5 | 91.6 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 13 | N | 61.2 | Low | 57.1 | Low | 139 Ų | 139 | 132.5 Ų | 132.5 | 74% | 0.743 | 76% | 0.764 | S | S | * | * | trans | 79.3 | 123.2 | 157 | -42.4 | -30.9 | 0 | 0 | 0 | 113 | ||||
| 14 | H | 59.5 | Low | 57.9 | Low | 163 Ų | 163 | 131.1 Ų | 131.1 | 76% | 0.755 | 76% | 0.764 | S | S | * | * | cis | -173 | 141.1 | 47.5 | 47.4 | -71.3 | 0 | 0 | 0 | 108.9 | T16 | H14-T16 PolarHBondContact O-N 3.25Š| ||
| 15 | Q | 53.2 | Low | 58 | Low | 163 Ų | 163 | 133.9 Ų | 133.9 | 76% | 0.762 | 77% | 0.77 | S | S | * | * | trans | -55.1 | 123.8 | 163.3 | -172.3 | 101.9 | 40.8 | 0 | 0 | 110.3 | M17 | Q15-M17 HydrophobicContact CG-CG 3.94Š| ||
| 16 | T | 62.2 | Low | 58.9 | Low | 88 Ų | 88 | 128.3 Ų | 128.3 | 54% | 0.54 | 77% | 0.765 | S | S | . | * | trans | -122.2 | 95.1 | 156.8 | -72.9 | 0 | 0 | 0 | 0 | 107.4 | H14 M18 | H14-T16 PolarHBondContact O-N 3.25Å; T16-M18 HydrophobicContact CG2-CE 3.52Å; T16-M18 HydrophobicContact CG2-CG 4.06Å; T16-M18 HydrophobicContact CG2-SD 3.73Å; T16-M18 PolarHBondContact O-N 2.93Å | ||
| 17 | M | 63 | Low | 58.8 | Low | 149 Ų | 149 | 128.8 Ų | 128.8 | 73% | 0.734 | 76% | 0.761 | S | S | * | * | trans | -69.6 | 107.1 | 161.1 | -66.7 | -87.3 | -82.6 | 0 | 0 | 106.3 | Q15 A19 | Q15-M17 HydrophobicContact CG-CG 3.94Å; M17-A19 VanDerWaalsContact C-N 3.33Å; M17-A19 PolarHBondContact O-N 3.32Å; M17-A19 VanDerWaalsContact O-N 3.08Å | ||
| 18 | M | 64.2 | Low | 58.6 | Low | 168 Ų | 168 | 129.5 Ų | 129.5 | 83% | 0.828 | 76% | 0.76 | S | S | * | * | trans | -76.2 | 97.4 | 164.3 | -68.6 | -59.2 | -172.5 | 0 | 0 | 106.9 | T16 | T16-M18 HydrophobicContact CG2-CE 3.52Å; T16-M18 HydrophobicContact CG2-CG 4.06Å; T16-M18 HydrophobicContact CG2-SD 3.73Å; T16-M18 PolarHBondContact O-N 2.93Å | ||
| 19 | A | 60.1 | Low | 58.4 | Low | 81 Ų | 81 | 129.9 Ų | 129.9 | 67% | 0.669 | 76% | 0.756 | S | S | * | * | trans | -59.7 | 138 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111 | M17 S21 | M17-A19 VanDerWaalsContact C-N 3.33Å; M17-A19 PolarHBondContact O-N 3.32Å; M17-A19 VanDerWaalsContact O-N 3.08Å; A19-S21 PolarHBondContact O-N 3.09Å; A19-S21 VanDerWaalsContact O-N 3.16Å | ||
| 20 | F | 56.3 | Low | 58.5 | Low | 193 Ų | 193 | 129.6 Ų | 129.6 | 85% | 0.846 | 75% | 0.754 | S | S | * | * | trans | -57.5 | 108.2 | 156.2 | -88.7 | -109.2 | 0 | 0 | 0 | 108 | E22 | F20-E22 VanDerWaalsContact C-N 3.28Å; F20-E22 PolarHBondContact O-N 3.27Å | ||
| 21 | S | 58.4 | Low | 58.8 | Low | 95 Ų | 95 | 129.2 Ų | 129.2 | 66% | 0.664 | 75% | 0.751 | S | S | * | * | trans | -78.3 | 84 | 166.1 | -65.5 | 0 | 0 | 0 | 0 | 108.7 | A19 H23 | A19-S21 PolarHBondContact O-N 3.09Å; A19-S21 VanDerWaalsContact O-N 3.16Å; S21-H23 PolarHBondContact O-N 2.96Å | ||
| 22 | E | 56.2 | Low | 58.8 | Low | 171 Ų | 171 | 129.5 Ų | 129.5 | 80% | 0.799 | 75% | 0.753 | S | S | * | * | trans | -63.8 | 118.4 | 150.1 | -92.1 | 165.6 | 103.7 | 0 | 0 | 107.7 | F20 P24 | F20-E22 VanDerWaalsContact C-N 3.28Å; F20-E22 PolarHBondContact O-N 3.27Å; E22-P24 VanDerWaalsContact O-CD 3.25Å; E22-P24 WeakPolarHBondContact O-CD 3.45Å | ||
| 23 | H | 64.4 | Low | 58.2 | Low | 168 Ų | 168 | 128.9 Ų | 128.9 | 78% | 0.778 | 76% | 0.761 | S | S | * | * | trans | -89.5 | 112.4 | 169.4 | -70.8 | -77.4 | 0 | 0 | 0 | 108.9 | S21 | S21-H23 PolarHBondContact O-N 2.96Š| ||
| 24 | P | 69.8 | Low | 58.1 | Low | 118 Ų | 118 | 130.6 Ų | 130.6 | 77% | 0.766 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -81 | 128.3 | 166.8 | 31.1 | -30.8 | 0 | 0 | 0 | 110.2 | E22 | E22-P24 VanDerWaalsContact O-CD 3.25Å; E22-P24 WeakPolarHBondContact O-CD 3.45Å |
| 25 | N | 59.7 | Low | 57.7 | Low | 159 Ų | 159 | 129.2 Ų | 129.2 | 85% | 0.85 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 131.5 | 172.5 | -73.7 | -34.3 | 0 | 0 | 0 | 111.5 | ||
| 26 | P | 68.4 | Low | 57.7 | Low | 124 Ų | 124 | 129.9 Ų | 129.9 | 81% | 0.805 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -89.8 | 121 | 162 | 31.6 | -28.2 | 0 | 0 | 0 | 111 | ||
| 27 | A | 48.8 | Very low | 57.4 | Low | 94 Ų | 94 | 130.3 Ų | 130.3 | 78% | 0.777 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -88.6 | 120 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 28 | T | 51.6 | Low | 57.2 | Low | 136 Ų | 136 | 128.3 Ų | 128.3 | 83% | 0.834 | 79% | 0.786 | S | S | * | * | trans | -178.5 | 106.6 | 154.7 | 15 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 29 | A | 50 | Low | 57.4 | Low | 83 Ų | 83 | 126 Ų | 126 | 69% | 0.686 | 78% | 0.784 | S | S | * | * | 109.6 | 123.9 | 72.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 30 | S | 52 | Low | 57.4 | Low | 115 Ų | 115 | 127.4 Ų | 127.4 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | trans | 76.2 | 101 | 151.1 | -44.1 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 31 | S | 55.7 | Low | 56.9 | Low | 108 Ų | 108 | 123.6 Ų | 123.6 | 76% | 0.755 | 78% | 0.784 | S | S | * | * | 157.7 | 119.6 | 109.6 | 70.1 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 32 | S | 57.8 | Low | 56.7 | Low | 118 Ų | 118 | 124.7 Ų | 124.7 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | trans | 46.2 | 116 | 142 | 59.3 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 33 | G | 50.5 | Low | 56.8 | Low | 74 Ų | 74 | 121.8 Ų | 121.8 | 76% | 0.763 | 79% | 0.787 | S | S | * | * | trans | 127.1 | 117.1 | 139.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 34 | Q | 58.1 | Low | 56 | Low | 175 Ų | 175 | 119 Ų | 119 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | trans | 86.7 | 117.9 | 163.5 | -59.5 | -171 | -42.5 | 0 | 0 | 118.5 | Q36 | Q34-Q36 PolarHBondContact O-N 3.39Š| ||
| 35 | P | 51.1 | Low | 55 | Low | 134 Ų | 134 | 122.1 Ų | 122.1 | 87% | 0.87 | 79% | 0.791 | S | S | * | * | trans | -81.5 | 105 | 164.6 | 32.1 | -25.8 | 0 | 0 | 0 | 108.5 | ||||
| 36 | Q | 52.8 | Low | 54.9 | Low | 177 Ų | 177 | 124.9 Ų | 124.9 | 83% | 0.827 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 118.3 | 162.7 | -82.9 | -166 | -5.6 | 0 | 0 | 109.3 | Q34 S38 | Q34-Q36 PolarHBondContact O-N 3.39Å; Q36-S38 PolarHBondContact O-N 3.14Å |
| 37 | A | 57 | Low | 54.5 | Low | 96 Ų | 96 | 124.4 Ų | 124.4 | 79% | 0.793 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 125.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 38 | S | 58.9 | Low | 54.8 | Low | 107 Ų | 107 | 125.6 Ų | 125.6 | 75% | 0.748 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 131.7 | 166.4 | -21.3 | 0 | 0 | 0 | 0 | 109.3 | Q36 | Q36-S38 PolarHBondContact O-N 3.14Š|
| 39 | P | 68.7 | Low | 54.6 | Low | 121 Ų | 121 | 124.8 Ų | 124.8 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 130.8 | 168.9 | 27 | -31.1 | 0 | 0 | 0 | 108.8 | S41 | P39-S41 PolarHBondContact O-N 3.03Š|
| 40 | P | 60 | Low | 54.3 | Low | 110 Ų | 110 | 124 Ų | 124 | 71% | 0.714 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 130.3 | 175.3 | 29.4 | -31.8 | 0 | 0 | 0 | 109.6 | S42 | P40-S42 PolarHBondContact O-N 3.38Š|
| 41 | S | 44.9 | Very low | 53.7 | Low | 113 Ų | 113 | 129.6 Ų | 129.6 | 79% | 0.79 | 79% | 0.789 | S | S | * | * | trans | 41.4 | 81 | 136 | -39.9 | 0 | 0 | 0 | 0 | 116.2 | P39 P43 | P39-S41 PolarHBondContact O-N 3.03Å; S41-P43 WeakPolarHBondContact O-CD 3.48Å | ||
| 42 | S | 54.9 | Low | 53.1 | Low | 118 Ų | 118 | 128.4 Ų | 128.4 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | trans | -78.4 | 109.1 | 155.9 | -60.2 | 0 | 0 | 0 | 0 | 108.2 | P40 S44 | P40-S42 PolarHBondContact O-N 3.38Å; S42-S44 PolarHBondContact O-N 3.38Å; S42-S44 VanDerWaalsContact O-N 3.14Å | ||
| 43 | P | 57.8 | Low | 52.6 | Low | 110 Ų | 110 | 133.9 Ų | 133.9 | 71% | 0.714 | 80% | 0.796 | S | S | * | * | trans | -63.3 | 119.6 | 163.1 | 28.8 | -30.3 | 0 | 0 | 0 | 105.7 | S41 E45 | S41-P43 WeakPolarHBondContact O-CD 3.48Å; P43-E45 VanDerWaalsContact C-N 3.28Å; P43-E45 PolarHBondContact O-N 3.25Å | ||
| 44 | S | 47.9 | Very low | 52.7 | Low | 108 Ų | 108 | 142 Ų | 142 | 76% | 0.755 | 80% | 0.804 | S | S | * | * | trans | -55.9 | 99.3 | 166.8 | -179.1 | 0 | 0 | 0 | 0 | 107.2 | S42 R46 | S42-S44 PolarHBondContact O-N 3.38Å; S42-S44 VanDerWaalsContact O-N 3.14Å; S44-R46 PolarHBondContact O-N 2.9Å | ||
| 45 | E | 48.5 | Very low | 52.5 | Low | 184 Ų | 184 | 145.6 Ų | 145.6 | 86% | 0.86 | 81% | 0.81 | S | S | * | * | trans | -61.6 | 79.3 | 163.6 | -86.7 | -177.4 | 123.2 | 0 | 0 | 107 | P43 P47 | P43-E45 VanDerWaalsContact C-N 3.28Å; P43-E45 PolarHBondContact O-N 3.25Å; E45-P47 WeakPolarHBondContact O-CD 3.43Å | ||
| 46 | R | 57.5 | Low | 52.5 | Low | 217 Ų | 217 | 143.2 Ų | 143.2 | 82% | 0.819 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 117.5 | 153.9 | -90.3 | -179.5 | 165.9 | -155.8 | -2.9 | 105 | S44 P48 | S44-R46 PolarHBondContact O-N 2.9Å; R46-P48 VanDerWaalsContact O-N 3.13Å |
| 47 | P | 59.9 | Low | 52.7 | Low | 114 Ų | 114 | 139.9 Ų | 139.9 | 74% | 0.74 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 128.6 | 173.3 | 23 | -31.5 | 0 | 0 | 0 | 106.4 | E45 S49 | E45-P47 WeakPolarHBondContact O-CD 3.43Å; P47-S49 PolarHBondContact O-N 3.46Å |
| 48 | P | 55.2 | Low | 52.6 | Low | 120 Ų | 120 | 141.7 Ų | 141.7 | 78% | 0.779 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 121.7 | -175.9 | 20.9 | -30.9 | 0 | 0 | 0 | 107.2 | R46 G50 | R46-P48 VanDerWaalsContact O-N 3.13Å; P48-G50 PolarHBondContact O-N 2.85Å |
| 49 | S | 47 | Very low | 52.7 | Low | 118 Ų | 118 | 143.2 Ų | 143.2 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | trans | -62.1 | 69.4 | 161.8 | 163.1 | 0 | 0 | 0 | 0 | 107.5 | P47 R51 | P47-S49 PolarHBondContact O-N 3.46Å; S49-R51 PolarHBondContact O-N 3.21Å | ||
| 50 | G | 43.7 | Very low | 52.8 | Low | 66 Ų | 66 | 140.6 Ų | 140.6 | 68% | 0.68 | 78% | 0.781 | S | S | * | * | trans | -76.9 | 99.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 108.1 | P48 G52 | P48-G50 PolarHBondContact O-N 2.85Å; G50-G52 PolarHBondContact O-N 2.84Å; G50-G52 VanDerWaalsContact O-N 3.11Å | ||
| 51 | R | 39.7 | Very low | 54.2 | Low | 233 Ų | 233 | 143.7 Ų | 143.7 | 88% | 0.879 | 78% | 0.778 | S | S | * | * | trans | -44.4 | 110.3 | 172.3 | -67.7 | 172 | -115.1 | -177.6 | -2.6 | 111.4 | S49 R53 | S49-R51 PolarHBondContact O-N 3.21Å; R51-R53 PolarHBondContact O-N 3.43Å | ||
| 52 | G | 43.6 | Very low | 56.5 | Low | 83 Ų | 83 | 141.1 Ų | 141.1 | 86% | 0.856 | 75% | 0.753 | S | S | * | * | S | Bend | trans | 65.8 | 19.7 | 131.4 | 0 | 0 | 0 | 0 | 0 | 120.3 | G50 | G50-G52 PolarHBondContact O-N 2.84Å; G50-G52 VanDerWaalsContact O-N 3.11Å |
| 53 | R | 46.9 | Very low | 58.3 | Low | 233 Ų | 233 | 136.9 Ų | 136.9 | 88% | 0.879 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -131 | 112.5 | 174.5 | -75 | -175 | -178.3 | -175.6 | 0.7 | 111.9 | R51 | R51-R53 PolarHBondContact O-N 3.43Š|
| 54 | R | 52.5 | Low | 60 | Low | 245 Ų | 245 | 133 Ų | 133 | 93% | 0.925 | 70% | 0.701 | S | S | * | * | trans | 57.4 | 75.7 | 168.5 | -54.9 | -171.5 | -169.2 | -130.6 | 4.2 | 116.1 | A56 | R54-A56 PolarHBondContact O-N 2.86Š| ||
| 55 | R | 54.2 | Low | 62.3 | Low | 251 Ų | 251 | 129.1 Ų | 129.1 | 95% | 0.947 | 67% | 0.672 | S | S | * | * | trans | -68.4 | 87.9 | 146.3 | -69.7 | -173.9 | -169.8 | -129 | 1 | 106 | Q57 | R55-Q57 PolarHBondContact O-N 2.73Š| ||
| 56 | A | 51.3 | Low | 64.4 | Low | 84 Ų | 84 | 124.7 Ų | 124.7 | 69% | 0.694 | 65% | 0.648 | S | S | * | * | trans | -46.3 | 125.6 | 157.6 | 0 | 0 | 0 | 0 | 0 | 105.7 | R54 E58 | R54-A56 PolarHBondContact O-N 2.86Å; A56-E58 PolarHBondContact O-N 3.17Å | ||
| 57 | Q | 55.9 | Low | 66.2 | Low | 106 Ų | 106 | 123.1 Ų | 123.1 | 50% | 0.495 | 64% | 0.642 | S | S | . | * | trans | -50.9 | 109.6 | -178 | -64.3 | 176.7 | 5.7 | 0 | 0 | 106.9 | R55 L63 | R55-Q57 PolarHBondContact O-N 2.73Å; Q57-L63 HydrophobicContact CG-CD1 4.14Å | ||
| 58 | E | 55.7 | Low | 67.8 | Low | 135 Ų | 135 | 124.8 Ų | 124.8 | 63% | 0.631 | 63% | 0.633 | S | S | * | * | trans | -55.3 | 127.7 | 166.9 | -75.4 | -122.9 | 145.4 | 0 | 0 | 105.9 | A56 G60 R61 | A56-E58 PolarHBondContact O-N 3.17Å; E58-G60 VanDerWaalsContact C-N 3.35Å; E58-G60 PolarHBondContact O-N 2.79Å; E58-R61 PolarHBondContact O-N 3.28Å | ||
| 59 | P | 61.2 | Low | 69.5 | Low | 138 Ų | 138 | 125.6 Ų | 125.6 | 90% | 0.896 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.5 | 99.6 | -176 | 20.3 | -30.4 | 0 | 0 | 0 | 108.7 | ||
| 60 | G | 70.9 | Confident | 71.6 | Confident | 67 Ų | 67 | 130.2 Ų | 130.2 | 69% | 0.691 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 126 | -5.7 | -174.6 | 0 | 0 | 0 | 0 | 0 | 116.7 | E58 | E58-G60 VanDerWaalsContact C-N 3.35Å; E58-G60 PolarHBondContact O-N 2.79Å |
| 61 | R | 88.4 | Confident | 73.9 | Confident | 174 Ų | 174 | 129.1 Ų | 129.1 | 66% | 0.657 | 63% | 0.626 | S | S | * | * | trans | -116.5 | 113.3 | 175 | -63.9 | -176 | -175.3 | -82.3 | 0.3 | 111.7 | E58 | E58-R61 PolarHBondContact O-N 3.28Š| ||
| 62 | F | 93.7 | Very high | 76.6 | Confident | 60 Ų | 60 | 122.5 Ų | 122.5 | 26% | 0.263 | 60% | 0.601 | S | S | . | * | trans | -82.7 | 146.4 | 171.8 | -63.2 | -71.5 | 0 | 0 | 0 | 111.7 | V65 A94 A98 N116 F117 | F62-V65 HydrophobicContact CB-CB 3.94Å; F62-V65 HydrophobicContact CB-CG2 3.68Å; F62-V65 PolarHBondContact O-N 3.47Å; F62-A94 HydrophobicContact CD2-CB 3.74Å; F62-A94 WeakPolarHBondContact CD2-O 3.26Å; F62-A94 HydrophobicContact CE2-CB 3.77Å; F62-A98 HydrophobicContact CB-CB 3.58Å; F62-A98 HydrophobicContact CD1-CB 3.77Å; F62-A98 HydrophobicContact CD2-CB 4.05Å; F62-A98 HydrophobicContact CE1-CB 4.46Å; F62-A98 HydrophobicContact CG-CB 3.53Å; F62-N116 VanDerWaalsContact CA-OD1 3.28Å; F62-N116 WeakPolarHBondContact CA-OD1 3.45Å; F62-N116 WeakPolarHBondContact CB-OD1 3.4Å; F62-N116 HydrophobicContact CD1-CB 4.03Å; F62-F117 HydrophobicContact CE1-CE1 4.22Å; F62-F117 HydrophobicContact CE1-CZ 4.07Å | ||
| 63 | L | 93.1 | Very high | 79.1 | Confident | 29 Ų | 29 | 121.4 Ų | 121.4 | 15% | 0.152 | 57% | 0.572 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -57 | 135.7 | 171.6 | -68.5 | 83.4 | 0 | 0 | 0 | 110.1 | Q57 V65 Y101 R114 N116 | Q57-L63 HydrophobicContact CG-CD1 4.14Å; L63-V65 PolarHBondContact O-N 2.75Å; L63-V65 VanDerWaalsContact O-N 3.1Å; L63-Y101 HydrophobicContact CB-CD1 4.17Å; L63-Y101 HydrophobicContact CB-CE1 3.82Å; L63-R114 HydrophobicContact CD2-CG 3.88Å; L63-N116 WeakPolarHBondContact CB-OD1 3.31Å; L63-N116 WeakPolarHBondContact CD1-OD1 3.16Å; L63-N116 PolarHBondContact N-OD1 3.29Å; L63-N116 PolarHBondContact O-ND2 2.93Å |
| 64 | G | 93.5 | Very high | 81.4 | Confident | 28 Ų | 28 | 110.4 Ų | 110.4 | 29% | 0.289 | 53% | 0.531 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72.9 | -8.6 | -179.2 | 0 | 0 | 0 | 0 | 0 | 115 | A75 E76 Y101 | G64-A75 WeakPolarHBondContact O-CA 3.37Å; G64-E76 PolarHBondContact O-N 3.35Å; G64-Y101 VanDerWaalsContact CA-CD2 3.47Å |
| 65 | V | 95.1 | Very high | 83.5 | Confident | 27 Ų | 27 | 98.7 Ų | 98.7 | 16% | 0.164 | 49% | 0.487 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.5 | 128.2 | -175.7 | -176 | 0 | 0 | 0 | 0 | 111.4 | F62 L63 Y73 A74 A97 A98 | F62-V65 HydrophobicContact CB-CB 3.94Å; F62-V65 HydrophobicContact CB-CG2 3.68Å; F62-V65 PolarHBondContact O-N 3.47Å; L63-V65 PolarHBondContact O-N 2.75Å; L63-V65 VanDerWaalsContact O-N 3.1Å; V65-Y73 HydrophobicContact CG1-CD1 3.81Å; V65-Y73 HydrophobicContact CG1-CG 4.33Å; V65-A74 WeakPolarHBondContact CA-O 3.22Å; V65-A97 HydrophobicContact CB-CB 4.38Å; V65-A97 HydrophobicContact CG1-CB 3.8Å; V65-A97 HydrophobicContact CG2-CB 3.66Å; V65-A98 HydrophobicContact CG2-CB 4.06Å |
| 66 | R | 94.6 | Very high | 85.4 | Confident | 90 Ų | 90 | 88.9 Ų | 88.9 | 34% | 0.34 | 45% | 0.452 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.9 | 142.1 | 172.2 | 63.3 | -178.6 | 179.8 | 76.7 | -4.5 | 111.3 | Y73 A74 E76 W87 | R66-Y73 WeakPolarHBondContact O-CA 3.12Å; R66-A74 HydrophobicContact CG-CB 3.86Å; R66-A74 PolarHBondContact N-O 3Å; R66-A74 PolarHBondContact O-N 3.36Å; R66-E76 IonicContact NE-OE2 3.67Å; R66-W87 VanDerWaalsContact NH2-CZ3 3.27Å |
| 67 | R | 94.2 | Very high | 87.4 | Confident | 185 Ų | 185 | 85.2 Ų | 85.2 | 70% | 0.698 | 42% | 0.42 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 125.6 | 173.1 | -164.8 | 175.4 | 78.2 | -177.4 | 5.4 | 110 | Y73 | R67-Y73 HydrophobicContact CB-CD1 4.34Å; R67-Y73 HydrophobicContact CB-CE1 4.14Å; R67-Y73 HydrophobicContact CG-CD1 4.45Å; R67-Y73 HydrophobicContact CG-CE1 4.03Å |
| 68 | R | 92.7 | Very high | 89.3 | Confident | 148 Ų | 148 | 86.1 Ų | 86.1 | 56% | 0.558 | 42% | 0.419 | S | S | * | . | trans | -86 | 151.8 | 173.4 | 177.8 | 122.9 | -100 | -171.6 | -6.7 | 109.1 | W70 G71 R72 | R68-W70 HydrophobicContact CG-CB 3.95Å; R68-W70 PolarHBondContact O-N 3.2Å; R68-W70 VanDerWaalsContact O-N 3.08Å; R68-G71 PolarHBondContact O-N 3.29Å; R68-R72 PolarHBondContact N-O 3.29Å | ||
| 69 | P | 92.8 | Very high | 90.9 | Very high | 137 Ų | 137 | 81.3 Ų | 81.3 | 89% | 0.89 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | -21.7 | 172.6 | 19.6 | -35.1 | 0 | 0 | 0 | 114.3 | G71 | P69-G71 PolarHBondContact O-N 3.16Š|
| 70 | W | 90.7 | Very high | 92.2 | Very high | 216 Ų | 216 | 80.2 Ų | 80.2 | 82% | 0.818 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.6 | -8.7 | 171.8 | -174.6 | -109.6 | 0 | 0 | 0 | 114.1 | R68 | R68-W70 HydrophobicContact CG-CB 3.95Å; R68-W70 PolarHBondContact O-N 3.2Å; R68-W70 VanDerWaalsContact O-N 3.08Å |
| 71 | G | 92.3 | Very high | 93.1 | Very high | 42 Ų | 42 | 83.3 Ų | 83.3 | 43% | 0.433 | 40% | 0.396 | S | S | . | . | S | Bend | trans | 96.2 | -23.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | R68 P69 | R68-G71 PolarHBondContact O-N 3.29Å; P69-G71 PolarHBondContact O-N 3.16Å |
| 72 | R | 94.9 | Very high | 93.2 | Very high | 94 Ų | 94 | 79 Ų | 79 | 36% | 0.355 | 39% | 0.389 | S | S | . | . | trans | -72.2 | 153 | 177.6 | -61.1 | -171.5 | 84.6 | -166.5 | 4.1 | 113.1 | R68 T90 D92 | R68-R72 PolarHBondContact N-O 3.29Å; R72-T90 PolarHBondContact NH1-OG1 3.34Å; R72-D92 IonicContact CZ-OD1 3.58Å; R72-D92 VanDerWaalsContact CZ-OD1 3.3Å; R72-D92 IonicContact NE-OD1 3.26Å; R72-D92 PolarHBondContact NE-OD1 2.93Å; R72-D92 IonicContact NH2-OD1 2.84Å; R72-D92 PolarHBondContact NH2-OD1 2.71Å | ||
| 73 | Y | 96.1 | Very high | 93 | Very high | 60 Ų | 60 | 84.8 Ų | 84.8 | 24% | 0.235 | 41% | 0.414 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.7 | 142 | 174.9 | -62.4 | -85.9 | 0 | 0 | 0 | 109.8 | V65 R66 R67 T90 F91 D92 A94 | V65-Y73 HydrophobicContact CG1-CD1 3.81Å; V65-Y73 HydrophobicContact CG1-CG 4.33Å; R66-Y73 WeakPolarHBondContact O-CA 3.12Å; R67-Y73 HydrophobicContact CB-CD1 4.34Å; R67-Y73 HydrophobicContact CB-CE1 4.14Å; R67-Y73 HydrophobicContact CG-CD1 4.45Å; R67-Y73 HydrophobicContact CG-CE1 4.03Å; Y73-T90 CarbonylContact O-C 3.45Å; Y73-T90 WeakPolarHBondContact O-CA 3.17Å; Y73-F91 PolarHBondContact N-O 2.86Å; Y73-F91 PolarHBondContact O-N 3.26Å; Y73-D92 WeakPolarHBondContact CD2-O 3.44Å; Y73-D92 WeakPolarHBondContact CE2-O 3.4Å; Y73-A94 HydrophobicContact CD1-CB 3.71Å; Y73-A94 HydrophobicContact CD2-CB 4.37Å; Y73-A94 HydrophobicContact CE1-CB 3.54Å; Y73-A94 HydrophobicContact CE2-CB 4.24Å; Y73-A94 HydrophobicContact CG-CB 4.13Å |
| 74 | A | 95.2 | Very high | 93 | Very high | 2 Ų | 2 | 86.4 Ų | 86.4 | 2% | 0.017 | 42% | 0.421 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 137.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | V65 R66 W87 G89 T90 | V65-A74 WeakPolarHBondContact CA-O 3.22Å; R66-A74 HydrophobicContact CG-CB 3.86Å; R66-A74 PolarHBondContact N-O 3Å; R66-A74 PolarHBondContact O-N 3.36Å; A74-W87 HydrophobicContact CB-CH2 3.42Å; A74-W87 VanDerWaalsContact CB-CH2 3.42Å; A74-W87 HydrophobicContact CB-CZ2 4.49Å; A74-W87 HydrophobicContact CB-CZ3 3.67Å; A74-G89 WeakPolarHBondContact CA-O 3.11Å; A74-T90 HydrophobicContact CB-CG2 4.21Å |
| 75 | A | 96.4 | Very high | 93 | Very high | 0 Ų | 0 | 92.4 Ų | 92.4 | 0% | 0 | 44% | 0.435 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.7 | 135.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111 | G64 L88 G89 F91 A97 | G64-A75 WeakPolarHBondContact O-CA 3.37Å; A75-L88 HydrophobicContact CB-CB 4.07Å; A75-L88 HydrophobicContact CB-CD1 4.19Å; A75-L88 WeakPolarHBondContact O-CB 3.47Å; A75-L88 PolarHBondContact O-N 3.04Å; A75-G89 PolarHBondContact N-O 3.12Å; A75-G89 PolarHBondContact O-N 3.31Å; A75-F91 HydrophobicContact CB-CD2 4.37Å; A75-F91 HydrophobicContact CB-CE2 3.89Å; A75-A97 HydrophobicContact CB-CB 4.24Å; A75-A97 WeakPolarHBondContact CB-O 3.44Å |
| 76 | E | 94.6 | Very high | 92.9 | Very high | 45 Ų | 45 | 92.2 Ų | 92.2 | 21% | 0.21 | 43% | 0.432 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -140 | 147.9 | 173.4 | 65.2 | -175.6 | -132.2 | 0 | 0 | 109.6 | G64 R66 R78 H86 Y101 | G64-E76 PolarHBondContact O-N 3.35Å; R66-E76 IonicContact NE-OE2 3.67Å; E76-R78 IonicContact OE1-CZ 3.3Å; E76-R78 IonicContact OE1-NE 2.91Å; E76-R78 IonicContact OE1-NH2 3.66Å; E76-R78 PolarHBondContact OE1-NH2 3.09Å; E76-H86 CarbonylContact C-O 3.55Å; E76-H86 VanDerWaalsContact CA-O 3.26Å; E76-H86 WeakPolarHBondContact CA-O 3.33Å; E76-Y101 WeakPolarHBondContact O-CD2 3.48Å |
| 77 | I | 94.4 | Very high | 92.9 | Very high | 6 Ų | 6 | 93 Ų | 93 | 3% | 0.031 | 44% | 0.436 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.4 | 153.8 | 174.3 | -167.4 | 156.2 | 0 | 0 | 0 | 110.6 | R85 H86 L88 Y101 A104 A105 M108 | I77-R85 WeakPolarHBondContact O-CA 3.29Å; I77-H86 HydrophobicContact CG2-CB 3.7Å; I77-H86 PolarHBondContact N-O 3.3Å; I77-H86 PolarHBondContact O-N 3.06Å; I77-L88 HydrophobicContact CB-CD1 4.18Å; I77-L88 HydrophobicContact CG2-CD1 4.33Å; I77-L88 HydrophobicContact CG2-CD2 3.89Å; I77-L88 HydrophobicContact CG2-CG 4.26Å; I77-Y101 HydrophobicContact CB-CD2 4.35Å; I77-Y101 HydrophobicContact CB-CE2 4.21Å; I77-Y101 HydrophobicContact CD1-CE2 4.27Å; I77-Y101 HydrophobicContact CG1-CE2 4.06Å; I77-A104 HydrophobicContact CD1-CB 3.92Å; I77-A104 HydrophobicContact CG2-CB 4.23Å; I77-A105 VanDerWaalsContact CD1-CA 3.45Å; I77-A105 HydrophobicContact CD1-CB 3.82Å; I77-M108 HydrophobicContact CB-SD 4.33Å; I77-M108 HydrophobicContact CD1-CE 3.99Å; I77-M108 HydrophobicContact CD1-SD 3.29Å; I77-M108 WeakPolarHBondContact CD1-SD 3.1Å; I77-M108 HydrophobicContact CG1-CE 3.93Å; I77-M108 HydrophobicContact CG1-SD 3.57Å; I77-M108 VanDerWaalsContact CG1-SD 3.57Å; I77-M108 HydrophobicContact CG2-SD 3.82Å |
| 78 | R | 94 | Very high | 92.9 | Very high | 125 Ų | 125 | 86.5 Ų | 86.5 | 47% | 0.472 | 41% | 0.414 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.2 | 131.5 | -177.7 | -61 | -175.8 | 179.9 | -135.1 | -3.1 | 110.1 | E76 E84 R85 | E76-R78 IonicContact OE1-CZ 3.3Å; E76-R78 IonicContact OE1-NE 2.91Å; E76-R78 IonicContact OE1-NH2 3.66Å; E76-R78 PolarHBondContact OE1-NH2 3.09Å; R78-E84 WeakPolarHBondContact CA-O 2.79Å; R78-R85 HydrophobicContact CG-CG 4.22Å; R78-R85 VanDerWaalsContact NH1-NE 3.11Å |
| 79 | D | 89.5 | Confident | 93 | Very high | 35 Ų | 35 | 80 Ų | 80 | 19% | 0.187 | 39% | 0.394 | C | S | . | . | trans | -89.2 | 121.5 | 179.4 | -73.2 | 29.1 | 0 | 0 | 0 | 108.4 | T81 T82 K83 E84 H86 M108 | D79-T81 PolarHBondContact O-N 3.26Å; D79-T82 WeakPolarHBondContact CB-OG1 3.21Å; D79-K83 WeakPolarHBondContact O-CA 3.1Å; D79-K83 PolarHBondContact O-N 2.96Å; D79-E84 PolarHBondContact N-O 2.9Å; D79-H86 IonicContact OD1-CD2 3.94Å; D79-H86 PolarHBondContact OD1-CD2 2.97Å; D79-H86 VanDerWaalsContact OD1-CD2 3.26Å; D79-H86 IonicContact OD1-NE2 3.46Å; D79-H86 IonicContact OD2-NE2 3.96Å; D79-M108 HydrophobicContact CB-CE 4.29Å; D79-M108 VanDerWaalsContact CG-CE 3.47Å; D79-M108 WeakPolarHBondContact OD1-CE 3.42Å; D79-M108 VanDerWaalsContact OD1-SD 3.4Å | ||
| 80 | P | 88.5 | Confident | 93.2 | Very high | 115 Ų | 115 | 76.4 Ų | 76.4 | 75% | 0.747 | 37% | 0.369 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.4 | -28.2 | 179.4 | 26.7 | -33.4 | 0 | 0 | 0 | 112 | ||
| 81 | T | 90.1 | Very high | 93.4 | Very high | 132 Ų | 132 | 67.4 Ų | 67.4 | 81% | 0.81 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.9 | -52.2 | -176.7 | -47.2 | 0 | 0 | 0 | 0 | 112 | D79 | D79-T81 PolarHBondContact O-N 3.26Š|
| 82 | T | 90.5 | Very high | 93.6 | Very high | 82 Ų | 82 | 70.7 Ų | 70.7 | 50% | 0.503 | 34% | 0.343 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.8 | -17 | -176.7 | 63.1 | 0 | 0 | 0 | 0 | 112.9 | D79 E84 | D79-T82 WeakPolarHBondContact CB-OG1 3.21Å; T82-E84 PolarHBondContact O-N 2.82Å; T82-E84 VanDerWaalsContact O-N 3.16Å; T82-E84 WeakPolarHBondContact OG1-CB 3.31Å; T82-E84 PolarHBondContact OG1-N 3.46Å |
| 83 | K | 90.3 | Very high | 93.6 | Very high | 182 Ų | 182 | 69.6 Ų | 69.6 | 79% | 0.791 | 35% | 0.347 | S | S | * | . | trans | 59.9 | 12.3 | -170.3 | -54.5 | 173.8 | -176.7 | 169.5 | 0 | 113.6 | D79 | D79-K83 WeakPolarHBondContact O-CA 3.1Å; D79-K83 PolarHBondContact O-N 2.96Å | ||
| 84 | E | 92.3 | Very high | 93.5 | Very high | 63 Ų | 63 | 67.6 Ų | 67.6 | 29% | 0.294 | 34% | 0.343 | S | S | . | . | trans | -73 | 151.9 | 176.1 | -166.8 | 174.7 | 170.2 | 0 | 0 | 110.6 | R78 D79 T82 H86 Q138 | R78-E84 WeakPolarHBondContact CA-O 2.79Å; D79-E84 PolarHBondContact N-O 2.9Å; T82-E84 PolarHBondContact O-N 2.82Å; T82-E84 VanDerWaalsContact O-N 3.16Å; T82-E84 WeakPolarHBondContact OG1-CB 3.31Å; T82-E84 PolarHBondContact OG1-N 3.46Å; E84-H86 IonicContact OE1-CE1 3.78Å; E84-H86 PolarHBondContact OE1-CE1 2.81Å; E84-H86 IonicContact OE1-ND1 3.69Å; E84-H86 IonicContact OE2-CE1 2.98Å; E84-H86 IonicContact OE2-NE2 2.71Å; E84-Q138 PolarHBondContact OE1-NE2 2.85Å | ||
| 85 | R | 93.8 | Very high | 93.5 | Very high | 155 Ų | 155 | 73.1 Ų | 73.1 | 59% | 0.585 | 37% | 0.369 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -112.7 | 121.8 | 175.6 | -55.1 | -174.5 | -172.7 | -173.7 | 2.3 | 108.5 | I77 R78 | I77-R85 WeakPolarHBondContact O-CA 3.29Å; R78-R85 HydrophobicContact CG-CG 4.22Å; R78-R85 VanDerWaalsContact NH1-NE 3.11Å |
| 86 | H | 92.4 | Very high | 93.4 | Very high | 23 Ų | 23 | 77.4 Ų | 77.4 | 11% | 0.106 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.9 | 124.1 | 177.2 | -58.1 | -77.5 | 0 | 0 | 0 | 109.5 | E76 I77 D79 E84 F134 | E76-H86 CarbonylContact C-O 3.55Å; E76-H86 VanDerWaalsContact CA-O 3.26Å; E76-H86 WeakPolarHBondContact CA-O 3.33Å; I77-H86 HydrophobicContact CG2-CB 3.7Å; I77-H86 PolarHBondContact N-O 3.3Å; I77-H86 PolarHBondContact O-N 3.06Å; D79-H86 IonicContact OD1-CD2 3.94Å; D79-H86 PolarHBondContact OD1-CD2 2.97Å; D79-H86 VanDerWaalsContact OD1-CD2 3.26Å; D79-H86 IonicContact OD1-NE2 3.46Å; D79-H86 IonicContact OD2-NE2 3.96Å; E84-H86 IonicContact OE1-CE1 3.78Å; E84-H86 PolarHBondContact OE1-CE1 2.81Å; E84-H86 IonicContact OE1-ND1 3.69Å; E84-H86 IonicContact OE2-CE1 2.98Å; E84-H86 IonicContact OE2-NE2 2.71Å; H86-F134 HydrophobicContact CB-CD1 3.67Å; H86-F134 HydrophobicContact CB-CE1 3.49Å; H86-F134 VanDerWaalsContact CB-CE1 3.49Å; H86-F134 HydrophobicContact CB-CZ 4.42Å; H86-F134 AromaticContact CG-CD1 3.87Å; H86-F134 AromaticContact CG-CE1 3.78Å; H86-F134 AromaticContact ND1-CD1 3.43Å; H86-F134 WeakPolarHBondContact ND1-CD1 3.37Å; H86-F134 AromaticContact ND1-CE1 3.31Å; H86-F134 VanDerWaalsContact ND1-CE1 3.31Å; H86-F134 WeakPolarHBondContact ND1-CE1 3.33Å |
| 87 | W | 94.2 | Very high | 93.5 | Very high | 107 Ų | 107 | 75.2 Ų | 75.2 | 41% | 0.405 | 38% | 0.379 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.4 | 116.2 | 177.8 | 173 | -99.9 | 0 | 0 | 0 | 109.6 | R66 A74 T90 F134 | R66-W87 VanDerWaalsContact NH2-CZ3 3.27Å; A74-W87 HydrophobicContact CB-CH2 3.42Å; A74-W87 VanDerWaalsContact CB-CH2 3.42Å; A74-W87 HydrophobicContact CB-CZ2 4.49Å; A74-W87 HydrophobicContact CB-CZ3 3.67Å; W87-T90 HydrophobicContact CH2-CG2 3.62Å; W87-T90 HydrophobicContact CZ2-CG2 3.41Å; W87-T90 VanDerWaalsContact CZ2-CG2 3.41Å; W87-F134 HydrophobicContact CB-CZ 4.33Å; W87-F134 WeakPolarHBondContact O-CE2 3.28Å |
| 88 | L | 94.9 | Very high | 93.5 | Very high | 47 Ų | 47 | 75 Ų | 75 | 25% | 0.246 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.1 | -28.4 | -176.4 | -57.1 | 177.7 | 0 | 0 | 0 | 112.3 | A75 I77 Y101 A104 | A75-L88 HydrophobicContact CB-CB 4.07Å; A75-L88 HydrophobicContact CB-CD1 4.19Å; A75-L88 WeakPolarHBondContact O-CB 3.47Å; A75-L88 PolarHBondContact O-N 3.04Å; I77-L88 HydrophobicContact CB-CD1 4.18Å; I77-L88 HydrophobicContact CG2-CD1 4.33Å; I77-L88 HydrophobicContact CG2-CD2 3.89Å; I77-L88 HydrophobicContact CG2-CG 4.26Å; L88-Y101 HydrophobicContact CD1-CD2 4.36Å; L88-A104 HydrophobicContact CD1-CB 3.78Å; L88-A104 HydrophobicContact CD2-CB 3.6Å; L88-A104 HydrophobicContact CG-CB 4.35Å |
| 89 | G | 95.6 | Very high | 93.6 | Very high | 13 Ų | 13 | 71.3 Ų | 71.3 | 13% | 0.134 | 37% | 0.367 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 146.3 | 178.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | A74 A75 | A74-G89 WeakPolarHBondContact CA-O 3.11Å; A75-G89 PolarHBondContact N-O 3.12Å; A75-G89 PolarHBondContact O-N 3.31Å |
| 90 | T | 96.3 | Very high | 93.9 | Very high | 60 Ų | 60 | 70 Ų | 70 | 37% | 0.368 | 36% | 0.361 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.5 | 135.6 | 164.5 | 50.4 | 0 | 0 | 0 | 0 | 110.2 | R72 Y73 A74 W87 | R72-T90 PolarHBondContact NH1-OG1 3.34Å; Y73-T90 CarbonylContact O-C 3.45Å; Y73-T90 WeakPolarHBondContact O-CA 3.17Å; A74-T90 HydrophobicContact CB-CG2 4.21Å; W87-T90 HydrophobicContact CH2-CG2 3.62Å; W87-T90 HydrophobicContact CZ2-CG2 3.41Å; W87-T90 VanDerWaalsContact CZ2-CG2 3.41Å |
| 91 | F | 95.8 | Very high | 94.2 | Very high | 28 Ų | 28 | 66.1 Ų | 66.1 | 12% | 0.123 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.5 | 157.5 | -175.6 | -52.9 | -85.6 | 0 | 0 | 0 | 109.6 | Y73 A75 E96 A97 A100 | Y73-F91 PolarHBondContact N-O 2.86Å; Y73-F91 PolarHBondContact O-N 3.26Å; A75-F91 HydrophobicContact CB-CD2 4.37Å; A75-F91 HydrophobicContact CB-CE2 3.89Å; F91-E96 HydrophobicContact CB-CB 4.2Å; F91-E96 HydrophobicContact CB-CG 4.23Å; F91-E96 HydrophobicContact CD1-CB 4.36Å; F91-E96 VanDerWaalsContact CD1-CD 3.49Å; F91-E96 HydrophobicContact CD1-CG 3.56Å; F91-E96 HydrophobicContact CE1-CG 4.27Å; F91-E96 HydrophobicContact CG-CB 4.48Å; F91-E96 HydrophobicContact CG-CG 4.14Å; F91-A97 HydrophobicContact CB-CB 4.02Å; F91-A97 HydrophobicContact CD2-CB 3.5Å; F91-A97 HydrophobicContact CE2-CB 4.32Å; F91-A97 HydrophobicContact CG-CB 4.02Å; F91-A100 HydrophobicContact CE1-CB 4.05Å; F91-A100 HydrophobicContact CE2-CB 3.74Å; F91-A100 HydrophobicContact CZ-CB 3.34Å |
| 92 | D | 94.8 | Very high | 94.5 | Very high | 110 Ų | 110 | 59.9 Ų | 59.9 | 59% | 0.588 | 29% | 0.293 | S | S | * | . | S | Bend | trans | -85.2 | -24.7 | -177.5 | -59.1 | -28.1 | 0 | 0 | 0 | 111 | R72 Y73 | R72-D92 IonicContact CZ-OD1 3.58Å; R72-D92 VanDerWaalsContact CZ-OD1 3.3Å; R72-D92 IonicContact NE-OD1 3.26Å; R72-D92 PolarHBondContact NE-OD1 2.93Å; R72-D92 IonicContact NH2-OD1 2.84Å; R72-D92 PolarHBondContact NH2-OD1 2.71Å; Y73-D92 WeakPolarHBondContact CD2-O 3.44Å; Y73-D92 WeakPolarHBondContact CE2-O 3.4Å |
| 93 | T | 95.4 | Very high | 94.6 | Very high | 71 Ų | 71 | 61 Ų | 61 | 44% | 0.436 | 29% | 0.288 | S | S | . | . | S | Bend | trans | -114.2 | 150.8 | 175.7 | 74.5 | 0 | 0 | 0 | 0 | 112.6 | Q95 E96 A97 | T93-Q95 VanDerWaalsContact C-N 3.3Å; T93-E96 WeakPolarHBondContact OG1-CB 3.34Å; T93-E96 PolarHBondContact OG1-N 3.36Å; T93-E96 VanDerWaalsContact OG1-N 3.09Å; T93-A97 PolarHBondContact O-N 3.49Å |
| 94 | A | 94.7 | Very high | 94.8 | Very high | 19 Ų | 19 | 53.1 Ų | 53.1 | 16% | 0.157 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -67.4 | -34.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | F62 Y73 A98 | F62-A94 HydrophobicContact CD2-CB 3.74Å; F62-A94 WeakPolarHBondContact CD2-O 3.26Å; F62-A94 HydrophobicContact CE2-CB 3.77Å; Y73-A94 HydrophobicContact CD1-CB 3.71Å; Y73-A94 HydrophobicContact CD2-CB 4.37Å; Y73-A94 HydrophobicContact CE1-CB 3.54Å; Y73-A94 HydrophobicContact CE2-CB 4.24Å; Y73-A94 HydrophobicContact CG-CB 4.13Å; A94-A98 WeakPolarHBondContact O-CB 3.41Å; A94-A98 PolarHBondContact O-N 3.42Å |
| 95 | Q | 94.7 | Very high | 94.8 | Very high | 118 Ų | 118 | 50.5 Ų | 50.5 | 55% | 0.551 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -67.3 | -45.7 | 179.2 | 177.8 | 178 | -19.2 | 0 | 0 | 111.8 | T93 A97 A98 L99 F117 | T93-Q95 VanDerWaalsContact C-N 3.3Å; Q95-A97 VanDerWaalsContact C-N 3.34Å; Q95-A97 PolarHBondContact O-N 2.98Å; Q95-A98 WeakPolarHBondContact O-CB 3.3Å; Q95-A98 PolarHBondContact O-N 2.95Å; Q95-A98 VanDerWaalsContact O-N 3.17Å; Q95-L99 HydrophobicContact CG-CD1 4.38Å; Q95-L99 WeakPolarHBondContact O-CG 3.38Å; Q95-L99 PolarHBondContact O-N 3.31Å; Q95-F117 HydrophobicContact CG-CZ 3.97Å |
| 96 | E | 94.7 | Very high | 94.8 | Very high | 89 Ų | 89 | 44.2 Ų | 44.2 | 42% | 0.416 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -62.6 | -42.6 | 177.1 | -173.2 | -172.8 | -174.3 | 0 | 0 | 111.5 | F91 T93 A98 L99 A100 | F91-E96 HydrophobicContact CB-CB 4.2Å; F91-E96 HydrophobicContact CB-CG 4.23Å; F91-E96 HydrophobicContact CD1-CB 4.36Å; F91-E96 VanDerWaalsContact CD1-CD 3.49Å; F91-E96 HydrophobicContact CD1-CG 3.56Å; F91-E96 HydrophobicContact CE1-CG 4.27Å; F91-E96 HydrophobicContact CG-CB 4.48Å; F91-E96 HydrophobicContact CG-CG 4.14Å; T93-E96 WeakPolarHBondContact OG1-CB 3.34Å; T93-E96 PolarHBondContact OG1-N 3.36Å; T93-E96 VanDerWaalsContact OG1-N 3.09Å; E96-A98 VanDerWaalsContact C-N 3.31Å; E96-A98 PolarHBondContact O-N 2.89Å; E96-L99 PolarHBondContact O-N 3.27Å; E96-A100 PolarHBondContact O-N 3.48Å |
| 97 | A | 96 | Very high | 94.6 | Very high | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -59.5 | -41.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | V65 A75 F91 T93 Q95 A100 Y101 | V65-A97 HydrophobicContact CB-CB 4.38Å; V65-A97 HydrophobicContact CG1-CB 3.8Å; V65-A97 HydrophobicContact CG2-CB 3.66Å; A75-A97 HydrophobicContact CB-CB 4.24Å; A75-A97 WeakPolarHBondContact CB-O 3.44Å; F91-A97 HydrophobicContact CB-CB 4.02Å; F91-A97 HydrophobicContact CD2-CB 3.5Å; F91-A97 HydrophobicContact CE2-CB 4.32Å; F91-A97 HydrophobicContact CG-CB 4.02Å; T93-A97 PolarHBondContact O-N 3.49Å; Q95-A97 VanDerWaalsContact C-N 3.34Å; Q95-A97 PolarHBondContact O-N 2.98Å; A97-A100 PolarHBondContact O-N 3.27Å; A97-Y101 PolarHBondContact O-N 2.98Å |
| 98 | A | 95.7 | Very high | 94.4 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.1 | -40.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | F62 V65 A94 Q95 E96 A100 Y101 D102 N116 F117 | F62-A98 HydrophobicContact CB-CB 3.58Å; F62-A98 HydrophobicContact CD1-CB 3.77Å; F62-A98 HydrophobicContact CD2-CB 4.05Å; F62-A98 HydrophobicContact CE1-CB 4.46Å; F62-A98 HydrophobicContact CG-CB 3.53Å; V65-A98 HydrophobicContact CG2-CB 4.06Å; A94-A98 WeakPolarHBondContact O-CB 3.41Å; A94-A98 PolarHBondContact O-N 3.42Å; Q95-A98 WeakPolarHBondContact O-CB 3.3Å; Q95-A98 PolarHBondContact O-N 2.95Å; Q95-A98 VanDerWaalsContact O-N 3.17Å; E96-A98 VanDerWaalsContact C-N 3.31Å; E96-A98 PolarHBondContact O-N 2.89Å; A98-A100 VanDerWaalsContact C-N 3.33Å; A98-A100 PolarHBondContact O-N 2.85Å; A98-Y101 WeakPolarHBondContact O-CB 3.16Å; A98-Y101 PolarHBondContact O-N 3.3Å; A98-D102 PolarHBondContact O-N 3.48Å; A98-N116 HydrophobicContact CB-CB 4.14Å; A98-F117 HydrophobicContact CB-CE2 3.75Å; A98-F117 HydrophobicContact CB-CZ 4Å |
| 99 | L | 95.3 | Very high | 94.1 | Very high | 49 Ų | 49 | 51.3 Ų | 51.3 | 26% | 0.257 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -63.2 | -40.1 | 174.8 | -72.5 | 170.5 | 0 | 0 | 0 | 111.5 | Q95 E96 Y101 D102 R103 F117 | Q95-L99 HydrophobicContact CG-CD1 4.38Å; Q95-L99 WeakPolarHBondContact O-CG 3.38Å; Q95-L99 PolarHBondContact O-N 3.31Å; E96-L99 PolarHBondContact O-N 3.27Å; L99-Y101 VanDerWaalsContact C-N 3.34Å; L99-D102 PolarHBondContact O-N 3Å; L99-R103 WeakPolarHBondContact O-CG 3.21Å; L99-R103 PolarHBondContact O-N 3.08Å; L99-R103 PolarHBondContact O-NH1 3.08Å; L99-F117 HydrophobicContact CD2-CD2 3.54Å; L99-F117 HydrophobicContact CD2-CE2 3.55Å; L99-F117 HydrophobicContact CD2-CG 4.44Å; L99-F117 HydrophobicContact CD2-CZ 4.44Å; L99-F117 HydrophobicContact CG-CD2 4.22Å; L99-F117 HydrophobicContact CG-CE2 3.69Å; L99-F117 HydrophobicContact CG-CZ 4.42Å |
| 100 | A | 95.2 | Very high | 93.7 | Very high | 7 Ų | 7 | 52.4 Ų | 52.4 | 6% | 0.058 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62.8 | -42.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | F91 E96 A97 A98 A104 | F91-A100 HydrophobicContact CE1-CB 4.05Å; F91-A100 HydrophobicContact CE2-CB 3.74Å; F91-A100 HydrophobicContact CZ-CB 3.34Å; E96-A100 PolarHBondContact O-N 3.48Å; A97-A100 PolarHBondContact O-N 3.27Å; A98-A100 VanDerWaalsContact C-N 3.33Å; A98-A100 PolarHBondContact O-N 2.85Å; A100-A104 PolarHBondContact O-N 3.33Å; A100-A104 VanDerWaalsContact O-N 3.16Å |
| 101 | Y | 96.1 | Very high | 93.3 | Very high | 34 Ų | 34 | 52.7 Ų | 52.7 | 13% | 0.133 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.1 | -46.1 | 173.5 | 179.7 | -90.8 | 0 | 0 | 0 | 112.2 | L63 G64 E76 I77 L88 A97 A98 L99 R103 A104 A105 | L63-Y101 HydrophobicContact CB-CD1 4.17Å; L63-Y101 HydrophobicContact CB-CE1 3.82Å; G64-Y101 VanDerWaalsContact CA-CD2 3.47Å; E76-Y101 WeakPolarHBondContact O-CD2 3.48Å; I77-Y101 HydrophobicContact CB-CD2 4.35Å; I77-Y101 HydrophobicContact CB-CE2 4.21Å; I77-Y101 HydrophobicContact CD1-CE2 4.27Å; I77-Y101 HydrophobicContact CG1-CE2 4.06Å; L88-Y101 HydrophobicContact CD1-CD2 4.36Å; A97-Y101 PolarHBondContact O-N 2.98Å; A98-Y101 WeakPolarHBondContact O-CB 3.16Å; A98-Y101 PolarHBondContact O-N 3.3Å; L99-Y101 VanDerWaalsContact C-N 3.34Å; Y101-R103 PolarHBondContact O-N 3.16Å; Y101-A104 PolarHBondContact O-N 3.42Å; Y101-A105 HydrophobicContact CE1-CB 4.2Å; Y101-A105 WeakPolarHBondContact O-CB 3.37Å; Y101-A105 PolarHBondContact O-N 3.36Å |
| 102 | D | 95.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -62.6 | -44.5 | -178.9 | -75.7 | 5.5 | 0 | 0 | 0 | 111.5 | A98 L99 A104 A105 L106 T115 N116 F117 Y119 | A98-D102 PolarHBondContact O-N 3.48Å; L99-D102 PolarHBondContact O-N 3Å; D102-A104 PolarHBondContact O-N 3.49Å; D102-A105 PolarHBondContact O-N 2.74Å; D102-L106 WeakPolarHBondContact O-CB 3.37Å; D102-L106 WeakPolarHBondContact O-CG 3.43Å; D102-L106 PolarHBondContact O-N 3.33Å; D102-T115 HydrophobicContact CB-CG2 4.03Å; D102-T115 VanDerWaalsContact CG-CB 3.48Å; D102-T115 VanDerWaalsContact OD1-CA 3.31Å; D102-T115 WeakPolarHBondContact OD1-CA 3.36Å; D102-T115 WeakPolarHBondContact OD2-CB 3.49Å; D102-N116 PolarHBondContact OD1-N 2.9Å; D102-N116 PolarHBondContact OD1-ND2 3.48Å; D102-N116 WeakPolarHBondContact OD2-CA 3.03Å; D102-N116 WeakPolarHBondContact OD2-CB 3.2Å; D102-N116 PolarHBondContact OD2-N 3.26Å; D102-F117 WeakPolarHBondContact OD2-CD2 3.17Å; D102-F117 PolarHBondContact OD2-N 3.06Å; D102-Y119 HydrophobicContact CB-CE2 3.77Å; D102-Y119 WeakPolarHBondContact CB-OH 3.2Å; D102-Y119 WeakPolarHBondContact OD2-CE2 3.11Å; D102-Y119 PolarHBondContact OD2-OH 3.02Å; D102-Y119 VanDerWaalsContact OD2-OH 3.1Å |
| 103 | R | 93.6 | Very high | 92.7 | Very high | 105 Ų | 105 | 53.8 Ų | 53.8 | 40% | 0.396 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -56.2 | -49.2 | 174.1 | -71.4 | -169.3 | -54 | -85.9 | 7.3 | 111.7 | L99 Y101 A105 L106 S107 | L99-R103 WeakPolarHBondContact O-CG 3.21Å; L99-R103 PolarHBondContact O-N 3.08Å; L99-R103 PolarHBondContact O-NH1 3.08Å; Y101-R103 PolarHBondContact O-N 3.16Å; R103-A105 PolarHBondContact O-N 3.24Å; R103-L106 PolarHBondContact O-N 3.41Å; R103-S107 PolarHBondContact O-N 2.91Å; R103-S107 PolarHBondContact O-OG 2.78Å; R103-S107 VanDerWaalsContact O-OG 3.09Å |
| 104 | A | 93.9 | Very high | 92.5 | Very high | 18 Ų | 18 | 59 Ų | 59 | 15% | 0.149 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -64.1 | -41.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | I77 L88 A100 Y101 D102 L106 S107 M108 | I77-A104 HydrophobicContact CD1-CB 3.92Å; I77-A104 HydrophobicContact CG2-CB 4.23Å; L88-A104 HydrophobicContact CD1-CB 3.78Å; L88-A104 HydrophobicContact CD2-CB 3.6Å; L88-A104 HydrophobicContact CG-CB 4.35Å; A100-A104 PolarHBondContact O-N 3.33Å; A100-A104 VanDerWaalsContact O-N 3.16Å; Y101-A104 PolarHBondContact O-N 3.42Å; D102-A104 PolarHBondContact O-N 3.49Å; A104-L106 VanDerWaalsContact C-N 3.32Å; A104-L106 PolarHBondContact O-N 3.02Å; A104-S107 PolarHBondContact O-N 2.91Å; A104-M108 WeakPolarHBondContact O-CG 3.48Å; A104-M108 PolarHBondContact O-N 2.94Å |
| 105 | A | 93.5 | Very high | 92.4 | Very high | 7 Ų | 7 | 59.4 Ų | 59.4 | 6% | 0.058 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -63.6 | -40.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | I77 Y101 D102 R103 M108 K109 A113 | I77-A105 VanDerWaalsContact CD1-CA 3.45Å; I77-A105 HydrophobicContact CD1-CB 3.82Å; Y101-A105 HydrophobicContact CE1-CB 4.2Å; Y101-A105 WeakPolarHBondContact O-CB 3.37Å; Y101-A105 PolarHBondContact O-N 3.36Å; D102-A105 PolarHBondContact O-N 2.74Å; R103-A105 PolarHBondContact O-N 3.24Å; A105-M108 PolarHBondContact O-N 3.21Å; A105-K109 PolarHBondContact O-N 2.84Å; A105-A113 VanDerWaalsContact C-CB 3.44Å; A105-A113 HydrophobicContact CB-CB 4Å; A105-A113 WeakPolarHBondContact O-CB 3.46Å |
| 106 | L | 92.1 | Very high | 92.3 | Very high | 23 Ų | 23 | 54.6 Ų | 54.6 | 12% | 0.12 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -64.7 | -43.1 | 174 | -69.8 | 175.2 | 0 | 0 | 0 | 111.9 | D102 R103 A104 M108 G110 A113 T115 Y119 Y124 | D102-L106 WeakPolarHBondContact O-CB 3.37Å; D102-L106 WeakPolarHBondContact O-CG 3.43Å; D102-L106 PolarHBondContact O-N 3.33Å; R103-L106 PolarHBondContact O-N 3.41Å; A104-L106 VanDerWaalsContact C-N 3.32Å; A104-L106 PolarHBondContact O-N 3.02Å; L106-M108 VanDerWaalsContact C-N 3.27Å; L106-M108 PolarHBondContact O-N 3.1Å; L106-G110 WeakPolarHBondContact CD2-O 3.38Å; L106-G110 WeakPolarHBondContact O-CA 3.39Å; L106-G110 PolarHBondContact O-N 3.08Å; L106-A113 HydrophobicContact CD2-CB 3.86Å; L106-A113 HydrophobicContact CG-CB 4.43Å; L106-T115 HydrophobicContact CD1-CG2 4.45Å; L106-T115 HydrophobicContact CD2-CG2 3.98Å; L106-T115 HydrophobicContact CG-CG2 3.99Å; L106-Y119 HydrophobicContact CD1-CD2 3.97Å; L106-Y119 HydrophobicContact CD1-CE2 4.05Å; L106-Y119 HydrophobicContact CD1-CG 4.42Å; L106-Y124 HydrophobicContact CD1-CD1 4.12Å; L106-Y124 HydrophobicContact CD1-CE1 4.3Å; L106-Y124 HydrophobicContact CD2-CD1 3.59Å; L106-Y124 HydrophobicContact CD2-CE1 3.25Å; L106-Y124 HydrophobicContact CG-CD1 4.41Å; L106-Y124 HydrophobicContact CG-CE1 4.4Å |
| 107 | S | 90 | Very high | 92.2 | Very high | 108 Ų | 108 | 53.2 Ų | 53.2 | 76% | 0.755 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -62.7 | -33.1 | 175.2 | -59 | 0 | 0 | 0 | 0 | 112.9 | R103 A104 | R103-S107 PolarHBondContact O-N 2.91Å; R103-S107 PolarHBondContact O-OG 2.78Å; R103-S107 VanDerWaalsContact O-OG 3.09Å; A104-S107 PolarHBondContact O-N 2.91Å |
| 108 | M | 88.2 | Confident | 91.8 | Very high | 81 Ų | 81 | 60 Ų | 60 | 40% | 0.399 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -85 | -39.9 | -178 | -71.8 | 170.1 | 46.4 | 0 | 0 | 114.6 | I77 D79 A104 A105 L106 | I77-M108 HydrophobicContact CB-SD 4.33Å; I77-M108 HydrophobicContact CD1-CE 3.99Å; I77-M108 HydrophobicContact CD1-SD 3.29Å; I77-M108 WeakPolarHBondContact CD1-SD 3.1Å; I77-M108 HydrophobicContact CG1-CE 3.93Å; I77-M108 HydrophobicContact CG1-SD 3.57Å; I77-M108 VanDerWaalsContact CG1-SD 3.57Å; I77-M108 HydrophobicContact CG2-SD 3.82Å; D79-M108 HydrophobicContact CB-CE 4.29Å; D79-M108 VanDerWaalsContact CG-CE 3.47Å; D79-M108 WeakPolarHBondContact OD1-CE 3.42Å; D79-M108 VanDerWaalsContact OD1-SD 3.4Å; A104-M108 WeakPolarHBondContact O-CG 3.48Å; A104-M108 PolarHBondContact O-N 2.94Å; A105-M108 PolarHBondContact O-N 3.21Å; L106-M108 VanDerWaalsContact C-N 3.27Å; L106-M108 PolarHBondContact O-N 3.1Å |
| 109 | K | 89.5 | Confident | 91.3 | Very high | 138 Ų | 138 | 60.7 Ų | 60.7 | 60% | 0.6 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -113.8 | -4.5 | -173.2 | -168.9 | 168.5 | 179.6 | -134.5 | 0 | 113.3 | A105 Q112 A113 | A105-K109 PolarHBondContact O-N 2.84Å; K109-Q112 WeakPolarHBondContact CD-O 3.38Å; K109-Q112 VanDerWaalsContact CE-O 3.3Å; K109-Q112 WeakPolarHBondContact CE-O 3.19Å; K109-Q112 HydrophobicContact CG-CB 4.34Å; K109-Q112 PolarHBondContact NZ-O 2.97Å; K109-A113 HydrophobicContact CB-CB 3.99Å |
| 110 | G | 87.6 | Confident | 90.6 | Very high | 35 Ų | 35 | 62.9 Ų | 62.9 | 36% | 0.361 | 34% | 0.337 | S | S | . | . | G | 310 helix | trans | 68.7 | -151.5 | -175.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | L106 Q112 A113 | L106-G110 WeakPolarHBondContact CD2-O 3.38Å; L106-G110 WeakPolarHBondContact O-CA 3.39Å; L106-G110 PolarHBondContact O-N 3.08Å; G110-Q112 PolarHBondContact O-N 3.17Å; G110-A113 WeakPolarHBondContact O-CB 3.45Å; G110-A113 PolarHBondContact O-N 3.42Å |
| 111 | A | 87.1 | Confident | 89.1 | Confident | 66 Ų | 66 | 70 Ų | 70 | 55% | 0.545 | 37% | 0.369 | S | S | . | . | G | 310 helix | trans | -60.6 | -15.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | A113 Y124 | A111-A113 VanDerWaalsContact C-N 3.31Å; A111-Y124 HydrophobicContact CB-CE1 4.24Å |
| 112 | Q | 87.2 | Confident | 87.3 | Confident | 147 Ų | 147 | 72.3 Ų | 72.3 | 69% | 0.687 | 40% | 0.395 | S | S | * | . | G | 310 helix | trans | -89.6 | 7.8 | 178.5 | -63.3 | -65.1 | -42.6 | 0 | 0 | 113 | K109 G110 | K109-Q112 WeakPolarHBondContact CD-O 3.38Å; K109-Q112 VanDerWaalsContact CE-O 3.3Å; K109-Q112 WeakPolarHBondContact CE-O 3.19Å; K109-Q112 HydrophobicContact CG-CB 4.34Å; K109-Q112 PolarHBondContact NZ-O 2.97Å; G110-Q112 PolarHBondContact O-N 3.17Å |
| 113 | A | 90.7 | Very high | 85.6 | Confident | 14 Ų | 14 | 73.2 Ų | 73.2 | 12% | 0.116 | 40% | 0.403 | C | S | . | . | trans | -66.7 | 147.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | A105 L106 K109 G110 A111 T115 | A105-A113 VanDerWaalsContact C-CB 3.44Å; A105-A113 HydrophobicContact CB-CB 4Å; A105-A113 WeakPolarHBondContact O-CB 3.46Å; L106-A113 HydrophobicContact CD2-CB 3.86Å; L106-A113 HydrophobicContact CG-CB 4.43Å; K109-A113 HydrophobicContact CB-CB 3.99Å; G110-A113 WeakPolarHBondContact O-CB 3.45Å; G110-A113 PolarHBondContact O-N 3.42Å; A111-A113 VanDerWaalsContact C-N 3.31Å; A113-T115 HydrophobicContact CB-CG2 4.35Å; A113-T115 PolarHBondContact O-N 3.36Å | ||
| 114 | R | 91.7 | Very high | 83.8 | Confident | 180 Ų | 180 | 71.4 Ų | 71.4 | 68% | 0.679 | 40% | 0.397 | S | S | * | . | trans | -89.8 | 107.5 | 171.7 | -169 | 179.2 | 71.4 | -176.8 | 5.1 | 109.1 | L63 | L63-R114 HydrophobicContact CD2-CG 3.88Š| ||
| 115 | T | 92.7 | Very high | 81.9 | Confident | 29 Ų | 29 | 77.8 Ų | 77.8 | 18% | 0.178 | 43% | 0.428 | C | S | . | . | trans | -105.7 | 168.9 | -176.3 | 54.8 | 0 | 0 | 0 | 0 | 112.5 | D102 L106 A113 F117 Y119 | D102-T115 HydrophobicContact CB-CG2 4.03Å; D102-T115 VanDerWaalsContact CG-CB 3.48Å; D102-T115 VanDerWaalsContact OD1-CA 3.31Å; D102-T115 WeakPolarHBondContact OD1-CA 3.36Å; D102-T115 WeakPolarHBondContact OD2-CB 3.49Å; L106-T115 HydrophobicContact CD1-CG2 4.45Å; L106-T115 HydrophobicContact CD2-CG2 3.98Å; L106-T115 HydrophobicContact CG-CG2 3.99Å; A113-T115 HydrophobicContact CB-CG2 4.35Å; A113-T115 PolarHBondContact O-N 3.36Å; T115-F117 PolarHBondContact OG1-O 3.05Å; T115-Y119 HydrophobicContact CG2-CD2 3.93Å; T115-Y119 HydrophobicContact CG2-CE2 3.71Å | ||
| 116 | N | 93.4 | Very high | 80 | Confident | 17 Ų | 17 | 83.7 Ų | 83.7 | 9% | 0.091 | 46% | 0.459 | C | S | . | . | S | Bend | trans | -82.4 | -37.5 | 171.4 | -69.1 | -76.3 | 0 | 0 | 0 | 111.8 | F62 L63 A98 D102 | F62-N116 VanDerWaalsContact CA-OD1 3.28Å; F62-N116 WeakPolarHBondContact CA-OD1 3.45Å; F62-N116 WeakPolarHBondContact CB-OD1 3.4Å; F62-N116 HydrophobicContact CD1-CB 4.03Å; L63-N116 WeakPolarHBondContact CB-OD1 3.31Å; L63-N116 WeakPolarHBondContact CD1-OD1 3.16Å; L63-N116 PolarHBondContact N-OD1 3.29Å; L63-N116 PolarHBondContact O-ND2 2.93Å; A98-N116 HydrophobicContact CB-CB 4.14Å; D102-N116 PolarHBondContact OD1-N 2.9Å; D102-N116 PolarHBondContact OD1-ND2 3.48Å; D102-N116 WeakPolarHBondContact OD2-CA 3.03Å; D102-N116 WeakPolarHBondContact OD2-CB 3.2Å; D102-N116 PolarHBondContact OD2-N 3.26Å |
| 117 | F | 91.2 | Very high | 78.1 | Confident | 60 Ų | 60 | 87.3 Ų | 87.3 | 26% | 0.263 | 47% | 0.472 | S | S | . | . | S | Bend | trans | -108.3 | 158.7 | -178.6 | -51.6 | -75.2 | 0 | 0 | 0 | 112.1 | F62 Q95 A98 L99 D102 T115 Y119 | F62-F117 HydrophobicContact CE1-CE1 4.22Å; F62-F117 HydrophobicContact CE1-CZ 4.07Å; Q95-F117 HydrophobicContact CG-CZ 3.97Å; A98-F117 HydrophobicContact CB-CE2 3.75Å; A98-F117 HydrophobicContact CB-CZ 4Å; L99-F117 HydrophobicContact CD2-CD2 3.54Å; L99-F117 HydrophobicContact CD2-CE2 3.55Å; L99-F117 HydrophobicContact CD2-CG 4.44Å; L99-F117 HydrophobicContact CD2-CZ 4.44Å; L99-F117 HydrophobicContact CG-CD2 4.22Å; L99-F117 HydrophobicContact CG-CE2 3.69Å; L99-F117 HydrophobicContact CG-CZ 4.42Å; D102-F117 WeakPolarHBondContact OD2-CD2 3.17Å; D102-F117 PolarHBondContact OD2-N 3.06Å; T115-F117 PolarHBondContact OG1-O 3.05Å; F117-Y119 HydrophobicContact CB-CE1 4.32Å; F117-Y119 HydrophobicContact CB-CE2 4.19Å; F117-Y119 WeakPolarHBondContact O-CD2 3.48Å; F117-Y119 WeakPolarHBondContact O-CE2 3.31Å |
| 118 | V | 89 | Confident | 76.1 | Confident | 142 Ų | 142 | 85.4 Ų | 85.4 | 86% | 0.861 | 46% | 0.457 | S | S | * | . | trans | -84.3 | 120.8 | 175.4 | -179.2 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 119 | Y | 84.8 | Confident | 74.1 | Confident | 15 Ų | 15 | 87.7 Ų | 87.7 | 6% | 0.059 | 48% | 0.478 | C | S | . | . | trans | -109.9 | 120.1 | 175.1 | -58.7 | -69.2 | 0 | 0 | 0 | 108.8 | D102 L106 T115 F117 Y124 Y127 | D102-Y119 HydrophobicContact CB-CE2 3.77Å; D102-Y119 WeakPolarHBondContact CB-OH 3.2Å; D102-Y119 WeakPolarHBondContact OD2-CE2 3.11Å; D102-Y119 PolarHBondContact OD2-OH 3.02Å; D102-Y119 VanDerWaalsContact OD2-OH 3.1Å; L106-Y119 HydrophobicContact CD1-CD2 3.97Å; L106-Y119 HydrophobicContact CD1-CE2 4.05Å; L106-Y119 HydrophobicContact CD1-CG 4.42Å; T115-Y119 HydrophobicContact CG2-CD2 3.93Å; T115-Y119 HydrophobicContact CG2-CE2 3.71Å; F117-Y119 HydrophobicContact CB-CE1 4.32Å; F117-Y119 HydrophobicContact CB-CE2 4.19Å; F117-Y119 WeakPolarHBondContact O-CD2 3.48Å; F117-Y119 WeakPolarHBondContact O-CE2 3.31Å; Y119-Y124 WeakPolarHBondContact O-CE2 3.5Å; Y119-Y124 PolarHBondContact O-OH 3.49Å; Y119-Y127 HydrophobicContact CD1-CD2 4.46Å; Y119-Y127 AromaticContact CD1-CE2 3.35Å; Y119-Y127 HydrophobicContact CD1-CE2 3.35Å; Y119-Y127 AromaticContact CD1-CZ 3.64Å; Y119-Y127 VanDerWaalsContact CD1-OH 3.31Å; Y119-Y127 WeakPolarHBondContact CD1-OH 3.18Å; Y119-Y127 HydrophobicContact CE1-CD2 4.43Å; Y119-Y127 HydrophobicContact CE1-CE1 4.32Å; Y119-Y127 AromaticContact CE1-CE2 3.44Å; Y119-Y127 HydrophobicContact CE1-CE2 3.44Å; Y119-Y127 VanDerWaalsContact CE1-CE2 3.44Å; Y119-Y127 AromaticContact CE1-CZ 3.39Å; Y119-Y127 WeakPolarHBondContact CE1-OH 3.4Å; Y119-Y127 HydrophobicContact CG-CE2 4.37Å | ||
| 120 | T | 80 | Confident | 71.6 | Confident | 94 Ų | 94 | 89.1 Ų | 89.1 | 58% | 0.577 | 48% | 0.484 | S | S | * | . | trans | -73.7 | 151.7 | 168.5 | 58.9 | 0 | 0 | 0 | 0 | 108.6 | A122 A123 Y124 | T120-A122 PolarHBondContact O-N 3.26Å; T120-A123 WeakPolarHBondContact O-CB 3.32Å; T120-A123 PolarHBondContact O-N 2.78Å; T120-Y124 WeakPolarHBondContact O-CD2 3.49Å; T120-Y124 VanDerWaalsContact O-CE2 3.32Å; T120-Y124 WeakPolarHBondContact O-CE2 3.39Å | ||
| 121 | H | 63.4 | Low | 69.6 | Low | 156 Ų | 156 | 95.3 Ų | 95.3 | 72% | 0.722 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -50 | -33.5 | -176.5 | -169.1 | -2.6 | 0 | 0 | 0 | 112.9 | A123 Y124 | H121-A123 VanDerWaalsContact C-N 3.33Å; H121-A123 PolarHBondContact O-N 3.27Å; H121-Y124 VanDerWaalsContact CA-CD2 3.48Å |
| 122 | A | 58.9 | Low | 67.6 | Low | 83 Ų | 83 | 98.2 Ų | 98.2 | 69% | 0.686 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -66.3 | -27.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | T120 | T120-A122 PolarHBondContact O-N 3.26Å |
| 123 | A | 58.8 | Low | 65.5 | Low | 20 Ų | 20 | 97 Ų | 97 | 17% | 0.165 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -81.3 | -25.1 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | T120 H121 N125 N126 Y127 | T120-A123 WeakPolarHBondContact O-CB 3.32Å; T120-A123 PolarHBondContact O-N 2.78Å; H121-A123 VanDerWaalsContact C-N 3.33Å; H121-A123 PolarHBondContact O-N 3.27Å; A123-N125 PolarHBondContact O-N 2.98Å; A123-N126 PolarHBondContact O-N 3.27Å; A123-N126 VanDerWaalsContact O-N 3.08Å; A123-Y127 HydrophobicContact CB-CE2 3.94Å; A123-Y127 WeakPolarHBondContact O-CD2 3.38Å; A123-Y127 WeakPolarHBondContact O-CE2 3.18Å |
| 124 | Y | 56.9 | Low | 63.4 | Low | 67 Ų | 67 | 100.9 Ų | 100.9 | 26% | 0.263 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.7 | -32.7 | -178.7 | -67 | -99.3 | 0 | 0 | 0 | 112.5 | L106 A111 Y119 T120 H121 | L106-Y124 HydrophobicContact CD1-CD1 4.12Å; L106-Y124 HydrophobicContact CD1-CE1 4.3Å; L106-Y124 HydrophobicContact CD2-CD1 3.59Å; L106-Y124 HydrophobicContact CD2-CE1 3.25Å; L106-Y124 HydrophobicContact CG-CD1 4.41Å; L106-Y124 HydrophobicContact CG-CE1 4.4Å; A111-Y124 HydrophobicContact CB-CE1 4.24Å; Y119-Y124 WeakPolarHBondContact O-CE2 3.5Å; Y119-Y124 PolarHBondContact O-OH 3.49Å; T120-Y124 WeakPolarHBondContact O-CD2 3.49Å; T120-Y124 VanDerWaalsContact O-CE2 3.32Å; T120-Y124 WeakPolarHBondContact O-CE2 3.39Å; H121-Y124 VanDerWaalsContact CA-CD2 3.48Å |
| 125 | N | 54.2 | Low | 61.6 | Low | 151 Ų | 151 | 100.1 Ų | 100.1 | 81% | 0.807 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.4 | -10.4 | 179.5 | -73.9 | 1.2 | 0 | 0 | 0 | 113.6 | A123 | A123-N125 PolarHBondContact O-N 2.98Š|
| 126 | N | 53.2 | Low | 59.5 | Low | 132 Ų | 132 | 107.4 Ų | 107.4 | 71% | 0.706 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -111.5 | 15.9 | -173.4 | -152.4 | 24.4 | 0 | 0 | 0 | 113.8 | A123 P128 | A123-N126 PolarHBondContact O-N 3.27Å; A123-N126 VanDerWaalsContact O-N 3.08Å; N126-P128 WeakPolarHBondContact O-CD 3.48Å |
| 127 | Y | 51.7 | Low | 57.3 | Low | 98 Ų | 98 | 111.4 Ų | 111.4 | 38% | 0.384 | 59% | 0.592 | S | S | . | * | S | Bend | trans | -92.5 | 97 | 161.3 | -67.5 | -70.3 | 0 | 0 | 0 | 107.7 | Y119 A123 | Y119-Y127 HydrophobicContact CD1-CD2 4.46Å; Y119-Y127 AromaticContact CD1-CE2 3.35Å; Y119-Y127 HydrophobicContact CD1-CE2 3.35Å; Y119-Y127 AromaticContact CD1-CZ 3.64Å; Y119-Y127 VanDerWaalsContact CD1-OH 3.31Å; Y119-Y127 WeakPolarHBondContact CD1-OH 3.18Å; Y119-Y127 HydrophobicContact CE1-CD2 4.43Å; Y119-Y127 HydrophobicContact CE1-CE1 4.32Å; Y119-Y127 AromaticContact CE1-CE2 3.44Å; Y119-Y127 HydrophobicContact CE1-CE2 3.44Å; Y119-Y127 VanDerWaalsContact CE1-CE2 3.44Å; Y119-Y127 AromaticContact CE1-CZ 3.39Å; Y119-Y127 WeakPolarHBondContact CE1-OH 3.4Å; Y119-Y127 HydrophobicContact CG-CE2 4.37Å; A123-Y127 HydrophobicContact CB-CE2 3.94Å; A123-Y127 WeakPolarHBondContact O-CD2 3.38Å; A123-Y127 WeakPolarHBondContact O-CE2 3.18Å |
| 128 | P | 47.9 | Very low | 55.4 | Low | 69 Ų | 69 | 115.7 Ų | 115.7 | 45% | 0.448 | 61% | 0.613 | S | S | . | * | trans | -63.5 | 136.2 | -174.5 | 28.1 | -36.2 | 0 | 0 | 0 | 109.7 | N126 F130 | N126-P128 WeakPolarHBondContact O-CD 3.48Å; P128-F130 HydrophobicContact CB-CD2 3.38Å; P128-F130 HydrophobicContact CB-CE2 3.23Å; P128-F130 HydrophobicContact CB-CG 4.31Å; P128-F130 HydrophobicContact CB-CZ 4.05Å; P128-F130 HydrophobicContact CG-CD2 3.57Å; P128-F130 HydrophobicContact CG-CE2 3.67Å; P128-F130 PolarHBondContact O-N 2.88Å | ||
| 129 | P | 46 | Very low | 53.4 | Low | 129 Ų | 129 | 118 Ų | 118 | 84% | 0.838 | 62% | 0.615 | S | S | * | * | trans | -75.7 | 64.9 | 175.7 | 34.1 | -35.2 | 0 | 0 | 0 | 109 | ||||
| 130 | F | 38 | Very low | 51.5 | Low | 168 Ų | 168 | 124.3 Ų | 124.3 | 74% | 0.737 | 64% | 0.644 | S | S | * | * | trans | -94.4 | 118.7 | 166.1 | -58.8 | -57.7 | 0 | 0 | 0 | 107 | P128 | P128-F130 HydrophobicContact CB-CD2 3.38Å; P128-F130 HydrophobicContact CB-CE2 3.23Å; P128-F130 HydrophobicContact CB-CG 4.31Å; P128-F130 HydrophobicContact CB-CZ 4.05Å; P128-F130 HydrophobicContact CG-CD2 3.57Å; P128-F130 HydrophobicContact CG-CE2 3.67Å; P128-F130 PolarHBondContact O-N 2.88Å | ||
| 131 | L | 44.8 | Very low | 49.5 | Very low | 165 Ų | 165 | 129.3 Ų | 129.3 | 86% | 0.864 | 65% | 0.654 | S | S | * | * | S | Bend | trans | 103.6 | 76.6 | 178.3 | -52.3 | 168.3 | 0 | 0 | 0 | 114.8 | ||
| 132 | V | 45.9 | Very low | 48.3 | Very low | 126 Ų | 126 | 125.4 Ų | 125.4 | 76% | 0.764 | 66% | 0.656 | S | S | * | * | trans | 59.3 | 119.9 | 150.6 | -71.3 | 0 | 0 | 0 | 0 | 120 | F134 | V132-F134 PolarHBondContact O-N 2.95Š| ||
| 133 | P | 42 | Very low | 47.5 | Very low | 121 Ų | 121 | 125.8 Ų | 125.8 | 79% | 0.786 | 66% | 0.659 | S | S | * | * | trans | -56.1 | 120.3 | 156.3 | -21.1 | 32.8 | 0 | 0 | 0 | 110 | H135 | P133-H135 PolarHBondContact O-N 3.1Š| ||
| 134 | F | 47.3 | Very low | 46.7 | Very low | 96 Ų | 96 | 128.5 Ų | 128.5 | 42% | 0.421 | 68% | 0.682 | S | S | . | * | S | Bend | trans | -69.2 | 20.6 | -176.7 | -176.4 | -103.9 | 0 | 0 | 0 | 114.3 | H86 W87 V132 | H86-F134 HydrophobicContact CB-CD1 3.67Å; H86-F134 HydrophobicContact CB-CE1 3.49Å; H86-F134 VanDerWaalsContact CB-CE1 3.49Å; H86-F134 HydrophobicContact CB-CZ 4.42Å; H86-F134 AromaticContact CG-CD1 3.87Å; H86-F134 AromaticContact CG-CE1 3.78Å; H86-F134 AromaticContact ND1-CD1 3.43Å; H86-F134 WeakPolarHBondContact ND1-CD1 3.37Å; H86-F134 AromaticContact ND1-CE1 3.31Å; H86-F134 VanDerWaalsContact ND1-CE1 3.31Å; H86-F134 WeakPolarHBondContact ND1-CE1 3.33Å; W87-F134 HydrophobicContact CB-CZ 4.33Å; W87-F134 WeakPolarHBondContact O-CE2 3.28Å; V132-F134 PolarHBondContact O-N 2.95Å |
| 135 | H | 53.5 | Low | 46.1 | Very low | 164 Ų | 164 | 131.3 Ų | 131.3 | 76% | 0.759 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -110.4 | 25.7 | -174.6 | -149.6 | 71.5 | 0 | 0 | 0 | 115.2 | P133 | P133-H135 PolarHBondContact O-N 3.1Š|
| 136 | Q | 49.7 | Very low | 45.9 | Very low | 182 Ų | 182 | 132.4 Ų | 132.4 | 85% | 0.85 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -140.1 | 19.9 | 176.9 | -151.6 | 163 | 0.4 | 0 | 0 | 116.1 | ||
| 137 | Q | 47.3 | Very low | 45.5 | Very low | 101 Ų | 101 | 134.8 Ų | 134.8 | 47% | 0.472 | 72% | 0.715 | S | S | . | * | trans | -115 | 2.9 | 175.8 | -127.5 | 177.5 | 14.6 | 0 | 0 | 116 | Q139 Q140 Y141 | Q137-Q139 PolarHBondContact O-N 2.79Å; Q137-Q139 VanDerWaalsContact O-N 3.14Å; Q137-Q140 PolarHBondContact O-N 3.36Å; Q137-Y141 HydrophobicContact CG-CE2 4.32Å | ||
| 138 | Q | 49.9 | Very low | 45.1 | Very low | 150 Ų | 150 | 138 Ų | 138 | 70% | 0.701 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.3 | 5.5 | 172.6 | -80.1 | -175.7 | 9.9 | 0 | 0 | 114.5 | E84 | E84-Q138 PolarHBondContact OE1-NE2 2.85Š|
| 139 | Q | 47.8 | Very low | 44.8 | Very low | 192 Ų | 192 | 137.9 Ų | 137.9 | 90% | 0.897 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.9 | -0.9 | 171.7 | -65.7 | -167.5 | 12.9 | 0 | 0 | 115.1 | Q137 | Q137-Q139 PolarHBondContact O-N 2.79Å; Q137-Q139 VanDerWaalsContact O-N 3.14Å |
| 140 | Q | 43.7 | Very low | 44.7 | Very low | 147 Ų | 147 | 135.9 Ų | 135.9 | 69% | 0.687 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -116 | 0.4 | -174.7 | -75.5 | -171.1 | -40.2 | 0 | 0 | 116.5 | Q137 | Q137-Q140 PolarHBondContact O-N 3.36Š|
| 141 | Y | 39.3 | Very low | 45.3 | Very low | 198 Ų | 198 | 138.3 Ų | 138.3 | 78% | 0.776 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -109.1 | 56.8 | 166.9 | -62.4 | -74.3 | 0 | 0 | 0 | 110.8 | Q137 | Q137-Y141 HydrophobicContact CG-CE2 4.32Š|
| 142 | G | 38.1 | Very low | 45.3 | Very low | 75 Ų | 75 | 133.8 Ų | 133.8 | 77% | 0.773 | 74% | 0.736 | S | S | * | * | trans | -140.7 | 54.5 | 174 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 143 | A | 41.5 | Very low | 45.2 | Very low | 90 Ų | 90 | 137.2 Ų | 137.2 | 74% | 0.744 | 74% | 0.744 | S | S | * | * | trans | -154.1 | 88.5 | 170 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 144 | A | 42 | Very low | 45.2 | Very low | 78 Ų | 78 | 134.3 Ų | 134.3 | 65% | 0.645 | 74% | 0.735 | S | S | * | * | trans | -61.1 | 139.3 | 152.6 | 0 | 0 | 0 | 0 | 0 | 107.7 | Q146 | A144-Q146 PolarHBondContact O-N 2.89Š| ||
| 145 | P | 45.3 | Very low | 45.1 | Very low | 126 Ų | 126 | 137.7 Ų | 137.7 | 82% | 0.818 | 75% | 0.752 | S | S | * | * | trans | -66 | 105 | 176.9 | 25 | -30.2 | 0 | 0 | 0 | 109.1 | H147 | P145-H147 PolarHBondContact O-N 2.79Å; P145-H147 VanDerWaalsContact O-N 3.09Å | ||
| 146 | Q | 50.2 | Low | 45 | Very low | 174 Ų | 174 | 137.9 Ų | 137.9 | 81% | 0.813 | 75% | 0.753 | S | S | * | * | trans | -71.1 | 101.2 | 165.3 | -64.3 | -65 | -16.2 | 0 | 0 | 106.7 | A144 I148 | A144-Q146 PolarHBondContact O-N 2.89Å; Q146-I148 PolarHBondContact O-N 3.49Å | ||
| 147 | H | 44.4 | Very low | 44.9 | Very low | 182 Ų | 182 | 136.9 Ų | 136.9 | 84% | 0.843 | 75% | 0.748 | S | S | * | * | trans | -63.4 | 121.4 | 172.3 | -145 | -99.2 | 0 | 0 | 0 | 107.8 | P145 G149 | P145-H147 PolarHBondContact O-N 2.79Å; P145-H147 VanDerWaalsContact O-N 3.09Å; H147-G149 PolarHBondContact O-N 3.17Å | ||
| 148 | I | 42.5 | Very low | 44.8 | Very low | 165 Ų | 165 | 143.1 Ų | 143.1 | 85% | 0.846 | 77% | 0.769 | S | S | * | * | trans | -50.6 | 124.2 | 175.1 | -77.9 | 163.4 | 0 | 0 | 0 | 109.8 | Q146 | Q146-I148 PolarHBondContact O-N 3.49Š| ||
| 149 | G | 40.9 | Very low | 44.7 | Very low | 66 Ų | 66 | 142.7 Ų | 142.7 | 68% | 0.68 | 77% | 0.772 | S | S | * | * | trans | -166.8 | 70.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | H147 | H147-G149 PolarHBondContact O-N 3.17Š| ||
| 150 | S | 44.2 | Very low | 44.8 | Very low | 87 Ų | 87 | 140.8 Ų | 140.8 | 61% | 0.608 | 76% | 0.763 | S | S | * | * | trans | -43.5 | 139 | 150.9 | -168.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 151 | Y | 51.3 | Low | 45 | Very low | 219 Ų | 219 | 140.5 Ų | 140.5 | 86% | 0.859 | 76% | 0.762 | S | S | * | * | -168.3 | 151.8 | 76.1 | -32.2 | -74.9 | 0 | 0 | 0 | 109.1 | |||||
| 152 | G | 45.4 | Very low | 45.6 | Very low | 70 Ų | 70 | 137.5 Ų | 137.5 | 72% | 0.722 | 75% | 0.754 | S | S | * | * | trans | -62.8 | -169.4 | -173.4 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 153 | H | 44 | Very low | 46.2 | Very low | 199 Ų | 199 | 140.5 Ų | 140.5 | 92% | 0.921 | 75% | 0.748 | S | S | * | * | cis | -174.7 | 160.2 | 26.6 | -118.6 | 38.5 | 0 | 0 | 0 | 108.8 | ||||
| 154 | G | 41.7 | Very low | 46.1 | Very low | 59 Ų | 59 | 144.9 Ų | 144.9 | 61% | 0.608 | 75% | 0.754 | S | S | * | * | trans | 127.4 | 102.6 | 152 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 155 | H | 45.3 | Very low | 46.2 | Very low | 168 Ų | 168 | 145.2 Ų | 145.2 | 78% | 0.778 | 77% | 0.765 | S | S | * | * | 76.6 | 130.8 | 102.1 | -72.2 | -67.4 | 0 | 0 | 0 | 114.2 | |||||
| 156 | H | 49.7 | Very low | 46.2 | Very low | 167 Ų | 167 | 144.5 Ų | 144.5 | 77% | 0.773 | 76% | 0.763 | S | S | * | * | cis | -163.9 | 137 | 44.5 | -71.9 | -88.9 | 0 | 0 | 0 | 108.5 | ||||
| 157 | H | 48.1 | Very low | 46.4 | Very low | 162 Ų | 162 | 143.4 Ų | 143.4 | 75% | 0.75 | 77% | 0.768 | S | S | * | * | 70.5 | 103.3 | 77.9 | -156 | 79.2 | 0 | 0 | 0 | 117.7 | |||||
| 158 | Y | 46.4 | Very low | 46.5 | Very low | 231 Ų | 231 | 141.7 Ų | 141.7 | 91% | 0.906 | 77% | 0.77 | S | S | * | * | trans | -169.1 | 149.7 | 133.4 | 41.3 | -102.6 | 0 | 0 | 0 | 113 | ||||
| 159 | D | 47 | Very low | 46.8 | Very low | 142 Ų | 142 | 137 Ų | 137 | 76% | 0.759 | 76% | 0.763 | S | S | * | * | trans | -100.5 | 175.6 | -159.7 | -152.3 | -64.5 | 0 | 0 | 0 | 113.3 | ||||
| 160 | Q | 50.5 | Low | 46.7 | Very low | 152 Ų | 152 | 143 Ų | 143 | 71% | 0.71 | 77% | 0.774 | S | S | * | * | trans | 125.8 | 103.8 | 138.1 | -152.4 | 163.3 | 85.6 | 0 | 0 | 119.4 | ||||
| 161 | Q | 48.2 | Very low | 46.5 | Very low | 141 Ų | 141 | 144.7 Ų | 144.7 | 66% | 0.659 | 78% | 0.784 | S | S | * | * | trans | 61.5 | 149.9 | 135 | -65.9 | 176.3 | 37.1 | 0 | 0 | 120.7 | ||||
| 162 | Q | 50.8 | Low | 46.3 | Very low | 134 Ų | 134 | 140.1 Ų | 140.1 | 63% | 0.626 | 78% | 0.784 | S | S | * | * | cis | -175.8 | 155 | -9.4 | -114.2 | -172.6 | 85.7 | 0 | 0 | 107.7 | ||||
| 163 | Q | 50.5 | Low | 46.2 | Very low | 139 Ų | 139 | 141.9 Ų | 141.9 | 65% | 0.65 | 79% | 0.785 | S | S | * | * | trans | 80.8 | 108.5 | 151.8 | -63.7 | 173.6 | 58.4 | 0 | 0 | 120.1 | ||||
| 164 | Q | 39.9 | Very low | 46.3 | Very low | 182 Ų | 182 | 138.2 Ų | 138.2 | 85% | 0.85 | 78% | 0.777 | S | S | * | * | 89.9 | 119.2 | 88.1 | -75.4 | -172.8 | 94.1 | 0 | 0 | 114.3 | |||||
| 165 | G | 43.1 | Very low | 47 | Very low | 85 Ų | 85 | 144.1 Ų | 144.1 | 88% | 0.876 | 79% | 0.791 | S | S | * | * | trans | 173.5 | 106.3 | 170.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 166 | S | 45.7 | Very low | 47.8 | Very low | 111 Ų | 111 | 141.5 Ų | 141.5 | 78% | 0.776 | 79% | 0.789 | S | S | * | * | trans | -99.3 | 142.2 | -174.8 | 47.6 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 167 | T | 55.9 | Low | 47.9 | Very low | 150 Ų | 150 | 139.2 Ų | 139.2 | 92% | 0.92 | 79% | 0.789 | S | S | * | * | trans | -160.5 | 151 | 148.9 | 48.3 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 168 | T | 46.2 | Very low | 47.9 | Very low | 146 Ų | 146 | 138.1 Ų | 138.1 | 90% | 0.896 | 79% | 0.793 | S | S | * | * | trans | -103.3 | 167.8 | -158.3 | 45.4 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 169 | G | 48.1 | Very low | 47.9 | Very low | 68 Ų | 68 | 132.5 Ų | 132.5 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | trans | 143.3 | 98.9 | 159.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 170 | E | 38.9 | Very low | 48.3 | Very low | 192 Ų | 192 | 132.2 Ų | 132.2 | 90% | 0.897 | 79% | 0.788 | S | S | * | * | 69.9 | 100.4 | 63.4 | -61.2 | -166.1 | 132.2 | 0 | 0 | 116.2 | |||||
| 171 | C | 39.8 | Very low | 48.3 | Very low | 122 Ų | 122 | 133.8 Ų | 133.8 | 82% | 0.824 | 80% | 0.795 | S | S | * | * | trans | -179.1 | 113 | 133.2 | 57.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 172 | S | 47 | Very low | 48.2 | Very low | 123 Ų | 123 | 138 Ų | 138 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | 52.1 | 134.6 | 95 | -73.8 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 173 | S | 43.8 | Very low | 48.4 | Very low | 106 Ų | 106 | 136 Ų | 136 | 74% | 0.741 | 81% | 0.811 | S | S | * | * | cis | -177.6 | 159 | 3.5 | 171 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 174 | T | 46.2 | Very low | 48.3 | Very low | 122 Ų | 122 | 136.6 Ų | 136.6 | 75% | 0.748 | 82% | 0.819 | S | S | * | * | trans | 128.6 | 111.4 | 143.2 | -49.9 | 0 | 0 | 0 | 0 | 115 | ||||
| 175 | M | 55.8 | Low | 48.8 | Very low | 183 Ų | 183 | 132 Ų | 132 | 90% | 0.901 | 82% | 0.821 | S | S | * | * | trans | -118.2 | 154.8 | 155.1 | -75.2 | -148.1 | 150.5 | 0 | 0 | 109.1 | ||||
| 176 | P | 62 | Low | 49.4 | Very low | 113 Ų | 113 | 133.1 Ų | 133.1 | 73% | 0.734 | 81% | 0.811 | S | S | * | * | trans | -133.8 | 175 | 151.1 | 43.8 | -30.1 | 0 | 0 | 0 | 111 | ||||
| 177 | P | 52 | Low | 49.5 | Very low | 120 Ų | 120 | 136.3 Ų | 136.3 | 78% | 0.779 | 82% | 0.818 | S | S | * | * | -120.5 | 168 | -96.3 | 24.2 | -1.4 | 0 | 0 | 0 | 114 | |||||
| 178 | V | 48.2 | Very low | 49 | Very low | 138 Ų | 138 | 135.7 Ų | 135.7 | 84% | 0.836 | 81% | 0.808 | S | S | * | * | trans | -118.6 | 172.8 | 153.9 | -66.7 | 0 | 0 | 0 | 0 | 107 | ||||
| 179 | P | 45.7 | Very low | 49.2 | Very low | 113 Ų | 113 | 135.3 Ų | 135.3 | 73% | 0.734 | 80% | 0.8 | S | S | * | * | cis | -130.6 | 172.9 | -22.8 | 35.6 | -19.1 | 0 | 0 | 0 | 111.8 | ||||
| 180 | V | 55.4 | Low | 48.9 | Very low | 136 Ų | 136 | 139.2 Ų | 139.2 | 82% | 0.824 | 81% | 0.805 | S | S | * | * | trans | -152 | 114.3 | 147 | -173.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 181 | E | 51.7 | Low | 49.2 | Very low | 185 Ų | 185 | 141.3 Ų | 141.3 | 86% | 0.864 | 80% | 0.804 | S | S | * | * | trans | -76.1 | 131.5 | 164 | -164 | -163.4 | 151.9 | 0 | 0 | 108.7 | ||||
| 182 | R | 44.6 | Very low | 49.2 | Very low | 231 Ų | 231 | 139.1 Ų | 139.1 | 87% | 0.872 | 80% | 0.803 | S | S | * | * | trans | -104.4 | 122.6 | 170.7 | -91.4 | -169 | 168.7 | 120.2 | -1.9 | 110 | D184 | R182-D184 PolarHBondContact O-N 2.77Š| ||
| 183 | A | 56 | Low | 48.9 | Very low | 91 Ų | 91 | 137.4 Ų | 137.4 | 75% | 0.752 | 80% | 0.804 | S | S | * | * | trans | -70 | 101.9 | 161.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 184 | D | 49.2 | Very low | 48.8 | Very low | 152 Ų | 152 | 135.4 Ų | 135.4 | 81% | 0.813 | 80% | 0.8 | S | S | * | * | trans | -171.7 | 94.5 | 150.7 | -92.2 | -26.2 | 0 | 0 | 0 | 107.8 | R182 T186 | R182-D184 PolarHBondContact O-N 2.77Å; D184-T186 PolarHBondContact O-N 2.97Å | ||
| 185 | G | 48.6 | Very low | 48.7 | Very low | 86 Ų | 86 | 139.2 Ų | 139.2 | 89% | 0.887 | 81% | 0.809 | S | S | * | * | trans | -73.6 | 75.5 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 186 | T | 56.8 | Low | 48 | Very low | 108 Ų | 108 | 138.7 Ų | 138.7 | 66% | 0.663 | 80% | 0.804 | S | S | * | * | trans | -148.9 | 108.8 | 177 | 2.2 | 0 | 0 | 0 | 0 | 113.6 | D184 | D184-T186 PolarHBondContact O-N 2.97Š| ||
| 187 | L | 47.7 | Very low | 47.1 | Very low | 177 Ų | 177 | 142.7 Ų | 142.7 | 93% | 0.927 | 81% | 0.813 | S | S | * | * | trans | -157 | 97.3 | 144.3 | -75.1 | -174.2 | 0 | 0 | 0 | 104.6 | ||||
| 188 | L | 46.2 | Very low | 46.5 | Very low | 137 Ų | 137 | 144.8 Ų | 144.8 | 72% | 0.717 | 81% | 0.812 | S | S | * | * | cis | 78.6 | 98.5 | 48.1 | -157.2 | 100.4 | 0 | 0 | 0 | 114.5 | ||||
| 189 | L | 49.1 | Very low | 46.2 | Very low | 139 Ų | 139 | 147 Ų | 147 | 73% | 0.728 | 81% | 0.813 | S | S | * | * | trans | 70.1 | 118.5 | 155.6 | -61.6 | 147.5 | 0 | 0 | 0 | 116.8 | ||||
| 190 | D | 42.4 | Very low | 46 | Very low | 149 Ų | 149 | 148.2 Ų | 148.2 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | cis | 63.3 | 137.2 | 36.1 | -160.2 | 41.9 | 0 | 0 | 0 | 117.6 | ||||
| 191 | R | 46.1 | Very low | 45.5 | Very low | 236 Ų | 236 | 149 Ų | 149 | 89% | 0.891 | 80% | 0.803 | S | S | * | * | trans | 100.2 | 121 | -173.3 | -67.4 | -178.8 | 167.6 | -176.7 | -2.8 | 114.6 | ||||
| 192 | G | 39.7 | Very low | 45 | Very low | 77 Ų | 77 | 147.9 Ų | 147.9 | 79% | 0.794 | 80% | 0.797 | S | S | * | * | cis | 163.2 | 158.8 | 2.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 193 | G | 39.6 | Very low | 44.7 | Very low | 86 Ų | 86 | 147.8 Ų | 147.8 | 89% | 0.887 | 80% | 0.797 | S | S | * | * | trans | 95 | 116.1 | 165 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 194 | G | 41.4 | Very low | 44.2 | Very low | 64 Ų | 64 | 150.1 Ų | 150.1 | 66% | 0.66 | 79% | 0.792 | S | S | * | * | cis | 110.3 | 108.3 | 17.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 195 | H | 45 | Very low | 44.1 | Very low | 202 Ų | 202 | 149.1 Ų | 149.1 | 94% | 0.935 | 79% | 0.786 | S | S | * | * | trans | -173.3 | 119.6 | 139.8 | -83.6 | -39.4 | 0 | 0 | 0 | 111.4 | ||||
| 196 | H | 40.6 | Very low | 43.8 | Very low | 172 Ų | 172 | 151.2 Ų | 151.2 | 80% | 0.796 | 78% | 0.776 | S | S | * | * | trans | -76.8 | 151.8 | 175.9 | -62.3 | -80.9 | 0 | 0 | 0 | 112 | ||||
| 197 | H | 43.1 | Very low | 42.7 | Very low | 198 Ų | 198 | 155.5 Ų | 155.5 | 92% | 0.917 | 79% | 0.786 | S | S | * | * | trans | -150.5 | 121.6 | 135.4 | -97.8 | 76.9 | 0 | 0 | 0 | 109.6 | ||||
| 198 | H | 38.8 | Very low | 42.1 | Very low | 163 Ų | 163 | 151.5 Ų | 151.5 | 76% | 0.755 | 78% | 0.779 | S | S | * | * | trans | -79.8 | 137.8 | 172.5 | -93.9 | -10.5 | 0 | 0 | 0 | 110.7 | ||||
| 199 | H | 42.1 | Very low | 41.9 | Very low | 186 Ų | 186 | 151.3 Ų | 151.3 | 86% | 0.861 | 78% | 0.783 | S | S | * | * | trans | -155.8 | 89.5 | 142.2 | -108.7 | -52 | 0 | 0 | 0 | 111.5 | ||||
| 200 | H | 40.9 | Very low | 41.5 | Very low | 138 Ų | 138 | 149.1 Ų | 149.1 | 64% | 0.639 | 79% | 0.786 | S | S | * | * | 18.3 | 108 | 120.9 | -100.1 | -77.9 | 0 | 0 | 0 | 118.2 | |||||
| 201 | H | 45.1 | Very low | 41.8 | Very low | 153 Ų | 153 | 149.8 Ų | 149.8 | 71% | 0.708 | 79% | 0.789 | S | S | * | * | 155.2 | 138.8 | 106.1 | -90.9 | -71 | 0 | 0 | 0 | 113.9 | |||||
| 202 | H | 42.3 | Very low | 41.8 | Very low | 160 Ų | 160 | 145 Ų | 145 | 74% | 0.741 | 78% | 0.781 | S | S | * | * | trans | 75.2 | 91.6 | 154.6 | -89.4 | -81.7 | 0 | 0 | 0 | 120.3 | ||||
| 203 | R | 38.1 | Very low | 42.2 | Very low | 229 Ų | 229 | 146.9 Ų | 146.9 | 86% | 0.864 | 78% | 0.782 | S | S | * | * | trans | -54.1 | 130.1 | 132.7 | -73 | 177.1 | 121.2 | 156.8 | 0.1 | 108.1 | ||||
| 204 | E | 45.7 | Very low | 42.9 | Very low | 141 Ų | 141 | 146.6 Ų | 146.6 | 66% | 0.659 | 77% | 0.767 | S | S | * | * | trans | -178.5 | 113.7 | 141.8 | -85.4 | -43.6 | 107.8 | 0 | 0 | 107.7 | ||||
| 205 | L | 46.7 | Very low | 43.6 | Very low | 130 Ų | 130 | 145.8 Ų | 145.8 | 68% | 0.681 | 76% | 0.758 | S | S | * | * | trans | 61.5 | 115.2 | 136.9 | -49.9 | 178.9 | 0 | 0 | 0 | 121.8 | ||||
| 206 | L | 42.8 | Very low | 44.3 | Very low | 131 Ų | 131 | 145.2 Ų | 145.2 | 69% | 0.686 | 75% | 0.749 | S | S | * | * | 55.9 | 107.2 | 119.7 | -61.4 | 168.9 | 0 | 0 | 0 | 118.8 | |||||
| 207 | F | 34.3 | Very low | 45.2 | Very low | 197 Ų | 197 | 142 Ų | 142 | 86% | 0.864 | 74% | 0.737 | S | S | * | * | trans | 57.2 | 88.8 | 147.9 | -56.1 | -71.7 | 0 | 0 | 0 | 118.4 | ||||
| 208 | A | 34 | Very low | 46 | Very low | 94 Ų | 94 | 135.3 Ų | 135.3 | 78% | 0.777 | 71% | 0.713 | S | S | * | * | trans | 174.3 | 134.1 | 151.3 | 0 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 209 | T | 42.9 | Very low | 47.1 | Very low | 132 Ų | 132 | 132 Ų | 132 | 81% | 0.81 | 71% | 0.708 | S | S | * | * | cis | -152.5 | 157.8 | 28.9 | 44.1 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 210 | A | 39.9 | Very low | 48.5 | Very low | 94 Ų | 94 | 127.9 Ų | 127.9 | 78% | 0.777 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -56.6 | 157.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 112 | ||
| 211 | D | 47.8 | Very low | 49.6 | Very low | 162 Ų | 162 | 123.1 Ų | 123.1 | 87% | 0.866 | 68% | 0.676 | S | S | * | * | S | Bend | trans | 97.3 | 19.8 | 169.2 | -96.6 | -42.8 | 0 | 0 | 0 | 121.5 | ||
| 212 | D | 47.6 | Very low | 50.9 | Low | 136 Ų | 136 | 119.7 Ų | 119.7 | 73% | 0.727 | 67% | 0.667 | S | S | * | * | trans | -146.6 | 79.1 | 169.2 | -124.5 | -34.5 | 0 | 0 | 0 | 114.6 | S214 | D212-S214 PolarHBondContact O-N 3.17Å; D212-S214 PolarHBondContact OD1-OG 3.16Å | ||
| 213 | S | 47.9 | Very low | 51.8 | Low | 117 Ų | 117 | 117 Ų | 117 | 82% | 0.818 | 66% | 0.655 | S | S | * | * | trans | -84.8 | 9.7 | 175.9 | -49.1 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 214 | S | 55 | Low | 52.8 | Low | 80 Ų | 80 | 110.6 Ų | 110.6 | 56% | 0.559 | 65% | 0.646 | S | S | * | * | trans | -87.9 | -11 | -169.5 | 69.3 | 0 | 0 | 0 | 0 | 114.7 | D212 S218 | D212-S214 PolarHBondContact O-N 3.17Å; D212-S214 PolarHBondContact OD1-OG 3.16Å; S214-S218 PolarHBondContact O-OG 3.07Å | ||
| 215 | G | 55.1 | Low | 53.6 | Low | 47 Ų | 47 | 108.1 Ų | 108.1 | 49% | 0.485 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -86 | -21.7 | -172.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | S218 | G215-S218 PolarHBondContact O-OG 3.3Å |
| 216 | Y | 58.8 | Low | 54.4 | Low | 189 Ų | 189 | 105.4 Ų | 105.4 | 74% | 0.741 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -83.1 | -36.5 | -174.9 | -157.9 | -96.9 | 0 | 0 | 0 | 112.2 | S219 V220 | Y216-S219 PolarHBondContact O-OG 3.08Å; Y216-V220 HydrophobicContact CD1-CG2 4.44Å; Y216-V220 HydrophobicContact CE1-CG2 4.22Å; Y216-V220 WeakPolarHBondContact O-CG2 3.14Å |
| 217 | L | 60 | Low | 55.3 | Low | 105 Ų | 105 | 107 Ų | 107 | 55% | 0.55 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -69.3 | -37.7 | 178.7 | -97.9 | 158 | 0 | 0 | 0 | 112.7 | S219 V220 V221 L226 | L217-S219 VanDerWaalsContact C-N 3.29Å; L217-S219 PolarHBondContact O-N 2.88Å; L217-V220 PolarHBondContact O-N 3.06Å; L217-V221 HydrophobicContact CD2-CG2 3.8Å; L217-V221 VanDerWaalsContact O-CB 3.22Å; L217-V221 WeakPolarHBondContact O-CB 3.48Å; L217-V221 PolarHBondContact O-N 3.04Å; L217-L226 HydrophobicContact CD2-CD2 4.49Å |
| 218 | S | 59.6 | Low | 56.1 | Low | 58 Ų | 58 | 103.7 Ų | 103.7 | 41% | 0.406 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -71 | -19.3 | -179.8 | 46.9 | 0 | 0 | 0 | 0 | 114.5 | S214 G215 | S214-S218 PolarHBondContact O-OG 3.07Å; G215-S218 PolarHBondContact O-OG 3.3Å |
| 219 | S | 63.2 | Low | 56.7 | Low | 93 Ų | 93 | 106.3 Ų | 106.3 | 65% | 0.65 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -90.3 | -19.2 | 176.3 | 66.8 | 0 | 0 | 0 | 0 | 114.1 | Y216 L217 | Y216-S219 PolarHBondContact O-OG 3.08Å; L217-S219 VanDerWaalsContact C-N 3.29Å; L217-S219 PolarHBondContact O-N 2.88Å |
| 220 | V | 71.3 | Confident | 57.1 | Low | 99 Ų | 99 | 104.2 Ų | 104.2 | 60% | 0.6 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -107 | -27.9 | -177.2 | -178.9 | 0 | 0 | 0 | 0 | 111.6 | Y216 L217 | Y216-V220 HydrophobicContact CD1-CG2 4.44Å; Y216-V220 HydrophobicContact CE1-CG2 4.22Å; Y216-V220 WeakPolarHBondContact O-CG2 3.14Å; L217-V220 PolarHBondContact O-N 3.06Å |
| 221 | V | 63.6 | Low | 57.8 | Low | 39 Ų | 39 | 104.9 Ų | 104.9 | 24% | 0.236 | 60% | 0.603 | C | S | . | * | S | Bend | trans | -112.9 | 117.8 | -178.1 | -179.4 | 0 | 0 | 0 | 0 | 107.8 | L217 C225 L226 | L217-V221 HydrophobicContact CD2-CG2 3.8Å; L217-V221 VanDerWaalsContact O-CB 3.22Å; L217-V221 WeakPolarHBondContact O-CB 3.48Å; L217-V221 PolarHBondContact O-N 3.04Å; V221-C225 HydrophobicContact CG1-CB 3.25Å; V221-L226 HydrophobicContact CB-CD2 4.13Å; V221-L226 HydrophobicContact CB-CG 4.25Å; V221-L226 HydrophobicContact CG1-CD2 3.78Å; V221-L226 HydrophobicContact CG1-CG 3.84Å |
| 222 | P | 73.2 | Confident | 58 | Low | 80 Ų | 80 | 100.6 Ų | 100.6 | 52% | 0.519 | 59% | 0.591 | S | S | . | * | trans | -52.4 | 144 | 174.2 | -24.3 | 32.8 | 0 | 0 | 0 | 110.6 | S224 C225 | P222-S224 WeakPolarHBondContact CB-OG 3.41Å; P222-S224 PolarHBondContact O-N 2.91Å; P222-C225 WeakPolarHBondContact O-CB 3.26Å; P222-C225 PolarHBondContact O-N 3.09Å | ||
| 223 | E | 59.7 | Low | 58.2 | Low | 103 Ų | 103 | 95.4 Ų | 95.4 | 48% | 0.481 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -55.4 | -22.8 | -178.9 | -158.1 | 69.8 | -169.9 | 0 | 0 | 112.8 | C225 L226 R227 | E223-C225 PolarHBondContact O-N 2.96Å; E223-L226 PolarHBondContact O-N 3.4Å; E223-R227 PolarHBondContact O-N 2.69Å; E223-R227 IonicContact OE1-CZ 3.66Å; E223-R227 IonicContact OE1-NH1 3.78Å; E223-R227 PolarHBondContact OE1-NH1 2.85Å |
| 224 | S | 59.7 | Low | 58.5 | Low | 96 Ų | 96 | 92.6 Ų | 92.6 | 67% | 0.671 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64.6 | -18 | 172.5 | 57.2 | 0 | 0 | 0 | 0 | 114.7 | P222 | P222-S224 WeakPolarHBondContact CB-OG 3.41Å; P222-S224 PolarHBondContact O-N 2.91Å |
| 225 | C | 62.2 | Low | 58.5 | Low | 89 Ų | 89 | 92.8 Ų | 92.8 | 60% | 0.601 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -102.9 | -14.5 | 179.7 | -63.2 | 0 | 0 | 0 | 0 | 112.2 | V221 P222 E223 | V221-C225 HydrophobicContact CG1-CB 3.25Å; P222-C225 WeakPolarHBondContact O-CB 3.26Å; P222-C225 PolarHBondContact O-N 3.09Å; E223-C225 PolarHBondContact O-N 2.96Å |
| 226 | L | 63.9 | Low | 58.6 | Low | 72 Ų | 72 | 94.8 Ų | 94.8 | 38% | 0.377 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -94.2 | -16.8 | 177.1 | -62.6 | 177.7 | 0 | 0 | 0 | 113 | L217 V221 E223 | L217-L226 HydrophobicContact CD2-CD2 4.49Å; V221-L226 HydrophobicContact CB-CD2 4.13Å; V221-L226 HydrophobicContact CB-CG 4.25Å; V221-L226 HydrophobicContact CG1-CD2 3.78Å; V221-L226 HydrophobicContact CG1-CG 3.84Å; E223-L226 PolarHBondContact O-N 3.4Å |
| 227 | R | 61 | Low | 58.2 | Low | 164 Ų | 164 | 89.1 Ų | 89.1 | 62% | 0.619 | 53% | 0.528 | S | S | * | . | S | Bend | trans | -117.8 | 108 | 171 | -72.3 | -169 | 170.6 | 91.9 | 3.3 | 110 | E223 R229 | E223-R227 PolarHBondContact O-N 2.69Å; E223-R227 IonicContact OE1-CZ 3.66Å; E223-R227 IonicContact OE1-NH1 3.78Å; E223-R227 PolarHBondContact OE1-NH1 2.85Å; R227-R229 PolarHBondContact O-N 2.86Å |
| 228 | P | 51.7 | Low | 57.8 | Low | 128 Ų | 128 | 90.7 Ų | 90.7 | 83% | 0.831 | 54% | 0.536 | S | S | * | . | trans | -58.4 | 114.5 | 169 | 23.5 | -30 | 0 | 0 | 0 | 107.8 | S230 | P228-S230 PolarHBondContact O-N 3.33Å; P228-S230 VanDerWaalsContact O-N 3.08Å | ||
| 229 | R | 47.6 | Very low | 57.5 | Low | 150 Ų | 150 | 97 Ų | 97 | 57% | 0.566 | 55% | 0.551 | S | S | * | * | trans | -51.8 | 118.4 | 177.6 | -166.2 | 174.7 | 167.3 | -160.1 | -5.9 | 107.1 | R227 S231 A233 D237 | R227-R229 PolarHBondContact O-N 2.86Å; R229-S231 PolarHBondContact O-N 2.89Å; R229-A233 HydrophobicContact CG-CB 3.99Å; R229-A233 VanDerWaalsContact NE-CB 3.29Å; R229-D237 IonicContact CZ-OD2 3.58Å; R229-D237 IonicContact NH1-OD2 2.75Å; R229-D237 PolarHBondContact NH1-OD2 3.5Å; R229-D237 IonicContact NH2-OD2 3.77Å | ||
| 230 | S | 50.7 | Low | 57 | Low | 87 Ų | 87 | 100.7 Ų | 100.7 | 61% | 0.608 | 55% | 0.55 | S | S | * | * | trans | -40.5 | 131.7 | -179.3 | 52.5 | 0 | 0 | 0 | 0 | 110.3 | P228 A232 A233 | P228-S230 PolarHBondContact O-N 3.33Å; P228-S230 VanDerWaalsContact O-N 3.08Å; S230-A232 PolarHBondContact O-N 3.38Å; S230-A233 PolarHBondContact O-N 2.9Å | ||
| 231 | S | 53.4 | Low | 55.8 | Low | 108 Ų | 108 | 104.4 Ų | 104.4 | 76% | 0.755 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -41.9 | -22.3 | -171.1 | 50.4 | 0 | 0 | 0 | 0 | 116.5 | R229 | R229-S231 PolarHBondContact O-N 2.89Š|
| 232 | A | 52.6 | Low | 55.1 | Low | 73 Ų | 73 | 107 Ų | 107 | 60% | 0.603 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.3 | -24 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | S230 V235 | S230-A232 PolarHBondContact O-N 3.38Å; A232-V235 WeakPolarHBondContact O-CG2 3.4Å |
| 233 | A | 52.3 | Low | 54.1 | Low | 26 Ų | 26 | 108.9 Ų | 108.9 | 22% | 0.215 | 59% | 0.585 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -102.2 | -8.5 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | R229 S230 | R229-A233 HydrophobicContact CG-CB 3.99Å; R229-A233 VanDerWaalsContact NE-CB 3.29Å; S230-A233 PolarHBondContact O-N 2.9Å |
| 234 | A | 53.3 | Low | 53.6 | Low | 59 Ų | 59 | 108.3 Ų | 108.3 | 49% | 0.488 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -76.7 | -25.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | L238 | A234-L238 PolarHBondContact O-N 3.47Å |
| 235 | V | 55 | Low | 53.1 | Low | 84 Ų | 84 | 109 Ų | 109 | 51% | 0.509 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -76.1 | -28 | 178.1 | -70.7 | 0 | 0 | 0 | 0 | 113.1 | A232 | A232-V235 WeakPolarHBondContact O-CG2 3.4Å |
| 236 | E | 57.6 | Low | 52.5 | Low | 88 Ų | 88 | 108.8 Ų | 108.8 | 41% | 0.411 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -82.5 | -27.2 | 179.4 | -118 | 67.7 | -158.5 | 0 | 0 | 113.4 | R240 | E236-R240 PolarHBondContact O-NH1 2.98Å |
| 237 | D | 50.4 | Low | 51.9 | Low | 71 Ų | 71 | 113 Ų | 113 | 38% | 0.38 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -79.5 | -32.8 | 176.2 | -100.2 | -10.6 | 0 | 0 | 0 | 112.2 | R229 R239 R240 Y241 | R229-D237 IonicContact CZ-OD2 3.58Å; R229-D237 IonicContact NH1-OD2 2.75Å; R229-D237 PolarHBondContact NH1-OD2 3.5Å; R229-D237 IonicContact NH2-OD2 3.77Å; D237-R239 PolarHBondContact O-N 2.66Å; D237-R240 PolarHBondContact O-N 3.17Å; D237-R240 VanDerWaalsContact O-N 3.12Å; D237-Y241 PolarHBondContact O-N 3.11Å |
| 238 | L | 51.9 | Low | 51.6 | Low | 138 Ų | 138 | 109.9 Ų | 109.9 | 72% | 0.723 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -66.8 | -24.9 | 174.3 | -156.5 | 69 | 0 | 0 | 0 | 112.2 | A234 | A234-L238 PolarHBondContact O-N 3.47Å |
| 239 | R | 53 | Low | 51.3 | Low | 190 Ų | 190 | 113.3 Ų | 113.3 | 72% | 0.717 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -77.2 | -25.7 | 172.1 | -88.6 | -167.3 | 172.1 | 124.9 | -0.8 | 114.2 | D237 | D237-R239 PolarHBondContact O-N 2.66Å |
| 240 | R | 52.4 | Low | 51 | Low | 170 Ų | 170 | 110.3 Ų | 110.3 | 64% | 0.642 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -90.9 | -24.8 | 179.6 | -70.9 | -173.1 | -178.6 | 90.3 | -0.9 | 113 | E236 D237 S242 | E236-R240 PolarHBondContact O-NH1 2.98Å; D237-R240 PolarHBondContact O-N 3.17Å; D237-R240 VanDerWaalsContact O-N 3.12Å; R240-S242 VanDerWaalsContact C-N 3.34Å |
| 241 | Y | 46.6 | Very low | 50.9 | Low | 177 Ų | 177 | 114.3 Ų | 114.3 | 69% | 0.694 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.6 | -6.2 | 177.6 | -124.5 | -93.4 | 0 | 0 | 0 | 114.5 | D237 | D237-Y241 PolarHBondContact O-N 3.11Š|
| 242 | S | 50 | Low | 50.3 | Low | 94 Ų | 94 | 112.7 Ų | 112.7 | 66% | 0.657 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.2 | -0.1 | -174.3 | -169.5 | 0 | 0 | 0 | 0 | 115.1 | R240 | R240-S242 VanDerWaalsContact C-N 3.34Š|
| 243 | V | 50.7 | Low | 49.9 | Very low | 120 Ų | 120 | 115.4 Ų | 115.4 | 73% | 0.727 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -126 | 4.7 | -170.3 | -173.9 | 0 | 0 | 0 | 0 | 113.6 | ||
| 244 | S | 50.5 | Low | 49.6 | Very low | 91 Ų | 91 | 125.4 Ų | 125.4 | 64% | 0.636 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -131.4 | -3.3 | -170.3 | -53.6 | 0 | 0 | 0 | 0 | 117.3 | ||
| 245 | D | 49.3 | Very low | 49.8 | Very low | 110 Ų | 110 | 130.3 Ų | 130.3 | 59% | 0.588 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -116.1 | 9.9 | -179.3 | -74.2 | -53.4 | 0 | 0 | 0 | 114.3 | D247 | D245-D247 VanDerWaalsContact C-N 3.34Å; D245-D247 PolarHBondContact O-N 2.88Å |
| 246 | A | 47.8 | Very low | 50 | Low | 85 Ų | 85 | 130.9 Ų | 130.9 | 70% | 0.702 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.3 | -8.4 | -178 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 247 | D | 52.4 | Low | 50.3 | Low | 161 Ų | 161 | 131.6 Ų | 131.6 | 86% | 0.861 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.4 | -3.8 | -170.7 | -67.4 | -34.7 | 0 | 0 | 0 | 114.8 | D245 | D245-D247 VanDerWaalsContact C-N 3.34Å; D245-D247 PolarHBondContact O-N 2.88Å |
| 248 | S | 54.5 | Low | 50.9 | Low | 97 Ų | 97 | 133.4 Ų | 133.4 | 68% | 0.678 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -101.9 | -4.5 | -173.9 | -168.4 | 0 | 0 | 0 | 0 | 115.5 | ||
| 249 | Y | 45.5 | Very low | 51.5 | Low | 201 Ų | 201 | 131.5 Ų | 131.5 | 79% | 0.788 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -124.1 | 96.3 | 173.9 | -71.9 | -84.1 | 0 | 0 | 0 | 109.1 | M251 | Y249-M251 PolarHBondContact O-N 2.91Š|
| 250 | G | 41.5 | Very low | 52.1 | Low | 86 Ų | 86 | 127.5 Ų | 127.5 | 89% | 0.887 | 70% | 0.695 | S | S | * | * | trans | -64.9 | 64.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 251 | M | 49.2 | Very low | 52.6 | Low | 171 Ų | 171 | 122.1 Ų | 122.1 | 84% | 0.842 | 69% | 0.687 | S | S | * | * | trans | -102.1 | 91.6 | 170 | -70.9 | -64.1 | -151.2 | 0 | 0 | 108.3 | Y249 L253 | Y249-M251 PolarHBondContact O-N 2.91Å; M251-L253 PolarHBondContact O-N 3.19Å | ||
| 252 | G | 39 | Very low | 53.5 | Low | 74 Ų | 74 | 119.8 Ų | 119.8 | 76% | 0.763 | 68% | 0.682 | S | S | * | * | trans | -65.9 | 100.1 | 167.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 253 | L | 45.3 | Very low | 54.3 | Low | 130 Ų | 130 | 122 Ų | 122 | 68% | 0.681 | 68% | 0.684 | S | S | * | * | trans | -140.5 | 66.9 | 157 | -73.8 | 178.9 | 0 | 0 | 0 | 108 | M251 | M251-L253 PolarHBondContact O-N 3.19Š| ||
| 254 | R | 45.3 | Very low | 54.8 | Low | 237 Ų | 237 | 120.7 Ų | 120.7 | 89% | 0.894 | 68% | 0.676 | S | S | * | * | trans | -83 | 104.4 | 154.4 | -79.5 | 169.5 | 84.9 | 153.6 | 2.9 | 104.6 | ||||
| 255 | E | 58.4 | Low | 55.2 | Low | 161 Ų | 161 | 119.6 Ų | 119.6 | 75% | 0.752 | 67% | 0.673 | S | S | * | * | S | Bend | trans | 167.7 | -21.3 | 153.8 | -89.5 | 152.4 | -160.6 | 0 | 0 | 112.1 | ||
| 256 | D | 59.4 | Low | 55.7 | Low | 96 Ų | 96 | 117.7 Ų | 117.7 | 51% | 0.513 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -92.6 | -8.8 | -173.1 | -55.2 | -30.8 | 0 | 0 | 0 | 115.3 | L260 | D256-L260 WeakPolarHBondContact O-CB 3.32Å; D256-L260 PolarHBondContact O-N 2.88Å |
| 257 | V | 63.4 | Low | 56.4 | Low | 104 Ų | 104 | 121.8 Ų | 121.8 | 63% | 0.63 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -77.2 | -34.4 | -177.1 | -175 | 0 | 0 | 0 | 0 | 111.2 | A261 | V257-A261 VanDerWaalsContact O-CB 3.32Å; V257-A261 WeakPolarHBondContact O-CB 3.4Å; V257-A261 PolarHBondContact O-N 2.75Å |
| 258 | D | 63.3 | Low | 56.7 | Low | 109 Ų | 109 | 124.3 Ų | 124.3 | 58% | 0.583 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -73.4 | -34.8 | 177.7 | -66.1 | -56.5 | 0 | 0 | 0 | 111.7 | A261 Q262 | D258-A261 PolarHBondContact O-N 3.46Å; D258-Q262 WeakPolarHBondContact O-CB 3.25Å; D258-Q262 VanDerWaalsContact O-CG 3.25Å; D258-Q262 WeakPolarHBondContact O-CG 3.25Å; D258-Q262 PolarHBondContact O-N 3.28Å; D258-Q262 PolarHBondContact O-NE2 3.47Å |
| 259 | D | 63.2 | Low | 56.1 | Low | 97 Ų | 97 | 123 Ų | 123 | 52% | 0.519 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -70.6 | -36.8 | 174.5 | -78.9 | -18.3 | 0 | 0 | 0 | 112.1 | Q262 M263 | D259-Q262 PolarHBondContact O-N 2.88Å; D259-M263 VanDerWaalsContact O-CB 3.25Å; D259-M263 WeakPolarHBondContact O-CB 3.35Å; D259-M263 PolarHBondContact O-N 3.46Å |
| 260 | L | 66.2 | Low | 56 | Low | 107 Ų | 107 | 118.8 Ų | 118.8 | 56% | 0.56 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -68.7 | -38.8 | 172.4 | -168.9 | 76.8 | 0 | 0 | 0 | 111.2 | D256 M263 V264 | D256-L260 WeakPolarHBondContact O-CB 3.32Å; D256-L260 PolarHBondContact O-N 2.88Å; L260-M263 PolarHBondContact O-N 3Å; L260-V264 HydrophobicContact CG-CG2 4.49Å; L260-V264 WeakPolarHBondContact O-CB 3.16Å; L260-V264 VanDerWaalsContact O-CG2 3.26Å; L260-V264 WeakPolarHBondContact O-CG2 3.25Å; L260-V264 PolarHBondContact O-N 2.74Å |
| 261 | A | 63.6 | Low | 56.1 | Low | 56 Ų | 56 | 118.1 Ų | 118.1 | 46% | 0.463 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -64.8 | -39.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | V257 D258 A265 | V257-A261 VanDerWaalsContact O-CB 3.32Å; V257-A261 WeakPolarHBondContact O-CB 3.4Å; V257-A261 PolarHBondContact O-N 2.75Å; D258-A261 PolarHBondContact O-N 3.46Å; A261-A265 WeakPolarHBondContact O-CB 3.13Å; A261-A265 PolarHBondContact O-N 3.41Å |
| 262 | Q | 64.1 | Low | 56.4 | Low | 129 Ų | 129 | 115.4 Ų | 115.4 | 60% | 0.603 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -70.2 | -35 | 174.3 | -73.7 | 163.6 | 42.3 | 0 | 0 | 112.3 | D258 D259 G266 | D258-Q262 WeakPolarHBondContact O-CB 3.25Å; D258-Q262 VanDerWaalsContact O-CG 3.25Å; D258-Q262 WeakPolarHBondContact O-CG 3.25Å; D258-Q262 PolarHBondContact O-N 3.28Å; D258-Q262 PolarHBondContact O-NE2 3.47Å; D259-Q262 PolarHBondContact O-N 2.88Å; Q262-G266 PolarHBondContact O-N 3.14Å |
| 263 | M | 67.9 | Low | 57 | Low | 140 Ų | 140 | 115.4 Ų | 115.4 | 69% | 0.69 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -70 | -39.4 | 175.1 | -169.5 | -176.7 | -63.2 | 0 | 0 | 112.4 | D259 L260 G266 | D259-M263 VanDerWaalsContact O-CB 3.25Å; D259-M263 WeakPolarHBondContact O-CB 3.35Å; D259-M263 PolarHBondContact O-N 3.46Å; L260-M263 PolarHBondContact O-N 3Å; M263-G266 PolarHBondContact O-N 2.79Å |
| 264 | V | 61.5 | Low | 57.2 | Low | 92 Ų | 92 | 117.7 Ų | 117.7 | 56% | 0.558 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -72.8 | -36.2 | 175.6 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | L260 G266 F267 | L260-V264 HydrophobicContact CG-CG2 4.49Å; L260-V264 WeakPolarHBondContact O-CB 3.16Å; L260-V264 VanDerWaalsContact O-CG2 3.26Å; L260-V264 WeakPolarHBondContact O-CG2 3.25Å; L260-V264 PolarHBondContact O-N 2.74Å; V264-G266 VanDerWaalsContact C-N 3.31Å; V264-G266 PolarHBondContact O-N 3.48Å; V264-F267 PolarHBondContact O-N 3.42Å |
| 265 | A | 59.1 | Low | 57.9 | Low | 69 Ų | 69 | 110 Ų | 110 | 57% | 0.57 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -66 | -31 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | A261 F267 | A261-A265 WeakPolarHBondContact O-CB 3.13Å; A261-A265 PolarHBondContact O-N 3.41Å; A265-F267 VanDerWaalsContact C-N 3.33Å; A265-F267 PolarHBondContact O-N 3.39Å |
| 266 | G | 59.3 | Low | 57.6 | Low | 69 Ų | 69 | 110.6 Ų | 110.6 | 71% | 0.711 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -72.3 | -18.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | Q262 M263 V264 | Q262-G266 PolarHBondContact O-N 3.14Å; M263-G266 PolarHBondContact O-N 2.79Å; V264-G266 VanDerWaalsContact C-N 3.31Å; V264-G266 PolarHBondContact O-N 3.48Å |
| 267 | F | 62.8 | Low | 57.2 | Low | 171 Ų | 171 | 108.9 Ų | 108.9 | 75% | 0.75 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -85.5 | -21.7 | -178.8 | -172.8 | -107 | 0 | 0 | 0 | 113.4 | V264 A265 | V264-F267 PolarHBondContact O-N 3.42Å; A265-F267 VanDerWaalsContact C-N 3.33Å; A265-F267 PolarHBondContact O-N 3.39Å |
| 268 | W | 57.2 | Low | 56.7 | Low | 214 Ų | 214 | 112.5 Ų | 112.5 | 81% | 0.811 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -121 | 87.5 | 177 | -84.3 | 88.5 | 0 | 0 | 0 | 111 | ||
| 269 | G | 42.4 | Very low | 56.3 | Low | 69 Ų | 69 | 113.9 Ų | 113.9 | 71% | 0.711 | 73% | 0.73 | S | S | * | * | trans | 90.8 | 79 | 148.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 270 | A | 43.5 | Very low | 55.8 | Low | 114 Ų | 114 | 113.4 Ų | 113.4 | 94% | 0.942 | 74% | 0.74 | S | S | * | * | trans | -60.8 | 123.4 | 142.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 271 | G | 44.5 | Very low | 55 | Low | 72 Ų | 72 | 114 Ų | 114 | 74% | 0.742 | 75% | 0.753 | S | S | * | * | trans | 175.5 | 108.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 272 | A | 54.5 | Low | 54.7 | Low | 114 Ų | 114 | 116.6 Ų | 116.6 | 94% | 0.942 | 77% | 0.768 | S | S | * | * | trans | 72.7 | 125.1 | 169.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 273 | G | 53.2 | Low | 54.3 | Low | 73 Ų | 73 | 120 Ų | 120 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | cis | 150.3 | 106.2 | 14.6 | 0 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 274 | D | 48.8 | Very low | 53.4 | Low | 179 Ų | 179 | 116.7 Ų | 116.7 | 96% | 0.957 | 79% | 0.785 | S | S | * | * | trans | -63.9 | 130.3 | 179 | -62.2 | -62.8 | 0 | 0 | 0 | 110.5 | ||||
| 275 | G | 59.2 | Low | 53.3 | Low | 75 Ų | 75 | 117 Ų | 117 | 77% | 0.773 | 79% | 0.791 | S | S | * | * | trans | -157.1 | 85 | -179.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 276 | D | 52.9 | Low | 53.3 | Low | 173 Ų | 173 | 121 Ų | 121 | 93% | 0.925 | 80% | 0.803 | S | S | * | * | trans | -42.4 | 149.8 | 167.7 | -86 | -60.2 | 0 | 0 | 0 | 113.8 | ||||
| 277 | G | 50.5 | Low | 53.3 | Low | 61 Ų | 61 | 120.6 Ų | 120.6 | 63% | 0.629 | 80% | 0.799 | S | S | * | * | trans | 111.4 | 97.8 | 137.1 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 278 | M | 52.3 | Low | 52.9 | Low | 179 Ų | 179 | 123.9 Ų | 123.9 | 88% | 0.882 | 81% | 0.808 | S | S | * | * | 74.3 | 132.2 | 121.6 | -73 | 178.3 | -174 | 0 | 0 | 119.9 | |||||
| 279 | V | 54.7 | Low | 53.1 | Low | 138 Ų | 138 | 118 Ų | 118 | 84% | 0.836 | 80% | 0.8 | S | S | * | * | trans | 87.8 | 119.2 | 143.3 | -63.1 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 280 | A | 53.2 | Low | 53.9 | Low | 88 Ų | 88 | 119.9 Ų | 119.9 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | trans | 89.8 | 93.8 | 130.2 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 281 | S | 49.9 | Very low | 54.4 | Low | 119 Ų | 119 | 123.9 Ų | 123.9 | 83% | 0.832 | 80% | 0.796 | S | S | * | * | 15.8 | 120.4 | 120.1 | -46.6 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 282 | S | 58.3 | Low | 55.1 | Low | 111 Ų | 111 | 125.9 Ų | 125.9 | 78% | 0.776 | 80% | 0.798 | S | S | * | * | trans | 164.6 | 111.1 | 131.5 | -80.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 283 | Q | 54.8 | Low | 55.1 | Low | 201 Ų | 201 | 130.2 Ų | 130.2 | 94% | 0.939 | 80% | 0.796 | S | S | * | * | 61.7 | 129.3 | 91.9 | -80.2 | -166.1 | -7.7 | 0 | 0 | 116 | |||||
| 284 | G | 49.3 | Very low | 55.5 | Low | 69 Ų | 69 | 135.2 Ų | 135.2 | 71% | 0.711 | 81% | 0.805 | S | S | * | * | trans | 117.5 | 86.6 | 168.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 285 | S | 59.4 | Low | 56.1 | Low | 98 Ų | 98 | 131.1 Ų | 131.1 | 69% | 0.685 | 79% | 0.79 | S | S | * | * | 68.8 | 127.6 | 68.3 | 89.5 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 286 | D | 59 | Low | 56.2 | Low | 154 Ų | 154 | 139.6 Ų | 139.6 | 82% | 0.824 | 81% | 0.809 | S | S | * | * | trans | 73.5 | 129.5 | 156.8 | -39.4 | -47.4 | 0 | 0 | 0 | 116.2 | ||||
| 287 | G | 58.6 | Low | 56.3 | Low | 61 Ų | 61 | 137.9 Ų | 137.9 | 63% | 0.629 | 80% | 0.803 | S | S | * | * | cis | 146.9 | 141.9 | 14 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 288 | Y | 55.1 | Low | 56.7 | Low | 239 Ų | 239 | 141.9 Ų | 141.9 | 94% | 0.937 | 81% | 0.812 | S | S | * | * | trans | 64.7 | 149.3 | 166.1 | -77.9 | -103.5 | 0 | 0 | 0 | 118 | ||||
| 289 | S | 61.1 | Low | 56.9 | Low | 92 Ų | 92 | 139.9 Ų | 139.9 | 64% | 0.643 | 81% | 0.808 | S | S | * | * | cis | -175.8 | 147.4 | -21 | 174.5 | 0 | 0 | 0 | 0 | 104 | ||||
| 290 | P | 59.9 | Low | 57 | Low | 107 Ų | 107 | 140 Ų | 140 | 70% | 0.695 | 81% | 0.807 | S | S | * | * | trans | -101 | 115.7 | -163.4 | 34 | -24.4 | 0 | 0 | 0 | 111.8 | ||||
| 291 | F | 53.5 | Low | 57.3 | Low | 198 Ų | 198 | 143.3 Ų | 143.3 | 87% | 0.868 | 81% | 0.812 | S | S | * | * | trans | -163.3 | 124.4 | 157.8 | -93.7 | -75.4 | 0 | 0 | 0 | 109.4 | ||||
| 292 | S | 58.4 | Low | 57.8 | Low | 114 Ų | 114 | 144.9 Ų | 144.9 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | 163.8 | 105.6 | 125.4 | -70.7 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 293 | F | 55.8 | Low | 57.7 | Low | 205 Ų | 205 | 147.3 Ų | 147.3 | 90% | 0.899 | 81% | 0.813 | S | S | * | * | trans | 26.7 | 116.4 | 136.8 | -99.8 | -102.8 | 0 | 0 | 0 | 119.8 | ||||
| 294 | L | 61.5 | Low | 57.9 | Low | 179 Ų | 179 | 143.2 Ų | 143.2 | 94% | 0.937 | 80% | 0.803 | S | S | * | * | trans | -84.6 | 127.5 | 159.5 | -146.8 | 74.6 | 0 | 0 | 0 | 109 | ||||
| 295 | S | 61.5 | Low | 58.7 | Low | 92 Ų | 92 | 149.3 Ų | 149.3 | 64% | 0.643 | 81% | 0.811 | S | S | * | * | trans | -149.3 | 139.1 | 168.8 | -177.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 296 | H | 60.3 | Low | 58.6 | Low | 253 Ų | 253 | 154 Ų | 154 | 100% | 1.171 | 82% | 0.822 | S | S | * | * | trans | 80.9 | 0 | -174.5 | -67.1 | 71.1 | 0 | 0 | 0 | 117.4 |
Retrieved 296 of 296 residues in 93.2 ms
(Link to these results)