| 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 | K | 48.7 | Very low | 57.8 | Low | 263 Ų | 263 | 167.3 Ų | 167.3 | 100% | 1.143 | 83% | 0.831 | S | S | * | * | 0 | 109.3 | 0 | -153.1 | 171.3 | 179.6 | -176.4 | 0 | 105.8 | |||||
| 2 | V | 52.5 | Low | 59.3 | Low | 139 Ų | 139 | 171.8 Ų | 171.8 | 84% | 0.842 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 127.7 | -175.8 | 174.6 | 0 | 0 | 0 | 0 | 108.5 | ||
| 3 | Q | 52.4 | Low | 60.5 | Low | 191 Ų | 191 | 173.6 Ų | 173.6 | 89% | 0.893 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 119.5 | 172.3 | -148.9 | 163 | -14.4 | 0 | 0 | 107.1 | ||
| 4 | K | 61.6 | Low | 61.6 | Low | 194 Ų | 194 | 177.9 Ų | 177.9 | 84% | 0.843 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 140.5 | -168.8 | -63.1 | 179.6 | 175.4 | -175.1 | 0 | 110.9 | ||
| 5 | Q | 55.9 | Low | 61.9 | Low | 194 Ų | 194 | 173.5 Ų | 173.5 | 91% | 0.907 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 123.7 | 164.1 | -65.5 | 178 | -88.8 | 0 | 0 | 107.8 | ||
| 6 | E | 54.6 | Low | 62.2 | Low | 187 Ų | 187 | 177.6 Ų | 177.6 | 87% | 0.874 | 83% | 0.834 | S | S | * | * | trans | -84.9 | 107.6 | 160.8 | -89.6 | 174.4 | 168.1 | 0 | 0 | 107.4 | D8 | E6-D8 PolarHBondContact O-N 2.83Š| ||
| 7 | E | 67.3 | Low | 62.6 | Low | 163 Ų | 163 | 176.1 Ų | 176.1 | 76% | 0.762 | 83% | 0.829 | S | S | * | * | trans | -84 | 97.4 | 166.6 | 179.9 | -179.7 | -176.1 | 0 | 0 | 107.1 | V9 | E7-V9 HydrophobicContact CG-CG2 3.83Š| ||
| 8 | D | 56.8 | Low | 62.4 | Low | 148 Ų | 148 | 175 Ų | 175 | 79% | 0.791 | 83% | 0.829 | S | S | * | * | trans | -106.3 | 94.8 | 162.4 | -89.3 | -27.9 | 0 | 0 | 0 | 108.1 | E6 N10 | E6-D8 PolarHBondContact O-N 2.83Å; D8-N10 PolarHBondContact O-N 3.5Å | ||
| 9 | V | 61.7 | Low | 62.8 | Low | 101 Ų | 101 | 173.7 Ų | 173.7 | 61% | 0.612 | 83% | 0.826 | S | S | * | * | trans | -67.7 | 85.2 | 170 | -166.4 | 0 | 0 | 0 | 0 | 107.6 | E7 V11 | E7-V9 HydrophobicContact CG-CG2 3.83Å; V9-V11 HydrophobicContact CG1-CG1 4.26Å; V9-V11 PolarHBondContact O-N 3Å | ||
| 10 | N | 58.8 | Low | 62.8 | Low | 142 Ų | 142 | 173.6 Ų | 173.6 | 76% | 0.759 | 83% | 0.825 | S | S | * | * | trans | -71.4 | 82.7 | 174.9 | -171.7 | -22.2 | 0 | 0 | 0 | 109 | D8 R12 | D8-N10 PolarHBondContact O-N 3.5Å; N10-R12 PolarHBondContact O-N 2.82Å | ||
| 11 | V | 65.3 | Low | 63.2 | Low | 118 Ų | 118 | 170.8 Ų | 170.8 | 72% | 0.715 | 82% | 0.819 | S | S | * | * | trans | -70 | 80.5 | 168.8 | -85.7 | 0 | 0 | 0 | 0 | 109.2 | V9 K13 | V9-V11 HydrophobicContact CG1-CG1 4.26Å; V9-V11 PolarHBondContact O-N 3Å; V11-K13 PolarHBondContact O-N 2.85Å | ||
| 12 | R | 76.4 | Confident | 63.9 | Low | 222 Ų | 222 | 164.8 Ų | 164.8 | 84% | 0.838 | 80% | 0.8 | S | S | * | * | trans | -61.7 | 103.2 | 173.7 | -162.9 | 173.9 | -164.4 | 178.5 | 3.9 | 109.3 | N10 R14 | N10-R12 PolarHBondContact O-N 2.82Å; R12-R14 PolarHBondContact O-N 2.95Å | ||
| 13 | K | 74.6 | Confident | 64.1 | Low | 195 Ų | 195 | 166 Ų | 166 | 85% | 0.848 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 122.8 | 172.4 | -69.6 | -81.3 | -175.9 | 175.2 | 0 | 108.7 | V11 | V11-K13 PolarHBondContact O-N 2.85Š|
| 14 | R | 75.3 | Confident | 64.4 | Low | 233 Ų | 233 | 162.3 Ų | 162.3 | 88% | 0.879 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -87.4 | 128.9 | 172.2 | -68.2 | -169.7 | 174.3 | -170.7 | -2.3 | 109.9 | R12 R16 | R12-R14 PolarHBondContact O-N 2.95Å; R14-R16 PolarHBondContact O-N 3.31Å |
| 15 | P | 66.4 | Low | 63.7 | Low | 113 Ų | 113 | 161.6 Ų | 161.6 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -72 | 124.9 | 168.3 | 18.8 | -13.1 | 0 | 0 | 0 | 108.9 | ||
| 16 | R | 66.4 | Low | 63.6 | Low | 238 Ų | 238 | 158.5 Ų | 158.5 | 90% | 0.898 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 121.5 | 167.6 | -74.7 | -171.1 | 169 | 120.5 | -1.9 | 107.4 | R14 | R14-R16 PolarHBondContact O-N 3.31Š|
| 17 | M | 69.1 | Low | 64 | Low | 153 Ų | 153 | 156.3 Ų | 156.3 | 75% | 0.754 | 78% | 0.783 | S | S | * | * | trans | -107.8 | 109.8 | 177.5 | -65.1 | -137.2 | 68 | 0 | 0 | 108 | ||||
| 18 | D | 59.6 | Low | 63.5 | Low | 156 Ų | 156 | 157 Ų | 157 | 83% | 0.834 | 79% | 0.787 | S | S | * | * | trans | -100.9 | 113.4 | 169.8 | -60.4 | -35.3 | 0 | 0 | 0 | 106.9 | ||||
| 19 | I | 70.1 | Confident | 63.5 | Low | 150 Ų | 150 | 154.2 Ų | 154.2 | 77% | 0.769 | 78% | 0.784 | S | S | * | * | trans | -97.8 | 121.5 | 175.4 | -72.7 | 159.9 | 0 | 0 | 0 | 106.7 | ||||
| 20 | E | 62.9 | Low | 63.4 | Low | 172 Ų | 172 | 155.5 Ų | 155.5 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | trans | -128.6 | 117.1 | 162.9 | -160.4 | 170.8 | -170.6 | 0 | 0 | 110.4 | ||||
| 21 | T | 70.3 | Confident | 63.3 | Low | 115 Ų | 115 | 154.3 Ų | 154.3 | 71% | 0.706 | 79% | 0.792 | S | S | * | * | trans | -75.2 | 133.2 | 174.9 | 38.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 22 | N | 64.4 | Low | 62.8 | Low | 137 Ų | 137 | 156.7 Ų | 156.7 | 73% | 0.733 | 80% | 0.795 | S | S | * | * | trans | -142.2 | 91.6 | 157.9 | -70.7 | -55.5 | 0 | 0 | 0 | 109.8 | ||||
| 23 | D | 56.3 | Low | 62.2 | Low | 164 Ų | 164 | 151.2 Ų | 151.2 | 88% | 0.877 | 79% | 0.791 | S | S | * | * | trans | -86.1 | 105.6 | 160 | -177.9 | 26.1 | 0 | 0 | 0 | 106.7 | ||||
| 24 | T | 58.7 | Low | 61.3 | Low | 114 Ų | 114 | 146.9 Ų | 146.9 | 70% | 0.699 | 79% | 0.785 | S | S | * | * | trans | -151 | 101.1 | 177.7 | -47.9 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 25 | F | 47.5 | Very low | 60.7 | Low | 178 Ų | 178 | 144.7 Ų | 144.7 | 78% | 0.781 | 78% | 0.782 | S | S | * | * | trans | 46.9 | 119.6 | 136.8 | -109.2 | -99.2 | 0 | 0 | 0 | 119.6 | ||||
| 26 | S | 53.3 | Low | 60.1 | Low | 129 Ų | 129 | 146.9 Ų | 146.9 | 90% | 0.902 | 79% | 0.786 | S | S | * | * | trans | -154.3 | 97.3 | 140.8 | -71 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 27 | D | 62.4 | Low | 59.7 | Low | 141 Ų | 141 | 141.1 Ų | 141.1 | 75% | 0.754 | 78% | 0.782 | S | S | * | * | trans | -82 | 161.7 | 150.7 | -175.2 | 18.3 | 0 | 0 | 0 | 107.8 | ||||
| 28 | E | 58.3 | Low | 59.1 | Low | 179 Ų | 179 | 143.3 Ų | 143.3 | 84% | 0.836 | 79% | 0.79 | S | S | * | * | trans | 83.5 | 100.7 | 164.4 | -157.4 | 174.7 | -173.4 | 0 | 0 | 118.3 | ||||
| 29 | A | 55.6 | Low | 59 | Low | 89 Ų | 89 | 144.5 Ų | 144.5 | 74% | 0.736 | 79% | 0.791 | S | S | * | * | 163.9 | 108.5 | 112.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 30 | V | 60.8 | Low | 58.4 | Low | 127 Ų | 127 | 143.1 Ų | 143.1 | 77% | 0.77 | 79% | 0.785 | S | S | * | * | trans | -70.5 | 127.2 | 164.5 | 177 | 0 | 0 | 0 | 0 | 108.4 | E32 | V30-E32 HydrophobicContact CG1-CG 4.4Å; V30-E32 PolarHBondContact O-N 2.94Å | ||
| 31 | P | 55.1 | Low | 58 | Low | 117 Ų | 117 | 144.5 Ų | 144.5 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | trans | -85.7 | 89.6 | 164.3 | 8.9 | 9 | 0 | 0 | 0 | 109 | S33 | P31-S33 PolarHBondContact O-N 3.05Å; P31-S33 VanDerWaalsContact O-N 3.16Å | ||
| 32 | E | 55.8 | Low | 57.5 | Low | 169 Ų | 169 | 145.6 Ų | 145.6 | 79% | 0.79 | 79% | 0.792 | S | S | * | * | trans | -68.1 | 97.6 | 155.4 | -83.7 | -164.7 | 160.7 | 0 | 0 | 108.2 | V30 | V30-E32 HydrophobicContact CG1-CG 4.4Å; V30-E32 PolarHBondContact O-N 2.94Å | ||
| 33 | S | 63 | Low | 57.1 | Low | 106 Ų | 106 | 142.1 Ų | 142.1 | 74% | 0.741 | 79% | 0.788 | S | S | * | * | trans | -154.4 | 102.5 | 162.6 | 59.6 | 0 | 0 | 0 | 0 | 113.1 | P31 | P31-S33 PolarHBondContact O-N 3.05Å; P31-S33 VanDerWaalsContact O-N 3.16Å | ||
| 34 | S | 56.7 | Low | 57.1 | Low | 104 Ų | 104 | 143.8 Ų | 143.8 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | trans | -171.4 | 62.4 | 142.3 | 170.1 | 0 | 0 | 0 | 0 | 108.1 | I36 | S34-I36 PolarHBondContact O-N 3.17Š| ||
| 35 | K | 62.8 | Low | 57 | Low | 187 Ų | 187 | 147.9 Ų | 147.9 | 81% | 0.813 | 80% | 0.796 | S | S | * | * | trans | -82.2 | 97.9 | 163.8 | -68 | -168.1 | -176.6 | 172.2 | 0 | 107.1 | S37 | K35-S37 PolarHBondContact O-N 2.93Š| ||
| 36 | I | 54.1 | Low | 57.5 | Low | 159 Ų | 159 | 151.2 Ų | 151.2 | 82% | 0.815 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 117 | 169.3 | 46.9 | 165.1 | 0 | 0 | 0 | 108.6 | S34 | S34-I36 PolarHBondContact O-N 3.17Š|
| 37 | S | 57.3 | Low | 57.4 | Low | 118 Ų | 118 | 153.4 Ų | 153.4 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 132.3 | 176.5 | -56.6 | 0 | 0 | 0 | 0 | 110.6 | K35 | K35-S37 PolarHBondContact O-N 2.93Š|
| 38 | Q | 57.3 | Low | 56.9 | Low | 198 Ų | 198 | 154 Ų | 154 | 93% | 0.925 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 118.5 | 172.2 | 173.7 | -175.6 | -46.7 | 0 | 0 | 110.4 | ||
| 39 | E | 55.6 | Low | 56.2 | Low | 181 Ų | 181 | 152.7 Ų | 152.7 | 85% | 0.846 | 79% | 0.793 | S | S | * | * | trans | -160.4 | 113.9 | 162.3 | -177.5 | -178 | 132.7 | 0 | 0 | 110.6 | ||||
| 40 | N | 57.8 | Low | 56.1 | Low | 122 Ų | 122 | 154.5 Ų | 154.5 | 65% | 0.652 | 79% | 0.786 | S | S | * | * | -171 | 103 | 128.1 | 52 | 14.8 | 0 | 0 | 0 | 111 | I42 | N40-I42 HydrophobicContact CB-CD1 3.91Å; N40-I42 HydrophobicContact CB-CG1 4.35Å; N40-I42 PolarHBondContact O-N 3.43Å | |||
| 41 | E | 54.2 | Low | 55.8 | Low | 200 Ų | 200 | 155.8 Ų | 155.8 | 94% | 0.935 | 79% | 0.789 | S | S | * | * | trans | -66.1 | 100.2 | 156.8 | -80.7 | -168.6 | 130.4 | 0 | 0 | 108.8 | ||||
| 42 | I | 60 | Low | 55.8 | Low | 139 Ų | 139 | 155 Ų | 155 | 71% | 0.713 | 79% | 0.786 | S | S | * | * | trans | -101 | 79.7 | 164.6 | -69.4 | 143.7 | 0 | 0 | 0 | 108 | N40 K44 | N40-I42 HydrophobicContact CB-CD1 3.91Å; N40-I42 HydrophobicContact CB-CG1 4.35Å; N40-I42 PolarHBondContact O-N 3.43Å; I42-K44 PolarHBondContact O-N 2.99Å | ||
| 43 | G | 56.7 | Low | 55.9 | Low | 64 Ų | 64 | 154.3 Ų | 154.3 | 66% | 0.66 | 79% | 0.787 | S | S | * | * | trans | -74.1 | 112 | 154 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 44 | K | 56.1 | Low | 54.6 | Low | 198 Ų | 198 | 161.6 Ų | 161.6 | 86% | 0.861 | 80% | 0.798 | S | S | * | * | 178.4 | 121.1 | 128.2 | -92.5 | 160.1 | -168 | -178 | 0 | 112.1 | I42 | I42-K44 PolarHBondContact O-N 2.99Š| |||
| 45 | K | 57.2 | Low | 54.3 | Low | 201 Ų | 201 | 161.4 Ų | 161.4 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | trans | -33.7 | 135.8 | 172.9 | -53.3 | -163.8 | 173.8 | -163.8 | 0 | 115.5 | ||||
| 46 | R | 57.3 | Low | 53.9 | Low | 248 Ų | 248 | 157.3 Ų | 157.3 | 94% | 0.936 | 80% | 0.798 | S | S | * | * | trans | -140.7 | 93.5 | 154.1 | -62.7 | -167.9 | -116.9 | -178.1 | 0.3 | 108.3 | ||||
| 47 | E | 51.2 | Low | 54.1 | Low | 175 Ų | 175 | 158 Ų | 158 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -93.1 | 160.1 | 161.9 | -87.8 | -178.8 | 158.2 | 0 | 0 | 109.1 | ||||
| 48 | L | 52.4 | Low | 54.3 | Low | 154 Ų | 154 | 161.4 Ų | 161.4 | 81% | 0.806 | 80% | 0.798 | S | S | * | * | trans | 86.3 | 126.3 | 173.5 | -43.3 | 174.1 | 0 | 0 | 0 | 113.5 | ||||
| 49 | K | 43.3 | Very low | 54.3 | Low | 151 Ų | 151 | 157.7 Ų | 157.7 | 66% | 0.657 | 78% | 0.783 | S | S | * | * | cis | -174.7 | 154.7 | -7.7 | -126.4 | 172 | 169.2 | -135.6 | 0 | 104.6 | ||||
| 50 | E | 52.6 | Low | 54.6 | Low | 126 Ų | 126 | 153.3 Ų | 153.3 | 59% | 0.589 | 77% | 0.773 | S | S | * | * | trans | 74.1 | 99.2 | 144 | -67.7 | 155.6 | -173.8 | 0 | 0 | 117.2 | ||||
| 51 | D | 54.9 | Low | 54.5 | Low | 155 Ų | 155 | 150.9 Ų | 150.9 | 83% | 0.829 | 76% | 0.762 | S | S | * | * | 57.7 | 83.3 | 109.4 | -49.9 | -24.6 | 0 | 0 | 0 | 116.3 | |||||
| 52 | S | 55.7 | Low | 55 | Low | 100 Ų | 100 | 146.8 Ų | 146.8 | 70% | 0.699 | 75% | 0.751 | S | S | * | * | trans | -146.9 | 75.1 | 154.4 | -168.5 | 0 | 0 | 0 | 0 | 112.1 | W54 | S52-W54 PolarHBondContact O-N 3.47Š| ||
| 53 | L | 57 | Low | 55.2 | Low | 154 Ų | 154 | 148.2 Ų | 148.2 | 81% | 0.806 | 75% | 0.749 | S | S | * | * | trans | 60.6 | 48.1 | 134.9 | -68 | 164.5 | 0 | 0 | 0 | 117.7 | S55 | L53-S55 PolarHBondContact O-N 3.49Š| ||
| 54 | W | 37.5 | Very low | 55.7 | Low | 259 Ų | 259 | 151.8 Ų | 151.8 | 98% | 0.981 | 76% | 0.76 | S | S | * | * | trans | -94.5 | 75.1 | 143.5 | -66 | -18.8 | 0 | 0 | 0 | 108.1 | S52 A56 | S52-W54 PolarHBondContact O-N 3.47Å; W54-A56 PolarHBondContact O-N 3.04Å | ||
| 55 | S | 49.7 | Very low | 56.2 | Low | 101 Ų | 101 | 145.9 Ų | 145.9 | 71% | 0.706 | 76% | 0.755 | S | S | * | * | trans | -46.8 | 125.1 | 169.7 | 179 | 0 | 0 | 0 | 0 | 109.2 | L53 K57 | L53-S55 PolarHBondContact O-N 3.49Å; S55-K57 PolarHBondContact O-N 2.99Å | ||
| 56 | A | 54.6 | Low | 56.8 | Low | 100 Ų | 100 | 140.1 Ų | 140.1 | 83% | 0.826 | 75% | 0.746 | S | S | * | * | trans | -48.3 | 98.3 | 171.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | W54 | W54-A56 PolarHBondContact O-N 3.04Š| ||
| 57 | K | 57.4 | Low | 57.8 | Low | 174 Ų | 174 | 131 Ų | 131 | 76% | 0.757 | 73% | 0.729 | S | S | * | * | trans | -129.5 | 88.6 | 148.2 | -119.4 | 169.8 | -177.1 | 178.3 | 0 | 103.3 | S55 I59 | S55-K57 PolarHBondContact O-N 2.99Å; K57-I59 HydrophobicContact CB-CD1 4.37Å; K57-I59 HydrophobicContact CB-CG1 4.12Å; K57-I59 HydrophobicContact CG-CG1 4.49Å; K57-I59 PolarHBondContact O-N 2.95Å | ||
| 58 | E | 61.3 | Low | 59.2 | Low | 189 Ų | 189 | 132.9 Ų | 132.9 | 88% | 0.883 | 73% | 0.734 | S | S | * | * | trans | -59.2 | 79.2 | 160.5 | -171.5 | 178.1 | -176.4 | 0 | 0 | 106.5 | S60 | E58-S60 PolarHBondContact O-N 3.24Š| ||
| 59 | I | 57.4 | Low | 60.4 | Low | 120 Ų | 120 | 133 Ų | 133 | 62% | 0.615 | 74% | 0.735 | S | S | * | * | trans | -81.7 | 90.5 | 162.5 | -56.1 | 163.8 | 0 | 0 | 0 | 101.4 | K57 V61 | K57-I59 HydrophobicContact CB-CD1 4.37Å; K57-I59 HydrophobicContact CB-CG1 4.12Å; K57-I59 HydrophobicContact CG-CG1 4.49Å; K57-I59 PolarHBondContact O-N 2.95Å; I59-V61 HydrophobicContact CB-CG2 4.25Å; I59-V61 HydrophobicContact CG2-CG2 3.54Å; I59-V61 PolarHBondContact O-N 3.03Å | ||
| 60 | S | 62.6 | Low | 62.4 | Low | 90 Ų | 90 | 130.5 Ų | 130.5 | 63% | 0.629 | 73% | 0.734 | S | S | * | * | trans | -60.3 | 89.4 | 156.7 | 51.5 | 0 | 0 | 0 | 0 | 105.3 | E58 T62 | E58-S60 PolarHBondContact O-N 3.24Å; S60-T62 PolarHBondContact O-N 3.48Å | ||
| 61 | V | 55.7 | Low | 64 | Low | 71 Ų | 71 | 132.4 Ų | 132.4 | 43% | 0.43 | 74% | 0.743 | S | S | . | * | trans | -66.5 | 92.3 | 174.6 | -178.4 | 0 | 0 | 0 | 0 | 104.9 | I59 Y63 | I59-V61 HydrophobicContact CB-CG2 4.25Å; I59-V61 HydrophobicContact CG2-CG2 3.54Å; I59-V61 PolarHBondContact O-N 3.03Å; V61-Y63 HydrophobicContact CB-CD2 4.32Å; V61-Y63 HydrophobicContact CB-CE1 4.33Å; V61-Y63 HydrophobicContact CB-CE2 3.77Å; V61-Y63 HydrophobicContact CG1-CD1 3.72Å; V61-Y63 HydrophobicContact CG1-CD2 3.95Å; V61-Y63 HydrophobicContact CG1-CE1 3.42Å; V61-Y63 VanDerWaalsContact CG1-CE1 3.42Å; V61-Y63 HydrophobicContact CG1-CE2 3.65Å; V61-Y63 HydrophobicContact CG1-CG 3.97Å; V61-Y63 WeakPolarHBondContact O-CD2 3.49Å; V61-Y63 WeakPolarHBondContact O-CE2 3.16Å; V61-Y63 PolarHBondContact O-N 3.32Å | ||
| 62 | T | 64.9 | Low | 65.6 | Low | 114 Ų | 114 | 131.5 Ų | 131.5 | 70% | 0.699 | 74% | 0.736 | S | S | * | * | trans | -69.6 | 90.7 | 165.9 | 49.1 | 0 | 0 | 0 | 0 | 106 | S60 | S60-T62 PolarHBondContact O-N 3.48Š| ||
| 63 | Y | 64.8 | Low | 67.1 | Low | 168 Ų | 168 | 133.3 Ų | 133.3 | 66% | 0.659 | 74% | 0.737 | S | S | * | * | trans | -61.6 | 139.7 | 171.9 | -61.4 | -85.2 | 0 | 0 | 0 | 108.6 | V61 G65 A66 | V61-Y63 HydrophobicContact CB-CD2 4.32Å; V61-Y63 HydrophobicContact CB-CE1 4.33Å; V61-Y63 HydrophobicContact CB-CE2 3.77Å; V61-Y63 HydrophobicContact CG1-CD1 3.72Å; V61-Y63 HydrophobicContact CG1-CD2 3.95Å; V61-Y63 HydrophobicContact CG1-CE1 3.42Å; V61-Y63 VanDerWaalsContact CG1-CE1 3.42Å; V61-Y63 HydrophobicContact CG1-CE2 3.65Å; V61-Y63 HydrophobicContact CG1-CG 3.97Å; V61-Y63 WeakPolarHBondContact O-CD2 3.49Å; V61-Y63 WeakPolarHBondContact O-CE2 3.16Å; V61-Y63 PolarHBondContact O-N 3.32Å; Y63-G65 PolarHBondContact O-N 2.99Å; Y63-A66 WeakPolarHBondContact O-CB 3.35Å; Y63-A66 PolarHBondContact O-N 3.42Å | ||
| 64 | P | 65.7 | Low | 68.5 | Low | 140 Ų | 140 | 127.3 Ų | 127.3 | 91% | 0.909 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.4 | 111.4 | 173.2 | 23.2 | -31.1 | 0 | 0 | 0 | 108.3 | ||
| 65 | G | 67.3 | Low | 70.8 | Confident | 73 Ų | 73 | 118.3 Ų | 118.3 | 75% | 0.753 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 124.8 | -11.2 | -170.6 | 0 | 0 | 0 | 0 | 0 | 115 | Y63 G67 | Y63-G65 PolarHBondContact O-N 2.99Å; G65-G67 PolarHBondContact O-N 3.14Å |
| 66 | A | 69.1 | Low | 72.4 | Confident | 81 Ų | 81 | 118.5 Ų | 118.5 | 67% | 0.669 | 70% | 0.701 | S | S | * | * | trans | -71.8 | 21.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | Y63 | Y63-A66 WeakPolarHBondContact O-CB 3.35Å; Y63-A66 PolarHBondContact O-N 3.42Å | ||
| 67 | G | 78.1 | Confident | 73.8 | Confident | 57 Ų | 57 | 117.2 Ų | 117.2 | 59% | 0.588 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -91.1 | 176.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | G65 L69 | G65-G67 PolarHBondContact O-N 3.14Å; G67-L69 PolarHBondContact O-N 3.09Å |
| 68 | K | 80.4 | Confident | 75 | Confident | 213 Ų | 213 | 115.6 Ų | 115.6 | 93% | 0.926 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 129.3 | 171.1 | -59.4 | 165.1 | -174.5 | -77 | 0 | 108.4 | ||
| 69 | L | 79.3 | Confident | 75.9 | Confident | 156 Ų | 156 | 113.3 Ų | 113.3 | 82% | 0.817 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 146.1 | 174.3 | -70.4 | 173 | 0 | 0 | 0 | 109.8 | G67 H71 | G67-L69 PolarHBondContact O-N 3.09Å; L69-H71 PolarHBondContact O-N 3.5Å |
| 70 | P | 85.2 | Confident | 76.6 | Confident | 100 Ų | 100 | 111 Ų | 111 | 65% | 0.649 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 141.8 | 175.3 | 24.1 | -33 | 0 | 0 | 0 | 109.5 | I72 | P70-I72 PolarHBondContact O-N 3.01Š|
| 71 | H | 86.4 | Confident | 76.8 | Confident | 165 Ų | 165 | 114.2 Ų | 114.2 | 76% | 0.764 | 68% | 0.676 | S | S | * | * | trans | -68.1 | 107.4 | 176.6 | -179.2 | 60.1 | 0 | 0 | 0 | 108.7 | L69 | L69-H71 PolarHBondContact O-N 3.5Š| ||
| 72 | I | 88.3 | Confident | 77.1 | Confident | 136 Ų | 136 | 118.3 Ų | 118.3 | 70% | 0.697 | 69% | 0.689 | S | S | * | * | trans | -97 | 127.7 | 175.7 | -61.3 | 166.6 | 0 | 0 | 0 | 106.7 | P70 G74 | P70-I72 PolarHBondContact O-N 3.01Å; I72-G74 PolarHBondContact O-N 3.45Å | ||
| 73 | I | 86.7 | Confident | 76.7 | Confident | 138 Ų | 138 | 117.2 Ų | 117.2 | 71% | 0.708 | 69% | 0.692 | S | S | * | * | trans | -58.3 | 113 | 174.9 | -60.9 | 175.5 | 0 | 0 | 0 | 107.8 | D77 | I73-D77 VanDerWaalsContact CA-OD2 3.25Å; I73-D77 WeakPolarHBondContact CA-OD2 3.12Å; I73-D77 HydrophobicContact CG2-CB 3.67Å | ||
| 74 | G | 85.8 | Confident | 76.6 | Confident | 28 Ų | 28 | 119.6 Ų | 119.6 | 29% | 0.289 | 70% | 0.7 | S | S | . | * | trans | -83.7 | 166.5 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | I72 S76 D77 | I72-G74 PolarHBondContact O-N 3.45Å; G74-S76 PolarHBondContact O-N 3.01Å; G74-D77 PolarHBondContact N-OD2 3.41Å; G74-D77 VanDerWaalsContact O-CB 3.32Å; G74-D77 WeakPolarHBondContact O-CB 3.47Å; G74-D77 PolarHBondContact O-N 3.4Å | ||
| 75 | G | 85.3 | Confident | 76.6 | Confident | 70 Ų | 70 | 121.1 Ų | 121.1 | 72% | 0.722 | 69% | 0.692 | S | S | * | * | G | 310 helix | trans | -60.7 | -24.5 | 170.5 | 0 | 0 | 0 | 0 | 0 | 113 | D77 L78 | G75-D77 PolarHBondContact O-N 2.88Å; G75-L78 WeakPolarHBondContact O-CB 3.3Å; G75-L78 PolarHBondContact O-N 3.19Å |
| 76 | S | 84.1 | Confident | 76.5 | Confident | 105 Ų | 105 | 122.9 Ų | 122.9 | 73% | 0.734 | 68% | 0.684 | S | S | * | * | G | 310 helix | trans | -61.2 | -28.3 | 170.4 | 48.8 | 0 | 0 | 0 | 0 | 113.6 | G74 L78 | G74-S76 PolarHBondContact O-N 3.01Å; S76-L78 VanDerWaalsContact C-N 3.27Å |
| 77 | D | 83.9 | Confident | 76.8 | Confident | 74 Ų | 74 | 122.6 Ų | 122.6 | 40% | 0.396 | 67% | 0.674 | S | S | . | * | G | 310 helix | trans | -84.7 | -12.6 | -176.4 | -51.9 | -15.8 | 0 | 0 | 0 | 110.4 | I73 G74 G75 I79 | I73-D77 VanDerWaalsContact CA-OD2 3.25Å; I73-D77 WeakPolarHBondContact CA-OD2 3.12Å; I73-D77 HydrophobicContact CG2-CB 3.67Å; G74-D77 PolarHBondContact N-OD2 3.41Å; G74-D77 VanDerWaalsContact O-CB 3.32Å; G74-D77 WeakPolarHBondContact O-CB 3.47Å; G74-D77 PolarHBondContact O-N 3.4Å; G75-D77 PolarHBondContact O-N 2.88Å; D77-I79 PolarHBondContact O-N 3.43Å |
| 78 | L | 83.9 | Confident | 77 | Confident | 139 Ų | 139 | 126.1 Ų | 126.1 | 73% | 0.728 | 68% | 0.676 | S | S | * | * | trans | -80.9 | 94 | 173.3 | -174 | 62.9 | 0 | 0 | 0 | 109.9 | G75 S76 A80 | G75-L78 WeakPolarHBondContact O-CB 3.3Å; G75-L78 PolarHBondContact O-N 3.19Å; S76-L78 VanDerWaalsContact C-N 3.27Å; L78-A80 PolarHBondContact O-N 3.18Å | ||
| 79 | I | 78.9 | Confident | 77.1 | Confident | 141 Ų | 141 | 121 Ų | 121 | 72% | 0.723 | 66% | 0.657 | S | S | * | * | trans | -76 | 111.4 | 168.1 | -58.6 | 173.5 | 0 | 0 | 0 | 107.7 | D77 H81 | D77-I79 PolarHBondContact O-N 3.43Å; I79-H81 PolarHBondContact O-N 3.43Å | ||
| 80 | A | 72.3 | Confident | 77.4 | Confident | 72 Ų | 72 | 119 Ų | 119 | 60% | 0.595 | 64% | 0.644 | S | S | * | * | trans | -63.1 | 107 | 172.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | L78 H82 | L78-A80 PolarHBondContact O-N 3.18Å; A80-H82 PolarHBondContact O-N 2.83Å | ||
| 81 | H | 66.3 | Low | 77.5 | Confident | 158 Ų | 158 | 119.8 Ų | 119.8 | 73% | 0.731 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | 46.1 | 179.2 | -141.4 | -75 | 0 | 0 | 0 | 112 | I79 | I79-H81 PolarHBondContact O-N 3.43Š|
| 82 | H | 62 | Low | 77.8 | Confident | 156 Ų | 156 | 120.6 Ų | 120.6 | 72% | 0.722 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.8 | 4.5 | -165 | -57.9 | 96.2 | 0 | 0 | 0 | 115 | A80 | A80-H82 PolarHBondContact O-N 2.83Š|
| 83 | A | 57.4 | Low | 77.8 | Confident | 91 Ų | 91 | 119.8 Ų | 119.8 | 75% | 0.752 | 63% | 0.632 | S | S | * | * | trans | -102.5 | 9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | K85 | A83-K85 PolarHBondContact O-N 2.94Š| ||
| 84 | R | 62.8 | Low | 78 | Confident | 219 Ų | 219 | 121 Ų | 121 | 83% | 0.826 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -77.6 | 75.4 | 167.7 | -167 | 168.9 | 164.3 | -93.7 | -1.7 | 107.5 | N86 | R84-N86 PolarHBondContact O-N 3.1Š|
| 85 | K | 64.4 | Low | 78.3 | Confident | 172 Ų | 172 | 125.9 Ų | 125.9 | 75% | 0.748 | 64% | 0.643 | S | S | * | * | trans | 8.9 | 104.1 | 165.7 | -56.6 | 178.2 | -177.3 | 179.4 | 0 | 112.5 | A83 T87 | A83-K85 PolarHBondContact O-N 2.94Å; K85-T87 HydrophobicContact CB-CG2 4.14Å; K85-T87 PolarHBondContact O-N 3.42Å | ||
| 86 | N | 65.8 | Low | 78.4 | Confident | 109 Ų | 109 | 128.1 Ų | 128.1 | 58% | 0.583 | 63% | 0.634 | S | S | * | * | trans | -69.7 | 66.8 | 173.5 | -71.5 | -56.2 | 0 | 0 | 0 | 110.1 | R84 E88 L89 E90 | R84-N86 PolarHBondContact O-N 3.1Å; N86-E88 PolarHBondContact O-N 3.35Å; N86-L89 HydrophobicContact CB-CB 3.87Å; N86-L89 PolarHBondContact O-N 2.9Å; N86-E90 PolarHBondContact O-N 2.83Å; N86-E90 VanDerWaalsContact O-N 3.14Å | ||
| 87 | T | 75.8 | Confident | 78.4 | Confident | 75 Ų | 75 | 129.7 Ų | 129.7 | 46% | 0.46 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -60.8 | -36.1 | 177.9 | 54.7 | 0 | 0 | 0 | 0 | 110.9 | K85 L89 E90 E91 | K85-T87 HydrophobicContact CB-CG2 4.14Å; K85-T87 PolarHBondContact O-N 3.42Å; T87-L89 VanDerWaalsContact C-N 3.34Å; T87-L89 PolarHBondContact O-N 3.26Å; T87-E90 PolarHBondContact O-N 3.36Å; T87-E91 WeakPolarHBondContact O-CB 3.44Å; T87-E91 WeakPolarHBondContact O-CG 3.48Å; T87-E91 PolarHBondContact O-N 3.08Å |
| 88 | E | 81.9 | Confident | 78.7 | Confident | 132 Ų | 132 | 131.3 Ų | 131.3 | 62% | 0.617 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -59.6 | -43.9 | 175.1 | -176.7 | 176.4 | -171.1 | 0 | 0 | 111.7 | N86 E91 W92 | N86-E88 PolarHBondContact O-N 3.35Å; E88-E91 PolarHBondContact O-N 3.28Å; E88-W92 PolarHBondContact O-N 2.88Å |
| 89 | L | 82.9 | Confident | 79 | Confident | 104 Ų | 104 | 128.6 Ų | 128.6 | 55% | 0.545 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -68.1 | -38.7 | 178.8 | -171.7 | 138.3 | 0 | 0 | 0 | 111.7 | N86 T87 W92 L93 | N86-L89 HydrophobicContact CB-CB 3.87Å; N86-L89 PolarHBondContact O-N 2.9Å; T87-L89 VanDerWaalsContact C-N 3.34Å; T87-L89 PolarHBondContact O-N 3.26Å; L89-W92 PolarHBondContact O-N 3.47Å; L89-L93 HydrophobicContact CD2-CD1 3.81Å; L89-L93 WeakPolarHBondContact O-CG 3.03Å; L89-L93 PolarHBondContact O-N 3.31Å; L89-L93 VanDerWaalsContact O-N 3.1Å |
| 90 | E | 84.4 | Confident | 79.4 | Confident | 115 Ų | 115 | 127.1 Ų | 127.1 | 54% | 0.537 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -65.7 | -37.4 | 173.9 | -69.5 | -177.6 | -176.6 | 0 | 0 | 112.4 | N86 T87 R94 | N86-E90 PolarHBondContact O-N 2.83Å; N86-E90 VanDerWaalsContact O-N 3.14Å; T87-E90 PolarHBondContact O-N 3.36Å; E90-R94 WeakPolarHBondContact O-CB 3.43Å; E90-R94 PolarHBondContact O-N 3.04Å |
| 91 | E | 88.8 | Confident | 80.3 | Confident | 116 Ų | 116 | 127 Ų | 127 | 54% | 0.542 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -65.3 | -45.1 | 175.1 | -76.3 | 166.5 | -172.5 | 0 | 0 | 111.2 | T87 E88 L93 R94 Q95 | T87-E91 WeakPolarHBondContact O-CB 3.44Å; T87-E91 WeakPolarHBondContact O-CG 3.48Å; T87-E91 PolarHBondContact O-N 3.08Å; E88-E91 PolarHBondContact O-N 3.28Å; E91-L93 PolarHBondContact O-N 3.48Å; E91-R94 WeakPolarHBondContact O-CB 3.35Å; E91-R94 PolarHBondContact O-N 3.45Å; E91-Q95 WeakPolarHBondContact O-CB 3.46Å; E91-Q95 PolarHBondContact O-N 2.84Å |
| 92 | W | 91.2 | Very high | 81.5 | Confident | 183 Ų | 183 | 123.2 Ų | 123.2 | 69% | 0.693 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -58.4 | -47.7 | 175.2 | -89.9 | 67.4 | 0 | 0 | 0 | 112.4 | E88 L89 R94 Q95 E96 | E88-W92 PolarHBondContact O-N 2.88Å; L89-W92 PolarHBondContact O-N 3.47Å; W92-R94 VanDerWaalsContact C-N 3.29Å; W92-R94 PolarHBondContact O-N 3.15Å; W92-Q95 PolarHBondContact O-N 2.7Å; W92-E96 PolarHBondContact O-N 3.43Å |
| 93 | L | 89.5 | Confident | 82.9 | Confident | 118 Ų | 118 | 120.2 Ų | 120.2 | 62% | 0.618 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -63 | -36.4 | 177.8 | -71 | 173.2 | 0 | 0 | 0 | 112.2 | L89 E91 M97 | L89-L93 HydrophobicContact CD2-CD1 3.81Å; L89-L93 WeakPolarHBondContact O-CG 3.03Å; L89-L93 PolarHBondContact O-N 3.31Å; L89-L93 VanDerWaalsContact O-N 3.1Å; E91-L93 PolarHBondContact O-N 3.48Å; L93-M97 PolarHBondContact O-N 3.13Å |
| 94 | R | 90.1 | Very high | 84.5 | Confident | 165 Ų | 165 | 118.5 Ų | 118.5 | 62% | 0.623 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -68 | -41.5 | 176.4 | -168.1 | -174.5 | -52.4 | -80.4 | -4.6 | 111.7 | E90 E91 W92 E96 M97 E98 | E90-R94 WeakPolarHBondContact O-CB 3.43Å; E90-R94 PolarHBondContact O-N 3.04Å; E91-R94 WeakPolarHBondContact O-CB 3.35Å; E91-R94 PolarHBondContact O-N 3.45Å; W92-R94 VanDerWaalsContact C-N 3.29Å; W92-R94 PolarHBondContact O-N 3.15Å; R94-E96 PolarHBondContact O-N 3.35Å; R94-M97 PolarHBondContact O-N 3.31Å; R94-E98 PolarHBondContact O-N 3.05Å |
| 95 | Q | 91.7 | Very high | 85.9 | Confident | 130 Ų | 130 | 113.5 Ų | 113.5 | 61% | 0.607 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -64.2 | -41.2 | -177.9 | -153.3 | 173.7 | -73.3 | 0 | 0 | 111.6 | E91 W92 M97 E98 V99 | E91-Q95 WeakPolarHBondContact O-CB 3.46Å; E91-Q95 PolarHBondContact O-N 2.84Å; W92-Q95 PolarHBondContact O-N 2.7Å; Q95-M97 PolarHBondContact O-N 3Å; Q95-E98 PolarHBondContact O-N 3.4Å; Q95-V99 WeakPolarHBondContact O-CG2 3.32Å; Q95-V99 PolarHBondContact O-N 3.06Å |
| 96 | E | 87.8 | Confident | 87.2 | Confident | 116 Ų | 116 | 111.3 Ų | 111.3 | 54% | 0.542 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -60.9 | -45 | 175.6 | -174.3 | 62.9 | -139.6 | 0 | 0 | 111.9 | W92 R94 E98 V99 Q100 | W92-E96 PolarHBondContact O-N 3.43Å; R94-E96 PolarHBondContact O-N 3.35Å; E96-E98 VanDerWaalsContact C-N 3.31Å; E96-E98 PolarHBondContact O-N 3.22Å; E96-V99 PolarHBondContact O-N 3.42Å; E96-Q100 WeakPolarHBondContact O-CG 3.4Å; E96-Q100 PolarHBondContact O-N 3.32Å; E96-Q100 VanDerWaalsContact O-N 3.13Å; E96-Q100 PolarHBondContact OE1-NE2 2.89Å |
| 97 | M | 84 | Confident | 88.3 | Confident | 139 Ų | 139 | 111.9 Ų | 111.9 | 69% | 0.685 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63.5 | -37.8 | 178.8 | -169.6 | -89.3 | -150.2 | 0 | 0 | 111.9 | L93 R94 Q95 N101 | L93-M97 PolarHBondContact O-N 3.13Å; R94-M97 PolarHBondContact O-N 3.31Å; Q95-M97 PolarHBondContact O-N 3Å; M97-N101 WeakPolarHBondContact O-CB 3.42Å; M97-N101 PolarHBondContact O-N 3.47Å |
| 98 | E | 90.8 | Very high | 89.1 | Confident | 108 Ų | 108 | 112.2 Ų | 112.2 | 51% | 0.505 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -67.6 | -42.7 | 175.9 | -174.8 | 165.1 | -157.1 | 0 | 0 | 112.2 | R94 Q95 E96 Q100 N101 Q102 | R94-E98 PolarHBondContact O-N 3.05Å; Q95-E98 PolarHBondContact O-N 3.4Å; E96-E98 VanDerWaalsContact C-N 3.31Å; E96-E98 PolarHBondContact O-N 3.22Å; E98-Q100 VanDerWaalsContact C-N 3.35Å; E98-Q100 PolarHBondContact O-N 3.5Å; E98-N101 WeakPolarHBondContact O-CB 3.35Å; E98-N101 PolarHBondContact O-N 3.1Å; E98-N101 VanDerWaalsContact O-N 3.15Å; E98-Q102 HydrophobicContact CG-CG 4.35Å; E98-Q102 WeakPolarHBondContact O-CG 3.45Å; E98-Q102 PolarHBondContact O-N 3.28Å |
| 99 | V | 90.1 | Very high | 89.6 | Confident | 82 Ų | 82 | 111.5 Ų | 111.5 | 50% | 0.497 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -59.7 | -45.4 | 177.1 | 169.7 | 0 | 0 | 0 | 0 | 111.1 | Q95 E96 N101 Q102 H103 | Q95-V99 WeakPolarHBondContact O-CG2 3.32Å; Q95-V99 PolarHBondContact O-N 3.06Å; E96-V99 PolarHBondContact O-N 3.42Å; V99-N101 VanDerWaalsContact C-N 3.32Å; V99-N101 PolarHBondContact O-N 3.48Å; V99-Q102 PolarHBondContact O-N 3.14Å; V99-H103 WeakPolarHBondContact O-CB 3.4Å; V99-H103 PolarHBondContact O-N 3.44Å |
| 100 | Q | 87.8 | Confident | 90.1 | Very high | 110 Ų | 110 | 108.5 Ų | 108.5 | 51% | 0.514 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.3 | -39.6 | 176 | -65.6 | -62.5 | -29.5 | 0 | 0 | 111.9 | E96 E98 H103 A104 | E96-Q100 WeakPolarHBondContact O-CG 3.4Å; E96-Q100 PolarHBondContact O-N 3.32Å; E96-Q100 VanDerWaalsContact O-N 3.13Å; E96-Q100 PolarHBondContact OE1-NE2 2.89Å; E98-Q100 VanDerWaalsContact C-N 3.35Å; E98-Q100 PolarHBondContact O-N 3.5Å; Q100-H103 PolarHBondContact O-N 3.19Å; Q100-A104 WeakPolarHBondContact O-CB 3.37Å; Q100-A104 PolarHBondContact O-N 3.27Å |
| 101 | N | 91.6 | Very high | 90.4 | Very high | 70 Ų | 70 | 107 Ų | 107 | 37% | 0.374 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.5 | -40.9 | 177.7 | -172.2 | -97.4 | 0 | 0 | 0 | 112.3 | M97 E98 V99 K105 | M97-N101 WeakPolarHBondContact O-CB 3.42Å; M97-N101 PolarHBondContact O-N 3.47Å; E98-N101 WeakPolarHBondContact O-CB 3.35Å; E98-N101 PolarHBondContact O-N 3.1Å; E98-N101 VanDerWaalsContact O-N 3.15Å; V99-N101 VanDerWaalsContact C-N 3.32Å; V99-N101 PolarHBondContact O-N 3.48Å; N101-K105 WeakPolarHBondContact O-CD 3.47Å; N101-K105 VanDerWaalsContact O-CG 3.28Å; N101-K105 WeakPolarHBondContact O-CG 3.02Å; N101-K105 PolarHBondContact O-N 3.37Å; N101-K105 VanDerWaalsContact O-N 3.1Å; N101-K105 WeakPolarHBondContact OD1-CE 3.28Å; N101-K105 PolarHBondContact OD1-NZ 2.92Å |
| 102 | Q | 91.1 | Very high | 90.5 | Very high | 77 Ų | 77 | 106.6 Ų | 106.6 | 36% | 0.36 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.1 | -45.6 | 174.3 | -66.2 | -62.3 | -6.6 | 0 | 0 | 111.1 | E98 V99 A104 K105 E106 | E98-Q102 HydrophobicContact CG-CG 4.35Å; E98-Q102 WeakPolarHBondContact O-CG 3.45Å; E98-Q102 PolarHBondContact O-N 3.28Å; V99-Q102 PolarHBondContact O-N 3.14Å; Q102-A104 VanDerWaalsContact C-N 3.32Å; Q102-A104 PolarHBondContact O-N 3.31Å; Q102-K105 WeakPolarHBondContact O-CB 3.37Å; Q102-K105 PolarHBondContact O-N 2.83Å; Q102-K105 VanDerWaalsContact O-N 3.08Å; Q102-E106 WeakPolarHBondContact O-CG 3.46Å; Q102-E106 PolarHBondContact O-N 2.75Å |
| 103 | H | 90.7 | Very high | 90.5 | Very high | 93 Ų | 93 | 104 Ų | 104 | 43% | 0.431 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -57.6 | -45.1 | 176.8 | -170.7 | -86 | 0 | 0 | 0 | 111.9 | V99 Q100 K105 E106 E107 | V99-H103 WeakPolarHBondContact O-CB 3.4Å; V99-H103 PolarHBondContact O-N 3.44Å; Q100-H103 PolarHBondContact O-N 3.19Å; H103-K105 VanDerWaalsContact C-N 3.33Å; H103-K105 PolarHBondContact O-N 3.39Å; H103-E106 PolarHBondContact O-N 3.17Å; H103-E107 IonicContact CE1-OE1 3.14Å; H103-E107 PolarHBondContact CE1-OE1 3.18Å; H103-E107 IonicContact CE1-OE2 3.69Å; H103-E107 IonicContact ND1-OE1 3.79Å; H103-E107 IonicContact ND1-OE2 3.54Å; H103-E107 WeakPolarHBondContact O-CG 3.38Å; H103-E107 PolarHBondContact O-N 3.24Å |
| 104 | A | 91.5 | Very high | 90.4 | Very high | 56 Ų | 56 | 106.7 Ų | 106.7 | 46% | 0.463 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.5 | -38.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q100 Q102 S108 | Q100-A104 WeakPolarHBondContact O-CB 3.37Å; Q100-A104 PolarHBondContact O-N 3.27Å; Q102-A104 VanDerWaalsContact C-N 3.32Å; Q102-A104 PolarHBondContact O-N 3.31Å; A104-S108 WeakPolarHBondContact O-CB 3.41Å; A104-S108 PolarHBondContact O-N 3.27Å; A104-S108 VanDerWaalsContact O-N 3.09Å |
| 105 | K | 91.9 | Very high | 90.2 | Very high | 114 Ų | 114 | 107.3 Ų | 107.3 | 50% | 0.496 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66 | -43.7 | 174.8 | -74.6 | 164.7 | 172.5 | 165.2 | 0 | 111.7 | N101 Q102 H103 S108 L109 | N101-K105 WeakPolarHBondContact O-CD 3.47Å; N101-K105 VanDerWaalsContact O-CG 3.28Å; N101-K105 WeakPolarHBondContact O-CG 3.02Å; N101-K105 PolarHBondContact O-N 3.37Å; N101-K105 VanDerWaalsContact O-N 3.1Å; N101-K105 WeakPolarHBondContact OD1-CE 3.28Å; N101-K105 PolarHBondContact OD1-NZ 2.92Å; Q102-K105 WeakPolarHBondContact O-CB 3.37Å; Q102-K105 PolarHBondContact O-N 2.83Å; Q102-K105 VanDerWaalsContact O-N 3.08Å; H103-K105 VanDerWaalsContact C-N 3.33Å; H103-K105 PolarHBondContact O-N 3.39Å; K105-S108 PolarHBondContact O-N 2.98Å; K105-L109 VanDerWaalsContact O-CB 3.32Å; K105-L109 WeakPolarHBondContact O-CB 3.32Å; K105-L109 PolarHBondContact O-N 2.84Å |
| 106 | E | 91.9 | Very high | 89.8 | Confident | 125 Ų | 125 | 108.9 Ų | 108.9 | 58% | 0.584 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -66.3 | -42.6 | 179.1 | -73.1 | -179.8 | -179.6 | 0 | 0 | 111.8 | Q102 H103 S108 L109 A110 | Q102-E106 WeakPolarHBondContact O-CG 3.46Å; Q102-E106 PolarHBondContact O-N 2.75Å; H103-E106 PolarHBondContact O-N 3.17Å; E106-S108 PolarHBondContact O-N 2.83Å; E106-L109 PolarHBondContact O-N 3.16Å; E106-A110 WeakPolarHBondContact O-CB 3.49Å; E106-A110 PolarHBondContact O-N 3.21Å |
| 107 | E | 89.2 | Confident | 89.6 | Confident | 121 Ų | 121 | 106.9 Ų | 106.9 | 57% | 0.565 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.2 | -42.4 | 174.2 | -76.5 | -172.7 | 143.7 | 0 | 0 | 111.8 | H103 A110 D111 | H103-E107 IonicContact CE1-OE1 3.14Å; H103-E107 PolarHBondContact CE1-OE1 3.18Å; H103-E107 IonicContact CE1-OE2 3.69Å; H103-E107 IonicContact ND1-OE1 3.79Å; H103-E107 IonicContact ND1-OE2 3.54Å; H103-E107 WeakPolarHBondContact O-CG 3.38Å; H103-E107 PolarHBondContact O-N 3.24Å; E107-A110 PolarHBondContact O-N 3.24Å; E107-D111 PolarHBondContact O-N 3.37Å |
| 108 | S | 91.4 | Very high | 89.4 | Confident | 82 Ų | 82 | 104 Ų | 104 | 57% | 0.573 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.6 | -39.4 | 175 | -178.4 | 0 | 0 | 0 | 0 | 112.4 | A104 K105 E106 D111 D112 | A104-S108 WeakPolarHBondContact O-CB 3.41Å; A104-S108 PolarHBondContact O-N 3.27Å; A104-S108 VanDerWaalsContact O-N 3.09Å; K105-S108 PolarHBondContact O-N 2.98Å; E106-S108 PolarHBondContact O-N 2.83Å; S108-D111 PolarHBondContact O-N 3.04Å; S108-D112 PolarHBondContact O-N 2.94Å |
| 109 | L | 92.9 | Very high | 88.8 | Confident | 118 Ų | 118 | 108.3 Ų | 108.3 | 62% | 0.618 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -69 | -39.9 | 179.1 | -179.1 | 63.5 | 0 | 0 | 0 | 111.1 | K105 E106 D111 D112 L113 | K105-L109 VanDerWaalsContact O-CB 3.32Å; K105-L109 WeakPolarHBondContact O-CB 3.32Å; K105-L109 PolarHBondContact O-N 2.84Å; E106-L109 PolarHBondContact O-N 3.16Å; L109-D111 VanDerWaalsContact C-N 3.34Å; L109-D112 PolarHBondContact O-N 3.43Å; L109-L113 WeakPolarHBondContact O-CB 3.37Å; L109-L113 PolarHBondContact O-N 2.91Å |
| 110 | A | 92.6 | Very high | 87.8 | Confident | 40 Ų | 40 | 110.2 Ų | 110.2 | 33% | 0.331 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -59.7 | -46.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | E106 E107 D112 L113 F114 | E106-A110 WeakPolarHBondContact O-CB 3.49Å; E106-A110 PolarHBondContact O-N 3.21Å; E107-A110 PolarHBondContact O-N 3.24Å; A110-D112 PolarHBondContact O-N 3.34Å; A110-L113 PolarHBondContact O-N 3.45Å; A110-F114 HydrophobicContact CB-CD2 4.43Å; A110-F114 HydrophobicContact CB-CE2 4.31Å; A110-F114 WeakPolarHBondContact O-CD2 3.21Å; A110-F114 PolarHBondContact O-N 3.36Å |
| 111 | D | 92.2 | Very high | 86.9 | Confident | 83 Ų | 83 | 114.3 Ų | 114.3 | 44% | 0.444 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -57.6 | -45.6 | 178.2 | -166.1 | 59.2 | 0 | 0 | 0 | 112.2 | E107 S108 L109 L113 F114 R115 | E107-D111 PolarHBondContact O-N 3.37Å; S108-D111 PolarHBondContact O-N 3.04Å; L109-D111 VanDerWaalsContact C-N 3.34Å; D111-L113 PolarHBondContact O-N 3.04Å; D111-F114 PolarHBondContact O-N 3.06Å; D111-R115 VanDerWaalsContact O-CB 3.3Å; D111-R115 WeakPolarHBondContact O-CB 3.37Å; D111-R115 WeakPolarHBondContact O-CD 3.25Å; D111-R115 WeakPolarHBondContact O-CG 3.44Å; D111-R115 PolarHBondContact O-N 2.79Å; D111-R115 WeakPolarHBondContact OD2-CD 3.32Å; D111-R115 IonicContact OD2-CZ 3.88Å; D111-R115 IonicContact OD2-NE 3.97Å; D111-R115 IonicContact OD2-NH1 2.94Å; D111-R115 PolarHBondContact OD2-NH1 3.45Å |
| 112 | D | 89.9 | Confident | 85.8 | Confident | 109 Ų | 109 | 121.8 Ų | 121.8 | 58% | 0.583 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -63.9 | -40.7 | 177.1 | -170.2 | 46.4 | 0 | 0 | 0 | 112.3 | S108 L109 A110 F114 R115 Y116 | S108-D112 PolarHBondContact O-N 2.94Å; L109-D112 PolarHBondContact O-N 3.43Å; A110-D112 PolarHBondContact O-N 3.34Å; D112-F114 PolarHBondContact O-N 2.94Å; D112-R115 PolarHBondContact O-N 2.97Å; D112-Y116 PolarHBondContact O-N 2.76Å |
| 113 | L | 91.6 | Very high | 84.5 | Confident | 128 Ų | 128 | 129.6 Ų | 129.6 | 67% | 0.67 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -63.5 | -42 | 178.7 | -173.8 | 62.6 | 0 | 0 | 0 | 112.2 | L109 A110 D111 R115 | L109-L113 WeakPolarHBondContact O-CB 3.37Å; L109-L113 PolarHBondContact O-N 2.91Å; A110-L113 PolarHBondContact O-N 3.45Å; D111-L113 PolarHBondContact O-N 3.04Å; L113-R115 VanDerWaalsContact C-N 3.32Å |
| 114 | F | 87.4 | Confident | 83.4 | Confident | 175 Ų | 175 | 139.4 Ų | 139.4 | 77% | 0.768 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -75.1 | -22.3 | 178 | -73.1 | -68.2 | 0 | 0 | 0 | 113.1 | A110 D111 D112 | A110-F114 HydrophobicContact CB-CD2 4.43Å; A110-F114 HydrophobicContact CB-CE2 4.31Å; A110-F114 WeakPolarHBondContact O-CD2 3.21Å; A110-F114 PolarHBondContact O-N 3.36Å; D111-F114 PolarHBondContact O-N 3.06Å; D112-F114 PolarHBondContact O-N 2.94Å |
| 115 | R | 85.8 | Confident | 83 | Confident | 177 Ų | 177 | 143.6 Ų | 143.6 | 67% | 0.668 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -91.3 | -8.1 | 177.8 | -69 | 172 | 66.9 | 180 | 0.2 | 113.5 | D111 D112 L113 N117 | D111-R115 VanDerWaalsContact O-CB 3.3Å; D111-R115 WeakPolarHBondContact O-CB 3.37Å; D111-R115 WeakPolarHBondContact O-CD 3.25Å; D111-R115 WeakPolarHBondContact O-CG 3.44Å; D111-R115 PolarHBondContact O-N 2.79Å; D111-R115 WeakPolarHBondContact OD2-CD 3.32Å; D111-R115 IonicContact OD2-CZ 3.88Å; D111-R115 IonicContact OD2-NE 3.97Å; D111-R115 IonicContact OD2-NH1 2.94Å; D111-R115 PolarHBondContact OD2-NH1 3.45Å; D112-R115 PolarHBondContact O-N 2.97Å; L113-R115 VanDerWaalsContact C-N 3.32Å; R115-N117 PolarHBondContact O-N 2.95Å |
| 116 | Y | 84.7 | Confident | 82.5 | Confident | 164 Ų | 164 | 145.1 Ų | 145.1 | 64% | 0.643 | 66% | 0.658 | S | S | * | * | trans | -60.3 | 106.7 | -178.8 | -177 | -107.1 | 0 | 0 | 0 | 111.2 | D112 P118 | D112-Y116 PolarHBondContact O-N 2.76Å; Y116-P118 HydrophobicContact CE1-CB 3.73Å; Y116-P118 HydrophobicContact CE1-CG 4.24Å; Y116-P118 WeakPolarHBondContact O-CD 3.11Å | ||
| 117 | N | 82 | Confident | 82 | Confident | 74 Ų | 74 | 146.2 Ų | 146.2 | 40% | 0.396 | 66% | 0.663 | S | S | . | * | trans | -106.9 | 102.9 | 172 | -178.6 | -11.7 | 0 | 0 | 0 | 108.9 | R115 Y119 L120 | R115-N117 PolarHBondContact O-N 2.95Å; N117-Y119 PolarHBondContact O-N 2.77Å; N117-Y119 WeakPolarHBondContact OD1-CB 3.38Å; N117-Y119 WeakPolarHBondContact OD1-CD2 3.46Å; N117-Y119 PolarHBondContact OD1-N 3.42Å; N117-L120 HydrophobicContact CB-CD1 3.77Å; N117-L120 HydrophobicContact CB-CG 3.8Å; N117-L120 PolarHBondContact O-N 3.33Å; N117-L120 VanDerWaalsContact O-N 3.17Å | ||
| 118 | P | 80.4 | Confident | 81.6 | Confident | 78 Ų | 78 | 147.7 Ų | 147.7 | 51% | 0.506 | 67% | 0.668 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -65.5 | -11.7 | -176.2 | 25.7 | -33.5 | 0 | 0 | 0 | 113.6 | Y116 | Y116-P118 HydrophobicContact CE1-CB 3.73Å; Y116-P118 HydrophobicContact CE1-CG 4.24Å; Y116-P118 WeakPolarHBondContact O-CD 3.11Å |
| 119 | Y | 77.9 | Confident | 80.9 | Confident | 198 Ų | 198 | 151.8 Ų | 151.8 | 78% | 0.776 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.8 | -3.8 | -179 | -52.7 | -70.3 | 0 | 0 | 0 | 113.5 | N117 K121 | N117-Y119 PolarHBondContact O-N 2.77Å; N117-Y119 WeakPolarHBondContact OD1-CB 3.38Å; N117-Y119 WeakPolarHBondContact OD1-CD2 3.46Å; N117-Y119 PolarHBondContact OD1-N 3.42Å; Y119-K121 VanDerWaalsContact C-N 3.34Å; Y119-K121 PolarHBondContact O-N 3.31Å |
| 120 | L | 70 | Confident | 80.1 | Confident | 122 Ų | 122 | 154.1 Ų | 154.1 | 64% | 0.639 | 68% | 0.678 | S | S | * | * | trans | -71.8 | 91 | 171.4 | -65.8 | 175.5 | 0 | 0 | 0 | 109.1 | N117 R122 | N117-L120 HydrophobicContact CB-CD1 3.77Å; N117-L120 HydrophobicContact CB-CG 3.8Å; N117-L120 PolarHBondContact O-N 3.33Å; N117-L120 VanDerWaalsContact O-N 3.17Å; L120-R122 PolarHBondContact O-N 2.71Å | ||
| 121 | K | 68.5 | Low | 79.2 | Confident | 197 Ų | 197 | 162.2 Ų | 162.2 | 86% | 0.857 | 70% | 0.703 | S | S | * | * | trans | -55.6 | 112.2 | 173.6 | -65.1 | -167.7 | -178.6 | -173.8 | 0 | 109 | Y119 R123 | Y119-K121 VanDerWaalsContact C-N 3.34Å; Y119-K121 PolarHBondContact O-N 3.31Å; K121-R123 PolarHBondContact O-N 2.81Å | ||
| 122 | R | 67.7 | Low | 78.2 | Confident | 226 Ų | 226 | 168.3 Ų | 168.3 | 85% | 0.853 | 72% | 0.723 | S | S | * | * | trans | -57.8 | 103.2 | 171.4 | -77.5 | 175.7 | 61.3 | 160.7 | 1.3 | 108.9 | L120 R124 | L120-R122 PolarHBondContact O-N 2.71Å; R122-R124 PolarHBondContact O-N 3.21Å | ||
| 123 | R | 65.3 | Low | 77.3 | Confident | 242 Ų | 242 | 173.3 Ų | 173.3 | 91% | 0.913 | 73% | 0.734 | S | S | * | * | trans | -75.4 | 110.5 | 163.3 | -73.1 | -175.1 | 63.9 | 161.8 | -1.3 | 106.9 | K121 | K121-R123 PolarHBondContact O-N 2.81Š| ||
| 124 | R | 66.1 | Low | 76 | Confident | 298 Ų | 298 | 177.4 Ų | 177.4 | 100% | 1.125 | 74% | 0.74 | S | S | * | * | trans | -70 | 0 | 163.2 | -83.1 | -176.8 | 178 | 160 | -0.7 | 109.7 | R122 | R122-R124 PolarHBondContact O-N 3.21Š|
Retrieved 124 of 124 residues in 103.6 ms
(Link to these results)