| 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 | 52.6 | Low | 53.1 | Low | 250 Ų | 250 | 164.8 Ų | 164.8 | 100% | 1.232 | 87% | 0.868 | S | S | * | * | 0 | 100.8 | 0 | -72.1 | 155.5 | 161.9 | 0 | 0 | 105.4 | |||||
| 2 | A | 47.5 | Very low | 52.7 | Low | 105 Ų | 105 | 171.8 Ų | 171.8 | 87% | 0.868 | 87% | 0.873 | S | S | * | * | -157.6 | 107.9 | 54.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 3 | S | 47.8 | Very low | 53 | Low | 115 Ų | 115 | 171.9 Ų | 171.9 | 80% | 0.804 | 88% | 0.876 | S | S | * | * | trans | -103.7 | 142 | 157.2 | -28.1 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 4 | R | 59 | Low | 53 | Low | 240 Ų | 240 | 168.2 Ų | 168.2 | 91% | 0.906 | 87% | 0.869 | S | S | * | * | trans | 107.9 | 83.4 | 177.2 | -60 | 165 | -178.3 | -161.1 | 0.4 | 114.4 | ||||
| 5 | V | 57.5 | Low | 53.3 | Low | 145 Ų | 145 | 164 Ų | 164 | 88% | 0.879 | 87% | 0.869 | S | S | * | * | trans | -140.2 | 90.4 | 132.2 | -173.3 | 0 | 0 | 0 | 0 | 107 | ||||
| 6 | L | 52.6 | Low | 53.1 | Low | 155 Ų | 155 | 159.7 Ų | 159.7 | 81% | 0.812 | 86% | 0.864 | S | S | * | * | trans | -69.8 | 150.4 | 165.5 | -78.7 | 165 | 0 | 0 | 0 | 109.4 | ||||
| 7 | S | 52.3 | Low | 52.9 | Low | 112 Ų | 112 | 162.9 Ų | 162.9 | 78% | 0.783 | 87% | 0.868 | S | S | * | * | trans | 66.4 | 86.2 | 132.5 | -179.8 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 8 | S | 59.7 | Low | 53.1 | Low | 92 Ų | 92 | 158.4 Ų | 158.4 | 64% | 0.643 | 86% | 0.858 | S | S | * | * | trans | -159.1 | 23.4 | 161.6 | 56.3 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 9 | Y | 49.8 | Very low | 53.4 | Low | 226 Ų | 226 | 156.5 Ų | 156.5 | 89% | 0.886 | 86% | 0.855 | S | S | * | * | trans | -138.2 | 44.9 | 171.4 | -81.4 | -80.3 | 0 | 0 | 0 | 115.2 | ||||
| 10 | V | 53.7 | Low | 54 | Low | 142 Ų | 142 | 156.8 Ų | 156.8 | 86% | 0.861 | 85% | 0.854 | S | S | * | * | trans | -103 | 100.2 | 152.7 | 176.6 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 11 | R | 51.3 | Low | 54.1 | Low | 231 Ų | 231 | 154.6 Ų | 154.6 | 87% | 0.872 | 85% | 0.848 | S | S | * | * | trans | 156 | 108.4 | 150.7 | -92.8 | 177.4 | -161.4 | -178.7 | 6.1 | 109.5 | ||||
| 12 | R | 49.3 | Very low | 54.5 | Low | 248 Ų | 248 | 154.7 Ų | 154.7 | 94% | 0.936 | 83% | 0.834 | S | S | * | * | trans | -176.3 | 78.1 | 136.2 | -100.4 | 167.8 | -153.7 | -131 | 6.3 | 108.8 | ||||
| 13 | L | 55.5 | Low | 55.3 | Low | 174 Ų | 174 | 155.9 Ų | 155.9 | 91% | 0.911 | 83% | 0.831 | S | S | * | * | trans | -76.5 | 123.9 | 155.5 | -84.2 | 156.5 | 0 | 0 | 0 | 107.2 | A15 | L13-A15 PolarHBondContact O-N 3.12Š| ||
| 14 | P | 53.3 | Low | 55.6 | Low | 120 Ų | 120 | 155.8 Ų | 155.8 | 78% | 0.779 | 83% | 0.827 | S | S | * | * | trans | -74.7 | 108.7 | 167.9 | 27.9 | -28.9 | 0 | 0 | 0 | 109.3 | A16 | P14-A16 PolarHBondContact O-N 3.05Š| ||
| 15 | A | 57.8 | Low | 55.4 | Low | 105 Ų | 105 | 153.7 Ų | 153.7 | 87% | 0.868 | 83% | 0.83 | S | S | * | * | trans | -67.8 | 106.2 | 163.4 | 0 | 0 | 0 | 0 | 0 | 109 | L13 | L13-A15 PolarHBondContact O-N 3.12Š| ||
| 16 | A | 49.8 | Very low | 55.3 | Low | 95 Ų | 95 | 154.5 Ų | 154.5 | 79% | 0.785 | 83% | 0.829 | S | S | * | * | trans | -128.1 | 64.6 | 167.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | P14 A18 | P14-A16 PolarHBondContact O-N 3.05Å; A16-A18 PolarHBondContact O-N 2.72Å | ||
| 17 | F | 50.3 | Low | 55.1 | Low | 214 Ų | 214 | 151.5 Ų | 151.5 | 94% | 0.939 | 83% | 0.826 | S | S | * | * | trans | -83.8 | 91.9 | 167.7 | -133.6 | -95.2 | 0 | 0 | 0 | 107 | ||||
| 18 | A | 56.9 | Low | 55.1 | Low | 82 Ų | 82 | 152.3 Ų | 152.3 | 68% | 0.678 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 135.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | A16 L20 | A16-A18 PolarHBondContact O-N 2.72Å; A18-L20 PolarHBondContact O-N 2.82Å |
| 19 | P | 58.8 | Low | 54.6 | Low | 123 Ų | 123 | 152.2 Ų | 152.2 | 80% | 0.799 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 123.5 | 177.9 | 29.2 | -30.9 | 0 | 0 | 0 | 110.3 | ||
| 20 | L | 64.1 | Low | 55.2 | Low | 161 Ų | 161 | 152.6 Ų | 152.6 | 84% | 0.843 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -65 | 141 | 172.6 | -72.3 | 167.9 | 0 | 0 | 0 | 111 | A18 R22 | A18-L20 PolarHBondContact O-N 2.82Å; L20-R22 PolarHBondContact O-N 3.5Å |
| 21 | P | 57.2 | Low | 55.3 | Low | 111 Ų | 111 | 151.6 Ų | 151.6 | 72% | 0.721 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 129.8 | 177.2 | 27.6 | -31.7 | 0 | 0 | 0 | 111 | V23 | P21-V23 PolarHBondContact O-N 2.86Š|
| 22 | R | 61 | Low | 55.4 | Low | 252 Ų | 252 | 148.6 Ų | 148.6 | 95% | 0.951 | 83% | 0.828 | S | S | * | * | trans | -61.7 | 111.1 | 173.8 | -75.5 | 175.8 | 167.4 | 169.3 | -4.3 | 110.2 | L20 | L20-R22 PolarHBondContact O-N 3.5Š| ||
| 23 | V | 63.7 | Low | 55.4 | Low | 131 Ų | 131 | 142.3 Ų | 142.3 | 79% | 0.794 | 82% | 0.822 | S | S | * | * | trans | -82.3 | 131 | 168.6 | -161.3 | 0 | 0 | 0 | 0 | 108.4 | P21 M25 | P21-V23 PolarHBondContact O-N 2.86Å; V23-M25 PolarHBondContact O-N 3.37Å | ||
| 24 | P | 54.1 | Low | 55.3 | Low | 113 Ų | 113 | 140.4 Ų | 140.4 | 73% | 0.734 | 82% | 0.818 | S | S | * | * | trans | -71.9 | 124.3 | 178.1 | 27.2 | -31 | 0 | 0 | 0 | 110.8 | L26 | P24-L26 PolarHBondContact O-N 3.22Š| ||
| 25 | M | 54.8 | Low | 55 | Low | 195 Ų | 195 | 138.3 Ų | 138.3 | 96% | 0.961 | 82% | 0.818 | S | S | * | * | trans | -65.5 | 110.1 | 168 | -102 | -152.7 | 163.2 | 0 | 0 | 109.9 | V23 A27 | V23-M25 PolarHBondContact O-N 3.37Å; M25-A27 PolarHBondContact O-N 3.22Å | ||
| 26 | L | 54.5 | Low | 54.6 | Low | 162 Ų | 162 | 141.4 Ų | 141.4 | 85% | 0.848 | 82% | 0.819 | S | S | * | * | trans | -83.6 | 99.5 | 165.6 | -104 | 156.5 | 0 | 0 | 0 | 108.8 | P24 V28 | P24-L26 PolarHBondContact O-N 3.22Å; L26-V28 PolarHBondContact O-N 2.99Å | ||
| 27 | A | 49.7 | Very low | 54.1 | Low | 92 Ų | 92 | 143 Ų | 143 | 76% | 0.76 | 82% | 0.823 | S | S | * | * | trans | -66.2 | 105.3 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110 | M25 A29 | M25-A27 PolarHBondContact O-N 3.22Å; A27-A29 PolarHBondContact O-N 2.93Å | ||
| 28 | V | 51.9 | Low | 53.5 | Low | 129 Ų | 129 | 137.9 Ų | 137.9 | 78% | 0.782 | 81% | 0.814 | S | S | * | * | trans | -81.6 | 93.5 | 168 | 174.8 | 0 | 0 | 0 | 0 | 107.9 | L26 R30 | L26-V28 PolarHBondContact O-N 2.99Å; V28-R30 PolarHBondContact O-N 3.41Å | ||
| 29 | A | 49.6 | Very low | 53 | Low | 91 Ų | 91 | 140.7 Ų | 140.7 | 75% | 0.752 | 82% | 0.823 | S | S | * | * | trans | -70.9 | 115.2 | 166.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | A27 P31 | A27-A29 PolarHBondContact O-N 2.93Å; A29-P31 WeakPolarHBondContact O-CD 3.37Å | ||
| 30 | R | 61.3 | Low | 52 | Low | 233 Ų | 233 | 138.4 Ų | 138.4 | 88% | 0.879 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -83.2 | 118.9 | 167.6 | -79.4 | 179.1 | 151.5 | 163 | -5.4 | 108.9 | V28 L32 | V28-R30 PolarHBondContact O-N 3.41Å; R30-L32 PolarHBondContact O-N 2.99Å |
| 31 | P | 56.6 | Low | 50.8 | Low | 121 Ų | 121 | 137.6 Ų | 137.6 | 79% | 0.786 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 120.5 | 169.3 | 28.8 | -29 | 0 | 0 | 0 | 110.2 | A29 S33 | A29-P31 WeakPolarHBondContact O-CD 3.37Å; P31-S33 PolarHBondContact O-N 3.3Å |
| 32 | L | 53.5 | Low | 50.3 | Low | 168 Ų | 168 | 141.1 Ų | 141.1 | 88% | 0.88 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 122 | 156.9 | -118.2 | 88.5 | 0 | 0 | 0 | 107.7 | R30 | R30-L32 PolarHBondContact O-N 2.99Š|
| 33 | S | 49.2 | Very low | 48.9 | Very low | 116 Ų | 116 | 136 Ų | 136 | 81% | 0.811 | 83% | 0.827 | S | S | * | * | trans | -130.1 | 99.1 | 168.3 | -155.8 | 0 | 0 | 0 | 0 | 109.5 | P31 | P31-S33 PolarHBondContact O-N 3.3Š| ||
| 34 | T | 53.6 | Low | 47.8 | Very low | 134 Ų | 134 | 140 Ų | 140 | 82% | 0.822 | 83% | 0.828 | S | S | * | * | trans | -83.2 | 116 | 162.4 | 45.6 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 35 | G | 47.2 | Very low | 46.9 | Very low | 77 Ų | 77 | 141.9 Ų | 141.9 | 79% | 0.794 | 83% | 0.831 | S | S | * | * | trans | -139.2 | 103.4 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 36 | L | 49.6 | Very low | 46.1 | Very low | 170 Ų | 170 | 136 Ų | 136 | 89% | 0.89 | 82% | 0.821 | S | S | * | * | trans | -88.3 | 165.1 | 169.1 | -104.7 | 146.5 | 0 | 0 | 0 | 110.2 | ||||
| 37 | C | 37.8 | Very low | 45.9 | Very low | 127 Ų | 127 | 134.1 Ų | 134.1 | 86% | 0.858 | 82% | 0.818 | S | S | * | * | trans | 88.5 | 144.5 | 171.4 | -53 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 38 | S | 38.7 | Very low | 45.4 | Very low | 107 Ų | 107 | 138.1 Ų | 138.1 | 75% | 0.748 | 83% | 0.825 | S | S | * | * | cis | -169.5 | 147.9 | -22.7 | 179.9 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 39 | V | 46.1 | Very low | 45.5 | Very low | 142 Ų | 142 | 140.3 Ų | 140.3 | 86% | 0.861 | 83% | 0.827 | S | S | * | * | trans | 5.5 | 129 | 156.3 | 178.8 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 40 | G | 37.6 | Very low | 45.3 | Very low | 74 Ų | 74 | 141.8 Ų | 141.8 | 76% | 0.763 | 83% | 0.829 | S | S | * | * | trans | -177.9 | 133 | 161.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 41 | T | 38.4 | Very low | 44.9 | Very low | 145 Ų | 145 | 134.5 Ų | 134.5 | 89% | 0.89 | 82% | 0.819 | S | S | * | * | trans | -75.7 | 161.5 | -164 | 41.1 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 42 | Q | 46.5 | Very low | 44.2 | Very low | 184 Ų | 184 | 136.7 Ų | 136.7 | 86% | 0.86 | 82% | 0.823 | S | S | * | * | trans | -37.9 | 150.3 | 176.6 | -63.4 | 174.3 | 13.7 | 0 | 0 | 117.5 | ||||
| 43 | T | 33.3 | Very low | 43.8 | Very low | 146 Ų | 146 | 138.1 Ų | 138.1 | 90% | 0.896 | 82% | 0.822 | S | S | * | * | -169.1 | 139.3 | 118.1 | -66.8 | 0 | 0 | 0 | 0 | 111 | |||||
| 44 | R | 39.7 | Very low | 43.4 | Very low | 214 Ų | 214 | 140 Ų | 140 | 81% | 0.808 | 82% | 0.822 | S | S | * | * | trans | -77.6 | 148.8 | -175.1 | -176.7 | -169.2 | -177.3 | -129.5 | 4 | 112.9 | ||||
| 45 | L | 34.5 | Very low | 43.5 | Very low | 152 Ų | 152 | 137.7 Ų | 137.7 | 80% | 0.796 | 82% | 0.817 | S | S | * | * | 161.4 | 129.1 | 125.2 | -84.1 | 170 | 0 | 0 | 0 | 113.4 | |||||
| 46 | G | 39.6 | Very low | 43.6 | Very low | 73 Ų | 73 | 142.5 Ų | 142.5 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | trans | 132.1 | 115.5 | 156 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 47 | P | 49.2 | Very low | 43.9 | Very low | 121 Ų | 121 | 140 Ų | 140 | 79% | 0.786 | 81% | 0.811 | S | S | * | * | trans | -99.9 | 127.9 | 175.5 | 34.8 | -24.2 | 0 | 0 | 0 | 111.1 | ||||
| 48 | L | 39.5 | Very low | 44.6 | Very low | 176 Ų | 176 | 140.3 Ų | 140.3 | 92% | 0.921 | 81% | 0.811 | S | S | * | * | trans | -146.4 | 92.9 | 155.2 | -73.9 | 180 | 0 | 0 | 0 | 108.1 | ||||
| 49 | Q | 53.6 | Low | 45.3 | Very low | 176 Ų | 176 | 137.2 Ų | 137.2 | 82% | 0.822 | 80% | 0.796 | S | S | * | * | trans | -89.6 | 123.3 | 163.9 | -68.2 | -175.4 | -11.2 | 0 | 0 | 108.3 | A51 | Q49-A51 VanDerWaalsContact C-N 3.34Å; Q49-A51 PolarHBondContact O-N 3.19Å | ||
| 50 | P | 45 | Very low | 45.9 | Very low | 121 Ų | 121 | 141.4 Ų | 141.4 | 79% | 0.786 | 80% | 0.796 | S | S | * | * | trans | -78.7 | 93.4 | 149.2 | 11.8 | 3.9 | 0 | 0 | 0 | 107.4 | L52 | P50-L52 VanDerWaalsContact C-N 3.3Å; P50-L52 PolarHBondContact O-N 2.96Å | ||
| 51 | A | 54.2 | Low | 46.7 | Very low | 81 Ų | 81 | 143.7 Ų | 143.7 | 67% | 0.669 | 80% | 0.795 | S | S | * | * | trans | -70.9 | 87.6 | 164 | 0 | 0 | 0 | 0 | 0 | 108.7 | Q49 K53 | Q49-A51 VanDerWaalsContact C-N 3.34Å; Q49-A51 PolarHBondContact O-N 3.19Å; A51-K53 PolarHBondContact O-N 3.35Å | ||
| 52 | L | 42.3 | Very low | 47.8 | Very low | 167 Ų | 167 | 141.6 Ų | 141.6 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | trans | -84.1 | 102.1 | 160.7 | -77.7 | 176.2 | 0 | 0 | 0 | 108 | P50 L54 | P50-L52 VanDerWaalsContact C-N 3.3Å; P50-L52 PolarHBondContact O-N 2.96Å; L52-L54 PolarHBondContact O-N 3.45Å | ||
| 53 | K | 43.6 | Very low | 48.4 | Very low | 197 Ų | 197 | 140 Ų | 140 | 86% | 0.857 | 78% | 0.775 | S | S | * | * | trans | -42.9 | 116.8 | 174.2 | -77.5 | -176.7 | 166.1 | -177.7 | 0 | 110.8 | A51 A55 | A51-K53 PolarHBondContact O-N 3.35Å; K53-A55 PolarHBondContact O-N 3.46Å | ||
| 54 | L | 42 | Very low | 49.7 | Very low | 155 Ų | 155 | 140.7 Ų | 140.7 | 81% | 0.812 | 77% | 0.772 | S | S | * | * | trans | -60.6 | 107.1 | 154.8 | -160.5 | 79.9 | 0 | 0 | 0 | 106 | L52 Q56 | L52-L54 PolarHBondContact O-N 3.45Å; L54-Q56 VanDerWaalsContact C-N 3.3Å; L54-Q56 PolarHBondContact O-N 3.31Å | ||
| 55 | A | 54.4 | Low | 51 | Low | 87 Ų | 87 | 134.4 Ų | 134.4 | 72% | 0.719 | 76% | 0.76 | S | S | * | * | trans | -61.3 | 99.6 | 168.4 | 0 | 0 | 0 | 0 | 0 | 106.8 | K53 V57 | K53-A55 PolarHBondContact O-N 3.46Å; A55-V57 VanDerWaalsContact C-N 3.26Å; A55-V57 PolarHBondContact O-N 3.45Å | ||
| 56 | Q | 49.5 | Very low | 52.7 | Low | 177 Ų | 177 | 136.2 Ų | 136.2 | 83% | 0.827 | 76% | 0.756 | S | S | * | * | trans | -65.1 | 95.6 | 166.8 | -77.3 | 173.4 | -14.8 | 0 | 0 | 106.4 | L54 P58 | L54-Q56 VanDerWaalsContact C-N 3.3Å; L54-Q56 PolarHBondContact O-N 3.31Å; Q56-P58 WeakPolarHBondContact O-CD 3.48Å | ||
| 57 | V | 56.4 | Low | 54 | Low | 119 Ų | 119 | 140.3 Ų | 140.3 | 72% | 0.721 | 76% | 0.756 | S | S | * | * | trans | -61.6 | 121.2 | 165.4 | 180 | 0 | 0 | 0 | 0 | 105.4 | A55 G59 | A55-V57 VanDerWaalsContact C-N 3.26Å; A55-V57 PolarHBondContact O-N 3.45Å; V57-G59 PolarHBondContact O-N 2.87Å | ||
| 58 | P | 52.5 | Low | 55.1 | Low | 133 Ų | 133 | 143.1 Ų | 143.1 | 86% | 0.864 | 75% | 0.752 | S | S | * | * | trans | -76.8 | 61.6 | 171.8 | 34 | -31.9 | 0 | 0 | 0 | 107.5 | Q56 | Q56-P58 WeakPolarHBondContact O-CD 3.48Š| ||
| 59 | G | 54.3 | Low | 57.1 | Low | 42 Ų | 42 | 140 Ų | 140 | 43% | 0.433 | 75% | 0.745 | S | S | . | * | trans | -95.7 | 102.5 | 167.8 | 0 | 0 | 0 | 0 | 0 | 105.2 | V57 V61 | V57-G59 PolarHBondContact O-N 2.87Å; G59-V61 PolarHBondContact O-N 3.4Å | ||
| 60 | R | 56.7 | Low | 58.3 | Low | 230 Ų | 230 | 136.6 Ų | 136.6 | 87% | 0.868 | 73% | 0.732 | S | S | * | * | trans | -58.3 | 92.3 | 154.7 | -168.2 | -178.5 | -172.8 | -170.8 | 2.2 | 104.6 | T62 | R60-T62 PolarHBondContact O-N 3.37Š| ||
| 61 | V | 54.5 | Low | 59.8 | Low | 122 Ų | 122 | 139 Ų | 139 | 74% | 0.739 | 74% | 0.735 | S | S | * | * | trans | -67.4 | 84.3 | 167.4 | -178.9 | 0 | 0 | 0 | 0 | 103.4 | G59 Q63 | G59-V61 PolarHBondContact O-N 3.4Å; V61-Q63 HydrophobicContact CG1-CB 4.42Å; V61-Q63 PolarHBondContact O-N 3.4Å | ||
| 62 | T | 61.4 | Low | 61 | Low | 100 Ų | 100 | 140 Ų | 140 | 61% | 0.613 | 74% | 0.735 | S | S | * | * | trans | -59.1 | 90.8 | 154.1 | 30.5 | 0 | 0 | 0 | 0 | 103.9 | R60 L64 | R60-T62 PolarHBondContact O-N 3.37Å; T62-L64 VanDerWaalsContact C-N 3.26Å; T62-L64 PolarHBondContact O-N 2.96Å | ||
| 63 | Q | 60.7 | Low | 62.8 | Low | 151 Ų | 151 | 137.6 Ų | 137.6 | 71% | 0.706 | 73% | 0.729 | S | S | * | * | trans | -60.9 | 100.9 | 174.3 | -161.8 | 165.2 | -32.5 | 0 | 0 | 104.8 | V61 C65 | V61-Q63 HydrophobicContact CG1-CB 4.42Å; V61-Q63 PolarHBondContact O-N 3.4Å; Q63-C65 PolarHBondContact O-N 3.45Å | ||
| 64 | L | 59.7 | Low | 64.7 | Low | 161 Ų | 161 | 130.9 Ų | 130.9 | 84% | 0.843 | 70% | 0.702 | S | S | * | * | trans | -67.5 | 71.4 | 165.1 | -74.8 | 162.8 | 0 | 0 | 0 | 105.8 | T62 R66 | T62-L64 VanDerWaalsContact C-N 3.26Å; T62-L64 PolarHBondContact O-N 2.96Å; L64-R66 VanDerWaalsContact C-N 3.32Å; L64-R66 PolarHBondContact O-N 2.89Å | ||
| 65 | C | 66.8 | Low | 67.1 | Low | 82 Ų | 82 | 127.1 Ų | 127.1 | 55% | 0.554 | 69% | 0.686 | S | S | * | * | trans | -60.5 | 105 | 163.9 | -74.7 | 0 | 0 | 0 | 0 | 105.1 | Q63 Q67 | Q63-C65 PolarHBondContact O-N 3.45Å; C65-Q67 PolarHBondContact O-N 3.16Å | ||
| 66 | R | 69.8 | Low | 68.9 | Low | 190 Ų | 190 | 125 Ų | 125 | 72% | 0.717 | 66% | 0.662 | S | S | * | * | trans | -67.5 | 106.3 | 169.4 | -64.9 | -170.3 | 172.7 | -153.8 | 0.2 | 106.2 | L64 Y68 | L64-R66 VanDerWaalsContact C-N 3.32Å; L64-R66 PolarHBondContact O-N 2.89Å; R66-Y68 VanDerWaalsContact C-N 3.29Å; R66-Y68 HydrophobicContact CB-CD2 3.54Å; R66-Y68 HydrophobicContact CB-CE2 3.22Å; R66-Y68 HydrophobicContact CB-CG 4.44Å; R66-Y68 VanDerWaalsContact CD-OH 3.3Å; R66-Y68 WeakPolarHBondContact CD-OH 3.02Å; R66-Y68 HydrophobicContact CG-CE2 3.94Å; R66-Y68 PolarHBondContact NH1-OH 3.06Å; R66-Y68 PolarHBondContact O-N 3.36Å | ||
| 67 | Q | 67.3 | Low | 70.9 | Confident | 158 Ų | 158 | 123.3 Ų | 123.3 | 74% | 0.738 | 65% | 0.654 | S | S | * | * | trans | -70.9 | 87.5 | 176.6 | -71.8 | 177.3 | -7.5 | 0 | 0 | 108.3 | C65 | C65-Q67 PolarHBondContact O-N 3.16Š| ||
| 68 | Y | 72.7 | Confident | 72.7 | Confident | 180 Ų | 180 | 118.7 Ų | 118.7 | 71% | 0.706 | 63% | 0.631 | S | S | * | * | trans | -102 | -2.2 | 173.8 | -68.9 | -60.2 | 0 | 0 | 0 | 112.6 | R66 | R66-Y68 VanDerWaalsContact C-N 3.29Å; R66-Y68 HydrophobicContact CB-CD2 3.54Å; R66-Y68 HydrophobicContact CB-CE2 3.22Å; R66-Y68 HydrophobicContact CB-CG 4.44Å; R66-Y68 VanDerWaalsContact CD-OH 3.3Å; R66-Y68 WeakPolarHBondContact CD-OH 3.02Å; R66-Y68 HydrophobicContact CG-CE2 3.94Å; R66-Y68 PolarHBondContact NH1-OH 3.06Å; R66-Y68 PolarHBondContact O-N 3.36Å | ||
| 69 | S | 81.6 | Confident | 74.6 | Confident | 110 Ų | 110 | 112.4 Ų | 112.4 | 77% | 0.769 | 59% | 0.59 | S | S | * | * | S | Bend | trans | -97.5 | -12.2 | -174.8 | 49.4 | 0 | 0 | 0 | 0 | 113.9 | ||
| 70 | D | 78.1 | Confident | 76.5 | Confident | 105 Ų | 105 | 115.7 Ų | 115.7 | 56% | 0.561 | 59% | 0.59 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 121.8 | -176.3 | -62 | -54.8 | 0 | 0 | 0 | 109.8 | ||
| 71 | M | 77.7 | Confident | 78.4 | Confident | 172 Ų | 172 | 109.9 Ų | 109.9 | 85% | 0.847 | 58% | 0.576 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 127.8 | 166.6 | -168.9 | 94.2 | 76.4 | 0 | 0 | 107.2 | ||
| 72 | P | 78.2 | Confident | 80.3 | Confident | 101 Ų | 101 | 107.7 Ų | 107.7 | 66% | 0.656 | 55% | 0.554 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 142.1 | 175 | 22.1 | -31.5 | 0 | 0 | 0 | 109.9 | L74 | P72-L74 PolarHBondContact O-N 3.49Š|
| 73 | P | 80.4 | Confident | 81.9 | Confident | 117 Ų | 117 | 103 Ų | 103 | 76% | 0.76 | 53% | 0.525 | S | S | * | . | P | Polyproline II helix | trans | -60.6 | 134.7 | -179.3 | 24.8 | -32.7 | 0 | 0 | 0 | 110 | T75 | P73-T75 PolarHBondContact O-N 3.3Š|
| 74 | L | 83.7 | Confident | 83.5 | Confident | 57 Ų | 57 | 96.9 Ų | 96.9 | 30% | 0.298 | 50% | 0.497 | S | S | . | . | P | Polyproline II helix | trans | -69 | 117.3 | 173.3 | -72.3 | 155.7 | 0 | 0 | 0 | 107.9 | P72 I79 F126 K152 V154 | P72-L74 PolarHBondContact O-N 3.49Å; L74-I79 HydrophobicContact CB-CD1 4.44Å; L74-I79 HydrophobicContact CB-CG1 4.35Å; L74-I79 HydrophobicContact CD2-CG1 4.49Å; L74-F126 HydrophobicContact CD2-CE1 4.42Å; L74-K152 HydrophobicContact CD1-CD 4.39Å; L74-K152 HydrophobicContact CD1-CG 4.39Å; L74-V154 HydrophobicContact CB-CG2 4.33Å; L74-V154 WeakPolarHBondContact O-CG1 3.38Å; L74-V154 WeakPolarHBondContact O-CG2 3.5Å |
| 75 | T | 92.7 | Very high | 85.2 | Confident | 76 Ų | 76 | 96 Ų | 96 | 47% | 0.466 | 48% | 0.484 | S | S | . | . | P | Polyproline II helix | trans | -90.5 | 158.1 | 169.6 | 58.8 | 0 | 0 | 0 | 0 | 109.7 | P73 E77 G78 I79 | P73-T75 PolarHBondContact O-N 3.3Å; T75-E77 VanDerWaalsContact C-N 3.3Å; T75-E77 PolarHBondContact O-N 3.21Å; T75-G78 WeakPolarHBondContact O-CA 3.46Å; T75-G78 PolarHBondContact O-N 3.3Å; T75-G78 PolarHBondContact OG1-N 3.42Å; T75-G78 VanDerWaalsContact OG1-N 3.13Å; T75-I79 WeakPolarHBondContact O-CG1 3.38Å; T75-I79 PolarHBondContact O-N 3.37Å |
| 76 | L | 91.5 | Very high | 86.5 | Confident | 41 Ų | 41 | 93.1 Ų | 93.1 | 22% | 0.215 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -58.4 | -42.8 | 175.7 | -68.7 | -165.7 | 0 | 0 | 0 | 112.3 | G78 I79 R80 A149 V154 E156 | L76-G78 VanDerWaalsContact C-N 3.29Å; L76-G78 PolarHBondContact O-N 3.1Å; L76-I79 HydrophobicContact CD2-CD1 4.29Å; L76-I79 PolarHBondContact O-N 3.44Å; L76-R80 WeakPolarHBondContact O-CB 3.39Å; L76-R80 PolarHBondContact O-N 2.95Å; L76-A149 HydrophobicContact CD2-CB 3.44Å; L76-A149 VanDerWaalsContact CD2-CB 3.44Å; L76-V154 HydrophobicContact CD2-CB 4.07Å; L76-V154 HydrophobicContact CD2-CG1 3.63Å; L76-V154 WeakPolarHBondContact CD2-O 3.42Å; L76-V154 HydrophobicContact CG-CG1 4.03Å; L76-E156 HydrophobicContact CD1-CB 4.45Å; L76-E156 HydrophobicContact CD1-CG 3.25Å; L76-E156 HydrophobicContact CG-CG 4.17Å |
| 77 | E | 92.7 | Very high | 87.7 | Confident | 142 Ų | 142 | 84.1 Ų | 84.1 | 66% | 0.664 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -56.8 | -44.4 | 173.1 | -63.8 | -178.7 | 164.8 | 0 | 0 | 111.2 | T75 I79 R80 D81 | T75-E77 VanDerWaalsContact C-N 3.3Å; T75-E77 PolarHBondContact O-N 3.21Å; E77-I79 PolarHBondContact O-N 3.42Å; E77-R80 PolarHBondContact O-N 3.07Å; E77-D81 WeakPolarHBondContact O-CB 3.33Å; E77-D81 VanDerWaalsContact O-CG 3.3Å; E77-D81 PolarHBondContact O-N 3.05Å |
| 78 | G | 93 | Very high | 89 | Confident | 23 Ų | 23 | 81.8 Ų | 81.8 | 24% | 0.237 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -65.3 | -36 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | T75 L76 R82 | T75-G78 WeakPolarHBondContact O-CA 3.46Å; T75-G78 PolarHBondContact O-N 3.3Å; T75-G78 PolarHBondContact OG1-N 3.42Å; T75-G78 VanDerWaalsContact OG1-N 3.13Å; L76-G78 VanDerWaalsContact C-N 3.29Å; L76-G78 PolarHBondContact O-N 3.1Å; G78-R82 WeakPolarHBondContact O-CB 3.21Å; G78-R82 WeakPolarHBondContact O-CG 3.24Å; G78-R82 PolarHBondContact O-N 3.32Å; G78-R82 VanDerWaalsContact O-N 3.11Å |
| 79 | I | 94 | Very high | 90 | Very high | 0 Ų | 0 | 78.3 Ų | 78.3 | 0% | 0 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -66 | -50.2 | 173.9 | -65.9 | 163.7 | 0 | 0 | 0 | 109.5 | L74 T75 L76 E77 D81 R82 V83 F126 V145 I148 V154 | L74-I79 HydrophobicContact CB-CD1 4.44Å; L74-I79 HydrophobicContact CB-CG1 4.35Å; L74-I79 HydrophobicContact CD2-CG1 4.49Å; T75-I79 WeakPolarHBondContact O-CG1 3.38Å; T75-I79 PolarHBondContact O-N 3.37Å; L76-I79 HydrophobicContact CD2-CD1 4.29Å; L76-I79 PolarHBondContact O-N 3.44Å; E77-I79 PolarHBondContact O-N 3.42Å; I79-D81 VanDerWaalsContact C-N 3.34Å; I79-D81 PolarHBondContact O-N 3.36Å; I79-R82 PolarHBondContact O-N 3.21Å; I79-V83 HydrophobicContact CG2-CG2 4.26Å; I79-V83 WeakPolarHBondContact O-CG2 3.41Å; I79-V83 PolarHBondContact O-N 2.72Å; I79-F126 HydrophobicContact CG1-CE1 4.24Å; I79-F126 HydrophobicContact CG2-CE1 4.28Å; I79-F126 HydrophobicContact CG2-CZ 4.12Å; I79-V145 HydrophobicContact CG2-CG1 4.08Å; I79-I148 HydrophobicContact CD1-CG2 4.09Å; I79-I148 HydrophobicContact CG1-CG2 4.21Å; I79-I148 HydrophobicContact CG2-CB 3.88Å; I79-I148 HydrophobicContact CG2-CD1 4.11Å; I79-I148 HydrophobicContact CG2-CG2 3.67Å; I79-V154 HydrophobicContact CD1-CB 4.23Å; I79-V154 HydrophobicContact CD1-CG1 4.37Å; I79-V154 HydrophobicContact CD1-CG2 4.31Å |
| 80 | R | 94.4 | Very high | 90.6 | Very high | 112 Ų | 112 | 75.1 Ų | 75.1 | 42% | 0.423 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -56.1 | -48.1 | 179 | -176.3 | -178.1 | -177.8 | 164.4 | 7.7 | 111.8 | L76 E77 R82 V83 L84 V145 | L76-R80 WeakPolarHBondContact O-CB 3.39Å; L76-R80 PolarHBondContact O-N 2.95Å; E77-R80 PolarHBondContact O-N 3.07Å; R80-R82 VanDerWaalsContact C-N 3.33Å; R80-R82 PolarHBondContact O-N 2.98Å; R80-V83 PolarHBondContact O-N 3.43Å; R80-L84 HydrophobicContact CG-CD1 4.2Å; R80-L84 WeakPolarHBondContact O-CB 3.43Å; R80-L84 WeakPolarHBondContact O-CG 3.38Å; R80-L84 PolarHBondContact O-N 3.16Å; R80-V145 HydrophobicContact CB-CG1 4.32Å; R80-V145 HydrophobicContact CB-CG2 4.29Å; R80-V145 HydrophobicContact CG-CG2 4.49Å |
| 81 | D | 94.8 | Very high | 91.3 | Very high | 108 Ų | 108 | 78 Ų | 78 | 58% | 0.578 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -62.8 | -40.9 | 179.6 | -75.2 | -15.8 | 0 | 0 | 0 | 111.7 | E77 I79 Y85 | E77-D81 WeakPolarHBondContact O-CB 3.33Å; E77-D81 VanDerWaalsContact O-CG 3.3Å; E77-D81 PolarHBondContact O-N 3.05Å; I79-D81 VanDerWaalsContact C-N 3.34Å; I79-D81 PolarHBondContact O-N 3.36Å; D81-Y85 VanDerWaalsContact O-CB 3.24Å; D81-Y85 WeakPolarHBondContact O-CB 3.49Å; D81-Y85 PolarHBondContact O-N 3.29Å |
| 82 | R | 94.4 | Very high | 92 | Very high | 76 Ų | 76 | 75.3 Ų | 75.3 | 29% | 0.287 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -67.2 | -43.9 | 176.6 | -74.1 | 177.9 | 75.2 | -162.4 | 5.8 | 112.5 | G78 I79 R80 L84 Y85 V86 E125 F126 | G78-R82 WeakPolarHBondContact O-CB 3.21Å; G78-R82 WeakPolarHBondContact O-CG 3.24Å; G78-R82 PolarHBondContact O-N 3.32Å; G78-R82 VanDerWaalsContact O-N 3.11Å; I79-R82 PolarHBondContact O-N 3.21Å; R80-R82 VanDerWaalsContact C-N 3.33Å; R80-R82 PolarHBondContact O-N 2.98Å; R82-L84 PolarHBondContact O-N 3.05Å; R82-Y85 WeakPolarHBondContact O-CB 3.45Å; R82-Y85 PolarHBondContact O-N 2.59Å; R82-Y85 VanDerWaalsContact O-N 3.16Å; R82-V86 WeakPolarHBondContact O-CG2 3.5Å; R82-V86 PolarHBondContact O-N 3.3Å; R82-E125 IonicContact CZ-OE1 2.59Å; R82-E125 IonicContact NE-OE1 3.15Å; R82-E125 PolarHBondContact NE-OE1 3.34Å; R82-E125 PolarHBondContact NH2-O 3.04Å; R82-E125 IonicContact NH2-OE1 2.83Å; R82-E125 PolarHBondContact NH2-OE1 3.41Å; R82-E125 IonicContact NH2-OE2 2.64Å; R82-F126 HydrophobicContact CB-CZ 3.86Å |
| 83 | V | 95.2 | Very high | 92.7 | Very high | 0 Ų | 0 | 70.8 Ų | 70.8 | 0% | 0 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -59.7 | -48.4 | 176.2 | 169.8 | 0 | 0 | 0 | 0 | 110.2 | I79 R80 Y85 V86 L87 M122 F126 P141 I144 V145 I148 | I79-V83 HydrophobicContact CG2-CG2 4.26Å; I79-V83 WeakPolarHBondContact O-CG2 3.41Å; I79-V83 PolarHBondContact O-N 2.72Å; R80-V83 PolarHBondContact O-N 3.43Å; V83-Y85 VanDerWaalsContact C-N 3.27Å; V83-Y85 PolarHBondContact O-N 3.24Å; V83-V86 PolarHBondContact O-N 2.89Å; V83-L87 HydrophobicContact CG1-CD1 4.09Å; V83-L87 WeakPolarHBondContact O-CG 3.49Å; V83-L87 PolarHBondContact O-N 3.2Å; V83-M122 HydrophobicContact CB-CE 4.36Å; V83-M122 HydrophobicContact CB-SD 4.4Å; V83-M122 HydrophobicContact CG1-CE 3.82Å; V83-M122 HydrophobicContact CG1-SD 4.29Å; V83-M122 HydrophobicContact CG2-SD 4.08Å; V83-F126 HydrophobicContact CG2-CE2 4.06Å; V83-F126 HydrophobicContact CG2-CZ 4.18Å; V83-P141 HydrophobicContact CG1-CB 4.46Å; V83-I144 HydrophobicContact CG1-CB 4.47Å; V83-I144 HydrophobicContact CG1-CG2 4.21Å; V83-I144 HydrophobicContact CG2-CG2 4.14Å; V83-V145 HydrophobicContact CB-CG2 3.94Å; V83-V145 HydrophobicContact CG1-CG2 4.07Å; V83-V145 HydrophobicContact CG2-CG2 3.9Å; V83-I148 HydrophobicContact CG2-CD1 3.59Å |
| 84 | L | 94.9 | Very high | 93.3 | Very high | 24 Ų | 24 | 69.2 Ų | 69.2 | 13% | 0.126 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -63.9 | -34.4 | 177 | -68.4 | 175.7 | 0 | 0 | 0 | 112.3 | R80 R82 K88 L98 V100 | R80-L84 HydrophobicContact CG-CD1 4.2Å; R80-L84 WeakPolarHBondContact O-CB 3.43Å; R80-L84 WeakPolarHBondContact O-CG 3.38Å; R80-L84 PolarHBondContact O-N 3.16Å; R82-L84 PolarHBondContact O-N 3.05Å; L84-K88 WeakPolarHBondContact O-CG 3.43Å; L84-K88 PolarHBondContact O-N 3.05Å; L84-L98 HydrophobicContact CD2-CD2 3.8Å; L84-L98 HydrophobicContact CD2-CG 4.25Å; L84-V100 HydrophobicContact CD1-CG2 3.94Å; L84-V100 HydrophobicContact CD2-CG2 4.12Å |
| 85 | Y | 94.8 | Very high | 93.6 | Very high | 141 Ų | 141 | 70 Ų | 70 | 55% | 0.553 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -63.9 | -48.4 | 175.8 | 178.9 | -102.3 | 0 | 0 | 0 | 111.7 | D81 R82 V83 L87 K88 L89 | D81-Y85 VanDerWaalsContact O-CB 3.24Å; D81-Y85 WeakPolarHBondContact O-CB 3.49Å; D81-Y85 PolarHBondContact O-N 3.29Å; R82-Y85 WeakPolarHBondContact O-CB 3.45Å; R82-Y85 PolarHBondContact O-N 2.59Å; R82-Y85 VanDerWaalsContact O-N 3.16Å; V83-Y85 VanDerWaalsContact C-N 3.27Å; V83-Y85 PolarHBondContact O-N 3.24Å; Y85-L87 VanDerWaalsContact C-N 3.33Å; Y85-L87 PolarHBondContact O-N 3.13Å; Y85-K88 PolarHBondContact O-N 3.4Å; Y85-L89 HydrophobicContact CD1-CD1 4.16Å; Y85-L89 HydrophobicContact CE1-CD1 3.59Å; Y85-L89 HydrophobicContact CE1-CG 4.38Å; Y85-L89 PolarHBondContact O-N 3.06Å |
| 86 | V | 95.3 | Very high | 93.6 | Very high | 22 Ų | 22 | 75.6 Ų | 75.6 | 13% | 0.133 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -59.6 | -44.1 | 177 | 174.3 | 0 | 0 | 0 | 0 | 110.9 | R82 V83 K88 L89 A121 M122 E125 | R82-V86 WeakPolarHBondContact O-CG2 3.5Å; R82-V86 PolarHBondContact O-N 3.3Å; V83-V86 PolarHBondContact O-N 2.89Å; V86-K88 VanDerWaalsContact C-N 3.31Å; V86-K88 PolarHBondContact O-N 2.91Å; V86-L89 WeakPolarHBondContact O-CB 3.03Å; V86-L89 PolarHBondContact O-N 2.87Å; V86-L89 VanDerWaalsContact O-N 3.1Å; V86-A121 HydrophobicContact CG1-CB 3.98Å; V86-M122 HydrophobicContact CB-CE 3.73Å; V86-M122 HydrophobicContact CB-SD 4.15Å; V86-M122 HydrophobicContact CG1-CE 3.69Å; V86-M122 HydrophobicContact CG1-SD 4.12Å; V86-M122 HydrophobicContact CG2-SD 4.48Å; V86-E125 HydrophobicContact CG2-CB 4.29Å; V86-E125 HydrophobicContact CG2-CG 3.93Å |
| 87 | L | 94.4 | Very high | 93.5 | Very high | 1 Ų | 1 | 80.1 Ų | 80.1 | 1% | 0.005 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63.9 | -33.8 | 178.5 | -69.5 | 172.2 | 0 | 0 | 0 | 113.3 | V83 Y85 L89 Y90 I93 L98 F104 I118 M122 P141 | V83-L87 HydrophobicContact CG1-CD1 4.09Å; V83-L87 WeakPolarHBondContact O-CG 3.49Å; V83-L87 PolarHBondContact O-N 3.2Å; Y85-L87 VanDerWaalsContact C-N 3.33Å; Y85-L87 PolarHBondContact O-N 3.13Å; L87-L89 VanDerWaalsContact C-N 3.25Å; L87-L89 PolarHBondContact O-N 3.19Å; L87-Y90 PolarHBondContact O-N 3.11Å; L87-I93 HydrophobicContact CB-CD1 4.4Å; L87-I93 HydrophobicContact CD2-CD1 4.02Å; L87-L98 HydrophobicContact CB-CD1 3.96Å; L87-L98 HydrophobicContact CB-CD2 3.9Å; L87-L98 HydrophobicContact CD1-CD1 4.01Å; L87-F104 HydrophobicContact CD1-CE1 4.13Å; L87-F104 HydrophobicContact CD1-CZ 4.3Å; L87-F104 HydrophobicContact CD2-CE1 3.84Å; L87-F104 HydrophobicContact CD2-CZ 4.19Å; L87-I118 HydrophobicContact CD2-CD1 4.12Å; L87-I118 HydrophobicContact CD2-CG1 4.3Å; L87-I118 HydrophobicContact CD2-CG2 3.58Å; L87-M122 HydrophobicContact CD1-CE 4.46Å; L87-M122 HydrophobicContact CD2-CE 4.03Å; L87-M122 HydrophobicContact CG-CE 3.79Å; L87-P141 HydrophobicContact CD1-CB 3.69Å; L87-P141 HydrophobicContact CD1-CG 3.62Å |
| 88 | K | 94.4 | Very high | 93.5 | Very high | 110 Ų | 110 | 74.4 Ų | 74.4 | 48% | 0.478 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -70 | -21.1 | 175.4 | -73.5 | 170.1 | -176.1 | 174.8 | 0 | 113.5 | L84 Y85 V86 Y90 P95 L98 | L84-K88 WeakPolarHBondContact O-CG 3.43Å; L84-K88 PolarHBondContact O-N 3.05Å; Y85-K88 PolarHBondContact O-N 3.4Å; V86-K88 VanDerWaalsContact C-N 3.31Å; V86-K88 PolarHBondContact O-N 2.91Å; K88-Y90 VanDerWaalsContact C-N 3.3Å; K88-P95 HydrophobicContact CG-CB 4Å; K88-L98 HydrophobicContact CG-CD2 3.83Å |
| 89 | L | 93.5 | Very high | 93.5 | Very high | 107 Ų | 107 | 76.2 Ų | 76.2 | 56% | 0.56 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.2 | -9.8 | 176.6 | -66.3 | 178 | 0 | 0 | 0 | 112.8 | Y85 V86 L87 D91 | Y85-L89 HydrophobicContact CD1-CD1 4.16Å; Y85-L89 HydrophobicContact CE1-CD1 3.59Å; Y85-L89 HydrophobicContact CE1-CG 4.38Å; Y85-L89 PolarHBondContact O-N 3.06Å; V86-L89 WeakPolarHBondContact O-CB 3.03Å; V86-L89 PolarHBondContact O-N 2.87Å; V86-L89 VanDerWaalsContact O-N 3.1Å; L87-L89 VanDerWaalsContact C-N 3.25Å; L87-L89 PolarHBondContact O-N 3.19Å; L89-D91 PolarHBondContact O-N 3.28Å |
| 90 | Y | 93.9 | Very high | 93.5 | Very high | 42 Ų | 42 | 76.9 Ų | 76.9 | 17% | 0.165 | 37% | 0.37 | C | S | . | . | S | Bend | trans | -81.6 | 115.7 | 179.8 | -164.8 | -106.3 | 0 | 0 | 0 | 110.2 | L87 K88 K92 I93 L110 D114 E117 I118 | L87-Y90 PolarHBondContact O-N 3.11Å; K88-Y90 VanDerWaalsContact C-N 3.3Å; Y90-K92 HydrophobicContact CD1-CB 3.95Å; Y90-K92 HydrophobicContact CE1-CB 3.72Å; Y90-K92 HydrophobicContact CE1-CD 3.88Å; Y90-K92 HydrophobicContact CE1-CG 3.97Å; Y90-K92 PolarHBondContact O-N 2.94Å; Y90-I93 HydrophobicContact CD1-CD1 3.93Å; Y90-I93 HydrophobicContact CD1-CG1 3.94Å; Y90-I93 HydrophobicContact CG-CD1 4.38Å; Y90-I93 PolarHBondContact O-N 3.32Å; Y90-L110 HydrophobicContact CE1-CD2 4.36Å; Y90-D114 HydrophobicContact CE1-CB 4.23Å; Y90-D114 WeakPolarHBondContact OH-CB 3.31Å; Y90-D114 PolarHBondContact OH-OD1 2.93Å; Y90-E117 HydrophobicContact CE2-CB 4.24Å; Y90-E117 WeakPolarHBondContact CE2-OE2 3.47Å; Y90-E117 PolarHBondContact OH-OE2 2.88Å; Y90-I118 HydrophobicContact CD1-CD1 4.45Å; Y90-I118 HydrophobicContact CD2-CG1 4.43Å; Y90-I118 HydrophobicContact CE1-CD1 4.48Å; Y90-I118 HydrophobicContact CG-CG1 4.45Å |
| 91 | D | 92.9 | Very high | 93.4 | Very high | 167 Ų | 167 | 77.1 Ų | 77.1 | 89% | 0.893 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.6 | -22.9 | -169.4 | -70.4 | -25.3 | 0 | 0 | 0 | 115 | L89 | L89-D91 PolarHBondContact O-N 3.28Š|
| 92 | K | 92.1 | Very high | 93.4 | Very high | 114 Ų | 114 | 72.3 Ų | 72.3 | 50% | 0.496 | 36% | 0.355 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | -10.9 | 179.7 | -58.6 | -178 | 178.5 | 177.7 | 0 | 113.6 | Y90 L110 D114 | Y90-K92 HydrophobicContact CD1-CB 3.95Å; Y90-K92 HydrophobicContact CE1-CB 3.72Å; Y90-K92 HydrophobicContact CE1-CD 3.88Å; Y90-K92 HydrophobicContact CE1-CG 3.97Å; Y90-K92 PolarHBondContact O-N 2.94Å; K92-L110 HydrophobicContact CB-CD2 3.95Å; K92-D114 VanDerWaalsContact CD-OD2 3.31Å; K92-D114 WeakPolarHBondContact CD-OD2 3.46Å; K92-D114 IonicContact NZ-OD1 3.05Å; K92-D114 PolarHBondContact NZ-OD1 3.48Å; K92-D114 IonicContact NZ-OD2 3.99Å; K92-D114 PolarHBondContact NZ-OD2 2.94Å |
| 93 | I | 93.3 | Very high | 93.4 | Very high | 7 Ų | 7 | 70.4 Ų | 70.4 | 4% | 0.036 | 35% | 0.349 | C | S | . | . | S | Bend | trans | -100.5 | 125.5 | -178.9 | -67.2 | 169.4 | 0 | 0 | 0 | 109.6 | L87 Y90 L98 L108 L110 I118 | L87-I93 HydrophobicContact CB-CD1 4.4Å; L87-I93 HydrophobicContact CD2-CD1 4.02Å; Y90-I93 HydrophobicContact CD1-CD1 3.93Å; Y90-I93 HydrophobicContact CD1-CG1 3.94Å; Y90-I93 HydrophobicContact CG-CD1 4.38Å; Y90-I93 PolarHBondContact O-N 3.32Å; I93-L98 HydrophobicContact CG2-CB 4.26Å; I93-L98 HydrophobicContact CG2-CD1 3.96Å; I93-L108 HydrophobicContact CD1-CD1 4.46Å; I93-L108 HydrophobicContact CG1-CD1 4.38Å; I93-L108 HydrophobicContact CG2-CD1 4.37Å; I93-L110 HydrophobicContact CD1-CD1 3.9Å; I93-L110 HydrophobicContact CG1-CD1 3.93Å; I93-L110 HydrophobicContact CG1-CD2 4.12Å; I93-I118 HydrophobicContact CD1-CD1 4.06Å |
| 94 | D | 92.9 | Very high | 93.3 | Very high | 83 Ų | 83 | 70.5 Ų | 70.5 | 44% | 0.444 | 35% | 0.35 | S | S | . | . | trans | -76.5 | 120.6 | 169.7 | -67.2 | -38.2 | 0 | 0 | 0 | 109.8 | E96 K97 L98 | D94-E96 PolarHBondContact O-N 3.13Å; D94-E96 VanDerWaalsContact O-N 3.12Å; D94-K97 HydrophobicContact CB-CB 4.22Å; D94-K97 HydrophobicContact CB-CD 4.06Å; D94-K97 HydrophobicContact CB-CG 4.1Å; D94-K97 PolarHBondContact O-N 3.04Å; D94-K97 WeakPolarHBondContact OD2-CE 3.38Å; D94-K97 IonicContact OD2-NZ 2.72Å; D94-K97 PolarHBondContact OD2-NZ 3.35Å; D94-L98 PolarHBondContact O-N 2.93Å | ||
| 95 | P | 91.1 | Very high | 93.2 | Very high | 75 Ų | 75 | 72.7 Ų | 72.7 | 49% | 0.487 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -20.9 | -175.8 | 27.4 | -36.2 | 0 | 0 | 0 | 113.3 | K88 | K88-P95 HydrophobicContact CG-CB 4Š|
| 96 | E | 91.6 | Very high | 93.2 | Very high | 192 Ų | 192 | 73.7 Ų | 73.7 | 90% | 0.897 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.4 | -24.2 | 177 | -62.1 | -172.4 | 173.3 | 0 | 0 | 113 | D94 | D94-E96 PolarHBondContact O-N 3.13Å; D94-E96 VanDerWaalsContact O-N 3.12Å |
| 97 | K | 89.5 | Confident | 93.1 | Very high | 136 Ų | 136 | 77.6 Ų | 77.6 | 59% | 0.591 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.2 | -15.3 | 177.7 | -64.4 | 179.8 | -173 | 153.5 | 0 | 112.6 | D94 S99 L108 | D94-K97 HydrophobicContact CB-CB 4.22Å; D94-K97 HydrophobicContact CB-CD 4.06Å; D94-K97 HydrophobicContact CB-CG 4.1Å; D94-K97 PolarHBondContact O-N 3.04Å; D94-K97 WeakPolarHBondContact OD2-CE 3.38Å; D94-K97 IonicContact OD2-NZ 2.72Å; D94-K97 PolarHBondContact OD2-NZ 3.35Å; K97-S99 PolarHBondContact O-N 2.97Å; K97-L108 HydrophobicContact CB-CD2 4.21Å |
| 98 | L | 93.1 | Very high | 93 | Very high | 23 Ų | 23 | 79 Ų | 79 | 12% | 0.12 | 40% | 0.395 | C | S | . | . | trans | -66.9 | 115.1 | 179.2 | -175 | 79.2 | 0 | 0 | 0 | 110.3 | L84 L87 K88 I93 D94 L108 | L84-L98 HydrophobicContact CD2-CD2 3.8Å; L84-L98 HydrophobicContact CD2-CG 4.25Å; L87-L98 HydrophobicContact CB-CD1 3.96Å; L87-L98 HydrophobicContact CB-CD2 3.9Å; L87-L98 HydrophobicContact CD1-CD1 4.01Å; K88-L98 HydrophobicContact CG-CD2 3.83Å; I93-L98 HydrophobicContact CG2-CB 4.26Å; I93-L98 HydrophobicContact CG2-CD1 3.96Å; D94-L98 PolarHBondContact O-N 2.93Å; L98-L108 HydrophobicContact CD1-CD1 4.09Å | ||
| 99 | S | 93.5 | Very high | 93 | Very high | 61 Ų | 61 | 76.5 Ų | 76.5 | 43% | 0.427 | 40% | 0.4 | S | S | . | . | trans | -114.1 | 166.1 | 167.5 | -172.7 | 0 | 0 | 0 | 0 | 109.3 | K97 D101 S102 | K97-S99 PolarHBondContact O-N 2.97Å; S99-D101 VanDerWaalsContact C-N 3.27Å; S99-S102 PolarHBondContact N-OG 3.25Å; S99-S102 PolarHBondContact O-N 2.63Å; S99-S102 PolarHBondContact O-OG 3.24Å | ||
| 100 | V | 92.8 | Very high | 93 | Very high | 13 Ų | 13 | 71.9 Ų | 71.9 | 8% | 0.079 | 38% | 0.376 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.8 | -28.9 | 178.3 | -162.6 | 0 | 0 | 0 | 0 | 110.9 | L84 P141 Q142 | L84-V100 HydrophobicContact CD1-CG2 3.94Å; L84-V100 HydrophobicContact CD2-CG2 4.12Å; V100-P141 WeakPolarHBondContact O-CB 3.48Å; V100-P141 WeakPolarHBondContact O-CD 3.38Å; V100-Q142 HydrophobicContact CG1-CB 4.1Å; V100-Q142 WeakPolarHBondContact O-CB 3.43Å; V100-Q142 PolarHBondContact O-N 3.1Å |
| 101 | D | 93.9 | Very high | 93 | Very high | 117 Ų | 117 | 75 Ų | 75 | 63% | 0.626 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.2 | 5 | 179.1 | -50.1 | -46.8 | 0 | 0 | 0 | 113.1 | S99 | S99-D101 VanDerWaalsContact C-N 3.27Š|
| 102 | S | 94 | Very high | 93 | Very high | 8 Ų | 8 | 70.7 Ų | 70.7 | 6% | 0.056 | 38% | 0.379 | C | S | . | . | trans | -73.9 | 134.6 | -178.2 | 59.9 | 0 | 0 | 0 | 0 | 111.3 | S99 P141 | S99-S102 PolarHBondContact N-OG 3.25Å; S99-S102 PolarHBondContact O-N 2.63Å; S99-S102 PolarHBondContact O-OG 3.24Å; S102-P141 WeakPolarHBondContact O-CD 3.2Å | ||
| 103 | H | 94.8 | Very high | 93.1 | Very high | 35 Ų | 35 | 71.2 Ų | 71.2 | 16% | 0.162 | 39% | 0.386 | C | S | . | . | trans | -84.7 | 128.8 | 178.6 | -168.8 | -36 | 0 | 0 | 0 | 111 | M105 K106 D107 L108 | H103-M105 PolarHBondContact ND1-N 3.15Å; H103-M105 PolarHBondContact O-N 3.49Å; H103-K106 HydrophobicContact CB-CB 4.2Å; H103-K106 PolarHBondContact O-N 3.18Å; H103-D107 PolarHBondContact N-OD2 3.2Å; H103-D107 WeakPolarHBondContact O-CB 3.35Å; H103-D107 PolarHBondContact O-N 3.44Å; H103-L108 PolarHBondContact O-N 3.41Å | ||
| 104 | F | 93.5 | Very high | 93.2 | Very high | 2 Ų | 2 | 71.3 Ų | 71.3 | 1% | 0.009 | 39% | 0.387 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.4 | -46.9 | -174.7 | -65.5 | -51.3 | 0 | 0 | 0 | 113.9 | L87 L108 G109 L110 I118 M139 P141 I144 | L87-F104 HydrophobicContact CD1-CE1 4.13Å; L87-F104 HydrophobicContact CD1-CZ 4.3Å; L87-F104 HydrophobicContact CD2-CE1 3.84Å; L87-F104 HydrophobicContact CD2-CZ 4.19Å; F104-L108 HydrophobicContact CD1-CD1 4.02Å; F104-L108 CarbonylContact O-C 3.59Å; F104-L108 WeakPolarHBondContact O-CB 3.42Å; F104-G109 PolarHBondContact O-N 3.08Å; F104-L110 HydrophobicContact CB-CD1 4.12Å; F104-L110 HydrophobicContact CD1-CD1 4.01Å; F104-L110 HydrophobicContact CG-CD1 4.42Å; F104-L110 WeakPolarHBondContact O-CB 3.39Å; F104-L110 PolarHBondContact O-N 3.42Å; F104-I118 HydrophobicContact CD1-CD1 4.46Å; F104-M139 WeakPolarHBondContact CD2-O 3.37Å; F104-M139 WeakPolarHBondContact CG-O 3.46Å; F104-M139 PolarHBondContact N-O 3.21Å; F104-P141 HydrophobicContact CE1-CG 3.81Å; F104-P141 HydrophobicContact CZ-CB 4.5Å; F104-P141 HydrophobicContact CZ-CG 3.81Å; F104-I144 HydrophobicContact CE2-CD1 3.8Å; F104-I144 HydrophobicContact CZ-CD1 3.76Å |
| 105 | M | 92.9 | Very high | 93.1 | Very high | 71 Ų | 71 | 68.1 Ų | 68.1 | 35% | 0.35 | 37% | 0.369 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.2 | -41.1 | -178.8 | -61.6 | -179.1 | -177.5 | 0 | 0 | 113.6 | H103 G109 Q115 M139 | H103-M105 PolarHBondContact ND1-N 3.15Å; H103-M105 PolarHBondContact O-N 3.49Å; M105-G109 WeakPolarHBondContact O-CA 3.4Å; M105-G109 PolarHBondContact O-N 3.31Å; M105-Q115 VanDerWaalsContact CE-OE1 3.25Å; M105-M139 HydrophobicContact CE-CE 4.15Å; M105-M139 HydrophobicContact CE-SD 4.25Å; M105-M139 HydrophobicContact SD-CE 4.47Å |
| 106 | K | 93.4 | Very high | 93.2 | Very high | 162 Ų | 162 | 68.4 Ų | 68.4 | 70% | 0.704 | 37% | 0.369 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.4 | -38.9 | -169.9 | -61.8 | 178.9 | -173 | 165.8 | 0 | 113.1 | H103 | H103-K106 HydrophobicContact CB-CB 4.2Å; H103-K106 PolarHBondContact O-N 3.18Å |
| 107 | D | 93.4 | Very high | 93.3 | Very high | 104 Ų | 104 | 63.5 Ų | 63.5 | 56% | 0.556 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.5 | -42.2 | -172.3 | -57.9 | -35.1 | 0 | 0 | 0 | 111.6 | H103 | H103-D107 PolarHBondContact N-OD2 3.2Å; H103-D107 WeakPolarHBondContact O-CB 3.35Å; H103-D107 PolarHBondContact O-N 3.44Å |
| 108 | L | 93.4 | Very high | 93.6 | Very high | 30 Ų | 30 | 57.3 Ų | 57.3 | 16% | 0.157 | 32% | 0.32 | C | S | . | . | S | Bend | trans | -91.1 | -14.9 | -180 | -56.9 | 176.9 | 0 | 0 | 0 | 112.8 | I93 K97 L98 H103 F104 L110 | I93-L108 HydrophobicContact CD1-CD1 4.46Å; I93-L108 HydrophobicContact CG1-CD1 4.38Å; I93-L108 HydrophobicContact CG2-CD1 4.37Å; K97-L108 HydrophobicContact CB-CD2 4.21Å; L98-L108 HydrophobicContact CD1-CD1 4.09Å; H103-L108 PolarHBondContact O-N 3.41Å; F104-L108 HydrophobicContact CD1-CD1 4.02Å; F104-L108 CarbonylContact O-C 3.59Å; F104-L108 WeakPolarHBondContact O-CB 3.42Å; L108-L110 VanDerWaalsContact C-N 3.34Å; L108-L110 HydrophobicContact CB-CD1 4.41Å; L108-L110 HydrophobicContact CB-CG 4.07Å |
| 109 | G | 92.8 | Very high | 93.7 | Very high | 57 Ų | 57 | 56.5 Ų | 56.5 | 59% | 0.588 | 32% | 0.316 | S | S | * | . | trans | 68.7 | 30.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | F104 M105 | F104-G109 PolarHBondContact O-N 3.08Å; M105-G109 WeakPolarHBondContact O-CA 3.4Å; M105-G109 PolarHBondContact O-N 3.31Å | ||
| 110 | L | 94.9 | Very high | 93.7 | Very high | 10 Ų | 10 | 58.1 Ų | 58.1 | 5% | 0.052 | 32% | 0.318 | C | S | . | . | trans | -80.4 | 150.2 | 177.5 | -59.8 | -180 | 0 | 0 | 0 | 111.6 | Y90 K92 I93 F104 L108 D114 I118 | Y90-L110 HydrophobicContact CE1-CD2 4.36Å; K92-L110 HydrophobicContact CB-CD2 3.95Å; I93-L110 HydrophobicContact CD1-CD1 3.9Å; I93-L110 HydrophobicContact CG1-CD1 3.93Å; I93-L110 HydrophobicContact CG1-CD2 4.12Å; F104-L110 HydrophobicContact CB-CD1 4.12Å; F104-L110 HydrophobicContact CD1-CD1 4.01Å; F104-L110 HydrophobicContact CG-CD1 4.42Å; F104-L110 WeakPolarHBondContact O-CB 3.39Å; F104-L110 PolarHBondContact O-N 3.42Å; L108-L110 VanDerWaalsContact C-N 3.34Å; L108-L110 HydrophobicContact CB-CD1 4.41Å; L108-L110 HydrophobicContact CB-CG 4.07Å; L110-D114 HydrophobicContact CB-CB 4.06Å; L110-D114 HydrophobicContact CD2-CB 4.49Å; L110-I118 HydrophobicContact CD1-CD1 3.63Å | ||
| 111 | D | 94.4 | Very high | 93.8 | Very high | 108 Ų | 108 | 59.5 Ų | 59.5 | 58% | 0.578 | 33% | 0.33 | S | S | * | . | trans | -84 | 165.6 | 176.2 | -70 | -23 | 0 | 0 | 0 | 111.7 | L113 D114 Q115 | D111-L113 PolarHBondContact O-N 3.07Å; D111-D114 PolarHBondContact N-OD2 2.88Å; D111-D114 WeakPolarHBondContact O-CB 3.48Å; D111-D114 PolarHBondContact O-N 3.4Å; D111-Q115 PolarHBondContact O-N 2.64Å | ||
| 112 | S | 92.7 | Very high | 93.9 | Very high | 77 Ų | 77 | 53.9 Ų | 53.9 | 54% | 0.538 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -63.1 | -26.2 | 177.6 | 60.5 | 0 | 0 | 0 | 0 | 113.6 | ||
| 113 | L | 93.4 | Very high | 93.9 | Very high | 125 Ų | 125 | 55.3 Ų | 55.3 | 65% | 0.654 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -72.9 | -35.9 | 173.8 | -65.5 | 179.7 | 0 | 0 | 0 | 111.5 | D111 Q115 V116 E117 | D111-L113 PolarHBondContact O-N 3.07Å; L113-Q115 VanDerWaalsContact C-N 3.28Å; L113-Q115 PolarHBondContact O-N 2.78Å; L113-V116 PolarHBondContact O-N 3.03Å; L113-V116 VanDerWaalsContact O-N 3.15Å; L113-E117 PolarHBondContact O-N 3.08Å; L113-E117 VanDerWaalsContact O-N 3.08Å |
| 114 | D | 94.4 | Very high | 93.9 | Very high | 8 Ų | 8 | 60.4 Ų | 60.4 | 4% | 0.043 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -66.5 | -35.6 | 178.9 | -61.3 | -15.2 | 0 | 0 | 0 | 110.6 | Y90 K92 L110 D111 V116 E117 I118 | Y90-D114 HydrophobicContact CE1-CB 4.23Å; Y90-D114 WeakPolarHBondContact OH-CB 3.31Å; Y90-D114 PolarHBondContact OH-OD1 2.93Å; K92-D114 VanDerWaalsContact CD-OD2 3.31Å; K92-D114 WeakPolarHBondContact CD-OD2 3.46Å; K92-D114 IonicContact NZ-OD1 3.05Å; K92-D114 PolarHBondContact NZ-OD1 3.48Å; K92-D114 IonicContact NZ-OD2 3.99Å; K92-D114 PolarHBondContact NZ-OD2 2.94Å; L110-D114 HydrophobicContact CB-CB 4.06Å; L110-D114 HydrophobicContact CD2-CB 4.49Å; D111-D114 PolarHBondContact N-OD2 2.88Å; D111-D114 WeakPolarHBondContact O-CB 3.48Å; D111-D114 PolarHBondContact O-N 3.4Å; D114-V116 PolarHBondContact O-N 3.28Å; D114-E117 PolarHBondContact O-N 3.31Å; D114-I118 VanDerWaalsContact O-CG1 3.32Å; D114-I118 WeakPolarHBondContact O-CG1 3.32Å; D114-I118 PolarHBondContact O-N 3.38Å |
| 115 | Q | 92.8 | Very high | 93.9 | Very high | 16 Ų | 16 | 63.9 Ų | 63.9 | 8% | 0.075 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -57.8 | -47.4 | 171.4 | -176.8 | -176.7 | 0.9 | 0 | 0 | 111.4 | M105 D111 L113 E117 I118 I119 A135 L138 | M105-Q115 VanDerWaalsContact CE-OE1 3.25Å; D111-Q115 PolarHBondContact O-N 2.64Å; L113-Q115 VanDerWaalsContact C-N 3.28Å; L113-Q115 PolarHBondContact O-N 2.78Å; Q115-E117 VanDerWaalsContact C-N 3.31Å; Q115-E117 PolarHBondContact O-N 3.38Å; Q115-I118 PolarHBondContact O-N 3.44Å; Q115-I119 WeakPolarHBondContact O-CG1 3.45Å; Q115-I119 PolarHBondContact O-N 3.05Å; Q115-A135 PolarHBondContact NE2-O 2.99Å; Q115-A135 VanDerWaalsContact NE2-O 3.08Å; Q115-L138 PolarHBondContact NE2-O 3.47Å; Q115-L138 VanDerWaalsContact NE2-O 3.1Å |
| 116 | V | 93 | Very high | 93.8 | Very high | 82 Ų | 82 | 61.1 Ų | 61.1 | 50% | 0.497 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -62 | -40.5 | 178.9 | 177.2 | 0 | 0 | 0 | 0 | 111 | L113 D114 I119 M120 | L113-V116 PolarHBondContact O-N 3.03Å; L113-V116 VanDerWaalsContact O-N 3.15Å; D114-V116 PolarHBondContact O-N 3.28Å; V116-I119 PolarHBondContact O-N 3.27Å; V116-M120 HydrophobicContact CG1-CE 4.26Å; V116-M120 WeakPolarHBondContact O-CG 3.34Å; V116-M120 PolarHBondContact O-N 2.98Å |
| 117 | E | 93.9 | Very high | 93.7 | Very high | 89 Ų | 89 | 56.4 Ų | 56.4 | 42% | 0.416 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -62.1 | -43.3 | 175.4 | -69.2 | 179.3 | -177.8 | 0 | 0 | 113 | Y90 L113 D114 Q115 M120 A121 | Y90-E117 HydrophobicContact CE2-CB 4.24Å; Y90-E117 WeakPolarHBondContact CE2-OE2 3.47Å; Y90-E117 PolarHBondContact OH-OE2 2.88Å; L113-E117 PolarHBondContact O-N 3.08Å; L113-E117 VanDerWaalsContact O-N 3.08Å; D114-E117 PolarHBondContact O-N 3.31Å; Q115-E117 VanDerWaalsContact C-N 3.31Å; Q115-E117 PolarHBondContact O-N 3.38Å; E117-M120 HydrophobicContact CB-CE 4.42Å; E117-M120 HydrophobicContact CG-CE 4.15Å; E117-M120 PolarHBondContact O-N 2.95Å; E117-A121 PolarHBondContact O-N 3.45Å |
| 118 | I | 94.8 | Very high | 93.7 | Very high | 5 Ų | 5 | 52.9 Ų | 52.9 | 3% | 0.026 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -62.5 | -44.4 | 176.7 | -71.4 | 166.1 | 0 | 0 | 0 | 110.6 | L87 Y90 I93 F104 L110 D114 Q115 A121 M122 I144 | L87-I118 HydrophobicContact CD2-CD1 4.12Å; L87-I118 HydrophobicContact CD2-CG1 4.3Å; L87-I118 HydrophobicContact CD2-CG2 3.58Å; Y90-I118 HydrophobicContact CD1-CD1 4.45Å; Y90-I118 HydrophobicContact CD2-CG1 4.43Å; Y90-I118 HydrophobicContact CE1-CD1 4.48Å; Y90-I118 HydrophobicContact CG-CG1 4.45Å; I93-I118 HydrophobicContact CD1-CD1 4.06Å; F104-I118 HydrophobicContact CD1-CD1 4.46Å; L110-I118 HydrophobicContact CD1-CD1 3.63Å; D114-I118 VanDerWaalsContact O-CG1 3.32Å; D114-I118 WeakPolarHBondContact O-CG1 3.32Å; D114-I118 PolarHBondContact O-N 3.38Å; Q115-I118 PolarHBondContact O-N 3.44Å; I118-A121 PolarHBondContact O-N 2.95Å; I118-M122 HydrophobicContact CG2-CE 4.32Å; I118-M122 WeakPolarHBondContact O-CG 3.32Å; I118-M122 PolarHBondContact O-N 2.95Å; I118-I144 HydrophobicContact CG2-CD1 4.47Å |
| 119 | I | 94.9 | Very high | 93.6 | Very high | 7 Ų | 7 | 59.2 Ų | 59.2 | 4% | 0.036 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -61.8 | -46 | 178.6 | -66.3 | -56.5 | 0 | 0 | 0 | 110.8 | Q115 V116 A121 M122 E123 I130 A135 L138 I144 | Q115-I119 WeakPolarHBondContact O-CG1 3.45Å; Q115-I119 PolarHBondContact O-N 3.05Å; V116-I119 PolarHBondContact O-N 3.27Å; I119-A121 VanDerWaalsContact C-N 3.28Å; I119-A121 PolarHBondContact O-N 3.29Å; I119-M122 WeakPolarHBondContact O-CB 3.31Å; I119-M122 PolarHBondContact O-N 3.29Å; I119-E123 HydrophobicContact CG2-CG 4.43Å; I119-E123 WeakPolarHBondContact O-CG 3.44Å; I119-E123 PolarHBondContact O-N 3.03Å; I119-I130 HydrophobicContact CG2-CB 4.19Å; I119-I130 HydrophobicContact CG2-CD1 3.95Å; I119-A135 HydrophobicContact CG1-CB 4.27Å; I119-A135 HydrophobicContact CG2-CB 3.95Å; I119-L138 HydrophobicContact CD1-CB 4.07Å; I119-L138 HydrophobicContact CD1-CD1 3.86Å; I119-I144 HydrophobicContact CD1-CD1 4.15Å; I119-I144 HydrophobicContact CD1-CG1 4.43Å |
| 120 | M | 94.3 | Very high | 93.7 | Very high | 95 Ų | 95 | 56.8 Ų | 56.8 | 47% | 0.468 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -58.1 | -40.3 | 175.3 | -70.4 | -174 | -62.3 | 0 | 0 | 112.2 | V116 E117 M122 E123 D124 | V116-M120 HydrophobicContact CG1-CE 4.26Å; V116-M120 WeakPolarHBondContact O-CG 3.34Å; V116-M120 PolarHBondContact O-N 2.98Å; E117-M120 HydrophobicContact CB-CE 4.42Å; E117-M120 HydrophobicContact CG-CE 4.15Å; E117-M120 PolarHBondContact O-N 2.95Å; M120-M122 VanDerWaalsContact C-N 3.31Å; M120-M122 PolarHBondContact O-N 3.47Å; M120-E123 WeakPolarHBondContact O-CB 3.47Å; M120-E123 PolarHBondContact O-N 3.11Å; M120-D124 PolarHBondContact O-N 3.01Å; M120-D124 VanDerWaalsContact O-N 3.08Å |
| 121 | A | 95.3 | Very high | 93.7 | Very high | 41 Ų | 41 | 59.3 Ų | 59.3 | 34% | 0.339 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -65.2 | -34.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | V86 E117 I118 I119 E125 | V86-A121 HydrophobicContact CG1-CB 3.98Å; E117-A121 PolarHBondContact O-N 3.45Å; I118-A121 PolarHBondContact O-N 2.95Å; I119-A121 VanDerWaalsContact C-N 3.28Å; I119-A121 PolarHBondContact O-N 3.29Å; A121-E125 WeakPolarHBondContact O-CB 3.41Å; A121-E125 PolarHBondContact O-N 3.37Å; A121-E125 VanDerWaalsContact O-N 3.11Å |
| 122 | M | 95.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -71.6 | -40.6 | 175.6 | -65.4 | -65 | 170.6 | 0 | 0 | 112 | V83 V86 L87 I118 I119 M120 D124 E125 F126 I144 | V83-M122 HydrophobicContact CB-CE 4.36Å; V83-M122 HydrophobicContact CB-SD 4.4Å; V83-M122 HydrophobicContact CG1-CE 3.82Å; V83-M122 HydrophobicContact CG1-SD 4.29Å; V83-M122 HydrophobicContact CG2-SD 4.08Å; V86-M122 HydrophobicContact CB-CE 3.73Å; V86-M122 HydrophobicContact CB-SD 4.15Å; V86-M122 HydrophobicContact CG1-CE 3.69Å; V86-M122 HydrophobicContact CG1-SD 4.12Å; V86-M122 HydrophobicContact CG2-SD 4.48Å; L87-M122 HydrophobicContact CD1-CE 4.46Å; L87-M122 HydrophobicContact CD2-CE 4.03Å; L87-M122 HydrophobicContact CG-CE 3.79Å; I118-M122 HydrophobicContact CG2-CE 4.32Å; I118-M122 WeakPolarHBondContact O-CG 3.32Å; I118-M122 PolarHBondContact O-N 2.95Å; I119-M122 WeakPolarHBondContact O-CB 3.31Å; I119-M122 PolarHBondContact O-N 3.29Å; M120-M122 VanDerWaalsContact C-N 3.31Å; M120-M122 PolarHBondContact O-N 3.47Å; M122-D124 VanDerWaalsContact C-N 3.32Å; M122-D124 PolarHBondContact O-N 3.11Å; M122-E125 PolarHBondContact O-N 3.43Å; M122-F126 WeakPolarHBondContact O-CD2 3.37Å; M122-F126 PolarHBondContact O-N 3.04Å; M122-F126 VanDerWaalsContact O-N 3.11Å; M122-F126 HydrophobicContact SD-CE2 4.47Å; M122-I144 HydrophobicContact CG-CG2 4.14Å; M122-I144 HydrophobicContact SD-CG2 4.35Å |
| 123 | E | 94.4 | Very high | 93.6 | Very high | 37 Ų | 37 | 61.2 Ų | 61.2 | 17% | 0.173 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -57 | -46.9 | 174.3 | -71.3 | 177 | 160.9 | 0 | 0 | 111.6 | I119 M120 G127 F128 I130 | I119-E123 HydrophobicContact CG2-CG 4.43Å; I119-E123 WeakPolarHBondContact O-CG 3.44Å; I119-E123 PolarHBondContact O-N 3.03Å; M120-E123 WeakPolarHBondContact O-CB 3.47Å; M120-E123 PolarHBondContact O-N 3.11Å; E123-G127 VanDerWaalsContact O-CA 3.31Å; E123-G127 WeakPolarHBondContact O-CA 3.22Å; E123-G127 PolarHBondContact O-N 2.98Å; E123-F128 WeakPolarHBondContact CA-O 3.46Å; E123-F128 WeakPolarHBondContact CB-O 3.45Å; E123-F128 WeakPolarHBondContact CG-O 3.41Å; E123-F128 PolarHBondContact O-N 3.36Å; E123-I130 HydrophobicContact CG-CB 4.29Å; E123-I130 HydrophobicContact CG-CD1 4.06Å; E123-I130 HydrophobicContact CG-CG1 3.96Å; E123-I130 WeakPolarHBondContact OE1-CA 3.47Å; E123-I130 VanDerWaalsContact OE1-CB 3.26Å; E123-I130 WeakPolarHBondContact OE1-CB 3.35Å; E123-I130 PolarHBondContact OE1-N 3.22Å |
| 124 | D | 94.4 | Very high | 93.7 | Very high | 142 Ų | 142 | 57.6 Ų | 57.6 | 76% | 0.759 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -63.2 | -42.3 | 177.2 | -79.1 | -16.3 | 0 | 0 | 0 | 112.2 | M120 M122 F126 | M120-D124 PolarHBondContact O-N 3.01Å; M120-D124 VanDerWaalsContact O-N 3.08Å; M122-D124 VanDerWaalsContact C-N 3.32Å; M122-D124 PolarHBondContact O-N 3.11Å; D124-F126 PolarHBondContact O-N 3.32Å |
| 125 | E | 92.8 | Very high | 93.6 | Very high | 75 Ų | 75 | 57.9 Ų | 57.9 | 35% | 0.35 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -67 | -35.3 | -177.9 | 180 | 63.5 | -166.7 | 0 | 0 | 112.8 | R82 V86 A121 M122 | R82-E125 IonicContact CZ-OE1 2.59Å; R82-E125 IonicContact NE-OE1 3.15Å; R82-E125 PolarHBondContact NE-OE1 3.34Å; R82-E125 PolarHBondContact NH2-O 3.04Å; R82-E125 IonicContact NH2-OE1 2.83Å; R82-E125 PolarHBondContact NH2-OE1 3.41Å; R82-E125 IonicContact NH2-OE2 2.64Å; V86-E125 HydrophobicContact CG2-CB 4.29Å; V86-E125 HydrophobicContact CG2-CG 3.93Å; A121-E125 WeakPolarHBondContact O-CB 3.41Å; A121-E125 PolarHBondContact O-N 3.37Å; A121-E125 VanDerWaalsContact O-N 3.11Å; M122-E125 PolarHBondContact O-N 3.43Å |
| 126 | F | 92.4 | Very high | 93.5 | Very high | 13 Ų | 13 | 63.7 Ų | 63.7 | 6% | 0.057 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -106.9 | -4.4 | -176.6 | -68.6 | -86.6 | 0 | 0 | 0 | 114.4 | L74 I79 R82 V83 M122 D124 F128 I148 K152 | L74-F126 HydrophobicContact CD2-CE1 4.42Å; I79-F126 HydrophobicContact CG1-CE1 4.24Å; I79-F126 HydrophobicContact CG2-CE1 4.28Å; I79-F126 HydrophobicContact CG2-CZ 4.12Å; R82-F126 HydrophobicContact CB-CZ 3.86Å; V83-F126 HydrophobicContact CG2-CE2 4.06Å; V83-F126 HydrophobicContact CG2-CZ 4.18Å; M122-F126 WeakPolarHBondContact O-CD2 3.37Å; M122-F126 PolarHBondContact O-N 3.04Å; M122-F126 VanDerWaalsContact O-N 3.11Å; M122-F126 HydrophobicContact SD-CE2 4.47Å; D124-F126 PolarHBondContact O-N 3.32Å; F126-F128 HydrophobicContact CB-CD1 3.52Å; F126-F128 HydrophobicContact CB-CE1 3.27Å; F126-F128 HydrophobicContact CB-CZ 4.4Å; F126-F128 HydrophobicContact CG-CE1 4.08Å; F126-I148 HydrophobicContact CD1-CG2 3.86Å; F126-I148 HydrophobicContact CD2-CD1 3.81Å; F126-I148 HydrophobicContact CD2-CG1 4.46Å; F126-I148 HydrophobicContact CE1-CG2 3.94Å; F126-I148 HydrophobicContact CE2-CD1 3.56Å; F126-I148 HydrophobicContact CG-CD1 4.42Å; F126-I148 HydrophobicContact CG-CG2 4.24Å; F126-I148 HydrophobicContact CZ-CD1 3.95Å; F126-I148 HydrophobicContact CZ-CG2 4.39Å; F126-K152 PolarHBondContact O-NZ 3.39Å |
| 127 | G | 91.3 | Very high | 93.5 | Very high | 64 Ų | 64 | 65.7 Ų | 65.7 | 66% | 0.66 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67 | 43.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | E123 | E123-G127 VanDerWaalsContact O-CA 3.31Å; E123-G127 WeakPolarHBondContact O-CA 3.22Å; E123-G127 PolarHBondContact O-N 2.98Å |
| 128 | F | 91.4 | Very high | 93.6 | Very high | 29 Ų | 29 | 62 Ų | 62 | 13% | 0.127 | 34% | 0.338 | C | S | . | . | trans | -144.3 | 162.3 | 174.5 | 69.5 | -97.3 | 0 | 0 | 0 | 111.1 | E123 F126 I130 Y147 I148 | E123-F128 WeakPolarHBondContact CA-O 3.46Å; E123-F128 WeakPolarHBondContact CB-O 3.45Å; E123-F128 WeakPolarHBondContact CG-O 3.41Å; E123-F128 PolarHBondContact O-N 3.36Å; F126-F128 HydrophobicContact CB-CD1 3.52Å; F126-F128 HydrophobicContact CB-CE1 3.27Å; F126-F128 HydrophobicContact CB-CZ 4.4Å; F126-F128 HydrophobicContact CG-CE1 4.08Å; F128-I130 HydrophobicContact CD2-CG1 3.98Å; F128-I130 HydrophobicContact CE2-CD1 3.73Å; F128-I130 HydrophobicContact CE2-CG1 3.37Å; F128-I130 HydrophobicContact CZ-CD1 4.24Å; F128-I130 HydrophobicContact CZ-CG1 4.34Å; F128-Y147 HydrophobicContact CE2-CD1 4.27Å; F128-Y147 AromaticContact CE2-CE1 3.83Å; F128-Y147 HydrophobicContact CE2-CE1 3.83Å; F128-Y147 HydrophobicContact CZ-CD1 4.46Å; F128-Y147 HydrophobicContact CZ-CE1 4.44Å; F128-I148 HydrophobicContact CE1-CG1 4Å; F128-I148 HydrophobicContact CE1-CG2 4.34Å; F128-I148 HydrophobicContact CZ-CG1 3.68Å | ||
| 129 | E | 93.3 | Very high | 93.5 | Very high | 164 Ų | 164 | 64.1 Ų | 64.1 | 77% | 0.766 | 35% | 0.349 | S | S | * | . | trans | -104.3 | 134.2 | -179 | -170.5 | 176.7 | -178.3 | 0 | 0 | 110.3 | ||||
| 130 | I | 94.4 | Very high | 93.5 | Very high | 5 Ų | 5 | 64.7 Ų | 64.7 | 3% | 0.026 | 35% | 0.353 | C | S | . | . | trans | -102.9 | 123.4 | 176.1 | -61 | 170.6 | 0 | 0 | 0 | 107.6 | I119 E123 F128 D134 A135 L138 Y147 | I119-I130 HydrophobicContact CG2-CB 4.19Å; I119-I130 HydrophobicContact CG2-CD1 3.95Å; E123-I130 HydrophobicContact CG-CB 4.29Å; E123-I130 HydrophobicContact CG-CD1 4.06Å; E123-I130 HydrophobicContact CG-CG1 3.96Å; E123-I130 WeakPolarHBondContact OE1-CA 3.47Å; E123-I130 VanDerWaalsContact OE1-CB 3.26Å; E123-I130 WeakPolarHBondContact OE1-CB 3.35Å; E123-I130 PolarHBondContact OE1-N 3.22Å; F128-I130 HydrophobicContact CD2-CG1 3.98Å; F128-I130 HydrophobicContact CE2-CD1 3.73Å; F128-I130 HydrophobicContact CE2-CG1 3.37Å; F128-I130 HydrophobicContact CZ-CD1 4.24Å; F128-I130 HydrophobicContact CZ-CG1 4.34Å; I130-D134 HydrophobicContact CG2-CB 4.29Å; I130-A135 HydrophobicContact CG2-CB 3.95Å; I130-L138 HydrophobicContact CD1-CD1 4.3Å; I130-L138 HydrophobicContact CG2-CD1 4.36Å; I130-Y147 HydrophobicContact CD1-CD1 4.39Å; I130-Y147 HydrophobicContact CD1-CE1 4.21Å; I130-Y147 HydrophobicContact CG1-CD1 4.45Å; I130-Y147 HydrophobicContact CG1-CE1 3.79Å; I130-Y147 HydrophobicContact CG2-CE1 4.31Å | ||
| 131 | P | 94.9 | Very high | 93.6 | Very high | 63 Ų | 63 | 60.1 Ų | 60.1 | 41% | 0.409 | 33% | 0.33 | S | S | . | . | trans | -67 | 143.9 | 174.9 | 29.4 | -33.5 | 0 | 0 | 0 | 110.6 | T133 D134 A135 | P131-T133 PolarHBondContact O-N 3.03Å; P131-D134 HydrophobicContact CG-CB 4.1Å; P131-D134 WeakPolarHBondContact CG-OD2 3.42Å; P131-D134 PolarHBondContact O-N 3.02Å; P131-A135 PolarHBondContact O-N 2.83Å | ||
| 132 | D | 92.2 | Very high | 93.6 | Very high | 129 Ų | 129 | 60.8 Ų | 60.8 | 69% | 0.69 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -49.1 | -39.1 | -179.6 | -61.5 | -15.7 | 0 | 0 | 0 | 113.2 | D134 A135 E136 | D132-D134 PolarHBondContact O-N 3.28Å; D132-A135 PolarHBondContact O-N 3.33Å; D132-E136 WeakPolarHBondContact O-CG 3.38Å; D132-E136 PolarHBondContact O-N 3.24Å |
| 133 | T | 93.2 | Very high | 93.6 | Very high | 96 Ų | 96 | 64.3 Ų | 64.3 | 59% | 0.589 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -61.3 | -28.8 | -179.7 | -49.6 | 0 | 0 | 0 | 0 | 113.4 | P131 K137 | P131-T133 PolarHBondContact O-N 3.03Å; T133-K137 WeakPolarHBondContact O-CE 3.23Å; T133-K137 PolarHBondContact O-NZ 3.24Å |
| 134 | D | 93.5 | Very high | 93.6 | Very high | 50 Ų | 50 | 62.6 Ų | 62.6 | 27% | 0.267 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -94 | -37.5 | 176.7 | -65.9 | -27.1 | 0 | 0 | 0 | 110.8 | I130 P131 D132 E136 K137 L138 Y147 | I130-D134 HydrophobicContact CG2-CB 4.29Å; P131-D134 HydrophobicContact CG-CB 4.1Å; P131-D134 WeakPolarHBondContact CG-OD2 3.42Å; P131-D134 PolarHBondContact O-N 3.02Å; D132-D134 PolarHBondContact O-N 3.28Å; D134-E136 VanDerWaalsContact C-N 3.26Å; D134-E136 PolarHBondContact O-N 3.27Å; D134-K137 WeakPolarHBondContact O-CB 3.34Å; D134-K137 PolarHBondContact O-N 2.96Å; D134-K137 IonicContact OD1-NZ 2.88Å; D134-K137 PolarHBondContact OD1-NZ 2.99Å; D134-L138 WeakPolarHBondContact O-CG 3.4Å; D134-L138 PolarHBondContact O-N 3.22Å; D134-Y147 HydrophobicContact CB-CE2 4.03Å |
| 135 | A | 92.8 | Very high | 93.6 | Very high | 14 Ų | 14 | 56.3 Ų | 56.3 | 12% | 0.116 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -53.9 | -41.3 | 174 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q115 I119 I130 P131 D132 K137 L138 | Q115-A135 PolarHBondContact NE2-O 2.99Å; Q115-A135 VanDerWaalsContact NE2-O 3.08Å; I119-A135 HydrophobicContact CG1-CB 4.27Å; I119-A135 HydrophobicContact CG2-CB 3.95Å; I130-A135 HydrophobicContact CG2-CB 3.95Å; P131-A135 PolarHBondContact O-N 2.83Å; D132-A135 PolarHBondContact O-N 3.33Å; A135-K137 PolarHBondContact O-N 3.22Å; A135-L138 PolarHBondContact O-N 2.81Å |
| 136 | E | 92.3 | Very high | 93.7 | Very high | 138 Ų | 138 | 56.3 Ų | 56.3 | 65% | 0.645 | 30% | 0.304 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.9 | -26 | 177 | -76.1 | 178.6 | -175.9 | 0 | 0 | 113.5 | D132 D134 M139 | D132-E136 WeakPolarHBondContact O-CG 3.38Å; D132-E136 PolarHBondContact O-N 3.24Å; D134-E136 VanDerWaalsContact C-N 3.26Å; D134-E136 PolarHBondContact O-N 3.27Å; E136-M139 WeakPolarHBondContact O-CE 3.43Å |
| 137 | K | 92.8 | Very high | 93.8 | Very high | 124 Ų | 124 | 57.8 Ų | 57.8 | 54% | 0.539 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.1 | -20.8 | -179.1 | -58.4 | 171.7 | -165.8 | 145.6 | 0 | 112.6 | T133 D134 A135 M139 | T133-K137 WeakPolarHBondContact O-CE 3.23Å; T133-K137 PolarHBondContact O-NZ 3.24Å; D134-K137 WeakPolarHBondContact O-CB 3.34Å; D134-K137 PolarHBondContact O-N 2.96Å; D134-K137 IonicContact OD1-NZ 2.88Å; D134-K137 PolarHBondContact OD1-NZ 2.99Å; A135-K137 PolarHBondContact O-N 3.22Å; K137-M139 PolarHBondContact O-N 3.08Å |
| 138 | L | 94.3 | Very high | 93.8 | Very high | 11 Ų | 11 | 54.8 Ų | 54.8 | 6% | 0.058 | 28% | 0.278 | C | S | . | . | trans | -78.6 | 87.2 | -177.6 | -61.1 | 176 | 0 | 0 | 0 | 109.9 | Q115 I119 I130 D134 A135 E143 I144 Y147 | Q115-L138 PolarHBondContact NE2-O 3.47Å; Q115-L138 VanDerWaalsContact NE2-O 3.1Å; I119-L138 HydrophobicContact CD1-CB 4.07Å; I119-L138 HydrophobicContact CD1-CD1 3.86Å; I130-L138 HydrophobicContact CD1-CD1 4.3Å; I130-L138 HydrophobicContact CG2-CD1 4.36Å; D134-L138 WeakPolarHBondContact O-CG 3.4Å; D134-L138 PolarHBondContact O-N 3.22Å; A135-L138 PolarHBondContact O-N 2.81Å; L138-E143 HydrophobicContact CD2-CB 3.96Å; L138-I144 HydrophobicContact CB-CG1 4.03Å; L138-I144 HydrophobicContact CD1-CG1 4.31Å; L138-Y147 HydrophobicContact CD1-CG 4.44Å; L138-Y147 HydrophobicContact CD2-CG 4.44Å | ||
| 139 | M | 94.1 | Very high | 93.9 | Very high | 50 Ų | 50 | 53.7 Ų | 53.7 | 25% | 0.246 | 27% | 0.274 | C | S | . | . | trans | -102.2 | -15.1 | -174.6 | -69.5 | -61.2 | -165.6 | 0 | 0 | 113.6 | F104 M105 E136 K137 E143 | F104-M139 WeakPolarHBondContact CD2-O 3.37Å; F104-M139 WeakPolarHBondContact CG-O 3.46Å; F104-M139 PolarHBondContact N-O 3.21Å; M105-M139 HydrophobicContact CE-CE 4.15Å; M105-M139 HydrophobicContact CE-SD 4.25Å; M105-M139 HydrophobicContact SD-CE 4.47Å; E136-M139 WeakPolarHBondContact O-CE 3.43Å; K137-M139 PolarHBondContact O-N 3.08Å; M139-E143 WeakPolarHBondContact CA-OE2 3.34Å; M139-E143 PolarHBondContact N-OE2 2.94Å | ||
| 140 | C | 95.2 | Very high | 93.9 | Very high | 18 Ų | 18 | 50.3 Ų | 50.3 | 12% | 0.122 | 26% | 0.262 | C | S | . | . | S | Bend | trans | -129.4 | 150.8 | 179.8 | -51.1 | 0 | 0 | 0 | 0 | 111.5 | Q142 E143 I144 | C140-Q142 VanDerWaalsContact C-N 3.28Å; C140-Q142 PolarHBondContact O-N 2.89Å; C140-E143 HydrophobicContact CB-CG 4.13Å; C140-E143 PolarHBondContact N-OE2 3.32Å; C140-E143 WeakPolarHBondContact O-CB 3.44Å; C140-E143 PolarHBondContact O-N 2.81Å; C140-E143 VanDerWaalsContact O-N 3.16Å; C140-I144 PolarHBondContact O-N 2.75Å |
| 141 | P | 95.1 | Very high | 93.7 | Very high | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -57.7 | -37.9 | 174.6 | -25.1 | 33.4 | 0 | 0 | 0 | 113.5 | V83 L87 V100 S102 F104 E143 I144 V145 | V83-P141 HydrophobicContact CG1-CB 4.46Å; L87-P141 HydrophobicContact CD1-CB 3.69Å; L87-P141 HydrophobicContact CD1-CG 3.62Å; V100-P141 WeakPolarHBondContact O-CB 3.48Å; V100-P141 WeakPolarHBondContact O-CD 3.38Å; S102-P141 WeakPolarHBondContact O-CD 3.2Å; F104-P141 HydrophobicContact CE1-CG 3.81Å; F104-P141 HydrophobicContact CZ-CB 4.5Å; F104-P141 HydrophobicContact CZ-CG 3.81Å; P141-E143 VanDerWaalsContact C-N 3.32Å; P141-E143 PolarHBondContact O-N 3.04Å; P141-I144 WeakPolarHBondContact O-CB 3.12Å; P141-I144 PolarHBondContact O-N 3.04Å; P141-V145 WeakPolarHBondContact O-CG2 3.21Å; P141-V145 PolarHBondContact O-N 2.76Å |
| 142 | Q | 95.5 | Very high | 93.3 | Very high | 55 Ų | 55 | 56.6 Ų | 56.6 | 26% | 0.257 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -58.1 | -43.5 | 176.3 | -174.9 | 61.4 | 27.8 | 0 | 0 | 111.9 | V100 C140 I144 V145 D146 | V100-Q142 HydrophobicContact CG1-CB 4.1Å; V100-Q142 WeakPolarHBondContact O-CB 3.43Å; V100-Q142 PolarHBondContact O-N 3.1Å; C140-Q142 VanDerWaalsContact C-N 3.28Å; C140-Q142 PolarHBondContact O-N 2.89Å; Q142-I144 VanDerWaalsContact C-N 3.28Å; Q142-I144 PolarHBondContact O-N 2.94Å; Q142-V145 WeakPolarHBondContact O-CB 3.31Å; Q142-V145 PolarHBondContact O-N 2.75Å; Q142-V145 VanDerWaalsContact O-N 3.13Å; Q142-D146 PolarHBondContact NE2-OD1 2.78Å; Q142-D146 VanDerWaalsContact NE2-OD1 3.07Å; Q142-D146 VanDerWaalsContact O-CG 3.25Å; Q142-D146 PolarHBondContact O-N 3.43Å |
| 143 | E | 95.1 | Very high | 93 | Very high | 74 Ų | 74 | 56.4 Ų | 56.4 | 35% | 0.346 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -64.5 | -35.1 | 179.6 | -62.8 | 167 | 173.5 | 0 | 0 | 111.4 | L138 M139 C140 P141 Y147 | L138-E143 HydrophobicContact CD2-CB 3.96Å; M139-E143 WeakPolarHBondContact CA-OE2 3.34Å; M139-E143 PolarHBondContact N-OE2 2.94Å; C140-E143 HydrophobicContact CB-CG 4.13Å; C140-E143 PolarHBondContact N-OE2 3.32Å; C140-E143 WeakPolarHBondContact O-CB 3.44Å; C140-E143 PolarHBondContact O-N 2.81Å; C140-E143 VanDerWaalsContact O-N 3.16Å; P141-E143 VanDerWaalsContact C-N 3.32Å; P141-E143 PolarHBondContact O-N 3.04Å; E143-Y147 VanDerWaalsContact O-CB 3.31Å; E143-Y147 WeakPolarHBondContact O-CB 3.38Å; E143-Y147 PolarHBondContact O-N 3.2Å |
| 144 | I | 94.4 | Very high | 92.4 | Very high | 1 Ų | 1 | 53 Ų | 53 | 1% | 0.005 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -65.3 | -44.7 | 173.8 | -63.1 | 174.6 | 0 | 0 | 0 | 110.4 | V83 F104 I118 I119 M122 L138 C140 P141 Q142 D146 Y147 I148 | V83-I144 HydrophobicContact CG1-CB 4.47Å; V83-I144 HydrophobicContact CG1-CG2 4.21Å; V83-I144 HydrophobicContact CG2-CG2 4.14Å; F104-I144 HydrophobicContact CE2-CD1 3.8Å; F104-I144 HydrophobicContact CZ-CD1 3.76Å; I118-I144 HydrophobicContact CG2-CD1 4.47Å; I119-I144 HydrophobicContact CD1-CD1 4.15Å; I119-I144 HydrophobicContact CD1-CG1 4.43Å; M122-I144 HydrophobicContact CG-CG2 4.14Å; M122-I144 HydrophobicContact SD-CG2 4.35Å; L138-I144 HydrophobicContact CB-CG1 4.03Å; L138-I144 HydrophobicContact CD1-CG1 4.31Å; C140-I144 PolarHBondContact O-N 2.75Å; P141-I144 WeakPolarHBondContact O-CB 3.12Å; P141-I144 PolarHBondContact O-N 3.04Å; Q142-I144 VanDerWaalsContact C-N 3.28Å; Q142-I144 PolarHBondContact O-N 2.94Å; I144-D146 VanDerWaalsContact C-N 3.35Å; I144-Y147 PolarHBondContact O-N 3.47Å; I144-I148 HydrophobicContact CG2-CD1 3.65Å; I144-I148 HydrophobicContact CG2-CG1 4.4Å; I144-I148 WeakPolarHBondContact O-CD1 3.26Å; I144-I148 VanDerWaalsContact O-CG1 3.23Å; I144-I148 WeakPolarHBondContact O-CG1 3.11Å; I144-I148 PolarHBondContact O-N 2.9Å |
| 145 | V | 94.9 | Very high | 91.4 | Very high | 9 Ų | 9 | 57.3 Ų | 57.3 | 6% | 0.055 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -59.4 | -48 | 177.4 | 172.7 | 0 | 0 | 0 | 0 | 110.5 | I79 R80 V83 P141 Q142 Y147 I148 A149 | I79-V145 HydrophobicContact CG2-CG1 4.08Å; R80-V145 HydrophobicContact CB-CG1 4.32Å; R80-V145 HydrophobicContact CB-CG2 4.29Å; R80-V145 HydrophobicContact CG-CG2 4.49Å; V83-V145 HydrophobicContact CB-CG2 3.94Å; V83-V145 HydrophobicContact CG1-CG2 4.07Å; V83-V145 HydrophobicContact CG2-CG2 3.9Å; P141-V145 WeakPolarHBondContact O-CG2 3.21Å; P141-V145 PolarHBondContact O-N 2.76Å; Q142-V145 WeakPolarHBondContact O-CB 3.31Å; Q142-V145 PolarHBondContact O-N 2.75Å; Q142-V145 VanDerWaalsContact O-N 3.13Å; V145-Y147 VanDerWaalsContact C-N 3.35Å; V145-Y147 PolarHBondContact O-N 2.79Å; V145-I148 PolarHBondContact O-N 2.83Å; V145-A149 VanDerWaalsContact O-CB 3.32Å; V145-A149 WeakPolarHBondContact O-CB 3.37Å; V145-A149 PolarHBondContact O-N 2.78Å |
| 146 | D | 94.3 | Very high | 90.1 | Very high | 75 Ų | 75 | 67.3 Ų | 67.3 | 40% | 0.401 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -63.1 | -42.4 | 179.9 | -63.4 | -18.1 | 0 | 0 | 0 | 110.8 | Q142 I144 I148 A149 D150 | Q142-D146 PolarHBondContact NE2-OD1 2.78Å; Q142-D146 VanDerWaalsContact NE2-OD1 3.07Å; Q142-D146 VanDerWaalsContact O-CG 3.25Å; Q142-D146 PolarHBondContact O-N 3.43Å; I144-D146 VanDerWaalsContact C-N 3.35Å; D146-I148 PolarHBondContact O-N 2.87Å; D146-A149 WeakPolarHBondContact O-CB 3.5Å; D146-A149 PolarHBondContact O-N 3.02Å; D146-D150 PolarHBondContact O-N 3.19Å |
| 147 | Y | 94.7 | Very high | 90 | Very high | 45 Ų | 45 | 63.8 Ų | 63.8 | 18% | 0.176 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.4 | -42.1 | 176.1 | -175.3 | -87.1 | 0 | 0 | 0 | 112.6 | F128 I130 D134 L138 E143 I144 V145 K151 | F128-Y147 HydrophobicContact CE2-CD1 4.27Å; F128-Y147 AromaticContact CE2-CE1 3.83Å; F128-Y147 HydrophobicContact CE2-CE1 3.83Å; F128-Y147 HydrophobicContact CZ-CD1 4.46Å; F128-Y147 HydrophobicContact CZ-CE1 4.44Å; I130-Y147 HydrophobicContact CD1-CD1 4.39Å; I130-Y147 HydrophobicContact CD1-CE1 4.21Å; I130-Y147 HydrophobicContact CG1-CD1 4.45Å; I130-Y147 HydrophobicContact CG1-CE1 3.79Å; I130-Y147 HydrophobicContact CG2-CE1 4.31Å; D134-Y147 HydrophobicContact CB-CE2 4.03Å; L138-Y147 HydrophobicContact CD1-CG 4.44Å; L138-Y147 HydrophobicContact CD2-CG 4.44Å; E143-Y147 VanDerWaalsContact O-CB 3.31Å; E143-Y147 WeakPolarHBondContact O-CB 3.38Å; E143-Y147 PolarHBondContact O-N 3.2Å; I144-Y147 PolarHBondContact O-N 3.47Å; V145-Y147 VanDerWaalsContact C-N 3.35Å; V145-Y147 PolarHBondContact O-N 2.79Å; Y147-K151 WeakPolarHBondContact O-CB 3.37Å; Y147-K151 PolarHBondContact O-N 3.35Å |
| 148 | I | 92.6 | Very high | 89.8 | Confident | 0 Ų | 0 | 60.6 Ų | 60.6 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -66.4 | -41.8 | 176.8 | -66.7 | 159 | 0 | 0 | 0 | 110.7 | I79 V83 F126 F128 I144 V145 D146 K151 K152 | I79-I148 HydrophobicContact CD1-CG2 4.09Å; I79-I148 HydrophobicContact CG1-CG2 4.21Å; I79-I148 HydrophobicContact CG2-CB 3.88Å; I79-I148 HydrophobicContact CG2-CD1 4.11Å; I79-I148 HydrophobicContact CG2-CG2 3.67Å; V83-I148 HydrophobicContact CG2-CD1 3.59Å; F126-I148 HydrophobicContact CD1-CG2 3.86Å; F126-I148 HydrophobicContact CD2-CD1 3.81Å; F126-I148 HydrophobicContact CD2-CG1 4.46Å; F126-I148 HydrophobicContact CE1-CG2 3.94Å; F126-I148 HydrophobicContact CE2-CD1 3.56Å; F126-I148 HydrophobicContact CG-CD1 4.42Å; F126-I148 HydrophobicContact CG-CG2 4.24Å; F126-I148 HydrophobicContact CZ-CD1 3.95Å; F126-I148 HydrophobicContact CZ-CG2 4.39Å; F128-I148 HydrophobicContact CE1-CG1 4Å; F128-I148 HydrophobicContact CE1-CG2 4.34Å; F128-I148 HydrophobicContact CZ-CG1 3.68Å; I144-I148 HydrophobicContact CG2-CD1 3.65Å; I144-I148 HydrophobicContact CG2-CG1 4.4Å; I144-I148 WeakPolarHBondContact O-CD1 3.26Å; I144-I148 VanDerWaalsContact O-CG1 3.23Å; I144-I148 WeakPolarHBondContact O-CG1 3.11Å; I144-I148 PolarHBondContact O-N 2.9Å; V145-I148 PolarHBondContact O-N 2.83Å; D146-I148 PolarHBondContact O-N 2.87Å; I148-K151 PolarHBondContact O-N 3.03Å; I148-K152 HydrophobicContact CG2-CG 4.29Å; I148-K152 WeakPolarHBondContact O-CB 3.3Å; I148-K152 WeakPolarHBondContact O-CG 3.32Å; I148-K152 PolarHBondContact O-N 3.41Å |
| 149 | A | 92.6 | Very high | 89.6 | Confident | 6 Ų | 6 | 63.4 Ų | 63.4 | 5% | 0.05 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -58.6 | -51 | 178 | 0 | 0 | 0 | 0 | 0 | 111.1 | L76 V145 D146 K151 K152 D153 V154 | L76-A149 HydrophobicContact CD2-CB 3.44Å; L76-A149 VanDerWaalsContact CD2-CB 3.44Å; V145-A149 VanDerWaalsContact O-CB 3.32Å; V145-A149 WeakPolarHBondContact O-CB 3.37Å; V145-A149 PolarHBondContact O-N 2.78Å; D146-A149 WeakPolarHBondContact O-CB 3.5Å; D146-A149 PolarHBondContact O-N 3.02Å; A149-K151 VanDerWaalsContact C-N 3.31Å; A149-K151 PolarHBondContact O-N 3.25Å; A149-K152 PolarHBondContact O-N 3.23Å; A149-D153 PolarHBondContact O-N 3.37Å; A149-V154 WeakPolarHBondContact CB-O 3.34Å; A149-V154 PolarHBondContact O-N 3.45Å |
| 150 | D | 92.6 | Very high | 89.3 | Confident | 94 Ų | 94 | 64.2 Ų | 64.2 | 50% | 0.503 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -58.9 | -42.4 | 175.9 | -76 | -5.4 | 0 | 0 | 0 | 111.4 | D146 K152 D153 Y155 | D146-D150 PolarHBondContact O-N 3.19Å; D150-K152 VanDerWaalsContact C-N 3.34Å; D150-K152 PolarHBondContact O-N 3.19Å; D150-D153 PolarHBondContact O-N 3.2Å; D150-Y155 WeakPolarHBondContact OD1-CE1 3.45Å |
| 151 | K | 90.2 | Very high | 88.9 | Confident | 119 Ų | 119 | 67.1 Ų | 67.1 | 52% | 0.517 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -69.9 | -29.7 | -177.9 | -167.3 | 63 | 172.9 | -163.6 | 0 | 113.7 | Y147 I148 A149 | Y147-K151 WeakPolarHBondContact O-CB 3.37Å; Y147-K151 PolarHBondContact O-N 3.35Å; I148-K151 PolarHBondContact O-N 3.03Å; A149-K151 VanDerWaalsContact C-N 3.31Å; A149-K151 PolarHBondContact O-N 3.25Å |
| 152 | K | 87.2 | Confident | 88.5 | Confident | 80 Ų | 80 | 71.5 Ų | 71.5 | 35% | 0.348 | 34% | 0.339 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.1 | 5.6 | -180 | -63.3 | -69.6 | -173.9 | 178.7 | 0 | 112.5 | L74 F126 I148 A149 D150 V154 | L74-K152 HydrophobicContact CD1-CD 4.39Å; L74-K152 HydrophobicContact CD1-CG 4.39Å; F126-K152 PolarHBondContact O-NZ 3.39Å; I148-K152 HydrophobicContact CG2-CG 4.29Å; I148-K152 WeakPolarHBondContact O-CB 3.3Å; I148-K152 WeakPolarHBondContact O-CG 3.32Å; I148-K152 PolarHBondContact O-N 3.41Å; A149-K152 PolarHBondContact O-N 3.23Å; D150-K152 VanDerWaalsContact C-N 3.34Å; D150-K152 PolarHBondContact O-N 3.19Å; K152-V154 HydrophobicContact CB-CG2 3.86Å; K152-V154 PolarHBondContact O-N 3.42Å |
| 153 | D | 85.3 | Confident | 88 | Confident | 125 Ų | 125 | 72.7 Ų | 72.7 | 67% | 0.668 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.5 | 37.5 | -175 | -62.7 | -53.3 | 0 | 0 | 0 | 112.9 | A149 D150 Y155 | A149-D153 PolarHBondContact O-N 3.37Å; D150-D153 PolarHBondContact O-N 3.2Å; D153-Y155 HydrophobicContact CB-CE2 4.22Å |
| 154 | V | 81.8 | Confident | 87.5 | Confident | 25 Ų | 25 | 72.6 Ų | 72.6 | 15% | 0.152 | 34% | 0.344 | C | S | . | . | trans | -99.3 | 115.1 | 177.4 | -174.7 | 0 | 0 | 0 | 0 | 107.9 | L74 L76 I79 A149 K152 | L74-V154 HydrophobicContact CB-CG2 4.33Å; L74-V154 WeakPolarHBondContact O-CG1 3.38Å; L74-V154 WeakPolarHBondContact O-CG2 3.5Å; L76-V154 HydrophobicContact CD2-CB 4.07Å; L76-V154 HydrophobicContact CD2-CG1 3.63Å; L76-V154 WeakPolarHBondContact CD2-O 3.42Å; L76-V154 HydrophobicContact CG-CG1 4.03Å; I79-V154 HydrophobicContact CD1-CB 4.23Å; I79-V154 HydrophobicContact CD1-CG1 4.37Å; I79-V154 HydrophobicContact CD1-CG2 4.31Å; A149-V154 WeakPolarHBondContact CB-O 3.34Å; A149-V154 PolarHBondContact O-N 3.45Å; K152-V154 HydrophobicContact CB-CG2 3.86Å; K152-V154 PolarHBondContact O-N 3.42Å | ||
| 155 | Y | 72.9 | Confident | 86.9 | Confident | 140 Ų | 140 | 78.6 Ų | 78.6 | 55% | 0.549 | 37% | 0.372 | S | S | . | . | trans | -131.9 | 155.6 | 177.3 | -54.2 | -84.7 | 0 | 0 | 0 | 108.7 | D150 D153 | D150-Y155 WeakPolarHBondContact OD1-CE1 3.45Å; D153-Y155 HydrophobicContact CB-CE2 4.22Å | ||
| 156 | E | 63.9 | Low | 86.2 | Confident | 225 Ų | 225 | 84.9 Ų | 84.9 | 100% | 1.051 | 40% | 0.401 | S | S | * | . | trans | -73.9 | 0 | 172.7 | -56.2 | -149.3 | 160.9 | 0 | 0 | 113.1 | L76 | L76-E156 HydrophobicContact CD1-CB 4.45Å; L76-E156 HydrophobicContact CD1-CG 3.25Å; L76-E156 HydrophobicContact CG-CG 4.17Å |
Retrieved 156 of 156 residues in 36.5 ms
(Link to these results)