| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.2 | Very low | 43.8 | Very low | 250 Ų | 250 | 156.2 Ų | 156.2 | 100% | 1.232 | 87% | 0.866 | S | S | * | * | 0 | 120.3 | 0 | -71.6 | 177.1 | 170.8 | 0 | 0 | 106.6 | |||||
| 2 | A | 48.4 | Very low | 44.1 | Very low | 102 Ų | 102 | 160.7 Ų | 160.7 | 84% | 0.843 | 86% | 0.86 | S | S | * | * | cis | -151.7 | 153.3 | 1.2 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 3 | E | 44.7 | Very low | 44.3 | Very low | 183 Ų | 183 | 159.8 Ų | 159.8 | 86% | 0.855 | 85% | 0.848 | S | S | * | * | trans | -66.3 | 150.7 | -170.7 | -73.1 | 153.8 | 134.4 | 0 | 0 | 113.8 | ||||
| 4 | G | 47.6 | Very low | 44.7 | Very low | 71 Ų | 71 | 164.8 Ų | 164.8 | 73% | 0.732 | 85% | 0.849 | S | S | * | * | trans | -93.1 | 123.6 | 166.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 5 | D | 46.4 | Very low | 44.8 | Very low | 131 Ų | 131 | 164.9 Ų | 164.9 | 70% | 0.701 | 84% | 0.841 | S | S | * | * | trans | -101.7 | 103.2 | 171.4 | -73.3 | -39.9 | 0 | 0 | 0 | 110.3 | Y7 | D5-Y7 HydrophobicContact CB-CE1 4.46Š| ||
| 6 | F | 36.2 | Very low | 45.1 | Very low | 206 Ų | 206 | 162.1 Ų | 162.1 | 90% | 0.904 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 124.6 | 158.7 | -92.3 | -105 | 0 | 0 | 0 | 109.2 | ||
| 7 | Y | 41.8 | Very low | 45.5 | Very low | 208 Ų | 208 | 167.2 Ų | 167.2 | 82% | 0.816 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 132.6 | 158.1 | -22 | -72.8 | 0 | 0 | 0 | 109.2 | D5 | D5-Y7 HydrophobicContact CB-CE1 4.46Š|
| 8 | T | 47.2 | Very low | 45.9 | Very low | 139 Ų | 139 | 163.9 Ų | 163.9 | 85% | 0.853 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 137.2 | -176.7 | 40.2 | 0 | 0 | 0 | 0 | 112.1 | G10 | T8-G10 PolarHBondContact O-N 3.1Å; T8-G10 VanDerWaalsContact O-N 3.1Å |
| 9 | M | 43.6 | Very low | 46.4 | Very low | 194 Ų | 194 | 161.2 Ų | 161.2 | 96% | 0.956 | 82% | 0.823 | S | S | * | * | trans | -61.2 | 109.7 | 168.3 | -68 | -165.2 | -147.6 | 0 | 0 | 109.8 | N11 | M9-N11 PolarHBondContact O-N 3.48Š| ||
| 10 | G | 41.2 | Very low | 46.9 | Very low | 78 Ų | 78 | 162.8 Ų | 162.8 | 80% | 0.804 | 82% | 0.824 | S | S | * | * | trans | -75.8 | 115.4 | 166 | 0 | 0 | 0 | 0 | 0 | 110.6 | T8 | T8-G10 PolarHBondContact O-N 3.1Å; T8-G10 VanDerWaalsContact O-N 3.1Å | ||
| 11 | N | 46.8 | Very low | 46.9 | Very low | 156 Ų | 156 | 157.3 Ų | 157.3 | 83% | 0.834 | 81% | 0.809 | S | S | * | * | trans | -57.2 | 133.8 | -176.6 | -161 | 17.1 | 0 | 0 | 0 | 113 | M9 | M9-N11 PolarHBondContact O-N 3.48Š| ||
| 12 | R | 47.5 | Very low | 47.6 | Very low | 210 Ų | 210 | 154.7 Ų | 154.7 | 79% | 0.792 | 79% | 0.793 | S | S | * | * | trans | -59.4 | 131.5 | 171.6 | -84.7 | 177.7 | 170.6 | -176.9 | -2.1 | 110.8 | ||||
| 13 | Q | 46.4 | Very low | 47.7 | Very low | 150 Ų | 150 | 154.6 Ų | 154.6 | 70% | 0.701 | 79% | 0.787 | S | S | * | * | trans | -137.6 | 89.1 | 136.4 | -75.8 | -61.3 | -61.3 | 0 | 0 | 108.1 | F15 | Q13-F15 HydrophobicContact CB-CE2 4.22Å; Q13-F15 HydrophobicContact CB-CZ 4.26Å; Q13-F15 PolarHBondContact O-N 2.78Å | ||
| 14 | R | 49.4 | Very low | 48.2 | Very low | 229 Ų | 229 | 151.4 Ų | 151.4 | 86% | 0.864 | 78% | 0.782 | S | S | * | * | trans | -77.8 | 98.7 | 166.9 | -72.1 | -84.3 | -175.1 | -176.8 | -1.5 | 105.9 | ||||
| 15 | F | 47 | Very low | 48.4 | Very low | 166 Ų | 166 | 157.2 Ų | 157.2 | 73% | 0.728 | 79% | 0.787 | S | S | * | * | trans | -65.7 | 130.9 | 168.6 | -62.7 | -78.6 | 0 | 0 | 0 | 108.7 | Q13 R17 | Q13-F15 HydrophobicContact CB-CE2 4.22Å; Q13-F15 HydrophobicContact CB-CZ 4.26Å; Q13-F15 PolarHBondContact O-N 2.78Å; F15-R17 PolarHBondContact O-N 2.81Å; F15-R17 VanDerWaalsContact O-N 3.16Å | ||
| 16 | P | 49.9 | Very low | 48.8 | Very low | 121 Ų | 121 | 161.7 Ų | 161.7 | 79% | 0.786 | 79% | 0.794 | S | S | * | * | trans | -61.2 | 119.4 | 167.1 | 25.1 | -29.5 | 0 | 0 | 0 | 107.5 | D18 | P16-D18 VanDerWaalsContact C-N 3.33Å; P16-D18 PolarHBondContact O-N 3.13Å | ||
| 17 | R | 50.3 | Low | 49.7 | Very low | 249 Ų | 249 | 159.3 Ų | 159.3 | 94% | 0.94 | 79% | 0.791 | S | S | * | * | trans | -70.1 | 97.3 | 168.2 | -81.9 | -173 | 173.9 | 175.5 | -2.1 | 106.9 | F15 P19 | F15-R17 PolarHBondContact O-N 2.81Å; F15-R17 VanDerWaalsContact O-N 3.16Å; R17-P19 WeakPolarHBondContact O-CD 3.45Å | ||
| 18 | D | 52.7 | Low | 50.2 | Low | 108 Ų | 108 | 158 Ų | 158 | 58% | 0.578 | 79% | 0.793 | S | S | * | * | trans | -73.9 | 121.3 | 168.2 | -163.7 | -22.8 | 0 | 0 | 0 | 108.3 | P16 F20 | P16-D18 VanDerWaalsContact C-N 3.33Å; P16-D18 PolarHBondContact O-N 3.13Å; D18-F20 PolarHBondContact O-N 3.06Å; D18-F20 PolarHBondContact OD1-N 3.32Å; D18-F20 VanDerWaalsContact OD1-N 3.15Å | ||
| 19 | P | 57.1 | Low | 50.3 | Low | 112 Ų | 112 | 155.6 Ų | 155.6 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72 | -0.5 | 178 | 27.5 | -31.3 | 0 | 0 | 0 | 113.7 | R17 | R17-P19 WeakPolarHBondContact O-CD 3.45Š|
| 20 | F | 55.6 | Low | 50.8 | Low | 192 Ų | 192 | 152.6 Ų | 152.6 | 84% | 0.842 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129.1 | 15.5 | 178.3 | -68.1 | -80.5 | 0 | 0 | 0 | 114.7 | D18 | D18-F20 PolarHBondContact O-N 3.06Å; D18-F20 PolarHBondContact OD1-N 3.32Å; D18-F20 VanDerWaalsContact OD1-N 3.15Å |
| 21 | G | 47.8 | Very low | 51.4 | Low | 48 Ų | 48 | 157 Ų | 157 | 50% | 0.495 | 77% | 0.773 | S | S | . | * | trans | -105.1 | 114.2 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 22 | E | 52.4 | Low | 51.9 | Low | 195 Ų | 195 | 159.5 Ų | 159.5 | 91% | 0.911 | 77% | 0.771 | S | S | * | * | trans | -59.9 | 144 | 172 | -70.4 | 170.3 | 105.5 | 0 | 0 | 112.4 | ||||
| 23 | S | 49.9 | Very low | 52.1 | Low | 100 Ų | 100 | 155.6 Ų | 155.6 | 70% | 0.699 | 77% | 0.766 | S | S | * | * | trans | -83.5 | 127.9 | 178.7 | -56.8 | 0 | 0 | 0 | 0 | 110.6 | F25 | S23-F25 PolarHBondContact O-N 3.26Š| ||
| 24 | P | 54.3 | Low | 52.3 | Low | 117 Ų | 117 | 155.7 Ų | 155.7 | 76% | 0.76 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | 26.9 | -170.1 | 32 | -36.1 | 0 | 0 | 0 | 115 | ||
| 25 | F | 52.2 | Low | 52.4 | Low | 192 Ų | 192 | 151.7 Ų | 151.7 | 84% | 0.842 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.2 | 20.6 | -172.8 | -88.4 | -77.2 | 0 | 0 | 0 | 115.1 | S23 | S23-F25 PolarHBondContact O-N 3.26Š|
| 26 | R | 54.8 | Low | 52.5 | Low | 225 Ų | 225 | 147.1 Ų | 147.1 | 85% | 0.849 | 75% | 0.754 | S | S | * | * | trans | -105.5 | 2.6 | -177.9 | -123.6 | -174.1 | -173.7 | -169.2 | 2.1 | 117.1 | ||||
| 27 | D | 55.7 | Low | 52.5 | Low | 156 Ų | 156 | 144.8 Ų | 144.8 | 83% | 0.834 | 74% | 0.741 | S | S | * | * | trans | -104.8 | 48.3 | -175.4 | -62.5 | -53.5 | 0 | 0 | 0 | 114.4 | ||||
| 28 | Q | 52.8 | Low | 52.6 | Low | 182 Ų | 182 | 143.8 Ų | 143.8 | 85% | 0.85 | 74% | 0.737 | S | S | * | * | trans | -137.1 | 84.8 | 165.9 | -67.2 | -172.6 | 50.4 | 0 | 0 | 110.1 | ||||
| 29 | S | 48.8 | Very low | 52.5 | Low | 88 Ų | 88 | 147 Ų | 147 | 62% | 0.615 | 75% | 0.747 | S | S | * | * | trans | -141.6 | 98.5 | 165.1 | -70.9 | 0 | 0 | 0 | 0 | 108.6 | F31 | S29-F31 PolarHBondContact O-N 3.23Š| ||
| 30 | P | 54.3 | Low | 52.4 | Low | 130 Ų | 130 | 149.9 Ų | 149.9 | 84% | 0.844 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73 | 14.2 | -169.9 | 30 | -36.1 | 0 | 0 | 0 | 114.9 | ||
| 31 | F | 54.4 | Low | 52.1 | Low | 170 Ų | 170 | 147 Ų | 147 | 75% | 0.746 | 74% | 0.742 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.1 | -1.6 | -174.9 | -125.8 | -86.9 | 0 | 0 | 0 | 114.1 | S29 | S29-F31 PolarHBondContact O-N 3.23Š|
| 32 | R | 55.6 | Low | 52.3 | Low | 210 Ų | 210 | 151.7 Ų | 151.7 | 79% | 0.792 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -85.8 | -21.8 | -176.4 | -160.2 | 173.6 | -177.7 | -171.9 | -1.7 | 113.6 | Q34 | R32-Q34 VanDerWaalsContact C-N 3.33Å; R32-Q34 PolarHBondContact O-N 2.81Å |
| 33 | D | 51.6 | Low | 52 | Low | 128 Ų | 128 | 150.7 Ų | 150.7 | 68% | 0.684 | 75% | 0.75 | S | S | * | * | H | α-helix | trans | -82 | -7.9 | -175.1 | -60 | -54.4 | 0 | 0 | 0 | 114.3 | ||
| 34 | Q | 50.8 | Low | 51.9 | Low | 151 Ų | 151 | 154.7 Ų | 154.7 | 71% | 0.706 | 76% | 0.755 | S | S | * | * | H | α-helix | trans | -93.8 | -9.8 | -176.6 | -131.5 | 173.1 | 5.7 | 0 | 0 | 114.7 | R32 | R32-Q34 VanDerWaalsContact C-N 3.33Å; R32-Q34 PolarHBondContact O-N 2.81Å |
| 35 | L | 52.3 | Low | 51.7 | Low | 145 Ų | 145 | 152.7 Ų | 152.7 | 76% | 0.759 | 76% | 0.756 | S | S | * | * | H | α-helix | trans | -104 | -20.6 | 176.7 | -69.8 | 175.2 | 0 | 0 | 0 | 113.5 | ||
| 36 | A | 50.1 | Low | 51.6 | Low | 70 Ų | 70 | 149.5 Ų | 149.5 | 58% | 0.579 | 75% | 0.745 | S | S | * | * | H | α-helix | trans | -73.9 | -32.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | R38 | A36-R38 PolarHBondContact O-N 2.98Å |
| 37 | S | 48.3 | Very low | 51.3 | Low | 73 Ų | 73 | 143 Ų | 143 | 51% | 0.51 | 73% | 0.733 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -95.2 | 18.6 | -172.9 | -44.7 | 0 | 0 | 0 | 0 | 114.6 | E41 | S37-E41 VanDerWaalsContact O-OE1 3.05Š|
| 38 | R | 52.9 | Low | 51.3 | Low | 228 Ų | 228 | 141.3 Ų | 141.3 | 86% | 0.86 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.1 | 2.1 | 168.6 | -74.1 | -164 | 173 | -130 | -1.9 | 113.9 | A36 | A36-R38 PolarHBondContact O-N 2.98Š|
| 39 | F | 51.4 | Low | 50.8 | Low | 176 Ų | 176 | 140.5 Ų | 140.5 | 77% | 0.772 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -96.1 | -8 | 179.4 | -168 | -104.6 | 0 | 0 | 0 | 112.8 | ||
| 40 | M | 55.1 | Low | 50.9 | Low | 172 Ų | 172 | 141.7 Ų | 141.7 | 85% | 0.847 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -136.1 | 12.7 | -175.4 | -77.7 | -174.1 | 172.7 | 0 | 0 | 115.1 | ||
| 41 | E | 47.9 | Very low | 50.8 | Low | 132 Ų | 132 | 143.2 Ų | 143.2 | 62% | 0.617 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -123.9 | 110.9 | 172.8 | 61.1 | 178.3 | 108.3 | 0 | 0 | 110.9 | S37 | S37-E41 VanDerWaalsContact O-OE1 3.05Š|
| 42 | D | 52.6 | Low | 50.7 | Low | 146 Ų | 146 | 141.9 Ų | 141.9 | 78% | 0.781 | 73% | 0.731 | S | S | * | * | S | Bend | trans | 70.4 | 120 | 155.6 | -82.2 | -80.2 | 0 | 0 | 0 | 122.1 | ||
| 43 | E | 47.1 | Very low | 50.6 | Low | 173 Ų | 173 | 139 Ų | 139 | 81% | 0.808 | 73% | 0.731 | S | S | * | * | trans | 94.2 | 53.8 | 135.1 | -129.8 | 163.9 | 128.5 | 0 | 0 | 119.8 | ||||
| 44 | F | 48.1 | Very low | 50.8 | Low | 184 Ų | 184 | 135.6 Ų | 135.6 | 81% | 0.807 | 73% | 0.726 | S | S | * | * | trans | -128.4 | 81.3 | 145.6 | -147.1 | -94 | 0 | 0 | 0 | 109.5 | M46 | F44-M46 VanDerWaalsContact C-N 3.3Å; F44-M46 HydrophobicContact CE1-CE 4.48Å; F44-M46 PolarHBondContact O-N 2.85Å | ||
| 45 | G | 48.2 | Very low | 50.7 | Low | 75 Ų | 75 | 134.8 Ų | 134.8 | 77% | 0.773 | 72% | 0.723 | S | S | * | * | trans | -61 | 92.1 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 46 | M | 51.5 | Low | 50.9 | Low | 125 Ų | 125 | 135.5 Ų | 135.5 | 62% | 0.616 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 122.7 | 161.3 | -94.7 | -71.2 | -177.3 | 0 | 0 | 106.8 | F44 | F44-M46 VanDerWaalsContact C-N 3.3Å; F44-M46 HydrophobicContact CE1-CE 4.48Å; F44-M46 PolarHBondContact O-N 2.85Å |
| 47 | P | 48.9 | Very low | 51.2 | Low | 90 Ų | 90 | 135.8 Ų | 135.8 | 58% | 0.584 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 148 | 169.4 | 27 | -32.8 | 0 | 0 | 0 | 108 | F49 | P47-F49 PolarHBondContact O-N 2.88Å; P47-F49 VanDerWaalsContact O-N 3.14Å |
| 48 | P | 54.4 | Low | 52.1 | Low | 120 Ų | 120 | 136.3 Ų | 136.3 | 78% | 0.779 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 129.1 | 169.5 | 24.6 | -33.1 | 0 | 0 | 0 | 107.7 | ||
| 49 | F | 42.9 | Very low | 52.3 | Low | 164 Ų | 164 | 128.9 Ų | 128.9 | 72% | 0.719 | 71% | 0.71 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 129.1 | 177.7 | -70.6 | -85.1 | 0 | 0 | 0 | 108.5 | P47 D51 | P47-F49 PolarHBondContact O-N 2.88Å; P47-F49 VanDerWaalsContact O-N 3.14Å; F49-D51 PolarHBondContact O-N 2.85Å |
| 50 | P | 49.8 | Very low | 52.9 | Low | 114 Ų | 114 | 130.4 Ų | 130.4 | 74% | 0.74 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 124.8 | 174.9 | -19.8 | 29.9 | 0 | 0 | 0 | 109.2 | D52 | P50-D52 PolarHBondContact O-N 2.84Š|
| 51 | D | 52.2 | Low | 53 | Low | 162 Ų | 162 | 124.4 Ų | 124.4 | 87% | 0.866 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -67.1 | 24.8 | 178.5 | -89.6 | -67.5 | 0 | 0 | 0 | 114 | F49 | F49-D51 PolarHBondContact O-N 2.85Š|
| 52 | D | 53.2 | Low | 53.8 | Low | 141 Ų | 141 | 126.3 Ų | 126.3 | 75% | 0.754 | 69% | 0.69 | S | S | * | * | trans | -126.2 | 49.8 | -169.2 | -132.7 | -25.8 | 0 | 0 | 0 | 113.6 | P50 | P50-D52 PolarHBondContact O-N 2.84Š| ||
| 53 | L | 52.8 | Low | 53.5 | Low | 151 Ų | 151 | 125 Ų | 125 | 79% | 0.791 | 69% | 0.689 | S | S | * | * | trans | -91.6 | 68.7 | 146.5 | -75 | 175.1 | 0 | 0 | 0 | 108 | M55 | L53-M55 HydrophobicContact CD2-SD 4.42Å; L53-M55 PolarHBondContact O-N 3.16Å | ||
| 54 | G | 55.6 | Low | 53.4 | Low | 55 Ų | 55 | 120.4 Ų | 120.4 | 57% | 0.567 | 69% | 0.689 | S | S | * | * | trans | -63.3 | 68.2 | 158.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 55 | M | 50.4 | Low | 53.2 | Low | 134 Ų | 134 | 121.4 Ų | 121.4 | 66% | 0.66 | 69% | 0.687 | S | S | * | * | trans | -80.9 | 114.7 | 145.2 | -94.5 | 79.7 | -179.2 | 0 | 0 | 105.2 | L53 W57 | L53-M55 HydrophobicContact CD2-SD 4.42Å; L53-M55 PolarHBondContact O-N 3.16Å; M55-W57 PolarHBondContact O-N 3.31Å | ||
| 56 | D | 54.8 | Low | 53.1 | Low | 160 Ų | 160 | 126.4 Ų | 126.4 | 86% | 0.856 | 70% | 0.695 | S | S | * | * | trans | -65.1 | 60.9 | 166 | 15.4 | -78.3 | 0 | 0 | 0 | 109.6 | ||||
| 57 | W | 57.2 | Low | 52.4 | Low | 77 Ų | 77 | 124.7 Ų | 124.7 | 29% | 0.292 | 70% | 0.696 | S | S | . | * | trans | -65.5 | 134.1 | 176 | 62.8 | -89.9 | 0 | 0 | 0 | 107.1 | M55 G59 A61 R62 | M55-W57 PolarHBondContact O-N 3.31Å; W57-G59 VanDerWaalsContact CZ3-C 3.49Å; W57-G59 VanDerWaalsContact CZ3-CA 3.46Å; W57-A61 HydrophobicContact CD2-CB 4.08Å; W57-A61 HydrophobicContact CE3-CB 3.32Å; W57-A61 VanDerWaalsContact CE3-N 3.28Å; W57-A61 HydrophobicContact CZ3-CB 4.15Å; W57-R62 VanDerWaalsContact CE3-N 3.27Å; W57-R62 HydrophobicContact CH2-CB 3.85Å; W57-R62 HydrophobicContact CH2-CG 2.81Å; W57-R62 HydrophobicContact CZ2-CB 4.07Å; W57-R62 HydrophobicContact CZ2-CG 2.94Å; W57-R62 HydrophobicContact CZ3-CB 4.14Å; W57-R62 HydrophobicContact CZ3-CG 3.56Å | ||
| 58 | P | 66 | Low | 51.7 | Low | 84 Ų | 84 | 126.3 Ų | 126.3 | 55% | 0.545 | 70% | 0.704 | S | S | . | * | trans | -68.4 | 142.5 | -172.7 | -16.6 | 28.7 | 0 | 0 | 0 | 111.1 | W60 A61 | P58-W60 VanDerWaalsContact O-CD1 3.28Å; P58-W60 PolarHBondContact O-N 3.17Å; P58-A61 PolarHBondContact O-N 3.41Å | ||
| 59 | G | 57.4 | Low | 51 | Low | 72 Ų | 72 | 132.2 Ų | 132.2 | 74% | 0.742 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -38.2 | -15.6 | -166.7 | 0 | 0 | 0 | 0 | 0 | 120.5 | W57 | W57-G59 VanDerWaalsContact CZ3-C 3.49Å; W57-G59 VanDerWaalsContact CZ3-CA 3.46Å |
| 60 | W | 64.6 | Low | 51.2 | Low | 208 Ų | 208 | 133 Ų | 133 | 79% | 0.788 | 72% | 0.721 | S | S | * | * | G | 310 helix | trans | -81.5 | -14.6 | 175.3 | 68.2 | -88.5 | 0 | 0 | 0 | 115.5 | P58 | P58-W60 VanDerWaalsContact O-CD1 3.28Å; P58-W60 PolarHBondContact O-N 3.17Å |
| 61 | A | 57.7 | Low | 50.8 | Low | 45 Ų | 45 | 130 Ų | 130 | 37% | 0.372 | 71% | 0.711 | S | S | . | * | G | 310 helix | trans | -106.3 | 20.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | W57 P58 P63 | W57-A61 HydrophobicContact CD2-CB 4.08Å; W57-A61 HydrophobicContact CE3-CB 3.32Å; W57-A61 VanDerWaalsContact CE3-N 3.28Å; W57-A61 HydrophobicContact CZ3-CB 4.15Å; P58-A61 PolarHBondContact O-N 3.41Å; A61-P63 WeakPolarHBondContact O-CD 2.97Å |
| 62 | R | 64.4 | Low | 50.3 | Low | 172 Ų | 172 | 128.7 Ų | 128.7 | 65% | 0.649 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 127.5 | 167.2 | -71.8 | -163.1 | 174.9 | -140.1 | -19.3 | 107.3 | W57 G64 | W57-R62 VanDerWaalsContact CE3-N 3.27Å; W57-R62 HydrophobicContact CH2-CB 3.85Å; W57-R62 HydrophobicContact CH2-CG 2.81Å; W57-R62 HydrophobicContact CZ2-CB 4.07Å; W57-R62 HydrophobicContact CZ2-CG 2.94Å; W57-R62 HydrophobicContact CZ3-CB 4.14Å; W57-R62 HydrophobicContact CZ3-CG 3.56Å; R62-G64 PolarHBondContact O-N 2.88Å |
| 63 | P | 45.9 | Very low | 49.6 | Very low | 118 Ų | 118 | 127.3 Ų | 127.3 | 77% | 0.766 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 124 | 150.3 | 9.7 | 3.5 | 0 | 0 | 0 | 107.4 | A61 R65 | A61-P63 WeakPolarHBondContact O-CD 2.97Å; P63-R65 PolarHBondContact O-N 2.85Å |
| 64 | G | 45.3 | Very low | 49.4 | Very low | 77 Ų | 77 | 125.1 Ų | 125.1 | 79% | 0.794 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -49.6 | 118 | -164.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | R62 | R62-G64 PolarHBondContact O-N 2.88Š|
| 65 | R | 43.5 | Very low | 49.2 | Very low | 205 Ų | 205 | 131.9 Ų | 131.9 | 77% | 0.774 | 72% | 0.722 | S | S | * | * | trans | -88.4 | 98.4 | 152.7 | -74.3 | -101.3 | -150 | -87.4 | -0.5 | 107.2 | P63 S67 | P63-R65 PolarHBondContact O-N 2.85Å; R65-S67 PolarHBondContact O-N 3.39Å | ||
| 66 | L | 46.5 | Very low | 48.9 | Very low | 181 Ų | 181 | 129.5 Ų | 129.5 | 95% | 0.948 | 73% | 0.731 | S | S | * | * | trans | -62.8 | 88 | 146 | -75.9 | 161.9 | 0 | 0 | 0 | 106 | T68 | L66-T68 PolarHBondContact O-N 2.79Š| ||
| 67 | S | 35.8 | Very low | 48.1 | Very low | 89 Ų | 89 | 125.7 Ų | 125.7 | 62% | 0.622 | 73% | 0.73 | S | S | * | * | trans | -75.1 | 107.8 | 176.8 | -154.8 | 0 | 0 | 0 | 0 | 108.8 | R65 R69 | R65-S67 PolarHBondContact O-N 3.39Å; S67-R69 PolarHBondContact O-N 2.79Å | ||
| 68 | T | 36.2 | Very low | 47.4 | Very low | 123 Ų | 123 | 125.5 Ų | 125.5 | 76% | 0.755 | 75% | 0.752 | S | S | * | * | trans | 14.9 | 92.3 | 130.4 | 21.6 | 0 | 0 | 0 | 0 | 114.9 | L66 | L66-T68 PolarHBondContact O-N 2.79Š| ||
| 69 | R | 38.3 | Very low | 46.7 | Very low | 244 Ų | 244 | 130.2 Ų | 130.2 | 92% | 0.921 | 77% | 0.772 | S | S | * | * | trans | -100.5 | 123.3 | 137.3 | -74.1 | -168 | -175.2 | -107.5 | 2.1 | 107.2 | S67 G71 | S67-R69 PolarHBondContact O-N 2.79Å; R69-G71 PolarHBondContact O-N 3.29Å | ||
| 70 | L | 46.5 | Very low | 46 | Very low | 181 Ų | 181 | 138.2 Ų | 138.2 | 95% | 0.948 | 78% | 0.779 | S | S | * | * | trans | -53 | 119.8 | 174.1 | -66.3 | 160.9 | 0 | 0 | 0 | 109.9 | ||||
| 71 | G | 41.9 | Very low | 45.1 | Very low | 51 Ų | 51 | 135.3 Ų | 135.3 | 53% | 0.526 | 79% | 0.785 | S | S | . | * | trans | -145.8 | 138.5 | 164.7 | 0 | 0 | 0 | 0 | 0 | 107.5 | R69 S73 | R69-G71 PolarHBondContact O-N 3.29Å; G71-S73 PolarHBondContact O-N 2.94Å | ||
| 72 | P | 41.4 | Very low | 44.3 | Very low | 134 Ų | 134 | 136.5 Ų | 136.5 | 87% | 0.87 | 80% | 0.801 | S | S | * | * | trans | -65.3 | 110 | -172.6 | 25.8 | -32.3 | 0 | 0 | 0 | 110.3 | P74 | P72-P74 WeakPolarHBondContact O-CD 3.4Š| ||
| 73 | S | 39.5 | Very low | 43.4 | Very low | 113 Ų | 113 | 138.6 Ų | 138.6 | 79% | 0.79 | 82% | 0.816 | S | S | * | * | trans | -64.2 | 124.5 | 170.7 | -70 | 0 | 0 | 0 | 0 | 110.1 | G71 F75 | G71-S73 PolarHBondContact O-N 2.94Å; S73-F75 PolarHBondContact O-N 2.98Å | ||
| 74 | P | 48.9 | Very low | 43.5 | Very low | 104 Ų | 104 | 138.6 Ų | 138.6 | 68% | 0.675 | 82% | 0.816 | S | S | * | * | trans | -97.1 | 56.8 | 175.2 | 38.9 | -32.3 | 0 | 0 | 0 | 110.1 | P72 | P72-P74 WeakPolarHBondContact O-CD 3.4Š| ||
| 75 | F | 51.1 | Low | 43.5 | Very low | 198 Ų | 198 | 140.4 Ų | 140.4 | 87% | 0.868 | 81% | 0.812 | S | S | * | * | trans | -144.3 | 69.4 | 168.8 | -75.2 | -73.4 | 0 | 0 | 0 | 110.5 | S73 | S73-F75 PolarHBondContact O-N 2.98Š| ||
| 76 | G | 43 | Very low | 43.5 | Very low | 83 Ų | 83 | 141.8 Ų | 141.8 | 86% | 0.856 | 82% | 0.817 | S | S | * | * | trans | -87 | 136.4 | 147 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 77 | G | 39.6 | Very low | 43.4 | Very low | 80 Ų | 80 | 141 Ų | 141 | 83% | 0.825 | 81% | 0.808 | S | S | * | * | trans | 151 | 108.2 | 174 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 78 | G | 41.3 | Very low | 44 | Very low | 74 Ų | 74 | 141.6 Ų | 141.6 | 76% | 0.763 | 81% | 0.812 | S | S | * | * | cis | 86.7 | 98.7 | 41.3 | 0 | 0 | 0 | 0 | 0 | 107.9 | R80 | G78-R80 PolarHBondContact O-N 2.9Š| ||
| 79 | L | 51.3 | Low | 44.5 | Very low | 183 Ų | 183 | 142.4 Ų | 142.4 | 96% | 0.958 | 82% | 0.817 | S | S | * | * | trans | -53.2 | 116.5 | 177.4 | -65.9 | 163.7 | 0 | 0 | 0 | 110.6 | ||||
| 80 | R | 43 | Very low | 44.5 | Very low | 239 Ų | 239 | 134.8 Ų | 134.8 | 90% | 0.902 | 81% | 0.814 | S | S | * | * | trans | -139.7 | 130.7 | 156.7 | -68.7 | -164.8 | -177.2 | -83.3 | -1.6 | 110.5 | G78 | G78-R80 PolarHBondContact O-N 2.9Š| ||
| 81 | T | 44.9 | Very low | 44.6 | Very low | 148 Ų | 148 | 129.5 Ų | 129.5 | 91% | 0.908 | 80% | 0.804 | S | S | * | * | trans | -59.9 | 147.9 | 170.7 | 46.5 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 82 | G | 42.3 | Very low | 45 | Very low | 69 Ų | 69 | 133.6 Ų | 133.6 | 71% | 0.711 | 82% | 0.821 | S | S | * | * | trans | 132.3 | 114.3 | 163.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 83 | F | 45.3 | Very low | 45.3 | Very low | 216 Ų | 216 | 132 Ų | 132 | 95% | 0.947 | 82% | 0.819 | S | S | * | * | trans | -54.4 | 149.7 | 171.4 | -65.3 | -93.3 | 0 | 0 | 0 | 112.8 | ||||
| 84 | P | 48.7 | Very low | 45.6 | Very low | 119 Ų | 119 | 134.4 Ų | 134.4 | 77% | 0.773 | 82% | 0.823 | S | S | * | * | trans | -130.3 | 123.8 | 141.5 | 31.6 | -18.1 | 0 | 0 | 0 | 114.6 | ||||
| 85 | T | 43.8 | Very low | 45.5 | Very low | 115 Ų | 115 | 139.8 Ų | 139.8 | 71% | 0.706 | 83% | 0.831 | S | S | * | * | trans | 15.5 | 115.4 | 135 | -63.8 | 0 | 0 | 0 | 0 | 119.1 | H87 | T85-H87 PolarHBondContact O-ND1 3.16Š| ||
| 86 | R | 45.1 | Very low | 45.3 | Very low | 234 Ų | 234 | 135.6 Ų | 135.6 | 88% | 0.883 | 82% | 0.822 | S | S | * | * | trans | -46.1 | 125 | 154.2 | -170.3 | -175.8 | -144.8 | -113.3 | 3.2 | 112.3 | ||||
| 87 | H | 44.2 | Very low | 45.5 | Very low | 164 Ų | 164 | 134.9 Ų | 134.9 | 76% | 0.759 | 80% | 0.803 | S | S | * | * | trans | -138 | 123.3 | 151.8 | 37.6 | -87.1 | 0 | 0 | 0 | 109.3 | T85 | T85-H87 PolarHBondContact O-ND1 3.16Š| ||
| 88 | S | 47.9 | Very low | 45.7 | Very low | 101 Ų | 101 | 141.6 Ų | 141.6 | 71% | 0.706 | 80% | 0.804 | S | S | * | * | trans | -96.4 | 120.8 | 178.3 | 171.8 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 89 | T | 46.4 | Very low | 46.1 | Very low | 140 Ų | 140 | 148.4 Ų | 148.4 | 86% | 0.859 | 81% | 0.808 | S | S | * | * | trans | -162.5 | 125.1 | 157.8 | -23.9 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 90 | G | 39.2 | Very low | 45.9 | Very low | 84 Ų | 84 | 143 Ų | 143 | 87% | 0.866 | 80% | 0.796 | S | S | * | * | trans | 82.4 | 124 | 161.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 91 | G | 47.5 | Very low | 46.2 | Very low | 71 Ų | 71 | 139.8 Ų | 139.8 | 73% | 0.732 | 79% | 0.791 | S | S | * | * | cis | 155.1 | 152.4 | 20.1 | 0 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 92 | P | 50 | Low | 46.5 | Very low | 136 Ų | 136 | 138.2 Ų | 138.2 | 88% | 0.883 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 156.7 | -163.1 | 33.2 | -34 | 0 | 0 | 0 | 113.9 | ||
| 93 | A | 48.2 | Very low | 46.9 | Very low | 101 Ų | 101 | 140 Ų | 140 | 84% | 0.835 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 132.7 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114 | Y95 | A93-Y95 PolarHBondContact O-N 2.77Š|
| 94 | L | 46.2 | Very low | 47.4 | Very low | 164 Ų | 164 | 134.8 Ų | 134.8 | 86% | 0.859 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 122.7 | 162.9 | -68.4 | 172.2 | 0 | 0 | 0 | 109.2 | T96 | L94-T96 PolarHBondContact O-N 2.9Š|
| 95 | Y | 47.4 | Very low | 47.8 | Very low | 216 Ų | 216 | 140.2 Ų | 140.2 | 85% | 0.847 | 78% | 0.778 | S | S | * | * | trans | -66.7 | 90.3 | 171.9 | -165.9 | -93.3 | 0 | 0 | 0 | 109.3 | A93 | A93-Y95 PolarHBondContact O-N 2.77Š| ||
| 96 | T | 45.1 | Very low | 48.4 | Very low | 110 Ų | 110 | 140.2 Ų | 140.2 | 68% | 0.675 | 78% | 0.783 | S | S | * | * | trans | -98.6 | 97.9 | 160 | 153.2 | 0 | 0 | 0 | 0 | 107.5 | L94 R98 | L94-T96 PolarHBondContact O-N 2.9Å; T96-R98 PolarHBondContact O-N 3.2Å | ||
| 97 | S | 49 | Very low | 48.9 | Very low | 68 Ų | 68 | 131.3 Ų | 131.3 | 48% | 0.476 | 76% | 0.757 | S | S | . | * | trans | -60.5 | 86.4 | 164.4 | -175.4 | 0 | 0 | 0 | 0 | 108.2 | Y99 | S97-Y99 PolarHBondContact O-N 2.99Å; S97-Y99 VanDerWaalsContact O-N 3.15Å | ||
| 98 | R | 42.9 | Very low | 49.5 | Very low | 222 Ų | 222 | 127 Ų | 127 | 84% | 0.838 | 74% | 0.744 | S | S | * | * | trans | -70.4 | 102.3 | 155.1 | -74.6 | -162.5 | -101.1 | -145.5 | -2 | 105.9 | T96 G100 | T96-R98 PolarHBondContact O-N 3.2Å; R98-G100 PolarHBondContact O-N 3.33Å | ||
| 99 | Y | 48.7 | Very low | 49.8 | Very low | 217 Ų | 217 | 128.8 Ų | 128.8 | 85% | 0.851 | 75% | 0.75 | S | S | * | * | trans | -56 | 90.4 | 153 | -76.1 | -90 | 0 | 0 | 0 | 106 | S97 E101 | S97-Y99 PolarHBondContact O-N 2.99Å; S97-Y99 VanDerWaalsContact O-N 3.15Å; Y99-E101 PolarHBondContact O-N 2.76Å | ||
| 100 | G | 47.6 | Very low | 50.4 | Low | 68 Ų | 68 | 123.7 Ų | 123.7 | 70% | 0.701 | 72% | 0.719 | S | S | * | * | trans | -69.4 | 90.3 | 164 | 0 | 0 | 0 | 0 | 0 | 105.4 | R98 P102 | R98-G100 PolarHBondContact O-N 3.33Å; G100-P102 WeakPolarHBondContact O-CD 3.47Å | ||
| 101 | E | 49 | Very low | 51.1 | Low | 172 Ų | 172 | 124.7 Ų | 124.7 | 80% | 0.804 | 71% | 0.708 | S | S | * | * | trans | -49.7 | 119.7 | 161 | -172.8 | 141.1 | 81.3 | 0 | 0 | 106.6 | Y99 S103 | Y99-E101 PolarHBondContact O-N 2.76Å; E101-S103 PolarHBondContact O-N 2.81Å | ||
| 102 | P | 52.4 | Low | 51.9 | Low | 115 Ų | 115 | 125.2 Ų | 125.2 | 75% | 0.747 | 71% | 0.714 | S | S | * | * | trans | -63.1 | 107.2 | 175.6 | 25.1 | -30.6 | 0 | 0 | 0 | 105.9 | G100 | G100-P102 WeakPolarHBondContact O-CD 3.47Š| ||
| 103 | S | 51.1 | Low | 53 | Low | 106 Ų | 106 | 122.2 Ų | 122.2 | 74% | 0.741 | 71% | 0.708 | S | S | * | * | trans | -44.2 | 122.6 | 172.3 | -72.1 | 0 | 0 | 0 | 0 | 107.5 | E101 R105 | E101-S103 PolarHBondContact O-N 2.81Å; S103-R105 PolarHBondContact O-N 2.83Å | ||
| 104 | P | 54.2 | Low | 54.6 | Low | 108 Ų | 108 | 123.5 Ų | 123.5 | 70% | 0.701 | 70% | 0.696 | S | S | * | * | trans | -54.3 | 125.1 | 174.9 | 21.2 | -29.8 | 0 | 0 | 0 | 106 | S106 | P104-S106 PolarHBondContact O-N 2.83Å; P104-S106 PolarHBondContact O-OG 2.96Å | ||
| 105 | R | 57.5 | Low | 56.6 | Low | 232 Ų | 232 | 119 Ų | 119 | 88% | 0.875 | 68% | 0.677 | S | S | * | * | trans | -59.3 | 91.8 | 178.3 | -132.9 | -178.9 | -170.4 | -143.6 | 4.1 | 105.8 | S103 S107 | S103-R105 PolarHBondContact O-N 2.83Å; R105-S107 PolarHBondContact O-N 2.8Å | ||
| 106 | S | 56 | Low | 58.8 | Low | 115 Ų | 115 | 108.7 Ų | 108.7 | 80% | 0.804 | 64% | 0.637 | S | S | * | * | trans | -58.2 | 110.7 | -177.2 | -58.7 | 0 | 0 | 0 | 0 | 107.4 | P104 | P104-S106 PolarHBondContact O-N 2.83Å; P104-S106 PolarHBondContact O-OG 2.96Å | ||
| 107 | S | 55.9 | Low | 61.2 | Low | 48 Ų | 48 | 108.8 Ų | 108.8 | 34% | 0.336 | 63% | 0.628 | S | S | . | * | trans | -57.5 | 146 | 168.7 | 39.4 | 0 | 0 | 0 | 0 | 108.3 | R105 T109 | R105-S107 PolarHBondContact O-N 2.8Å; S107-T109 PolarHBondContact O-N 2.9Å | ||
| 108 | P | 58 | Low | 63.5 | Low | 74 Ų | 74 | 106.6 Ų | 106.6 | 48% | 0.481 | 61% | 0.612 | S | S | . | * | trans | -55.6 | 115.5 | 179.1 | 23.7 | -33 | 0 | 0 | 0 | 109.1 | T110 V118 | P108-T110 PolarHBondContact O-N 3.14Å; P108-V118 HydrophobicContact CG-CG2 4.48Å | ||
| 109 | T | 53.6 | Low | 66.1 | Low | 138 Ų | 138 | 98.9 Ų | 98.9 | 85% | 0.847 | 59% | 0.591 | S | S | * | * | trans | -75 | 112.2 | 172.3 | 35 | 0 | 0 | 0 | 0 | 108 | S107 T111 | S107-T109 PolarHBondContact O-N 2.9Å; T109-T111 PolarHBondContact O-N 3.21Å | ||
| 110 | T | 57.9 | Low | 68.4 | Low | 32 Ų | 32 | 88.6 Ų | 88.6 | 20% | 0.196 | 55% | 0.55 | C | S | . | * | P | Polyproline II helix | trans | -74.1 | 118.2 | 176.6 | 40.2 | 0 | 0 | 0 | 0 | 110 | P108 W116 Q190 | P108-T110 PolarHBondContact O-N 3.14Å; T110-W116 HydrophobicContact CG2-CB 4.19Å; T110-Q190 PolarHBondContact OG1-NE2 3.34Å |
| 111 | T | 55.2 | Low | 70.8 | Confident | 105 Ų | 105 | 90.2 Ų | 90.2 | 64% | 0.644 | 54% | 0.543 | S | S | * | . | P | Polyproline II helix | trans | -59.4 | 137.9 | 165.8 | 29.1 | 0 | 0 | 0 | 0 | 109.7 | T109 G113 E114 | T109-T111 PolarHBondContact O-N 3.21Å; T111-G113 PolarHBondContact O-N 3.15Å; T111-G113 VanDerWaalsContact O-N 3.15Å; T111-E114 PolarHBondContact O-N 2.9Å |
| 112 | G | 63.6 | Low | 73.1 | Confident | 82 Ų | 82 | 82.2 Ų | 82.2 | 85% | 0.845 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52 | 118.1 | -166 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 113 | G | 73.3 | Confident | 75.2 | Confident | 74 Ų | 74 | 82.6 Ų | 82.6 | 76% | 0.763 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 117.2 | -25 | 174.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | T111 | T111-G113 PolarHBondContact O-N 3.15Å; T111-G113 VanDerWaalsContact O-N 3.15Å |
| 114 | E | 82.3 | Confident | 77.3 | Confident | 127 Ų | 127 | 79.5 Ų | 79.5 | 59% | 0.593 | 48% | 0.476 | S | S | * | . | S | Bend | trans | -84.6 | 139.3 | 179.2 | -65.8 | -170.8 | 125 | 0 | 0 | 111.7 | T111 Q190 | T111-E114 PolarHBondContact O-N 2.9Å; E114-Q190 PolarHBondContact O-NE2 3.36Å |
| 115 | P | 87.8 | Confident | 79.3 | Confident | 70 Ų | 70 | 75.8 Ų | 75.8 | 46% | 0.455 | 45% | 0.449 | S | S | . | . | P | Polyproline II helix | trans | -62 | 144.1 | 174.5 | 27.4 | -33.5 | 0 | 0 | 0 | 110.1 | K117 A188 | P115-K117 PolarHBondContact O-N 2.99Å; P115-A188 CarbonylContact C-O 3.59Å; P115-A188 WeakPolarHBondContact CA-O 3.49Å; P115-A188 WeakPolarHBondContact CB-O 3.37Å |
| 116 | W | 93.9 | Very high | 81.1 | Confident | 0 Ų | 0 | 70 Ų | 70 | 0% | 0 | 43% | 0.43 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -62.1 | 129.4 | 170.9 | 173.8 | 77.1 | 0 | 0 | 0 | 109.2 | T110 V118 V139 I163 I165 V169 I186 E187 A188 | T110-W116 HydrophobicContact CG2-CB 4.19Å; W116-V118 HydrophobicContact CD2-CG2 4.48Å; W116-V118 HydrophobicContact CH2-CG2 4.22Å; W116-V118 HydrophobicContact CZ2-CG2 3.57Å; W116-V139 HydrophobicContact CH2-CG2 3.98Å; W116-V139 HydrophobicContact CZ3-CG2 4.23Å; W116-I163 HydrophobicContact CH2-CG2 4.05Å; W116-I163 HydrophobicContact CZ2-CG2 3.74Å; W116-I165 HydrophobicContact CH2-CG1 4.08Å; W116-V169 HydrophobicContact CB-CG1 4.11Å; W116-V169 HydrophobicContact CB-CG2 3.57Å; W116-V169 HydrophobicContact CD2-CG1 4.32Å; W116-V169 HydrophobicContact CE3-CG1 4.16Å; W116-V169 HydrophobicContact CG-CG1 4.36Å; W116-V169 HydrophobicContact CG-CG2 3.88Å; W116-I186 HydrophobicContact CH2-CG2 4.32Å; W116-I186 HydrophobicContact CZ3-CG2 3.86Å; W116-E187 CarbonylContact O-C 3.54Å; W116-E187 WeakPolarHBondContact O-CA 3.36Å; W116-A188 HydrophobicContact CE3-CB 3.69Å; W116-A188 HydrophobicContact CZ3-CB 4.28Å; W116-A188 PolarHBondContact N-O 2.8Å; W116-A188 PolarHBondContact O-N 3.32Å |
| 117 | K | 95.6 | Very high | 83 | Confident | 111 Ų | 111 | 69 Ų | 69 | 48% | 0.483 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.3 | 134.2 | -174.6 | -169.5 | 174 | -173.3 | 169.5 | 0 | 111.8 | P115 I185 I186 | P115-K117 PolarHBondContact O-N 2.99Å; K117-I185 HydrophobicContact CD-CG2 4.33Å; K117-I185 HydrophobicContact CG-CG2 4.19Å; K117-I186 CarbonylContact C-O 3.45Å; K117-I186 VanDerWaalsContact CA-O 3.3Å; K117-I186 WeakPolarHBondContact CA-O 3.3Å |
| 118 | V | 96.4 | Very high | 84.9 | Confident | 23 Ų | 23 | 74.7 Ų | 74.7 | 14% | 0.139 | 44% | 0.442 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.8 | 135.1 | 176 | -178.5 | 0 | 0 | 0 | 0 | 110.2 | P108 W116 V120 I163 I186 | P108-V118 HydrophobicContact CG-CG2 4.48Å; W116-V118 HydrophobicContact CD2-CG2 4.48Å; W116-V118 HydrophobicContact CH2-CG2 4.22Å; W116-V118 HydrophobicContact CZ2-CG2 3.57Å; V118-V120 HydrophobicContact CG1-CG2 4.47Å; V118-I163 HydrophobicContact CG1-CD1 3.81Å; V118-I163 HydrophobicContact CG1-CG1 4.48Å; V118-I163 HydrophobicContact CG1-CG2 4.4Å; V118-I163 HydrophobicContact CG2-CG2 4.17Å; V118-I186 PolarHBondContact N-O 2.95Å; V118-I186 PolarHBondContact O-N 3.27Å |
| 119 | C | 97.3 | Very high | 86.8 | Confident | 59 Ų | 59 | 73.2 Ų | 73.2 | 40% | 0.399 | 43% | 0.429 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.4 | 137.8 | 176.2 | -58.8 | 0 | 0 | 0 | 0 | 111 | V183 L184 | C119-V183 HydrophobicContact CB-CG1 3.94Å; C119-L184 CarbonylContact C-O 3.47Å; C119-L184 WeakPolarHBondContact CA-O 3.15Å |
| 120 | V | 97.7 | Very high | 88.9 | Confident | 1 Ų | 1 | 68 Ų | 68 | 1% | 0.006 | 40% | 0.396 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.8 | 120.1 | 178.9 | -173.5 | 0 | 0 | 0 | 0 | 109 | V118 V122 F159 K161 I163 L184 I186 | V118-V120 HydrophobicContact CG1-CG2 4.47Å; V120-V122 HydrophobicContact CG1-CG1 3.95Å; V120-V122 PolarHBondContact O-N 3.15Å; V120-F159 HydrophobicContact CG1-CE1 4.07Å; V120-F159 HydrophobicContact CG1-CZ 3.65Å; V120-K161 HydrophobicContact CB-CD 4.46Å; V120-K161 HydrophobicContact CG1-CD 3.62Å; V120-K161 HydrophobicContact CG2-CD 4.02Å; V120-I163 HydrophobicContact CG2-CD1 3.83Å; V120-L184 HydrophobicContact CB-CB 4.31Å; V120-L184 PolarHBondContact N-O 3.46Å; V120-L184 PolarHBondContact O-N 3.2Å; V120-I186 HydrophobicContact CG2-CD1 4.2Å |
| 121 | N | 97.2 | Very high | 90.8 | Very high | 102 Ų | 102 | 69.6 Ų | 69.6 | 55% | 0.545 | 40% | 0.403 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.6 | 123 | 172.6 | -173 | 3.5 | 0 | 0 | 0 | 110 | H123 G182 | N121-H123 PolarHBondContact OD1-CD2 3.42Å; N121-H123 VanDerWaalsContact OD1-CD2 3.27Å; N121-H123 PolarHBondContact OD1-N 3.38Å; N121-G182 PolarHBondContact OD1-O 3.21Å |
| 122 | V | 97.6 | Very high | 92.8 | Very high | 5 Ų | 5 | 67 Ų | 67 | 3% | 0.03 | 39% | 0.387 | C | S | . | . | trans | -133.4 | 18.7 | -178.3 | -64.4 | 0 | 0 | 0 | 0 | 112.2 | V120 S124 F125 L130 F159 L178 G182 L184 | V120-V122 HydrophobicContact CG1-CG1 3.95Å; V120-V122 PolarHBondContact O-N 3.15Å; V122-S124 PolarHBondContact O-N 2.91Å; V122-F125 PolarHBondContact O-N 3.17Å; V122-L130 HydrophobicContact CB-CD1 4.04Å; V122-L130 HydrophobicContact CB-CD2 4.18Å; V122-L130 HydrophobicContact CG1-CD1 4.49Å; V122-L130 HydrophobicContact CG1-CD2 4.22Å; V122-L130 HydrophobicContact CG2-CD1 3.72Å; V122-F159 HydrophobicContact CG1-CE1 4.18Å; V122-L178 HydrophobicContact CG2-CD1 3.52Å; V122-G182 CarbonylContact C-O 3.59Å; V122-G182 WeakPolarHBondContact CA-O 3.4Å; V122-G182 VanDerWaalsContact CG2-O 3.27Å; V122-G182 WeakPolarHBondContact CG2-O 3.25Å; V122-G182 PolarHBondContact N-O 3.11Å; V122-L184 HydrophobicContact CG1-CB 4.28Å; V122-L184 HydrophobicContact CG2-CB 3.91Å | ||
| 123 | H | 96.8 | Very high | 94.4 | Very high | 123 Ų | 123 | 68.6 Ų | 68.6 | 57% | 0.569 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.6 | -19.3 | -173.9 | 82 | 92.7 | 0 | 0 | 0 | 116.1 | N121 F125 G182 | N121-H123 PolarHBondContact OD1-CD2 3.42Å; N121-H123 VanDerWaalsContact OD1-CD2 3.27Å; N121-H123 PolarHBondContact OD1-N 3.38Å; H123-F125 VanDerWaalsContact C-N 3.28Å; H123-G182 PolarHBondContact N-O 3.23Å; H123-G182 VanDerWaalsContact N-O 3.14Å |
| 124 | S | 94.9 | Very high | 95.5 | Very high | 41 Ų | 41 | 68 Ų | 68 | 29% | 0.287 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.2 | -0.3 | 178.5 | -69.7 | 0 | 0 | 0 | 0 | 114 | V122 | V122-S124 PolarHBondContact O-N 2.91Š|
| 125 | F | 96.9 | Very high | 96.1 | Very high | 30 Ų | 30 | 70.8 Ų | 70.8 | 13% | 0.132 | 36% | 0.357 | C | S | . | . | S | Bend | trans | -127 | 145.3 | -174.5 | -63 | -90.9 | 0 | 0 | 0 | 110.5 | V122 H123 L130 H145 K157 F159 | V122-F125 PolarHBondContact O-N 3.17Å; H123-F125 VanDerWaalsContact C-N 3.28Å; F125-L130 HydrophobicContact CB-CD2 3.74Å; F125-L130 HydrophobicContact CB-CG 4.15Å; F125-L130 HydrophobicContact CG-CD2 4.12Å; F125-H145 HydrophobicContact CD1-CB 3.71Å; F125-H145 HydrophobicContact CE1-CB 3.84Å; F125-K157 HydrophobicContact CE1-CB 4.12Å; F125-K157 HydrophobicContact CZ-CB 3.98Å; F125-F159 HydrophobicContact CE1-CB 4.24Å; F125-F159 HydrophobicContact CE2-CB 3.64Å; F125-F159 HydrophobicContact CE2-CG 4.32Å; F125-F159 HydrophobicContact CZ-CB 3.45Å; F125-F159 VanDerWaalsContact CZ-CB 3.45Å |
| 126 | K | 95.4 | Very high | 96.4 | Very high | 110 Ų | 110 | 73 Ų | 73 | 48% | 0.478 | 37% | 0.365 | S | S | . | . | trans | -76.1 | 154.1 | 171.3 | -64.1 | 176.8 | -177.8 | 171.6 | 0 | 110.4 | E128 E129 | K126-E128 HydrophobicContact CB-CG 3.91Å; K126-E128 PolarHBondContact O-N 2.81Å; K126-E129 HydrophobicContact CB-CG 4.09Å; K126-E129 PolarHBondContact N-OE2 2.76Å; K126-E129 WeakPolarHBondContact O-CB 3.33Å; K126-E129 PolarHBondContact O-N 2.86Å | ||
| 127 | P | 96 | Very high | 96.4 | Very high | 93 Ų | 93 | 74.7 Ų | 74.7 | 60% | 0.604 | 38% | 0.383 | S | S | * | . | G | 310 helix | trans | -54.8 | -38 | 178.7 | -21.7 | 29.6 | 0 | 0 | 0 | 113.2 | E129 L130 L178 | P127-E129 VanDerWaalsContact C-N 3.28Å; P127-E129 PolarHBondContact O-N 3.29Å; P127-L130 PolarHBondContact O-N 3.08Å; P127-L178 HydrophobicContact CB-CD2 3.72Å; P127-L178 HydrophobicContact CG-CD2 3.63Å |
| 128 | E | 96.2 | Very high | 96.4 | Very high | 169 Ų | 169 | 72.2 Ų | 72.2 | 79% | 0.79 | 37% | 0.373 | S | S | * | . | G | 310 helix | trans | -71.7 | -16.1 | 179.4 | 47.6 | -166.4 | 173.7 | 0 | 0 | 114.4 | K126 | K126-E128 HydrophobicContact CB-CG 3.91Å; K126-E128 PolarHBondContact O-N 2.81Å |
| 129 | E | 96.8 | Very high | 96.5 | Very high | 43 Ų | 43 | 71.1 Ų | 71.1 | 20% | 0.201 | 37% | 0.366 | C | S | . | . | G | 310 helix | trans | -91.1 | -9 | 176.2 | -66.3 | 169.8 | 170.8 | 0 | 0 | 112.6 | K126 P127 G143 K144 H145 | K126-E129 HydrophobicContact CB-CG 4.09Å; K126-E129 PolarHBondContact N-OE2 2.76Å; K126-E129 WeakPolarHBondContact O-CB 3.33Å; K126-E129 PolarHBondContact O-N 2.86Å; P127-E129 VanDerWaalsContact C-N 3.28Å; P127-E129 PolarHBondContact O-N 3.29Å; E129-G143 WeakPolarHBondContact O-CA 3.5Å; E129-K144 WeakPolarHBondContact CB-O 3.5Å; E129-K144 PolarHBondContact O-N 2.87Å; E129-H145 VanDerWaalsContact CD-ND1 3.26Å; E129-H145 IonicContact OE1-CE1 2.81Å; E129-H145 IonicContact OE1-CG 2.98Å; E129-H145 IonicContact OE1-ND1 3.76Å; E129-H145 PolarHBondContact OE1-ND1 2.85Å; E129-H145 WeakPolarHBondContact OE2-CB 3.29Å; E129-H145 IonicContact OE2-CG 3.52Å; E129-H145 IonicContact OE2-ND1 3.72Å; E129-H145 PolarHBondContact OE2-ND1 2.9Å |
| 130 | L | 97.9 | Very high | 96.5 | Very high | 29 Ų | 29 | 71.8 Ų | 71.8 | 15% | 0.152 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.1 | 144.1 | -176.7 | -64.5 | 174.3 | 0 | 0 | 0 | 111.8 | V122 F125 P127 S142 L178 | V122-L130 HydrophobicContact CB-CD1 4.04Å; V122-L130 HydrophobicContact CB-CD2 4.18Å; V122-L130 HydrophobicContact CG1-CD1 4.49Å; V122-L130 HydrophobicContact CG1-CD2 4.22Å; V122-L130 HydrophobicContact CG2-CD1 3.72Å; F125-L130 HydrophobicContact CB-CD2 3.74Å; F125-L130 HydrophobicContact CB-CG 4.15Å; F125-L130 HydrophobicContact CG-CD2 4.12Å; P127-L130 PolarHBondContact O-N 3.08Å; L130-S142 CarbonylContact C-O 3.57Å; L130-S142 WeakPolarHBondContact CA-O 3.43Å; L130-L178 HydrophobicContact CD1-CD2 4.28Å |
| 131 | N | 97.8 | Very high | 96.6 | Very high | 64 Ų | 64 | 71.8 Ų | 71.8 | 34% | 0.342 | 36% | 0.363 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.6 | 126.4 | 175.4 | -176.5 | -103.9 | 0 | 0 | 0 | 110.4 | K133 V141 S142 | N131-K133 VanDerWaalsContact OD1-CD 3.29Å; N131-K133 WeakPolarHBondContact OD1-CD 3.39Å; N131-K133 WeakPolarHBondContact OD1-CE 3.44Å; N131-K133 WeakPolarHBondContact OD1-CG 3.36Å; N131-K133 PolarHBondContact OD1-NZ 3.2Å; N131-V141 CarbonylContact O-C 3.57Å; N131-V141 WeakPolarHBondContact O-CA 3.4Å; N131-S142 PolarHBondContact N-O 2.78Å; N131-S142 PolarHBondContact O-N 2.91Å; N131-S142 PolarHBondContact O-OG 3.31Å |
| 132 | V | 97.6 | Very high | 96.6 | Very high | 52 Ų | 52 | 68.1 Ų | 68.1 | 32% | 0.315 | 35% | 0.345 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.3 | 129.2 | 177.7 | -174.9 | 0 | 0 | 0 | 0 | 108.7 | V139 E140 V141 A176 L184 | V132-V139 HydrophobicContact CG1-CG1 3.66Å; V132-E140 CarbonylContact C-O 3.55Å; V132-E140 WeakPolarHBondContact CA-O 3.47Å; V132-V141 HydrophobicContact CG2-CG1 4.45Å; V132-V141 HydrophobicContact CG2-CG2 4.46Å; V132-A176 HydrophobicContact CG1-CB 4.47Å; V132-A176 HydrophobicContact CG2-CB 4.39Å; V132-L184 HydrophobicContact CG2-CD2 3.84Å |
| 133 | K | 97.2 | Very high | 96.6 | Very high | 115 Ų | 115 | 67.9 Ų | 67.9 | 50% | 0.5 | 34% | 0.344 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.4 | 134.4 | 179.8 | -75.6 | 169.9 | 175.7 | 154.3 | 0 | 110.4 | N131 V139 E140 | N131-K133 VanDerWaalsContact OD1-CD 3.29Å; N131-K133 WeakPolarHBondContact OD1-CD 3.39Å; N131-K133 WeakPolarHBondContact OD1-CE 3.44Å; N131-K133 WeakPolarHBondContact OD1-CG 3.36Å; N131-K133 PolarHBondContact OD1-NZ 3.2Å; K133-V139 CarbonylContact O-C 3.49Å; K133-V139 WeakPolarHBondContact O-CA 3.39Å; K133-E140 PolarHBondContact N-O 3.02Å; K133-E140 PolarHBondContact O-N 2.99Å |
| 134 | T | 97.2 | Very high | 96.7 | Very high | 62 Ų | 62 | 70.2 Ų | 70.2 | 38% | 0.38 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 118.9 | 171.1 | -56.1 | 0 | 0 | 0 | 0 | 108.8 | F138 I165 P171 V174 | T134-F138 CarbonylContact C-O 3.57Å; T134-F138 WeakPolarHBondContact CA-O 3.48Å; T134-I165 HydrophobicContact CG2-CD1 3.66Å; T134-P171 HydrophobicContact CG2-CB 3.97Å; T134-V174 HydrophobicContact CG2-CG2 4.4Å |
| 135 | R | 94.5 | Very high | 96.8 | Very high | 184 Ų | 184 | 69.2 Ų | 69.2 | 69% | 0.694 | 34% | 0.343 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -155.5 | 142.8 | -179.9 | -164.5 | -165.8 | 159 | 167.6 | 2.2 | 111.1 | G137 F138 | R135-G137 PolarHBondContact O-N 3.13Å; R135-G137 VanDerWaalsContact O-N 3.16Å; R135-F138 PolarHBondContact N-O 3.2Å; R135-F138 PolarHBondContact O-N 3.25Å |
| 136 | D | 93.3 | Very high | 96.7 | Very high | 116 Ų | 116 | 73.4 Ų | 73.4 | 62% | 0.62 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.2 | 33.4 | 171.7 | -51.6 | -36.2 | 0 | 0 | 0 | 113.9 | F138 | D136-F138 VanDerWaalsContact C-N 3.34Å; D136-F138 WeakPolarHBondContact O-CD2 3.19Å; D136-F138 WeakPolarHBondContact O-CE2 3.29Å |
| 137 | G | 93.8 | Very high | 96.6 | Very high | 37 Ų | 37 | 73 Ų | 73 | 38% | 0.381 | 36% | 0.364 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 76.8 | 17.4 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | R135 I165 | R135-G137 PolarHBondContact O-N 3.13Å; R135-G137 VanDerWaalsContact O-N 3.16Å; G137-I165 WeakPolarHBondContact O-CB 3.34Å; G137-I165 PolarHBondContact O-N 2.78Å |
| 138 | F | 96.8 | Very high | 96.6 | Very high | 59 Ų | 59 | 76.3 Ų | 76.3 | 26% | 0.259 | 37% | 0.368 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.1 | 149.5 | 175.6 | -61.4 | -96.4 | 0 | 0 | 0 | 112.1 | T134 R135 D136 K162 I163 Q164 | T134-F138 CarbonylContact C-O 3.57Å; T134-F138 WeakPolarHBondContact CA-O 3.48Å; R135-F138 PolarHBondContact N-O 3.2Å; R135-F138 PolarHBondContact O-N 3.25Å; D136-F138 VanDerWaalsContact C-N 3.34Å; D136-F138 WeakPolarHBondContact O-CD2 3.19Å; D136-F138 WeakPolarHBondContact O-CE2 3.29Å; F138-K162 HydrophobicContact CB-CD 4.25Å; F138-K162 VanDerWaalsContact CB-CE 3.44Å; F138-K162 HydrophobicContact CB-CG 3.76Å; F138-K162 HydrophobicContact CD1-CD 3.99Å; F138-K162 HydrophobicContact CD1-CG 3.58Å; F138-K162 HydrophobicContact CE1-CD 4.48Å; F138-K162 HydrophobicContact CE1-CG 4.39Å; F138-K162 HydrophobicContact CG-CD 4.05Å; F138-K162 HydrophobicContact CG-CG 3.84Å; F138-I163 CarbonylContact C-O 3.51Å; F138-I163 WeakPolarHBondContact CA-O 3.34Å; F138-I163 WeakPolarHBondContact CB-O 3.4Å; F138-Q164 VanDerWaalsContact CD1-CA 3.46Å; F138-Q164 HydrophobicContact CD1-CB 3.82Å; F138-Q164 HydrophobicContact CD1-CG 4.24Å; F138-Q164 HydrophobicContact CE1-CB 3.64Å; F138-Q164 HydrophobicContact CE1-CG 3.85Å; F138-Q164 HydrophobicContact CZ-CG 4.26Å |
| 139 | V | 97.9 | Very high | 96.4 | Very high | 0 Ų | 0 | 72.9 Ų | 72.9 | 0% | 0 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.6 | 119.5 | 160.5 | -173.5 | 0 | 0 | 0 | 0 | 108.4 | W116 V132 K133 K162 I163 I165 V174 I186 | W116-V139 HydrophobicContact CH2-CG2 3.98Å; W116-V139 HydrophobicContact CZ3-CG2 4.23Å; V132-V139 HydrophobicContact CG1-CG1 3.66Å; K133-V139 CarbonylContact O-C 3.49Å; K133-V139 WeakPolarHBondContact O-CA 3.39Å; V139-K162 CarbonylContact O-C 3.56Å; V139-K162 WeakPolarHBondContact O-CA 3.43Å; V139-I163 PolarHBondContact N-O 2.79Å; V139-I163 PolarHBondContact O-N 3.4Å; V139-I165 HydrophobicContact CG2-CD1 3.68Å; V139-I165 HydrophobicContact CG2-CG1 3.79Å; V139-V174 HydrophobicContact CG2-CG1 3.96Å; V139-V174 HydrophobicContact CG2-CG2 4.27Å; V139-I186 HydrophobicContact CG1-CD1 3.96Å; V139-I186 HydrophobicContact CG1-CG2 4.29Å; V139-I186 HydrophobicContact CG2-CG2 4.33Å |
| 140 | E | 97.9 | Very high | 96.1 | Very high | 73 Ų | 73 | 80.6 Ų | 80.6 | 34% | 0.341 | 39% | 0.388 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.3 | 120 | 174 | -172.3 | 179.4 | 133.7 | 0 | 0 | 109.6 | V132 K133 T160 K161 | V132-E140 CarbonylContact C-O 3.55Å; V132-E140 WeakPolarHBondContact CA-O 3.47Å; K133-E140 PolarHBondContact N-O 3.02Å; K133-E140 PolarHBondContact O-N 2.99Å; E140-T160 HydrophobicContact CG-CG2 3.99Å; E140-K161 WeakPolarHBondContact CA-O 3.37Å |
| 141 | V | 98.1 | Very high | 95.9 | Very high | 0 Ų | 0 | 88.2 Ų | 88.2 | 0% | 0 | 42% | 0.423 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.1 | 122.6 | 172.5 | -174.1 | 0 | 0 | 0 | 0 | 107.6 | N131 V132 F159 T160 K161 L184 I186 | N131-V141 CarbonylContact O-C 3.57Å; N131-V141 WeakPolarHBondContact O-CA 3.4Å; V132-V141 HydrophobicContact CG2-CG1 4.45Å; V132-V141 HydrophobicContact CG2-CG2 4.46Å; V141-F159 HydrophobicContact CB-CE1 4.13Å; V141-F159 HydrophobicContact CG1-CD1 4.42Å; V141-F159 HydrophobicContact CG1-CE1 3.83Å; V141-T160 CarbonylContact O-C 3.58Å; V141-T160 VanDerWaalsContact O-CA 3.29Å; V141-T160 WeakPolarHBondContact O-CA 3.4Å; V141-K161 PolarHBondContact N-O 2.87Å; V141-K161 PolarHBondContact O-N 2.8Å; V141-L184 HydrophobicContact CB-CD2 4.3Å; V141-L184 HydrophobicContact CG1-CD2 3.47Å; V141-L184 VanDerWaalsContact CG1-CD2 3.47Å; V141-L184 HydrophobicContact CG2-CD2 3.78Å; V141-I186 HydrophobicContact CG2-CD1 3.63Å |
| 142 | S | 97.9 | Very high | 95.4 | Very high | 25 Ų | 25 | 88.4 Ų | 88.4 | 18% | 0.175 | 44% | 0.441 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.3 | 152.5 | 176.9 | 61 | 0 | 0 | 0 | 0 | 111.2 | L130 N131 F159 | L130-S142 CarbonylContact C-O 3.57Å; L130-S142 WeakPolarHBondContact CA-O 3.43Å; N131-S142 PolarHBondContact N-O 2.78Å; N131-S142 PolarHBondContact O-N 2.91Å; N131-S142 PolarHBondContact O-OG 3.31Å; S142-F159 CarbonylContact C-O 3.55Å; S142-F159 WeakPolarHBondContact CA-O 3.09Å |
| 143 | G | 97.9 | Very high | 95.1 | Very high | 1 Ų | 1 | 87.3 Ų | 87.3 | 1% | 0.01 | 44% | 0.439 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.3 | 139.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | E129 N158 F159 | E129-G143 WeakPolarHBondContact O-CA 3.5Å; G143-N158 CarbonylContact O-C 3.58Å; G143-N158 WeakPolarHBondContact O-CA 3.15Å; G143-F159 PolarHBondContact N-O 3.1Å; G143-F159 PolarHBondContact O-N 3.41Å |
| 144 | K | 97.5 | Very high | 95 | Very high | 171 Ų | 171 | 86.6 Ų | 86.6 | 74% | 0.743 | 44% | 0.44 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -135 | 117.6 | 175 | -67.6 | -175.9 | -178.5 | -178.5 | 0 | 109.5 | E129 K157 | E129-K144 WeakPolarHBondContact CB-O 3.5Å; E129-K144 PolarHBondContact O-N 2.87Å; K144-K157 WeakPolarHBondContact CA-O 3.41Å |
| 145 | H | 96.9 | Very high | 94.9 | Very high | 20 Ų | 20 | 85.6 Ų | 85.6 | 9% | 0.093 | 43% | 0.434 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.8 | 135.9 | -178.3 | 176.6 | 71.7 | 0 | 0 | 0 | 109.7 | F125 E129 E147 T156 K157 | F125-H145 HydrophobicContact CD1-CB 3.71Å; F125-H145 HydrophobicContact CE1-CB 3.84Å; E129-H145 VanDerWaalsContact CD-ND1 3.26Å; E129-H145 IonicContact OE1-CE1 2.81Å; E129-H145 IonicContact OE1-CG 2.98Å; E129-H145 IonicContact OE1-ND1 3.76Å; E129-H145 PolarHBondContact OE1-ND1 2.85Å; E129-H145 WeakPolarHBondContact OE2-CB 3.29Å; E129-H145 IonicContact OE2-CG 3.52Å; E129-H145 IonicContact OE2-ND1 3.72Å; E129-H145 PolarHBondContact OE2-ND1 2.9Å; H145-E147 IonicContact NE2-OE2 3.79Å; H145-T156 CarbonylContact O-C 3.51Å; H145-T156 VanDerWaalsContact O-CA 3.25Å; H145-T156 WeakPolarHBondContact O-CA 3.27Å; H145-K157 HydrophobicContact CB-CB 4.27Å; H145-K157 PolarHBondContact N-O 3.02Å; H145-K157 PolarHBondContact O-N 3.27Å |
| 146 | E | 95.7 | Very high | 94.9 | Very high | 119 Ų | 119 | 81.2 Ų | 81.2 | 56% | 0.556 | 43% | 0.427 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -130.3 | 121.4 | 172.3 | -173.5 | 179.4 | 105.3 | 0 | 0 | 109.2 | I154 V155 | E146-I154 HydrophobicContact CG-CG2 3.47Å; E146-I154 VanDerWaalsContact CG-CG2 3.47Å; E146-V155 CarbonylContact C-O 3.56Å; E146-V155 WeakPolarHBondContact CA-O 3.44Å |
| 147 | E | 93.9 | Very high | 95 | Very high | 102 Ų | 102 | 79.6 Ų | 79.6 | 48% | 0.477 | 42% | 0.415 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.9 | 125.9 | 178 | -177.6 | 178.7 | -177.8 | 0 | 0 | 109.7 | H145 I154 V155 | H145-E147 IonicContact NE2-OE2 3.79Å; E147-I154 CarbonylContact O-C 3.59Å; E147-I154 WeakPolarHBondContact O-CA 3.5Å; E147-V155 HydrophobicContact CB-CB 4.45Å; E147-V155 PolarHBondContact N-O 3.13Å; E147-V155 PolarHBondContact O-N 3.04Å |
| 148 | K | 94.6 | Very high | 95.2 | Very high | 162 Ų | 162 | 84.2 Ų | 84.2 | 70% | 0.704 | 43% | 0.431 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -86.1 | 121.4 | 172 | -65.4 | -177.3 | -179.8 | 178.3 | 0 | 108.6 | I154 | K148-I154 HydrophobicContact CG-CG1 4.49Å |
| 149 | Q | 93.3 | Very high | 95.2 | Very high | 97 Ų | 97 | 83.9 Ų | 83.9 | 45% | 0.453 | 43% | 0.429 | S | S | . | . | trans | -79.1 | 152.3 | 173.7 | -59.6 | -174.9 | 7.4 | 0 | 0 | 110.4 | E151 G152 G153 V155 | Q149-E151 VanDerWaalsContact C-N 3.27Å; Q149-E151 PolarHBondContact O-N 2.87Å; Q149-G152 PolarHBondContact O-N 2.98Å; Q149-G153 PolarHBondContact N-O 2.89Å; Q149-V155 HydrophobicContact CG-CG2 4.02Å | ||
| 150 | E | 90.3 | Very high | 95.1 | Very high | 205 Ų | 205 | 88.4 Ų | 88.4 | 96% | 0.958 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60 | -35 | -179.7 | -172.3 | 176.3 | -174.7 | 0 | 0 | 112.9 | G152 | E150-G152 PolarHBondContact O-N 2.76Å; E150-G152 VanDerWaalsContact O-N 3.13Å |
| 151 | E | 92.7 | Very high | 95.1 | Very high | 188 Ų | 188 | 88.1 Ų | 88.1 | 88% | 0.879 | 46% | 0.455 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.4 | 7.7 | 178 | -153.4 | -179.8 | 168.2 | 0 | 0 | 113.4 | Q149 | Q149-E151 VanDerWaalsContact C-N 3.27Å; Q149-E151 PolarHBondContact O-N 2.87Å |
| 152 | G | 87.9 | Confident | 95 | Very high | 69 Ų | 69 | 93.5 Ų | 93.5 | 71% | 0.711 | 48% | 0.478 | S | S | * | . | S | Bend | trans | 86.2 | 9.5 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | Q149 E150 | Q149-G152 PolarHBondContact O-N 2.98Å; E150-G152 PolarHBondContact O-N 2.76Å; E150-G152 VanDerWaalsContact O-N 3.13Å |
| 153 | G | 92.3 | Very high | 95 | Very high | 28 Ų | 28 | 93.3 Ų | 93.3 | 29% | 0.289 | 48% | 0.475 | S | S | . | . | trans | -78.5 | 158.7 | 171.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q149 | Q149-G153 PolarHBondContact N-O 2.89Š| ||
| 154 | I | 94.5 | Very high | 95 | Very high | 100 Ų | 100 | 99.1 Ų | 99.1 | 51% | 0.513 | 50% | 0.502 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.5 | 128.8 | 172.5 | -56.8 | 175.2 | 0 | 0 | 0 | 108.6 | E146 E147 K148 | E146-I154 HydrophobicContact CG-CG2 3.47Å; E146-I154 VanDerWaalsContact CG-CG2 3.47Å; E147-I154 CarbonylContact O-C 3.59Å; E147-I154 WeakPolarHBondContact O-CA 3.5Å; K148-I154 HydrophobicContact CG-CG1 4.49Å |
| 155 | V | 94.1 | Very high | 94.9 | Very high | 41 Ų | 41 | 91.5 Ų | 91.5 | 25% | 0.248 | 47% | 0.469 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.8 | 119.5 | 170.8 | -176 | 0 | 0 | 0 | 0 | 108.5 | E146 E147 Q149 K157 | E146-V155 CarbonylContact C-O 3.56Å; E146-V155 WeakPolarHBondContact CA-O 3.44Å; E147-V155 HydrophobicContact CB-CB 4.45Å; E147-V155 PolarHBondContact N-O 3.13Å; E147-V155 PolarHBondContact O-N 3.04Å; Q149-V155 HydrophobicContact CG-CG2 4.02Å; V155-K157 HydrophobicContact CG1-CG 4.35Å |
| 156 | T | 95.6 | Very high | 94.7 | Very high | 92 Ų | 92 | 91.3 Ų | 91.3 | 56% | 0.564 | 47% | 0.47 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -111.9 | 126.7 | 172.4 | -48.2 | 0 | 0 | 0 | 0 | 109.7 | H145 | H145-T156 CarbonylContact O-C 3.51Å; H145-T156 VanDerWaalsContact O-CA 3.25Å; H145-T156 WeakPolarHBondContact O-CA 3.27Å |
| 157 | K | 95.9 | Very high | 94.5 | Very high | 82 Ų | 82 | 92.7 Ų | 92.7 | 36% | 0.357 | 49% | 0.487 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.6 | 136.2 | 171.3 | -60.3 | 176.4 | -176.7 | 167.3 | 0 | 109.4 | F125 K144 H145 V155 | F125-K157 HydrophobicContact CE1-CB 4.12Å; F125-K157 HydrophobicContact CZ-CB 3.98Å; K144-K157 WeakPolarHBondContact CA-O 3.41Å; H145-K157 HydrophobicContact CB-CB 4.27Å; H145-K157 PolarHBondContact N-O 3.02Å; H145-K157 PolarHBondContact O-N 3.27Å; V155-K157 HydrophobicContact CG1-CG 4.35Å |
| 158 | N | 96.6 | Very high | 94.4 | Very high | 135 Ų | 135 | 91.2 Ų | 91.2 | 72% | 0.722 | 48% | 0.482 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -123.3 | 143 | 172 | 56.6 | 58.4 | 0 | 0 | 0 | 109.8 | G143 | G143-N158 CarbonylContact O-C 3.58Å; G143-N158 WeakPolarHBondContact O-CA 3.15Å |
| 159 | F | 96.6 | Very high | 94.3 | Very high | 51 Ų | 51 | 83.7 Ų | 83.7 | 22% | 0.224 | 45% | 0.449 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.2 | 138 | 178.4 | 173.5 | -105.4 | 0 | 0 | 0 | 109.2 | V120 V122 F125 V141 S142 G143 K161 | V120-F159 HydrophobicContact CG1-CE1 4.07Å; V120-F159 HydrophobicContact CG1-CZ 3.65Å; V122-F159 HydrophobicContact CG1-CE1 4.18Å; F125-F159 HydrophobicContact CE1-CB 4.24Å; F125-F159 HydrophobicContact CE2-CB 3.64Å; F125-F159 HydrophobicContact CE2-CG 4.32Å; F125-F159 HydrophobicContact CZ-CB 3.45Å; F125-F159 VanDerWaalsContact CZ-CB 3.45Å; V141-F159 HydrophobicContact CB-CE1 4.13Å; V141-F159 HydrophobicContact CG1-CD1 4.42Å; V141-F159 HydrophobicContact CG1-CE1 3.83Å; S142-F159 CarbonylContact C-O 3.55Å; S142-F159 WeakPolarHBondContact CA-O 3.09Å; G143-F159 PolarHBondContact N-O 3.1Å; G143-F159 PolarHBondContact O-N 3.41Å; F159-K161 HydrophobicContact CE1-CB 3.81Å; F159-K161 HydrophobicContact CE2-CB 3.96Å; F159-K161 HydrophobicContact CZ-CB 3.32Å; F159-K161 HydrophobicContact CZ-CD 3.9Å; F159-K161 HydrophobicContact CZ-CG 4.24Å |
| 160 | T | 97.1 | Very high | 94.2 | Very high | 96 Ų | 96 | 81.2 Ų | 81.2 | 59% | 0.589 | 44% | 0.44 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -147.8 | 122.8 | 169.2 | -54.6 | 0 | 0 | 0 | 0 | 108.5 | E140 V141 | E140-T160 HydrophobicContact CG-CG2 3.99Å; V141-T160 CarbonylContact O-C 3.58Å; V141-T160 VanDerWaalsContact O-CA 3.29Å; V141-T160 WeakPolarHBondContact O-CA 3.4Å |
| 161 | K | 97 | Very high | 94.3 | Very high | 67 Ų | 67 | 74.2 Ų | 74.2 | 29% | 0.291 | 41% | 0.412 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.3 | 120.4 | 178 | -175.5 | 177.8 | -176.3 | -177.8 | 0 | 109.3 | V120 E140 V141 F159 I163 | V120-K161 HydrophobicContact CB-CD 4.46Å; V120-K161 HydrophobicContact CG1-CD 3.62Å; V120-K161 HydrophobicContact CG2-CD 4.02Å; E140-K161 WeakPolarHBondContact CA-O 3.37Å; V141-K161 PolarHBondContact N-O 2.87Å; V141-K161 PolarHBondContact O-N 2.8Å; F159-K161 HydrophobicContact CE1-CB 3.81Å; F159-K161 HydrophobicContact CE2-CB 3.96Å; F159-K161 HydrophobicContact CZ-CB 3.32Å; F159-K161 HydrophobicContact CZ-CD 3.9Å; F159-K161 HydrophobicContact CZ-CG 4.24Å; K161-I163 HydrophobicContact CG-CG1 4.35Å |
| 162 | K | 97.5 | Very high | 94.3 | Very high | 113 Ų | 113 | 72.7 Ų | 72.7 | 49% | 0.491 | 41% | 0.409 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103 | 128.4 | 177.9 | -170.1 | 170.9 | 176.6 | 171.9 | 0 | 109.6 | F138 V139 | F138-K162 HydrophobicContact CB-CD 4.25Å; F138-K162 VanDerWaalsContact CB-CE 3.44Å; F138-K162 HydrophobicContact CB-CG 3.76Å; F138-K162 HydrophobicContact CD1-CD 3.99Å; F138-K162 HydrophobicContact CD1-CG 3.58Å; F138-K162 HydrophobicContact CE1-CD 4.48Å; F138-K162 HydrophobicContact CE1-CG 4.39Å; F138-K162 HydrophobicContact CG-CD 4.05Å; F138-K162 HydrophobicContact CG-CG 3.84Å; V139-K162 CarbonylContact O-C 3.56Å; V139-K162 WeakPolarHBondContact O-CA 3.43Å |
| 163 | I | 97.3 | Very high | 94.6 | Very high | 20 Ų | 20 | 71.5 Ų | 71.5 | 10% | 0.103 | 39% | 0.388 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.9 | 124.6 | -176.4 | -61.6 | 158.7 | 0 | 0 | 0 | 107.3 | W116 V118 V120 F138 V139 K161 I186 | W116-I163 HydrophobicContact CH2-CG2 4.05Å; W116-I163 HydrophobicContact CZ2-CG2 3.74Å; V118-I163 HydrophobicContact CG1-CD1 3.81Å; V118-I163 HydrophobicContact CG1-CG1 4.48Å; V118-I163 HydrophobicContact CG1-CG2 4.4Å; V118-I163 HydrophobicContact CG2-CG2 4.17Å; V120-I163 HydrophobicContact CG2-CD1 3.83Å; F138-I163 CarbonylContact C-O 3.51Å; F138-I163 WeakPolarHBondContact CA-O 3.34Å; F138-I163 WeakPolarHBondContact CB-O 3.4Å; V139-I163 PolarHBondContact N-O 2.79Å; V139-I163 PolarHBondContact O-N 3.4Å; K161-I163 HydrophobicContact CG-CG1 4.35Å; I163-I186 HydrophobicContact CD1-CD1 3.78Å |
| 164 | Q | 96.8 | Very high | 94.8 | Very high | 124 Ų | 124 | 71.6 Ų | 71.6 | 58% | 0.579 | 38% | 0.383 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -75.4 | 131.8 | 176.8 | -169.8 | 173.2 | -27.8 | 0 | 0 | 110.1 | F138 | F138-Q164 VanDerWaalsContact CD1-CA 3.46Å; F138-Q164 HydrophobicContact CD1-CB 3.82Å; F138-Q164 HydrophobicContact CD1-CG 4.24Å; F138-Q164 HydrophobicContact CE1-CB 3.64Å; F138-Q164 HydrophobicContact CE1-CG 3.85Å; F138-Q164 HydrophobicContact CZ-CG 4.26Å |
| 165 | I | 95.6 | Very high | 94.9 | Very high | 11 Ų | 11 | 72.6 Ų | 72.6 | 6% | 0.056 | 38% | 0.383 | C | S | . | . | P | Polyproline II helix | trans | -83.9 | 126.6 | 173.2 | -56.9 | 173.5 | 0 | 0 | 0 | 107.1 | W116 T134 G137 V139 V169 P171 V174 | W116-I165 HydrophobicContact CH2-CG1 4.08Å; T134-I165 HydrophobicContact CG2-CD1 3.66Å; G137-I165 WeakPolarHBondContact O-CB 3.34Å; G137-I165 PolarHBondContact O-N 2.78Å; V139-I165 HydrophobicContact CG2-CD1 3.68Å; V139-I165 HydrophobicContact CG2-CG1 3.79Å; I165-V169 HydrophobicContact CG2-CB 3.71Å; I165-V169 HydrophobicContact CG2-CG1 3.68Å; I165-P171 HydrophobicContact CD1-CB 4.01Å; I165-V174 HydrophobicContact CD1-CG2 4.13Å |
| 166 | P | 94.4 | Very high | 95 | Very high | 15 Ų | 15 | 72.3 Ų | 72.3 | 10% | 0.097 | 39% | 0.385 | C | S | . | . | P | Polyproline II helix | trans | -58.2 | 151.3 | 171.8 | -24.2 | 35.4 | 0 | 0 | 0 | 112.1 | D168 V169 | P166-D168 WeakPolarHBondContact CB-OD1 3.29Å; P166-D168 PolarHBondContact O-N 3.49Å; P166-V169 HydrophobicContact CB-CG2 4Å; P166-V169 HydrophobicContact CG-CG2 4.12Å; P166-V169 PolarHBondContact O-N 3.31Å; P166-V169 VanDerWaalsContact O-N 3.13Å |
| 167 | T | 91 | Very high | 95.1 | Very high | 149 Ų | 149 | 70 Ų | 70 | 91% | 0.914 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.9 | -22.5 | -177.9 | 39.2 | 0 | 0 | 0 | 0 | 114.2 | V169 | T167-V169 VanDerWaalsContact C-N 3.3Š|
| 168 | D | 90.5 | Very high | 95.2 | Very high | 70 Ų | 70 | 69.1 Ų | 69.1 | 37% | 0.374 | 37% | 0.372 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.9 | 1.6 | 177.6 | 55.9 | -46.6 | 0 | 0 | 0 | 113.2 | P166 Q190 T191 | P166-D168 WeakPolarHBondContact CB-OD1 3.29Å; P166-D168 PolarHBondContact O-N 3.49Å; D168-Q190 CarbonylContact O-C 3.47Å; D168-Q190 VanDerWaalsContact O-CA 3.22Å; D168-Q190 WeakPolarHBondContact O-CA 3.37Å; D168-T191 PolarHBondContact O-N 3.43Å |
| 169 | V | 92.5 | Very high | 95.2 | Very high | 4 Ų | 4 | 64.1 Ų | 64.1 | 2% | 0.024 | 35% | 0.347 | C | S | . | . | B | Isolated β-bridge | trans | -109 | 134.2 | 179.9 | 174.6 | 0 | 0 | 0 | 0 | 110.2 | W116 I165 P166 T167 P171 A188 | W116-V169 HydrophobicContact CB-CG1 4.11Å; W116-V169 HydrophobicContact CB-CG2 3.57Å; W116-V169 HydrophobicContact CD2-CG1 4.32Å; W116-V169 HydrophobicContact CE3-CG1 4.16Å; W116-V169 HydrophobicContact CG-CG1 4.36Å; W116-V169 HydrophobicContact CG-CG2 3.88Å; I165-V169 HydrophobicContact CG2-CB 3.71Å; I165-V169 HydrophobicContact CG2-CG1 3.68Å; P166-V169 HydrophobicContact CB-CG2 4Å; P166-V169 HydrophobicContact CG-CG2 4.12Å; P166-V169 PolarHBondContact O-N 3.31Å; P166-V169 VanDerWaalsContact O-N 3.13Å; T167-V169 VanDerWaalsContact C-N 3.3Å; V169-P171 VanDerWaalsContact O-CD 3.28Å; V169-P171 WeakPolarHBondContact O-CD 3.41Å; V169-A188 HydrophobicContact CG1-CB 3.45Å; V169-A188 VanDerWaalsContact CG1-CB 3.45Å |
| 170 | D | 91.6 | Very high | 95.2 | Very high | 46 Ų | 46 | 68.1 Ų | 68.1 | 25% | 0.246 | 38% | 0.379 | C | S | . | . | trans | -79.4 | 112.7 | 178.1 | -177.6 | -2.5 | 0 | 0 | 0 | 110.2 | L172 T173 R189 T191 | D170-L172 PolarHBondContact O-N 2.8Å; D170-L172 WeakPolarHBondContact OD1-CB 3.49Å; D170-L172 PolarHBondContact OD1-N 2.96Å; D170-T173 HydrophobicContact CB-CG2 3.91Å; D170-T173 PolarHBondContact O-N 2.86Å; D170-T173 VanDerWaalsContact O-N 3.08Å; D170-T173 PolarHBondContact O-OG1 2.84Å; D170-T173 WeakPolarHBondContact OD2-CG2 3.29Å; D170-R189 PolarHBondContact N-O 3.2Å; D170-T191 PolarHBondContact N-OG1 3.36Å | ||
| 171 | P | 93.1 | Very high | 95.1 | Very high | 57 Ų | 57 | 71.1 Ų | 71.1 | 37% | 0.37 | 39% | 0.386 | S | S | . | . | G | 310 helix | trans | -63.7 | -20.9 | -179.7 | 28.3 | -36.4 | 0 | 0 | 0 | 113.4 | T134 I165 V169 T173 V174 | T134-P171 HydrophobicContact CG2-CB 3.97Å; I165-P171 HydrophobicContact CD1-CB 4.01Å; V169-P171 VanDerWaalsContact O-CD 3.28Å; V169-P171 WeakPolarHBondContact O-CD 3.41Å; P171-T173 VanDerWaalsContact C-N 3.28Å; P171-V174 VanDerWaalsContact O-CG2 3.29Å; P171-V174 WeakPolarHBondContact O-CG2 3.28Å |
| 172 | L | 92.8 | Very high | 95.1 | Very high | 157 Ų | 157 | 68.4 Ų | 68.4 | 82% | 0.822 | 38% | 0.377 | S | S | * | . | G | 310 helix | trans | -75.7 | -20.6 | 178 | -59 | 178.5 | 0 | 0 | 0 | 112.4 | D170 V174 | D170-L172 PolarHBondContact O-N 2.8Å; D170-L172 WeakPolarHBondContact OD1-CB 3.49Å; D170-L172 PolarHBondContact OD1-N 2.96Å; L172-V174 VanDerWaalsContact C-N 3.32Å |
| 173 | T | 94 | Very high | 95.1 | Very high | 44 Ų | 44 | 65.1 Ų | 65.1 | 27% | 0.27 | 37% | 0.366 | S | S | . | . | G | 310 helix | trans | -91.4 | 5.4 | 179.2 | 67.5 | 0 | 0 | 0 | 0 | 113.3 | D170 P171 F175 R189 | D170-T173 HydrophobicContact CB-CG2 3.91Å; D170-T173 PolarHBondContact O-N 2.86Å; D170-T173 VanDerWaalsContact O-N 3.08Å; D170-T173 PolarHBondContact O-OG1 2.84Å; D170-T173 WeakPolarHBondContact OD2-CG2 3.29Å; P171-T173 VanDerWaalsContact C-N 3.28Å; T173-F175 PolarHBondContact O-N 2.9Å; T173-R189 HydrophobicContact CG2-CB 4.21Å; T173-R189 PolarHBondContact OG1-N 2.98Å; T173-R189 PolarHBondContact OG1-O 3.47Å |
| 174 | V | 96.3 | Very high | 95.2 | Very high | 30 Ų | 30 | 64.6 Ų | 64.6 | 18% | 0.182 | 36% | 0.364 | C | S | . | . | trans | -64.9 | 123 | 178.3 | 174.9 | 0 | 0 | 0 | 0 | 110 | T134 V139 I165 P171 L172 I186 E187 A188 | T134-V174 HydrophobicContact CG2-CG2 4.4Å; V139-V174 HydrophobicContact CG2-CG1 3.96Å; V139-V174 HydrophobicContact CG2-CG2 4.27Å; I165-V174 HydrophobicContact CD1-CG2 4.13Å; P171-V174 VanDerWaalsContact O-CG2 3.29Å; P171-V174 WeakPolarHBondContact O-CG2 3.28Å; L172-V174 VanDerWaalsContact C-N 3.32Å; V174-I186 HydrophobicContact CG1-CG2 3.94Å; V174-E187 CarbonylContact C-O 3.54Å; V174-E187 WeakPolarHBondContact CA-O 3.44Å; V174-A188 HydrophobicContact CB-CB 4.49Å; V174-A188 HydrophobicContact CG2-CB 3.84Å | ||
| 175 | F | 96.4 | Very high | 95.2 | Very high | 120 Ų | 120 | 60.4 Ų | 60.4 | 53% | 0.526 | 35% | 0.345 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.3 | 150.6 | 173.7 | 179.1 | -101.8 | 0 | 0 | 0 | 110 | T173 I186 E187 | T173-F175 PolarHBondContact O-N 2.9Å; F175-I186 WeakPolarHBondContact O-CA 3.4Å; F175-E187 HydrophobicContact CB-CG 4.22Å; F175-E187 HydrophobicContact CD1-CG 4.19Å; F175-E187 WeakPolarHBondContact CD1-OE1 2.98Å; F175-E187 PolarHBondContact N-O 2.73Å; F175-E187 PolarHBondContact O-N 2.93Å |
| 176 | A | 96.8 | Very high | 95.3 | Very high | 35 Ų | 35 | 59.9 Ų | 59.9 | 29% | 0.289 | 34% | 0.343 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.6 | 136.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | V132 L184 I185 I186 | V132-A176 HydrophobicContact CG1-CB 4.47Å; V132-A176 HydrophobicContact CG2-CB 4.39Å; A176-L184 HydrophobicContact CB-CD1 4.24Å; A176-I185 CarbonylContact C-O 3.46Å; A176-I185 VanDerWaalsContact CA-O 3.29Å; A176-I185 WeakPolarHBondContact CA-O 3.22Å; A176-I186 HydrophobicContact CB-CG1 4.33Å |
| 177 | S | 97.3 | Very high | 95.4 | Very high | 44 Ų | 44 | 62.5 Ų | 62.5 | 31% | 0.308 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.3 | 147.3 | 174.5 | 57.1 | 0 | 0 | 0 | 0 | 110.2 | L184 I185 | S177-L184 CarbonylContact O-C 3.55Å; S177-L184 WeakPolarHBondContact O-CA 3.46Å; S177-I185 PolarHBondContact N-O 3.38Å; S177-I185 PolarHBondContact O-N 2.98Å |
| 178 | L | 97.8 | Very high | 95.6 | Very high | 64 Ų | 64 | 55.6 Ų | 55.6 | 34% | 0.335 | 31% | 0.311 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.5 | 124.5 | 179.6 | 180 | 62.5 | 0 | 0 | 0 | 109.5 | V122 P127 L130 L184 | V122-L178 HydrophobicContact CG2-CD1 3.52Å; P127-L178 HydrophobicContact CB-CD2 3.72Å; P127-L178 HydrophobicContact CG-CD2 3.63Å; L130-L178 HydrophobicContact CD1-CD2 4.28Å; L178-L184 HydrophobicContact CB-CD1 4.37Å; L178-L184 HydrophobicContact CD1-CB 4.32Å |
| 179 | S | 97.4 | Very high | 95.7 | Very high | 29 Ų | 29 | 60.8 Ų | 60.8 | 20% | 0.203 | 33% | 0.326 | C | S | . | . | trans | -76.6 | 155.4 | 173.5 | 77.8 | 0 | 0 | 0 | 0 | 111.5 | E181 G182 V183 | S179-E181 PolarHBondContact O-N 3.17Å; S179-G182 PolarHBondContact O-N 3.12Å; S179-V183 PolarHBondContact N-O 3.34Å; S179-V183 WeakPolarHBondContact OG-CB 3.45Å; S179-V183 PolarHBondContact OG-N 3.47Å; S179-V183 PolarHBondContact OG-O 3.19Å | ||
| 180 | P | 95.9 | Very high | 95.6 | Very high | 136 Ų | 136 | 63.4 Ų | 63.4 | 88% | 0.883 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.3 | -29.5 | 173.7 | -25.1 | 35 | 0 | 0 | 0 | 113.7 | G182 | P180-G182 PolarHBondContact O-N 3.3Š|
| 181 | E | 95.8 | Very high | 95.2 | Very high | 158 Ų | 158 | 64.7 Ų | 64.7 | 74% | 0.738 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.1 | 4.8 | 177.3 | -55.2 | -54.4 | 146.6 | 0 | 0 | 113.5 | S179 | S179-E181 PolarHBondContact O-N 3.17Š|
| 182 | G | 96.8 | Very high | 94.4 | Very high | 11 Ų | 11 | 64.7 Ų | 64.7 | 11% | 0.113 | 35% | 0.348 | C | S | . | . | S | Bend | trans | 76.9 | 30 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | N121 V122 H123 S179 P180 | N121-G182 PolarHBondContact OD1-O 3.21Å; V122-G182 CarbonylContact C-O 3.59Å; V122-G182 WeakPolarHBondContact CA-O 3.4Å; V122-G182 VanDerWaalsContact CG2-O 3.27Å; V122-G182 WeakPolarHBondContact CG2-O 3.25Å; V122-G182 PolarHBondContact N-O 3.11Å; H123-G182 PolarHBondContact N-O 3.23Å; H123-G182 VanDerWaalsContact N-O 3.14Å; S179-G182 PolarHBondContact O-N 3.12Å; P180-G182 PolarHBondContact O-N 3.3Å |
| 183 | V | 97.9 | Very high | 93.4 | Very high | 43 Ų | 43 | 61.2 Ų | 61.2 | 26% | 0.261 | 33% | 0.334 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.8 | 114.3 | 173.8 | -174.6 | 0 | 0 | 0 | 0 | 109.4 | C119 S179 I185 | C119-V183 HydrophobicContact CB-CG1 3.94Å; S179-V183 PolarHBondContact N-O 3.34Å; S179-V183 WeakPolarHBondContact OG-CB 3.45Å; S179-V183 PolarHBondContact OG-N 3.47Å; S179-V183 PolarHBondContact OG-O 3.19Å; V183-I185 HydrophobicContact CG1-CG1 4.43Å |
| 184 | L | 98.3 | Very high | 92.1 | Very high | 10 Ų | 10 | 67.9 Ų | 67.9 | 5% | 0.052 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.4 | 120.9 | 171.6 | -174.8 | 74.9 | 0 | 0 | 0 | 109.3 | C119 V120 V122 V132 V141 A176 S177 L178 I186 | C119-L184 CarbonylContact C-O 3.47Å; C119-L184 WeakPolarHBondContact CA-O 3.15Å; V120-L184 HydrophobicContact CB-CB 4.31Å; V120-L184 PolarHBondContact N-O 3.46Å; V120-L184 PolarHBondContact O-N 3.2Å; V122-L184 HydrophobicContact CG1-CB 4.28Å; V122-L184 HydrophobicContact CG2-CB 3.91Å; V132-L184 HydrophobicContact CG2-CD2 3.84Å; V141-L184 HydrophobicContact CB-CD2 4.3Å; V141-L184 HydrophobicContact CG1-CD2 3.47Å; V141-L184 VanDerWaalsContact CG1-CD2 3.47Å; V141-L184 HydrophobicContact CG2-CD2 3.78Å; A176-L184 HydrophobicContact CB-CD1 4.24Å; S177-L184 CarbonylContact O-C 3.55Å; S177-L184 WeakPolarHBondContact O-CA 3.46Å; L178-L184 HydrophobicContact CB-CD1 4.37Å; L178-L184 HydrophobicContact CD1-CB 4.32Å; L184-I186 HydrophobicContact CD2-CD1 4.28Å; L184-I186 HydrophobicContact CD2-CG1 4.34Å; L184-I186 HydrophobicContact CG-CG1 4.36Å |
| 185 | I | 97.9 | Very high | 90.6 | Very high | 36 Ų | 36 | 76 Ų | 76 | 19% | 0.185 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106 | 120.6 | 179.7 | -61.2 | 163.9 | 0 | 0 | 0 | 107.4 | K117 A176 S177 V183 | K117-I185 HydrophobicContact CD-CG2 4.33Å; K117-I185 HydrophobicContact CG-CG2 4.19Å; A176-I185 CarbonylContact C-O 3.46Å; A176-I185 VanDerWaalsContact CA-O 3.29Å; A176-I185 WeakPolarHBondContact CA-O 3.22Å; S177-I185 PolarHBondContact N-O 3.38Å; S177-I185 PolarHBondContact O-N 2.98Å; V183-I185 HydrophobicContact CG1-CG1 4.43Å |
| 186 | I | 97.7 | Very high | 89.1 | Confident | 0 Ų | 0 | 76.2 Ų | 76.2 | 0% | 0 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.9 | 127.4 | 178 | -60.2 | 161.3 | 0 | 0 | 0 | 107.3 | W116 K117 V118 V120 V139 V141 I163 V174 F175 A176 L184 | W116-I186 HydrophobicContact CH2-CG2 4.32Å; W116-I186 HydrophobicContact CZ3-CG2 3.86Å; K117-I186 CarbonylContact C-O 3.45Å; K117-I186 VanDerWaalsContact CA-O 3.3Å; K117-I186 WeakPolarHBondContact CA-O 3.3Å; V118-I186 PolarHBondContact N-O 2.95Å; V118-I186 PolarHBondContact O-N 3.27Å; V120-I186 HydrophobicContact CG2-CD1 4.2Å; V139-I186 HydrophobicContact CG1-CD1 3.96Å; V139-I186 HydrophobicContact CG1-CG2 4.29Å; V139-I186 HydrophobicContact CG2-CG2 4.33Å; V141-I186 HydrophobicContact CG2-CD1 3.63Å; I163-I186 HydrophobicContact CD1-CD1 3.78Å; V174-I186 HydrophobicContact CG1-CG2 3.94Å; F175-I186 WeakPolarHBondContact O-CA 3.4Å; A176-I186 HydrophobicContact CB-CG1 4.33Å; L184-I186 HydrophobicContact CD2-CD1 4.28Å; L184-I186 HydrophobicContact CD2-CG1 4.34Å; L184-I186 HydrophobicContact CG-CG1 4.36Å |
| 187 | E | 96.6 | Very high | 87.4 | Confident | 69 Ų | 69 | 81.7 Ų | 81.7 | 32% | 0.322 | 41% | 0.408 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.6 | 149.1 | -179.3 | 64.4 | -170.9 | 177.9 | 0 | 0 | 112.1 | W116 V174 F175 | W116-E187 CarbonylContact O-C 3.54Å; W116-E187 WeakPolarHBondContact O-CA 3.36Å; V174-E187 CarbonylContact C-O 3.54Å; V174-E187 WeakPolarHBondContact CA-O 3.44Å; F175-E187 HydrophobicContact CB-CG 4.22Å; F175-E187 HydrophobicContact CD1-CG 4.19Å; F175-E187 WeakPolarHBondContact CD1-OE1 2.98Å; F175-E187 PolarHBondContact N-O 2.73Å; F175-E187 PolarHBondContact O-N 2.93Å |
| 188 | A | 95.1 | Very high | 85.6 | Confident | 4 Ų | 4 | 82.9 Ų | 82.9 | 3% | 0.033 | 42% | 0.416 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.7 | 156.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | P115 W116 V169 V174 | P115-A188 CarbonylContact C-O 3.59Å; P115-A188 WeakPolarHBondContact CA-O 3.49Å; P115-A188 WeakPolarHBondContact CB-O 3.37Å; W116-A188 HydrophobicContact CE3-CB 3.69Å; W116-A188 HydrophobicContact CZ3-CB 4.28Å; W116-A188 PolarHBondContact N-O 2.8Å; W116-A188 PolarHBondContact O-N 3.32Å; V169-A188 HydrophobicContact CG1-CB 3.45Å; V169-A188 VanDerWaalsContact CG1-CB 3.45Å; V174-A188 HydrophobicContact CB-CB 4.49Å; V174-A188 HydrophobicContact CG2-CB 3.84Å |
| 189 | R | 92.1 | Very high | 83.6 | Confident | 180 Ų | 180 | 84.6 Ų | 84.6 | 68% | 0.679 | 43% | 0.434 | S | S | * | . | P | Polyproline II helix | trans | -85.5 | 146.6 | 178.3 | -60.7 | -176.7 | 67.9 | 178.7 | -0 | 110.4 | D170 T173 | D170-R189 PolarHBondContact N-O 3.2Å; T173-R189 HydrophobicContact CG2-CB 4.21Å; T173-R189 PolarHBondContact OG1-N 2.98Å; T173-R189 PolarHBondContact OG1-O 3.47Å |
| 190 | Q | 89.5 | Confident | 81.6 | Confident | 58 Ų | 58 | 92.2 Ų | 92.2 | 27% | 0.271 | 47% | 0.466 | S | S | . | . | B | Isolated β-bridge | trans | -71 | 137.7 | 168.4 | -64.9 | 179.2 | 43.7 | 0 | 0 | 109.6 | T110 E114 D168 | T110-Q190 PolarHBondContact OG1-NE2 3.34Å; E114-Q190 PolarHBondContact O-NE2 3.36Å; D168-Q190 CarbonylContact O-C 3.47Å; D168-Q190 VanDerWaalsContact O-CA 3.22Å; D168-Q190 WeakPolarHBondContact O-CA 3.37Å |
| 191 | T | 84.1 | Confident | 79.3 | Confident | 73 Ų | 73 | 94.6 Ų | 94.6 | 45% | 0.448 | 47% | 0.465 | S | S | . | . | P | Polyproline II helix | trans | -67.6 | 121.7 | 172.3 | -53.7 | 0 | 0 | 0 | 0 | 108.1 | D168 D170 | D168-T191 PolarHBondContact O-N 3.43Å; D170-T191 PolarHBondContact N-OG1 3.36Å |
| 192 | P | 75.4 | Confident | 76.8 | Confident | 58 Ų | 58 | 92.1 Ų | 92.1 | 38% | 0.377 | 47% | 0.466 | S | S | . | . | P | Polyproline II helix | trans | -64.5 | 145.8 | -179.6 | -15.8 | 29 | 0 | 0 | 0 | 110.3 | Y194 L196 F197 | P192-Y194 PolarHBondContact O-N 3.44Å; P192-L196 HydrophobicContact CB-CD1 4.45Å; P192-F197 HydrophobicContact CB-CD2 4.39Å; P192-F197 HydrophobicContact CB-CE2 3.56Å; P192-F197 HydrophobicContact CB-CZ 4.16Å; P192-F197 HydrophobicContact CG-CE2 3.53Å; P192-F197 HydrophobicContact CG-CZ 3.78Å |
| 193 | P | 71.9 | Confident | 74.4 | Confident | 83 Ų | 83 | 97.6 Ų | 97.6 | 54% | 0.539 | 50% | 0.499 | S | S | . | . | P | Polyproline II helix | trans | -59.3 | 131.4 | 172.9 | 23.5 | -32.9 | 0 | 0 | 0 | 110.2 | Y195 L196 | P193-Y195 PolarHBondContact O-N 3.07Å; P193-L196 HydrophobicContact CG-CD1 3.68Å; P193-L196 HydrophobicContact CG-CG 4.23Å; P193-L196 WeakPolarHBondContact O-CB 3.44Å; P193-L196 PolarHBondContact O-N 3.15Å |
| 194 | Y | 66.4 | Low | 71.9 | Confident | 185 Ų | 185 | 99.1 Ų | 99.1 | 73% | 0.725 | 52% | 0.524 | S | S | * | . | G | 310 helix | trans | -50.3 | -30.1 | -173.5 | -173.2 | -95.6 | 0 | 0 | 0 | 114.8 | P192 L196 F197 S198 | P192-Y194 PolarHBondContact O-N 3.44Å; Y194-L196 PolarHBondContact O-N 2.65Å; Y194-F197 PolarHBondContact O-N 3.3Å; Y194-S198 PolarHBondContact O-OG 3.47Å |
| 195 | Y | 66.4 | Low | 69.1 | Low | 199 Ų | 199 | 102.4 Ų | 102.4 | 78% | 0.78 | 56% | 0.56 | S | S | * | * | G | 310 helix | trans | -64.2 | -23.1 | 177.6 | -57.5 | -73.1 | 0 | 0 | 0 | 114.3 | P193 F197 S198 | P193-Y195 PolarHBondContact O-N 3.07Å; Y195-F197 VanDerWaalsContact C-N 3.28Å; Y195-F197 PolarHBondContact O-N 3.22Å; Y195-S198 PolarHBondContact O-N 2.94Å |
| 196 | L | 64.6 | Low | 66.4 | Low | 125 Ų | 125 | 108.1 Ų | 108.1 | 65% | 0.654 | 59% | 0.586 | S | S | * | * | G | 310 helix | trans | -71 | -24.2 | 176.7 | -78.1 | 167.6 | 0 | 0 | 0 | 112.9 | P192 P193 Y194 | P192-L196 HydrophobicContact CB-CD1 4.45Å; P193-L196 HydrophobicContact CG-CD1 3.68Å; P193-L196 HydrophobicContact CG-CG 4.23Å; P193-L196 WeakPolarHBondContact O-CB 3.44Å; P193-L196 PolarHBondContact O-N 3.15Å; Y194-L196 PolarHBondContact O-N 2.65Å |
| 197 | F | 61.2 | Low | 63.9 | Low | 151 Ų | 151 | 116 Ų | 116 | 66% | 0.662 | 63% | 0.626 | S | S | * | * | G | 310 helix | trans | -97 | -3.1 | 178.7 | -66.6 | -70.2 | 0 | 0 | 0 | 113.5 | P192 Y194 Y195 S199 | P192-F197 HydrophobicContact CB-CD2 4.39Å; P192-F197 HydrophobicContact CB-CE2 3.56Å; P192-F197 HydrophobicContact CB-CZ 4.16Å; P192-F197 HydrophobicContact CG-CE2 3.53Å; P192-F197 HydrophobicContact CG-CZ 3.78Å; Y194-F197 PolarHBondContact O-N 3.3Å; Y195-F197 VanDerWaalsContact C-N 3.28Å; Y195-F197 PolarHBondContact O-N 3.22Å; F197-S199 PolarHBondContact O-N 2.72Å |
| 198 | S | 58.4 | Low | 61.3 | Low | 69 Ų | 69 | 119.9 Ų | 119.9 | 48% | 0.483 | 64% | 0.644 | S | S | . | * | trans | -83.6 | 8 | -177 | -60.6 | 0 | 0 | 0 | 0 | 114 | Y194 Y195 | Y194-S198 PolarHBondContact O-OG 3.47Å; Y195-S198 PolarHBondContact O-N 2.94Å | ||
| 199 | S | 56.7 | Low | 58.9 | Low | 100 Ų | 100 | 128.7 Ų | 128.7 | 70% | 0.699 | 69% | 0.685 | S | S | * | * | trans | -111.7 | 41.3 | -173.5 | -56.4 | 0 | 0 | 0 | 0 | 113.7 | F197 | F197-S199 PolarHBondContact O-N 2.72Š| ||
| 200 | E | 55.2 | Low | 56.9 | Low | 189 Ų | 189 | 126.4 Ų | 126.4 | 88% | 0.883 | 69% | 0.69 | S | S | * | * | trans | -143.9 | 68.1 | 157.9 | -74.1 | -157.2 | 113.6 | 0 | 0 | 109.9 | S202 | E200-S202 VanDerWaalsContact C-N 3.34Å; E200-S202 PolarHBondContact O-N 3.2Å; E200-S202 VanDerWaalsContact O-N 3.11Å | ||
| 201 | E | 47.9 | Very low | 55 | Low | 186 Ų | 186 | 132 Ų | 132 | 87% | 0.869 | 72% | 0.717 | S | S | * | * | trans | -62.6 | 101.2 | 148.9 | -179 | 169.9 | 76.4 | 0 | 0 | 106.9 | P203 | E201-P203 WeakPolarHBondContact O-CD 3.44Š| ||
| 202 | S | 42.6 | Very low | 53.4 | Low | 106 Ų | 106 | 132.6 Ų | 132.6 | 74% | 0.741 | 73% | 0.729 | S | S | * | * | trans | -56.2 | 120 | 163.9 | -93.1 | 0 | 0 | 0 | 0 | 108.6 | E200 G204 | E200-S202 VanDerWaalsContact C-N 3.34Å; E200-S202 PolarHBondContact O-N 3.2Å; E200-S202 VanDerWaalsContact O-N 3.11Å; S202-G204 PolarHBondContact O-N 3.2Å | ||
| 203 | P | 47.1 | Very low | 52.2 | Low | 125 Ų | 125 | 135.9 Ų | 135.9 | 81% | 0.812 | 75% | 0.75 | S | S | * | * | trans | -70.8 | 118.8 | 173.1 | 28.3 | -29.7 | 0 | 0 | 0 | 108.9 | E201 | E201-P203 WeakPolarHBondContact O-CD 3.44Š| ||
| 204 | G | 43.8 | Very low | 51.2 | Low | 76 Ų | 76 | 141 Ų | 141 | 78% | 0.784 | 76% | 0.764 | S | S | * | * | trans | 11.6 | 105.9 | 161.6 | 0 | 0 | 0 | 0 | 0 | 118.7 | S202 E206 | S202-G204 PolarHBondContact O-N 3.2Å; G204-E206 PolarHBondContact O-N 3.39Å | ||
| 205 | G | 39.5 | Very low | 50.5 | Low | 78 Ų | 78 | 138 Ų | 138 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | trans | -76.3 | 97.5 | 149.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | I207 | G205-I207 PolarHBondContact O-N 3.21Å; G205-I207 VanDerWaalsContact O-N 3.12Å | ||
| 206 | E | 41.4 | Very low | 49.7 | Very low | 156 Ų | 156 | 137.9 Ų | 137.9 | 73% | 0.729 | 77% | 0.773 | S | S | * | * | trans | -59.1 | 106.1 | 167.6 | -174.5 | 179.2 | 103.1 | 0 | 0 | 109.2 | G204 Q208 | G204-E206 PolarHBondContact O-N 3.39Å; E206-Q208 PolarHBondContact O-N 2.79Å | ||
| 207 | I | 46.7 | Very low | 49.2 | Very low | 165 Ų | 165 | 141 Ų | 141 | 85% | 0.846 | 79% | 0.785 | S | S | * | * | trans | -72.8 | 100.4 | 162.1 | 35.4 | 170 | 0 | 0 | 0 | 107.3 | G205 E209 | G205-I207 PolarHBondContact O-N 3.21Å; G205-I207 VanDerWaalsContact O-N 3.12Å; I207-E209 PolarHBondContact O-N 2.86Å; I207-E209 VanDerWaalsContact O-N 3.1Å | ||
| 208 | Q | 40.6 | Very low | 49.2 | Very low | 152 Ų | 152 | 138.1 Ų | 138.1 | 71% | 0.71 | 79% | 0.788 | S | S | * | * | trans | -61.1 | 109.7 | 162.3 | -81.9 | 174.4 | 16.3 | 0 | 0 | 108.2 | E206 V210 | E206-Q208 PolarHBondContact O-N 2.79Å; Q208-V210 PolarHBondContact O-N 3.14Å | ||
| 209 | E | 46.3 | Very low | 49.2 | Very low | 189 Ų | 189 | 140.8 Ų | 140.8 | 88% | 0.883 | 80% | 0.804 | S | S | * | * | trans | -62 | 99 | 166.5 | -169.6 | 176.3 | 109.9 | 0 | 0 | 107.7 | I207 E211 | I207-E209 PolarHBondContact O-N 2.86Å; I207-E209 VanDerWaalsContact O-N 3.1Å; E209-E211 PolarHBondContact O-N 2.83Å; E209-E211 VanDerWaalsContact O-N 3.13Å | ||
| 210 | V | 49.2 | Very low | 48.7 | Very low | 132 Ų | 132 | 140.8 Ų | 140.8 | 80% | 0.8 | 81% | 0.81 | S | S | * | * | trans | -76.5 | 101.3 | 171.4 | -170.2 | 0 | 0 | 0 | 0 | 107 | Q208 A212 | Q208-V210 PolarHBondContact O-N 3.14Å; V210-A212 PolarHBondContact O-N 3.29Å | ||
| 211 | E | 49.3 | Very low | 48.3 | Very low | 176 Ų | 176 | 142.1 Ų | 142.1 | 82% | 0.822 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -46.2 | 116.6 | 171 | -172.4 | 179.5 | 132.5 | 0 | 0 | 110.8 | E209 | E209-E211 PolarHBondContact O-N 2.83Å; E209-E211 VanDerWaalsContact O-N 3.13Å |
| 212 | A | 51.5 | Low | 48.3 | Very low | 85 Ų | 85 | 140 Ų | 140 | 70% | 0.702 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 131 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | V210 K214 | V210-A212 PolarHBondContact O-N 3.29Å; A212-K214 PolarHBondContact O-N 3.02Å |
| 213 | P | 49.6 | Very low | 48.7 | Very low | 126 Ų | 126 | 141.7 Ų | 141.7 | 82% | 0.818 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 127 | 177.8 | 27.6 | -32.4 | 0 | 0 | 0 | 111.4 | ||
| 214 | K | 50.5 | Low | 48.7 | Very low | 192 Ų | 192 | 142.7 Ų | 142.7 | 84% | 0.835 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 132.4 | 176.5 | -169.8 | 176.8 | -173.7 | 177 | 0 | 111.6 | A212 Q216 | A212-K214 PolarHBondContact O-N 3.02Å; K214-Q216 PolarHBondContact O-N 3.19Å |
| 215 | P | 51.9 | Low | 49 | Very low | 122 Ų | 122 | 146.6 Ų | 146.6 | 79% | 0.792 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 121.7 | 170.5 | 26.3 | -29.8 | 0 | 0 | 0 | 110.1 | ||
| 216 | Q | 49.4 | Very low | 49.6 | Very low | 195 Ų | 195 | 150.9 Ų | 150.9 | 91% | 0.911 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 119.5 | 167.7 | -80.9 | 179.5 | -19.7 | 0 | 0 | 109.2 | K214 | K214-Q216 PolarHBondContact O-N 3.19Š|
| 217 | E | 54.5 | Low | 50.2 | Low | 192 Ų | 192 | 150.5 Ų | 150.5 | 90% | 0.897 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 122.4 | 168.4 | -171.1 | 175.1 | 118.4 | 0 | 0 | 108.9 | ||
| 218 | A | 61 | Low | 50.4 | Low | 89 Ų | 89 | 149.5 Ų | 149.5 | 74% | 0.736 | 85% | 0.848 | S | S | * | * | P | Polyproline II helix | trans | -88.8 | 133.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||
| 219 | P | 58.1 | Low | 51.2 | Low | 126 Ų | 126 | 149.3 Ų | 149.3 | 82% | 0.818 | 86% | 0.858 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 135.1 | 172.8 | 30.3 | -31.4 | 0 | 0 | 0 | 111 | ||
| 220 | A | 46.3 | Very low | 51.6 | Low | 99 Ų | 99 | 146 Ų | 146 | 82% | 0.818 | 86% | 0.856 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 138.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 221 | V | 47.8 | Very low | 51.8 | Low | 218 Ų | 218 | 147.3 Ų | 147.3 | 100% | 1.321 | 86% | 0.861 | S | S | * | * | trans | -138.8 | 0 | 152.9 | 178.8 | 0 | 0 | 0 | 0 | 107.8 |
Retrieved 221 of 221 residues in 232.3 ms
(Link to these results)