| 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 | 67.1 | Low | 66 | Low | 245 Ų | 245 | 154.5 Ų | 154.5 | 100% | 1.207 | 85% | 0.847 | S | S | * | * | 0 | 112.8 | 0 | -71 | 171.8 | 97.1 | 0 | 0 | 106.7 | |||||
| 2 | Q | 56.7 | Low | 66.1 | Low | 183 Ų | 183 | 154.8 Ų | 154.8 | 86% | 0.855 | 84% | 0.844 | S | S | * | * | trans | -78.2 | 145.1 | 177.4 | -75.5 | 160.5 | -32.6 | 0 | 0 | 109.7 | ||||
| 3 | S | 70.8 | Confident | 65.5 | Low | 121 Ų | 121 | 152.7 Ų | 152.7 | 85% | 0.846 | 84% | 0.839 | S | S | * | * | trans | -147.4 | 82.7 | 167.8 | -60.7 | 0 | 0 | 0 | 0 | 109 | ||||
| 4 | D | 65 | Low | 65.4 | Low | 142 Ų | 142 | 153.1 Ų | 153.1 | 76% | 0.759 | 84% | 0.838 | S | S | * | * | trans | -96.5 | 118.2 | 164 | -64.8 | -47.2 | 0 | 0 | 0 | 108.9 | ||||
| 5 | K | 70.4 | Confident | 65 | Low | 210 Ų | 210 | 159.3 Ų | 159.3 | 91% | 0.913 | 84% | 0.844 | S | S | * | * | trans | -162.8 | 142.9 | 162.2 | -64.5 | -62.2 | 171.7 | 172 | 0 | 106.7 | ||||
| 6 | A | 63.6 | Low | 64.5 | Low | 88 Ų | 88 | 155.9 Ų | 155.9 | 73% | 0.727 | 84% | 0.837 | S | S | * | * | cis | -166.9 | 146.7 | -17.3 | 0 | 0 | 0 | 0 | 0 | 104.4 | ||||
| 7 | S | 62.7 | Low | 64.1 | Low | 117 Ų | 117 | 151.6 Ų | 151.6 | 82% | 0.818 | 84% | 0.839 | S | S | * | * | trans | -59.8 | 130.1 | 175.4 | 156.7 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 8 | E | 67.5 | Low | 63.7 | Low | 185 Ų | 185 | 155.5 Ų | 155.5 | 86% | 0.864 | 84% | 0.838 | S | S | * | * | trans | -86.6 | 112.8 | 163.7 | -86.7 | -177.8 | 140.4 | 0 | 0 | 110.3 | ||||
| 9 | E | 72.7 | Confident | 63.4 | Low | 176 Ų | 176 | 156.2 Ų | 156.2 | 82% | 0.822 | 84% | 0.841 | S | S | * | * | trans | -89.6 | 109.1 | 171.8 | 179.6 | -179.7 | 164.7 | 0 | 0 | 108.9 | A11 | E9-A11 PolarHBondContact O-N 2.99Š| ||
| 10 | N | 69.5 | Low | 63.2 | Low | 146 Ų | 146 | 156.6 Ų | 156.6 | 78% | 0.781 | 84% | 0.839 | S | S | * | * | trans | -81.6 | 100.3 | 174.4 | -84.7 | -45.8 | 0 | 0 | 0 | 110.6 | I12 | N10-I12 PolarHBondContact O-N 3.46Š| ||
| 11 | A | 60.4 | Low | 63.2 | Low | 87 Ų | 87 | 160.1 Ų | 160.1 | 72% | 0.719 | 84% | 0.841 | S | S | * | * | trans | -75.8 | 114.7 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | E9 | E9-A11 PolarHBondContact O-N 2.99Š| ||
| 12 | I | 67.1 | Low | 62.8 | Low | 158 Ų | 158 | 154.1 Ų | 154.1 | 81% | 0.81 | 82% | 0.823 | S | S | * | * | trans | -96.2 | 105.5 | 173.6 | -34.2 | 173.9 | 0 | 0 | 0 | 108.3 | N10 | N10-I12 PolarHBondContact O-N 3.46Š| ||
| 13 | T | 57.7 | Low | 63 | Low | 127 Ų | 127 | 156.3 Ų | 156.3 | 78% | 0.779 | 82% | 0.823 | S | S | * | * | trans | -90.9 | 116.3 | 175.6 | 1.4 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 14 | L | 64.1 | Low | 62.6 | Low | 158 Ų | 158 | 156.2 Ų | 156.2 | 83% | 0.827 | 82% | 0.82 | S | S | * | * | trans | -131.7 | 82.8 | 163.7 | -74.3 | 178.3 | 0 | 0 | 0 | 111.7 | S16 | L14-S16 PolarHBondContact O-N 3.43Š| ||
| 15 | R | 59.5 | Low | 62.4 | Low | 246 Ų | 246 | 161.2 Ų | 161.2 | 93% | 0.928 | 83% | 0.828 | S | S | * | * | 17.1 | 95.6 | 121.5 | -161.7 | 174.7 | -178.4 | 169.5 | -0.5 | 116.1 | |||||
| 16 | S | 57.8 | Low | 61.9 | Low | 105 Ų | 105 | 159.3 Ų | 159.3 | 73% | 0.734 | 83% | 0.827 | S | S | * | * | trans | -147.4 | 101 | 151.7 | -169.3 | 0 | 0 | 0 | 0 | 110.4 | L14 R18 | L14-S16 PolarHBondContact O-N 3.43Å; S16-R18 PolarHBondContact O-N 3.49Å | ||
| 17 | G | 57 | Low | 61.6 | Low | 84 Ų | 84 | 163.2 Ų | 163.2 | 87% | 0.866 | 84% | 0.836 | S | S | * | * | trans | -74.1 | 107 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 18 | R | 56.7 | Low | 61.3 | Low | 221 Ų | 221 | 160.3 Ų | 160.3 | 83% | 0.834 | 82% | 0.824 | S | S | * | * | trans | -114.2 | 111.8 | 160.7 | -86 | -173.8 | 175.9 | -168.1 | 0.3 | 109.4 | S16 M20 | S16-R18 PolarHBondContact O-N 3.49Å; R18-M20 PolarHBondContact O-N 3.44Å | ||
| 19 | L | 57.8 | Low | 60.8 | Low | 169 Ų | 169 | 160.4 Ų | 160.4 | 89% | 0.885 | 82% | 0.824 | S | S | * | * | trans | -61.6 | 109.2 | 170 | -138.7 | 92.7 | 0 | 0 | 0 | 108.6 | R21 | L19-R21 PolarHBondContact O-N 2.85Š| ||
| 20 | M | 61 | Low | 60 | Low | 164 Ų | 164 | 164.5 Ų | 164.5 | 81% | 0.808 | 83% | 0.832 | S | S | * | * | trans | -74.2 | 106.6 | 169.4 | -82 | -84 | 97.6 | 0 | 0 | 108.7 | R18 S22 | R18-M20 PolarHBondContact O-N 3.44Å; M20-S22 PolarHBondContact O-N 3.16Å; M20-S22 VanDerWaalsContact O-N 3.08Å | ||
| 21 | R | 63.3 | Low | 59.9 | Low | 230 Ų | 230 | 168.3 Ų | 168.3 | 87% | 0.868 | 84% | 0.836 | S | S | * | * | trans | -63.9 | 106.1 | 168.1 | -83.1 | -173.5 | 171.6 | -158.2 | -1 | 109.3 | L19 R23 | L19-R21 PolarHBondContact O-N 2.85Å; R21-R23 PolarHBondContact O-N 3.46Å | ||
| 22 | S | 58.2 | Low | 60.3 | Low | 119 Ų | 119 | 169.5 Ų | 169.5 | 83% | 0.832 | 84% | 0.836 | S | S | * | * | trans | -61.2 | 111.9 | 167.5 | -43.5 | 0 | 0 | 0 | 0 | 109.4 | M20 | M20-S22 PolarHBondContact O-N 3.16Å; M20-S22 VanDerWaalsContact O-N 3.08Å | ||
| 23 | R | 61.3 | Low | 60.3 | Low | 229 Ų | 229 | 167.4 Ų | 167.4 | 86% | 0.864 | 83% | 0.832 | S | S | * | * | trans | -81.4 | 135.2 | 170.3 | -78.3 | -173.4 | 170.7 | -172.8 | -2.1 | 109.9 | R21 | R21-R23 PolarHBondContact O-N 3.46Š| ||
| 24 | P | 62.5 | Low | 60.7 | Low | 120 Ų | 120 | 167 Ų | 167 | 78% | 0.779 | 83% | 0.832 | S | S | * | * | trans | -65.8 | 137 | 178.4 | -12 | 25.9 | 0 | 0 | 0 | 110.9 | L26 | P24-L26 PolarHBondContact O-N 3.19Š| ||
| 25 | R | 59 | Low | 60.5 | Low | 247 Ų | 247 | 171.5 Ų | 171.5 | 93% | 0.932 | 84% | 0.838 | S | S | * | * | trans | -74.1 | 104.3 | 170.6 | -69.7 | -160.6 | 166.8 | -166.6 | -2.5 | 109.4 | N27 | R25-N27 PolarHBondContact O-N 2.76Å; R25-N27 VanDerWaalsContact O-N 3.16Å | ||
| 26 | L | 61.5 | Low | 60.5 | Low | 170 Ų | 170 | 171.2 Ų | 171.2 | 89% | 0.89 | 84% | 0.837 | S | S | * | * | trans | -71.7 | 100.5 | 162 | -89.5 | 155.7 | 0 | 0 | 0 | 108.5 | P24 G28 | P24-L26 PolarHBondContact O-N 3.19Å; L26-G28 PolarHBondContact O-N 2.8Å | ||
| 27 | N | 56.6 | Low | 60.6 | Low | 169 Ų | 169 | 169.4 Ų | 169.4 | 90% | 0.904 | 84% | 0.835 | S | S | * | * | trans | -64.3 | 111.2 | 159.6 | -103.4 | -10 | 0 | 0 | 0 | 107.9 | R25 | R25-N27 PolarHBondContact O-N 2.76Å; R25-N27 VanDerWaalsContact O-N 3.16Å | ||
| 28 | G | 56.2 | Low | 60.7 | Low | 56 Ų | 56 | 171.8 Ų | 171.8 | 58% | 0.577 | 83% | 0.832 | S | S | * | * | trans | -153.4 | 103.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111 | L26 | L26-G28 PolarHBondContact O-N 2.8Š| ||
| 29 | H | 57.9 | Low | 60.9 | Low | 188 Ų | 188 | 172.1 Ų | 172.1 | 87% | 0.87 | 83% | 0.834 | S | S | * | * | trans | 56.3 | 101.4 | 157.2 | -55.2 | -64.7 | 0 | 0 | 0 | 118.4 | R31 | H29-R31 PolarHBondContact O-N 2.88Š| ||
| 30 | R | 54.5 | Low | 61 | Low | 261 Ų | 261 | 169.7 Ų | 169.7 | 99% | 0.985 | 83% | 0.826 | S | S | * | * | trans | -42.5 | 105 | 157.9 | -72.1 | -177.6 | 174 | -165.7 | -1.1 | 111.1 | ||||
| 31 | R | 68.9 | Low | 61 | Low | 227 Ų | 227 | 168 Ų | 168 | 86% | 0.857 | 83% | 0.825 | S | S | * | * | trans | -113.1 | 126.3 | 155.1 | -163.4 | 176 | -173 | -175.2 | 2.3 | 107.3 | H29 | H29-R31 PolarHBondContact O-N 2.88Š| ||
| 32 | P | 68.3 | Low | 60.6 | Low | 111 Ų | 111 | 162 Ų | 162 | 72% | 0.721 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 130.8 | 175.2 | -15 | 27.4 | 0 | 0 | 0 | 108.8 | ||
| 33 | P | 66.7 | Low | 60.4 | Low | 114 Ų | 114 | 164.5 Ų | 164.5 | 74% | 0.74 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 139.2 | 175.5 | 26.3 | -31.2 | 0 | 0 | 0 | 109.3 | R35 | P33-R35 PolarHBondContact O-N 3.09Š|
| 34 | P | 66.5 | Low | 59.8 | Low | 118 Ų | 118 | 161.2 Ų | 161.2 | 77% | 0.766 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 137.2 | 169.6 | 25.7 | -31.4 | 0 | 0 | 0 | 108.6 | R36 | P34-R36 PolarHBondContact O-N 3.48Š|
| 35 | R | 60.2 | Low | 59.6 | Low | 254 Ų | 254 | 159 Ų | 159 | 96% | 0.958 | 80% | 0.798 | S | S | * | * | trans | -47 | 102.3 | 177.7 | -78.6 | -177.6 | 164.9 | -177.2 | -4.1 | 109.6 | P33 G37 | P33-R35 PolarHBondContact O-N 3.09Å; R35-G37 PolarHBondContact O-N 3.4Å | ||
| 36 | R | 58.7 | Low | 59.9 | Low | 239 Ų | 239 | 153.6 Ų | 153.6 | 90% | 0.902 | 79% | 0.787 | S | S | * | * | trans | -66.6 | 112.9 | 169.8 | -93 | -175.6 | 178.4 | -166.2 | -1 | 107.1 | P34 V38 | P34-R36 PolarHBondContact O-N 3.48Å; R36-V38 PolarHBondContact O-N 3.28Å | ||
| 37 | G | 60.1 | Low | 59.9 | Low | 68 Ų | 68 | 154 Ų | 154 | 70% | 0.701 | 78% | 0.782 | S | S | * | * | trans | -52.5 | 128.6 | 159 | 0 | 0 | 0 | 0 | 0 | 108.3 | R35 R39 | R35-G37 PolarHBondContact O-N 3.4Å; G37-R39 PolarHBondContact O-N 3.39Å | ||
| 38 | V | 58.8 | Low | 60.6 | Low | 133 Ų | 133 | 148.1 Ų | 148.1 | 81% | 0.806 | 76% | 0.757 | S | S | * | * | trans | -65 | 86.2 | 174.5 | 179.6 | 0 | 0 | 0 | 0 | 107 | R36 T40 | R36-V38 PolarHBondContact O-N 3.28Å; V38-T40 HydrophobicContact CG1-CG2 4.28Å; V38-T40 PolarHBondContact O-N 3.08Å | ||
| 39 | R | 60.6 | Low | 61.8 | Low | 228 Ų | 228 | 149.5 Ų | 149.5 | 86% | 0.86 | 75% | 0.754 | S | S | * | * | trans | -77.5 | 104 | 157 | -79.4 | 179.6 | 87.4 | 162.2 | 3.3 | 105.1 | G37 V41 | G37-R39 PolarHBondContact O-N 3.39Å; R39-V41 PolarHBondContact O-N 2.87Å | ||
| 40 | T | 61.1 | Low | 63.1 | Low | 118 Ų | 118 | 144.5 Ų | 144.5 | 72% | 0.724 | 75% | 0.746 | S | S | * | * | trans | -58.3 | 93.1 | 157.4 | 45.9 | 0 | 0 | 0 | 0 | 106.8 | V38 S42 | V38-T40 HydrophobicContact CG1-CG2 4.28Å; V38-T40 PolarHBondContact O-N 3.08Å; T40-S42 PolarHBondContact O-N 3.04Å | ||
| 41 | V | 60.9 | Low | 64.6 | Low | 129 Ų | 129 | 135.5 Ų | 135.5 | 78% | 0.782 | 73% | 0.727 | S | S | * | * | trans | -70.7 | 93.6 | 158.6 | -117.4 | 0 | 0 | 0 | 0 | 104.2 | R39 H43 | R39-V41 PolarHBondContact O-N 2.87Å; V41-H43 PolarHBondContact O-N 3.47Å | ||
| 42 | S | 53.9 | Low | 65.6 | Low | 103 Ų | 103 | 130 Ų | 130 | 72% | 0.72 | 71% | 0.711 | S | S | * | * | trans | -58.8 | 95.8 | 161.8 | -84.5 | 0 | 0 | 0 | 0 | 106.3 | T40 E44 | T40-S42 PolarHBondContact O-N 3.04Å; S42-E44 PolarHBondContact O-N 3.29Å | ||
| 43 | H | 53.6 | Low | 66.6 | Low | 173 Ų | 173 | 129.8 Ų | 129.8 | 80% | 0.801 | 70% | 0.703 | S | S | * | * | trans | -77.3 | 77 | 167.9 | -143.8 | -69.2 | 0 | 0 | 0 | 105.6 | V41 S45 | V41-H43 PolarHBondContact O-N 3.47Å; H43-S45 PolarHBondContact O-N 3.38Å | ||
| 44 | E | 50.4 | Low | 67.8 | Low | 159 Ų | 159 | 126.9 Ų | 126.9 | 74% | 0.743 | 69% | 0.688 | S | S | * | * | trans | -70.8 | 81.9 | 170.7 | -145.2 | 156.4 | -177.5 | 0 | 0 | 105.7 | S42 N46 | S42-E44 PolarHBondContact O-N 3.29Å; E44-N46 PolarHBondContact O-N 3.26Å | ||
| 45 | S | 58.3 | Low | 69.1 | Low | 74 Ų | 74 | 124 Ų | 124 | 52% | 0.517 | 68% | 0.675 | S | S | . | * | trans | -69.2 | 95.4 | 165.9 | 82.6 | 0 | 0 | 0 | 0 | 105.1 | H43 K47 | H43-S45 PolarHBondContact O-N 3.38Å; S45-K47 PolarHBondContact O-N 3.33Å | ||
| 46 | N | 63.3 | Low | 70.7 | Confident | 133 Ų | 133 | 114.9 Ų | 114.9 | 71% | 0.711 | 65% | 0.653 | S | S | * | * | trans | -57.8 | 94.3 | 167.4 | -69.2 | -18.5 | 0 | 0 | 0 | 106.7 | E44 A48 | E44-N46 PolarHBondContact O-N 3.26Å; N46-A48 PolarHBondContact O-N 3.29Å | ||
| 47 | K | 62.4 | Low | 72.3 | Confident | 180 Ų | 180 | 106.1 Ų | 106.1 | 78% | 0.783 | 63% | 0.632 | S | S | * | * | trans | -72.9 | 85.9 | 167.7 | -69 | -178.6 | -177.8 | -179.9 | 0 | 104.6 | S45 T49 | S45-K47 PolarHBondContact O-N 3.33Å; K47-T49 PolarHBondContact O-N 2.8Å; K47-T49 VanDerWaalsContact O-N 3.14Å | ||
| 48 | A | 70.6 | Confident | 74 | Confident | 44 Ų | 44 | 107.6 Ų | 107.6 | 36% | 0.364 | 63% | 0.628 | S | S | . | * | trans | -50.7 | 123.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 107.6 | N46 E52 I53 | N46-A48 PolarHBondContact O-N 3.29Å; A48-E52 WeakPolarHBondContact CA-OE2 3.38Å; A48-I53 HydrophobicContact CB-CD1 4.36Å; A48-I53 HydrophobicContact CB-CG1 3.95Å | ||
| 49 | T | 83 | Confident | 75.8 | Confident | 85 Ų | 85 | 104 Ų | 104 | 52% | 0.521 | 61% | 0.611 | S | S | . | * | trans | -68.2 | 154.1 | 178.3 | 61.8 | 0 | 0 | 0 | 0 | 108.6 | K47 A51 E52 I53 | K47-T49 PolarHBondContact O-N 2.8Å; K47-T49 VanDerWaalsContact O-N 3.14Å; T49-A51 PolarHBondContact O-N 3.3Å; T49-A51 VanDerWaalsContact O-N 3.08Å; T49-E52 WeakPolarHBondContact O-CB 3.44Å; T49-E52 PolarHBondContact O-N 3.4Å; T49-E52 PolarHBondContact OG1-N 3.18Å; T49-I53 PolarHBondContact O-N 2.91Å; T49-I53 VanDerWaalsContact O-N 3.08Å | ||
| 50 | A | 83.3 | Confident | 77.5 | Confident | 84 Ų | 84 | 96.8 Ų | 96.8 | 69% | 0.694 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -53.6 | -32.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | I53 A54 | A50-I53 PolarHBondContact O-N 3.12Å; A50-A54 WeakPolarHBondContact O-CB 3.46Å; A50-A54 PolarHBondContact O-N 3.26Å |
| 51 | A | 87.3 | Confident | 79.2 | Confident | 72 Ų | 72 | 94.6 Ų | 94.6 | 60% | 0.595 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -65.4 | -40.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | T49 A54 A55 | T49-A51 PolarHBondContact O-N 3.3Å; T49-A51 VanDerWaalsContact O-N 3.08Å; A51-A54 PolarHBondContact O-N 3.46Å; A51-A55 VanDerWaalsContact O-CB 3.32Å; A51-A55 WeakPolarHBondContact O-CB 3.46Å; A51-A55 PolarHBondContact O-N 2.93Å |
| 52 | E | 89.2 | Confident | 80.9 | Confident | 112 Ų | 112 | 90.8 Ų | 90.8 | 52% | 0.523 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -67.5 | -40.7 | 176.6 | -172.5 | -178.5 | 175.4 | 0 | 0 | 111.5 | A48 T49 A55 A56 | A48-E52 WeakPolarHBondContact CA-OE2 3.38Å; T49-E52 WeakPolarHBondContact O-CB 3.44Å; T49-E52 PolarHBondContact O-N 3.4Å; T49-E52 PolarHBondContact OG1-N 3.18Å; E52-A55 PolarHBondContact O-N 3.3Å; E52-A56 WeakPolarHBondContact O-CB 3.35Å; E52-A56 PolarHBondContact O-N 2.96Å |
| 53 | I | 90.5 | Very high | 82.9 | Confident | 106 Ų | 106 | 90.7 Ų | 90.7 | 54% | 0.544 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -63.1 | -45.3 | 174.9 | -61.5 | 173.1 | 0 | 0 | 0 | 110.3 | A48 T49 A50 A56 A57 | A48-I53 HydrophobicContact CB-CD1 4.36Å; A48-I53 HydrophobicContact CB-CG1 3.95Å; T49-I53 PolarHBondContact O-N 2.91Å; T49-I53 VanDerWaalsContact O-N 3.08Å; A50-I53 PolarHBondContact O-N 3.12Å; I53-A56 PolarHBondContact O-N 3.27Å; I53-A57 WeakPolarHBondContact O-CB 3.5Å; I53-A57 PolarHBondContact O-N 3.17Å |
| 54 | A | 90.9 | Very high | 85 | Confident | 52 Ų | 52 | 88.4 Ų | 88.4 | 43% | 0.43 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.3 | -44.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | A50 A51 A56 A57 T58 | A50-A54 WeakPolarHBondContact O-CB 3.46Å; A50-A54 PolarHBondContact O-N 3.26Å; A51-A54 PolarHBondContact O-N 3.46Å; A54-A56 PolarHBondContact O-N 3.49Å; A54-A57 PolarHBondContact O-N 3.09Å; A54-T58 PolarHBondContact O-N 3.09Å; A54-T58 PolarHBondContact O-OG1 3.47Å; A54-T58 VanDerWaalsContact O-OG1 3.07Å |
| 55 | A | 93.2 | Very high | 87.2 | Confident | 59 Ų | 59 | 85 Ų | 85 | 49% | 0.488 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.5 | -43.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | A51 E52 T58 A59 | A51-A55 VanDerWaalsContact O-CB 3.32Å; A51-A55 WeakPolarHBondContact O-CB 3.46Å; A51-A55 PolarHBondContact O-N 2.93Å; E52-A55 PolarHBondContact O-N 3.3Å; A55-T58 PolarHBondContact O-N 3.31Å; A55-A59 VanDerWaalsContact O-CB 3.31Å; A55-A59 WeakPolarHBondContact O-CB 3.37Å; A55-A59 PolarHBondContact O-N 2.73Å |
| 56 | A | 94 | Very high | 89.1 | Confident | 62 Ų | 62 | 84.2 Ų | 84.2 | 51% | 0.512 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64 | -40.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | E52 I53 A54 A59 S60 | E52-A56 WeakPolarHBondContact O-CB 3.35Å; E52-A56 PolarHBondContact O-N 2.96Å; I53-A56 PolarHBondContact O-N 3.27Å; A54-A56 PolarHBondContact O-N 3.49Å; A56-A59 PolarHBondContact O-N 2.87Å; A56-S60 WeakPolarHBondContact O-CB 3.37Å; A56-S60 PolarHBondContact O-N 2.75Å |
| 57 | A | 94 | Very high | 90.7 | Very high | 54 Ų | 54 | 79.9 Ų | 79.9 | 45% | 0.446 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.3 | -48.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | I53 A54 A59 S60 V61 | I53-A57 WeakPolarHBondContact O-CB 3.5Å; I53-A57 PolarHBondContact O-N 3.17Å; A54-A57 PolarHBondContact O-N 3.09Å; A57-A59 PolarHBondContact O-N 3.38Å; A57-S60 WeakPolarHBondContact O-CB 3.32Å; A57-S60 PolarHBondContact O-N 3.36Å; A57-V61 WeakPolarHBondContact O-CG2 3.5Å; A57-V61 PolarHBondContact O-N 3Å |
| 58 | T | 94.5 | Very high | 92.3 | Very high | 100 Ų | 100 | 76.3 Ų | 76.3 | 61% | 0.613 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.8 | -42.8 | 176.9 | -57.9 | 0 | 0 | 0 | 0 | 111.8 | A54 A55 S60 V61 A62 | A54-T58 PolarHBondContact O-N 3.09Å; A54-T58 PolarHBondContact O-OG1 3.47Å; A54-T58 VanDerWaalsContact O-OG1 3.07Å; A55-T58 PolarHBondContact O-N 3.31Å; T58-S60 VanDerWaalsContact C-N 3.33Å; T58-S60 PolarHBondContact O-N 3.31Å; T58-V61 PolarHBondContact O-N 3.28Å; T58-A62 WeakPolarHBondContact O-CB 3.46Å; T58-A62 PolarHBondContact O-N 3.11Å |
| 59 | A | 95.9 | Very high | 93.6 | Very high | 56 Ų | 56 | 80.7 Ų | 80.7 | 46% | 0.463 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.1 | -38.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A55 A56 A57 T63 | A55-A59 VanDerWaalsContact O-CB 3.31Å; A55-A59 WeakPolarHBondContact O-CB 3.37Å; A55-A59 PolarHBondContact O-N 2.73Å; A56-A59 PolarHBondContact O-N 2.87Å; A57-A59 PolarHBondContact O-N 3.38Å; A59-T63 WeakPolarHBondContact O-CB 3.44Å; A59-T63 PolarHBondContact O-N 2.9Å; A59-T63 PolarHBondContact O-OG1 3.4Å |
| 60 | S | 96.4 | Very high | 94.3 | Very high | 77 Ų | 77 | 82.4 Ų | 82.4 | 54% | 0.538 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.1 | -45.3 | 174.5 | -174.4 | 0 | 0 | 0 | 0 | 111.6 | A56 A57 T58 T63 Q64 | A56-S60 WeakPolarHBondContact O-CB 3.37Å; A56-S60 PolarHBondContact O-N 2.75Å; A57-S60 WeakPolarHBondContact O-CB 3.32Å; A57-S60 PolarHBondContact O-N 3.36Å; T58-S60 VanDerWaalsContact C-N 3.33Å; T58-S60 PolarHBondContact O-N 3.31Å; S60-T63 PolarHBondContact O-N 3.4Å; S60-Q64 WeakPolarHBondContact O-CB 3.49Å; S60-Q64 PolarHBondContact O-N 2.66Å |
| 61 | V | 97 | Very high | 94.9 | Very high | 73 Ų | 73 | 81.7 Ų | 81.7 | 44% | 0.442 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.8 | -44.6 | 177.6 | 174.5 | 0 | 0 | 0 | 0 | 110.9 | A57 T58 T63 Q64 M65 | A57-V61 WeakPolarHBondContact O-CG2 3.5Å; A57-V61 PolarHBondContact O-N 3Å; T58-V61 PolarHBondContact O-N 3.28Å; V61-T63 VanDerWaalsContact C-N 3.31Å; V61-T63 PolarHBondContact O-N 3.45Å; V61-Q64 WeakPolarHBondContact O-CB 3.31Å; V61-Q64 PolarHBondContact O-N 2.88Å; V61-M65 HydrophobicContact CG1-CE 4.12Å; V61-M65 HydrophobicContact CG1-SD 4.45Å; V61-M65 WeakPolarHBondContact O-CG 3.49Å; V61-M65 PolarHBondContact O-N 3.22Å |
| 62 | A | 96.2 | Very high | 95.4 | Very high | 48 Ų | 48 | 84.3 Ų | 84.3 | 40% | 0.397 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.4 | -42.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | T58 M65 A66 | T58-A62 WeakPolarHBondContact O-CB 3.46Å; T58-A62 PolarHBondContact O-N 3.11Å; A62-M65 PolarHBondContact O-N 2.74Å; A62-A66 WeakPolarHBondContact O-CB 3.41Å; A62-A66 PolarHBondContact O-N 3.33Å |
| 63 | T | 97.2 | Very high | 95.8 | Very high | 102 Ų | 102 | 83.6 Ų | 83.6 | 63% | 0.626 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.3 | -39.5 | 177 | -59 | 0 | 0 | 0 | 0 | 111.4 | A59 S60 V61 A66 G67 | A59-T63 WeakPolarHBondContact O-CB 3.44Å; A59-T63 PolarHBondContact O-N 2.9Å; A59-T63 PolarHBondContact O-OG1 3.4Å; S60-T63 PolarHBondContact O-N 3.4Å; V61-T63 VanDerWaalsContact C-N 3.31Å; V61-T63 PolarHBondContact O-N 3.45Å; T63-A66 PolarHBondContact O-N 2.93Å; T63-G67 PolarHBondContact O-N 2.87Å |
| 64 | Q | 97.7 | Very high | 96.1 | Very high | 124 Ų | 124 | 81.8 Ų | 81.8 | 58% | 0.579 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.8 | -47.2 | 174.9 | -174.4 | 179.2 | 21.6 | 0 | 0 | 111.4 | S60 V61 G67 M68 | S60-Q64 WeakPolarHBondContact O-CB 3.49Å; S60-Q64 PolarHBondContact O-N 2.66Å; V61-Q64 WeakPolarHBondContact O-CB 3.31Å; V61-Q64 PolarHBondContact O-N 2.88Å; Q64-G67 PolarHBondContact O-N 3.43Å; Q64-M68 WeakPolarHBondContact O-CG 3.38Å; Q64-M68 PolarHBondContact O-N 2.89Å |
| 65 | M | 96.7 | Very high | 96.4 | Very high | 87 Ų | 87 | 84.3 Ų | 84.3 | 43% | 0.429 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.9 | -46.1 | 176.8 | -69.1 | -171.7 | -61.1 | 0 | 0 | 111.6 | V61 A62 G67 M68 F69 | V61-M65 HydrophobicContact CG1-CE 4.12Å; V61-M65 HydrophobicContact CG1-SD 4.45Å; V61-M65 WeakPolarHBondContact O-CG 3.49Å; V61-M65 PolarHBondContact O-N 3.22Å; A62-M65 PolarHBondContact O-N 2.74Å; M65-G67 VanDerWaalsContact C-N 3.3Å; M65-G67 PolarHBondContact O-N 3.31Å; M65-M68 HydrophobicContact CB-CE 4.41Å; M65-M68 HydrophobicContact CG-CE 4.07Å; M65-M68 PolarHBondContact O-N 3.05Å; M65-M68 VanDerWaalsContact O-N 3.14Å; M65-F69 HydrophobicContact CB-CE2 4.26Å; M65-F69 WeakPolarHBondContact O-CD2 3.2Å; M65-F69 PolarHBondContact O-N 3.35Å |
| 66 | A | 96.8 | Very high | 96.6 | Very high | 59 Ų | 59 | 85.2 Ų | 85.2 | 49% | 0.488 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -57.8 | -43.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | A62 T63 M68 F69 E70 | A62-A66 WeakPolarHBondContact O-CB 3.41Å; A62-A66 PolarHBondContact O-N 3.33Å; T63-A66 PolarHBondContact O-N 2.93Å; A66-M68 VanDerWaalsContact C-N 3.35Å; A66-M68 PolarHBondContact O-N 3.5Å; A66-F69 PolarHBondContact O-N 2.8Å; A66-E70 WeakPolarHBondContact O-CB 3.31Å; A66-E70 PolarHBondContact O-N 2.7Å |
| 67 | G | 97.6 | Very high | 96.8 | Very high | 42 Ų | 42 | 90.6 Ų | 90.6 | 43% | 0.433 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63 | -37.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | T63 Q64 M65 S71 | T63-G67 PolarHBondContact O-N 2.87Å; Q64-G67 PolarHBondContact O-N 3.43Å; M65-G67 VanDerWaalsContact C-N 3.3Å; M65-G67 PolarHBondContact O-N 3.31Å; G67-S71 WeakPolarHBondContact O-CB 3.33Å; G67-S71 PolarHBondContact O-N 3.02Å; G67-S71 PolarHBondContact O-OG 3.39Å |
| 68 | M | 96.4 | Very high | 96.9 | Very high | 105 Ų | 105 | 90.6 Ų | 90.6 | 52% | 0.517 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.7 | -39.6 | 175.1 | -68.3 | -173.1 | -62.6 | 0 | 0 | 112.4 | Q64 M65 A66 S71 F72 | Q64-M68 WeakPolarHBondContact O-CG 3.38Å; Q64-M68 PolarHBondContact O-N 2.89Å; M65-M68 HydrophobicContact CB-CE 4.41Å; M65-M68 HydrophobicContact CG-CE 4.07Å; M65-M68 PolarHBondContact O-N 3.05Å; M65-M68 VanDerWaalsContact O-N 3.14Å; A66-M68 VanDerWaalsContact C-N 3.35Å; A66-M68 PolarHBondContact O-N 3.5Å; M68-S71 PolarHBondContact O-OG 3.33Å; M68-F72 WeakPolarHBondContact O-CB 3.13Å; M68-F72 PolarHBondContact O-N 3.33Å |
| 69 | F | 97.5 | Very high | 96.9 | Very high | 136 Ų | 136 | 89.4 Ų | 89.4 | 60% | 0.596 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -67.7 | -41.5 | 175.9 | -70.8 | -58.6 | 0 | 0 | 0 | 111.7 | M65 A66 S71 F72 L73 | M65-F69 HydrophobicContact CB-CE2 4.26Å; M65-F69 WeakPolarHBondContact O-CD2 3.2Å; M65-F69 PolarHBondContact O-N 3.35Å; A66-F69 PolarHBondContact O-N 2.8Å; F69-S71 PolarHBondContact O-N 2.91Å; F69-F72 PolarHBondContact O-N 3.38Å; F69-L73 WeakPolarHBondContact O-CB 3.35Å; F69-L73 VanDerWaalsContact O-CG 3.28Å; F69-L73 WeakPolarHBondContact O-CG 3.23Å; F69-L73 PolarHBondContact O-N 2.87Å |
| 70 | E | 97.2 | Very high | 96.9 | Very high | 120 Ų | 120 | 91.4 Ų | 91.4 | 56% | 0.561 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.8 | -41.9 | 177.3 | -168.4 | 63.8 | -158.4 | 0 | 0 | 111.4 | A66 L73 T74 | A66-E70 WeakPolarHBondContact O-CB 3.31Å; A66-E70 PolarHBondContact O-N 2.7Å; E70-L73 PolarHBondContact O-N 3.1Å; E70-T74 WeakPolarHBondContact O-CB 3.22Å; E70-T74 VanDerWaalsContact O-CG2 3.23Å; E70-T74 WeakPolarHBondContact O-CG2 3.48Å; E70-T74 PolarHBondContact O-N 2.78Å; E70-T74 PolarHBondContact O-OG1 3.03Å |
| 71 | S | 96.8 | Very high | 96.7 | Very high | 69 Ų | 69 | 92.6 Ų | 92.6 | 48% | 0.483 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.1 | -39.7 | 175.8 | 68.5 | 0 | 0 | 0 | 0 | 112.4 | G67 M68 F69 T74 Q75 | G67-S71 WeakPolarHBondContact O-CB 3.33Å; G67-S71 PolarHBondContact O-N 3.02Å; G67-S71 PolarHBondContact O-OG 3.39Å; M68-S71 PolarHBondContact O-OG 3.33Å; F69-S71 PolarHBondContact O-N 2.91Å; S71-T74 VanDerWaalsContact CA-OG1 3.31Å; S71-T74 WeakPolarHBondContact CA-OG1 3.39Å; S71-T74 PolarHBondContact O-OG1 3.31Å; S71-Q75 WeakPolarHBondContact O-CB 3.42Å; S71-Q75 PolarHBondContact O-N 3.33Å |
| 72 | F | 98.1 | Very high | 96.4 | Very high | 127 Ų | 127 | 95.5 Ų | 95.5 | 56% | 0.557 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.3 | -46.6 | 174.8 | 176.3 | -99.1 | 0 | 0 | 0 | 112.2 | M68 F69 T74 Q75 L76 | M68-F72 WeakPolarHBondContact O-CB 3.13Å; M68-F72 PolarHBondContact O-N 3.33Å; F69-F72 PolarHBondContact O-N 3.38Å; F72-T74 PolarHBondContact O-N 3.07Å; F72-Q75 PolarHBondContact O-N 3.35Å; F72-L76 HydrophobicContact CE1-CD2 4.31Å; F72-L76 WeakPolarHBondContact O-CB 3.28Å; F72-L76 PolarHBondContact O-N 3.27Å |
| 73 | L | 97.7 | Very high | 96.1 | Very high | 97 Ų | 97 | 99 Ų | 99 | 51% | 0.508 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -67.2 | -36.8 | -179.5 | -70.7 | 176.5 | 0 | 0 | 0 | 112.2 | F69 E70 L76 R77 | F69-L73 WeakPolarHBondContact O-CB 3.35Å; F69-L73 VanDerWaalsContact O-CG 3.28Å; F69-L73 WeakPolarHBondContact O-CG 3.23Å; F69-L73 PolarHBondContact O-N 2.87Å; E70-L73 PolarHBondContact O-N 3.1Å; L73-L76 PolarHBondContact O-N 3.37Å; L73-R77 WeakPolarHBondContact O-CB 3.49Å; L73-R77 PolarHBondContact O-N 2.96Å |
| 74 | T | 97.3 | Very high | 95.5 | Very high | 68 Ų | 68 | 102.1 Ų | 102.1 | 42% | 0.417 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.1 | -44.3 | 174.3 | 49.1 | 0 | 0 | 0 | 0 | 111.3 | E70 S71 F72 R77 T78 | E70-T74 WeakPolarHBondContact O-CB 3.22Å; E70-T74 VanDerWaalsContact O-CG2 3.23Å; E70-T74 WeakPolarHBondContact O-CG2 3.48Å; E70-T74 PolarHBondContact O-N 2.78Å; E70-T74 PolarHBondContact O-OG1 3.03Å; S71-T74 VanDerWaalsContact CA-OG1 3.31Å; S71-T74 WeakPolarHBondContact CA-OG1 3.39Å; S71-T74 PolarHBondContact O-OG1 3.31Å; F72-T74 PolarHBondContact O-N 3.07Å; T74-R77 WeakPolarHBondContact O-CB 3Å; T74-R77 PolarHBondContact O-N 2.94Å; T74-T78 PolarHBondContact O-N 3.32Å; T74-T78 PolarHBondContact O-OG1 3.1Å |
| 75 | Q | 97.2 | Very high | 94.3 | Very high | 105 Ų | 105 | 102.6 Ų | 102.6 | 49% | 0.491 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.8 | -45.9 | 174.2 | -172.9 | 64.6 | 53.6 | 0 | 0 | 112 | S71 F72 R77 T78 D79 | S71-Q75 WeakPolarHBondContact O-CB 3.42Å; S71-Q75 PolarHBondContact O-N 3.33Å; F72-Q75 PolarHBondContact O-N 3.35Å; Q75-R77 PolarHBondContact O-N 3.5Å; Q75-T78 WeakPolarHBondContact CA-OG1 3.5Å; Q75-T78 PolarHBondContact NE2-OG1 3.03Å; Q75-T78 PolarHBondContact O-N 3.14Å; Q75-T78 VanDerWaalsContact O-N 3.17Å; Q75-T78 PolarHBondContact O-OG1 3.45Å; Q75-D79 PolarHBondContact NE2-OD1 2.98Å; Q75-D79 PolarHBondContact O-N 2.72Å |
| 76 | L | 97.1 | Very high | 93 | Very high | 78 Ų | 78 | 103.4 Ų | 103.4 | 41% | 0.408 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -59.7 | -39.2 | 177.7 | -176.2 | 65.4 | 0 | 0 | 0 | 111.3 | F72 L73 L80 | F72-L76 HydrophobicContact CE1-CD2 4.31Å; F72-L76 WeakPolarHBondContact O-CB 3.28Å; F72-L76 PolarHBondContact O-N 3.27Å; L73-L76 PolarHBondContact O-N 3.37Å; L76-L80 HydrophobicContact CG-CD1 4.43Å; L76-L80 WeakPolarHBondContact O-CB 3.45Å; L76-L80 WeakPolarHBondContact O-CG 3.31Å; L76-L80 PolarHBondContact O-N 3.38Å; L76-L80 VanDerWaalsContact O-N 3.09Å |
| 77 | R | 96.7 | Very high | 91.2 | Very high | 175 Ų | 175 | 103.9 Ų | 103.9 | 66% | 0.66 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -66.1 | -42.4 | 176.7 | -172.2 | 179.9 | -170.9 | 126.8 | 0.8 | 111.9 | L73 T74 Q75 Q81 | L73-R77 WeakPolarHBondContact O-CB 3.49Å; L73-R77 PolarHBondContact O-N 2.96Å; T74-R77 WeakPolarHBondContact O-CB 3Å; T74-R77 PolarHBondContact O-N 2.94Å; Q75-R77 PolarHBondContact O-N 3.5Å; R77-Q81 VanDerWaalsContact O-CG 3.31Å; R77-Q81 WeakPolarHBondContact O-CG 3.5Å; R77-Q81 PolarHBondContact O-N 2.71Å; R77-Q81 VanDerWaalsContact O-N 3.09Å |
| 78 | T | 96.6 | Very high | 89.1 | Confident | 55 Ų | 55 | 112.6 Ų | 112.6 | 34% | 0.337 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64.5 | -44.1 | 177.1 | 50.2 | 0 | 0 | 0 | 0 | 111 | T74 Q75 L80 Q81 E82 | T74-T78 PolarHBondContact O-N 3.32Å; T74-T78 PolarHBondContact O-OG1 3.1Å; Q75-T78 WeakPolarHBondContact CA-OG1 3.5Å; Q75-T78 PolarHBondContact NE2-OG1 3.03Å; Q75-T78 PolarHBondContact O-N 3.14Å; Q75-T78 VanDerWaalsContact O-N 3.17Å; Q75-T78 PolarHBondContact O-OG1 3.45Å; T78-L80 VanDerWaalsContact C-N 3.34Å; T78-L80 PolarHBondContact O-N 3Å; T78-Q81 WeakPolarHBondContact O-CB 3.42Å; T78-Q81 PolarHBondContact O-N 2.98Å; T78-Q81 VanDerWaalsContact O-N 3.08Å; T78-E82 PolarHBondContact O-N 3.38Å |
| 79 | D | 95.9 | Very high | 87 | Confident | 75 Ų | 75 | 113.1 Ų | 113.1 | 40% | 0.401 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -62.3 | -41.6 | -179.8 | -65.7 | -0.4 | 0 | 0 | 0 | 111.4 | Q75 Q81 E82 L83 | Q75-D79 PolarHBondContact NE2-OD1 2.98Å; Q75-D79 PolarHBondContact O-N 2.72Å; D79-Q81 VanDerWaalsContact C-N 3.34Å; D79-Q81 PolarHBondContact O-N 3.11Å; D79-E82 PolarHBondContact O-N 3.04Å; D79-L83 WeakPolarHBondContact O-CB 3.39Å; D79-L83 PolarHBondContact O-N 3.3Å |
| 80 | L | 95 | Very high | 84.8 | Confident | 98 Ų | 98 | 109.7 Ų | 109.7 | 51% | 0.513 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -66.6 | -33.7 | 175.3 | -73.2 | 175.4 | 0 | 0 | 0 | 112.8 | L76 T78 K84 | L76-L80 HydrophobicContact CG-CD1 4.43Å; L76-L80 WeakPolarHBondContact O-CB 3.45Å; L76-L80 WeakPolarHBondContact O-CG 3.31Å; L76-L80 PolarHBondContact O-N 3.38Å; L76-L80 VanDerWaalsContact O-N 3.09Å; T78-L80 VanDerWaalsContact C-N 3.34Å; T78-L80 PolarHBondContact O-N 3Å; L80-K84 WeakPolarHBondContact O-CB 3.38Å; L80-K84 WeakPolarHBondContact O-CG 3.3Å; L80-K84 PolarHBondContact O-N 3.06Å; L80-K84 VanDerWaalsContact O-N 3.09Å |
| 81 | Q | 92 | Very high | 82.7 | Confident | 101 Ų | 101 | 112.4 Ų | 112.4 | 47% | 0.472 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -70.3 | -43 | 174.7 | -75.2 | 177.9 | -21.1 | 0 | 0 | 111.3 | R77 T78 D79 K84 L85 | R77-Q81 VanDerWaalsContact O-CG 3.31Å; R77-Q81 WeakPolarHBondContact O-CG 3.5Å; R77-Q81 PolarHBondContact O-N 2.71Å; R77-Q81 VanDerWaalsContact O-N 3.09Å; T78-Q81 WeakPolarHBondContact O-CB 3.42Å; T78-Q81 PolarHBondContact O-N 2.98Å; T78-Q81 VanDerWaalsContact O-N 3.08Å; D79-Q81 VanDerWaalsContact C-N 3.34Å; D79-Q81 PolarHBondContact O-N 3.11Å; Q81-K84 WeakPolarHBondContact O-CB 3.43Å; Q81-K84 PolarHBondContact O-N 3.35Å; Q81-L85 WeakPolarHBondContact O-CG 3.44Å; Q81-L85 PolarHBondContact O-N 3.4Å |
| 82 | E | 91.4 | Very high | 80.4 | Confident | 134 Ų | 134 | 114.8 Ų | 114.8 | 63% | 0.626 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -61.9 | -43.8 | 174.6 | -72.2 | -170.7 | 177 | 0 | 0 | 111.4 | T78 D79 K84 L85 S86 | T78-E82 PolarHBondContact O-N 3.38Å; D79-E82 PolarHBondContact O-N 3.04Å; E82-K84 VanDerWaalsContact C-N 3.31Å; E82-K84 PolarHBondContact O-N 3.04Å; E82-L85 PolarHBondContact O-N 3.12Å; E82-L85 VanDerWaalsContact O-N 3.16Å; E82-S86 WeakPolarHBondContact O-CB 3.08Å; E82-S86 PolarHBondContact O-N 3.22Å |
| 83 | L | 89.5 | Confident | 78.1 | Confident | 121 Ų | 121 | 114.3 Ų | 114.3 | 63% | 0.634 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -60.3 | -41.2 | 176.1 | -173.3 | 65 | 0 | 0 | 0 | 111.8 | D79 L85 S86 G87 | D79-L83 WeakPolarHBondContact O-CB 3.39Å; D79-L83 PolarHBondContact O-N 3.3Å; L83-L85 VanDerWaalsContact C-N 3.35Å; L83-L85 PolarHBondContact O-N 3.41Å; L83-S86 PolarHBondContact O-N 3.32Å; L83-G87 PolarHBondContact O-N 3.17Å |
| 84 | K | 83.9 | Confident | 75.9 | Confident | 168 Ų | 168 | 117.1 Ų | 117.1 | 73% | 0.73 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -64.1 | -36.5 | 175.6 | -83.9 | -176.1 | 162.2 | -176.2 | 0 | 113.2 | L80 Q81 E82 | L80-K84 WeakPolarHBondContact O-CB 3.38Å; L80-K84 WeakPolarHBondContact O-CG 3.3Å; L80-K84 PolarHBondContact O-N 3.06Å; L80-K84 VanDerWaalsContact O-N 3.09Å; Q81-K84 WeakPolarHBondContact O-CB 3.43Å; Q81-K84 PolarHBondContact O-N 3.35Å; E82-K84 VanDerWaalsContact C-N 3.31Å; E82-K84 PolarHBondContact O-N 3.04Å |
| 85 | L | 72.8 | Confident | 73.4 | Confident | 134 Ų | 134 | 120.6 Ų | 120.6 | 70% | 0.702 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -75.6 | -40 | 177.6 | -66.9 | 173.5 | 0 | 0 | 0 | 111.3 | Q81 E82 L83 G87 R88 | Q81-L85 WeakPolarHBondContact O-CG 3.44Å; Q81-L85 PolarHBondContact O-N 3.4Å; E82-L85 PolarHBondContact O-N 3.12Å; E82-L85 VanDerWaalsContact O-N 3.16Å; L83-L85 VanDerWaalsContact C-N 3.35Å; L83-L85 PolarHBondContact O-N 3.41Å; L85-G87 VanDerWaalsContact C-N 3.34Å; L85-G87 PolarHBondContact O-N 3.18Å; L85-R88 PolarHBondContact O-N 2.95Å |
| 86 | S | 68.6 | Low | 70.9 | Confident | 104 Ų | 104 | 121.3 Ų | 121.3 | 73% | 0.727 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -64.5 | -36.2 | 176.7 | -117.4 | 0 | 0 | 0 | 0 | 112.6 | E82 L83 R88 | E82-S86 WeakPolarHBondContact O-CB 3.08Å; E82-S86 PolarHBondContact O-N 3.22Å; L83-S86 PolarHBondContact O-N 3.32Å; S86-R88 PolarHBondContact O-N 2.96Å |
| 87 | G | 60.1 | Low | 68.4 | Low | 70 Ų | 70 | 122.8 Ų | 122.8 | 72% | 0.722 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.5 | -13.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | L83 L85 | L83-G87 PolarHBondContact O-N 3.17Å; L85-G87 VanDerWaalsContact C-N 3.34Å; L85-G87 PolarHBondContact O-N 3.18Å |
| 88 | R | 53.9 | Low | 66.4 | Low | 224 Ų | 224 | 121.8 Ų | 121.8 | 85% | 0.845 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.7 | -4.2 | -171.8 | -166.2 | 165.8 | 169 | -179.6 | -3.6 | 114.7 | L85 S86 | L85-R88 PolarHBondContact O-N 2.95Å; S86-R88 PolarHBondContact O-N 2.96Å |
| 89 | S | 52.5 | Low | 64.5 | Low | 117 Ų | 117 | 125.7 Ų | 125.7 | 82% | 0.818 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -93 | 9.8 | -174.9 | -101 | 0 | 0 | 0 | 0 | 116.2 | ||
| 90 | G | 50.8 | Low | 62.2 | Low | 64 Ų | 64 | 125.6 Ų | 125.6 | 66% | 0.66 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -120.1 | -17.3 | -171.1 | 0 | 0 | 0 | 0 | 0 | 119 | ||
| 91 | L | 53.3 | Low | 59.8 | Low | 176 Ų | 176 | 128.3 Ų | 128.3 | 92% | 0.921 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -140.4 | 36.7 | -161.8 | -65 | 174.6 | 0 | 0 | 0 | 115.9 | ||
| 92 | S | 48.9 | Very low | 57.6 | Low | 119 Ų | 119 | 127.3 Ų | 127.3 | 83% | 0.832 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -123 | 55.2 | 165.6 | 84.4 | 0 | 0 | 0 | 0 | 112 | ||
| 93 | S | 48.4 | Very low | 55.6 | Low | 117 Ų | 117 | 128.9 Ų | 128.9 | 82% | 0.818 | 77% | 0.772 | S | S | * | * | trans | -156.8 | 65.4 | 165.5 | -158.1 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 94 | L | 52.2 | Low | 53.7 | Low | 157 Ų | 157 | 127.9 Ų | 127.9 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | trans | -137.4 | 119.5 | 162 | -130.6 | 86.2 | 0 | 0 | 0 | 107.5 | ||||
| 95 | D | 45.6 | Very low | 51.9 | Low | 141 Ų | 141 | 123.5 Ų | 123.5 | 75% | 0.754 | 78% | 0.783 | S | S | * | * | trans | 80.2 | 74.3 | 157.1 | -53.7 | -25.5 | 0 | 0 | 0 | 120.2 | ||||
| 96 | S | 43.2 | Very low | 50.8 | Low | 119 Ų | 119 | 128.7 Ų | 128.7 | 83% | 0.832 | 79% | 0.793 | S | S | * | * | -83.5 | 134.6 | 118 | -99.1 | 0 | 0 | 0 | 0 | 107 | |||||
| 97 | P | 45.4 | Very low | 49.7 | Very low | 109 Ų | 109 | 132.3 Ų | 132.3 | 71% | 0.708 | 80% | 0.799 | S | S | * | * | -148.2 | 150.6 | 54.4 | 37.3 | -17.6 | 0 | 0 | 0 | 115 | |||||
| 98 | N | 55 | Low | 49.3 | Very low | 155 Ų | 155 | 135.6 Ų | 135.6 | 83% | 0.829 | 80% | 0.804 | S | S | * | * | trans | -146.8 | 134.1 | 142.5 | -156.9 | 8.3 | 0 | 0 | 0 | 112.1 | ||||
| 99 | N | 56.1 | Low | 49 | Very low | 137 Ų | 137 | 129.4 Ų | 129.4 | 73% | 0.733 | 80% | 0.801 | S | S | * | * | trans | -67.7 | 147.5 | -169.2 | -61.4 | -71.2 | 0 | 0 | 0 | 111.7 | ||||
| 100 | G | 46.5 | Very low | 48.7 | Very low | 72 Ų | 72 | 128.7 Ų | 128.7 | 74% | 0.742 | 80% | 0.803 | S | S | * | * | trans | -69.6 | 134 | 159.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 101 | D | 45.2 | Very low | 48.6 | Very low | 155 Ų | 155 | 130.8 Ų | 130.8 | 83% | 0.829 | 81% | 0.814 | S | S | * | * | trans | -173.5 | 102.6 | 143.6 | -110.3 | -19.6 | 0 | 0 | 0 | 105.6 | ||||
| 102 | A | 46 | Very low | 48 | Very low | 81 Ų | 81 | 130.3 Ų | 130.3 | 67% | 0.669 | 81% | 0.807 | S | S | * | * | 52.4 | 95.7 | 89.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 103 | L | 50.3 | Low | 48.5 | Very low | 167 Ų | 167 | 136.4 Ų | 136.4 | 87% | 0.874 | 81% | 0.811 | S | S | * | * | 169.7 | 117.7 | 123 | -89.8 | 158.7 | 0 | 0 | 0 | 111.8 | |||||
| 104 | A | 48.4 | Very low | 48.5 | Very low | 99 Ų | 99 | 134.4 Ų | 134.4 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | 42.3 | 118.7 | 134.8 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 105 | G | 45.8 | Very low | 48.2 | Very low | 76 Ų | 76 | 134.8 Ų | 134.8 | 78% | 0.784 | 80% | 0.799 | S | S | * | * | 145.8 | 112.3 | 129.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | |||||
| 106 | R | 51.2 | Low | 48.4 | Very low | 243 Ų | 243 | 132.1 Ų | 132.1 | 92% | 0.917 | 80% | 0.796 | S | S | * | * | trans | 104.1 | 94.7 | 135 | -159.3 | 165.2 | 164 | -147.7 | -5.2 | 117.2 | ||||
| 107 | E | 44.7 | Very low | 48.7 | Very low | 180 Ų | 180 | 132.3 Ų | 132.3 | 84% | 0.841 | 80% | 0.795 | S | S | * | * | trans | -42.2 | 150.3 | 146.2 | -80.1 | 174.5 | 108.2 | 0 | 0 | 112.3 | ||||
| 108 | V | 52.1 | Low | 48.6 | Very low | 139 Ų | 139 | 136.2 Ų | 136.2 | 84% | 0.842 | 80% | 0.803 | S | S | * | * | -174.9 | 133.9 | 117.4 | 151.2 | 0 | 0 | 0 | 0 | 110.1 | |||||
| 109 | X | 47.9 | Very low | 48.4 | Very low | 95 Ų | 95 | 134.7 Ų | 134.7 | 79% | 0.785 | 80% | 0.802 | S | S | * | * | trans | 86.4 | 99.6 | 153.6 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 110 | X | 46.8 | Very low | 47.7 | Very low | 102 Ų | 102 | 138 Ų | 138 | 84% | 0.843 | 81% | 0.81 | S | S | * | * | trans | -58 | 151 | 155.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 111 | X | 48.1 | Very low | 48.1 | Very low | 108 Ų | 108 | 140.5 Ų | 140.5 | 89% | 0.893 | 82% | 0.816 | S | S | * | * | trans | -155.3 | 106.7 | 139.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 112 | E | 39.6 | Very low | 47.9 | Very low | 165 Ų | 165 | 139.2 Ų | 139.2 | 77% | 0.771 | 81% | 0.814 | S | S | * | * | trans | -73.1 | 145.4 | 171.8 | 175.1 | 178.2 | 176.7 | 0 | 0 | 111 | ||||
| 113 | W | 59.1 | Low | 48 | Very low | 247 Ų | 247 | 143.1 Ų | 143.1 | 94% | 0.936 | 82% | 0.823 | S | S | * | * | trans | -147.9 | 135.8 | 145.2 | -115.5 | 97 | 0 | 0 | 0 | 110.9 | ||||
| 114 | P | 49.6 | Very low | 47.7 | Very low | 76 Ų | 76 | 142.9 Ų | 142.9 | 49% | 0.494 | 82% | 0.817 | S | S | . | * | trans | -100.8 | 150.3 | -165.4 | 2 | 22.4 | 0 | 0 | 0 | 114.1 | ||||
| 115 | D | 46.6 | Very low | 47.3 | Very low | 165 Ų | 165 | 145.3 Ų | 145.3 | 88% | 0.882 | 82% | 0.816 | S | S | * | * | trans | 29.4 | 150.2 | 136.6 | -134 | -9.3 | 0 | 0 | 0 | 123.8 | ||||
| 116 | A | 48.6 | Very low | 47.5 | Very low | 84 Ų | 84 | 149.5 Ų | 149.5 | 69% | 0.694 | 82% | 0.815 | S | S | * | * | trans | 103.3 | 156.3 | 160.1 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 117 | P | 48.7 | Very low | 47.3 | Very low | 124 Ų | 124 | 144.7 Ų | 144.7 | 81% | 0.805 | 80% | 0.803 | S | S | * | * | cis | -134.5 | 164 | -27.9 | 28.7 | -7.6 | 0 | 0 | 0 | 114.9 | ||||
| 118 | Q | 43.6 | Very low | 47.4 | Very low | 190 Ų | 190 | 141.1 Ų | 141.1 | 89% | 0.888 | 79% | 0.793 | S | S | * | * | trans | -72 | 151.2 | 172.7 | -74.8 | -147.5 | -17.7 | 0 | 0 | 115.2 | ||||
| 119 | P | 51.4 | Low | 47.4 | Very low | 123 Ų | 123 | 140.1 Ų | 140.1 | 80% | 0.799 | 79% | 0.793 | S | S | * | * | trans | -105.1 | 126.6 | 159.1 | 32.6 | -21.9 | 0 | 0 | 0 | 113.5 | ||||
| 120 | K | 42.4 | Very low | 47.2 | Very low | 208 Ų | 208 | 142.9 Ų | 142.9 | 90% | 0.904 | 79% | 0.794 | S | S | * | * | trans | -62.4 | 138.1 | 164.7 | -86 | 158.5 | 170 | 165.2 | 0 | 111.4 | ||||
| 121 | S | 54.8 | Low | 47.5 | Very low | 123 Ų | 123 | 145.4 Ų | 145.4 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | -123.4 | 119.1 | 153.4 | 79.1 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 122 | T | 39.8 | Very low | 47.8 | Very low | 129 Ų | 129 | 147.2 Ų | 147.2 | 79% | 0.791 | 79% | 0.785 | S | S | * | * | trans | -96.6 | 125.9 | 172.8 | -3.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 123 | L | 47.8 | Very low | 48.1 | Very low | 163 Ų | 163 | 145 Ų | 145 | 85% | 0.853 | 79% | 0.787 | S | S | * | * | trans | 173.3 | 139.2 | 156.2 | -128.4 | 88.9 | 0 | 0 | 0 | 105.6 | ||||
| 124 | H | 45.2 | Very low | 47.7 | Very low | 162 Ų | 162 | 139 Ų | 139 | 75% | 0.75 | 78% | 0.78 | S | S | * | * | cis | -169.4 | 139.7 | 18.1 | -172.6 | -65.3 | 0 | 0 | 0 | 106.3 | ||||
| 125 | D | 40.2 | Very low | 47 | Very low | 150 Ų | 150 | 138.6 Ų | 138.6 | 80% | 0.802 | 79% | 0.79 | S | S | * | * | trans | -71.2 | 143.4 | 177.6 | -61.6 | -61.2 | 0 | 0 | 0 | 113.2 | ||||
| 126 | H | 49 | Very low | 47.5 | Very low | 163 Ų | 163 | 138.2 Ų | 138.2 | 76% | 0.755 | 79% | 0.787 | S | S | * | * | trans | -177.2 | 101.4 | 135.9 | -143.3 | -92.1 | 0 | 0 | 0 | 108.7 | ||||
| 127 | E | 47.8 | Very low | 47.1 | Very low | 143 Ų | 143 | 144.2 Ų | 144.2 | 67% | 0.668 | 80% | 0.797 | S | S | * | * | 75.6 | 118 | 96.5 | -134.3 | -156.8 | 104.8 | 0 | 0 | 115.8 | |||||
| 128 | T | 45.7 | Very low | 47.3 | Very low | 104 Ų | 104 | 144 Ų | 144 | 64% | 0.638 | 79% | 0.794 | S | S | * | * | trans | 57.4 | 109.9 | 142.6 | 48.5 | 0 | 0 | 0 | 0 | 120 | ||||
| 129 | S | 52.8 | Low | 47.2 | Very low | 119 Ų | 119 | 144.3 Ų | 144.3 | 83% | 0.832 | 80% | 0.795 | S | S | * | * | -177.6 | 127.5 | 101.6 | -89.1 | 0 | 0 | 0 | 0 | 112 | |||||
| 130 | D | 42.5 | Very low | 47.3 | Very low | 152 Ų | 152 | 143.9 Ų | 143.9 | 81% | 0.813 | 80% | 0.795 | S | S | * | * | trans | -51.1 | 145.2 | 167.1 | -60 | -64.3 | 0 | 0 | 0 | 112.4 | ||||
| 131 | I | 54.7 | Low | 47.5 | Very low | 155 Ų | 155 | 139.7 Ų | 139.7 | 80% | 0.795 | 79% | 0.792 | S | S | * | * | trans | -165.3 | 100 | 137.1 | -88.6 | 140.5 | 0 | 0 | 0 | 109 | ||||
| 132 | I | 54.1 | Low | 47.3 | Very low | 147 Ų | 147 | 142.1 Ų | 142.1 | 75% | 0.754 | 79% | 0.79 | S | S | * | * | trans | 52.9 | 104.6 | 131.8 | -49.4 | 163.9 | 0 | 0 | 0 | 118.1 | ||||
| 133 | S | 45.2 | Very low | 47.3 | Very low | 117 Ų | 117 | 141 Ų | 141 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | trans | -83.2 | 153.7 | 144.3 | -69.3 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 134 | P | 50.4 | Low | 47.6 | Very low | 121 Ų | 121 | 141.2 Ų | 141.2 | 79% | 0.786 | 79% | 0.79 | S | S | * | * | -149.7 | 145.7 | 93.6 | 35.3 | -16.6 | 0 | 0 | 0 | 116 | |||||
| 135 | G | 36.2 | Very low | 47.7 | Very low | 69 Ų | 69 | 139.3 Ų | 139.3 | 71% | 0.711 | 80% | 0.795 | S | S | * | * | trans | 98.8 | 91.7 | 130.1 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 136 | I | 55.7 | Low | 48.2 | Very low | 157 Ų | 157 | 138.3 Ų | 138.3 | 81% | 0.805 | 80% | 0.795 | S | S | * | * | trans | -137.5 | 110.3 | 139.8 | -43.1 | -85.3 | 0 | 0 | 0 | 107.1 | T138 | I136-T138 PolarHBondContact O-N 3.39Š| ||
| 137 | K | 41 | Very low | 49.3 | Very low | 209 Ų | 209 | 134.4 Ų | 134.4 | 91% | 0.909 | 79% | 0.791 | S | S | * | * | trans | -71.8 | 117.6 | 167.2 | -67.9 | 176.7 | 177 | -178 | 0 | 107.2 | ||||
| 138 | T | 53.3 | Low | 50.5 | Low | 120 Ų | 120 | 133.4 Ų | 133.4 | 74% | 0.736 | 80% | 0.797 | S | S | * | * | trans | -128.6 | 96.5 | 163.8 | -44.1 | 0 | 0 | 0 | 0 | 108.1 | I136 S140 | I136-T138 PolarHBondContact O-N 3.39Å; T138-S140 PolarHBondContact O-N 2.91Å | ||
| 139 | E | 41.7 | Very low | 51.9 | Low | 197 Ų | 197 | 134.7 Ų | 134.7 | 92% | 0.921 | 80% | 0.798 | S | S | * | * | trans | -63.3 | 117.6 | 156.3 | -89.1 | 170.8 | 99.2 | 0 | 0 | 108 | ||||
| 140 | S | 53.2 | Low | 53.3 | Low | 114 Ų | 114 | 136.8 Ų | 136.8 | 80% | 0.797 | 79% | 0.788 | S | S | * | * | trans | -169.2 | 112.8 | 138.1 | -173.7 | 0 | 0 | 0 | 0 | 109.7 | T138 | T138-S140 PolarHBondContact O-N 2.91Š| ||
| 141 | S | 45.4 | Very low | 55.3 | Low | 120 Ų | 120 | 133.7 Ų | 133.7 | 84% | 0.839 | 78% | 0.783 | S | S | * | * | trans | -67.8 | 122.3 | -177.9 | -47.1 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 142 | Q | 51 | Low | 56.9 | Low | 173 Ų | 173 | 129.9 Ų | 129.9 | 81% | 0.808 | 77% | 0.765 | S | S | * | * | trans | -158.8 | 94.4 | 142.3 | -166.4 | 159.4 | -25.7 | 0 | 0 | 109.2 | Q144 | Q142-Q144 PolarHBondContact O-N 3.38Å; Q142-Q144 VanDerWaalsContact O-N 3.1Å | ||
| 143 | A | 40.7 | Very low | 58.3 | Low | 106 Ų | 106 | 127.1 Ų | 127.1 | 88% | 0.876 | 75% | 0.748 | S | S | * | * | trans | -71.4 | 100 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 144 | Q | 53.1 | Low | 60.5 | Low | 167 Ų | 167 | 129.9 Ų | 129.9 | 78% | 0.78 | 74% | 0.741 | S | S | * | * | trans | -115.7 | 118.2 | 151.7 | -78.7 | -175 | -37.2 | 0 | 0 | 107.4 | Q142 T146 | Q142-Q144 PolarHBondContact O-N 3.38Å; Q142-Q144 VanDerWaalsContact O-N 3.1Å; Q144-T146 PolarHBondContact O-N 2.89Å | ||
| 145 | S | 47.3 | Very low | 62.1 | Low | 123 Ų | 123 | 127.5 Ų | 127.5 | 86% | 0.86 | 72% | 0.721 | S | S | * | * | trans | -63.4 | 117.5 | -179.7 | 162.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 146 | T | 52.2 | Low | 64.3 | Low | 128 Ų | 128 | 129 Ų | 129 | 79% | 0.785 | 71% | 0.71 | S | S | * | * | trans | -156.7 | 142.9 | 157.8 | 31.8 | 0 | 0 | 0 | 0 | 109.4 | Q144 | Q144-T146 PolarHBondContact O-N 2.89Š| ||
| 147 | A | 70.4 | Confident | 65.2 | Low | 81 Ų | 81 | 125.1 Ų | 125.1 | 67% | 0.669 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -46.4 | 162.3 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | I149 | A147-I149 PolarHBondContact O-N 3.48Š|
| 148 | P | 73.6 | Confident | 66.7 | Low | 123 Ų | 123 | 119.7 Ų | 119.7 | 80% | 0.799 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -53 | 117.8 | 174.6 | 22.2 | -34 | 0 | 0 | 0 | 110.5 | R150 | P148-R150 PolarHBondContact O-N 3.36Š|
| 149 | I | 75.6 | Confident | 67.5 | Low | 131 Ų | 131 | 118.2 Ų | 118.2 | 67% | 0.672 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 118.2 | 176.2 | -72 | 167.4 | 0 | 0 | 0 | 108.2 | A147 E153 | A147-I149 PolarHBondContact O-N 3.48Å; I149-E153 VanDerWaalsContact CA-OE1 3.32Å; I149-E153 WeakPolarHBondContact CA-OE1 3.32Å; I149-E153 HydrophobicContact CG2-CB 4.45Å; I149-E153 HydrophobicContact CG2-CG 4.49Å; I149-E153 WeakPolarHBondContact CG2-OE2 3.4Å |
| 150 | R | 82.7 | Confident | 68.6 | Low | 163 Ų | 163 | 112.8 Ų | 112.8 | 62% | 0.615 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 142.6 | 173.5 | -77.4 | -125.9 | -72.8 | 170 | -2.6 | 109 | P148 D152 E153 | P148-R150 PolarHBondContact O-N 3.36Å; R150-D152 PolarHBondContact O-N 3.18Å; R150-E153 HydrophobicContact CB-CG 4.32Å; R150-E153 PolarHBondContact N-OE1 3.23Å; R150-E153 PolarHBondContact O-N 3.17Å |
| 151 | A | 84.4 | Confident | 68.9 | Low | 86 Ų | 86 | 112.1 Ų | 112.1 | 71% | 0.711 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.1 | -20.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | W154 | A151-W154 PolarHBondContact O-NE1 3.04Š|
| 152 | D | 86.7 | Confident | 69.5 | Low | 76 Ų | 76 | 111 Ų | 111 | 41% | 0.406 | 64% | 0.642 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -98.3 | 2 | -177.1 | -55.8 | -35 | 0 | 0 | 0 | 113.7 | R150 W154 I155 E156 | R150-D152 PolarHBondContact O-N 3.18Å; D152-W154 PolarHBondContact O-N 3.08Å; D152-W154 VanDerWaalsContact O-N 3.1Å; D152-I155 HydrophobicContact CB-CD1 4.18Å; D152-I155 WeakPolarHBondContact O-CA 3.38Å; D152-I155 VanDerWaalsContact O-CB 3.31Å; D152-I155 WeakPolarHBondContact O-CB 3.41Å; D152-I155 PolarHBondContact O-N 3.22Å; D152-E156 PolarHBondContact O-N 3.32Å |
| 153 | E | 84.3 | Confident | 69.9 | Low | 88 Ų | 88 | 111.5 Ų | 111.5 | 41% | 0.411 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -58.3 | -28.7 | -178.4 | -84.8 | -178.9 | -161.4 | 0 | 0 | 113.1 | I149 R150 I155 E156 S157 | I149-E153 VanDerWaalsContact CA-OE1 3.32Å; I149-E153 WeakPolarHBondContact CA-OE1 3.32Å; I149-E153 HydrophobicContact CG2-CB 4.45Å; I149-E153 HydrophobicContact CG2-CG 4.49Å; I149-E153 WeakPolarHBondContact CG2-OE2 3.4Å; R150-E153 HydrophobicContact CB-CG 4.32Å; R150-E153 PolarHBondContact N-OE1 3.23Å; R150-E153 PolarHBondContact O-N 3.17Å; E153-I155 PolarHBondContact O-N 3.2Å; E153-E156 PolarHBondContact O-N 3.45Å; E153-S157 PolarHBondContact O-N 3.47Å; E153-S157 VanDerWaalsContact O-N 3.07Å |
| 154 | W | 91.1 | Very high | 70.5 | Confident | 175 Ų | 175 | 115.3 Ų | 115.3 | 66% | 0.663 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -65.1 | -29.2 | 175.3 | 72 | -86.6 | 0 | 0 | 0 | 112.2 | A151 D152 S157 | A151-W154 PolarHBondContact O-NE1 3.04Å; D152-W154 PolarHBondContact O-N 3.08Å; D152-W154 VanDerWaalsContact O-N 3.1Å; W154-S157 PolarHBondContact O-OG 3.44Å |
| 155 | I | 85 | Confident | 70 | Confident | 72 Ų | 72 | 110.3 Ų | 110.3 | 37% | 0.369 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -73 | -43.8 | 176.9 | -52.9 | 177.9 | 0 | 0 | 0 | 109.9 | D152 E153 S157 V158 T159 | D152-I155 HydrophobicContact CB-CD1 4.18Å; D152-I155 WeakPolarHBondContact O-CA 3.38Å; D152-I155 VanDerWaalsContact O-CB 3.31Å; D152-I155 WeakPolarHBondContact O-CB 3.41Å; D152-I155 PolarHBondContact O-N 3.22Å; E153-I155 PolarHBondContact O-N 3.2Å; I155-S157 PolarHBondContact O-N 3.44Å; I155-V158 WeakPolarHBondContact O-CG2 3.36Å; I155-V158 PolarHBondContact O-N 2.96Å; I155-T159 PolarHBondContact O-N 3.49Å; I155-T159 PolarHBondContact O-OG1 3.32Å |
| 156 | E | 80.8 | Confident | 70.1 | Confident | 101 Ų | 101 | 110.9 Ų | 110.9 | 47% | 0.472 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -65.1 | -31.6 | 178.7 | -65.1 | -178.7 | -171.3 | 0 | 0 | 111.4 | D152 E153 V158 T159 S160 | D152-E156 PolarHBondContact O-N 3.32Å; E153-E156 PolarHBondContact O-N 3.45Å; E156-V158 VanDerWaalsContact C-N 3.35Å; E156-V158 PolarHBondContact O-N 3.2Å; E156-T159 WeakPolarHBondContact CA-OG1 3.4Å; E156-T159 PolarHBondContact O-N 2.93Å; E156-T159 PolarHBondContact O-OG1 3.33Å; E156-T159 VanDerWaalsContact O-OG1 3.11Å; E156-S160 WeakPolarHBondContact O-CB 3.37Å; E156-S160 PolarHBondContact O-N 3.43Å; E156-S160 PolarHBondContact O-OG 3.07Å |
| 157 | S | 75.4 | Confident | 69.9 | Low | 75 Ų | 75 | 111.1 Ų | 111.1 | 52% | 0.524 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -65.6 | -33.2 | 176.5 | 78.8 | 0 | 0 | 0 | 0 | 113.6 | E153 W154 I155 | E153-S157 PolarHBondContact O-N 3.47Å; E153-S157 VanDerWaalsContact O-N 3.07Å; W154-S157 PolarHBondContact O-OG 3.44Å; I155-S157 PolarHBondContact O-N 3.44Å |
| 158 | V | 72.3 | Confident | 68.9 | Low | 95 Ų | 95 | 114.5 Ų | 114.5 | 58% | 0.576 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -79.3 | -29.5 | 177.7 | -64.2 | 0 | 0 | 0 | 0 | 112.4 | I155 E156 | I155-V158 WeakPolarHBondContact O-CG2 3.36Å; I155-V158 PolarHBondContact O-N 2.96Å; E156-V158 VanDerWaalsContact C-N 3.35Å; E156-V158 PolarHBondContact O-N 3.2Å |
| 159 | T | 71.3 | Confident | 67.7 | Low | 89 Ų | 89 | 115 Ų | 115 | 55% | 0.546 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -82 | -36 | 176.9 | 54.2 | 0 | 0 | 0 | 0 | 112.4 | I155 E156 S161 S162 | I155-T159 PolarHBondContact O-N 3.49Å; I155-T159 PolarHBondContact O-OG1 3.32Å; E156-T159 WeakPolarHBondContact CA-OG1 3.4Å; E156-T159 PolarHBondContact O-N 2.93Å; E156-T159 PolarHBondContact O-OG1 3.33Å; E156-T159 VanDerWaalsContact O-OG1 3.11Å; T159-S161 VanDerWaalsContact C-N 3.3Å; T159-S161 PolarHBondContact O-N 2.88Å; T159-S162 WeakPolarHBondContact O-CB 3.4Å; T159-S162 PolarHBondContact O-N 3.29Å |
| 160 | S | 63.8 | Low | 66.2 | Low | 83 Ų | 83 | 110.8 Ų | 110.8 | 58% | 0.58 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -73.8 | -20 | -177.6 | -53.1 | 0 | 0 | 0 | 0 | 113.3 | E156 S162 | E156-S160 WeakPolarHBondContact O-CB 3.37Å; E156-S160 PolarHBondContact O-N 3.43Å; E156-S160 PolarHBondContact O-OG 3.07Å; S160-S162 PolarHBondContact O-N 3.46Å |
| 161 | S | 60 | Low | 64.7 | Low | 99 Ų | 99 | 112.2 Ų | 112.2 | 69% | 0.692 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.3 | -8 | 174.6 | -173.7 | 0 | 0 | 0 | 0 | 113.5 | T159 | T159-S161 VanDerWaalsContact C-N 3.3Å; T159-S161 PolarHBondContact O-N 2.88Å |
| 162 | S | 58.8 | Low | 63 | Low | 96 Ų | 96 | 114.2 Ų | 114.2 | 67% | 0.671 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.6 | -3.6 | -170 | -170.1 | 0 | 0 | 0 | 0 | 115.2 | T159 S160 | T159-S162 WeakPolarHBondContact O-CB 3.4Å; T159-S162 PolarHBondContact O-N 3.29Å; S160-S162 PolarHBondContact O-N 3.46Å |
| 163 | E | 58.5 | Low | 61.3 | Low | 184 Ų | 184 | 117.8 Ų | 117.8 | 86% | 0.86 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -87.9 | -2.6 | -174.7 | -63.8 | -166.3 | 143.4 | 0 | 0 | 114.7 | ||
| 164 | Q | 54.1 | Low | 60 | Low | 186 Ų | 186 | 116.7 Ų | 116.7 | 87% | 0.869 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -103.9 | 87.1 | 168.5 | -79 | -178.6 | -8.4 | 0 | 0 | 111.1 | ||
| 165 | G | 42.3 | Very low | 58.5 | Low | 63 Ų | 63 | 109.7 Ų | 109.7 | 65% | 0.649 | 66% | 0.658 | S | S | * | * | trans | 28.6 | 97.3 | 148.6 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 166 | T | 49.6 | Very low | 57.4 | Low | 134 Ų | 134 | 112.2 Ų | 112.2 | 82% | 0.822 | 67% | 0.671 | S | S | * | * | 174.1 | 140.4 | 119.3 | 29.5 | 0 | 0 | 0 | 0 | 107.9 | N168 | T166-N168 PolarHBondContact O-N 2.79Š| |||
| 167 | T | 46.6 | Very low | 56.6 | Low | 133 Ų | 133 | 112.5 Ų | 112.5 | 82% | 0.816 | 68% | 0.676 | S | S | * | * | trans | -52.2 | 89 | 178.7 | 50.1 | 0 | 0 | 0 | 0 | 112 | T169 | T167-T169 PolarHBondContact O-N 2.94Š| ||
| 168 | N | 49.4 | Very low | 56.1 | Low | 153 Ų | 153 | 115.5 Ų | 115.5 | 82% | 0.818 | 69% | 0.686 | S | S | * | * | trans | -91.5 | 63.9 | 172.9 | -153.6 | 7.5 | 0 | 0 | 0 | 109.5 | T166 G170 | T166-N168 PolarHBondContact O-N 2.79Å; N168-G170 PolarHBondContact O-N 3.43Å | ||
| 169 | T | 49.6 | Very low | 56.1 | Low | 132 Ų | 132 | 118.6 Ų | 118.6 | 81% | 0.81 | 69% | 0.694 | S | S | * | * | trans | -77.9 | 107.7 | 165.8 | -17.5 | 0 | 0 | 0 | 0 | 107 | T167 | T167-T169 PolarHBondContact O-N 2.94Š| ||
| 170 | G | 42.7 | Very low | 56.1 | Low | 44 Ų | 44 | 117.5 Ų | 117.5 | 45% | 0.454 | 69% | 0.685 | S | S | . | * | trans | 90.7 | 121.7 | 166.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | N168 | N168-G170 PolarHBondContact O-N 3.43Š| ||
| 171 | H | 51.3 | Low | 56.6 | Low | 192 Ų | 192 | 117.8 Ų | 117.8 | 89% | 0.889 | 68% | 0.684 | S | S | * | * | -166.2 | 86.9 | 110.5 | -93.9 | 80.5 | 0 | 0 | 0 | 104.7 | H173 | H171-H173 PolarHBondContact O-N 3.16Å; H171-H173 VanDerWaalsContact O-N 3.12Å | |||
| 172 | C | 50 | Low | 57.1 | Low | 129 Ų | 129 | 123.1 Ų | 123.1 | 87% | 0.872 | 70% | 0.698 | S | S | * | * | trans | -54 | 122.6 | 157 | -90 | 0 | 0 | 0 | 0 | 106.2 | A174 | C172-A174 VanDerWaalsContact C-N 3.35Å; C172-A174 PolarHBondContact O-N 3.33Å | ||
| 173 | H | 50.4 | Low | 58.1 | Low | 150 Ų | 150 | 122.1 Ų | 122.1 | 69% | 0.694 | 70% | 0.702 | S | S | * | * | trans | -60.9 | 92.4 | -173.5 | -164.5 | -84.3 | 0 | 0 | 0 | 109.6 | H171 G175 L176 | H171-H173 PolarHBondContact O-N 3.16Å; H171-H173 VanDerWaalsContact O-N 3.12Å; H173-G175 PolarHBondContact O-N 3.07Å; H173-L176 PolarHBondContact O-N 2.91Å | ||
| 174 | A | 57.4 | Low | 58.8 | Low | 66 Ų | 66 | 117.7 Ų | 117.7 | 55% | 0.545 | 68% | 0.684 | S | S | . | * | G | 310 helix | trans | -56.2 | -15.5 | -179 | 0 | 0 | 0 | 0 | 0 | 113.2 | C172 L176 L177 | C172-A174 VanDerWaalsContact C-N 3.35Å; C172-A174 PolarHBondContact O-N 3.33Å; A174-L176 VanDerWaalsContact C-N 3.26Å; A174-L176 PolarHBondContact O-N 3.28Å; A174-L177 PolarHBondContact O-N 3.42Å |
| 175 | G | 59.6 | Low | 59.7 | Low | 28 Ų | 28 | 115.3 Ų | 115.3 | 29% | 0.289 | 68% | 0.682 | S | S | . | * | G | 310 helix | trans | -63 | -23.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | H173 | H173-G175 PolarHBondContact O-N 3.07Š|
| 176 | L | 62.2 | Low | 61.3 | Low | 124 Ų | 124 | 117.3 Ų | 117.3 | 65% | 0.649 | 68% | 0.677 | S | S | * | * | G | 310 helix | trans | -73.8 | -34.5 | 177.6 | -72.8 | 175.3 | 0 | 0 | 0 | 112.3 | H173 A174 N178 Q179 | H173-L176 PolarHBondContact O-N 2.91Å; A174-L176 VanDerWaalsContact C-N 3.26Å; A174-L176 PolarHBondContact O-N 3.28Å; L176-N178 PolarHBondContact O-N 2.91Å; L176-Q179 PolarHBondContact O-N 3.5Å |
| 177 | L | 63.1 | Low | 62.9 | Low | 107 Ų | 107 | 118.8 Ų | 118.8 | 56% | 0.56 | 68% | 0.675 | S | S | * | * | G | 310 helix | trans | -67.5 | -28.9 | 176.9 | -67.6 | 175 | 0 | 0 | 0 | 111.9 | A174 Q179 L180 I186 | A174-L177 PolarHBondContact O-N 3.42Å; L177-Q179 PolarHBondContact O-N 3.31Å; L177-L180 HydrophobicContact CD2-CD1 3.99Å; L177-L180 PolarHBondContact O-N 3.4Å; L177-I186 HydrophobicContact CD2-CD1 3.84Å |
| 178 | N | 65.4 | Low | 64.5 | Low | 138 Ų | 138 | 117.9 Ų | 117.9 | 74% | 0.738 | 67% | 0.671 | S | S | * | * | G | 310 helix | trans | -72.3 | -9.3 | 178.9 | -67.5 | -19.2 | 0 | 0 | 0 | 114.2 | L176 | L176-N178 PolarHBondContact O-N 2.91Š|
| 179 | Q | 71.2 | Confident | 66 | Low | 161 Ų | 161 | 116.5 Ų | 116.5 | 75% | 0.752 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -92.6 | -5.8 | 175.5 | -70.4 | -172.1 | 44.8 | 0 | 0 | 113.4 | L176 L177 | L176-Q179 PolarHBondContact O-N 3.5Å; L177-Q179 PolarHBondContact O-N 3.31Å |
| 180 | L | 71.9 | Confident | 67.7 | Low | 66 Ų | 66 | 114.5 Ų | 114.5 | 35% | 0.346 | 64% | 0.642 | S | S | . | * | S | Bend | trans | -73.5 | 137.6 | 177.7 | -65 | 167.2 | 0 | 0 | 0 | 109.7 | L177 H182 I184 I186 | L177-L180 HydrophobicContact CD2-CD1 3.99Å; L177-L180 PolarHBondContact O-N 3.4Å; L180-H182 PolarHBondContact O-N 2.87Å; L180-I184 HydrophobicContact CB-CB 4.23Å; L180-I184 HydrophobicContact CB-CD1 4.42Å; L180-I184 HydrophobicContact CD1-CG2 4.34Å; L180-I184 HydrophobicContact CD2-CD1 4.11Å; L180-I186 HydrophobicContact CD1-CD1 3.38Å; L180-I186 HydrophobicContact CD1-CG1 4.11Å |
| 181 | P | 74.9 | Confident | 69.9 | Low | 89 Ų | 89 | 114.9 Ų | 114.9 | 58% | 0.578 | 65% | 0.646 | S | S | * | * | trans | -48.9 | 141.3 | 172.3 | -26.4 | 32.1 | 0 | 0 | 0 | 111.1 | G183 I184 | P181-G183 PolarHBondContact O-N 3.37Å; P181-I184 HydrophobicContact CG-CD1 4.35Å; P181-I184 PolarHBondContact O-N 3.44Å | ||
| 182 | H | 70.9 | Confident | 71.6 | Confident | 211 Ų | 211 | 107.3 Ų | 107.3 | 98% | 0.977 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.7 | -5.9 | -177.2 | -71.7 | -101.4 | 0 | 0 | 0 | 115.7 | L180 | L180-H182 PolarHBondContact O-N 2.87Š|
| 183 | G | 78.9 | Confident | 73.2 | Confident | 74 Ų | 74 | 106 Ų | 106 | 76% | 0.763 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.7 | -8.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | P181 T185 | P181-G183 PolarHBondContact O-N 3.37Å; G183-T185 PolarHBondContact O-N 2.87Å |
| 184 | I | 73 | Confident | 75 | Confident | 91 Ų | 91 | 108.2 Ų | 108.2 | 47% | 0.467 | 60% | 0.604 | S | S | . | * | trans | -95.7 | 98.8 | -178.5 | -53 | -176.8 | 0 | 0 | 0 | 108.8 | L180 P181 I186 | L180-I184 HydrophobicContact CB-CB 4.23Å; L180-I184 HydrophobicContact CB-CD1 4.42Å; L180-I184 HydrophobicContact CD1-CG2 4.34Å; L180-I184 HydrophobicContact CD2-CD1 4.11Å; P181-I184 HydrophobicContact CG-CD1 4.35Å; P181-I184 PolarHBondContact O-N 3.44Å; I184-I186 HydrophobicContact CG2-CD1 4.47Å; I184-I186 HydrophobicContact CG2-CG1 3.91Å | ||
| 185 | T | 73.5 | Confident | 76.1 | Confident | 136 Ų | 136 | 109.3 Ų | 109.3 | 83% | 0.834 | 60% | 0.596 | S | S | * | * | trans | -90 | 107.6 | 168.6 | -55.2 | 0 | 0 | 0 | 0 | 107.9 | G183 | G183-T185 PolarHBondContact O-N 2.87Š| ||
| 186 | I | 76.4 | Confident | 77 | Confident | 105 Ų | 105 | 116.2 Ų | 116.2 | 54% | 0.538 | 61% | 0.614 | S | S | . | * | trans | -88.3 | 109 | 170.2 | -56.8 | -175.8 | 0 | 0 | 0 | 107 | L177 L180 I184 | L177-I186 HydrophobicContact CD2-CD1 3.84Å; L180-I186 HydrophobicContact CD1-CD1 3.38Å; L180-I186 HydrophobicContact CD1-CG1 4.11Å; I184-I186 HydrophobicContact CG2-CD1 4.47Å; I184-I186 HydrophobicContact CG2-CG1 3.91Å | ||
| 187 | E | 81.5 | Confident | 77.8 | Confident | 166 Ų | 166 | 116.7 Ų | 116.7 | 78% | 0.776 | 62% | 0.617 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 132 | 172.2 | -161.1 | -177.5 | -168.2 | 0 | 0 | 109 | F189 | E187-F189 PolarHBondContact O-N 2.95Š|
| 188 | P | 80.6 | Confident | 78.2 | Confident | 114 Ų | 114 | 118.6 Ų | 118.6 | 74% | 0.74 | 62% | 0.623 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 128.9 | 176.1 | 24.2 | -32.6 | 0 | 0 | 0 | 110 | D190 | P188-D190 PolarHBondContact O-N 2.9Š|
| 189 | F | 80.9 | Confident | 78.2 | Confident | 123 Ų | 123 | 115.5 Ų | 115.5 | 54% | 0.539 | 61% | 0.612 | S | S | . | * | P | Polyproline II helix | trans | -64.5 | 124.3 | 177.5 | -173.7 | -113.7 | 0 | 0 | 0 | 110.1 | E187 G191 K195 | E187-F189 PolarHBondContact O-N 2.95Å; F189-G191 VanDerWaalsContact CE1-CA 3.49Å; F189-G191 PolarHBondContact O-N 3Å; F189-K195 HydrophobicContact CE2-CB 4.36Å |
| 190 | D | 86.3 | Confident | 77.8 | Confident | 91 Ų | 91 | 112 Ų | 112 | 49% | 0.487 | 60% | 0.602 | S | S | . | * | trans | -78.3 | -2.5 | -176.7 | 71.7 | -3.7 | 0 | 0 | 0 | 114 | P188 D192 K195 | P188-D190 PolarHBondContact O-N 2.9Å; D190-D192 VanDerWaalsContact C-N 3.32Å; D190-D192 WeakPolarHBondContact OD1-CA 3.37Å; D190-D192 WeakPolarHBondContact OD1-CB 3.31Å; D190-D192 PolarHBondContact OD1-N 3.5Å; D190-K195 WeakPolarHBondContact OD2-CE 3.34Å; D190-K195 IonicContact OD2-NZ 2.7Å; D190-K195 PolarHBondContact OD2-NZ 3.43Å | ||
| 191 | G | 89.1 | Confident | 77.5 | Confident | 51 Ų | 51 | 117 Ų | 117 | 53% | 0.526 | 62% | 0.623 | S | S | . | * | trans | 81.7 | 3.3 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | F189 P193 | F189-G191 VanDerWaalsContact CE1-CA 3.49Å; F189-G191 PolarHBondContact O-N 3Å; G191-P193 VanDerWaalsContact O-CD 3.22Å; G191-P193 WeakPolarHBondContact O-CD 3.33Å | ||
| 192 | D | 86.8 | Confident | 76.9 | Confident | 33 Ų | 33 | 121.9 Ų | 121.9 | 18% | 0.176 | 64% | 0.636 | C | S | . | * | trans | -75.7 | 112.2 | 177.4 | -168.6 | -16.5 | 0 | 0 | 0 | 110.1 | D190 R194 K195 | D190-D192 VanDerWaalsContact C-N 3.32Å; D190-D192 WeakPolarHBondContact OD1-CA 3.37Å; D190-D192 WeakPolarHBondContact OD1-CB 3.31Å; D190-D192 PolarHBondContact OD1-N 3.5Å; D192-R194 PolarHBondContact O-N 3.08Å; D192-R194 VanDerWaalsContact OD1-CB 3.3Å; D192-R194 WeakPolarHBondContact OD1-CB 3.46Å; D192-R194 WeakPolarHBondContact OD1-CG 3.32Å; D192-R194 IonicContact OD1-CZ 3.91Å; D192-R194 PolarHBondContact OD1-N 2.93Å; D192-R194 IonicContact OD1-NE 3.04Å; D192-R194 PolarHBondContact OD1-NE 3.35Å; D192-R194 IonicContact OD1-NH2 3.88Å; D192-R194 IonicContact OD2-CZ 3.32Å; D192-R194 IonicContact OD2-NE 3.11Å; D192-R194 PolarHBondContact OD2-NE 2.91Å; D192-R194 VanDerWaalsContact OD2-NE 3.11Å; D192-R194 IonicContact OD2-NH2 2.72Å; D192-R194 PolarHBondContact OD2-NH2 2.77Å; D192-K195 HydrophobicContact CB-CD 4.34Å; D192-K195 HydrophobicContact CB-CG 4.24Å; D192-K195 PolarHBondContact O-N 3.14Å | ||
| 193 | P | 84.4 | Confident | 76.5 | Confident | 101 Ų | 101 | 116 Ų | 116 | 66% | 0.656 | 62% | 0.619 | S | S | * | * | G | 310 helix | trans | -60.9 | -20.9 | 179.8 | 23.7 | -32.2 | 0 | 0 | 0 | 112.9 | G191 K195 R196 | G191-P193 VanDerWaalsContact O-CD 3.22Å; G191-P193 WeakPolarHBondContact O-CD 3.33Å; P193-K195 PolarHBondContact O-N 2.84Å; P193-R196 WeakPolarHBondContact O-CB 3.37Å; P193-R196 PolarHBondContact O-N 3.08Å |
| 194 | R | 87.4 | Confident | 76.1 | Confident | 198 Ų | 198 | 120.1 Ų | 120.1 | 75% | 0.747 | 62% | 0.623 | S | S | * | * | G | 310 helix | trans | -70.2 | -19.5 | 176 | -60.5 | 176.2 | -66.2 | 175.7 | 2.7 | 113.3 | D192 | D192-R194 PolarHBondContact O-N 3.08Å; D192-R194 VanDerWaalsContact OD1-CB 3.3Å; D192-R194 WeakPolarHBondContact OD1-CB 3.46Å; D192-R194 WeakPolarHBondContact OD1-CG 3.32Å; D192-R194 IonicContact OD1-CZ 3.91Å; D192-R194 PolarHBondContact OD1-N 2.93Å; D192-R194 IonicContact OD1-NE 3.04Å; D192-R194 PolarHBondContact OD1-NE 3.35Å; D192-R194 IonicContact OD1-NH2 3.88Å; D192-R194 IonicContact OD2-CZ 3.32Å; D192-R194 IonicContact OD2-NE 3.11Å; D192-R194 PolarHBondContact OD2-NE 2.91Å; D192-R194 VanDerWaalsContact OD2-NE 3.11Å; D192-R194 IonicContact OD2-NH2 2.72Å; D192-R194 PolarHBondContact OD2-NH2 2.77Å |
| 195 | K | 80.9 | Confident | 75.8 | Confident | 89 Ų | 89 | 122 Ų | 122 | 39% | 0.387 | 64% | 0.643 | S | S | . | * | G | 310 helix | trans | -91.7 | -5.8 | 177.6 | -66.7 | -175.2 | 177.7 | 176.6 | 0 | 113.2 | F189 D190 D192 P193 D197 Q198 | F189-K195 HydrophobicContact CE2-CB 4.36Å; D190-K195 WeakPolarHBondContact OD2-CE 3.34Å; D190-K195 IonicContact OD2-NZ 2.7Å; D190-K195 PolarHBondContact OD2-NZ 3.43Å; D192-K195 HydrophobicContact CB-CD 4.34Å; D192-K195 HydrophobicContact CB-CG 4.24Å; D192-K195 PolarHBondContact O-N 3.14Å; P193-K195 PolarHBondContact O-N 2.84Å; K195-D197 VanDerWaalsContact C-N 3.28Å; K195-D197 PolarHBondContact O-N 2.95Å; K195-Q198 PolarHBondContact O-N 2.97Å |
| 196 | R | 78.4 | Confident | 74.9 | Confident | 172 Ų | 172 | 125.3 Ų | 125.3 | 65% | 0.649 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -60.4 | -38 | -176 | -159.9 | -179.9 | -155 | 176.7 | 5.9 | 112.5 | P193 Q198 S199 T200 | P193-R196 WeakPolarHBondContact O-CB 3.37Å; P193-R196 PolarHBondContact O-N 3.08Å; R196-Q198 VanDerWaalsContact C-N 3.27Å; R196-Q198 PolarHBondContact O-N 2.88Å; R196-S199 PolarHBondContact O-N 3.06Å; R196-S199 VanDerWaalsContact O-N 3.12Å; R196-S199 PolarHBondContact O-OG 2.8Å; R196-T200 PolarHBondContact O-OG1 2.84Å |
| 197 | D | 77.8 | Confident | 74.8 | Confident | 135 Ų | 135 | 126.3 Ų | 126.3 | 72% | 0.722 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -65.4 | -31.6 | -177.4 | -60.4 | -24.4 | 0 | 0 | 0 | 112.1 | K195 S199 T200 | K195-D197 VanDerWaalsContact C-N 3.28Å; K195-D197 PolarHBondContact O-N 2.95Å; D197-S199 VanDerWaalsContact C-N 3.3Å; D197-S199 PolarHBondContact O-N 3.33Å; D197-T200 PolarHBondContact O-N 2.85Å |
| 198 | Q | 72.1 | Confident | 74.5 | Confident | 147 Ų | 147 | 124.2 Ų | 124.2 | 69% | 0.687 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -71.1 | -23.6 | 177.3 | -62.2 | 179 | 24.7 | 0 | 0 | 113.1 | K195 R196 T200 | K195-Q198 PolarHBondContact O-N 2.97Å; R196-Q198 VanDerWaalsContact C-N 3.27Å; R196-Q198 PolarHBondContact O-N 2.88Å; Q198-T200 VanDerWaalsContact C-N 3.32Å |
| 199 | S | 65.6 | Low | 74.1 | Confident | 73 Ų | 73 | 124.8 Ų | 124.8 | 51% | 0.51 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -78.2 | -16.3 | -179.4 | 71.5 | 0 | 0 | 0 | 0 | 113.8 | R196 D197 | R196-S199 PolarHBondContact O-N 3.06Å; R196-S199 VanDerWaalsContact O-N 3.12Å; R196-S199 PolarHBondContact O-OG 2.8Å; D197-S199 VanDerWaalsContact C-N 3.3Å; D197-S199 PolarHBondContact O-N 3.33Å |
| 200 | T | 63.5 | Low | 73.7 | Confident | 86 Ų | 86 | 124.9 Ų | 124.9 | 53% | 0.528 | 67% | 0.667 | S | S | . | * | G | 310 helix | trans | -90.1 | -9.9 | -169.1 | -41.1 | 0 | 0 | 0 | 0 | 112.9 | R196 D197 Q198 F202 | R196-T200 PolarHBondContact O-OG1 2.84Å; D197-T200 PolarHBondContact O-N 2.85Å; Q198-T200 VanDerWaalsContact C-N 3.32Å; T200-F202 PolarHBondContact O-N 3.2Å |
| 201 | E | 64.3 | Low | 73 | Confident | 172 Ų | 172 | 127 Ų | 127 | 80% | 0.804 | 68% | 0.678 | S | S | * | * | G | 310 helix | trans | -70.1 | -4.1 | -173.1 | -112.2 | 178.2 | 179.5 | 0 | 0 | 115.3 | S203 | E201-S203 PolarHBondContact O-N 3.32Š|
| 202 | F | 62.3 | Low | 71.9 | Confident | 191 Ų | 191 | 132.1 Ų | 132.1 | 84% | 0.838 | 69% | 0.688 | S | S | * | * | G | 310 helix | trans | -86.2 | 7.4 | -178.9 | -75.2 | -76.8 | 0 | 0 | 0 | 115.7 | T200 | T200-F202 PolarHBondContact O-N 3.2Š|
| 203 | S | 63.6 | Low | 70.8 | Confident | 89 Ų | 89 | 139.1 Ų | 139.1 | 62% | 0.622 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -95.9 | -5.5 | -170.5 | -50.8 | 0 | 0 | 0 | 0 | 115.9 | E201 | E201-S203 PolarHBondContact O-N 3.32Š|
| 204 | D | 70.8 | Confident | 69.8 | Low | 159 Ų | 159 | 142.1 Ų | 142.1 | 85% | 0.85 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -108.4 | 22.8 | -169.6 | -87.4 | -5.8 | 0 | 0 | 0 | 115.5 | ||
| 205 | C | 65.6 | Low | 68.3 | Low | 130 Ų | 130 | 137.4 Ų | 137.4 | 88% | 0.878 | 73% | 0.728 | S | S | * | * | trans | -119.5 | 24.6 | -176.3 | -81.1 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 206 | T | 55 | Low | 67.2 | Low | 206 Ų | 206 | 141.8 Ų | 141.8 | 100% | 1.264 | 76% | 0.759 | S | S | * | * | trans | -129 | 0 | 173 | 21.1 | 0 | 0 | 0 | 0 | 111.4 |
Retrieved 206 of 206 residues in 83.3 ms
(Link to these results)