| 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 | 44.7 | Very low | 47.3 | Very low | 244 Ų | 244 | 131.8 Ų | 131.8 | 100% | 1.202 | 78% | 0.779 | S | S | * | * | 0 | 110.7 | 0 | -77.2 | 165 | 175.9 | 0 | 0 | 105.2 | |||||
| 2 | A | 43.1 | Very low | 47.1 | Very low | 103 Ų | 103 | 133.4 Ų | 133.4 | 85% | 0.851 | 78% | 0.781 | S | S | * | * | trans | -82.7 | 126.6 | -174.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | F4 | A2-F4 PolarHBondContact O-N 3.1Š| ||
| 3 | D | 45.2 | Very low | 47.2 | Very low | 167 Ų | 167 | 135.8 Ų | 135.8 | 89% | 0.893 | 79% | 0.789 | S | S | * | * | trans | -66.9 | 121.1 | 171.6 | -85.2 | -44.3 | 0 | 0 | 0 | 109.5 | ||||
| 4 | F | 48.2 | Very low | 46.9 | Very low | 176 Ų | 176 | 134.3 Ų | 134.3 | 77% | 0.772 | 78% | 0.783 | S | S | * | * | trans | -91 | 105.9 | 174.1 | -163.1 | -99.2 | 0 | 0 | 0 | 108.6 | A2 | A2-F4 PolarHBondContact O-N 3.1Š| ||
| 5 | S | 47.1 | Very low | 46.6 | Very low | 74 Ų | 74 | 134.3 Ų | 134.3 | 52% | 0.517 | 79% | 0.788 | S | S | . | * | trans | -93.7 | 137.2 | 175.1 | -179.9 | 0 | 0 | 0 | 0 | 109.8 | S7 D8 | S5-S7 PolarHBondContact O-N 3.13Å; S5-S7 PolarHBondContact OG-OG 3.17Å; S5-D8 PolarHBondContact O-N 3.5Å | ||
| 6 | L | 47.3 | Very low | 46.2 | Very low | 156 Ų | 156 | 133.3 Ų | 133.3 | 82% | 0.817 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.4 | 3.6 | 177.6 | -99.6 | 150.8 | 0 | 0 | 0 | 115.4 | ||
| 7 | S | 51.4 | Low | 45.7 | Very low | 97 Ų | 97 | 136.8 Ų | 136.8 | 68% | 0.678 | 80% | 0.798 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | -16.2 | 176.4 | -39.4 | 0 | 0 | 0 | 0 | 113.5 | S5 | S5-S7 PolarHBondContact O-N 3.13Å; S5-S7 PolarHBondContact OG-OG 3.17Å |
| 8 | D | 53.6 | Low | 45.4 | Very low | 139 Ų | 139 | 135 Ų | 135 | 74% | 0.743 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -92.3 | -2.8 | -175.3 | -132.6 | 8 | 0 | 0 | 0 | 113.2 | S5 | S5-D8 PolarHBondContact O-N 3.5Š|
| 9 | A | 49.8 | Very low | 44.9 | Very low | 67 Ų | 67 | 137.8 Ų | 137.8 | 55% | 0.554 | 80% | 0.802 | S | S | * | * | S | Bend | trans | -94.7 | 1.1 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 10 | L | 47.5 | Very low | 44.6 | Very low | 158 Ų | 158 | 141.5 Ų | 141.5 | 83% | 0.827 | 81% | 0.808 | S | S | * | * | trans | -111.2 | 83.1 | 174.4 | -65.4 | 177.4 | 0 | 0 | 0 | 109 | D12 | L10-D12 PolarHBondContact O-N 2.69Š| ||
| 11 | G | 42.9 | Very low | 44.2 | Very low | 69 Ų | 69 | 142.1 Ų | 142.1 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | trans | -62.3 | 129 | 165.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | D13 | G11-D13 PolarHBondContact O-N 3.27Å; G11-D13 VanDerWaalsContact O-N 3.1Å | ||
| 12 | D | 44.7 | Very low | 43.7 | Very low | 151 Ų | 151 | 133.7 Ų | 133.7 | 81% | 0.807 | 78% | 0.783 | S | S | * | * | trans | -71.7 | 90.5 | -179 | -155.7 | 9.1 | 0 | 0 | 0 | 109.9 | L10 T14 | L10-D12 PolarHBondContact O-N 2.69Å; D12-T14 PolarHBondContact O-N 3.39Å | ||
| 13 | D | 48.3 | Very low | 43.4 | Very low | 165 Ų | 165 | 138 Ų | 138 | 88% | 0.882 | 79% | 0.785 | S | S | * | * | trans | -81.9 | 94.8 | 175.8 | -90.5 | -28 | 0 | 0 | 0 | 110.9 | G11 | G11-D13 PolarHBondContact O-N 3.27Å; G11-D13 VanDerWaalsContact O-N 3.1Å | ||
| 14 | T | 43.2 | Very low | 43.1 | Very low | 114 Ų | 114 | 136.6 Ų | 136.6 | 70% | 0.699 | 78% | 0.783 | S | S | * | * | trans | -83.3 | 138.3 | 159.7 | 25 | 0 | 0 | 0 | 0 | 110 | D12 S16 | D12-T14 PolarHBondContact O-N 3.39Å; T14-S16 PolarHBondContact O-N 3.39Å; T14-S16 VanDerWaalsContact O-N 3.1Å | ||
| 15 | P | 41.4 | Very low | 42.4 | Very low | 134 Ų | 134 | 135.4 Ų | 135.4 | 87% | 0.87 | 78% | 0.784 | S | S | * | * | trans | -78.1 | 105.2 | -169.4 | 30 | -32.7 | 0 | 0 | 0 | 111.1 | ||||
| 16 | S | 40.5 | Very low | 42 | Very low | 119 Ų | 119 | 137.4 Ų | 137.4 | 83% | 0.832 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -91.5 | 128 | 170.1 | -162.7 | 0 | 0 | 0 | 0 | 110.8 | T14 A18 | T14-S16 PolarHBondContact O-N 3.39Å; T14-S16 VanDerWaalsContact O-N 3.1Å; S16-A18 PolarHBondContact O-N 3.08Å |
| 17 | Q | 38.8 | Very low | 41.4 | Very low | 193 Ų | 193 | 136.2 Ų | 136.2 | 90% | 0.902 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 122.9 | -178.1 | -72.9 | -176.5 | -35.3 | 0 | 0 | 112.9 | ||
| 18 | A | 38.7 | Very low | 40.6 | Very low | 104 Ų | 104 | 135.8 Ų | 135.8 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -89.4 | 126.8 | 167.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | S16 | S16-A18 PolarHBondContact O-N 3.08Š|
| 19 | K | 36.1 | Very low | 39.7 | Very low | 189 Ų | 189 | 134.9 Ų | 134.9 | 82% | 0.822 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -75.6 | 133.6 | -178.1 | -170.3 | 176.2 | -177.4 | -179.5 | 0 | 110.9 | I21 | K19-I21 PolarHBondContact O-N 2.68Š|
| 20 | K | 39.2 | Very low | 39.1 | Very low | 210 Ų | 210 | 136.9 Ų | 136.9 | 91% | 0.913 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 118 | 175.4 | -162.5 | 174.9 | -171.4 | 176.2 | 0 | 110.9 | ||
| 21 | I | 37.5 | Very low | 38.6 | Very low | 156 Ų | 156 | 133.9 Ų | 133.9 | 80% | 0.8 | 81% | 0.808 | S | S | * | * | trans | -135.4 | 132.5 | 167.6 | -42.6 | 179 | 0 | 0 | 0 | 108.4 | K19 | K19-I21 PolarHBondContact O-N 2.68Š| ||
| 22 | G | 32.7 | Very low | 38.3 | Very low | 67 Ų | 67 | 138.7 Ų | 138.7 | 69% | 0.691 | 82% | 0.817 | S | S | * | * | trans | -77.8 | 163.1 | -158.2 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 23 | H | 36.8 | Very low | 37.9 | Very low | 193 Ų | 193 | 139.3 Ų | 139.3 | 89% | 0.894 | 82% | 0.815 | S | S | * | * | trans | -62.5 | 126.7 | 173.1 | -63.4 | -88.7 | 0 | 0 | 0 | 112.5 | ||||
| 24 | T | 38.9 | Very low | 37.5 | Very low | 138 Ų | 138 | 137.3 Ų | 137.3 | 85% | 0.847 | 81% | 0.811 | S | S | * | * | trans | -144.3 | 117.9 | 148.2 | 50.4 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 25 | N | 34 | Very low | 37.2 | Very low | 150 Ų | 150 | 136.7 Ų | 136.7 | 80% | 0.802 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 131.5 | 174.3 | -166.9 | 19.2 | 0 | 0 | 0 | 109.5 | ||
| 26 | P | 37.8 | Very low | 37.1 | Very low | 116 Ų | 116 | 134.7 Ų | 134.7 | 75% | 0.753 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -97.9 | 117.5 | 163.3 | 11.3 | 7.4 | 0 | 0 | 0 | 110.6 | A28 | P26-A28 PolarHBondContact O-N 3.29Š|
| 27 | T | 34.6 | Very low | 37 | Very low | 132 Ų | 132 | 134.9 Ų | 134.9 | 81% | 0.81 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 124.4 | 168 | -37.7 | 0 | 0 | 0 | 0 | 110.6 | ||
| 28 | A | 36 | Very low | 37.1 | Very low | 88 Ų | 88 | 132.4 Ų | 132.4 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 133 | 170.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | P26 | P26-A28 PolarHBondContact O-N 3.29Š|
| 29 | P | 34.8 | Very low | 37 | Very low | 120 Ų | 120 | 132.6 Ų | 132.6 | 78% | 0.779 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 139.4 | 172.8 | 29.7 | -29.9 | 0 | 0 | 0 | 111 | ||
| 30 | A | 36.8 | Very low | 36.8 | Very low | 108 Ų | 108 | 127 Ų | 127 | 89% | 0.893 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 126.7 | 168.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 31 | S | 36 | Very low | 36.7 | Very low | 96 Ų | 96 | 128 Ų | 128 | 67% | 0.671 | 79% | 0.79 | S | S | * | * | trans | -132.9 | 105.8 | 162.7 | 53.6 | 0 | 0 | 0 | 0 | 110.2 | H33 | S31-H33 PolarHBondContact O-N 2.99Š| ||
| 32 | N | 36.5 | Very low | 36.7 | Very low | 169 Ų | 169 | 126.1 Ų | 126.1 | 90% | 0.904 | 79% | 0.788 | S | S | * | * | trans | -67.3 | 114.3 | 161.3 | -87.2 | -20.9 | 0 | 0 | 0 | 108.6 | ||||
| 33 | H | 38.2 | Very low | 37 | Very low | 165 Ų | 165 | 126 Ų | 126 | 76% | 0.764 | 79% | 0.787 | S | S | * | * | trans | -127 | 132.6 | 158.5 | -76.2 | -74.1 | 0 | 0 | 0 | 109.5 | S31 | S31-H33 PolarHBondContact O-N 2.99Š| ||
| 34 | P | 39.3 | Very low | 37.1 | Very low | 122 Ų | 122 | 122.7 Ų | 122.7 | 79% | 0.792 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -70 | 145.7 | 177.2 | 28.3 | -31.8 | 0 | 0 | 0 | 110.9 | A36 | P34-A36 PolarHBondContact O-N 3.26Š|
| 35 | A | 36.3 | Very low | 36.8 | Very low | 102 Ų | 102 | 121 Ų | 121 | 84% | 0.843 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 131.9 | 178 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 36 | A | 38.4 | Very low | 36.7 | Very low | 91 Ų | 91 | 120.3 Ų | 120.3 | 75% | 0.752 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 141.1 | 169.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | P34 N38 | P34-A36 PolarHBondContact O-N 3.26Å; A36-N38 PolarHBondContact O-N 3.49Å |
| 37 | P | 38.7 | Very low | 37 | Very low | 124 Ų | 124 | 118.4 Ų | 118.4 | 81% | 0.805 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -75 | 122.9 | 175.6 | 29 | -30.3 | 0 | 0 | 0 | 110.1 | ||
| 38 | N | 42 | Very low | 37.1 | Very low | 140 Ų | 140 | 116.4 Ų | 116.4 | 75% | 0.749 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 130.5 | 178.3 | -161.2 | 16.4 | 0 | 0 | 0 | 110.6 | A36 | A36-N38 PolarHBondContact O-N 3.49Š|
| 39 | P | 36.2 | Very low | 37.2 | Very low | 109 Ų | 109 | 118.4 Ų | 118.4 | 71% | 0.708 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 125 | -178.9 | -6.6 | 24.3 | 0 | 0 | 0 | 112.1 | ||
| 40 | G | 31.8 | Very low | 37.5 | Very low | 71 Ų | 71 | 119.3 Ų | 119.3 | 73% | 0.732 | 80% | 0.797 | S | S | * | * | trans | 50.3 | 100.8 | 145.8 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 41 | W | 36.3 | Very low | 37.5 | Very low | 230 Ų | 230 | 122.6 Ų | 122.6 | 87% | 0.871 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -96 | 131.9 | 152.4 | -77.8 | 92.8 | 0 | 0 | 0 | 109.7 | ||
| 42 | P | 39.2 | Very low | 37.7 | Very low | 118 Ų | 118 | 124 Ų | 124 | 77% | 0.766 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 133.8 | 177.7 | 27.6 | -31.1 | 0 | 0 | 0 | 110.6 | ||
| 43 | G | 37.7 | Very low | 37.8 | Very low | 65 Ų | 65 | 121.5 Ų | 121.5 | 67% | 0.67 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 152.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 44 | S | 39.8 | Very low | 37.7 | Very low | 123 Ų | 123 | 118 Ų | 118 | 86% | 0.86 | 80% | 0.796 | S | S | * | * | trans | 65.6 | 99.1 | 155.2 | -43.5 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 45 | A | 32.6 | Very low | 37.4 | Very low | 101 Ų | 101 | 118.7 Ų | 118.7 | 84% | 0.835 | 80% | 0.8 | S | S | * | * | trans | -75.3 | 131.8 | 156.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 46 | P | 32.4 | Very low | 37.3 | Very low | 136 Ų | 136 | 118.5 Ų | 118.5 | 88% | 0.883 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -78.8 | 133.9 | 179.3 | -0.9 | 17.3 | 0 | 0 | 0 | 111.2 | ||
| 47 | G | 43.3 | Very low | 37 | Very low | 77 Ų | 77 | 121.8 Ų | 121.8 | 79% | 0.794 | 80% | 0.804 | S | S | * | * | trans | 141.9 | 17.1 | 164.8 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 48 | A | 36.8 | Very low | 36.5 | Very low | 90 Ų | 90 | 125.9 Ų | 125.9 | 74% | 0.744 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 133 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | T50 | A48-T50 PolarHBondContact O-N 2.84Š|
| 49 | P | 37.3 | Very low | 36.2 | Very low | 130 Ų | 130 | 124.1 Ų | 124.1 | 84% | 0.844 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 124.9 | 175.5 | 24.7 | -29.4 | 0 | 0 | 0 | 110.9 | ||
| 50 | T | 42.7 | Very low | 35.9 | Very low | 139 Ų | 139 | 122.9 Ų | 122.9 | 85% | 0.853 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 126.9 | 177.9 | 45.5 | 0 | 0 | 0 | 0 | 111.7 | A48 | A48-T50 PolarHBondContact O-N 2.84Š|
| 51 | Q | 36.1 | Very low | 35.8 | Very low | 177 Ų | 177 | 123 Ų | 123 | 83% | 0.827 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 135.9 | 171.9 | -163.3 | -177.7 | -12.7 | 0 | 0 | 110.4 | S53 | Q51-S53 PolarHBondContact O-N 3.41Š|
| 52 | P | 39 | Very low | 35.8 | Very low | 124 Ų | 124 | 120.2 Ų | 120.2 | 81% | 0.805 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 124.5 | 178.9 | -14.4 | 28.2 | 0 | 0 | 0 | 111.4 | ||
| 53 | S | 38.7 | Very low | 35.5 | Very low | 117 Ų | 117 | 120.3 Ų | 120.3 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -87.6 | 139.6 | 166.4 | -61.2 | 0 | 0 | 0 | 0 | 109.8 | Q51 | Q51-S53 PolarHBondContact O-N 3.41Š|
| 54 | A | 36 | Very low | 35.2 | Very low | 93 Ų | 93 | 120.6 Ų | 120.6 | 77% | 0.769 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 146.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 55 | P | 34.7 | Very low | 35.3 | Very low | 135 Ų | 135 | 121.3 Ų | 121.3 | 88% | 0.877 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -79 | 124 | 173.6 | -0.2 | 17.2 | 0 | 0 | 0 | 110.2 | ||
| 56 | A | 32.8 | Very low | 35.1 | Very low | 99 Ų | 99 | 119.9 Ų | 119.9 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | trans | -122.8 | 84.1 | 167.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 57 | D | 33.3 | Very low | 35.3 | Very low | 159 Ų | 159 | 118.2 Ų | 118.2 | 85% | 0.85 | 82% | 0.819 | S | S | * | * | trans | -129.2 | 97.8 | 162.3 | -90.1 | -32.3 | 0 | 0 | 0 | 107.8 | ||||
| 58 | F | 28.4 | Very low | 34.9 | Very low | 210 Ų | 210 | 120.7 Ų | 120.7 | 92% | 0.921 | 82% | 0.82 | S | S | * | * | trans | -158.1 | 131.4 | 141.3 | -137.7 | -99.3 | 0 | 0 | 0 | 111.1 | ||||
| 59 | S | 34.5 | Very low | 34.8 | Very low | 104 Ų | 104 | 119.5 Ų | 119.5 | 73% | 0.727 | 82% | 0.817 | S | S | * | * | trans | -95.9 | 153 | 176 | 44.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 60 | G | 30.1 | Very low | 34.9 | Very low | 82 Ų | 82 | 119.4 Ų | 119.4 | 85% | 0.845 | 82% | 0.817 | S | S | * | * | trans | 111.1 | 122.7 | 161 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 61 | G | 30.7 | Very low | 34.4 | Very low | 74 Ų | 74 | 122 Ų | 122 | 76% | 0.763 | 82% | 0.816 | S | S | * | * | trans | -90.5 | -174.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 62 | L | 34.8 | Very low | 34.1 | Very low | 172 Ų | 172 | 122.8 Ų | 122.8 | 90% | 0.901 | 82% | 0.82 | S | S | * | * | trans | 84.4 | 137.5 | 166 | -56.4 | 177.3 | 0 | 0 | 0 | 118.8 | ||||
| 63 | S | 33.6 | Very low | 34 | Very low | 120 Ų | 120 | 127.1 Ų | 127.1 | 84% | 0.839 | 82% | 0.822 | S | S | * | * | trans | 88.3 | 111.6 | 163.4 | 66.7 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 64 | G | 32 | Very low | 34 | Very low | 70 Ų | 70 | 127.6 Ų | 127.6 | 72% | 0.722 | 82% | 0.822 | S | S | * | * | trans | -74.7 | -175.4 | 147.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 65 | P | 40.6 | Very low | 34 | Very low | 138 Ų | 138 | 128.7 Ų | 128.7 | 90% | 0.896 | 82% | 0.824 | S | S | * | * | cis | -136.7 | 177 | 24 | 39.3 | -20.5 | 0 | 0 | 0 | 114.7 | ||||
| 66 | G | 29.8 | Very low | 34.1 | Very low | 72 Ų | 72 | 125.7 Ų | 125.7 | 74% | 0.742 | 82% | 0.817 | S | S | * | * | trans | 128.4 | 104.3 | 154 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 67 | A | 35.3 | Very low | 34.7 | Very low | 101 Ų | 101 | 127.7 Ų | 127.7 | 84% | 0.835 | 82% | 0.822 | S | S | * | * | trans | -73.7 | 151 | 165.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 68 | P | 36.2 | Very low | 34.7 | Very low | 128 Ų | 128 | 123.8 Ų | 123.8 | 83% | 0.831 | 82% | 0.82 | S | S | * | * | trans | -121.4 | 140.9 | 136.3 | 6.9 | 14 | 0 | 0 | 0 | 111.7 | ||||
| 69 | G | 34.2 | Very low | 35.1 | Very low | 65 Ų | 65 | 118.8 Ų | 118.8 | 67% | 0.67 | 82% | 0.817 | S | S | * | * | trans | -69.6 | 177 | -167.9 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 70 | P | 38.8 | Very low | 35.4 | Very low | 129 Ų | 129 | 120.2 Ų | 120.2 | 84% | 0.838 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -86 | 146.4 | -172.5 | 32.4 | -31.6 | 0 | 0 | 0 | 113.3 | ||
| 71 | F | 32.9 | Very low | 35.6 | Very low | 193 Ų | 193 | 119.6 Ų | 119.6 | 85% | 0.846 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 143.1 | 179 | -69.8 | -93.8 | 0 | 0 | 0 | 113.4 | ||
| 72 | Q | 30.1 | Very low | 35.9 | Very low | 193 Ų | 193 | 125.3 Ų | 125.3 | 90% | 0.902 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 136.3 | 171.7 | -65.2 | -174.8 | -52.1 | 0 | 0 | 110.9 | ||
| 73 | Y | 37.1 | Very low | 36.1 | Very low | 215 Ų | 215 | 127.9 Ų | 127.9 | 84% | 0.843 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -101.1 | 141.1 | 160.7 | -72.7 | -85.5 | 0 | 0 | 0 | 109.5 | ||
| 74 | P | 37.2 | Very low | 36.4 | Very low | 127 Ų | 127 | 128.4 Ų | 128.4 | 83% | 0.825 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -85 | 133.4 | 174.2 | 31.5 | -28.9 | 0 | 0 | 0 | 111 | ||
| 75 | S | 37.3 | Very low | 36.6 | Very low | 117 Ų | 117 | 128.3 Ų | 128.3 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | trans | -111.1 | 130.5 | 171.8 | -41.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 76 | G | 37.2 | Very low | 36.7 | Very low | 71 Ų | 71 | 127.6 Ų | 127.6 | 73% | 0.732 | 82% | 0.818 | S | S | * | * | trans | -69.8 | 167.2 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 77 | P | 43.7 | Very low | 37.2 | Very low | 141 Ų | 141 | 130.5 Ų | 130.5 | 92% | 0.916 | 82% | 0.824 | S | S | * | * | trans | -92.7 | 139.6 | -162.2 | 33.9 | -31.3 | 0 | 0 | 0 | 113.4 | ||||
| 78 | G | 33.6 | Very low | 37.3 | Very low | 78 Ų | 78 | 131.4 Ų | 131.4 | 80% | 0.804 | 82% | 0.824 | S | S | * | * | trans | 160.7 | 97.4 | 158.8 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 79 | A | 36.6 | Very low | 37.5 | Very low | 104 Ų | 104 | 130 Ų | 130 | 86% | 0.86 | 82% | 0.824 | S | S | * | * | trans | 90 | 144.3 | 149.9 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 80 | P | 41.2 | Very low | 37.8 | Very low | 134 Ų | 134 | 133 Ų | 133 | 87% | 0.87 | 83% | 0.831 | S | S | * | * | trans | -109.3 | 147 | -158.4 | 37.7 | -24.5 | 0 | 0 | 0 | 114.1 | ||||
| 81 | G | 35.3 | Very low | 37.5 | Very low | 69 Ų | 69 | 131 Ų | 131 | 71% | 0.711 | 83% | 0.834 | S | S | * | * | trans | -168.6 | 111.9 | 168.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 82 | Q | 36.3 | Very low | 37.5 | Very low | 194 Ų | 194 | 125.5 Ų | 125.5 | 91% | 0.907 | 83% | 0.832 | S | S | * | * | trans | -80.6 | 138.1 | -174.6 | -60.4 | -165.7 | 1.6 | 0 | 0 | 112.2 | ||||
| 83 | Y | 39 | Very low | 37.8 | Very low | 227 Ų | 227 | 126 Ų | 126 | 89% | 0.89 | 83% | 0.831 | S | S | * | * | trans | -122.5 | 133.7 | 160.8 | -74.3 | -85.4 | 0 | 0 | 0 | 109 | ||||
| 84 | P | 39.9 | Very low | 38.1 | Very low | 131 Ų | 131 | 122.1 Ų | 122.1 | 85% | 0.851 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 136.3 | 178.1 | -10.2 | 26.6 | 0 | 0 | 0 | 112.4 | ||
| 85 | G | 37.2 | Very low | 37.9 | Very low | 67 Ų | 67 | 121 Ų | 121 | 69% | 0.691 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -79.1 | 172.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 86 | P | 42.5 | Very low | 38 | Very low | 124 Ų | 124 | 119 Ų | 119 | 81% | 0.805 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -88.3 | 155.7 | -164.6 | 35.8 | -34.7 | 0 | 0 | 0 | 113.2 | ||
| 87 | P | 40.3 | Very low | 38.4 | Very low | 132 Ų | 132 | 122.3 Ų | 122.3 | 86% | 0.857 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -95.6 | 139.2 | 165.2 | 29.4 | -21 | 0 | 0 | 0 | 113 | ||
| 88 | S | 37.2 | Very low | 37.8 | Very low | 121 Ų | 121 | 119.5 Ų | 119.5 | 85% | 0.846 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 155.2 | 179.2 | -45.5 | 0 | 0 | 0 | 0 | 113.6 | ||
| 89 | A | 39.3 | Very low | 37.9 | Very low | 99 Ų | 99 | 122.4 Ų | 122.4 | 82% | 0.818 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 162.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 90 | P | 40.7 | Very low | 38.2 | Very low | 126 Ų | 126 | 123.3 Ų | 123.3 | 82% | 0.818 | 84% | 0.836 | S | S | * | * | trans | -142.7 | 134 | 141.5 | 32.9 | -15.5 | 0 | 0 | 0 | 116.3 | ||||
| 91 | G | 33.6 | Very low | 37.8 | Very low | 88 Ų | 88 | 120.4 Ų | 120.4 | 91% | 0.907 | 83% | 0.83 | S | S | * | * | trans | 50.5 | 152.1 | 146.1 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 92 | G | 31.6 | Very low | 37.7 | Very low | 77 Ų | 77 | 126.4 Ų | 126.4 | 79% | 0.794 | 84% | 0.84 | S | S | * | * | cis | 176.2 | 161 | 7.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 93 | F | 37.5 | Very low | 37.6 | Very low | 204 Ų | 204 | 127.9 Ų | 127.9 | 90% | 0.895 | 84% | 0.838 | S | S | * | * | trans | -75 | 171.7 | -173.6 | -66.6 | -93.3 | 0 | 0 | 0 | 115.2 | ||||
| 94 | P | 43.7 | Very low | 37.6 | Very low | 134 Ų | 134 | 123.2 Ų | 123.2 | 87% | 0.87 | 84% | 0.836 | S | S | * | * | -142.9 | 177 | 102.1 | 36.4 | -19.6 | 0 | 0 | 0 | 116.1 | |||||
| 95 | A | 33.2 | Very low | 37.4 | Very low | 103 Ų | 103 | 121.5 Ų | 121.5 | 85% | 0.851 | 83% | 0.833 | S | S | * | * | trans | -123.8 | 158.9 | -159.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 96 | G | 38.4 | Very low | 37.6 | Very low | 75 Ų | 75 | 124.8 Ų | 124.8 | 77% | 0.773 | 84% | 0.842 | S | S | * | * | trans | 91 | 156.8 | 149.2 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 97 | P | 45.4 | Very low | 37.1 | Very low | 141 Ų | 141 | 122.7 Ų | 122.7 | 92% | 0.916 | 84% | 0.843 | S | S | * | * | cis | -141.2 | 164.9 | 25 | 39.5 | -19.9 | 0 | 0 | 0 | 118.7 | ||||
| 98 | G | 32.1 | Very low | 36.9 | Very low | 81 Ų | 81 | 121.1 Ų | 121.1 | 84% | 0.835 | 84% | 0.841 | S | S | * | * | trans | 142.3 | 110.3 | 152.9 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 99 | V | 35.3 | Very low | 37.1 | Very low | 139 Ų | 139 | 121.6 Ų | 121.6 | 84% | 0.842 | 84% | 0.841 | S | S | * | * | trans | -132 | 166.8 | -177.3 | 162 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 100 | P | 42.4 | Very low | 36.6 | Very low | 124 Ų | 124 | 120.3 Ų | 120.3 | 81% | 0.805 | 84% | 0.838 | S | S | * | * | cis | -138.7 | 171 | 11.3 | 19 | 8.4 | 0 | 0 | 0 | 118.3 | ||||
| 101 | G | 32.6 | Very low | 36.3 | Very low | 73 Ų | 73 | 123.4 Ų | 123.4 | 75% | 0.753 | 84% | 0.841 | S | S | * | * | trans | -173.5 | 119.8 | 156.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 102 | Q | 33.1 | Very low | 36.3 | Very low | 194 Ų | 194 | 129.1 Ų | 129.1 | 91% | 0.907 | 84% | 0.842 | S | S | * | * | trans | -72.6 | 152 | -161.5 | -64.3 | 168.8 | 0.9 | 0 | 0 | 117.3 | ||||
| 103 | Y | 35.7 | Very low | 36.6 | Very low | 225 Ų | 225 | 131.7 Ų | 131.7 | 88% | 0.882 | 84% | 0.844 | S | S | * | * | trans | -93.8 | 155 | 157.5 | -65.4 | -90.3 | 0 | 0 | 0 | 110.5 | ||||
| 104 | P | 37.1 | Very low | 36.5 | Very low | 129 Ų | 129 | 127.5 Ų | 127.5 | 84% | 0.838 | 84% | 0.84 | S | S | * | * | trans | -121.7 | 143.2 | 147.5 | 14.2 | 6.3 | 0 | 0 | 0 | 113.5 | ||||
| 105 | A | 37.3 | Very low | 36.3 | Very low | 95 Ų | 95 | 126.8 Ų | 126.8 | 79% | 0.785 | 84% | 0.839 | S | S | * | * | trans | -82.9 | 168.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 106 | P | 40.3 | Very low | 36.7 | Very low | 136 Ų | 136 | 128.1 Ų | 128.1 | 88% | 0.883 | 84% | 0.838 | S | S | * | * | trans | -83.1 | 139.4 | -165.9 | -2.4 | 20.3 | 0 | 0 | 0 | 114.2 | ||||
| 107 | G | 32.8 | Very low | 36.4 | Very low | 80 Ų | 80 | 128.2 Ų | 128.2 | 83% | 0.825 | 84% | 0.839 | S | S | * | * | trans | -120 | 139.1 | 168.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 108 | A | 35.3 | Very low | 35.9 | Very low | 99 Ų | 99 | 126.4 Ų | 126.4 | 82% | 0.818 | 84% | 0.836 | S | S | * | * | trans | -91.6 | -176.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 109 | P | 41.1 | Very low | 36.2 | Very low | 131 Ų | 131 | 128.6 Ų | 128.6 | 85% | 0.851 | 84% | 0.836 | S | S | * | * | -111.1 | 145.6 | -74.1 | 34.5 | -22.1 | 0 | 0 | 0 | 110.9 | |||||
| 110 | G | 30.5 | Very low | 36 | Very low | 72 Ų | 72 | 125.3 Ų | 125.3 | 74% | 0.742 | 83% | 0.83 | S | S | * | * | trans | -164 | 107.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 111 | Q | 33.5 | Very low | 35.6 | Very low | 192 Ų | 192 | 128.3 Ų | 128.3 | 90% | 0.897 | 83% | 0.833 | S | S | * | * | trans | 60.3 | 117.1 | 144.7 | -57.4 | -165.4 | -2.9 | 0 | 0 | 120.3 | ||||
| 112 | F | 34.3 | Very low | 35.6 | Very low | 208 Ų | 208 | 134.1 Ų | 134.1 | 91% | 0.912 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 138.9 | 166.4 | -65.6 | -89.7 | 0 | 0 | 0 | 112.7 | ||
| 113 | P | 37.7 | Very low | 36.2 | Very low | 130 Ų | 130 | 131 Ų | 131 | 84% | 0.844 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -89.3 | 137.2 | 156.4 | -8.6 | 26.8 | 0 | 0 | 0 | 111.6 | ||
| 114 | S | 34.8 | Very low | 36 | Very low | 116 Ų | 116 | 123 Ų | 123 | 81% | 0.811 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 146.1 | -175.7 | -44 | 0 | 0 | 0 | 0 | 114.2 | ||
| 115 | S | 38.9 | Very low | 35.9 | Very low | 120 Ų | 120 | 126.4 Ų | 126.4 | 84% | 0.839 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -59 | 147.2 | 166.5 | -57.1 | 0 | 0 | 0 | 0 | 112.8 | ||
| 116 | P | 42.8 | Very low | 35.8 | Very low | 130 Ų | 130 | 133 Ų | 133 | 84% | 0.844 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -102.1 | 120.4 | 162.5 | 8.2 | 12 | 0 | 0 | 0 | 112.3 | ||
| 117 | G | 30.7 | Very low | 36.1 | Very low | 77 Ų | 77 | 132.2 Ų | 132.2 | 79% | 0.794 | 83% | 0.827 | S | S | * | * | trans | 80.9 | 96.5 | 130 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 118 | A | 35.7 | Very low | 36.2 | Very low | 103 Ų | 103 | 132.9 Ų | 132.9 | 85% | 0.851 | 82% | 0.818 | S | S | * | * | trans | -97 | 144 | 145.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 119 | P | 38.7 | Very low | 36.1 | Very low | 128 Ų | 128 | 136.9 Ų | 136.9 | 83% | 0.831 | 82% | 0.82 | S | S | * | * | trans | -114.3 | 118.6 | 162.1 | 30 | -17.3 | 0 | 0 | 0 | 112.9 | ||||
| 120 | G | 30.9 | Very low | 35.6 | Very low | 69 Ų | 69 | 134.3 Ų | 134.3 | 71% | 0.711 | 82% | 0.818 | S | S | * | * | trans | 79 | 127.9 | 131.6 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 121 | Q | 33.6 | Very low | 35.9 | Very low | 187 Ų | 187 | 137.6 Ų | 137.6 | 87% | 0.874 | 82% | 0.824 | S | S | * | * | 158 | 114.3 | 110 | -75.7 | -74.8 | -5.5 | 0 | 0 | 110 | |||||
| 122 | F | 32.7 | Very low | 36.3 | Very low | 196 Ų | 196 | 134.3 Ų | 134.3 | 86% | 0.86 | 82% | 0.819 | S | S | * | * | trans | -106.3 | 155.7 | 156.6 | -86.9 | -81.3 | 0 | 0 | 0 | 107.7 | ||||
| 123 | P | 45 | Very low | 36.1 | Very low | 127 Ų | 127 | 127.8 Ų | 127.8 | 83% | 0.825 | 81% | 0.81 | S | S | * | * | -140 | 152.2 | 98.8 | 33.3 | -17.3 | 0 | 0 | 0 | 110.8 | |||||
| 124 | G | 33.1 | Very low | 35.9 | Very low | 58 Ų | 58 | 130.5 Ų | 130.5 | 60% | 0.598 | 81% | 0.812 | S | S | * | * | cis | 116 | 114.5 | 32.3 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 125 | Q | 33.9 | Very low | 36.1 | Very low | 200 Ų | 200 | 133.1 Ų | 133.1 | 94% | 0.935 | 82% | 0.816 | S | S | * | * | trans | 180 | 114.6 | 150.5 | -101.1 | 170.2 | 59.8 | 0 | 0 | 112.3 | ||||
| 126 | Y | 35.2 | Very low | 36.2 | Very low | 233 Ų | 233 | 133.1 Ų | 133.1 | 91% | 0.914 | 81% | 0.813 | S | S | * | * | trans | -116.6 | 158.6 | 151.8 | -85.3 | -82.2 | 0 | 0 | 0 | 106.2 | ||||
| 127 | P | 47.4 | Very low | 35.6 | Very low | 121 Ų | 121 | 130.6 Ų | 130.6 | 79% | 0.786 | 81% | 0.81 | S | S | * | * | -153 | -176.9 | 86.7 | 41.4 | -21.3 | 0 | 0 | 0 | 112.4 | |||||
| 128 | S | 35.3 | Very low | 35.6 | Very low | 93 Ų | 93 | 130.6 Ų | 130.6 | 65% | 0.65 | 81% | 0.811 | S | S | * | * | cis | -160.7 | 150.4 | -11.4 | -132.6 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 129 | E | 33.2 | Very low | 36.1 | Very low | 183 Ų | 183 | 131.7 Ų | 131.7 | 86% | 0.855 | 81% | 0.809 | S | S | * | * | trans | 37.7 | 134.7 | 138.9 | -71.6 | 175.1 | 119.1 | 0 | 0 | 124.4 | ||||
| 130 | G | 31 | Very low | 36 | Very low | 78 Ų | 78 | 130.2 Ų | 130.2 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | trans | -172.7 | 110.1 | 149.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 131 | T | 36.8 | Very low | 36.6 | Very low | 140 Ų | 140 | 132.7 Ų | 132.7 | 86% | 0.859 | 81% | 0.811 | S | S | * | * | trans | -79.1 | 175.5 | -168.5 | 0.5 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 132 | P | 40.9 | Very low | 36.7 | Very low | 123 Ų | 123 | 134.6 Ų | 134.6 | 80% | 0.799 | 81% | 0.812 | S | S | * | * | trans | -103.6 | 165.1 | -152.9 | 40.9 | -39.5 | 0 | 0 | 0 | 117.2 | ||||
| 133 | G | 30.4 | Very low | 37.1 | Very low | 71 Ų | 71 | 131.2 Ų | 131.2 | 73% | 0.732 | 81% | 0.809 | S | S | * | * | trans | 125.9 | 125.7 | 148.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 134 | Q | 33.1 | Very low | 36.4 | Very low | 188 Ų | 188 | 131 Ų | 131 | 88% | 0.879 | 81% | 0.811 | S | S | * | * | 167.3 | 118.4 | 123 | -92 | -170.8 | 44.5 | 0 | 0 | 112.1 | |||||
| 135 | L | 39 | Very low | 36.5 | Very low | 170 Ų | 170 | 131.3 Ų | 131.3 | 89% | 0.89 | 81% | 0.814 | S | S | * | * | trans | -87.7 | 146.1 | 146.1 | -72.9 | 166.8 | 0 | 0 | 0 | 107.4 | ||||
| 136 | P | 40.5 | Very low | 36.8 | Very low | 121 Ų | 121 | 128 Ų | 128 | 79% | 0.786 | 81% | 0.81 | S | S | * | * | -145.3 | 159.2 | 105.8 | 34 | -17.1 | 0 | 0 | 0 | 110.9 | |||||
| 137 | G | 31.1 | Very low | 36.9 | Very low | 76 Ų | 76 | 126.3 Ų | 126.3 | 78% | 0.784 | 81% | 0.808 | S | S | * | * | cis | 171.2 | 156.3 | 18.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 138 | G | 30.2 | Very low | 36.6 | Very low | 78 Ų | 78 | 126.5 Ų | 126.5 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | -83.8 | -166.6 | 165.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 139 | P | 45.6 | Very low | 36.8 | Very low | 125 Ų | 125 | 127.8 Ų | 127.8 | 81% | 0.812 | 82% | 0.818 | S | S | * | * | cis | -138 | 160.2 | 6.1 | 38.7 | -19.6 | 0 | 0 | 0 | 117.7 | ||||
| 140 | A | 37.1 | Very low | 37.1 | Very low | 98 Ų | 98 | 122.4 Ų | 122.4 | 81% | 0.81 | 81% | 0.812 | S | S | * | * | trans | 62.4 | 165.9 | 149.8 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 141 | P | 44.4 | Very low | 37.4 | Very low | 120 Ų | 120 | 125.4 Ų | 125.4 | 78% | 0.779 | 82% | 0.817 | S | S | * | * | cis | -128.6 | 172.4 | -4.6 | 36.8 | -17.7 | 0 | 0 | 0 | 115.3 | ||||
| 142 | Y | 35.4 | Very low | 37.3 | Very low | 228 Ų | 228 | 122.5 Ų | 122.5 | 89% | 0.894 | 82% | 0.815 | S | S | * | * | trans | -67.3 | 154.4 | 174.6 | -60.9 | -91.9 | 0 | 0 | 0 | 113.9 | ||||
| 143 | P | 40 | Very low | 37.1 | Very low | 124 Ų | 124 | 121.3 Ų | 121.3 | 81% | 0.805 | 82% | 0.815 | S | S | * | * | trans | -132.3 | 151.1 | 132.6 | 31.4 | -16.3 | 0 | 0 | 0 | 114.5 | ||||
| 144 | S | 31.8 | Very low | 37.6 | Very low | 124 Ų | 124 | 124.3 Ų | 124.3 | 87% | 0.867 | 82% | 0.822 | S | S | * | * | trans | -62.4 | 140 | 177.5 | 48.8 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 145 | G | 33.9 | Very low | 37.7 | Very low | 63 Ų | 63 | 120.2 Ų | 120.2 | 65% | 0.649 | 82% | 0.82 | S | S | * | * | trans | 174.5 | 145.3 | 163.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 146 | P | 41.4 | Very low | 37.4 | Very low | 131 Ų | 131 | 115.7 Ų | 115.7 | 85% | 0.851 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -84.4 | 144.4 | -152 | 32.9 | -34.7 | 0 | 0 | 0 | 114.7 | ||
| 147 | F | 36.8 | Very low | 37.8 | Very low | 197 Ų | 197 | 115.5 Ų | 115.5 | 86% | 0.864 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 141.4 | 172.9 | -65.2 | -85.2 | 0 | 0 | 0 | 111.9 | ||
| 148 | P | 41.8 | Very low | 37.9 | Very low | 126 Ų | 126 | 122.9 Ų | 122.9 | 82% | 0.818 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 127 | 169.5 | 31.2 | -29.8 | 0 | 0 | 0 | 111.4 | ||
| 149 | S | 39.5 | Very low | 38.9 | Very low | 120 Ų | 120 | 125.2 Ų | 125.2 | 84% | 0.839 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 133.7 | 172.7 | -37.4 | 0 | 0 | 0 | 0 | 111.2 | ||
| 150 | G | 39.3 | Very low | 38.3 | Very low | 70 Ų | 70 | 125.8 Ų | 125.8 | 72% | 0.722 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 159.2 | 167.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 151 | P | 36 | Very low | 38.2 | Very low | 140 Ų | 140 | 126.8 Ų | 126.8 | 91% | 0.909 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -91.3 | 142 | -164.7 | 1.7 | 18.2 | 0 | 0 | 0 | 113.1 | ||
| 152 | G | 34.7 | Very low | 38.1 | Very low | 80 Ų | 80 | 126.8 Ų | 126.8 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | trans | 171.5 | -12.5 | 161.8 | 0 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 153 | A | 36.9 | Very low | 38 | Very low | 97 Ų | 97 | 125.4 Ų | 125.4 | 80% | 0.802 | 81% | 0.811 | S | S | * | * | trans | -151.8 | 127.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 154 | P | 41.5 | Very low | 38.3 | Very low | 134 Ų | 134 | 125.4 Ų | 125.4 | 87% | 0.87 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -92 | 133.2 | 169.2 | 30.4 | -26 | 0 | 0 | 0 | 112.7 | ||
| 155 | A | 34.9 | Very low | 38.1 | Very low | 102 Ų | 102 | 123.3 Ų | 123.3 | 84% | 0.843 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 144.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 156 | G | 32.5 | Very low | 38 | Very low | 75 Ų | 75 | 124.2 Ų | 124.2 | 77% | 0.773 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 169.8 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 157 | P | 49.3 | Very low | 37.6 | Very low | 118 Ų | 118 | 127.2 Ų | 127.2 | 77% | 0.766 | 82% | 0.821 | S | S | * | * | trans | -114.5 | 132.4 | 176.5 | 35.6 | -22.7 | 0 | 0 | 0 | 113.3 | ||||
| 158 | Y | 33.9 | Very low | 38.4 | Very low | 230 Ų | 230 | 123.5 Ų | 123.5 | 90% | 0.902 | 82% | 0.817 | S | S | * | * | trans | -129.2 | 145.9 | 146 | -75.3 | -74 | 0 | 0 | 0 | 107.8 | ||||
| 159 | P | 49.7 | Very low | 37.8 | Very low | 127 Ų | 127 | 122.2 Ų | 122.2 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | -148.1 | 138.3 | 106.3 | 31.6 | -12 | 0 | 0 | 0 | 117 | |||||
| 160 | N | 33 | Very low | 37.5 | Very low | 138 Ų | 138 | 120.7 Ų | 120.7 | 74% | 0.738 | 82% | 0.82 | S | S | * | * | trans | 53.1 | 110.5 | 134.3 | -127.9 | 40.4 | 0 | 0 | 0 | 125.2 | ||||
| 161 | V | 35.8 | Very low | 37.1 | Very low | 118 Ų | 118 | 120.5 Ų | 120.5 | 72% | 0.715 | 82% | 0.818 | S | S | * | * | trans | 54.1 | 160.7 | 133.3 | -55.5 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 162 | P | 42 | Very low | 37.2 | Very low | 120 Ų | 120 | 122.3 Ų | 122.3 | 78% | 0.779 | 82% | 0.82 | S | S | * | * | cis | -137.2 | 171.6 | 9.4 | 38.3 | -16.8 | 0 | 0 | 0 | 118 | ||||
| 163 | F | 33.2 | Very low | 37.1 | Very low | 200 Ų | 200 | 121.6 Ų | 121.6 | 88% | 0.877 | 81% | 0.813 | S | S | * | * | trans | -63.2 | 163.7 | 164.6 | -86 | -89.8 | 0 | 0 | 0 | 112 | ||||
| 164 | P | 46.6 | Very low | 36.8 | Very low | 124 Ų | 124 | 126.1 Ų | 126.1 | 81% | 0.805 | 82% | 0.819 | S | S | * | * | cis | -153.4 | 172.1 | 41.7 | 40.1 | -17.3 | 0 | 0 | 0 | 119.3 | ||||
| 165 | G | 28.3 | Very low | 36.7 | Very low | 79 Ų | 79 | 130.4 Ų | 130.4 | 81% | 0.814 | 82% | 0.82 | S | S | * | * | trans | 101.5 | 132.1 | 136.7 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 166 | G | 30.1 | Very low | 36.5 | Very low | 83 Ų | 83 | 128.8 Ų | 128.8 | 86% | 0.856 | 81% | 0.814 | S | S | * | * | trans | 106.4 | 103.2 | 137.6 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 167 | Q | 34.4 | Very low | 37 | Very low | 193 Ų | 193 | 131.7 Ų | 131.7 | 90% | 0.902 | 82% | 0.818 | S | S | * | * | trans | -54.3 | 176.1 | 152.1 | -80.4 | 170.3 | -71 | 0 | 0 | 112.3 | ||||
| 168 | P | 52.1 | Low | 36.1 | Very low | 120 Ų | 120 | 130.2 Ų | 130.2 | 78% | 0.779 | 83% | 0.825 | S | S | * | * | cis | -134.1 | -170.8 | 16.5 | 31.1 | -4.6 | 0 | 0 | 0 | 112 | ||||
| 169 | A | 30.8 | Very low | 36 | Very low | 99 Ų | 99 | 123 Ų | 123 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | cis | -176 | 161.6 | 43.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 170 | G | 33.3 | Very low | 35.2 | Very low | 87 Ų | 87 | 126.9 Ų | 126.9 | 90% | 0.897 | 83% | 0.828 | S | S | * | * | trans | 103.6 | 118.9 | 156.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 171 | G | 30.3 | Very low | 35.1 | Very low | 66 Ų | 66 | 124.3 Ų | 124.3 | 68% | 0.68 | 83% | 0.834 | S | S | * | * | cis | 152.2 | 138.1 | 9.7 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 172 | N | 37.2 | Very low | 35 | Very low | 178 Ų | 178 | 122.2 Ų | 122.2 | 95% | 0.952 | 84% | 0.837 | S | S | * | * | trans | 71.8 | 122.9 | 169.8 | -58.7 | 4.9 | 0 | 0 | 0 | 116 | ||||
| 173 | G | 32.7 | Very low | 34.7 | Very low | 65 Ų | 65 | 126.5 Ų | 126.5 | 67% | 0.67 | 84% | 0.843 | S | S | * | * | cis | 129.3 | 94 | 27.8 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 174 | M | 31.6 | Very low | 35.7 | Very low | 192 Ų | 192 | 122.7 Ų | 122.7 | 95% | 0.946 | 84% | 0.838 | S | S | * | * | 61.4 | 107.9 | 94.8 | -119.4 | 176.9 | 177.5 | 0 | 0 | 115.7 | |||||
| 175 | Y | 38.9 | Very low | 35.8 | Very low | 224 Ų | 224 | 122.4 Ų | 122.4 | 88% | 0.878 | 84% | 0.837 | S | S | * | * | trans | -162.9 | 123.7 | 133.4 | 51.3 | -92.1 | 0 | 0 | 0 | 110.7 | ||||
| 176 | G | 30.5 | Very low | 36.6 | Very low | 69 Ų | 69 | 124.7 Ų | 124.7 | 71% | 0.711 | 84% | 0.837 | S | S | * | * | trans | -88.7 | -149.4 | 165.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 177 | P | 44 | Very low | 36.9 | Very low | 135 Ų | 135 | 125.8 Ų | 125.8 | 88% | 0.877 | 84% | 0.838 | S | S | * | * | cis | -138.1 | 173.3 | -5.5 | 39.4 | -20.6 | 0 | 0 | 0 | 115.3 | ||||
| 178 | G | 30.4 | Very low | 36.9 | Very low | 87 Ų | 87 | 119.8 Ų | 119.8 | 90% | 0.897 | 83% | 0.828 | S | S | * | * | trans | 107.3 | 129.8 | 146.8 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 179 | G | 31.3 | Very low | 36.3 | Very low | 80 Ų | 80 | 120.8 Ų | 120.8 | 83% | 0.825 | 83% | 0.834 | S | S | * | * | trans | 150.5 | 102.8 | 160.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 180 | Q | 33 | Very low | 36.9 | Very low | 207 Ų | 207 | 119.7 Ų | 119.7 | 97% | 0.967 | 83% | 0.833 | S | S | * | * | trans | -83.1 | 153.9 | 168.9 | -73.9 | -175.4 | -19.9 | 0 | 0 | 112 | ||||
| 181 | G | 30.3 | Very low | 36.9 | Very low | 84 Ų | 84 | 121 Ų | 121 | 87% | 0.866 | 83% | 0.828 | S | S | * | * | trans | 122.5 | 136.4 | 160.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 182 | G | 33.3 | Very low | 37.4 | Very low | 75 Ų | 75 | 127.8 Ų | 127.8 | 77% | 0.773 | 84% | 0.839 | S | S | * | * | cis | -177.8 | 143.3 | -0.5 | 0 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 183 | F | 37 | Very low | 37.3 | Very low | 210 Ų | 210 | 124.4 Ų | 124.4 | 92% | 0.921 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -69 | 143.5 | 176.9 | -72.6 | -97.6 | 0 | 0 | 0 | 111 | ||
| 184 | P | 53.8 | Low | 37.2 | Very low | 119 Ų | 119 | 126.1 Ų | 126.1 | 77% | 0.773 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 143.7 | 167.9 | 30.1 | -30.4 | 0 | 0 | 0 | 111.6 | ||
| 185 | P | 49 | Very low | 37.4 | Very low | 118 Ų | 118 | 126.1 Ų | 126.1 | 77% | 0.766 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 168.3 | 178.7 | 33.5 | -34.7 | 0 | 0 | 0 | 112.9 | ||
| 186 | P | 44.7 | Very low | 37.3 | Very low | 128 Ų | 128 | 121.3 Ų | 121.3 | 83% | 0.831 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 140.3 | -169.8 | 32.9 | -33 | 0 | 0 | 0 | 112.1 | ||
| 187 | A | 37.4 | Very low | 37.4 | Very low | 105 Ų | 105 | 122.2 Ų | 122.2 | 87% | 0.868 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -90.3 | 122.8 | 169.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 188 | G | 34.4 | Very low | 36.8 | Very low | 67 Ų | 67 | 119 Ų | 119 | 69% | 0.691 | 83% | 0.827 | S | S | * | * | trans | -75.8 | 178.5 | 168.5 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 189 | P | 37.7 | Very low | 36.9 | Very low | 141 Ų | 141 | 118.9 Ų | 118.9 | 92% | 0.916 | 83% | 0.826 | S | S | * | * | S | Bend | trans | -87.2 | 137.3 | -147.9 | 33 | -33.6 | 0 | 0 | 0 | 113.8 | ||
| 190 | G | 45.1 | Very low | 37.2 | Very low | 76 Ų | 76 | 124.5 Ų | 124.5 | 78% | 0.784 | 83% | 0.828 | S | S | * | * | trans | 113.5 | 72.5 | 159.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 191 | S | 32.4 | Very low | 37.6 | Very low | 114 Ų | 114 | 119.8 Ų | 119.8 | 80% | 0.797 | 82% | 0.815 | S | S | * | * | trans | -176.7 | 108.5 | 152.7 | 51.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 192 | F | 39.9 | Very low | 38.2 | Very low | 209 Ų | 209 | 121.9 Ų | 121.9 | 92% | 0.917 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 137 | 165.3 | -71.5 | -80.8 | 0 | 0 | 0 | 109.6 | ||
| 193 | P | 35.5 | Very low | 38.8 | Very low | 107 Ų | 107 | 125.3 Ų | 125.3 | 70% | 0.695 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -79 | 146.8 | 175.4 | 30.7 | -31.1 | 0 | 0 | 0 | 111.9 | ||
| 194 | A | 31.4 | Very low | 38.8 | Very low | 102 Ų | 102 | 120.1 Ų | 120.1 | 84% | 0.843 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -73 | 140.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 195 | F | 36.5 | Very low | 37.9 | Very low | 191 Ų | 191 | 121.1 Ų | 121.1 | 84% | 0.838 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -103.6 | 141.8 | 166.4 | -76.6 | -81.7 | 0 | 0 | 0 | 111.2 | ||
| 196 | P | 35.9 | Very low | 37.6 | Very low | 124 Ų | 124 | 118.8 Ų | 118.8 | 81% | 0.805 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 155.2 | -179 | 34.7 | -32.6 | 0 | 0 | 0 | 112.1 | ||
| 197 | G | 33.3 | Very low | 37.1 | Very low | 87 Ų | 87 | 117.8 Ų | 117.8 | 90% | 0.897 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 157.9 | -166 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||
| 198 | G | 30.9 | Very low | 37.2 | Very low | 67 Ų | 67 | 124.7 Ų | 124.7 | 69% | 0.691 | 80% | 0.804 | S | S | * | * | trans | -165.8 | 128.8 | 166.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 199 | G | 33 | Very low | 37.2 | Very low | 85 Ų | 85 | 125.5 Ų | 125.5 | 88% | 0.876 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 151 | -165.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 200 | F | 36.9 | Very low | 37.1 | Very low | 199 Ų | 199 | 124.4 Ų | 124.4 | 87% | 0.873 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -92.6 | 147.6 | 170.4 | -70.9 | -91.1 | 0 | 0 | 0 | 110.8 | ||
| 201 | P | 41.5 | Very low | 37.2 | Very low | 108 Ų | 108 | 126.7 Ų | 126.7 | 70% | 0.701 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 158.5 | 172.2 | 29.5 | -33.6 | 0 | 0 | 0 | 111.8 | ||
| 202 | P | 41.8 | Very low | 37.2 | Very low | 128 Ų | 128 | 125.1 Ų | 125.1 | 83% | 0.831 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 136.8 | -172 | 27.6 | -34 | 0 | 0 | 0 | 112.5 | ||
| 203 | I | 46.3 | Very low | 36.8 | Very low | 147 Ų | 147 | 119.3 Ų | 119.3 | 75% | 0.754 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 133.8 | 176.5 | -50.6 | 172.5 | 0 | 0 | 0 | 108.7 | ||
| 204 | P | 37.2 | Very low | 36.6 | Very low | 101 Ų | 101 | 117.9 Ų | 117.9 | 66% | 0.656 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 148.3 | 173.2 | 28.1 | -32.2 | 0 | 0 | 0 | 111.2 | G206 | P204-G206 PolarHBondContact O-N 3.09Š|
| 205 | P | 34.3 | Very low | 36.6 | Very low | 140 Ų | 140 | 123 Ų | 123 | 91% | 0.909 | 82% | 0.817 | S | S | * | * | S | Bend | trans | -74.5 | 122.8 | -176.3 | 28.9 | -31 | 0 | 0 | 0 | 110.7 | ||
| 206 | G | 43.7 | Very low | 36.8 | Very low | 69 Ų | 69 | 119.2 Ų | 119.2 | 71% | 0.711 | 81% | 0.812 | S | S | * | * | trans | 158.8 | -3.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 118.4 | P204 | P204-G206 PolarHBondContact O-N 3.09Š| ||
| 207 | S | 33.6 | Very low | 36.7 | Very low | 106 Ų | 106 | 119.3 Ų | 119.3 | 74% | 0.741 | 81% | 0.811 | S | S | * | * | trans | -93.2 | 125.6 | -175.3 | -58.4 | 0 | 0 | 0 | 0 | 113.5 | G209 | S207-G209 PolarHBondContact O-N 2.75Š| ||
| 208 | W | 39.5 | Very low | 37.7 | Very low | 251 Ų | 251 | 120.8 Ų | 120.8 | 95% | 0.951 | 81% | 0.805 | S | S | * | * | trans | -42.6 | 124.6 | 172.1 | -60.3 | 81.6 | 0 | 0 | 0 | 112.3 | ||||
| 209 | G | 33.9 | Very low | 38.5 | Very low | 83 Ų | 83 | 123.5 Ų | 123.5 | 86% | 0.856 | 81% | 0.81 | S | S | * | * | trans | -60.8 | 145.8 | -172.3 | 0 | 0 | 0 | 0 | 0 | 114 | S207 | S207-G209 PolarHBondContact O-N 2.75Š| ||
| 210 | S | 37.3 | Very low | 38.4 | Very low | 119 Ų | 119 | 123.7 Ų | 123.7 | 83% | 0.832 | 80% | 0.804 | S | S | * | * | trans | -108.8 | 151 | 165.6 | -139.7 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 211 | P | 46.3 | Very low | 38.7 | Very low | 124 Ų | 124 | 123.3 Ų | 123.3 | 81% | 0.805 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 132.5 | -160.3 | 33.6 | -31 | 0 | 0 | 0 | 112.6 | ||
| 212 | G | 32.5 | Very low | 38.4 | Very low | 81 Ų | 81 | 127.8 Ų | 127.8 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 125.4 | 163.2 | 0 | 0 | 0 | 0 | 0 | 110 | ||
| 213 | G | 32.4 | Very low | 38 | Very low | 86 Ų | 86 | 124.6 Ų | 124.6 | 89% | 0.887 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 167.1 | -169.6 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 214 | G | 29.8 | Very low | 37.9 | Very low | 78 Ų | 78 | 124.2 Ų | 124.2 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | trans | 166.3 | 110.8 | 166.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 215 | F | 32.7 | Very low | 37.6 | Very low | 208 Ų | 208 | 122.2 Ų | 122.2 | 91% | 0.912 | 81% | 0.809 | S | S | * | * | trans | -85.2 | 144.1 | 160.2 | -82.6 | -84 | 0 | 0 | 0 | 108.5 | ||||
| 216 | P | 40.6 | Very low | 38 | Very low | 113 Ų | 113 | 122 Ų | 122 | 73% | 0.734 | 81% | 0.807 | S | S | * | * | -147.4 | 151.1 | 85.6 | 32.7 | -11.9 | 0 | 0 | 0 | 118.3 | |||||
| 217 | T | 33.4 | Very low | 38.2 | Very low | 125 Ų | 125 | 126.5 Ų | 126.5 | 77% | 0.767 | 81% | 0.812 | S | S | * | * | trans | 59.9 | 135.9 | 150.8 | 55.4 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 218 | P | 54.9 | Low | 38.6 | Very low | 119 Ų | 119 | 124 Ų | 124 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | trans | -87.7 | 171.8 | 170.1 | 40.1 | -33.8 | 0 | 0 | 0 | 110.9 | ||||
| 219 | P | 46.3 | Very low | 38.5 | Very low | 123 Ų | 123 | 117.7 Ų | 117.7 | 80% | 0.799 | 79% | 0.794 | S | S | * | * | cis | -142 | 152.8 | 29.6 | 38.8 | -18.6 | 0 | 0 | 0 | 116.9 | ||||
| 220 | A | 30.5 | Very low | 39.4 | Very low | 90 Ų | 90 | 122.1 Ų | 122.1 | 74% | 0.744 | 79% | 0.786 | S | S | * | * | trans | -160.5 | 121.3 | 150.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 221 | Q | 43.8 | Very low | 39.9 | Very low | 191 Ų | 191 | 119 Ų | 119 | 89% | 0.893 | 77% | 0.772 | S | S | * | * | trans | -55.6 | 122.1 | 169 | -174.5 | 176.6 | -0.4 | 0 | 0 | 112.3 | ||||
| 222 | F | 36 | Very low | 40.3 | Very low | 201 Ų | 201 | 114.2 Ų | 114.2 | 88% | 0.882 | 75% | 0.746 | S | S | * | * | trans | -137.3 | 110.4 | 159.2 | -88.2 | -95.3 | 0 | 0 | 0 | 104.9 | ||||
| 223 | G | 32.3 | Very low | 41.3 | Very low | 61 Ų | 61 | 115.8 Ų | 115.8 | 63% | 0.629 | 74% | 0.741 | S | S | * | * | 90.2 | 116.5 | 62.5 | 0 | 0 | 0 | 0 | 0 | 107.4 | G225 | G223-G225 PolarHBondContact O-N 3.5Å; G223-G225 VanDerWaalsContact O-N 3.17Å | |||
| 224 | P | 44.2 | Very low | 42.4 | Very low | 140 Ų | 140 | 115.2 Ų | 115.2 | 91% | 0.909 | 73% | 0.728 | S | S | * | * | trans | -74.1 | 112.2 | -168 | 30.5 | -31.5 | 0 | 0 | 0 | 109.9 | ||||
| 225 | G | 32.4 | Very low | 43.6 | Very low | 59 Ų | 59 | 111.8 Ų | 111.8 | 61% | 0.608 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -85.9 | 151.5 | 167.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | G223 M227 | G223-G225 PolarHBondContact O-N 3.5Å; G223-G225 VanDerWaalsContact O-N 3.17Å; G225-M227 PolarHBondContact O-N 3.44Å |
| 226 | P | 41.4 | Very low | 44.3 | Very low | 135 Ų | 135 | 108 Ų | 108 | 88% | 0.877 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 119.4 | -166.5 | 29.3 | -32.5 | 0 | 0 | 0 | 110.8 | ||
| 227 | M | 48.3 | Very low | 45.3 | Very low | 164 Ų | 164 | 106.5 Ų | 106.5 | 81% | 0.808 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 136.4 | 168.6 | -79.3 | -157.3 | -176 | 0 | 0 | 110.1 | G225 | G225-M227 PolarHBondContact O-N 3.44Š|
| 228 | G | 41.7 | Very low | 47.6 | Very low | 52 Ų | 52 | 103 Ų | 103 | 54% | 0.536 | 68% | 0.683 | S | S | . | * | P | Polyproline II helix | trans | -60 | 165.7 | 165.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y230 | G228-Y230 PolarHBondContact O-N 3.32Š|
| 229 | P | 38 | Very low | 49.4 | Very low | 120 Ų | 120 | 98.8 Ų | 98.8 | 78% | 0.779 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.3 | 15.5 | -161.3 | 29.9 | -35 | 0 | 0 | 0 | 115.7 | ||
| 230 | Y | 53.1 | Low | 51.7 | Low | 175 Ų | 175 | 94 Ų | 94 | 69% | 0.686 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.2 | 12.2 | -169.9 | -57.6 | -69.4 | 0 | 0 | 0 | 114.7 | G228 G232 | G228-Y230 PolarHBondContact O-N 3.32Å; Y230-G232 PolarHBondContact O-N 2.86Å |
| 231 | G | 46.8 | Very low | 54.8 | Low | 54 Ų | 54 | 95 Ų | 95 | 56% | 0.557 | 62% | 0.615 | S | S | * | * | trans | -82.5 | 110.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 232 | G | 54.8 | Low | 57.4 | Low | 24 Ų | 24 | 88.1 Ų | 88.1 | 25% | 0.247 | 59% | 0.585 | C | S | . | * | P | Polyproline II helix | trans | -60.9 | 166.9 | 163.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y230 A234 | Y230-G232 PolarHBondContact O-N 2.86Å; G232-A234 PolarHBondContact O-N 2.76Å; G232-A234 VanDerWaalsContact O-N 3.13Å |
| 233 | P | 54.1 | Low | 60.3 | Low | 113 Ų | 113 | 82.9 Ų | 82.9 | 73% | 0.734 | 57% | 0.572 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 121.1 | -177.9 | 21.7 | -30.1 | 0 | 0 | 0 | 110.8 | G235 | P233-G235 PolarHBondContact O-N 2.89Š|
| 234 | A | 54.7 | Low | 63.5 | Low | 74 Ų | 74 | 81 Ų | 81 | 61% | 0.612 | 55% | 0.546 | S | S | * | . | B | Isolated β-bridge | trans | -67.3 | 125.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 110 | G232 | G232-A234 PolarHBondContact O-N 2.76Å; G232-A234 VanDerWaalsContact O-N 3.13Å |
| 235 | G | 54.9 | Low | 66 | Low | 7 Ų | 7 | 77.5 Ų | 77.5 | 7% | 0.072 | 52% | 0.519 | C | S | . | . | P | Polyproline II helix | trans | -67.9 | 167.6 | 164.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | P233 G237 G238 T239 | P233-G235 PolarHBondContact O-N 2.89Å; G235-G237 PolarHBondContact O-N 2.83Å; G235-G237 VanDerWaalsContact O-N 3.1Å; G235-G238 PolarHBondContact O-N 3.39Å; G235-T239 VanDerWaalsContact CA-O 3.28Å; G235-T239 WeakPolarHBondContact CA-O 3.28Å; G235-T239 PolarHBondContact N-O 2.73Å |
| 236 | P | 47.5 | Very low | 69.2 | Low | 127 Ų | 127 | 75 Ų | 75 | 83% | 0.825 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.3 | 118.4 | -178.8 | -20.4 | 31.2 | 0 | 0 | 0 | 111 | T239 | P236-T239 PolarHBondContact O-OG1 3.09Š|
| 237 | G | 62.9 | Low | 71.9 | Confident | 83 Ų | 83 | 71.9 Ų | 71.9 | 86% | 0.856 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 94.2 | 13.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 116.4 | G235 | G235-G237 PolarHBondContact O-N 2.83Å; G235-G237 VanDerWaalsContact O-N 3.1Å |
| 238 | G | 81.6 | Confident | 74.2 | Confident | 50 Ų | 50 | 64.5 Ų | 64.5 | 52% | 0.515 | 44% | 0.435 | S | S | . | . | S | Bend | trans | 83.8 | 22.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114 | G235 | G235-G238 PolarHBondContact O-N 3.39Š|
| 239 | T | 92.1 | Very high | 76.5 | Confident | 31 Ų | 31 | 69.8 Ų | 69.8 | 19% | 0.19 | 45% | 0.446 | C | S | . | . | P | Polyproline II helix | trans | -98.4 | 160.6 | 169.8 | 54.9 | 0 | 0 | 0 | 0 | 110 | G235 P236 V364 L365 Y366 | G235-T239 VanDerWaalsContact CA-O 3.28Å; G235-T239 WeakPolarHBondContact CA-O 3.28Å; G235-T239 PolarHBondContact N-O 2.73Å; P236-T239 PolarHBondContact O-OG1 3.09Å; T239-V364 HydrophobicContact CG2-CG1 3.58Å; T239-L365 CarbonylContact C-O 3.48Å; T239-L365 VanDerWaalsContact CA-O 3.24Å; T239-L365 WeakPolarHBondContact CA-O 3.33Å; T239-L365 WeakPolarHBondContact CB-O 3.24Å; T239-Y366 HydrophobicContact CG2-CD1 3.85Å; T239-Y366 HydrophobicContact CG2-CE1 3.73Å |
| 240 | L | 94.9 | Very high | 78.9 | Confident | 23 Ų | 23 | 68.2 Ų | 68.2 | 12% | 0.12 | 44% | 0.443 | C | S | . | . | B | Isolated β-bridge | trans | -99.3 | 141.5 | 171.3 | -61.8 | 176.2 | 0 | 0 | 0 | 108.8 | V242 Y244 L365 | L240-V242 PolarHBondContact O-N 3.49Å; L240-Y244 HydrophobicContact CB-CD2 3.87Å; L240-Y244 HydrophobicContact CB-CE2 4.12Å; L240-Y244 HydrophobicContact CB-CG 4.36Å; L240-Y244 HydrophobicContact CD1-CD1 4.36Å; L240-Y244 HydrophobicContact CD1-CD2 4.19Å; L240-Y244 HydrophobicContact CD1-CE1 3.99Å; L240-Y244 HydrophobicContact CD1-CE2 3.81Å; L240-Y244 HydrophobicContact CD1-CG 4.44Å; L240-Y244 HydrophobicContact CD2-CE2 4Å; L240-Y244 HydrophobicContact CG-CD2 4.44Å; L240-Y244 HydrophobicContact CG-CE2 4.2Å; L240-L365 HydrophobicContact CB-CB 4.13Å; L240-L365 HydrophobicContact CB-CD2 3.76Å; L240-L365 HydrophobicContact CB-CG 3.89Å; L240-L365 HydrophobicContact CD1-CD2 3.87Å; L240-L365 HydrophobicContact CD1-CG 4.02Å; L240-L365 HydrophobicContact CG-CD2 4.44Å; L240-L365 HydrophobicContact CG-CG 4.42Å; L240-L365 PolarHBondContact N-O 3.18Å |
| 241 | I | 96.3 | Very high | 81 | Confident | 112 Ų | 112 | 60.4 Ų | 60.4 | 57% | 0.574 | 42% | 0.415 | S | S | * | . | P | Polyproline II helix | trans | -72.4 | 129 | -179.8 | -61.7 | 175.3 | 0 | 0 | 0 | 109.1 | P243 Y244 | I241-P243 CarbonylContact O-C 3.46Å; I241-P243 VanDerWaalsContact O-O 3.12Å; I241-Y244 WeakPolarHBondContact O-CB 3.37Å |
| 242 | V | 97.1 | Very high | 83.4 | Confident | 45 Ų | 45 | 58 Ų | 58 | 27% | 0.273 | 39% | 0.39 | S | S | . | . | S | Bend | trans | -100.6 | 133.8 | 175.4 | 177.4 | 0 | 0 | 0 | 0 | 109.1 | L240 V363 L365 | L240-V242 PolarHBondContact O-N 3.49Å; V242-V363 HydrophobicContact CG2-CG1 4.45Å; V242-L365 HydrophobicContact CG2-CB 3.7Å; V242-L365 HydrophobicContact CG2-CD2 4.48Å |
| 243 | P | 97.8 | Very high | 85.4 | Confident | 92 Ų | 92 | 62 Ų | 62 | 60% | 0.597 | 40% | 0.403 | S | S | * | . | S | Bend | cis | -67.1 | 139 | 2.8 | 30 | -36.2 | 0 | 0 | 0 | 112.9 | I241 V359 T360 | I241-P243 CarbonylContact O-C 3.46Å; I241-P243 VanDerWaalsContact O-O 3.12Å; P243-V359 VanDerWaalsContact CA-O 3.32Å; P243-V359 WeakPolarHBondContact CA-O 3.27Å; P243-T360 HydrophobicContact CB-CG2 3.71Å |
| 244 | Y | 98.4 | Very high | 87.5 | Confident | 21 Ų | 21 | 59 Ų | 59 | 8% | 0.082 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.4 | 127.3 | -178.6 | -177.3 | -101.2 | 0 | 0 | 0 | 110.5 | L240 I241 L246 R358 V359 L365 A368 | L240-Y244 HydrophobicContact CB-CD2 3.87Å; L240-Y244 HydrophobicContact CB-CE2 4.12Å; L240-Y244 HydrophobicContact CB-CG 4.36Å; L240-Y244 HydrophobicContact CD1-CD1 4.36Å; L240-Y244 HydrophobicContact CD1-CD2 4.19Å; L240-Y244 HydrophobicContact CD1-CE1 3.99Å; L240-Y244 HydrophobicContact CD1-CE2 3.81Å; L240-Y244 HydrophobicContact CD1-CG 4.44Å; L240-Y244 HydrophobicContact CD2-CE2 4Å; L240-Y244 HydrophobicContact CG-CD2 4.44Å; L240-Y244 HydrophobicContact CG-CE2 4.2Å; I241-Y244 WeakPolarHBondContact O-CB 3.37Å; Y244-L246 HydrophobicContact CD1-CB 4.48Å; Y244-L246 HydrophobicContact CE1-CB 3.93Å; Y244-R358 CarbonylContact O-C 3.37Å; Y244-R358 WeakPolarHBondContact O-CA 3.48Å; Y244-V359 PolarHBondContact N-O 3.37Å; Y244-V359 PolarHBondContact O-N 2.98Å; Y244-L365 VanDerWaalsContact CB-CD2 3.41Å; Y244-L365 HydrophobicContact CD1-CD2 3.6Å; Y244-L365 HydrophobicContact CD2-CD2 4.32Å; Y244-L365 HydrophobicContact CE1-CD2 4.46Å; Y244-L365 HydrophobicContact CG-CD2 3.51Å; Y244-A368 HydrophobicContact CD1-CB 4.19Å; Y244-A368 HydrophobicContact CE1-CB 3.86Å |
| 245 | D | 98.4 | Very high | 89.6 | Confident | 67 Ų | 67 | 62.5 Ų | 62.5 | 36% | 0.358 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.3 | 120.9 | 174.5 | -72.3 | -3.9 | 0 | 0 | 0 | 109.5 | P247 V356 R358 | D245-P247 WeakPolarHBondContact O-CD 3.46Å; D245-V356 HydrophobicContact CB-CG1 3.98Å; D245-R358 WeakPolarHBondContact OD1-CB 3.36Å; D245-R358 WeakPolarHBondContact OD1-CD 3.49Å; D245-R358 WeakPolarHBondContact OD1-CG 3.38Å; D245-R358 IonicContact OD1-CZ 2.73Å; D245-R358 IonicContact OD1-NE 3.53Å; D245-R358 PolarHBondContact OD1-NE 3.44Å; D245-R358 IonicContact OD1-NH2 3.59Å; D245-R358 IonicContact OD2-CZ 3.58Å; D245-R358 IonicContact OD2-NE 2.67Å; D245-R358 PolarHBondContact OD2-NE 2.92Å; D245-R358 IonicContact OD2-NH2 3.66Å; D245-R358 PolarHBondContact OD2-NH2 2.86Å |
| 246 | L | 98 | Very high | 91.6 | Very high | 7 Ų | 7 | 62.9 Ų | 62.9 | 4% | 0.037 | 38% | 0.381 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97 | 110.5 | 170.3 | 177.1 | 61.8 | 0 | 0 | 0 | 109 | Y244 L248 V258 L357 A368 P370 | Y244-L246 HydrophobicContact CD1-CB 4.48Å; Y244-L246 HydrophobicContact CE1-CB 3.93Å; L246-L248 HydrophobicContact CD2-CD2 4.28Å; L246-L248 HydrophobicContact CG-CD2 4.29Å; L246-L248 PolarHBondContact O-N 2.87Å; L246-V258 HydrophobicContact CD2-CG1 4.31Å; L246-L357 HydrophobicContact CB-CB 4.24Å; L246-L357 HydrophobicContact CB-CD2 4.16Å; L246-L357 HydrophobicContact CD2-CD2 4.36Å; L246-L357 PolarHBondContact N-O 2.94Å; L246-L357 PolarHBondContact O-N 3.3Å; L246-A368 HydrophobicContact CD2-CB 4.41Å; L246-P370 HydrophobicContact CD2-CG 4.48Å |
| 247 | P | 97.9 | Very high | 94.1 | Very high | 68 Ų | 68 | 58 Ų | 58 | 44% | 0.442 | 35% | 0.348 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.2 | 128.2 | 175.8 | -19.3 | 33.4 | 0 | 0 | 0 | 112 | D245 | D245-P247 WeakPolarHBondContact O-CD 3.46Å |
| 248 | L | 97.1 | Very high | 95.8 | Very high | 10 Ų | 10 | 54 Ų | 54 | 5% | 0.052 | 31% | 0.308 | C | S | . | . | trans | -110 | 73.9 | 176.2 | -57.4 | 172.9 | 0 | 0 | 0 | 108.4 | L246 A250 G251 I252 F275 T355 L357 P370 | L246-L248 HydrophobicContact CD2-CD2 4.28Å; L246-L248 HydrophobicContact CG-CD2 4.29Å; L246-L248 PolarHBondContact O-N 2.87Å; L248-A250 PolarHBondContact O-N 2.84Å; L248-G251 PolarHBondContact O-N 2.89Å; L248-I252 HydrophobicContact CD1-CG2 3.65Å; L248-F275 HydrophobicContact CD1-CD1 4.27Å; L248-F275 HydrophobicContact CD1-CE1 4.3Å; L248-T355 PolarHBondContact N-O 2.98Å; L248-T355 WeakPolarHBondContact O-CA 3.37Å; L248-L357 HydrophobicContact CD1-CB 4.02Å; L248-P370 HydrophobicContact CD2-CB 4.25Å; L248-P370 HydrophobicContact CD2-CG 4.47Å | ||
| 249 | H | 89.3 | Confident | 96.6 | Very high | 163 Ų | 163 | 52.9 Ų | 52.9 | 76% | 0.755 | 29% | 0.291 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.7 | -27.9 | -166.6 | -61.1 | 84.7 | 0 | 0 | 0 | 115.5 | ||
| 250 | A | 90.3 | Very high | 96.9 | Very high | 86 Ų | 86 | 51.5 Ų | 51.5 | 71% | 0.711 | 28% | 0.282 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.7 | 10.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | L248 | L248-A250 PolarHBondContact O-N 2.84Š|
| 251 | G | 95.6 | Very high | 97.1 | Very high | 11 Ų | 11 | 52.3 Ų | 52.3 | 11% | 0.113 | 29% | 0.286 | C | S | . | . | trans | 75.5 | -161 | -167.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L248 E352 V354 | L248-G251 PolarHBondContact O-N 2.89Å; G251-E352 VanDerWaalsContact CA-O 3.22Å; G251-E352 WeakPolarHBondContact CA-O 3.33Å; G251-V354 CarbonylContact C-O 3.52Å; G251-V354 VanDerWaalsContact CA-O 3.24Å; G251-V354 WeakPolarHBondContact CA-O 3.38Å | ||
| 252 | I | 97.7 | Very high | 97.2 | Very high | 3 Ų | 3 | 47 Ų | 47 | 2% | 0.015 | 26% | 0.259 | C | S | . | . | trans | -111.4 | 148.9 | 168.9 | 73.6 | -176.9 | 0 | 0 | 0 | 110.9 | L248 L256 F275 V327 F332 L351 V354 | L248-I252 HydrophobicContact CD1-CG2 3.65Å; I252-L256 HydrophobicContact CB-CD2 3.69Å; I252-L256 HydrophobicContact CG2-CD2 3.51Å; I252-F275 HydrophobicContact CD1-CD1 4.21Å; I252-F275 HydrophobicContact CG2-CD1 4.18Å; I252-F275 HydrophobicContact CG2-CE1 4.18Å; I252-V327 HydrophobicContact CB-CG2 4.23Å; I252-V327 HydrophobicContact CD1-CG1 4.24Å; I252-V327 HydrophobicContact CD1-CG2 4.13Å; I252-V327 HydrophobicContact CG1-CG1 4.26Å; I252-V327 HydrophobicContact CG1-CG2 4.5Å; I252-F332 HydrophobicContact CD1-CE1 3.62Å; I252-F332 HydrophobicContact CD1-CZ 3.62Å; I252-L351 HydrophobicContact CD1-CD2 4.18Å; I252-L351 HydrophobicContact CG1-CB 3.75Å; I252-L351 HydrophobicContact CG1-CD2 4.35Å; I252-L351 HydrophobicContact CG1-CG 4.45Å; I252-L351 WeakPolarHBondContact CG1-O 3.39Å; I252-L351 PolarHBondContact N-O 3.05Å; I252-L351 CarbonylContact O-C 3.57Å; I252-L351 VanDerWaalsContact O-C 3.31Å; I252-L351 WeakPolarHBondContact O-CB 3.32Å; I252-V354 HydrophobicContact CD1-CB 4.05Å; I252-V354 HydrophobicContact CD1-CG1 4.03Å; I252-V354 HydrophobicContact CD1-CG2 4.08Å; I252-V354 HydrophobicContact CG1-CB 3.98Å; I252-V354 HydrophobicContact CG1-CG1 4.4Å; I252-V354 HydrophobicContact CG1-CG2 4.21Å; I252-V354 HydrophobicContact CG2-CB 4.16Å; I252-V354 HydrophobicContact CG2-CG1 4.06Å | ||
| 253 | M | 97.3 | Very high | 97.2 | Very high | 108 Ų | 108 | 46.8 Ų | 46.8 | 53% | 0.532 | 26% | 0.255 | S | S | . | . | trans | -144.7 | 159 | -179.7 | 65 | -169.1 | -62.5 | 0 | 0 | 109.7 | R255 L256 M372 | M253-R255 PolarHBondContact O-N 2.83Å; M253-L256 WeakPolarHBondContact O-CB 3.42Å; M253-L256 PolarHBondContact O-N 2.88Å; M253-M372 HydrophobicContact CG-CE 3.87Å; M253-M372 HydrophobicContact CG-SD 4.21Å; M253-M372 HydrophobicContact SD-CE 4.05Å; M253-M372 HydrophobicContact SD-SD 4.42Å | ||
| 254 | P | 98 | Very high | 97.3 | Very high | 50 Ų | 50 | 42.4 Ų | 42.4 | 33% | 0.325 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -51.1 | 142.4 | 175.1 | -27.6 | 35.9 | 0 | 0 | 0 | 111.4 | L256 V327 E329 | P254-L256 VanDerWaalsContact C-N 3.25Å; P254-L256 PolarHBondContact O-N 2.85Å; P254-V327 CarbonylContact C-O 3.55Å; P254-V327 WeakPolarHBondContact CA-O 3.44Å; P254-E329 HydrophobicContact CB-CG 4.12Å; P254-E329 HydrophobicContact CG-CG 3.86Å |
| 255 | R | 97.8 | Very high | 97.2 | Very high | 148 Ų | 148 | 43.8 Ų | 43.8 | 56% | 0.558 | 24% | 0.237 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 74.6 | 2.5 | -174.5 | -43.7 | 171.2 | 64 | 87.7 | 2.9 | 115.3 | M253 L257 V327 M372 I373 | M253-R255 PolarHBondContact O-N 2.83Å; R255-L257 PolarHBondContact O-N 2.91Å; R255-V327 PolarHBondContact N-O 3.02Å; R255-M372 HydrophobicContact CB-CE 3.98Å; R255-I373 HydrophobicContact CB-CG1 4.43Å; R255-I373 WeakPolarHBondContact CB-O 3.39Å; R255-I373 PolarHBondContact NE-O 3.4Å; R255-I373 PolarHBondContact NH2-O 3.46Å; R255-I373 PolarHBondContact NH2-OXT 3.38Å; R255-I373 WeakPolarHBondContact O-CG1 3.32Å; R255-I373 PolarHBondContact O-N 3.22Å; R255-I373 VanDerWaalsContact O-N 3.09Å |
| 256 | L | 98.3 | Very high | 97.2 | Very high | 15 Ų | 15 | 45.7 Ų | 45.7 | 8% | 0.079 | 25% | 0.253 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.6 | 121.3 | 165.7 | -179.3 | 70.8 | 0 | 0 | 0 | 109.4 | I252 M253 P254 V258 V327 P370 M372 | I252-L256 HydrophobicContact CB-CD2 3.69Å; I252-L256 HydrophobicContact CG2-CD2 3.51Å; M253-L256 WeakPolarHBondContact O-CB 3.42Å; M253-L256 PolarHBondContact O-N 2.88Å; P254-L256 VanDerWaalsContact C-N 3.25Å; P254-L256 PolarHBondContact O-N 2.85Å; L256-V258 HydrophobicContact CD2-CG2 4.44Å; L256-V258 HydrophobicContact CG-CG2 4.5Å; L256-V327 HydrophobicContact CB-CB 4.2Å; L256-V327 HydrophobicContact CB-CG2 4.12Å; L256-V327 HydrophobicContact CD2-CG2 4.3Å; L256-V327 PolarHBondContact O-N 3.15Å; L256-P370 HydrophobicContact CD1-CB 3.95Å; L256-M372 HydrophobicContact CB-SD 4Å; L256-M372 HydrophobicContact CD1-SD 3.88Å |
| 257 | L | 98.7 | Very high | 97.1 | Very high | 25 Ų | 25 | 48.5 Ų | 48.5 | 13% | 0.131 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110 | 116.5 | 172.1 | 175.7 | 65.1 | 0 | 0 | 0 | 109.6 | R255 K324 L326 P370 S371 I373 | R255-L257 PolarHBondContact O-N 2.91Å; L257-K324 HydrophobicContact CD1-CB 3.95Å; L257-K324 HydrophobicContact CD1-CG 4.11Å; L257-L326 HydrophobicContact CB-CD1 4.45Å; L257-L326 HydrophobicContact CD1-CB 4.27Å; L257-P370 CarbonylContact O-C 3.57Å; L257-S371 PolarHBondContact N-O 3.46Å; L257-S371 PolarHBondContact O-N 2.81Å; L257-S371 PolarHBondContact O-OG 2.83Å; L257-S371 VanDerWaalsContact O-OG 3.14Å; L257-I373 HydrophobicContact CB-CG2 4.15Å; L257-I373 HydrophobicContact CD2-CG2 3.96Å |
| 258 | V | 98.6 | Very high | 97 | Very high | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 26% | 0.264 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.2 | 128.1 | 167.6 | -176.5 | 0 | 0 | 0 | 0 | 109.2 | L246 L256 V260 F275 K324 I325 L357 | L246-V258 HydrophobicContact CD2-CG1 4.31Å; L256-V258 HydrophobicContact CD2-CG2 4.44Å; L256-V258 HydrophobicContact CG-CG2 4.5Å; V258-V260 HydrophobicContact CG1-CG2 4.07Å; V258-F275 HydrophobicContact CG2-CE1 4.36Å; V258-F275 HydrophobicContact CG2-CZ 4.24Å; V258-K324 WeakPolarHBondContact O-CA 3.42Å; V258-I325 PolarHBondContact N-O 3.36Å; V258-I325 PolarHBondContact O-N 3.48Å; V258-L357 HydrophobicContact CB-CD1 4.37Å; V258-L357 HydrophobicContact CG1-CD1 3.79Å; V258-L357 HydrophobicContact CG2-CD1 4.29Å |
| 259 | T | 98.7 | Very high | 97.1 | Very high | 26 Ų | 26 | 47.9 Ų | 47.9 | 16% | 0.16 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.6 | 126.8 | 171.8 | -55.5 | 0 | 0 | 0 | 0 | 110 | I261 E322 L323 K324 A368 A369 | T259-I261 HydrophobicContact CG2-CD1 4.22Å; T259-E322 HydrophobicContact CG2-CG 3.91Å; T259-L323 CarbonylContact C-O 3.46Å; T259-L323 WeakPolarHBondContact CA-O 3.17Å; T259-K324 HydrophobicContact CG2-CG 4.22Å; T259-A368 WeakPolarHBondContact O-CA 3.33Å; T259-A369 PolarHBondContact N-O 3.1Å; T259-A369 PolarHBondContact O-N 3.35Å |
| 260 | V | 98.8 | Very high | 97.5 | Very high | 2 Ų | 2 | 45.7 Ų | 45.7 | 1% | 0.012 | 26% | 0.262 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 124.1 | 178.7 | 177.3 | 0 | 0 | 0 | 0 | 108.8 | V258 L323 L365 S367 A368 | V258-V260 HydrophobicContact CG1-CG2 4.07Å; V260-L323 HydrophobicContact CB-CB 4.23Å; V260-L323 HydrophobicContact CB-CD2 4.43Å; V260-L323 PolarHBondContact N-O 2.69Å; V260-L323 PolarHBondContact O-N 3.36Å; V260-L365 HydrophobicContact CG1-CD1 3.61Å; V260-S367 WeakPolarHBondContact CA-O 3.48Å; V260-A368 HydrophobicContact CG2-CB 4.19Å |
| 261 | I | 98.6 | Very high | 97.9 | Very high | 39 Ų | 39 | 41.7 Ų | 41.7 | 20% | 0.2 | 23% | 0.229 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -106 | 115.6 | 172.3 | -52.6 | -58.1 | 0 | 0 | 0 | 108.2 | T259 F321 E322 Y366 S367 | T259-I261 HydrophobicContact CG2-CD1 4.22Å; I261-F321 WeakPolarHBondContact CA-O 3.31Å; I261-E322 HydrophobicContact CD1-CB 3.6Å; I261-E322 HydrophobicContact CD1-CG 3.58Å; I261-Y366 HydrophobicContact CG2-CD2 4.4Å; I261-Y366 PolarHBondContact O-N 3.27Å; I261-S367 WeakPolarHBondContact CB-OG 3.19Å; I261-S367 WeakPolarHBondContact CG1-OG 2.98Å; I261-S367 PolarHBondContact N-O 3.46Å; I261-S367 PolarHBondContact O-N 3.2Å |
| 262 | G | 98.3 | Very high | 98.1 | Very high | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 23% | 0.233 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -138 | 167.5 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | R320 F321 V364 | G262-R320 CarbonylContact O-C 3.59Å; G262-R320 VanDerWaalsContact O-CA 3.26Å; G262-R320 WeakPolarHBondContact O-CA 3.35Å; G262-F321 VanDerWaalsContact C-CE1 3.45Å; G262-F321 PolarHBondContact N-O 2.76Å; G262-F321 WeakPolarHBondContact O-CD1 3.41Å; G262-F321 PolarHBondContact O-N 2.82Å; G262-V364 CarbonylContact C-O 3.44Å; G262-V364 VanDerWaalsContact CA-O 3.27Å; G262-V364 WeakPolarHBondContact CA-O 3.27Å |
| 263 | E | 98.5 | Very high | 98.1 | Very high | 42 Ų | 42 | 43.1 Ų | 43.1 | 20% | 0.196 | 23% | 0.233 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -140.1 | 111.9 | 174.1 | -179.5 | -179.4 | 155.4 | 0 | 0 | 108.5 | V265 R320 V364 Y366 | E263-V265 PolarHBondContact O-N 2.87Å; E263-R320 HydrophobicContact CB-CG 3.97Å; E263-R320 HydrophobicContact CG-CG 4.31Å; E263-R320 WeakPolarHBondContact OE2-CG 3.33Å; E263-R320 IonicContact OE2-NE 2.67Å; E263-V364 HydrophobicContact CB-CB 4.48Å; E263-V364 PolarHBondContact N-O 2.81Å; E263-V364 PolarHBondContact O-N 3.47Å; E263-Y366 HydrophobicContact CB-CE2 3.71Å; E263-Y366 PolarHBondContact OE2-OH 3.48Å |
| 264 | P | 98.4 | Very high | 98.2 | Very high | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 21% | 0.21 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -63.9 | 134 | 177.2 | -14.7 | 29.3 | 0 | 0 | 0 | 108.7 | A268 F271 F289 G318 R319 F321 D362 | P264-A268 HydrophobicContact CB-CB 4.34Å; P264-F271 HydrophobicContact CG-CE1 4.15Å; P264-F289 HydrophobicContact CB-CE1 4.1Å; P264-F289 HydrophobicContact CB-CE2 3.87Å; P264-F289 HydrophobicContact CB-CZ 3.31Å; P264-F289 HydrophobicContact CG-CE1 4.28Å; P264-F289 HydrophobicContact CG-CE2 4.43Å; P264-F289 HydrophobicContact CG-CZ 3.55Å; P264-G318 PolarHBondContact O-N 3.45Å; P264-R319 VanDerWaalsContact CD-O 3.23Å; P264-R319 WeakPolarHBondContact CD-O 3.47Å; P264-F321 HydrophobicContact CG-CD1 4.15Å; P264-F321 HydrophobicContact CG-CE1 3.99Å; P264-D362 WeakPolarHBondContact CA-O 3.35Å |
| 265 | V | 97.6 | Very high | 98.3 | Very high | 49 Ų | 49 | 36 Ų | 36 | 30% | 0.297 | 19% | 0.194 | S | C | . | . | P | Polyproline II helix | trans | -67.9 | 150.8 | -177.3 | -63.4 | 0 | 0 | 0 | 0 | 111.1 | E263 G267 A268 D362 V364 | E263-V265 PolarHBondContact O-N 2.87Å; V265-G267 PolarHBondContact O-N 2.9Å; V265-A268 HydrophobicContact CG2-CB 4.03Å; V265-A268 WeakPolarHBondContact O-CB 3.44Å; V265-A268 PolarHBondContact O-N 3.38Å; V265-D362 HydrophobicContact CG2-CB 3.82Å; V265-D362 PolarHBondContact N-O 3.27Å; V265-D362 VanDerWaalsContact N-O 3.09Å; V265-V364 HydrophobicContact CG1-CG2 3.85Å |
| 266 | P | 96.9 | Very high | 98.3 | Very high | 107 Ų | 107 | 29.9 Ų | 29.9 | 70% | 0.695 | 17% | 0.172 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -53.2 | 127 | 168.1 | -26.6 | 35.8 | 0 | 0 | 0 | 111.2 | ||
| 267 | G | 96.3 | Very high | 98.3 | Very high | 66 Ų | 66 | 30.9 Ų | 30.9 | 68% | 0.68 | 18% | 0.176 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 80.8 | 11.6 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | V265 | V265-G267 PolarHBondContact O-N 2.9Š|
| 268 | A | 97.2 | Very high | 98.1 | Very high | 5 Ų | 5 | 32.3 Ų | 32.3 | 4% | 0.041 | 20% | 0.196 | C | C | . | . | trans | -54.6 | 134.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | P264 V265 F289 Q317 D362 | P264-A268 HydrophobicContact CB-CB 4.34Å; V265-A268 HydrophobicContact CG2-CB 4.03Å; V265-A268 WeakPolarHBondContact O-CB 3.44Å; V265-A268 PolarHBondContact O-N 3.38Å; A268-F289 HydrophobicContact CB-CD2 3.86Å; A268-F289 HydrophobicContact CB-CE2 3.89Å; A268-F289 WeakPolarHBondContact O-CB 3.37Å; A268-Q317 HydrophobicContact CB-CG 4.35Å; A268-Q317 PolarHBondContact O-NE2 2.9Å; A268-D362 HydrophobicContact CB-CB 3.52Å | ||
| 269 | D | 98 | Very high | 98.1 | Very high | 60 Ų | 60 | 38.1 Ų | 38.1 | 32% | 0.321 | 23% | 0.234 | S | C | . | . | trans | -84 | -51.4 | 169.6 | 179.3 | 54.4 | 0 | 0 | 0 | 109.8 | F289 N290 D362 | D269-F289 PolarHBondContact O-N 3.04Å; D269-N290 PolarHBondContact OD1-ND2 3.13Å; D269-D362 PolarHBondContact N-OD2 2.71Å | ||
| 270 | R | 98.4 | Very high | 98 | Very high | 118 Ų | 118 | 38.7 Ų | 38.7 | 45% | 0.445 | 24% | 0.236 | S | C | . | . | B | Isolated β-bridge | trans | -163.3 | 160.2 | -179.8 | 65.8 | -173.9 | -173.8 | -85 | -0.5 | 112.9 | P287 R288 D362 | R270-P287 VanDerWaalsContact CA-O 3.29Å; R270-P287 WeakPolarHBondContact CA-O 3.29Å; R270-P287 VanDerWaalsContact CB-O 3.29Å; R270-P287 WeakPolarHBondContact CB-O 3.29Å; R270-R288 HydrophobicContact CB-CG 4.27Å; R270-D362 PolarHBondContact N-OD2 2.8Å; R270-D362 WeakPolarHBondContact O-CB 3.28Å; R270-D362 PolarHBondContact O-N 2.86Å |
| 271 | F | 98.8 | Very high | 98 | Very high | 2 Ų | 2 | 39.4 Ų | 39.4 | 1% | 0.009 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -133.5 | 167.5 | 161.1 | 71.6 | -87.4 | 0 | 0 | 0 | 109.9 | P264 F285 N286 P287 F289 F315 F321 T360 V363 | P264-F271 HydrophobicContact CG-CE1 4.15Å; F271-F285 HydrophobicContact CE2-CE1 4.48Å; F271-N286 WeakPolarHBondContact O-CA 3.4Å; F271-N286 PolarHBondContact O-ND2 2.88Å; F271-P287 HydrophobicContact CD1-CB 4.23Å; F271-P287 HydrophobicContact CD1-CG 4.45Å; F271-P287 HydrophobicContact CE1-CB 3.72Å; F271-P287 HydrophobicContact CE1-CG 3.79Å; F271-P287 HydrophobicContact CE2-CG 3.94Å; F271-P287 HydrophobicContact CZ-CB 4Å; F271-P287 HydrophobicContact CZ-CG 3.52Å; F271-P287 PolarHBondContact N-O 2.85Å; F271-P287 VanDerWaalsContact O-CD 3.29Å; F271-P287 WeakPolarHBondContact O-CD 3.26Å; F271-F289 AromaticContact CD1-CE2 3.94Å; F271-F289 HydrophobicContact CD1-CE2 3.94Å; F271-F289 HydrophobicContact CD1-CZ 4.33Å; F271-F289 HydrophobicContact CE1-CE2 4.17Å; F271-F289 HydrophobicContact CE1-CZ 4.14Å; F271-F315 HydrophobicContact CE1-CD1 4.15Å; F271-F315 HydrophobicContact CE1-CE1 4.4Å; F271-F315 HydrophobicContact CE1-CG 4.23Å; F271-F315 AromaticContact CZ-CD1 3.92Å; F271-F315 HydrophobicContact CZ-CD1 3.92Å; F271-F315 AromaticContact CZ-CE1 3.71Å; F271-F315 HydrophobicContact CZ-CE1 3.71Å; F271-F315 HydrophobicContact CZ-CE2 4.32Å; F271-F315 HydrophobicContact CZ-CG 4.31Å; F271-F315 AromaticContact CZ-CZ 3.92Å; F271-F315 HydrophobicContact CZ-CZ 3.92Å; F271-F321 HydrophobicContact CE1-CE1 4.3Å; F271-F321 HydrophobicContact CE1-CZ 4.5Å; F271-F321 HydrophobicContact CE2-CE1 4.42Å; F271-F321 AromaticContact CE2-CZ 3.84Å; F271-F321 HydrophobicContact CE2-CZ 3.84Å; F271-F321 AromaticContact CZ-CE1 3.88Å; F271-F321 HydrophobicContact CZ-CE1 3.88Å; F271-F321 HydrophobicContact CZ-CE2 4.46Å; F271-F321 AromaticContact CZ-CZ 3.69Å; F271-F321 HydrophobicContact CZ-CZ 3.69Å; F271-T360 CarbonylContact C-O 3.51Å; F271-T360 WeakPolarHBondContact CA-O 2.82Å; F271-T360 WeakPolarHBondContact CB-O 3.3Å; F271-V363 HydrophobicContact CB-CB 3.95Å; F271-V363 HydrophobicContact CB-CG1 3.91Å; F271-V363 HydrophobicContact CG-CB 4.16Å; F271-V363 HydrophobicContact CG-CG1 4.35Å |
| 272 | Q | 98.8 | Very high | 98 | Very high | 43 Ų | 43 | 37.9 Ų | 37.9 | 20% | 0.201 | 23% | 0.233 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -144.1 | 149.2 | 178.1 | 64.8 | -165.2 | 53.4 | 0 | 0 | 112.6 | D274 F285 N286 V359 T360 | Q272-D274 PolarHBondContact NE2-OD2 3.24Å; Q272-F285 CarbonylContact C-O 3.59Å; Q272-F285 WeakPolarHBondContact CA-O 3.2Å; Q272-N286 HydrophobicContact CB-CB 4.19Å; Q272-V359 WeakPolarHBondContact O-CA 3.31Å; Q272-T360 VanDerWaalsContact CD-OG1 3.24Å; Q272-T360 WeakPolarHBondContact CG-OG1 3.2Å; Q272-T360 PolarHBondContact N-O 2.87Å; Q272-T360 PolarHBondContact NE2-OG1 2.8Å; Q272-T360 PolarHBondContact O-N 3.26Å |
| 273 | V | 98.9 | Very high | 98.1 | Very high | 1 Ų | 1 | 37.9 Ų | 37.9 | 1% | 0.006 | 23% | 0.233 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -122.1 | 116.1 | 171 | -177.2 | 0 | 0 | 0 | 0 | 107.3 | F285 L323 I325 L357 R358 V359 | V273-F285 HydrophobicContact CB-CB 4.36Å; V273-F285 HydrophobicContact CB-CD1 4.42Å; V273-F285 HydrophobicContact CG2-CD1 4.43Å; V273-F285 PolarHBondContact N-O 3.46Å; V273-F285 PolarHBondContact O-N 2.95Å; V273-L323 HydrophobicContact CG2-CD2 3.94Å; V273-I325 HydrophobicContact CG1-CD1 4.1Å; V273-L357 HydrophobicContact CG1-CD1 3.74Å; V273-L357 HydrophobicContact CG1-CD2 4.06Å; V273-L357 HydrophobicContact CG1-CG 3.86Å; V273-R358 CarbonylContact C-O 3.55Å; V273-R358 WeakPolarHBondContact CA-O 3.21Å; V273-V359 HydrophobicContact CG2-CG2 4.31Å |
| 274 | D | 98.9 | Very high | 98.1 | Very high | 9 Ų | 9 | 36.3 Ų | 36.3 | 5% | 0.048 | 23% | 0.226 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.2 | 128.5 | -173.1 | -62.4 | -33.1 | 0 | 0 | 0 | 110.5 | Q272 L276 V281 F283 H284 L357 R358 | Q272-D274 PolarHBondContact NE2-OD2 3.24Å; D274-L276 HydrophobicContact CB-CD1 4.21Å; D274-L276 WeakPolarHBondContact O-CD1 3.41Å; D274-V281 HydrophobicContact CB-CG1 4Å; D274-F283 WeakPolarHBondContact CA-O 3.2Å; D274-H284 IonicContact OD1-CE1 3.76Å; D274-H284 IonicContact OD1-CG 3.83Å; D274-H284 IonicContact OD1-ND1 2.69Å; D274-H284 PolarHBondContact OD1-ND1 2.8Å; D274-L357 CarbonylContact O-C 3.52Å; D274-L357 VanDerWaalsContact O-CA 3.3Å; D274-L357 WeakPolarHBondContact O-CA 3.49Å; D274-R358 HydrophobicContact CB-CB 4.46Å; D274-R358 PolarHBondContact N-O 3.44Å; D274-R358 PolarHBondContact O-N 3.29Å |
| 275 | F | 98.8 | Very high | 98.1 | Very high | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 23% | 0.226 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -92.9 | 119.2 | 166.6 | -75.7 | -100.3 | 0 | 0 | 0 | 109.2 | L248 I252 V258 V281 V282 F283 I325 F332 V354 L357 | L248-F275 HydrophobicContact CD1-CD1 4.27Å; L248-F275 HydrophobicContact CD1-CE1 4.3Å; I252-F275 HydrophobicContact CD1-CD1 4.21Å; I252-F275 HydrophobicContact CG2-CD1 4.18Å; I252-F275 HydrophobicContact CG2-CE1 4.18Å; V258-F275 HydrophobicContact CG2-CE1 4.36Å; V258-F275 HydrophobicContact CG2-CZ 4.24Å; F275-V281 CarbonylContact O-C 3.54Å; F275-V281 WeakPolarHBondContact O-CA 3.49Å; F275-V282 HydrophobicContact CB-CG2 3.75Å; F275-V282 WeakPolarHBondContact O-CG2 3.05Å; F275-V282 PolarHBondContact O-N 2.9Å; F275-F283 HydrophobicContact CB-CB 4.23Å; F275-F283 HydrophobicContact CD2-CB 4.16Å; F275-F283 AromaticContact CD2-CD1 3.6Å; F275-F283 HydrophobicContact CD2-CD1 3.6Å; F275-F283 HydrophobicContact CD2-CE1 4.48Å; F275-F283 HydrophobicContact CD2-CG 4.29Å; F275-F283 AromaticContact CE2-CD1 3.77Å; F275-F283 HydrophobicContact CE2-CD1 3.77Å; F275-F283 HydrophobicContact CE2-CE1 4.29Å; F275-F283 PolarHBondContact N-O 2.77Å; F275-I325 HydrophobicContact CE2-CD1 3.81Å; F275-I325 HydrophobicContact CE2-CG2 3.94Å; F275-I325 HydrophobicContact CZ-CB 4.37Å; F275-I325 HydrophobicContact CZ-CD1 4.33Å; F275-I325 HydrophobicContact CZ-CG2 3.88Å; F275-F332 HydrophobicContact CD1-CE1 4.17Å; F275-F332 HydrophobicContact CD2-CE1 4.31Å; F275-F332 HydrophobicContact CE1-CE1 4.14Å; F275-F332 HydrophobicContact CE2-CE1 4.28Å; F275-F332 HydrophobicContact CG-CE1 4.24Å; F275-F332 HydrophobicContact CG-CZ 4.48Å; F275-F332 HydrophobicContact CZ-CE1 4.18Å; F275-V354 HydrophobicContact CB-CG1 3.81Å; F275-V354 HydrophobicContact CD1-CG1 3.93Å; F275-V354 HydrophobicContact CG-CG1 4.38Å; F275-L357 HydrophobicContact CD1-CD1 4.49Å; F275-L357 HydrophobicContact CD2-CD1 4.33Å; F275-L357 HydrophobicContact CE1-CD1 3.91Å; F275-L357 HydrophobicContact CE2-CD1 3.72Å; F275-L357 HydrophobicContact CZ-CD1 3.51Å |
| 276 | L | 98.7 | Very high | 98.2 | Very high | 19 Ų | 19 | 34.1 Ų | 34.1 | 10% | 0.099 | 21% | 0.212 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -106.3 | 130.9 | -173.7 | -59.1 | 99.1 | 0 | 0 | 0 | 112.5 | D274 D280 V354 T355 V356 R358 | D274-L276 HydrophobicContact CB-CD1 4.21Å; D274-L276 WeakPolarHBondContact O-CD1 3.41Å; L276-D280 CarbonylContact C-O 3.54Å; L276-D280 VanDerWaalsContact CA-O 3.31Å; L276-D280 WeakPolarHBondContact CA-O 3.23Å; L276-V354 CarbonylContact O-C 3.58Å; L276-V354 VanDerWaalsContact O-CA 3.31Å; L276-V354 WeakPolarHBondContact O-CA 3.17Å; L276-T355 PolarHBondContact O-N 2.68Å; L276-V356 HydrophobicContact CB-CB 4.28Å; L276-V356 HydrophobicContact CD1-CB 4.03Å; L276-V356 HydrophobicContact CD1-CG1 3.94Å; L276-V356 WeakPolarHBondContact CD1-O 3.48Å; L276-V356 PolarHBondContact N-O 3.27Å; L276-R358 HydrophobicContact CD1-CB 3.51Å |
| 277 | K | 97.8 | Very high | 98.3 | Very high | 36 Ų | 36 | 29 Ų | 29 | 16% | 0.157 | 18% | 0.179 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -114.6 | 90.8 | 170 | -178.7 | -179.4 | 176.9 | 172.5 | 0 | 108.1 | P279 D280 V282 G349 E353 V354 | K277-P279 WeakPolarHBondContact O-CD 3.34Å; K277-D280 PolarHBondContact N-O 2.81Å; K277-D280 PolarHBondContact O-N 2.83Å; K277-V282 HydrophobicContact CB-CG1 3.52Å; K277-V282 HydrophobicContact CD-CG1 4.09Å; K277-V282 HydrophobicContact CG-CG1 4.45Å; K277-G349 PolarHBondContact NZ-O 2.93Å; K277-E353 HydrophobicContact CD-CB 4.22Å; K277-E353 WeakPolarHBondContact CE-OE2 3.48Å; K277-E353 HydrophobicContact CG-CB 3.84Å; K277-E353 IonicContact NZ-OE2 3.47Å; K277-E353 PolarHBondContact NZ-OE2 2.84Å; K277-V354 HydrophobicContact CB-CG2 4.21Å |
| 278 | G | 96.1 | Very high | 98.4 | Very high | 54 Ų | 54 | 28.1 Ų | 28.1 | 56% | 0.557 | 16% | 0.155 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 58.8 | -121.7 | -169.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | D280 | G278-D280 VanDerWaalsContact C-N 3.35Š|
| 279 | P | 96.8 | Very high | 98.4 | Very high | 122 Ų | 122 | 29 Ų | 29 | 79% | 0.792 | 16% | 0.158 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -80.7 | -13.9 | 177.1 | 35 | -35.6 | 0 | 0 | 0 | 113.9 | K277 | K277-P279 WeakPolarHBondContact O-CD 3.34Š|
| 280 | D | 98.4 | Very high | 98.3 | Very high | 39 Ų | 39 | 31.2 Ų | 31.2 | 21% | 0.209 | 17% | 0.17 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -86.2 | 147.3 | -174.5 | -68.6 | -22.8 | 0 | 0 | 0 | 111.3 | L276 K277 G278 S299 L300 G301 | L276-D280 CarbonylContact C-O 3.54Å; L276-D280 VanDerWaalsContact CA-O 3.31Å; L276-D280 WeakPolarHBondContact CA-O 3.23Å; K277-D280 PolarHBondContact N-O 2.81Å; K277-D280 PolarHBondContact O-N 2.83Å; G278-D280 VanDerWaalsContact C-N 3.35Å; D280-S299 WeakPolarHBondContact CA-O 3.37Å; D280-L300 HydrophobicContact CB-CD2 4.1Å; D280-G301 PolarHBondContact OD1-N 2.89Å |
| 281 | V | 98.8 | Very high | 98.2 | Very high | 17 Ų | 17 | 29.8 Ų | 29.8 | 10% | 0.103 | 17% | 0.168 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.3 | 105.2 | 169.6 | -178.2 | 0 | 0 | 0 | 0 | 107.5 | D274 F275 H284 S298 S299 | D274-V281 HydrophobicContact CB-CG1 4Å; F275-V281 CarbonylContact O-C 3.54Å; F275-V281 WeakPolarHBondContact O-CA 3.49Å; V281-H284 HydrophobicContact CG1-CB 3.81Å; V281-S298 CarbonylContact O-C 3.58Å; V281-S298 WeakPolarHBondContact O-CA 3.2Å; V281-S298 WeakPolarHBondContact O-CB 3.47Å; V281-S299 PolarHBondContact N-O 2.88Å; V281-S299 PolarHBondContact O-N 3.06Å |
| 282 | V | 98.6 | Very high | 98.2 | Very high | 6 Ų | 6 | 36.4 Ų | 36.4 | 4% | 0.036 | 20% | 0.199 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -78.4 | -30.7 | -177.3 | -58.6 | 0 | 0 | 0 | 0 | 111.8 | F275 K277 S298 V348 V354 | F275-V282 HydrophobicContact CB-CG2 3.75Å; F275-V282 WeakPolarHBondContact O-CG2 3.05Å; F275-V282 PolarHBondContact O-N 2.9Å; K277-V282 HydrophobicContact CB-CG1 3.52Å; K277-V282 HydrophobicContact CD-CG1 4.09Å; K277-V282 HydrophobicContact CG-CG1 4.45Å; V282-S298 PolarHBondContact O-OG 3.14Å; V282-V348 HydrophobicContact CB-CG1 4.04Å; V282-V348 HydrophobicContact CG1-CG1 3.58Å; V282-V354 HydrophobicContact CG1-CG2 4.37Å; V282-V354 HydrophobicContact CG2-CG1 4.1Å; V282-V354 HydrophobicContact CG2-CG2 3.73Å |
| 283 | F | 98.9 | Very high | 98.1 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 20% | 0.195 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -142.6 | 115 | 172.5 | 174.8 | -141.8 | 0 | 0 | 0 | 109.5 | D274 F275 F285 R296 I325 F332 V334 Y344 | D274-F283 WeakPolarHBondContact CA-O 3.2Å; F275-F283 HydrophobicContact CB-CB 4.23Å; F275-F283 HydrophobicContact CD2-CB 4.16Å; F275-F283 AromaticContact CD2-CD1 3.6Å; F275-F283 HydrophobicContact CD2-CD1 3.6Å; F275-F283 HydrophobicContact CD2-CE1 4.48Å; F275-F283 HydrophobicContact CD2-CG 4.29Å; F275-F283 AromaticContact CE2-CD1 3.77Å; F275-F283 HydrophobicContact CE2-CD1 3.77Å; F275-F283 HydrophobicContact CE2-CE1 4.29Å; F275-F283 PolarHBondContact N-O 2.77Å; F283-F285 HydrophobicContact CE1-CB 4.3Å; F283-F285 HydrophobicContact CE2-CB 4.19Å; F283-F285 HydrophobicContact CZ-CB 3.85Å; F283-F285 HydrophobicContact CZ-CD2 4.11Å; F283-F285 HydrophobicContact CZ-CG 4.43Å; F283-R296 HydrophobicContact CE2-CB 4.09Å; F283-R296 HydrophobicContact CE2-CG 4.08Å; F283-I325 HydrophobicContact CE1-CD1 4.3Å; F283-I325 HydrophobicContact CE1-CG2 4.09Å; F283-F332 HydrophobicContact CB-CD2 4.01Å; F283-F332 HydrophobicContact CB-CE2 3.6Å; F283-F332 HydrophobicContact CB-CZ 3.88Å; F283-F332 HydrophobicContact CD1-CB 4.16Å; F283-F332 AromaticContact CD1-CD1 3.82Å; F283-F332 HydrophobicContact CD1-CD1 3.82Å; F283-F332 AromaticContact CD1-CD2 3.89Å; F283-F332 HydrophobicContact CD1-CD2 3.89Å; F283-F332 HydrophobicContact CD1-CE1 4.11Å; F283-F332 HydrophobicContact CD1-CE2 4.18Å; F283-F332 AromaticContact CD1-CG 3.69Å; F283-F332 HydrophobicContact CD1-CG 3.69Å; F283-F332 HydrophobicContact CD1-CZ 4.28Å; F283-F332 HydrophobicContact CE1-CB 4.01Å; F283-F332 HydrophobicContact CE1-CD1 4.3Å; F283-F332 HydrophobicContact CE1-CG 4.05Å; F283-F332 AromaticContact CG-CD2 3.96Å; F283-F332 HydrophobicContact CG-CD2 3.96Å; F283-F332 HydrophobicContact CG-CE2 4.06Å; F283-F332 HydrophobicContact CG-CG 4.24Å; F283-F332 HydrophobicContact CG-CZ 4.45Å; F283-V334 HydrophobicContact CE1-CG2 4.23Å; F283-V334 HydrophobicContact CZ-CG2 4.01Å; F283-Y344 HydrophobicContact CB-CD1 4.25Å; F283-Y344 HydrophobicContact CB-CE1 4.27Å; F283-Y344 AromaticContact CD2-CD1 3.3Å; F283-Y344 HydrophobicContact CD2-CD1 3.3Å; F283-Y344 HydrophobicContact CD2-CD2 4.4Å; F283-Y344 AromaticContact CD2-CE1 3.68Å; F283-Y344 HydrophobicContact CD2-CE1 3.68Å; F283-Y344 AromaticContact CD2-CG 3.71Å; F283-Y344 HydrophobicContact CD2-CG 3.71Å; F283-Y344 AromaticContact CE2-CD1 3.8Å; F283-Y344 HydrophobicContact CE2-CD1 3.8Å; F283-Y344 HydrophobicContact CE2-CD2 4.3Å; F283-Y344 HydrophobicContact CE2-CE1 4.48Å; F283-Y344 AromaticContact CE2-CG 3.7Å; F283-Y344 HydrophobicContact CE2-CG 3.7Å; F283-Y344 AromaticContact CG-CD1 3.93Å; F283-Y344 HydrophobicContact CG-CD1 3.93Å; F283-Y344 HydrophobicContact CG-CE1 4.33Å |
| 284 | H | 98.9 | Very high | 98.1 | Very high | 10 Ų | 10 | 35.5 Ų | 35.5 | 5% | 0.046 | 20% | 0.197 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.6 | 117.3 | 172.3 | 177.5 | 66.2 | 0 | 0 | 0 | 108.2 | D274 V281 N286 R296 N297 W304 | D274-H284 IonicContact OD1-CE1 3.76Å; D274-H284 IonicContact OD1-CG 3.83Å; D274-H284 IonicContact OD1-ND1 2.69Å; D274-H284 PolarHBondContact OD1-ND1 2.8Å; V281-H284 HydrophobicContact CG1-CB 3.81Å; H284-N286 WeakPolarHBondContact NE2-CB 3.5Å; H284-R296 VanDerWaalsContact O-CA 3.22Å; H284-R296 WeakPolarHBondContact O-CA 3.39Å; H284-N297 VanDerWaalsContact CB-O 3.29Å; H284-N297 WeakPolarHBondContact CB-O 3.38Å; H284-N297 PolarHBondContact N-O 2.91Å; H284-N297 PolarHBondContact O-N 2.9Å; H284-W304 HydrophobicContact CB-CH2 3.73Å; H284-W304 HydrophobicContact CB-CZ3 3.55Å; H284-W304 AromaticContact CD2-CH2 3.7Å; H284-W304 AromaticContact CD2-CZ3 3.77Å; H284-W304 AromaticContact CE1-CH2 3.99Å; H284-W304 AromaticContact CG-CH2 3.48Å; H284-W304 VanDerWaalsContact CG-CH2 3.48Å; H284-W304 AromaticContact CG-CZ3 3.67Å; H284-W304 AromaticContact ND1-CH2 3.69Å |
| 285 | F | 98.9 | Very high | 98.1 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 20% | 0.195 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -109.4 | 110.6 | 172.4 | 176.5 | -93.1 | 0 | 0 | 0 | 108.7 | F271 Q272 V273 F283 P287 I294 F315 L323 V334 L341 L342 | F271-F285 HydrophobicContact CE2-CE1 4.48Å; Q272-F285 CarbonylContact C-O 3.59Å; Q272-F285 WeakPolarHBondContact CA-O 3.2Å; V273-F285 HydrophobicContact CB-CB 4.36Å; V273-F285 HydrophobicContact CB-CD1 4.42Å; V273-F285 HydrophobicContact CG2-CD1 4.43Å; V273-F285 PolarHBondContact N-O 3.46Å; V273-F285 PolarHBondContact O-N 2.95Å; F283-F285 HydrophobicContact CE1-CB 4.3Å; F283-F285 HydrophobicContact CE2-CB 4.19Å; F283-F285 HydrophobicContact CZ-CB 3.85Å; F283-F285 HydrophobicContact CZ-CD2 4.11Å; F283-F285 HydrophobicContact CZ-CG 4.43Å; F285-P287 HydrophobicContact CD1-CG 3.98Å; F285-P287 HydrophobicContact CE1-CG 3.35Å; F285-P287 HydrophobicContact CZ-CG 3.88Å; F285-I294 HydrophobicContact CD2-CG2 3.75Å; F285-I294 HydrophobicContact CE2-CD1 4.21Å; F285-I294 HydrophobicContact CE2-CG2 3.46Å; F285-I294 VanDerWaalsContact CE2-CG2 3.46Å; F285-I294 HydrophobicContact CG-CG2 4.43Å; F285-I294 HydrophobicContact CZ-CD1 4.06Å; F285-I294 HydrophobicContact CZ-CG2 3.9Å; F285-F315 HydrophobicContact CE1-CE2 4.19Å; F285-F315 AromaticContact CE1-CZ 3.88Å; F285-F315 HydrophobicContact CE1-CZ 3.88Å; F285-F315 AromaticContact CZ-CE2 3.93Å; F285-F315 HydrophobicContact CZ-CE2 3.93Å; F285-F315 AromaticContact CZ-CZ 3.78Å; F285-F315 HydrophobicContact CZ-CZ 3.78Å; F285-L323 HydrophobicContact CD1-CD2 4.27Å; F285-L323 HydrophobicContact CE1-CD1 4.22Å; F285-L323 HydrophobicContact CE1-CD2 4.04Å; F285-L323 HydrophobicContact CZ-CD1 4.12Å; F285-V334 HydrophobicContact CE2-CG1 3.92Å; F285-V334 HydrophobicContact CZ-CG1 4.36Å; F285-L341 HydrophobicContact CE2-CD2 4.44Å; F285-L341 HydrophobicContact CZ-CD2 4.36Å; F285-L342 HydrophobicContact CE2-CD2 4.07Å |
| 286 | N | 98.9 | Very high | 98.1 | Very high | 3 Ų | 3 | 36.3 Ų | 36.3 | 2% | 0.016 | 20% | 0.199 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -130.9 | 91.1 | -171.1 | 175 | -133.6 | 0 | 0 | 0 | 113.5 | F271 Q272 H284 R288 V295 | F271-N286 WeakPolarHBondContact O-CA 3.4Å; F271-N286 PolarHBondContact O-ND2 2.88Å; Q272-N286 HydrophobicContact CB-CB 4.19Å; H284-N286 WeakPolarHBondContact NE2-CB 3.5Å; N286-R288 PolarHBondContact O-N 2.86Å; N286-R288 PolarHBondContact OD1-NE 3.3Å; N286-V295 HydrophobicContact CB-CB 4.45Å; N286-V295 PolarHBondContact N-O 3.28Å; N286-V295 PolarHBondContact O-N 2.94Å |
| 287 | P | 98.8 | Very high | 98.1 | Very high | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 20% | 0.195 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -66.2 | 125.3 | 167.8 | -25.4 | 39 | 0 | 0 | 0 | 111.7 | R270 F271 F285 I294 F313 F315 | R270-P287 VanDerWaalsContact CA-O 3.29Å; R270-P287 WeakPolarHBondContact CA-O 3.29Å; R270-P287 VanDerWaalsContact CB-O 3.29Å; R270-P287 WeakPolarHBondContact CB-O 3.29Å; F271-P287 HydrophobicContact CD1-CB 4.23Å; F271-P287 HydrophobicContact CD1-CG 4.45Å; F271-P287 HydrophobicContact CE1-CB 3.72Å; F271-P287 HydrophobicContact CE1-CG 3.79Å; F271-P287 HydrophobicContact CE2-CG 3.94Å; F271-P287 HydrophobicContact CZ-CB 4Å; F271-P287 HydrophobicContact CZ-CG 3.52Å; F271-P287 PolarHBondContact N-O 2.85Å; F271-P287 VanDerWaalsContact O-CD 3.29Å; F271-P287 WeakPolarHBondContact O-CD 3.26Å; F285-P287 HydrophobicContact CD1-CG 3.98Å; F285-P287 HydrophobicContact CE1-CG 3.35Å; F285-P287 HydrophobicContact CZ-CG 3.88Å; P287-I294 HydrophobicContact CB-CG1 4.38Å; P287-I294 HydrophobicContact CG-CG1 4.31Å; P287-I294 HydrophobicContact CG-CG2 4.43Å; P287-F313 HydrophobicContact CB-CE2 3.82Å; P287-F313 HydrophobicContact CB-CZ 4.24Å; P287-F315 HydrophobicContact CB-CD2 3.69Å; P287-F315 HydrophobicContact CB-CE2 3.78Å; P287-F315 HydrophobicContact CB-CG 4.5Å; P287-F315 HydrophobicContact CG-CD2 3.83Å; P287-F315 HydrophobicContact CG-CE2 3.36Å; P287-F315 HydrophobicContact CG-CZ 3.94Å |
| 288 | R | 98.7 | Very high | 98.2 | Very high | 46 Ų | 46 | 34 Ų | 34 | 17% | 0.174 | 19% | 0.189 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 118.4 | 176.6 | -58.4 | -175.7 | -174.4 | 172.6 | 7.8 | 109.7 | R270 N286 E291 Q292 T293 V295 E307 F313 | R270-R288 HydrophobicContact CB-CG 4.27Å; N286-R288 PolarHBondContact O-N 2.86Å; N286-R288 PolarHBondContact OD1-NE 3.3Å; R288-E291 HydrophobicContact CB-CB 4.33Å; R288-E291 WeakPolarHBondContact CD-OE1 3.4Å; R288-E291 IonicContact NH1-OE1 3.52Å; R288-E291 PolarHBondContact NH1-OE1 3.45Å; R288-E291 VanDerWaalsContact NH1-OE1 3.13Å; R288-E291 IonicContact NH1-OE2 3.5Å; R288-Q292 WeakPolarHBondContact O-CA 3.29Å; R288-Q292 PolarHBondContact O-N 3.2Å; R288-T293 PolarHBondContact N-O 2.98Å; R288-T293 PolarHBondContact O-N 2.67Å; R288-V295 VanDerWaalsContact CZ-CG2 3.48Å; R288-E307 IonicContact NH2-OE1 3.7Å; R288-E307 PolarHBondContact NH2-OE1 3.38Å; R288-F313 WeakPolarHBondContact O-CE2 3.4Å |
| 289 | F | 98.3 | Very high | 98.3 | Very high | 23 Ų | 23 | 32 Ų | 32 | 10% | 0.101 | 17% | 0.167 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -33.2 | -172.9 | -71.8 | -88.9 | 0 | 0 | 0 | 113 | P264 A268 D269 F271 E291 Q292 F313 F315 Q317 | P264-F289 HydrophobicContact CB-CE1 4.1Å; P264-F289 HydrophobicContact CB-CE2 3.87Å; P264-F289 HydrophobicContact CB-CZ 3.31Å; P264-F289 HydrophobicContact CG-CE1 4.28Å; P264-F289 HydrophobicContact CG-CE2 4.43Å; P264-F289 HydrophobicContact CG-CZ 3.55Å; A268-F289 HydrophobicContact CB-CD2 3.86Å; A268-F289 HydrophobicContact CB-CE2 3.89Å; A268-F289 WeakPolarHBondContact O-CB 3.37Å; D269-F289 PolarHBondContact O-N 3.04Å; F271-F289 AromaticContact CD1-CE2 3.94Å; F271-F289 HydrophobicContact CD1-CE2 3.94Å; F271-F289 HydrophobicContact CD1-CZ 4.33Å; F271-F289 HydrophobicContact CE1-CE2 4.17Å; F271-F289 HydrophobicContact CE1-CZ 4.14Å; F289-E291 VanDerWaalsContact C-N 3.33Å; F289-Q292 PolarHBondContact O-N 3.39Å; F289-F313 AromaticContact CD1-CE1 3.74Å; F289-F313 HydrophobicContact CD1-CE1 3.74Å; F289-F313 AromaticContact CD1-CZ 3.73Å; F289-F313 HydrophobicContact CD1-CZ 3.73Å; F289-F313 HydrophobicContact CD2-CZ 4.46Å; F289-F313 AromaticContact CE1-CE1 3.83Å; F289-F313 HydrophobicContact CE1-CE1 3.83Å; F289-F313 AromaticContact CE1-CZ 3.83Å; F289-F313 HydrophobicContact CE1-CZ 3.83Å; F289-F313 HydrophobicContact CG-CE1 4.45Å; F289-F313 HydrophobicContact CG-CZ 4.04Å; F289-F313 HydrophobicContact CZ-CZ 4.21Å; F289-F315 HydrophobicContact CE1-CB 3.83Å; F289-F315 HydrophobicContact CZ-CB 3.89Å; F289-Q317 HydrophobicContact CD1-CG 3.61Å; F289-Q317 HydrophobicContact CE1-CG 3.74Å; F289-Q317 HydrophobicContact CG-CG 4.22Å; F289-Q317 HydrophobicContact CZ-CG 4.44Å |
| 290 | N | 95.9 | Very high | 98.4 | Very high | 108 Ų | 108 | 29.1 Ų | 29.1 | 58% | 0.578 | 14% | 0.144 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -64 | -37.1 | 177 | 60.5 | -12.5 | 0 | 0 | 0 | 112.8 | D269 | D269-N290 PolarHBondContact OD1-ND2 3.13Š|
| 291 | E | 96.3 | Very high | 98.3 | Very high | 87 Ų | 87 | 30 Ų | 30 | 41% | 0.407 | 16% | 0.162 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -92.4 | -12.4 | 179.1 | -67.3 | 175.7 | -134 | 0 | 0 | 112.3 | R288 F289 T293 R309 | R288-E291 HydrophobicContact CB-CB 4.33Å; R288-E291 WeakPolarHBondContact CD-OE1 3.4Å; R288-E291 IonicContact NH1-OE1 3.52Å; R288-E291 PolarHBondContact NH1-OE1 3.45Å; R288-E291 VanDerWaalsContact NH1-OE1 3.13Å; R288-E291 IonicContact NH1-OE2 3.5Å; F289-E291 VanDerWaalsContact C-N 3.33Å; E291-T293 HydrophobicContact CB-CG2 3.61Å; E291-T293 PolarHBondContact O-N 2.85Å; E291-T293 WeakPolarHBondContact OE2-CG2 3.3Å; E291-R309 IonicContact OE2-CZ 2.73Å; E291-R309 IonicContact OE2-NH1 3.09Å; E291-R309 PolarHBondContact OE2-NH1 2.7Å; E291-R309 IonicContact OE2-NH2 3.45Å |
| 292 | Q | 97.6 | Very high | 98.2 | Very high | 141 Ų | 141 | 32 Ų | 32 | 66% | 0.659 | 19% | 0.186 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 45.2 | 46.7 | -167.5 | -58.7 | -161.1 | -79.4 | 0 | 0 | 112.3 | R288 F289 F313 | R288-Q292 WeakPolarHBondContact O-CA 3.29Å; R288-Q292 PolarHBondContact O-N 3.2Å; F289-Q292 PolarHBondContact O-N 3.39Å; Q292-F313 HydrophobicContact CB-CB 4.36Å; Q292-F313 HydrophobicContact CB-CD1 4.37Å; Q292-F313 HydrophobicContact CB-CG 4.25Å; Q292-F313 VanDerWaalsContact O-CB 3.3Å; Q292-F313 WeakPolarHBondContact O-CB 3.49Å |
| 293 | T | 98.4 | Very high | 98.2 | Very high | 19 Ų | 19 | 40.5 Ų | 40.5 | 12% | 0.117 | 22% | 0.219 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -135 | 157.1 | -178.7 | -164.3 | 0 | 0 | 0 | 0 | 110.7 | R288 E291 V295 R309 F313 | R288-T293 PolarHBondContact N-O 2.98Å; R288-T293 PolarHBondContact O-N 2.67Å; E291-T293 HydrophobicContact CB-CG2 3.61Å; E291-T293 PolarHBondContact O-N 2.85Å; E291-T293 WeakPolarHBondContact OE2-CG2 3.3Å; T293-V295 HydrophobicContact CG2-CG2 4.11Å; T293-R309 PolarHBondContact OG1-O 2.67Å; T293-F313 WeakPolarHBondContact O-CE2 3.31Å |
| 294 | I | 98.8 | Very high | 98.2 | Very high | 7 Ų | 7 | 47 Ų | 47 | 4% | 0.036 | 24% | 0.243 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.6 | 113.1 | 172.5 | -57.4 | 172.7 | 0 | 0 | 0 | 106.5 | F285 P287 R296 F313 F315 L341 L342 | F285-I294 HydrophobicContact CD2-CG2 3.75Å; F285-I294 HydrophobicContact CE2-CD1 4.21Å; F285-I294 HydrophobicContact CE2-CG2 3.46Å; F285-I294 VanDerWaalsContact CE2-CG2 3.46Å; F285-I294 HydrophobicContact CG-CG2 4.43Å; F285-I294 HydrophobicContact CZ-CD1 4.06Å; F285-I294 HydrophobicContact CZ-CG2 3.9Å; P287-I294 HydrophobicContact CB-CG1 4.38Å; P287-I294 HydrophobicContact CG-CG1 4.31Å; P287-I294 HydrophobicContact CG-CG2 4.43Å; I294-R296 HydrophobicContact CG2-CG 4.49Å; I294-F313 HydrophobicContact CG1-CD2 3.92Å; I294-F313 HydrophobicContact CG1-CE2 4.33Å; I294-F315 HydrophobicContact CD1-CD2 4.44Å; I294-F315 HydrophobicContact CD1-CE2 3.78Å; I294-F315 HydrophobicContact CG1-CE2 4.27Å; I294-L341 HydrophobicContact CD1-CD1 4.39Å; I294-L341 HydrophobicContact CD1-CD2 3.61Å; I294-L341 HydrophobicContact CD1-CG 4.3Å; I294-L342 HydrophobicContact CD1-CD2 4.37Å; I294-L342 HydrophobicContact CG2-CD2 4.15Å |
| 295 | V | 98.8 | Very high | 98.2 | Very high | 1 Ų | 1 | 48 Ų | 48 | 1% | 0.006 | 26% | 0.257 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.6 | 124.1 | 173 | 179.3 | 0 | 0 | 0 | 0 | 108.5 | N286 R288 T293 E307 R309 | N286-V295 HydrophobicContact CB-CB 4.45Å; N286-V295 PolarHBondContact N-O 3.28Å; N286-V295 PolarHBondContact O-N 2.94Å; R288-V295 VanDerWaalsContact CZ-CG2 3.48Å; T293-V295 HydrophobicContact CG2-CG2 4.11Å; V295-E307 HydrophobicContact CG1-CB 4.07Å; V295-E307 HydrophobicContact CG1-CG 3.74Å; V295-E307 WeakPolarHBondContact CG1-OE1 3.35Å; V295-R309 HydrophobicContact CG2-CG 4.28Å |
| 296 | R | 98.8 | Very high | 98.1 | Very high | 24 Ų | 24 | 52.9 Ų | 52.9 | 9% | 0.091 | 29% | 0.289 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.3 | 138.4 | 165.1 | -45.2 | 100.3 | 64.6 | 158.3 | -2.2 | 111.2 | F283 H284 I294 E308 E310 L342 E343 Y344 | F283-R296 HydrophobicContact CE2-CB 4.09Å; F283-R296 HydrophobicContact CE2-CG 4.08Å; H284-R296 VanDerWaalsContact O-CA 3.22Å; H284-R296 WeakPolarHBondContact O-CA 3.39Å; I294-R296 HydrophobicContact CG2-CG 4.49Å; R296-E308 HydrophobicContact CB-CB 4.33Å; R296-E308 IonicContact CZ-OE2 3.45Å; R296-E308 PolarHBondContact N-O 2.77Å; R296-E308 IonicContact NE-OE2 3.89Å; R296-E308 PolarHBondContact NE-OE2 3.11Å; R296-E308 IonicContact NH2-OE2 2.68Å; R296-E308 PolarHBondContact NH2-OE2 2.67Å; R296-E308 PolarHBondContact O-N 3.04Å; R296-E310 PolarHBondContact NH1-O 2.84Å; R296-L342 HydrophobicContact CG-CD1 4.19Å; R296-L342 HydrophobicContact CG-CD2 4.25Å; R296-E343 PolarHBondContact NH2-O 2.88Å; R296-Y344 HydrophobicContact CB-CD2 3.56Å; R296-Y344 HydrophobicContact CB-CE2 3.74Å; R296-Y344 HydrophobicContact CB-CG 4.37Å; R296-Y344 HydrophobicContact CG-CD2 4.32Å |
| 297 | N | 98.8 | Very high | 98.1 | Very high | 4 Ų | 4 | 57 Ų | 57 | 2% | 0.021 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -161.6 | 176.9 | 178.4 | -150.9 | -18 | 0 | 0 | 0 | 111.7 | H284 W304 G305 P306 E307 Y344 R347 | H284-N297 VanDerWaalsContact CB-O 3.29Å; H284-N297 WeakPolarHBondContact CB-O 3.38Å; H284-N297 PolarHBondContact N-O 2.91Å; H284-N297 PolarHBondContact O-N 2.9Å; N297-W304 HydrophobicContact CB-CE3 3.79Å; N297-W304 HydrophobicContact CB-CZ3 3.96Å; N297-G305 PolarHBondContact ND2-O 2.78Å; N297-G305 WeakPolarHBondContact OD1-CA 3.14Å; N297-G305 PolarHBondContact OD1-N 3.36Å; N297-G305 PolarHBondContact OD1-O 3.06Å; N297-P306 PolarHBondContact OD1-O 3.24Å; N297-P306 VanDerWaalsContact OD1-O 3.05Å; N297-E307 WeakPolarHBondContact ND2-CG 3.45Å; N297-Y344 WeakPolarHBondContact CA-OH 3.37Å; N297-Y344 PolarHBondContact O-OH 3.06Å; N297-R347 PolarHBondContact OD1-NH1 2.9Å |
| 298 | S | 98.9 | Very high | 98.1 | Very high | 2 Ų | 2 | 59.6 Ų | 59.6 | 1% | 0.014 | 32% | 0.32 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.2 | 143.9 | 165.1 | -49.2 | 0 | 0 | 0 | 0 | 109.1 | V281 V282 G305 Y344 R347 | V281-S298 CarbonylContact O-C 3.58Å; V281-S298 WeakPolarHBondContact O-CA 3.2Å; V281-S298 WeakPolarHBondContact O-CB 3.47Å; V282-S298 PolarHBondContact O-OG 3.14Å; S298-G305 PolarHBondContact O-N 3.39Å; S298-Y344 PolarHBondContact N-OH 2.87Å; S298-Y344 PolarHBondContact OG-OH 2.81Å; S298-R347 WeakPolarHBondContact OG-CD 3.22Å |
| 299 | S | 98.7 | Very high | 98.1 | Very high | 14 Ų | 14 | 61.7 Ų | 61.7 | 10% | 0.098 | 33% | 0.328 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.8 | 105.1 | 168.3 | -174.7 | 0 | 0 | 0 | 0 | 108.3 | D280 V281 Y303 | D280-S299 WeakPolarHBondContact CA-O 3.37Å; V281-S299 PolarHBondContact N-O 2.88Å; V281-S299 PolarHBondContact O-N 3.06Å; S299-Y303 CarbonylContact C-O 3.53Å; S299-Y303 VanDerWaalsContact CA-O 3.31Å; S299-Y303 WeakPolarHBondContact CA-O 3.35Å |
| 300 | L | 98.3 | Very high | 98 | Very high | 60 Ų | 60 | 68.9 Ų | 68.9 | 31% | 0.314 | 36% | 0.362 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.5 | 126.8 | -174.4 | -55.7 | -179.8 | 0 | 0 | 0 | 109.3 | D280 G302 Y303 V348 | D280-L300 HydrophobicContact CB-CD2 4.1Å; L300-G302 PolarHBondContact O-N 3.46Å; L300-Y303 PolarHBondContact N-O 2.92Å; L300-Y303 PolarHBondContact O-N 2.77Å; L300-Y303 VanDerWaalsContact O-N 3.16Å; L300-V348 HydrophobicContact CD1-CB 4.44Å; L300-V348 HydrophobicContact CD2-CG1 4.2Å |
| 301 | G | 97 | Very high | 97.9 | Very high | 57 Ų | 57 | 66.3 Ų | 66.3 | 59% | 0.588 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.3 | 25.5 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | D280 Y303 | D280-G301 PolarHBondContact OD1-N 2.89Å; G301-Y303 WeakPolarHBondContact O-CD2 3.39Å; G301-Y303 WeakPolarHBondContact O-CE2 3.26Å |
| 302 | G | 96.4 | Very high | 98 | Very high | 59 Ų | 59 | 66.1 Ų | 66.1 | 61% | 0.608 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 83.1 | 6.6 | -177.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | L300 | L300-G302 PolarHBondContact O-N 3.46Š|
| 303 | Y | 98.2 | Very high | 98 | Very high | 186 Ų | 186 | 61.2 Ų | 61.2 | 73% | 0.729 | 34% | 0.344 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -116.1 | 129.5 | 179 | -59.4 | -85.8 | 0 | 0 | 0 | 111.4 | S299 L300 G301 | S299-Y303 CarbonylContact C-O 3.53Å; S299-Y303 VanDerWaalsContact CA-O 3.31Å; S299-Y303 WeakPolarHBondContact CA-O 3.35Å; L300-Y303 PolarHBondContact N-O 2.92Å; L300-Y303 PolarHBondContact O-N 2.77Å; L300-Y303 VanDerWaalsContact O-N 3.16Å; G301-Y303 WeakPolarHBondContact O-CD2 3.39Å; G301-Y303 WeakPolarHBondContact O-CE2 3.26Å |
| 304 | W | 98.6 | Very high | 98 | Very high | 135 Ų | 135 | 62 Ų | 62 | 51% | 0.511 | 35% | 0.349 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.7 | 132.7 | 171 | -71.1 | 105.8 | 0 | 0 | 0 | 111 | H284 N297 | H284-W304 HydrophobicContact CB-CH2 3.73Å; H284-W304 HydrophobicContact CB-CZ3 3.55Å; H284-W304 AromaticContact CD2-CH2 3.7Å; H284-W304 AromaticContact CD2-CZ3 3.77Å; H284-W304 AromaticContact CE1-CH2 3.99Å; H284-W304 AromaticContact CG-CH2 3.48Å; H284-W304 VanDerWaalsContact CG-CH2 3.48Å; H284-W304 AromaticContact CG-CZ3 3.67Å; H284-W304 AromaticContact ND1-CH2 3.69Å; N297-W304 HydrophobicContact CB-CE3 3.79Å; N297-W304 HydrophobicContact CB-CZ3 3.96Å |
| 305 | G | 98.6 | Very high | 98 | Very high | 32 Ų | 32 | 62.1 Ų | 62.1 | 33% | 0.33 | 35% | 0.35 | S | S | . | . | trans | -78.6 | -165.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | N297 S298 | N297-G305 PolarHBondContact ND2-O 2.78Å; N297-G305 WeakPolarHBondContact OD1-CA 3.14Å; N297-G305 PolarHBondContact OD1-N 3.36Å; N297-G305 PolarHBondContact OD1-O 3.06Å; S298-G305 PolarHBondContact O-N 3.39Å | ||
| 306 | P | 98.4 | Very high | 97.9 | Very high | 102 Ų | 102 | 65.4 Ų | 65.4 | 66% | 0.662 | 37% | 0.369 | S | S | * | . | trans | -64.6 | 135.4 | 171.8 | -20.5 | 33.2 | 0 | 0 | 0 | 111.6 | N297 R347 | N297-P306 PolarHBondContact OD1-O 3.24Å; N297-P306 VanDerWaalsContact OD1-O 3.05Å; P306-R347 VanDerWaalsContact O-CZ 3.3Å; P306-R347 PolarHBondContact O-NH1 2.73Å; P306-R347 PolarHBondContact O-NH2 3.23Å | ||
| 307 | E | 98.7 | Very high | 97.9 | Very high | 90 Ų | 90 | 68 Ų | 68 | 42% | 0.421 | 38% | 0.383 | S | S | . | . | trans | -78.7 | 140.4 | 176.1 | -67.5 | 178.9 | 142.4 | 0 | 0 | 111.6 | R288 V295 N297 R309 | R288-E307 IonicContact NH2-OE1 3.7Å; R288-E307 PolarHBondContact NH2-OE1 3.38Å; V295-E307 HydrophobicContact CG1-CB 4.07Å; V295-E307 HydrophobicContact CG1-CG 3.74Å; V295-E307 WeakPolarHBondContact CG1-OE1 3.35Å; N297-E307 WeakPolarHBondContact ND2-CG 3.45Å; E307-R309 HydrophobicContact CB-CG 4.25Å; E307-R309 VanDerWaalsContact CD-NH2 3.32Å; E307-R309 IonicContact OE1-NH2 3.39Å; E307-R309 PolarHBondContact OE1-NH2 3.3Å; E307-R309 IonicContact OE2-CZ 2.76Å; E307-R309 IonicContact OE2-NE 3.7Å; E307-R309 PolarHBondContact OE2-NE 2.89Å; E307-R309 IonicContact OE2-NH2 2.67Å; E307-R309 PolarHBondContact OE2-NH2 2.73Å | ||
| 308 | E | 98.7 | Very high | 97.8 | Very high | 55 Ų | 55 | 69.6 Ų | 69.6 | 26% | 0.257 | 40% | 0.399 | S | S | . | . | B | Isolated β-bridge | trans | -107.2 | 127.1 | 165.7 | -69.1 | 164.9 | -135.3 | 0 | 0 | 108.6 | R296 Y344 R347 | R296-E308 HydrophobicContact CB-CB 4.33Å; R296-E308 IonicContact CZ-OE2 3.45Å; R296-E308 PolarHBondContact N-O 2.77Å; R296-E308 IonicContact NE-OE2 3.89Å; R296-E308 PolarHBondContact NE-OE2 3.11Å; R296-E308 IonicContact NH2-OE2 2.68Å; R296-E308 PolarHBondContact NH2-OE2 2.67Å; R296-E308 PolarHBondContact O-N 3.04Å; E308-Y344 WeakPolarHBondContact OE1-CE2 3.45Å; E308-Y344 VanDerWaalsContact OE2-CD2 3.28Å; E308-Y344 WeakPolarHBondContact OE2-CD2 3.31Å; E308-R347 IonicContact OE1-CZ 2.7Å; E308-R347 IonicContact OE1-NE 3.74Å; E308-R347 IonicContact OE1-NH2 3.88Å; E308-R347 PolarHBondContact OE1-NH2 2.79Å |
| 309 | R | 98.4 | Very high | 97.8 | Very high | 90 Ų | 90 | 75.1 Ų | 75.1 | 34% | 0.34 | 42% | 0.42 | S | S | . | . | trans | -129.6 | -6.1 | -168.1 | -67.4 | 172.3 | 163.3 | -96.2 | 2.6 | 114 | E291 T293 V295 E307 | E291-R309 IonicContact OE2-CZ 2.73Å; E291-R309 IonicContact OE2-NH1 3.09Å; E291-R309 PolarHBondContact OE2-NH1 2.7Å; E291-R309 IonicContact OE2-NH2 3.45Å; T293-R309 PolarHBondContact OG1-O 2.67Å; V295-R309 HydrophobicContact CG2-CG 4.28Å; E307-R309 HydrophobicContact CB-CG 4.25Å; E307-R309 VanDerWaalsContact CD-NH2 3.32Å; E307-R309 IonicContact OE1-NH2 3.39Å; E307-R309 PolarHBondContact OE1-NH2 3.3Å; E307-R309 IonicContact OE2-CZ 2.76Å; E307-R309 IonicContact OE2-NE 3.7Å; E307-R309 PolarHBondContact OE2-NE 2.89Å; E307-R309 IonicContact OE2-NH2 2.67Å; E307-R309 PolarHBondContact OE2-NH2 2.73Å | ||
| 310 | E | 95.4 | Very high | 97.8 | Very high | 173 Ų | 173 | 81.1 Ų | 81.1 | 81% | 0.808 | 44% | 0.441 | S | S | * | . | trans | -72.9 | 143.9 | -176.3 | -61.7 | -176.9 | -179.1 | 0 | 0 | 111.1 | R296 | R296-E310 PolarHBondContact NH1-O 2.84Š| ||
| 311 | G | 94.7 | Very high | 97.8 | Very high | 54 Ų | 54 | 78.8 Ų | 78.8 | 56% | 0.557 | 43% | 0.428 | S | S | * | . | S | Bend | trans | 127.2 | 170.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 312 | P | 96.9 | Very high | 97.9 | Very high | 84 Ų | 84 | 79 Ų | 79 | 55% | 0.545 | 41% | 0.413 | S | S | . | . | trans | -77.6 | 165.2 | 177.9 | 31.9 | -32 | 0 | 0 | 0 | 111.9 | L341 | P312-L341 HydrophobicContact CG-CD1 3.62Š| ||
| 313 | F | 98.4 | Very high | 98 | Very high | 38 Ų | 38 | 76.1 Ų | 76.1 | 17% | 0.167 | 38% | 0.384 | C | S | . | . | trans | -115.4 | 97.9 | 175.9 | -169.6 | -91.7 | 0 | 0 | 0 | 110.7 | P287 R288 F289 Q292 T293 I294 F315 | P287-F313 HydrophobicContact CB-CE2 3.82Å; P287-F313 HydrophobicContact CB-CZ 4.24Å; R288-F313 WeakPolarHBondContact O-CE2 3.4Å; F289-F313 AromaticContact CD1-CE1 3.74Å; F289-F313 HydrophobicContact CD1-CE1 3.74Å; F289-F313 AromaticContact CD1-CZ 3.73Å; F289-F313 HydrophobicContact CD1-CZ 3.73Å; F289-F313 HydrophobicContact CD2-CZ 4.46Å; F289-F313 AromaticContact CE1-CE1 3.83Å; F289-F313 HydrophobicContact CE1-CE1 3.83Å; F289-F313 AromaticContact CE1-CZ 3.83Å; F289-F313 HydrophobicContact CE1-CZ 3.83Å; F289-F313 HydrophobicContact CG-CE1 4.45Å; F289-F313 HydrophobicContact CG-CZ 4.04Å; F289-F313 HydrophobicContact CZ-CZ 4.21Å; Q292-F313 HydrophobicContact CB-CB 4.36Å; Q292-F313 HydrophobicContact CB-CD1 4.37Å; Q292-F313 HydrophobicContact CB-CG 4.25Å; Q292-F313 VanDerWaalsContact O-CB 3.3Å; Q292-F313 WeakPolarHBondContact O-CB 3.49Å; T293-F313 WeakPolarHBondContact O-CE2 3.31Å; I294-F313 HydrophobicContact CG1-CD2 3.92Å; I294-F313 HydrophobicContact CG1-CE2 4.33Å; F313-F315 HydrophobicContact CD1-CB 4.44Å; F313-F315 HydrophobicContact CD2-CD2 4.49Å; F313-F315 HydrophobicContact CE1-CB 3.82Å; F313-F315 WeakPolarHBondContact CE1-O 3.42Å; F313-F315 HydrophobicContact CE2-CD2 4.18Å; F313-F315 HydrophobicContact CZ-CB 4.03Å; F313-F315 HydrophobicContact CZ-CD2 4.2Å | ||
| 314 | P | 98.1 | Very high | 98 | Very high | 36 Ų | 36 | 70.5 Ų | 70.5 | 23% | 0.234 | 36% | 0.363 | C | S | . | . | trans | -87.1 | -6.5 | -171.9 | 33.8 | -35.6 | 0 | 0 | 0 | 114.4 | R319 V336 L341 | P314-R319 PolarHBondContact O-NH2 2.89Å; P314-V336 HydrophobicContact CB-CB 4.44Å; P314-V336 HydrophobicContact CB-CG1 4.17Å; P314-V336 HydrophobicContact CG-CB 3.93Å; P314-V336 HydrophobicContact CG-CG1 3.94Å; P314-V336 HydrophobicContact CG-CG2 4.11Å; P314-L341 HydrophobicContact CG-CD1 4.01Å; P314-L341 HydrophobicContact CG-CD2 3.94Å | ||
| 315 | F | 98.4 | Very high | 98 | Very high | 9 Ų | 9 | 64 Ų | 64 | 4% | 0.039 | 34% | 0.339 | C | S | . | . | trans | -81.5 | 138.6 | -172.8 | -57.2 | -75.1 | 0 | 0 | 0 | 112.3 | F271 F285 P287 F289 I294 F313 F321 V336 | F271-F315 HydrophobicContact CE1-CD1 4.15Å; F271-F315 HydrophobicContact CE1-CE1 4.4Å; F271-F315 HydrophobicContact CE1-CG 4.23Å; F271-F315 AromaticContact CZ-CD1 3.92Å; F271-F315 HydrophobicContact CZ-CD1 3.92Å; F271-F315 AromaticContact CZ-CE1 3.71Å; F271-F315 HydrophobicContact CZ-CE1 3.71Å; F271-F315 HydrophobicContact CZ-CE2 4.32Å; F271-F315 HydrophobicContact CZ-CG 4.31Å; F271-F315 AromaticContact CZ-CZ 3.92Å; F271-F315 HydrophobicContact CZ-CZ 3.92Å; F285-F315 HydrophobicContact CE1-CE2 4.19Å; F285-F315 AromaticContact CE1-CZ 3.88Å; F285-F315 HydrophobicContact CE1-CZ 3.88Å; F285-F315 AromaticContact CZ-CE2 3.93Å; F285-F315 HydrophobicContact CZ-CE2 3.93Å; F285-F315 AromaticContact CZ-CZ 3.78Å; F285-F315 HydrophobicContact CZ-CZ 3.78Å; P287-F315 HydrophobicContact CB-CD2 3.69Å; P287-F315 HydrophobicContact CB-CE2 3.78Å; P287-F315 HydrophobicContact CB-CG 4.5Å; P287-F315 HydrophobicContact CG-CD2 3.83Å; P287-F315 HydrophobicContact CG-CE2 3.36Å; P287-F315 HydrophobicContact CG-CZ 3.94Å; F289-F315 HydrophobicContact CE1-CB 3.83Å; F289-F315 HydrophobicContact CZ-CB 3.89Å; I294-F315 HydrophobicContact CD1-CD2 4.44Å; I294-F315 HydrophobicContact CD1-CE2 3.78Å; I294-F315 HydrophobicContact CG1-CE2 4.27Å; F313-F315 HydrophobicContact CD1-CB 4.44Å; F313-F315 HydrophobicContact CD2-CD2 4.49Å; F313-F315 HydrophobicContact CE1-CB 3.82Å; F313-F315 WeakPolarHBondContact CE1-O 3.42Å; F313-F315 HydrophobicContact CE2-CD2 4.18Å; F313-F315 HydrophobicContact CZ-CB 4.03Å; F313-F315 HydrophobicContact CZ-CD2 4.2Å; F315-F321 HydrophobicContact CD1-CB 4.31Å; F315-F321 AromaticContact CD1-CD1 3.79Å; F315-F321 HydrophobicContact CD1-CD1 3.79Å; F315-F321 HydrophobicContact CD1-CD2 4.44Å; F315-F321 HydrophobicContact CD1-CE1 4.19Å; F315-F321 AromaticContact CD1-CG 3.93Å; F315-F321 HydrophobicContact CD1-CG 3.93Å; F315-F321 HydrophobicContact CE1-CB 4.32Å; F315-F321 AromaticContact CE1-CD1 3.99Å; F315-F321 HydrophobicContact CE1-CD1 3.99Å; F315-F321 AromaticContact CE1-CD2 3.84Å; F315-F321 HydrophobicContact CE1-CD2 3.84Å; F315-F321 HydrophobicContact CE1-CE1 4.24Å; F315-F321 HydrophobicContact CE1-CE2 4.11Å; F315-F321 AromaticContact CE1-CG 3.78Å; F315-F321 HydrophobicContact CE1-CG 3.78Å; F315-F321 HydrophobicContact CE1-CZ 4.3Å; F315-V336 HydrophobicContact CE1-CG1 4.19Å; F315-V336 HydrophobicContact CE1-CG2 4.08Å; F315-V336 HydrophobicContact CZ-CG2 3.77Å | ||
| 316 | V | 98.1 | Very high | 98 | Very high | 69 Ų | 69 | 64.2 Ų | 64.2 | 42% | 0.418 | 33% | 0.332 | S | S | . | . | trans | -127.1 | 128.5 | 176.2 | -179.7 | 0 | 0 | 0 | 0 | 108.3 | G318 R319 | V316-G318 PolarHBondContact O-N 2.84Å; V316-R319 HydrophobicContact CB-CB 3.93Å; V316-R319 HydrophobicContact CG1-CB 4.24Å; V316-R319 WeakPolarHBondContact O-CB 3.14Å; V316-R319 PolarHBondContact O-N 3.38Å; V316-R319 VanDerWaalsContact O-N 3.09Å | ||
| 317 | Q | 98.2 | Very high | 98.1 | Very high | 80 Ų | 80 | 59.4 Ų | 59.4 | 37% | 0.374 | 30% | 0.301 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | 135.8 | 177.1 | -62.5 | 177.8 | -3.3 | 0 | 0 | 110.7 | A268 F289 R319 | A268-Q317 HydrophobicContact CB-CG 4.35Å; A268-Q317 PolarHBondContact O-NE2 2.9Å; F289-Q317 HydrophobicContact CD1-CG 3.61Å; F289-Q317 HydrophobicContact CE1-CG 3.74Å; F289-Q317 HydrophobicContact CG-CG 4.22Å; F289-Q317 HydrophobicContact CZ-CG 4.44Å; Q317-R319 PolarHBondContact O-N 2.81Å |
| 318 | G | 97.6 | Very high | 98 | Very high | 36 Ų | 36 | 57.6 Ų | 57.6 | 37% | 0.371 | 29% | 0.293 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72.1 | 9 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | P264 V316 | P264-G318 PolarHBondContact O-N 3.45Å; V316-G318 PolarHBondContact O-N 2.84Å |
| 319 | R | 98.1 | Very high | 98 | Very high | 118 Ų | 118 | 62.9 Ų | 62.9 | 45% | 0.445 | 32% | 0.317 | S | S | . | . | trans | -115.5 | 132 | 175.5 | -162.6 | -179.8 | 75.7 | -166.7 | -0.2 | 110.5 | P264 P314 V316 Q317 | P264-R319 VanDerWaalsContact CD-O 3.23Å; P264-R319 WeakPolarHBondContact CD-O 3.47Å; P314-R319 PolarHBondContact O-NH2 2.89Å; V316-R319 HydrophobicContact CB-CB 3.93Å; V316-R319 HydrophobicContact CG1-CB 4.24Å; V316-R319 WeakPolarHBondContact O-CB 3.14Å; V316-R319 PolarHBondContact O-N 3.38Å; V316-R319 VanDerWaalsContact O-N 3.09Å; Q317-R319 PolarHBondContact O-N 2.81Å | ||
| 320 | R | 98.1 | Very high | 97.9 | Very high | 141 Ų | 141 | 63 Ų | 63 | 53% | 0.532 | 33% | 0.325 | S | S | . | . | trans | -63.2 | 146.5 | 171.7 | -72.5 | -179.4 | -176.2 | -172.2 | -0.2 | 111.2 | G262 E263 Y366 | G262-R320 CarbonylContact O-C 3.59Å; G262-R320 VanDerWaalsContact O-CA 3.26Å; G262-R320 WeakPolarHBondContact O-CA 3.35Å; E263-R320 HydrophobicContact CB-CG 3.97Å; E263-R320 HydrophobicContact CG-CG 4.31Å; E263-R320 WeakPolarHBondContact OE2-CG 3.33Å; E263-R320 IonicContact OE2-NE 2.67Å; R320-Y366 HydrophobicContact CG-CE2 4Å; R320-Y366 PolarHBondContact NE-OH 3.1Å; R320-Y366 PolarHBondContact NH2-OH 3.5Å; R320-Y366 VanDerWaalsContact NH2-OH 3.08Å | ||
| 321 | F | 98.6 | Very high | 98.1 | Very high | 10 Ų | 10 | 55.9 Ų | 55.9 | 4% | 0.044 | 29% | 0.292 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131 | 153 | 170.1 | 66 | -94.9 | 0 | 0 | 0 | 110.3 | I261 G262 P264 F271 F315 L323 V336 D337 V363 | I261-F321 WeakPolarHBondContact CA-O 3.31Å; G262-F321 VanDerWaalsContact C-CE1 3.45Å; G262-F321 PolarHBondContact N-O 2.76Å; G262-F321 WeakPolarHBondContact O-CD1 3.41Å; G262-F321 PolarHBondContact O-N 2.82Å; P264-F321 HydrophobicContact CG-CD1 4.15Å; P264-F321 HydrophobicContact CG-CE1 3.99Å; F271-F321 HydrophobicContact CE1-CE1 4.3Å; F271-F321 HydrophobicContact CE1-CZ 4.5Å; F271-F321 HydrophobicContact CE2-CE1 4.42Å; F271-F321 AromaticContact CE2-CZ 3.84Å; F271-F321 HydrophobicContact CE2-CZ 3.84Å; F271-F321 AromaticContact CZ-CE1 3.88Å; F271-F321 HydrophobicContact CZ-CE1 3.88Å; F271-F321 HydrophobicContact CZ-CE2 4.46Å; F271-F321 AromaticContact CZ-CZ 3.69Å; F271-F321 HydrophobicContact CZ-CZ 3.69Å; F315-F321 HydrophobicContact CD1-CB 4.31Å; F315-F321 AromaticContact CD1-CD1 3.79Å; F315-F321 HydrophobicContact CD1-CD1 3.79Å; F315-F321 HydrophobicContact CD1-CD2 4.44Å; F315-F321 HydrophobicContact CD1-CE1 4.19Å; F315-F321 AromaticContact CD1-CG 3.93Å; F315-F321 HydrophobicContact CD1-CG 3.93Å; F315-F321 HydrophobicContact CE1-CB 4.32Å; F315-F321 AromaticContact CE1-CD1 3.99Å; F315-F321 HydrophobicContact CE1-CD1 3.99Å; F315-F321 AromaticContact CE1-CD2 3.84Å; F315-F321 HydrophobicContact CE1-CD2 3.84Å; F315-F321 HydrophobicContact CE1-CE1 4.24Å; F315-F321 HydrophobicContact CE1-CE2 4.11Å; F315-F321 AromaticContact CE1-CG 3.78Å; F315-F321 HydrophobicContact CE1-CG 3.78Å; F315-F321 HydrophobicContact CE1-CZ 4.3Å; F321-L323 HydrophobicContact CD2-CB 3.73Å; F321-L323 HydrophobicContact CE2-CB 3.59Å; F321-L323 HydrophobicContact CE2-CD2 4.41Å; F321-V336 HydrophobicContact CB-CG1 4.18Å; F321-D337 WeakPolarHBondContact CA-OD1 3.46Å; F321-V363 HydrophobicContact CE1-CG2 4.14Å; F321-V363 HydrophobicContact CZ-CG2 4.29Å |
| 322 | E | 98.8 | Very high | 98.3 | Very high | 61 Ų | 61 | 53.4 Ų | 53.4 | 29% | 0.285 | 27% | 0.266 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104 | 114.8 | 160.9 | 178.1 | -179.6 | 88 | 0 | 0 | 109.2 | T259 I261 K324 V336 D337 | T259-E322 HydrophobicContact CG2-CG 3.91Å; I261-E322 HydrophobicContact CD1-CB 3.6Å; I261-E322 HydrophobicContact CD1-CG 3.58Å; E322-K324 HydrophobicContact CG-CG 4.38Å; E322-K324 WeakPolarHBondContact OE1-CE 3.24Å; E322-K324 IonicContact OE1-NZ 3.49Å; E322-K324 PolarHBondContact OE1-NZ 3.17Å; E322-K324 IonicContact OE2-NZ 3.3Å; E322-V336 CarbonylContact O-C 3.53Å; E322-V336 VanDerWaalsContact O-CA 3.26Å; E322-V336 WeakPolarHBondContact O-CA 3.43Å; E322-D337 PolarHBondContact N-OD1 3.22Å; E322-D337 PolarHBondContact O-N 2.89Å |
| 323 | L | 98.9 | Very high | 98.3 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 25% | 0.252 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 125.8 | 173.8 | 171.3 | 67.2 | 0 | 0 | 0 | 109 | T259 V260 V273 F285 F321 I325 V334 V336 | T259-L323 CarbonylContact C-O 3.46Å; T259-L323 WeakPolarHBondContact CA-O 3.17Å; V260-L323 HydrophobicContact CB-CB 4.23Å; V260-L323 HydrophobicContact CB-CD2 4.43Å; V260-L323 PolarHBondContact N-O 2.69Å; V260-L323 PolarHBondContact O-N 3.36Å; V273-L323 HydrophobicContact CG2-CD2 3.94Å; F285-L323 HydrophobicContact CD1-CD2 4.27Å; F285-L323 HydrophobicContact CE1-CD1 4.22Å; F285-L323 HydrophobicContact CE1-CD2 4.04Å; F285-L323 HydrophobicContact CZ-CD1 4.12Å; F321-L323 HydrophobicContact CD2-CB 3.73Å; F321-L323 HydrophobicContact CE2-CB 3.59Å; F321-L323 HydrophobicContact CE2-CD2 4.41Å; L323-I325 HydrophobicContact CD1-CG1 4.24Å; L323-I325 HydrophobicContact CD2-CD1 4.19Å; L323-I325 HydrophobicContact CD2-CG1 4.49Å; L323-I325 HydrophobicContact CG-CD1 4.38Å; L323-I325 HydrophobicContact CG-CG1 4.14Å; L323-V334 HydrophobicContact CD1-CG1 3.46Å; L323-V334 VanDerWaalsContact CD1-CG1 3.46Å; L323-V336 HydrophobicContact CD1-CG2 3.83Å |
| 324 | K | 98.9 | Very high | 98.4 | Very high | 67 Ų | 67 | 50.4 Ų | 50.4 | 29% | 0.291 | 24% | 0.244 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.2 | 126.6 | 175.6 | -83.2 | 171.7 | 172.6 | 154.8 | 0 | 109.4 | L257 V258 T259 E322 V334 A335 | L257-K324 HydrophobicContact CD1-CB 3.95Å; L257-K324 HydrophobicContact CD1-CG 4.11Å; V258-K324 WeakPolarHBondContact O-CA 3.42Å; T259-K324 HydrophobicContact CG2-CG 4.22Å; E322-K324 HydrophobicContact CG-CG 4.38Å; E322-K324 WeakPolarHBondContact OE1-CE 3.24Å; E322-K324 IonicContact OE1-NZ 3.49Å; E322-K324 PolarHBondContact OE1-NZ 3.17Å; E322-K324 IonicContact OE2-NZ 3.3Å; K324-V334 CarbonylContact O-C 3.31Å; K324-V334 WeakPolarHBondContact O-CA 3.3Å; K324-A335 HydrophobicContact CB-CB 4.35Å; K324-A335 PolarHBondContact N-O 2.89Å; K324-A335 PolarHBondContact O-N 2.84Å |
| 325 | I | 98.9 | Very high | 98.4 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -121.7 | 108.6 | 176.1 | -53.9 | 177.7 | 0 | 0 | 0 | 107.3 | V258 V273 F275 F283 L323 F332 K333 V334 | V258-I325 PolarHBondContact N-O 3.36Å; V258-I325 PolarHBondContact O-N 3.48Å; V273-I325 HydrophobicContact CG1-CD1 4.1Å; F275-I325 HydrophobicContact CE2-CD1 3.81Å; F275-I325 HydrophobicContact CE2-CG2 3.94Å; F275-I325 HydrophobicContact CZ-CB 4.37Å; F275-I325 HydrophobicContact CZ-CD1 4.33Å; F275-I325 HydrophobicContact CZ-CG2 3.88Å; F283-I325 HydrophobicContact CE1-CD1 4.3Å; F283-I325 HydrophobicContact CE1-CG2 4.09Å; L323-I325 HydrophobicContact CD1-CG1 4.24Å; L323-I325 HydrophobicContact CD2-CD1 4.19Å; L323-I325 HydrophobicContact CD2-CG1 4.49Å; L323-I325 HydrophobicContact CG-CD1 4.38Å; L323-I325 HydrophobicContact CG-CG1 4.14Å; I325-F332 HydrophobicContact CG2-CB 4.3Å; I325-F332 HydrophobicContact CG2-CD1 3.86Å; I325-K333 WeakPolarHBondContact CA-O 3.16Å; I325-V334 HydrophobicContact CG1-CG2 4.31Å; I325-V334 HydrophobicContact CG2-CG2 4.42Å |
| 326 | L | 98.8 | Very high | 98.4 | Very high | 36 Ų | 36 | 49.6 Ų | 49.6 | 19% | 0.188 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -94.7 | 129.1 | 175.5 | 175.5 | 62.9 | 0 | 0 | 0 | 109.1 | L257 E328 F332 K333 I373 | L257-L326 HydrophobicContact CB-CD1 4.45Å; L257-L326 HydrophobicContact CD1-CB 4.27Å; L326-E328 HydrophobicContact CD2-CG 4.18Å; L326-E328 HydrophobicContact CG-CG 4.18Å; L326-F332 CarbonylContact O-C 3.51Å; L326-F332 WeakPolarHBondContact O-CA 3.47Å; L326-K333 HydrophobicContact CB-CB 4.33Å; L326-K333 PolarHBondContact N-O 3.1Å; L326-K333 PolarHBondContact O-N 3.04Å; L326-I373 HydrophobicContact CD1-CD1 3.7Å; L326-I373 HydrophobicContact CD1-CG1 4.16Å; L326-I373 HydrophobicContact CD2-CD1 4.41Å |
| 327 | V | 98.7 | Very high | 98.4 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -87.7 | 121 | 170.9 | -175.9 | 0 | 0 | 0 | 0 | 108.3 | I252 P254 R255 L256 F332 L351 | I252-V327 HydrophobicContact CB-CG2 4.23Å; I252-V327 HydrophobicContact CD1-CG1 4.24Å; I252-V327 HydrophobicContact CD1-CG2 4.13Å; I252-V327 HydrophobicContact CG1-CG1 4.26Å; I252-V327 HydrophobicContact CG1-CG2 4.5Å; P254-V327 CarbonylContact C-O 3.55Å; P254-V327 WeakPolarHBondContact CA-O 3.44Å; R255-V327 PolarHBondContact N-O 3.02Å; L256-V327 HydrophobicContact CB-CB 4.2Å; L256-V327 HydrophobicContact CB-CG2 4.12Å; L256-V327 HydrophobicContact CD2-CG2 4.3Å; L256-V327 PolarHBondContact O-N 3.15Å; V327-F332 HydrophobicContact CG2-CD1 4.07Å; V327-F332 HydrophobicContact CG2-CE1 3.96Å; V327-L351 HydrophobicContact CG1-CD1 4.42Å |
| 328 | E | 98.4 | Very high | 98.3 | Very high | 53 Ų | 53 | 49 Ų | 49 | 25% | 0.248 | 25% | 0.253 | C | S | . | . | trans | -108.2 | 179.6 | 168.5 | -65.5 | -163.2 | 169.9 | 0 | 0 | 110.4 | L326 D330 M331 K333 H346 | L326-E328 HydrophobicContact CD2-CG 4.18Å; L326-E328 HydrophobicContact CG-CG 4.18Å; E328-D330 VanDerWaalsContact C-N 3.31Å; E328-D330 PolarHBondContact O-N 2.95Å; E328-M331 WeakPolarHBondContact CA-O 3.32Å; E328-M331 HydrophobicContact CB-CG 4.26Å; E328-M331 PolarHBondContact N-O 2.85Å; E328-K333 HydrophobicContact CG-CD 4.44Å; E328-K333 HydrophobicContact CG-CG 4.46Å; E328-K333 WeakPolarHBondContact OE1-CD 3.17Å; E328-K333 WeakPolarHBondContact OE1-CE 3.35Å; E328-K333 IonicContact OE1-NZ 2.8Å; E328-K333 PolarHBondContact OE1-NZ 3.45Å; E328-K333 WeakPolarHBondContact OE2-CE 3.45Å; E328-K333 IonicContact OE2-NZ 2.71Å; E328-K333 PolarHBondContact OE2-NZ 2.97Å; E328-H346 PolarHBondContact O-NE2 2.93Å | ||
| 329 | E | 96.9 | Very high | 98.3 | Very high | 166 Ų | 166 | 52.1 Ų | 52.1 | 78% | 0.776 | 27% | 0.265 | S | S | * | . | S | Bend | trans | -63.2 | -37 | -175.6 | -65.8 | -172.7 | 174.1 | 0 | 0 | 112.9 | P254 H346 | P254-E329 HydrophobicContact CB-CG 4.12Å; P254-E329 HydrophobicContact CG-CG 3.86Å; E329-H346 PolarHBondContact O-CD2 2.78Å |
| 330 | D | 97.6 | Very high | 98.4 | Very high | 93 Ų | 93 | 51.7 Ų | 51.7 | 50% | 0.497 | 27% | 0.268 | S | S | . | . | S | Bend | trans | -117.2 | -13.8 | -172.3 | 59 | -17.5 | 0 | 0 | 0 | 113.8 | E328 H346 | E328-D330 VanDerWaalsContact C-N 3.31Å; E328-D330 PolarHBondContact O-N 2.95Å; D330-H346 PolarHBondContact O-CD2 2.67Å; D330-H346 PolarHBondContact O-N 2.72Å |
| 331 | M | 98.5 | Very high | 98.4 | Very high | 23 Ų | 23 | 45.8 Ų | 45.8 | 11% | 0.113 | 25% | 0.247 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -151.9 | 170.5 | -175.9 | 67.1 | -178 | 75.7 | 0 | 0 | 114.9 | E328 K333 E343 Y344 H346 | E328-M331 WeakPolarHBondContact CA-O 3.32Å; E328-M331 HydrophobicContact CB-CG 4.26Å; E328-M331 PolarHBondContact N-O 2.85Å; M331-K333 HydrophobicContact CG-CG 4.22Å; M331-K333 HydrophobicContact SD-CG 4.06Å; M331-E343 HydrophobicContact SD-CB 3.81Å; M331-E343 VanDerWaalsContact SD-CD 3.57Å; M331-E343 HydrophobicContact SD-CG 3.97Å; M331-Y344 CarbonylContact C-O 3.54Å; M331-Y344 VanDerWaalsContact CA-O 3.27Å; M331-Y344 WeakPolarHBondContact CA-O 3.42Å; M331-Y344 WeakPolarHBondContact CB-O 3.43Å; M331-H346 VanDerWaalsContact C-CE1 3.41Å; M331-H346 PolarHBondContact N-CD2 3.16Å; M331-H346 VanDerWaalsContact N-CD2 3.26Å; M331-H346 PolarHBondContact N-NE2 3.3Å; M331-H346 PolarHBondContact O-CE1 2.97Å; M331-H346 PolarHBondContact O-NE2 2.78Å |
| 332 | F | 98.8 | Very high | 98.4 | Very high | 2 Ų | 2 | 45.9 Ų | 45.9 | 1% | 0.009 | 25% | 0.247 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -95.8 | 132.1 | 158.7 | -60.9 | -91.8 | 0 | 0 | 0 | 109.8 | I252 F275 F283 I325 L326 V327 E343 Y344 H346 | I252-F332 HydrophobicContact CD1-CE1 3.62Å; I252-F332 HydrophobicContact CD1-CZ 3.62Å; F275-F332 HydrophobicContact CD1-CE1 4.17Å; F275-F332 HydrophobicContact CD2-CE1 4.31Å; F275-F332 HydrophobicContact CE1-CE1 4.14Å; F275-F332 HydrophobicContact CE2-CE1 4.28Å; F275-F332 HydrophobicContact CG-CE1 4.24Å; F275-F332 HydrophobicContact CG-CZ 4.48Å; F275-F332 HydrophobicContact CZ-CE1 4.18Å; F283-F332 HydrophobicContact CB-CD2 4.01Å; F283-F332 HydrophobicContact CB-CE2 3.6Å; F283-F332 HydrophobicContact CB-CZ 3.88Å; F283-F332 HydrophobicContact CD1-CB 4.16Å; F283-F332 AromaticContact CD1-CD1 3.82Å; F283-F332 HydrophobicContact CD1-CD1 3.82Å; F283-F332 AromaticContact CD1-CD2 3.89Å; F283-F332 HydrophobicContact CD1-CD2 3.89Å; F283-F332 HydrophobicContact CD1-CE1 4.11Å; F283-F332 HydrophobicContact CD1-CE2 4.18Å; F283-F332 AromaticContact CD1-CG 3.69Å; F283-F332 HydrophobicContact CD1-CG 3.69Å; F283-F332 HydrophobicContact CD1-CZ 4.28Å; F283-F332 HydrophobicContact CE1-CB 4.01Å; F283-F332 HydrophobicContact CE1-CD1 4.3Å; F283-F332 HydrophobicContact CE1-CG 4.05Å; F283-F332 AromaticContact CG-CD2 3.96Å; F283-F332 HydrophobicContact CG-CD2 3.96Å; F283-F332 HydrophobicContact CG-CE2 4.06Å; F283-F332 HydrophobicContact CG-CG 4.24Å; F283-F332 HydrophobicContact CG-CZ 4.45Å; I325-F332 HydrophobicContact CG2-CB 4.3Å; I325-F332 HydrophobicContact CG2-CD1 3.86Å; L326-F332 CarbonylContact O-C 3.51Å; L326-F332 WeakPolarHBondContact O-CA 3.47Å; V327-F332 HydrophobicContact CG2-CD1 4.07Å; V327-F332 HydrophobicContact CG2-CE1 3.96Å; F332-E343 CarbonylContact O-C 3.56Å; F332-E343 VanDerWaalsContact O-CA 3.31Å; F332-E343 WeakPolarHBondContact O-CA 3.49Å; F332-Y344 HydrophobicContact CD2-CD1 4.03Å; F332-Y344 PolarHBondContact N-O 3.09Å; F332-Y344 PolarHBondContact O-N 2.88Å; F332-H346 AromaticContact CD2-CE1 3.48Å; F332-H346 VanDerWaalsContact CD2-CE1 3.48Å; F332-H346 WeakPolarHBondContact CD2-CE1 3.31Å; F332-H346 AromaticContact CD2-ND1 3.45Å; F332-H346 WeakPolarHBondContact CD2-ND1 3.39Å; F332-H346 AromaticContact CE2-CE1 3.33Å; F332-H346 WeakPolarHBondContact CE2-CE1 3.45Å; F332-H346 AromaticContact CE2-ND1 3.09Å; F332-H346 WeakPolarHBondContact CE2-ND1 3.47Å; F332-H346 AromaticContact CZ-CE1 3.72Å; F332-H346 AromaticContact CZ-ND1 3.81Å |
| 333 | K | 98.8 | Very high | 98.4 | Very high | 58 Ų | 58 | 47 Ų | 47 | 25% | 0.252 | 25% | 0.253 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.7 | 130.5 | 167.9 | -65 | -167.3 | 175.9 | 154.1 | 0 | 110.4 | I325 L326 E328 M331 E343 | I325-K333 WeakPolarHBondContact CA-O 3.16Å; L326-K333 HydrophobicContact CB-CB 4.33Å; L326-K333 PolarHBondContact N-O 3.1Å; L326-K333 PolarHBondContact O-N 3.04Å; E328-K333 HydrophobicContact CG-CD 4.44Å; E328-K333 HydrophobicContact CG-CG 4.46Å; E328-K333 WeakPolarHBondContact OE1-CD 3.17Å; E328-K333 WeakPolarHBondContact OE1-CE 3.35Å; E328-K333 IonicContact OE1-NZ 2.8Å; E328-K333 PolarHBondContact OE1-NZ 3.45Å; E328-K333 WeakPolarHBondContact OE2-CE 3.45Å; E328-K333 IonicContact OE2-NZ 2.71Å; E328-K333 PolarHBondContact OE2-NZ 2.97Å; M331-K333 HydrophobicContact CG-CG 4.22Å; M331-K333 HydrophobicContact SD-CG 4.06Å; K333-E343 WeakPolarHBondContact CE-OE1 3.43Å; K333-E343 HydrophobicContact CG-CG 4.16Å |
| 334 | V | 98.9 | Very high | 98.4 | Very high | 1 Ų | 1 | 47.1 Ų | 47.1 | 1% | 0.006 | 25% | 0.253 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.9 | 134 | -176.1 | -176.1 | 0 | 0 | 0 | 0 | 110.3 | F283 F285 L323 K324 I325 L341 L342 | F283-V334 HydrophobicContact CE1-CG2 4.23Å; F283-V334 HydrophobicContact CZ-CG2 4.01Å; F285-V334 HydrophobicContact CE2-CG1 3.92Å; F285-V334 HydrophobicContact CZ-CG1 4.36Å; L323-V334 HydrophobicContact CD1-CG1 3.46Å; L323-V334 VanDerWaalsContact CD1-CG1 3.46Å; K324-V334 CarbonylContact O-C 3.31Å; K324-V334 WeakPolarHBondContact O-CA 3.3Å; I325-V334 HydrophobicContact CG1-CG2 4.31Å; I325-V334 HydrophobicContact CG2-CG2 4.42Å; V334-L341 HydrophobicContact CG1-CD2 4.33Å; V334-L341 WeakPolarHBondContact O-CB 3.29Å; V334-L341 PolarHBondContact O-N 3.46Å; V334-L342 HydrophobicContact CB-CD1 3.82Å; V334-L342 HydrophobicContact CB-CG 4Å; V334-L342 HydrophobicContact CG2-CD1 3.63Å; V334-L342 HydrophobicContact CG2-CG 4.36Å; V334-L342 PolarHBondContact N-O 2.85Å; V334-L342 PolarHBondContact O-N 2.82Å |
| 335 | A | 98.8 | Very high | 98.4 | Very high | 22 Ų | 22 | 50.8 Ų | 50.8 | 18% | 0.182 | 27% | 0.271 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.1 | 146.1 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | K324 T339 | K324-A335 HydrophobicContact CB-CB 4.35Å; K324-A335 PolarHBondContact N-O 2.89Å; K324-A335 PolarHBondContact O-N 2.84Å; A335-T339 CarbonylContact C-O 3.6Å; A335-T339 WeakPolarHBondContact CA-O 3.35Å; A335-T339 VanDerWaalsContact CB-O 3.32Å; A335-T339 WeakPolarHBondContact CB-O 3.18Å |
| 336 | V | 98.8 | Very high | 98.3 | Very high | 5 Ų | 5 | 52.7 Ų | 52.7 | 3% | 0.03 | 28% | 0.28 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 130.8 | 173.5 | 176 | 0 | 0 | 0 | 0 | 109 | P314 F315 F321 E322 L323 G338 T339 L341 | P314-V336 HydrophobicContact CB-CB 4.44Å; P314-V336 HydrophobicContact CB-CG1 4.17Å; P314-V336 HydrophobicContact CG-CB 3.93Å; P314-V336 HydrophobicContact CG-CG1 3.94Å; P314-V336 HydrophobicContact CG-CG2 4.11Å; F315-V336 HydrophobicContact CE1-CG1 4.19Å; F315-V336 HydrophobicContact CE1-CG2 4.08Å; F315-V336 HydrophobicContact CZ-CG2 3.77Å; F321-V336 HydrophobicContact CB-CG1 4.18Å; E322-V336 CarbonylContact O-C 3.53Å; E322-V336 VanDerWaalsContact O-CA 3.26Å; E322-V336 WeakPolarHBondContact O-CA 3.43Å; L323-V336 HydrophobicContact CD1-CG2 3.83Å; V336-G338 PolarHBondContact O-N 2.83Å; V336-T339 PolarHBondContact N-O 3.43Å; V336-T339 PolarHBondContact O-N 2.82Å; V336-L341 HydrophobicContact CB-CD2 4.38Å; V336-L341 HydrophobicContact CG2-CD2 3.61Å |
| 337 | D | 98.2 | Very high | 98.3 | Very high | 76 Ų | 76 | 54.8 Ų | 54.8 | 41% | 0.406 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 50.4 | 42.7 | 179.8 | -60.8 | -30.4 | 0 | 0 | 0 | 112.7 | F321 E322 T339 | F321-D337 WeakPolarHBondContact CA-OD1 3.46Å; E322-D337 PolarHBondContact N-OD1 3.22Å; E322-D337 PolarHBondContact O-N 2.89Å; D337-T339 PolarHBondContact O-N 2.86Å |
| 338 | G | 96.1 | Very high | 98.2 | Very high | 62 Ų | 62 | 57.1 Ų | 57.1 | 64% | 0.639 | 30% | 0.3 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.3 | -0.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | V336 | V336-G338 PolarHBondContact O-N 2.83Š|
| 339 | T | 98.1 | Very high | 98.1 | Very high | 100 Ų | 100 | 57 Ų | 57 | 61% | 0.613 | 31% | 0.313 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -105.7 | 130.6 | 179 | -55.1 | 0 | 0 | 0 | 0 | 110.3 | A335 V336 D337 L341 | A335-T339 CarbonylContact C-O 3.6Å; A335-T339 WeakPolarHBondContact CA-O 3.35Å; A335-T339 VanDerWaalsContact CB-O 3.32Å; A335-T339 WeakPolarHBondContact CB-O 3.18Å; V336-T339 PolarHBondContact N-O 3.43Å; V336-T339 PolarHBondContact O-N 2.82Å; D337-T339 PolarHBondContact O-N 2.86Å; T339-L341 PolarHBondContact O-N 3.34Å |
| 340 | H | 98.4 | Very high | 98 | Very high | 109 Ų | 109 | 50 Ų | 50 | 51% | 0.505 | 29% | 0.285 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -58.7 | 135.9 | 172.6 | 177.7 | 81 | 0 | 0 | 0 | 110.4 | L342 E343 | H340-L342 PolarHBondContact CE1-O 3.46Å; H340-E343 IonicContact CE1-OE1 3.13Å |
| 341 | L | 98.4 | Very high | 97.9 | Very high | 18 Ų | 18 | 46.8 Ų | 46.8 | 9% | 0.094 | 27% | 0.267 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.7 | -53.3 | -172.4 | 178.9 | 59.5 | 0 | 0 | 0 | 112.3 | F285 I294 P312 P314 V334 V336 T339 | F285-L341 HydrophobicContact CE2-CD2 4.44Å; F285-L341 HydrophobicContact CZ-CD2 4.36Å; I294-L341 HydrophobicContact CD1-CD1 4.39Å; I294-L341 HydrophobicContact CD1-CD2 3.61Å; I294-L341 HydrophobicContact CD1-CG 4.3Å; P312-L341 HydrophobicContact CG-CD1 3.62Å; P314-L341 HydrophobicContact CG-CD1 4.01Å; P314-L341 HydrophobicContact CG-CD2 3.94Å; V334-L341 HydrophobicContact CG1-CD2 4.33Å; V334-L341 WeakPolarHBondContact O-CB 3.29Å; V334-L341 PolarHBondContact O-N 3.46Å; V336-L341 HydrophobicContact CB-CD2 4.38Å; V336-L341 HydrophobicContact CG2-CD2 3.61Å; T339-L341 PolarHBondContact O-N 3.34Å |
| 342 | L | 98.6 | Very high | 97.7 | Very high | 11 Ų | 11 | 51.5 Ų | 51.5 | 6% | 0.058 | 29% | 0.289 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -163 | 167.5 | -176 | 60.9 | 85.1 | 0 | 0 | 0 | 112 | F285 I294 R296 V334 H340 | F285-L342 HydrophobicContact CE2-CD2 4.07Å; I294-L342 HydrophobicContact CD1-CD2 4.37Å; I294-L342 HydrophobicContact CG2-CD2 4.15Å; R296-L342 HydrophobicContact CG-CD1 4.19Å; R296-L342 HydrophobicContact CG-CD2 4.25Å; V334-L342 HydrophobicContact CB-CD1 3.82Å; V334-L342 HydrophobicContact CB-CG 4Å; V334-L342 HydrophobicContact CG2-CD1 3.63Å; V334-L342 HydrophobicContact CG2-CG 4.36Å; V334-L342 PolarHBondContact N-O 2.85Å; V334-L342 PolarHBondContact O-N 2.82Å; H340-L342 PolarHBondContact CE1-O 3.46Å |
| 343 | E | 98.6 | Very high | 97.7 | Very high | 86 Ų | 86 | 56.4 Ų | 56.4 | 40% | 0.402 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123 | 149.6 | 172.3 | -57.5 | -175.5 | 159.7 | 0 | 0 | 109.1 | R296 M331 F332 K333 H340 | R296-E343 PolarHBondContact NH2-O 2.88Å; M331-E343 HydrophobicContact SD-CB 3.81Å; M331-E343 VanDerWaalsContact SD-CD 3.57Å; M331-E343 HydrophobicContact SD-CG 3.97Å; F332-E343 CarbonylContact O-C 3.56Å; F332-E343 VanDerWaalsContact O-CA 3.31Å; F332-E343 WeakPolarHBondContact O-CA 3.49Å; K333-E343 WeakPolarHBondContact CE-OE1 3.43Å; K333-E343 HydrophobicContact CG-CG 4.16Å; H340-E343 IonicContact CE1-OE1 3.13Å |
| 344 | Y | 98.8 | Very high | 97.7 | Very high | 1 Ų | 1 | 53.7 Ų | 53.7 | 0% | 0.004 | 30% | 0.301 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.8 | 112.2 | 177.9 | -174.6 | -102.4 | 0 | 0 | 0 | 110.1 | F283 R296 N297 S298 E308 M331 F332 R347 | F283-Y344 HydrophobicContact CB-CD1 4.25Å; F283-Y344 HydrophobicContact CB-CE1 4.27Å; F283-Y344 AromaticContact CD2-CD1 3.3Å; F283-Y344 HydrophobicContact CD2-CD1 3.3Å; F283-Y344 HydrophobicContact CD2-CD2 4.4Å; F283-Y344 AromaticContact CD2-CE1 3.68Å; F283-Y344 HydrophobicContact CD2-CE1 3.68Å; F283-Y344 AromaticContact CD2-CG 3.71Å; F283-Y344 HydrophobicContact CD2-CG 3.71Å; F283-Y344 AromaticContact CE2-CD1 3.8Å; F283-Y344 HydrophobicContact CE2-CD1 3.8Å; F283-Y344 HydrophobicContact CE2-CD2 4.3Å; F283-Y344 HydrophobicContact CE2-CE1 4.48Å; F283-Y344 AromaticContact CE2-CG 3.7Å; F283-Y344 HydrophobicContact CE2-CG 3.7Å; F283-Y344 AromaticContact CG-CD1 3.93Å; F283-Y344 HydrophobicContact CG-CD1 3.93Å; F283-Y344 HydrophobicContact CG-CE1 4.33Å; R296-Y344 HydrophobicContact CB-CD2 3.56Å; R296-Y344 HydrophobicContact CB-CE2 3.74Å; R296-Y344 HydrophobicContact CB-CG 4.37Å; R296-Y344 HydrophobicContact CG-CD2 4.32Å; N297-Y344 WeakPolarHBondContact CA-OH 3.37Å; N297-Y344 PolarHBondContact O-OH 3.06Å; S298-Y344 PolarHBondContact N-OH 2.87Å; S298-Y344 PolarHBondContact OG-OH 2.81Å; E308-Y344 WeakPolarHBondContact OE1-CE2 3.45Å; E308-Y344 VanDerWaalsContact OE2-CD2 3.28Å; E308-Y344 WeakPolarHBondContact OE2-CD2 3.31Å; M331-Y344 CarbonylContact C-O 3.54Å; M331-Y344 VanDerWaalsContact CA-O 3.27Å; M331-Y344 WeakPolarHBondContact CA-O 3.42Å; M331-Y344 WeakPolarHBondContact CB-O 3.43Å; F332-Y344 HydrophobicContact CD2-CD1 4.03Å; F332-Y344 PolarHBondContact N-O 3.09Å; F332-Y344 PolarHBondContact O-N 2.88Å; Y344-R347 VanDerWaalsContact OH-CD 3.31Å; Y344-R347 WeakPolarHBondContact OH-CD 3.22Å; Y344-R347 PolarHBondContact OH-NE 2.98Å |
| 345 | E | 98.7 | Very high | 97.6 | Very high | 145 Ų | 145 | 56.5 Ų | 56.5 | 68% | 0.678 | 32% | 0.318 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -64.9 | 142.5 | -179.1 | -67.1 | -178.6 | -178.2 | 0 | 0 | 112 | R347 | E345-R347 PolarHBondContact O-N 3.26Å; E345-R347 VanDerWaalsContact O-N 3.09Å |
| 346 | H | 98.4 | Very high | 97.6 | Very high | 39 Ų | 39 | 57.1 Ų | 57.1 | 18% | 0.181 | 32% | 0.319 | C | S | . | . | trans | -66.5 | 110.6 | 175.1 | -65.9 | -42.5 | 0 | 0 | 0 | 110.1 | E328 E329 D330 M331 F332 V348 | E328-H346 PolarHBondContact O-NE2 2.93Å; E329-H346 PolarHBondContact O-CD2 2.78Å; D330-H346 PolarHBondContact O-CD2 2.67Å; D330-H346 PolarHBondContact O-N 2.72Å; M331-H346 VanDerWaalsContact C-CE1 3.41Å; M331-H346 PolarHBondContact N-CD2 3.16Å; M331-H346 VanDerWaalsContact N-CD2 3.26Å; M331-H346 PolarHBondContact N-NE2 3.3Å; M331-H346 PolarHBondContact O-CE1 2.97Å; M331-H346 PolarHBondContact O-NE2 2.78Å; F332-H346 AromaticContact CD2-CE1 3.48Å; F332-H346 VanDerWaalsContact CD2-CE1 3.48Å; F332-H346 WeakPolarHBondContact CD2-CE1 3.31Å; F332-H346 AromaticContact CD2-ND1 3.45Å; F332-H346 WeakPolarHBondContact CD2-ND1 3.39Å; F332-H346 AromaticContact CE2-CE1 3.33Å; F332-H346 WeakPolarHBondContact CE2-CE1 3.45Å; F332-H346 AromaticContact CE2-ND1 3.09Å; F332-H346 WeakPolarHBondContact CE2-ND1 3.47Å; F332-H346 AromaticContact CZ-CE1 3.72Å; F332-H346 AromaticContact CZ-ND1 3.81Å; H346-V348 VanDerWaalsContact C-N 3.3Å; H346-V348 PolarHBondContact O-N 2.76Å | ||
| 347 | R | 98.2 | Very high | 97.6 | Very high | 81 Ų | 81 | 56.9 Ų | 56.9 | 31% | 0.306 | 32% | 0.318 | S | S | . | . | S | Bend | trans | -77.9 | -15.1 | 177.2 | -62.6 | -166.6 | 179.5 | 169.9 | 2.7 | 113.9 | N297 S298 P306 E308 Y344 E345 | N297-R347 PolarHBondContact OD1-NH1 2.9Å; S298-R347 WeakPolarHBondContact OG-CD 3.22Å; P306-R347 VanDerWaalsContact O-CZ 3.3Å; P306-R347 PolarHBondContact O-NH1 2.73Å; P306-R347 PolarHBondContact O-NH2 3.23Å; E308-R347 IonicContact OE1-CZ 2.7Å; E308-R347 IonicContact OE1-NE 3.74Å; E308-R347 IonicContact OE1-NH2 3.88Å; E308-R347 PolarHBondContact OE1-NH2 2.79Å; Y344-R347 VanDerWaalsContact OH-CD 3.31Å; Y344-R347 WeakPolarHBondContact OH-CD 3.22Å; Y344-R347 PolarHBondContact OH-NE 2.98Å; E345-R347 PolarHBondContact O-N 3.26Å; E345-R347 VanDerWaalsContact O-N 3.09Å |
| 348 | V | 96.3 | Very high | 97.7 | Very high | 49 Ų | 49 | 57.5 Ų | 57.5 | 30% | 0.297 | 31% | 0.314 | S | S | . | . | S | Bend | trans | -146.2 | 145.7 | -178.9 | 66.5 | 0 | 0 | 0 | 0 | 110.2 | V282 L300 H346 | V282-V348 HydrophobicContact CB-CG1 4.04Å; V282-V348 HydrophobicContact CG1-CG1 3.58Å; L300-V348 HydrophobicContact CD1-CB 4.44Å; L300-V348 HydrophobicContact CD2-CG1 4.2Å; H346-V348 VanDerWaalsContact C-N 3.3Å; H346-V348 PolarHBondContact O-N 2.76Å |
| 349 | G | 95.6 | Very high | 97.8 | Very high | 50 Ų | 50 | 54.6 Ų | 54.6 | 52% | 0.515 | 29% | 0.285 | S | S | . | . | trans | -82.4 | -167.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | K277 | K277-G349 PolarHBondContact NZ-O 2.93Š| ||
| 350 | G | 94.9 | Very high | 97.8 | Very high | 19 Ų | 19 | 51.2 Ų | 51.2 | 20% | 0.196 | 26% | 0.264 | C | S | . | . | trans | 69 | 50 | -176.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | E352 E353 | G350-E352 VanDerWaalsContact C-OE2 3.24Å; G350-E352 VanDerWaalsContact CA-OE2 3.3Å; G350-E352 WeakPolarHBondContact CA-OE2 3.46Å; G350-E352 PolarHBondContact O-N 2.89Å; G350-E353 WeakPolarHBondContact O-CB 3.09Å; G350-E353 PolarHBondContact O-N 3.47Å; G350-E353 VanDerWaalsContact O-N 3.1Å | ||
| 351 | L | 95.1 | Very high | 97.8 | Very high | 25 Ų | 25 | 47.8 Ų | 47.8 | 13% | 0.131 | 26% | 0.258 | C | S | . | . | G | 310 helix | trans | -64.1 | -28.5 | -179.6 | -64.8 | -173.5 | 0 | 0 | 0 | 111.4 | I252 V327 E353 V354 | I252-L351 HydrophobicContact CD1-CD2 4.18Å; I252-L351 HydrophobicContact CG1-CB 3.75Å; I252-L351 HydrophobicContact CG1-CD2 4.35Å; I252-L351 HydrophobicContact CG1-CG 4.45Å; I252-L351 WeakPolarHBondContact CG1-O 3.39Å; I252-L351 PolarHBondContact N-O 3.05Å; I252-L351 CarbonylContact O-C 3.57Å; I252-L351 VanDerWaalsContact O-C 3.31Å; I252-L351 WeakPolarHBondContact O-CB 3.32Å; V327-L351 HydrophobicContact CG1-CD1 4.42Å; L351-E353 PolarHBondContact O-N 3.38Å; L351-E353 VanDerWaalsContact O-N 3.15Å; L351-V354 VanDerWaalsContact O-CB 3.31Å; L351-V354 WeakPolarHBondContact O-CB 3.45Å; L351-V354 WeakPolarHBondContact O-CG2 3.31Å; L351-V354 PolarHBondContact O-N 3.09Å |
| 352 | E | 96.2 | Very high | 97.8 | Very high | 123 Ų | 123 | 50 Ų | 50 | 58% | 0.575 | 27% | 0.269 | S | S | * | . | G | 310 helix | trans | -60.9 | -18.1 | 172.3 | 67.3 | -81.3 | -168.4 | 0 | 0 | 113.7 | G251 G350 | G251-E352 VanDerWaalsContact CA-O 3.22Å; G251-E352 WeakPolarHBondContact CA-O 3.33Å; G350-E352 VanDerWaalsContact C-OE2 3.24Å; G350-E352 VanDerWaalsContact CA-OE2 3.3Å; G350-E352 WeakPolarHBondContact CA-OE2 3.46Å; G350-E352 PolarHBondContact O-N 2.89Å |
| 353 | E | 97.6 | Very high | 97.8 | Very high | 105 Ų | 105 | 50 Ų | 50 | 49% | 0.491 | 27% | 0.27 | S | S | . | . | G | 310 helix | trans | -92.2 | -4.2 | 176.9 | -60.4 | 177.1 | -159.7 | 0 | 0 | 112.8 | K277 G350 L351 T355 | K277-E353 HydrophobicContact CD-CB 4.22Å; K277-E353 WeakPolarHBondContact CE-OE2 3.48Å; K277-E353 HydrophobicContact CG-CB 3.84Å; K277-E353 IonicContact NZ-OE2 3.47Å; K277-E353 PolarHBondContact NZ-OE2 2.84Å; G350-E353 WeakPolarHBondContact O-CB 3.09Å; G350-E353 PolarHBondContact O-N 3.47Å; G350-E353 VanDerWaalsContact O-N 3.1Å; L351-E353 PolarHBondContact O-N 3.38Å; L351-E353 VanDerWaalsContact O-N 3.15Å; E353-T355 PolarHBondContact O-N 2.91Å; E353-T355 VanDerWaalsContact O-N 3.11Å |
| 354 | V | 98.4 | Very high | 97.8 | Very high | 1 Ų | 1 | 48.2 Ų | 48.2 | 1% | 0.006 | 27% | 0.265 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.8 | 91.6 | 177.6 | -176.2 | 0 | 0 | 0 | 0 | 109.6 | G251 I252 F275 L276 K277 V282 L351 | G251-V354 CarbonylContact C-O 3.52Å; G251-V354 VanDerWaalsContact CA-O 3.24Å; G251-V354 WeakPolarHBondContact CA-O 3.38Å; I252-V354 HydrophobicContact CD1-CB 4.05Å; I252-V354 HydrophobicContact CD1-CG1 4.03Å; I252-V354 HydrophobicContact CD1-CG2 4.08Å; I252-V354 HydrophobicContact CG1-CB 3.98Å; I252-V354 HydrophobicContact CG1-CG1 4.4Å; I252-V354 HydrophobicContact CG1-CG2 4.21Å; I252-V354 HydrophobicContact CG2-CB 4.16Å; I252-V354 HydrophobicContact CG2-CG1 4.06Å; F275-V354 HydrophobicContact CB-CG1 3.81Å; F275-V354 HydrophobicContact CD1-CG1 3.93Å; F275-V354 HydrophobicContact CG-CG1 4.38Å; L276-V354 CarbonylContact O-C 3.58Å; L276-V354 VanDerWaalsContact O-CA 3.31Å; L276-V354 WeakPolarHBondContact O-CA 3.17Å; K277-V354 HydrophobicContact CB-CG2 4.21Å; V282-V354 HydrophobicContact CG1-CG2 4.37Å; V282-V354 HydrophobicContact CG2-CG1 4.1Å; V282-V354 HydrophobicContact CG2-CG2 3.73Å; L351-V354 VanDerWaalsContact O-CB 3.31Å; L351-V354 WeakPolarHBondContact O-CB 3.45Å; L351-V354 WeakPolarHBondContact O-CG2 3.31Å; L351-V354 PolarHBondContact O-N 3.09Å |
| 355 | T | 98.1 | Very high | 97.7 | Very high | 60 Ų | 60 | 48.2 Ų | 48.2 | 37% | 0.368 | 27% | 0.265 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.8 | -7.4 | -163.1 | 45.8 | 0 | 0 | 0 | 0 | 114.6 | L248 L276 E353 | L248-T355 PolarHBondContact N-O 2.98Å; L248-T355 WeakPolarHBondContact O-CA 3.37Å; L276-T355 PolarHBondContact O-N 2.68Å; E353-T355 PolarHBondContact O-N 2.91Å; E353-T355 VanDerWaalsContact O-N 3.11Å |
| 356 | V | 98.6 | Very high | 97.7 | Very high | 35 Ų | 35 | 43.9 Ų | 43.9 | 21% | 0.212 | 24% | 0.243 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -139.2 | 135 | 179.5 | -177.6 | 0 | 0 | 0 | 0 | 109.6 | D245 L276 | D245-V356 HydrophobicContact CB-CG1 3.98Å; L276-V356 HydrophobicContact CB-CB 4.28Å; L276-V356 HydrophobicContact CD1-CB 4.03Å; L276-V356 HydrophobicContact CD1-CG1 3.94Å; L276-V356 WeakPolarHBondContact CD1-O 3.48Å; L276-V356 PolarHBondContact N-O 3.27Å |
| 357 | L | 98.8 | Very high | 97.6 | Very high | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 25% | 0.249 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -103.7 | 127.2 | 157.4 | 173 | 148.6 | 0 | 0 | 0 | 108.5 | L246 L248 V258 V273 D274 F275 V359 | L246-L357 HydrophobicContact CB-CB 4.24Å; L246-L357 HydrophobicContact CB-CD2 4.16Å; L246-L357 HydrophobicContact CD2-CD2 4.36Å; L246-L357 PolarHBondContact N-O 2.94Å; L246-L357 PolarHBondContact O-N 3.3Å; L248-L357 HydrophobicContact CD1-CB 4.02Å; V258-L357 HydrophobicContact CB-CD1 4.37Å; V258-L357 HydrophobicContact CG1-CD1 3.79Å; V258-L357 HydrophobicContact CG2-CD1 4.29Å; V273-L357 HydrophobicContact CG1-CD1 3.74Å; V273-L357 HydrophobicContact CG1-CD2 4.06Å; V273-L357 HydrophobicContact CG1-CG 3.86Å; D274-L357 CarbonylContact O-C 3.52Å; D274-L357 VanDerWaalsContact O-CA 3.3Å; D274-L357 WeakPolarHBondContact O-CA 3.49Å; F275-L357 HydrophobicContact CD1-CD1 4.49Å; F275-L357 HydrophobicContact CD2-CD1 4.33Å; F275-L357 HydrophobicContact CE1-CD1 3.91Å; F275-L357 HydrophobicContact CE2-CD1 3.72Å; F275-L357 HydrophobicContact CZ-CD1 3.51Å; L357-V359 HydrophobicContact CD2-CG2 3.79Å |
| 358 | R | 98.8 | Very high | 97.6 | Very high | 88 Ų | 88 | 40.7 Ų | 40.7 | 33% | 0.332 | 24% | 0.238 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.2 | 130.9 | -178.8 | 177.3 | 172.4 | -71.7 | 161.1 | 2.4 | 110.5 | Y244 D245 V273 D274 L276 T360 | Y244-R358 CarbonylContact O-C 3.37Å; Y244-R358 WeakPolarHBondContact O-CA 3.48Å; D245-R358 WeakPolarHBondContact OD1-CB 3.36Å; D245-R358 WeakPolarHBondContact OD1-CD 3.49Å; D245-R358 WeakPolarHBondContact OD1-CG 3.38Å; D245-R358 IonicContact OD1-CZ 2.73Å; D245-R358 IonicContact OD1-NE 3.53Å; D245-R358 PolarHBondContact OD1-NE 3.44Å; D245-R358 IonicContact OD1-NH2 3.59Å; D245-R358 IonicContact OD2-CZ 3.58Å; D245-R358 IonicContact OD2-NE 2.67Å; D245-R358 PolarHBondContact OD2-NE 2.92Å; D245-R358 IonicContact OD2-NH2 3.66Å; D245-R358 PolarHBondContact OD2-NH2 2.86Å; V273-R358 CarbonylContact C-O 3.55Å; V273-R358 WeakPolarHBondContact CA-O 3.21Å; D274-R358 HydrophobicContact CB-CB 4.46Å; D274-R358 PolarHBondContact N-O 3.44Å; D274-R358 PolarHBondContact O-N 3.29Å; L276-R358 HydrophobicContact CD1-CB 3.51Å; R358-T360 HydrophobicContact CG-CG2 3.56Å |
| 359 | V | 98.8 | Very high | 97.6 | Very high | 2 Ų | 2 | 40.7 Ų | 40.7 | 1% | 0.012 | 24% | 0.243 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -108.1 | 124.7 | 172 | -174 | 0 | 0 | 0 | 0 | 108.8 | P243 Y244 Q272 V273 L357 V363 L365 | P243-V359 VanDerWaalsContact CA-O 3.32Å; P243-V359 WeakPolarHBondContact CA-O 3.27Å; Y244-V359 PolarHBondContact N-O 3.37Å; Y244-V359 PolarHBondContact O-N 2.98Å; Q272-V359 WeakPolarHBondContact O-CA 3.31Å; V273-V359 HydrophobicContact CG2-CG2 4.31Å; L357-V359 HydrophobicContact CD2-CG2 3.79Å; V359-V363 HydrophobicContact CG1-CG1 3.93Å; V359-L365 HydrophobicContact CB-CD2 4.29Å; V359-L365 HydrophobicContact CG2-CD2 4.37Å |
| 360 | T | 98.7 | Very high | 97.7 | Very high | 29 Ų | 29 | 40.5 Ų | 40.5 | 18% | 0.178 | 23% | 0.233 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -137.8 | 169.7 | 175.9 | 79.4 | 0 | 0 | 0 | 0 | 112.4 | P243 F271 Q272 R358 | P243-T360 HydrophobicContact CB-CG2 3.71Å; F271-T360 CarbonylContact C-O 3.51Å; F271-T360 WeakPolarHBondContact CA-O 2.82Å; F271-T360 WeakPolarHBondContact CB-O 3.3Å; Q272-T360 VanDerWaalsContact CD-OG1 3.24Å; Q272-T360 WeakPolarHBondContact CG-OG1 3.2Å; Q272-T360 PolarHBondContact N-O 2.87Å; Q272-T360 PolarHBondContact NE2-OG1 2.8Å; Q272-T360 PolarHBondContact O-N 3.26Å; R358-T360 HydrophobicContact CG-CG2 3.56Å |
| 361 | G | 98.3 | Very high | 97.8 | Very high | 37 Ų | 37 | 42 Ų | 42 | 38% | 0.381 | 24% | 0.24 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | 93.6 | -158.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114 | V363 | G361-V363 VanDerWaalsContact C-N 3.28Å; G361-V363 PolarHBondContact O-N 3.44Å |
| 362 | D | 98.3 | Very high | 97.9 | Very high | 63 Ų | 63 | 45.7 Ų | 45.7 | 34% | 0.337 | 26% | 0.258 | S | S | . | . | S | Bend | trans | -83.8 | 61.8 | -164.4 | -59.3 | -34.7 | 0 | 0 | 0 | 112.5 | P264 V265 A268 D269 R270 | P264-D362 WeakPolarHBondContact CA-O 3.35Å; V265-D362 HydrophobicContact CG2-CB 3.82Å; V265-D362 PolarHBondContact N-O 3.27Å; V265-D362 VanDerWaalsContact N-O 3.09Å; A268-D362 HydrophobicContact CB-CB 3.52Å; D269-D362 PolarHBondContact N-OD2 2.71Å; R270-D362 PolarHBondContact N-OD2 2.8Å; R270-D362 WeakPolarHBondContact O-CB 3.28Å; R270-D362 PolarHBondContact O-N 2.86Å |
| 363 | V | 98.4 | Very high | 97.8 | Very high | 11 Ų | 11 | 45.2 Ų | 45.2 | 7% | 0.067 | 26% | 0.258 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.3 | 136 | -176.3 | 65.5 | 0 | 0 | 0 | 0 | 111.6 | V242 F271 F321 V359 G361 | V242-V363 HydrophobicContact CG2-CG1 4.45Å; F271-V363 HydrophobicContact CB-CB 3.95Å; F271-V363 HydrophobicContact CB-CG1 3.91Å; F271-V363 HydrophobicContact CG-CB 4.16Å; F271-V363 HydrophobicContact CG-CG1 4.35Å; F321-V363 HydrophobicContact CE1-CG2 4.14Å; F321-V363 HydrophobicContact CZ-CG2 4.29Å; V359-V363 HydrophobicContact CG1-CG1 3.93Å; G361-V363 VanDerWaalsContact C-N 3.28Å; G361-V363 PolarHBondContact O-N 3.44Å |
| 364 | V | 98.2 | Very high | 97.8 | Very high | 49 Ų | 49 | 42.3 Ų | 42.3 | 30% | 0.297 | 25% | 0.247 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -83.2 | 119.7 | 163.3 | 179.8 | 0 | 0 | 0 | 0 | 107.5 | T239 G262 E263 V265 Y366 | T239-V364 HydrophobicContact CG2-CG1 3.58Å; G262-V364 CarbonylContact C-O 3.44Å; G262-V364 VanDerWaalsContact CA-O 3.27Å; G262-V364 WeakPolarHBondContact CA-O 3.27Å; E263-V364 HydrophobicContact CB-CB 4.48Å; E263-V364 PolarHBondContact N-O 2.81Å; E263-V364 PolarHBondContact O-N 3.47Å; V265-V364 HydrophobicContact CG1-CG2 3.85Å; V364-Y366 HydrophobicContact CB-CE2 4.4Å; V364-Y366 HydrophobicContact CG1-CE1 4.27Å; V364-Y366 HydrophobicContact CG1-CE2 4Å |
| 365 | L | 98.3 | Very high | 97.8 | Very high | 1 Ų | 1 | 44.4 Ų | 44.4 | 1% | 0.005 | 26% | 0.26 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.7 | 130.7 | 179.3 | -174.3 | 63.8 | 0 | 0 | 0 | 109.9 | T239 L240 V242 Y244 V260 V359 | T239-L365 CarbonylContact C-O 3.48Å; T239-L365 VanDerWaalsContact CA-O 3.24Å; T239-L365 WeakPolarHBondContact CA-O 3.33Å; T239-L365 WeakPolarHBondContact CB-O 3.24Å; L240-L365 HydrophobicContact CB-CB 4.13Å; L240-L365 HydrophobicContact CB-CD2 3.76Å; L240-L365 HydrophobicContact CB-CG 3.89Å; L240-L365 HydrophobicContact CD1-CD2 3.87Å; L240-L365 HydrophobicContact CD1-CG 4.02Å; L240-L365 HydrophobicContact CG-CD2 4.44Å; L240-L365 HydrophobicContact CG-CG 4.42Å; L240-L365 PolarHBondContact N-O 3.18Å; V242-L365 HydrophobicContact CG2-CB 3.7Å; V242-L365 HydrophobicContact CG2-CD2 4.48Å; Y244-L365 VanDerWaalsContact CB-CD2 3.41Å; Y244-L365 HydrophobicContact CD1-CD2 3.6Å; Y244-L365 HydrophobicContact CD2-CD2 4.32Å; Y244-L365 HydrophobicContact CE1-CD2 4.46Å; Y244-L365 HydrophobicContact CG-CD2 3.51Å; V260-L365 HydrophobicContact CG1-CD1 3.61Å; V359-L365 HydrophobicContact CB-CD2 4.29Å; V359-L365 HydrophobicContact CG2-CD2 4.37Å |
| 366 | Y | 97.6 | Very high | 97.7 | Very high | 54 Ų | 54 | 43.6 Ų | 43.6 | 21% | 0.212 | 25% | 0.254 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.7 | -38.8 | 177.9 | -66.5 | -81.7 | 0 | 0 | 0 | 112.1 | T239 I261 E263 R320 V364 | T239-Y366 HydrophobicContact CG2-CD1 3.85Å; T239-Y366 HydrophobicContact CG2-CE1 3.73Å; I261-Y366 HydrophobicContact CG2-CD2 4.4Å; I261-Y366 PolarHBondContact O-N 3.27Å; E263-Y366 HydrophobicContact CB-CE2 3.71Å; E263-Y366 PolarHBondContact OE2-OH 3.48Å; R320-Y366 HydrophobicContact CG-CE2 4Å; R320-Y366 PolarHBondContact NE-OH 3.1Å; R320-Y366 PolarHBondContact NH2-OH 3.5Å; R320-Y366 VanDerWaalsContact NH2-OH 3.08Å; V364-Y366 HydrophobicContact CB-CE2 4.4Å; V364-Y366 HydrophobicContact CG1-CE1 4.27Å; V364-Y366 HydrophobicContact CG1-CE2 4Å |
| 367 | S | 97.3 | Very high | 97.7 | Very high | 45 Ų | 45 | 44.1 Ų | 44.1 | 32% | 0.315 | 26% | 0.256 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -155.9 | 152.7 | 173.6 | 65 | 0 | 0 | 0 | 0 | 111.2 | V260 I261 | V260-S367 WeakPolarHBondContact CA-O 3.48Å; I261-S367 WeakPolarHBondContact CB-OG 3.19Å; I261-S367 WeakPolarHBondContact CG1-OG 2.98Å; I261-S367 PolarHBondContact N-O 3.46Å; I261-S367 PolarHBondContact O-N 3.2Å |
| 368 | A | 97.9 | Very high | 97.6 | Very high | 9 Ų | 9 | 46.8 Ų | 46.8 | 7% | 0.074 | 27% | 0.272 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.9 | 116.4 | 168 | 0 | 0 | 0 | 0 | 0 | 107 | Y244 L246 T259 V260 | Y244-A368 HydrophobicContact CD1-CB 4.19Å; Y244-A368 HydrophobicContact CE1-CB 3.86Å; L246-A368 HydrophobicContact CD2-CB 4.41Å; T259-A368 WeakPolarHBondContact O-CA 3.33Å; V260-A368 HydrophobicContact CG2-CB 4.19Å |
| 369 | A | 96.9 | Very high | 97.6 | Very high | 49 Ų | 49 | 44.1 Ų | 44.1 | 41% | 0.405 | 27% | 0.268 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.5 | 133 | -173.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | T259 | T259-A369 PolarHBondContact N-O 3.1Å; T259-A369 PolarHBondContact O-N 3.35Å |
| 370 | P | 97.4 | Very high | 97.5 | Very high | 45 Ų | 45 | 47.1 Ų | 47.1 | 29% | 0.292 | 29% | 0.286 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.6 | 148.4 | 168.6 | 33.2 | -27.5 | 0 | 0 | 0 | 110.6 | L246 L248 L256 L257 | L246-P370 HydrophobicContact CD2-CG 4.48Å; L248-P370 HydrophobicContact CD2-CB 4.25Å; L248-P370 HydrophobicContact CD2-CG 4.47Å; L256-P370 HydrophobicContact CD1-CB 3.95Å; L257-P370 CarbonylContact O-C 3.57Å |
| 371 | S | 96.8 | Very high | 97.4 | Very high | 51 Ų | 51 | 48.5 Ų | 48.5 | 36% | 0.357 | 30% | 0.295 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.9 | 150 | 173 | 57.9 | 0 | 0 | 0 | 0 | 109.7 | L257 | L257-S371 PolarHBondContact N-O 3.46Å; L257-S371 PolarHBondContact O-N 2.81Å; L257-S371 PolarHBondContact O-OG 2.83Å; L257-S371 VanDerWaalsContact O-OG 3.14Å |
| 372 | M | 96.7 | Very high | 97.3 | Very high | 102 Ų | 102 | 49.4 Ų | 49.4 | 50% | 0.502 | 29% | 0.287 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.9 | 133.1 | 170.2 | -67 | -58.6 | -62.3 | 0 | 0 | 108.4 | M253 R255 L256 | M253-M372 HydrophobicContact CG-CE 3.87Å; M253-M372 HydrophobicContact CG-SD 4.21Å; M253-M372 HydrophobicContact SD-CE 4.05Å; M253-M372 HydrophobicContact SD-SD 4.42Å; R255-M372 HydrophobicContact CB-CE 3.98Å; L256-M372 HydrophobicContact CB-SD 4Å; L256-M372 HydrophobicContact CD1-SD 3.88Å |
| 373 | I | 93.8 | Very high | 97.2 | Very high | 114 Ų | 114 | 48.2 Ų | 48.2 | 59% | 0.585 | 28% | 0.283 | S | S | * | . | trans | -110.6 | 0 | 176.6 | 60.8 | 170.1 | 0 | 0 | 0 | 112.4 | R255 L257 L326 | R255-I373 HydrophobicContact CB-CG1 4.43Å; R255-I373 WeakPolarHBondContact CB-O 3.39Å; R255-I373 PolarHBondContact NE-O 3.4Å; R255-I373 PolarHBondContact NH2-O 3.46Å; R255-I373 PolarHBondContact NH2-OXT 3.38Å; R255-I373 WeakPolarHBondContact O-CG1 3.32Å; R255-I373 PolarHBondContact O-N 3.22Å; R255-I373 VanDerWaalsContact O-N 3.09Å; L257-I373 HydrophobicContact CB-CG2 4.15Å; L257-I373 HydrophobicContact CD2-CG2 3.96Å; L326-I373 HydrophobicContact CD1-CD1 3.7Å; L326-I373 HydrophobicContact CD1-CG1 4.16Å; L326-I373 HydrophobicContact CD2-CD1 4.41Å |
Retrieved 373 of 373 residues in 200.8 ms
(Link to these results)