| 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 | 57.9 | Low | 59.5 | Low | 242 Ų | 242 | 168.4 Ų | 168.4 | 100% | 1.192 | 87% | 0.87 | S | S | * | * | 0 | 112.8 | 0 | -65.8 | 176.6 | 178.9 | 0 | 0 | 109 | |||||
| 2 | P | 56 | Low | 60.1 | Low | 134 Ų | 134 | 167.5 Ų | 167.5 | 87% | 0.87 | 86% | 0.863 | S | S | * | * | trans | -119.9 | 148.8 | 139.7 | 3.8 | 17 | 0 | 0 | 0 | 111 | ||||
| 3 | R | 59.4 | Low | 60.6 | Low | 248 Ų | 248 | 163.1 Ų | 163.1 | 94% | 0.936 | 86% | 0.856 | S | S | * | * | trans | -66.4 | 140.4 | -169.9 | -70.9 | 170.8 | 161.9 | 172.5 | -5.8 | 111.7 | ||||
| 4 | G | 54.3 | Low | 61.2 | Low | 79 Ų | 79 | 159.5 Ų | 159.5 | 81% | 0.814 | 85% | 0.847 | S | S | * | * | trans | -58 | 140.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 5 | S | 58.7 | Low | 61.5 | Low | 116 Ų | 116 | 157.1 Ų | 157.1 | 81% | 0.811 | 84% | 0.844 | S | S | * | * | trans | -138.1 | 87.7 | 155.9 | -160.3 | 0 | 0 | 0 | 0 | 106.4 | S7 | S5-S7 PolarHBondContact O-N 3.43Š| ||
| 6 | R | 61.5 | Low | 61.9 | Low | 243 Ų | 243 | 153.6 Ų | 153.6 | 92% | 0.917 | 84% | 0.844 | S | S | * | * | trans | -73.7 | 115.1 | 168.6 | -79.3 | -177 | -171.5 | -140.7 | 0.6 | 106.9 | R8 | R6-R8 PolarHBondContact O-N 3.16Š| ||
| 7 | S | 61.4 | Low | 62.4 | Low | 114 Ų | 114 | 151.8 Ų | 151.8 | 80% | 0.797 | 85% | 0.845 | S | S | * | * | trans | -45 | 118.3 | 169.2 | -49.7 | 0 | 0 | 0 | 0 | 110.2 | S5 P9 | S5-S7 PolarHBondContact O-N 3.43Å; S7-P9 WeakPolarHBondContact O-CD 3.34Å | ||
| 8 | R | 64.3 | Low | 62.8 | Low | 237 Ų | 237 | 157 Ų | 157 | 89% | 0.894 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 125 | 169.7 | -74.2 | -173 | 158.5 | -167.7 | -5.1 | 108.3 | R6 A10 | R6-R8 PolarHBondContact O-N 3.16Å; R8-A10 PolarHBondContact O-N 2.98Å |
| 9 | P | 59.4 | Low | 63.4 | Low | 122 Ų | 122 | 153.4 Ų | 153.4 | 79% | 0.792 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -66 | 131.6 | 162.6 | 26.4 | -29.9 | 0 | 0 | 0 | 108.5 | S7 R11 | S7-P9 WeakPolarHBondContact O-CD 3.34Å; P9-R11 PolarHBondContact O-N 3.12Å |
| 10 | A | 61.4 | Low | 64.1 | Low | 79 Ų | 79 | 151.5 Ų | 151.5 | 65% | 0.653 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 126.1 | 172.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | R8 M12 | R8-A10 PolarHBondContact O-N 2.98Å; A10-M12 HydrophobicContact CB-SD 4.23Å; A10-M12 PolarHBondContact O-N 3.16Å; A10-M12 VanDerWaalsContact O-N 3.12Å |
| 11 | R | 59.6 | Low | 64.6 | Low | 238 Ų | 238 | 150.1 Ų | 150.1 | 90% | 0.898 | 84% | 0.836 | S | S | * | * | trans | -74.4 | 101.4 | 174.9 | -167.1 | -173.9 | -114.4 | -91.4 | 5.5 | 106.7 | P9 S13 | P9-R11 PolarHBondContact O-N 3.12Å; R11-S13 PolarHBondContact O-N 3.02Å | ||
| 12 | M | 66.9 | Low | 65.5 | Low | 158 Ų | 158 | 144 Ų | 144 | 78% | 0.778 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 123 | 169.8 | -87.3 | 50.5 | 172.1 | 0 | 0 | 108.3 | A10 | A10-M12 HydrophobicContact CB-SD 4.23Å; A10-M12 PolarHBondContact O-N 3.16Å; A10-M12 VanDerWaalsContact O-N 3.12Å |
| 13 | S | 66.7 | Low | 66.5 | Low | 110 Ų | 110 | 143.1 Ų | 143.1 | 77% | 0.769 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 133.6 | 171.5 | -60.2 | 0 | 0 | 0 | 0 | 109.2 | R11 | R11-S13 PolarHBondContact O-N 3.02Š|
| 14 | P | 69.1 | Low | 67.4 | Low | 113 Ų | 113 | 136.5 Ų | 136.5 | 73% | 0.734 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 149.9 | 169.4 | 28.3 | -32.4 | 0 | 0 | 0 | 109.7 | ||
| 15 | P | 65.9 | Low | 68.4 | Low | 123 Ų | 123 | 138.9 Ų | 138.9 | 80% | 0.799 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 143.4 | 173.7 | 27.1 | -32.9 | 0 | 0 | 0 | 109.8 | S17 | P15-S17 PolarHBondContact O-N 2.76Å; P15-S17 VanDerWaalsContact O-N 3.11Å |
| 16 | A | 68.2 | Low | 69 | Low | 102 Ų | 102 | 141.9 Ų | 141.9 | 84% | 0.843 | 81% | 0.805 | S | S | * | * | trans | -60.7 | 114.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | R18 | A16-R18 PolarHBondContact O-N 3.17Å; A16-R18 VanDerWaalsContact O-N 3.1Å | ||
| 17 | S | 69.3 | Low | 69.4 | Low | 123 Ų | 123 | 135.2 Ų | 135.2 | 86% | 0.86 | 80% | 0.802 | S | S | * | * | trans | -61.1 | 112.3 | 170.5 | -66.8 | 0 | 0 | 0 | 0 | 109 | P15 A19 | P15-S17 PolarHBondContact O-N 2.76Å; P15-S17 VanDerWaalsContact O-N 3.11Å; S17-A19 PolarHBondContact O-N 3.12Å | ||
| 18 | R | 70.3 | Confident | 69.7 | Low | 245 Ų | 245 | 135.4 Ų | 135.4 | 93% | 0.925 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 118.4 | 169.2 | -109.6 | 177.3 | 176.7 | -173.8 | -1.4 | 108.1 | A16 | A16-R18 PolarHBondContact O-N 3.17Å; A16-R18 VanDerWaalsContact O-N 3.1Å |
| 19 | A | 74.9 | Confident | 70 | Confident | 88 Ų | 88 | 128.1 Ų | 128.1 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 145 | 171 | 0 | 0 | 0 | 0 | 0 | 110.1 | S17 | S17-A19 PolarHBondContact O-N 3.12Š|
| 20 | P | 76 | Confident | 70.2 | Confident | 115 Ų | 115 | 127.7 Ų | 127.7 | 75% | 0.747 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 151.5 | 172.2 | 28.3 | -33.5 | 0 | 0 | 0 | 110.5 | ||
| 21 | P | 75.1 | Confident | 70.2 | Confident | 124 Ų | 124 | 129.7 Ų | 129.7 | 81% | 0.805 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 145.2 | 174.5 | 27.8 | -33.5 | 0 | 0 | 0 | 110.9 | ||
| 22 | S | 76.9 | Confident | 70.4 | Confident | 113 Ų | 113 | 126.9 Ų | 126.9 | 79% | 0.79 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 142.8 | 175.8 | -43.1 | 0 | 0 | 0 | 0 | 111.2 | ||
| 23 | P | 77.2 | Confident | 70.2 | Confident | 115 Ų | 115 | 123.5 Ų | 123.5 | 75% | 0.747 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 152.6 | 173.1 | 28.1 | -33.6 | 0 | 0 | 0 | 111.2 | ||
| 24 | P | 79.2 | Confident | 69.9 | Low | 110 Ų | 110 | 124.2 Ų | 124.2 | 71% | 0.714 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 152.3 | 176.2 | 28.6 | -34.3 | 0 | 0 | 0 | 111.1 | M26 | P24-M26 PolarHBondContact O-N 3.47Š|
| 25 | P | 73.3 | Confident | 69.6 | Low | 128 Ų | 128 | 125 Ų | 125 | 83% | 0.831 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 126 | 174.1 | 27.1 | -32.2 | 0 | 0 | 0 | 109.7 | A27 | P25-A27 PolarHBondContact O-N 3.04Š|
| 26 | M | 72.4 | Confident | 69.3 | Low | 180 Ų | 180 | 125.5 Ų | 125.5 | 89% | 0.887 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 126.3 | 172.2 | -65.7 | -171.8 | -68.2 | 0 | 0 | 109 | P24 S28 | P24-M26 PolarHBondContact O-N 3.47Å; M26-S28 PolarHBondContact O-N 2.68Å |
| 27 | A | 70.6 | Confident | 68.6 | Low | 103 Ų | 103 | 129.2 Ų | 129.2 | 85% | 0.851 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 122 | 170.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | P25 A29 | P25-A27 PolarHBondContact O-N 3.04Å; A27-A29 PolarHBondContact O-N 3.48Å |
| 28 | S | 67.8 | Low | 68.1 | Low | 118 Ų | 118 | 132.4 Ų | 132.4 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 126.8 | 174.9 | -48.7 | 0 | 0 | 0 | 0 | 110.1 | M26 | M26-S28 PolarHBondContact O-N 2.68Š|
| 29 | A | 69.5 | Low | 67.1 | Low | 84 Ų | 84 | 125.1 Ų | 125.1 | 69% | 0.694 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 148.9 | 170.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | A27 S31 | A27-A29 PolarHBondContact O-N 3.48Å; A29-S31 PolarHBondContact O-N 3.14Å |
| 30 | P | 64.2 | Low | 65.9 | Low | 112 Ų | 112 | 125.1 Ų | 125.1 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 122.9 | 176.2 | 24.3 | -31.4 | 0 | 0 | 0 | 110.5 | H32 | P30-H32 PolarHBondContact O-N 3.01Å; P30-H32 PolarHBondContact O-ND1 3Å |
| 31 | S | 61.8 | Low | 64.9 | Low | 122 Ų | 122 | 125.8 Ų | 125.8 | 85% | 0.853 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 118.7 | 168.9 | -66.6 | 0 | 0 | 0 | 0 | 109.2 | A29 A33 | A29-S31 PolarHBondContact O-N 3.14Å; S31-A33 PolarHBondContact O-N 3.38Å |
| 32 | H | 62.5 | Low | 63.8 | Low | 179 Ų | 179 | 125.5 Ų | 125.5 | 83% | 0.829 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 121.4 | 169.5 | -71.9 | 60.5 | 0 | 0 | 0 | 108 | P30 | P30-H32 PolarHBondContact O-N 3.01Å; P30-H32 PolarHBondContact O-ND1 3Å |
| 33 | A | 64.2 | Low | 62.5 | Low | 87 Ų | 87 | 124.6 Ų | 124.6 | 72% | 0.719 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 137.9 | 172 | 0 | 0 | 0 | 0 | 0 | 109.4 | S31 V35 | S31-A33 PolarHBondContact O-N 3.38Å; A33-V35 PolarHBondContact O-N 3.29Å |
| 34 | P | 60.2 | Low | 61 | Low | 125 Ų | 125 | 125.9 Ų | 125.9 | 81% | 0.812 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 127.7 | 176.2 | 26.5 | -31.4 | 0 | 0 | 0 | 109.8 | ||
| 35 | V | 62.3 | Low | 59.4 | Low | 130 Ų | 130 | 123.9 Ų | 123.9 | 79% | 0.788 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 140 | 167.2 | -71.1 | 0 | 0 | 0 | 0 | 109.5 | A33 M37 | A33-V35 PolarHBondContact O-N 3.29Å; V35-M37 PolarHBondContact O-N 2.03Å; V35-M37 VanDerWaalsContact O-N 3.13Å |
| 36 | P | 59.6 | Low | 58.1 | Low | 132 Ų | 132 | 122.4 Ų | 122.4 | 86% | 0.857 | 81% | 0.805 | S | S | * | * | trans | -66.4 | 116 | 179.5 | 24.4 | -30.5 | 0 | 0 | 0 | 110.5 | Q38 | P36-Q38 PolarHBondContact O-N 2.85Š| ||
| 37 | M | 53.8 | Low | 57.2 | Low | 180 Ų | 180 | 119.9 Ų | 119.9 | 89% | 0.887 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 118.9 | 171.1 | -172.4 | 72.4 | 157.1 | 0 | 0 | 109.3 | V35 A39 | V35-M37 PolarHBondContact O-N 2.03Å; V35-M37 VanDerWaalsContact O-N 3.13Å; M37-A39 PolarHBondContact O-N 3.41Å |
| 38 | Q | 57.3 | Low | 56.6 | Low | 190 Ų | 190 | 119.7 Ų | 119.7 | 89% | 0.888 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 121.9 | 171.9 | -143.5 | 167.6 | -9.2 | 0 | 0 | 108.5 | P36 | P36-Q38 PolarHBondContact O-N 2.85Š|
| 39 | A | 50 | Low | 55.8 | Low | 93 Ų | 93 | 118.8 Ų | 118.8 | 77% | 0.769 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 137.8 | -169.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | M37 | M37-A39 PolarHBondContact O-N 3.41Š|
| 40 | A | 50.2 | Low | 55.1 | Low | 88 Ų | 88 | 119.5 Ų | 119.5 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 133.3 | 167 | 0 | 0 | 0 | 0 | 0 | 110.7 | S42 | A40-S42 PolarHBondContact O-N 3.38Š|
| 41 | P | 54.8 | Low | 54.5 | Low | 129 Ų | 129 | 118.8 Ų | 118.8 | 84% | 0.838 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 116.9 | 163.9 | 28.5 | -28.4 | 0 | 0 | 0 | 110.3 | ||
| 42 | S | 51 | Low | 54.2 | Low | 117 Ų | 117 | 123.4 Ų | 123.4 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 163 | 171.2 | -67.8 | 0 | 0 | 0 | 0 | 112.9 | A40 | A40-S42 PolarHBondContact O-N 3.38Š|
| 43 | A | 51.3 | Low | 53.7 | Low | 95 Ų | 95 | 123.5 Ų | 123.5 | 79% | 0.785 | 80% | 0.801 | S | S | * | * | trans | 92.1 | 127.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 44 | V | 44.4 | Very low | 53.2 | Low | 142 Ų | 142 | 125.7 Ų | 125.7 | 86% | 0.861 | 81% | 0.808 | S | S | * | * | cis | -156.3 | 150.9 | 50 | 178.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 45 | G | 46.4 | Very low | 52.8 | Low | 67 Ų | 67 | 122.2 Ų | 122.2 | 69% | 0.691 | 80% | 0.795 | S | S | * | * | trans | -64.2 | 168.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 46 | A | 45.6 | Very low | 52.9 | Low | 97 Ų | 97 | 124.1 Ų | 124.1 | 80% | 0.802 | 80% | 0.8 | S | S | * | * | trans | -46.5 | 164.9 | 171.2 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 47 | P | 53.9 | Low | 52.7 | Low | 127 Ų | 127 | 127 Ų | 127 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | cis | -138.7 | -172.5 | 21.4 | 36.7 | -13.6 | 0 | 0 | 0 | 115.5 | ||||
| 48 | A | 58.3 | Low | 52.6 | Low | 99 Ų | 99 | 123.5 Ų | 123.5 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | -50 | 142.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 49 | A | 49.4 | Very low | 52.5 | Low | 99 Ų | 99 | 121.9 Ų | 121.9 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | 176.9 | 136.4 | 134.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 50 | A | 55.9 | Low | 52.7 | Low | 99 Ų | 99 | 126.1 Ų | 126.1 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | trans | -57.4 | 161.3 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 51 | P | 51.6 | Low | 52.8 | Low | 97 Ų | 97 | 125.9 Ų | 125.9 | 63% | 0.63 | 80% | 0.796 | S | S | * | * | -155.4 | 161.9 | 103 | 37.9 | -17.9 | 0 | 0 | 0 | 118.4 | |||||
| 52 | R | 55.8 | Low | 52.8 | Low | 219 Ų | 219 | 126.7 Ų | 126.7 | 83% | 0.826 | 80% | 0.799 | S | S | * | * | trans | 68.3 | 86.1 | 138 | 67.3 | -167.6 | 59.3 | 172.3 | -1.4 | 122.9 | ||||
| 53 | Q | 52.3 | Low | 53 | Low | 182 Ų | 182 | 127 Ų | 127 | 85% | 0.85 | 80% | 0.796 | S | S | * | * | trans | 9.3 | 134.5 | 131.2 | -56.8 | -90.1 | -79.4 | 0 | 0 | 119.8 | ||||
| 54 | P | 52.6 | Low | 53 | Low | 133 Ų | 133 | 127.3 Ų | 127.3 | 86% | 0.864 | 80% | 0.798 | S | S | * | * | trans | -119.4 | 111.6 | 130.8 | 21.8 | -4.9 | 0 | 0 | 0 | 108.3 | ||||
| 55 | G | 52.5 | Low | 53.2 | Low | 52 Ų | 52 | 124.5 Ų | 124.5 | 54% | 0.536 | 79% | 0.79 | S | S | . | * | 100.5 | 115.6 | 61.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | F57 | G55-F57 PolarHBondContact O-N 2.97Š| |||
| 56 | L | 63.5 | Low | 52.7 | Low | 170 Ų | 170 | 124.4 Ų | 124.4 | 89% | 0.89 | 79% | 0.789 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.6 | 29.6 | -173.5 | -78.5 | 138.5 | 0 | 0 | 0 | 117.6 | ||
| 57 | F | 56.1 | Low | 52.8 | Low | 191 Ų | 191 | 127.3 Ų | 127.3 | 84% | 0.838 | 80% | 0.796 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.2 | 1.1 | -173.2 | -81.6 | -87.5 | 0 | 0 | 0 | 116.1 | G55 Q59 | G55-F57 PolarHBondContact O-N 2.97Å; F57-Q59 PolarHBondContact O-N 3.39Å |
| 58 | A | 51.7 | Low | 53.1 | Low | 107 Ų | 107 | 125 Ų | 125 | 88% | 0.884 | 79% | 0.788 | S | S | * | * | trans | -80.4 | 16.7 | 167 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 59 | Q | 55.9 | Low | 52.7 | Low | 156 Ų | 156 | 127.3 Ų | 127.3 | 73% | 0.729 | 79% | 0.792 | S | S | * | * | trans | -57.9 | 155.6 | 153.2 | -86.8 | -157.4 | -8.5 | 0 | 0 | 110 | F57 | F57-Q59 PolarHBondContact O-N 3.39Š| ||
| 60 | M | 53.3 | Low | 52.2 | Low | 182 Ų | 182 | 125.7 Ų | 125.7 | 90% | 0.897 | 79% | 0.785 | S | S | * | * | S | Bend | trans | 96.4 | -18.3 | 142.9 | -148.6 | 175.3 | -161.3 | 0 | 0 | 119.1 | ||
| 61 | A | 53.3 | Low | 52 | Low | 84 Ų | 84 | 127.3 Ų | 127.3 | 69% | 0.694 | 79% | 0.79 | S | S | * | * | trans | -126.8 | 55.7 | -166.1 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 62 | T | 53.2 | Low | 52.1 | Low | 146 Ų | 146 | 126.7 Ų | 126.7 | 90% | 0.896 | 79% | 0.793 | S | S | * | * | trans | -167.4 | 83.3 | 144.7 | 8 | 0 | 0 | 0 | 0 | 112.7 | A64 | T62-A64 PolarHBondContact O-N 3.47Š| ||
| 63 | T | 55.8 | Low | 51.7 | Low | 123 Ų | 123 | 123 Ų | 123 | 76% | 0.755 | 79% | 0.794 | S | S | * | * | trans | -37.9 | 118.3 | 156.4 | -37 | 0 | 0 | 0 | 0 | 113.1 | A65 | T63-A65 HydrophobicContact CG2-CB 3.83Š| ||
| 64 | A | 51.4 | Low | 50.9 | Low | 102 Ų | 102 | 117.3 Ų | 117.3 | 84% | 0.843 | 78% | 0.784 | S | S | * | * | trans | -111 | 67 | 149.6 | 0 | 0 | 0 | 0 | 0 | 106.3 | T62 | T62-A64 PolarHBondContact O-N 3.47Š| ||
| 65 | A | 49.6 | Very low | 50.4 | Low | 82 Ų | 82 | 119.2 Ų | 119.2 | 68% | 0.678 | 78% | 0.781 | S | S | * | * | 47 | 67.1 | 80.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | T63 | T63-A65 HydrophobicContact CG2-CB 3.83Š| |||
| 66 | G | 35 | Very low | 50.6 | Low | 65 Ų | 65 | 123 Ų | 123 | 67% | 0.67 | 79% | 0.794 | S | S | * | * | 87.3 | 87.7 | 128.3 | 0 | 0 | 0 | 0 | 0 | 117 | |||||
| 67 | V | 47 | Very low | 50 | Low | 159 Ų | 159 | 123 Ų | 123 | 96% | 0.964 | 79% | 0.793 | S | S | * | * | -125.5 | 113.7 | 120.4 | -88.6 | 0 | 0 | 0 | 0 | 106.8 | |||||
| 68 | A | 60.2 | Low | 49.3 | Very low | 79 Ų | 79 | 116.6 Ų | 116.6 | 65% | 0.653 | 78% | 0.782 | S | S | * | * | trans | -121.6 | 157.1 | -162.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 69 | V | 49.9 | Very low | 49.1 | Very low | 147 Ų | 147 | 121 Ų | 121 | 89% | 0.891 | 78% | 0.784 | S | S | * | * | trans | 77.1 | 120.6 | 154.8 | -159.5 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 70 | G | 39.7 | Very low | 48.7 | Very low | 65 Ų | 65 | 117.3 Ų | 117.3 | 67% | 0.67 | 78% | 0.779 | S | S | * | * | cis | -156 | 132.3 | 30.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 71 | S | 50.8 | Low | 48.5 | Very low | 132 Ų | 132 | 116.3 Ų | 116.3 | 92% | 0.923 | 77% | 0.774 | S | S | * | * | trans | -71.1 | 120.1 | 141.8 | -63.1 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 72 | A | 55.3 | Low | 48.5 | Very low | 84 Ų | 84 | 119.2 Ų | 119.2 | 69% | 0.694 | 78% | 0.784 | S | S | * | * | trans | -160.2 | 104.4 | 150.4 | 0 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 73 | V | 46.2 | Very low | 47.9 | Very low | 142 Ų | 142 | 116 Ų | 116 | 86% | 0.861 | 78% | 0.78 | S | S | * | * | 49.3 | 106.2 | 96.2 | -176.5 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 74 | G | 35.4 | Very low | 47.6 | Very low | 62 Ų | 62 | 113.3 Ų | 113.3 | 64% | 0.639 | 78% | 0.777 | S | S | * | * | trans | 142.9 | 77 | 162 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 75 | H | 42.4 | Very low | 47.5 | Very low | 173 Ų | 173 | 118.6 Ų | 118.6 | 80% | 0.801 | 78% | 0.781 | S | S | * | * | 71.6 | 120.5 | 90.2 | -77.8 | 67.6 | 0 | 0 | 0 | 114 | |||||
| 76 | T | 57.5 | Low | 47.3 | Very low | 132 Ų | 132 | 120.3 Ų | 120.3 | 81% | 0.81 | 79% | 0.788 | S | S | * | * | trans | 147.6 | 91.2 | 145.7 | 47.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 77 | I | 51.1 | Low | 47.7 | Very low | 169 Ų | 169 | 120.7 Ų | 120.7 | 87% | 0.867 | 79% | 0.792 | S | S | * | * | S | Bend | 172.4 | 139.6 | 71.2 | -84.2 | 145.5 | 0 | 0 | 0 | 104.4 | |||
| 78 | G | 41.7 | Very low | 47.6 | Very low | 58 Ų | 58 | 116.7 Ų | 116.7 | 60% | 0.598 | 78% | 0.782 | S | S | * | * | cis | -125 | 144.1 | 7.4 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 79 | H | 46.3 | Very low | 46.8 | Very low | 200 Ų | 200 | 123.4 Ų | 123.4 | 93% | 0.926 | 79% | 0.791 | S | S | * | * | 44.3 | 72.6 | 70.9 | -103.3 | -87.9 | 0 | 0 | 0 | 111.4 | |||||
| 80 | A | 48.1 | Very low | 46.6 | Very low | 77 Ų | 77 | 120.6 Ų | 120.6 | 64% | 0.636 | 78% | 0.778 | S | S | * | * | 170.6 | 130.6 | 119.6 | 0 | 0 | 0 | 0 | 0 | 107.1 | |||||
| 81 | M | 48.8 | Very low | 47.1 | Very low | 161 Ų | 161 | 125.5 Ų | 125.5 | 79% | 0.793 | 78% | 0.783 | S | S | * | * | cis | -169.8 | 131.4 | 9.4 | -104.2 | 159.6 | -174.5 | 0 | 0 | 100.9 | ||||
| 82 | T | 53 | Low | 46.5 | Very low | 145 Ų | 145 | 124.2 Ų | 124.2 | 89% | 0.89 | 78% | 0.781 | S | S | * | * | 47.8 | 103 | 97.7 | -53.6 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 83 | G | 41.4 | Very low | 45.6 | Very low | 80 Ų | 80 | 124.5 Ų | 124.5 | 83% | 0.825 | 78% | 0.783 | S | S | * | * | trans | 101.9 | 121.6 | 167.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 84 | G | 49.7 | Very low | 45.4 | Very low | 66 Ų | 66 | 123.1 Ų | 123.1 | 68% | 0.68 | 78% | 0.78 | S | S | * | * | cis | -176.4 | -179.5 | 8 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 85 | F | 48.9 | Very low | 46 | Very low | 213 Ų | 213 | 125.9 Ų | 125.9 | 93% | 0.934 | 79% | 0.786 | S | S | * | * | trans | -21 | 152.9 | 163.8 | -61 | -92.8 | 0 | 0 | 0 | 117.2 | ||||
| 86 | S | 44.4 | Very low | 45.9 | Very low | 118 Ų | 118 | 124 Ų | 124 | 83% | 0.825 | 78% | 0.782 | S | S | * | * | trans | 89.7 | 113.9 | 169.4 | -154.8 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 87 | G | 43.2 | Very low | 45.2 | Very low | 72 Ų | 72 | 124.3 Ų | 124.3 | 74% | 0.742 | 78% | 0.784 | S | S | * | * | 86.6 | 99.3 | 54.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 88 | G | 45.8 | Very low | 45 | Very low | 75 Ų | 75 | 122.1 Ų | 122.1 | 77% | 0.773 | 78% | 0.778 | S | S | * | * | trans | 87.3 | 148.5 | 156.7 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 89 | R | 42.5 | Very low | 44.8 | Very low | 220 Ų | 220 | 128.3 Ų | 128.3 | 83% | 0.83 | 79% | 0.785 | S | S | * | * | trans | 77.4 | 101.5 | 159.8 | -148.3 | 67.6 | -176.1 | -143.8 | 3.1 | 115.6 | ||||
| 90 | S | 47.3 | Very low | 44.4 | Very low | 88 Ų | 88 | 124.8 Ų | 124.8 | 62% | 0.615 | 77% | 0.769 | S | S | * | * | 54.4 | 126.7 | 99.3 | -61.5 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 91 | E | 49 | Very low | 43.8 | Very low | 169 Ų | 169 | 126.6 Ų | 126.6 | 79% | 0.79 | 76% | 0.764 | S | S | * | * | trans | 70.4 | 123.2 | 151.9 | 82.2 | -150.5 | 76.9 | 0 | 0 | 121.7 | ||||
| 92 | A | 38 | Very low | 43.5 | Very low | 105 Ų | 105 | 123.4 Ų | 123.4 | 87% | 0.868 | 76% | 0.756 | S | S | * | * | trans | 153.2 | 136.2 | 144.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 93 | A | 36.7 | Very low | 42.6 | Very low | 89 Ų | 89 | 123.2 Ų | 123.2 | 74% | 0.736 | 74% | 0.739 | S | S | * | * | cis | -168 | 135.6 | 0.5 | 0 | 0 | 0 | 0 | 0 | 103.6 | ||||
| 94 | S | 42.4 | Very low | 42.7 | Very low | 114 Ų | 114 | 126.9 Ų | 126.9 | 80% | 0.797 | 74% | 0.735 | S | S | * | * | 166.3 | 162.2 | 80.3 | -94.4 | 0 | 0 | 0 | 0 | 108.6 | |||||
| 95 | P | 49 | Very low | 42.3 | Very low | 120 Ų | 120 | 130.9 Ų | 130.9 | 78% | 0.779 | 74% | 0.736 | S | S | * | * | trans | -96.1 | 175.8 | -150.1 | 32.9 | -21.3 | 0 | 0 | 0 | 113.4 | ||||
| 96 | D | 39.1 | Very low | 42 | Very low | 134 Ų | 134 | 129.1 Ų | 129.1 | 72% | 0.717 | 73% | 0.731 | S | S | * | * | trans | 91.7 | 77.1 | 170.7 | -153.4 | -116.8 | 0 | 0 | 0 | 116.7 | ||||
| 97 | V | 43.3 | Very low | 42.1 | Very low | 138 Ų | 138 | 126.2 Ų | 126.2 | 84% | 0.836 | 71% | 0.714 | S | S | * | * | -127.5 | 77.1 | 129.9 | -177.4 | 0 | 0 | 0 | 0 | 106.4 | Y99 | V97-Y99 PolarHBondContact O-N 2.8Š| |||
| 98 | T | 46.2 | Very low | 42.6 | Very low | 122 Ų | 122 | 124.2 Ų | 124.2 | 75% | 0.748 | 69% | 0.693 | S | S | * | * | trans | -66.9 | 86.5 | 150.6 | -70.4 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 99 | Y | 37.6 | Very low | 42.9 | Very low | 189 Ų | 189 | 125.8 Ų | 125.8 | 74% | 0.741 | 68% | 0.68 | S | S | * | * | trans | -130.7 | 68.6 | 150.7 | -156.7 | -88.9 | 0 | 0 | 0 | 107.4 | V97 E101 | V97-Y99 PolarHBondContact O-N 2.8Å; Y99-E101 HydrophobicContact CE1-CB 4.09Å; Y99-E101 PolarHBondContact O-N 3.41Å | ||
| 100 | Q | 38.2 | Very low | 43.6 | Very low | 125 Ų | 125 | 121.3 Ų | 121.3 | 58% | 0.584 | 67% | 0.669 | S | S | * | * | trans | -61.7 | 114.1 | 143.3 | -102.3 | -131.9 | 106.5 | 0 | 0 | 106.5 | ||||
| 101 | E | 35.8 | Very low | 44.1 | Very low | 115 Ų | 115 | 118.5 Ų | 118.5 | 54% | 0.537 | 65% | 0.646 | S | S | . | * | trans | -155.9 | 75.7 | 130.1 | -92.6 | -61.2 | 93.7 | 0 | 0 | 109.3 | Y99 Y103 | Y99-E101 HydrophobicContact CE1-CB 4.09Å; Y99-E101 PolarHBondContact O-N 3.41Å; E101-Y103 PolarHBondContact O-N 3.04Å; E101-Y103 WeakPolarHBondContact OE1-CD2 3.38Å; E101-Y103 VanDerWaalsContact OE1-CE2 3.3Å; E101-Y103 WeakPolarHBondContact OE1-CE2 3.42Å; E101-Y103 WeakPolarHBondContact OE2-CB 3.36Å | ||
| 102 | P | 41.6 | Very low | 44.8 | Very low | 95 Ų | 95 | 114.5 Ų | 114.5 | 62% | 0.617 | 63% | 0.628 | S | S | * | * | trans | -79.6 | 28.8 | 160.6 | 33.2 | -33.4 | 0 | 0 | 0 | 112.6 | Q104 | P102-Q104 PolarHBondContact O-N 3.47Š| ||
| 103 | Y | 35.7 | Very low | 46.1 | Very low | 141 Ų | 141 | 116.5 Ų | 116.5 | 55% | 0.553 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.4 | 9.9 | -171.9 | -71.8 | -94.7 | 0 | 0 | 0 | 115.6 | E101 | E101-Y103 PolarHBondContact O-N 3.04Å; E101-Y103 WeakPolarHBondContact OE1-CD2 3.38Å; E101-Y103 VanDerWaalsContact OE1-CE2 3.3Å; E101-Y103 WeakPolarHBondContact OE1-CE2 3.42Å; E101-Y103 WeakPolarHBondContact OE2-CB 3.36Å |
| 104 | Q | 41.5 | Very low | 48.1 | Very low | 157 Ų | 157 | 115.4 Ų | 115.4 | 73% | 0.734 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.1 | -14.6 | 172.5 | -86.3 | -71.7 | -82.9 | 0 | 0 | 115.3 | P102 G108 | P102-Q104 PolarHBondContact O-N 3.47Å; Q104-G108 PolarHBondContact O-N 3.42Å |
| 105 | Q | 42.4 | Very low | 50.3 | Low | 150 Ų | 150 | 110 Ų | 110 | 70% | 0.701 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -80.3 | -27.4 | -178.8 | -105.1 | -149.5 | -5.6 | 0 | 0 | 114.1 | G108 Q109 | Q105-G108 PolarHBondContact O-N 3Å; Q105-Q109 WeakPolarHBondContact O-CB 3.46Å; Q105-Q109 VanDerWaalsContact O-CG 3.26Å; Q105-Q109 WeakPolarHBondContact O-CG 3.32Å; Q105-Q109 PolarHBondContact O-N 3.17Å |
| 106 | Q | 42.1 | Very low | 52 | Low | 176 Ų | 176 | 107.2 Ų | 107.2 | 82% | 0.822 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -76.8 | -33.2 | -174.1 | -157 | 158.4 | -87.7 | 0 | 0 | 112.9 | ||
| 107 | A | 47.8 | Very low | 54.3 | Low | 56 Ų | 56 | 108.4 Ų | 108.4 | 46% | 0.463 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -76.6 | -32.8 | 170.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q111 | A107-Q111 WeakPolarHBondContact O-CB 3.48Å; A107-Q111 PolarHBondContact O-N 2.93Å; A107-Q111 VanDerWaalsContact O-N 3.16Å |
| 108 | G | 53.1 | Low | 56.4 | Low | 31 Ų | 31 | 104 Ų | 104 | 32% | 0.32 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.3 | -35.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q104 Q105 Q112 | Q104-G108 PolarHBondContact O-N 3.42Å; Q105-G108 PolarHBondContact O-N 3Å; G108-Q112 WeakPolarHBondContact O-CB 3.01Å; G108-Q112 PolarHBondContact O-N 3.31Å |
| 109 | Q | 52.3 | Low | 58.3 | Low | 107 Ų | 107 | 99.7 Ų | 99.7 | 50% | 0.5 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -67.3 | -41.7 | 178.2 | -78.8 | -83 | 53.7 | 0 | 0 | 112.7 | Q105 Q112 E113 | Q105-Q109 WeakPolarHBondContact O-CB 3.46Å; Q105-Q109 VanDerWaalsContact O-CG 3.26Å; Q105-Q109 WeakPolarHBondContact O-CG 3.32Å; Q105-Q109 PolarHBondContact O-N 3.17Å; Q109-Q112 WeakPolarHBondContact O-CB 3.05Å; Q109-Q112 PolarHBondContact O-N 3.46Å; Q109-E113 PolarHBondContact O-N 3.38Å |
| 110 | Q | 56.5 | Low | 60.7 | Low | 126 Ų | 126 | 97 Ų | 97 | 59% | 0.589 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -72.4 | -36.6 | 177.7 | -153.9 | -166.9 | 18.4 | 0 | 0 | 111.7 | Q112 E113 V114 F151 | Q110-Q112 VanDerWaalsContact C-N 3.29Å; Q110-E113 PolarHBondContact O-N 3.26Å; Q110-V114 WeakPolarHBondContact O-CG2 3.46Å; Q110-V114 PolarHBondContact O-N 3.06Å; Q110-F151 HydrophobicContact CB-CE1 4.33Å; Q110-F151 HydrophobicContact CB-CZ 4.38Å; Q110-F151 HydrophobicContact CG-CZ 4.28Å |
| 111 | Q | 59 | Low | 63.1 | Low | 29 Ų | 29 | 93.3 Ų | 93.3 | 14% | 0.136 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -62.6 | -37.4 | 170.7 | 177.2 | 125.3 | 73.5 | 0 | 0 | 111.8 | A107 E113 V114 C115 | A107-Q111 WeakPolarHBondContact O-CB 3.48Å; A107-Q111 PolarHBondContact O-N 2.93Å; A107-Q111 VanDerWaalsContact O-N 3.16Å; Q111-E113 VanDerWaalsContact C-N 3.32Å; Q111-E113 PolarHBondContact O-N 2.86Å; Q111-V114 PolarHBondContact O-N 3.27Å; Q111-C115 WeakPolarHBondContact O-CB 3.26Å; Q111-C115 PolarHBondContact O-N 3.46Å |
| 112 | Q | 62.1 | Low | 65.6 | Low | 86 Ų | 86 | 90.2 Ų | 90.2 | 40% | 0.402 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -65.2 | -34.4 | 177 | 179.3 | 154.8 | 23.5 | 0 | 0 | 111.6 | G108 Q109 Q110 S116 L119 | G108-Q112 WeakPolarHBondContact O-CB 3.01Å; G108-Q112 PolarHBondContact O-N 3.31Å; Q109-Q112 WeakPolarHBondContact O-CB 3.05Å; Q109-Q112 PolarHBondContact O-N 3.46Å; Q110-Q112 VanDerWaalsContact C-N 3.29Å; Q112-S116 WeakPolarHBondContact O-CA 3.05Å; Q112-S116 WeakPolarHBondContact O-CB 3.26Å; Q112-S116 PolarHBondContact O-N 2.78Å; Q112-L119 HydrophobicContact CB-CD2 3.85Å; Q112-L119 HydrophobicContact CG-CD2 3.86Å |
| 113 | E | 66.5 | Low | 67.7 | Low | 146 Ų | 146 | 89.8 Ų | 89.8 | 68% | 0.682 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -71.6 | -43.4 | 176.5 | -68.5 | -71.7 | 103.8 | 0 | 0 | 112 | Q109 Q110 Q111 S116 | Q109-E113 PolarHBondContact O-N 3.38Å; Q110-E113 PolarHBondContact O-N 3.26Å; Q111-E113 VanDerWaalsContact C-N 3.32Å; Q111-E113 PolarHBondContact O-N 2.86Å; E113-S116 PolarHBondContact O-OG 3.02Å |
| 114 | V | 78.9 | Confident | 70.2 | Confident | 67 Ų | 67 | 88.1 Ų | 88.1 | 41% | 0.406 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -81.3 | -34.6 | -173 | -177.3 | 0 | 0 | 0 | 0 | 113.1 | Q110 Q111 N149 F151 | Q110-V114 WeakPolarHBondContact O-CG2 3.46Å; Q110-V114 PolarHBondContact O-N 3.06Å; Q111-V114 PolarHBondContact O-N 3.27Å; V114-N149 HydrophobicContact CG1-CB 4.04Å; V114-N149 WeakPolarHBondContact CG1-ND2 3.18Å; V114-N149 WeakPolarHBondContact CG1-OD1 2.88Å; V114-F151 HydrophobicContact CB-CE2 4.23Å; V114-F151 HydrophobicContact CG1-CE2 4.48Å; V114-F151 HydrophobicContact CG2-CE2 4.34Å; V114-F151 HydrophobicContact CG2-CZ 4.46Å |
| 115 | C | 88.4 | Confident | 72.5 | Confident | 0 Ų | 0 | 81.8 Ų | 81.8 | 0% | 0 | 41% | 0.409 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -112.3 | 28.2 | 176.6 | -56.2 | 0 | 0 | 0 | 0 | 111.8 | Q111 Y117 E118 L119 L142 C145 | Q111-C115 WeakPolarHBondContact O-CB 3.26Å; Q111-C115 PolarHBondContact O-N 3.46Å; C115-Y117 VanDerWaalsContact C-N 3.29Å; C115-Y117 PolarHBondContact O-N 3.39Å; C115-E118 PolarHBondContact O-N 2.98Å; C115-L119 WeakPolarHBondContact O-CB 3.19Å; C115-L119 PolarHBondContact O-N 3.1Å; C115-L142 HydrophobicContact CB-CD1 3.95Å; C115-C145 WeakPolarHBondContact CA-SG 3.17Å; C115-C145 HydrophobicContact CB-CB 3.86Å; C115-C145 WeakPolarHBondContact CB-SG 3.42Å; C115-C145 WeakPolarHBondContact SG-CB 3.33Å; C115-C145 CovalentContact SG-SG 2.03Å; C115-C145 PolarHBondContact SG-SG 3.45Å |
| 116 | S | 84.6 | Confident | 74.6 | Confident | 62 Ų | 62 | 76.2 Ų | 76.2 | 43% | 0.434 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -52.2 | -43.5 | -174.9 | 41.1 | 0 | 0 | 0 | 0 | 113.5 | Q112 E113 K120 | Q112-S116 WeakPolarHBondContact O-CA 3.05Å; Q112-S116 WeakPolarHBondContact O-CB 3.26Å; Q112-S116 PolarHBondContact O-N 2.78Å; E113-S116 PolarHBondContact O-OG 3.02Å; S116-K120 WeakPolarHBondContact O-CB 3.49Å; S116-K120 PolarHBondContact O-N 3.25Å |
| 117 | Y | 87.4 | Confident | 76.7 | Confident | 159 Ų | 159 | 76.2 Ų | 76.2 | 62% | 0.624 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -68.4 | -55.6 | -176 | -179.3 | -101.5 | 0 | 0 | 0 | 111.1 | C115 L119 K120 Q121 | C115-Y117 VanDerWaalsContact C-N 3.29Å; C115-Y117 PolarHBondContact O-N 3.39Å; Y117-L119 VanDerWaalsContact C-N 3.29Å; Y117-L119 PolarHBondContact O-N 3.28Å; Y117-K120 PolarHBondContact O-N 3.47Å; Y117-Q121 HydrophobicContact CE1-CG 4.34Å; Y117-Q121 WeakPolarHBondContact O-CG 3.36Å; Y117-Q121 PolarHBondContact O-N 3.36Å |
| 118 | E | 87.6 | Confident | 78.5 | Confident | 46 Ų | 46 | 79.6 Ų | 79.6 | 22% | 0.215 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -58.9 | -40 | 176.5 | -70 | 84.8 | 102 | 0 | 0 | 112.7 | C115 Q121 F122 V141 L142 C145 | C115-E118 PolarHBondContact O-N 2.98Å; E118-Q121 PolarHBondContact O-N 3.35Å; E118-F122 PolarHBondContact O-N 3.01Å; E118-V141 HydrophobicContact CG-CB 4Å; E118-V141 HydrophobicContact CG-CG1 3.46Å; E118-V141 VanDerWaalsContact CG-CG1 3.46Å; E118-L142 HydrophobicContact CB-CB 4.11Å; E118-L142 HydrophobicContact CB-CD1 3.99Å; E118-C145 VanDerWaalsContact OE1-CB 3.3Å; E118-C145 WeakPolarHBondContact OE1-CB 3.26Å |
| 119 | L | 85.6 | Confident | 79.5 | Confident | 31 Ų | 31 | 82.8 Ų | 82.8 | 16% | 0.162 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -65.4 | -45.3 | 179 | -179.4 | 64.9 | 0 | 0 | 0 | 110.4 | Q112 C115 Y117 Q121 F122 L123 L142 | Q112-L119 HydrophobicContact CB-CD2 3.85Å; Q112-L119 HydrophobicContact CG-CD2 3.86Å; C115-L119 WeakPolarHBondContact O-CB 3.19Å; C115-L119 PolarHBondContact O-N 3.1Å; Y117-L119 VanDerWaalsContact C-N 3.29Å; Y117-L119 PolarHBondContact O-N 3.28Å; L119-Q121 VanDerWaalsContact C-N 3.32Å; L119-Q121 PolarHBondContact O-N 3.31Å; L119-F122 PolarHBondContact O-N 3.35Å; L119-L123 HydrophobicContact CD1-CD1 3.56Å; L119-L123 HydrophobicContact CG-CD1 3.99Å; L119-L123 WeakPolarHBondContact O-CB 3.4Å; L119-L123 WeakPolarHBondContact O-CD1 3.37Å; L119-L123 PolarHBondContact O-N 3.22Å; L119-L142 HydrophobicContact CB-CD1 3.81Å; L119-L142 HydrophobicContact CD1-CD1 4.24Å; L119-L142 HydrophobicContact CD1-CD2 3.8Å |
| 120 | K | 87.4 | Confident | 80.6 | Confident | 132 Ų | 132 | 82.9 Ų | 82.9 | 57% | 0.574 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -61.7 | -42.2 | 177.2 | -178.5 | 174.2 | 174.5 | 170.5 | 0 | 111.3 | S116 Y117 F122 L123 E124 | S116-K120 WeakPolarHBondContact O-CB 3.49Å; S116-K120 PolarHBondContact O-N 3.25Å; Y117-K120 PolarHBondContact O-N 3.47Å; K120-F122 VanDerWaalsContact C-N 3.34Å; K120-F122 PolarHBondContact O-N 2.74Å; K120-L123 PolarHBondContact O-N 2.75Å; K120-E124 WeakPolarHBondContact O-CB 3.38Å; K120-E124 PolarHBondContact O-N 3.28Å |
| 121 | Q | 88.3 | Confident | 81.8 | Confident | 47 Ų | 47 | 81.4 Ų | 81.4 | 22% | 0.22 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -62.9 | -40.6 | 177.3 | -68.4 | -58.2 | 112.5 | 0 | 0 | 112.1 | Y117 E118 L119 C125 F138 | Y117-Q121 HydrophobicContact CE1-CG 4.34Å; Y117-Q121 WeakPolarHBondContact O-CG 3.36Å; Y117-Q121 PolarHBondContact O-N 3.36Å; E118-Q121 PolarHBondContact O-N 3.35Å; L119-Q121 VanDerWaalsContact C-N 3.32Å; L119-Q121 PolarHBondContact O-N 3.31Å; Q121-C125 VanDerWaalsContact O-CB 3.26Å; Q121-C125 WeakPolarHBondContact O-CB 3.38Å; Q121-C125 PolarHBondContact O-N 3.22Å; Q121-F138 HydrophobicContact CB-CD1 3.6Å; Q121-F138 HydrophobicContact CB-CE1 3.97Å; Q121-F138 HydrophobicContact CB-CG 4.21Å; Q121-F138 HydrophobicContact CG-CD1 4.39Å; Q121-F138 HydrophobicContact CG-CE1 4.39Å |
| 122 | F | 88.3 | Confident | 82.8 | Confident | 51 Ų | 51 | 84.8 Ų | 84.8 | 22% | 0.224 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -66.4 | -44.6 | 174.7 | 179.4 | -102.9 | 0 | 0 | 0 | 111.9 | E118 L119 K120 C125 A126 L132 C135 F138 L142 | E118-F122 PolarHBondContact O-N 3.01Å; L119-F122 PolarHBondContact O-N 3.35Å; K120-F122 VanDerWaalsContact C-N 3.34Å; K120-F122 PolarHBondContact O-N 2.74Å; F122-C125 PolarHBondContact O-N 3.49Å; F122-A126 VanDerWaalsContact O-CB 3.32Å; F122-A126 WeakPolarHBondContact O-CB 3.21Å; F122-A126 PolarHBondContact O-N 3.29Å; F122-L132 HydrophobicContact CZ-CD2 4.26Å; F122-C135 HydrophobicContact CD2-CB 4.12Å; F122-C135 HydrophobicContact CE2-CB 4.13Å; F122-F138 HydrophobicContact CB-CB 4.21Å; F122-F138 HydrophobicContact CD2-CB 4.45Å; F122-L142 HydrophobicContact CB-CD2 4.22Å; F122-L142 HydrophobicContact CD1-CD2 4.3Å; F122-L142 HydrophobicContact CG-CD2 4.34Å |
| 123 | L | 86.8 | Confident | 83.8 | Confident | 85 Ų | 85 | 88.7 Ų | 88.7 | 45% | 0.445 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -65.5 | -41.1 | 178 | -98.2 | 69.2 | 0 | 0 | 0 | 112.2 | L119 K120 C125 A126 Q127 | L119-L123 HydrophobicContact CD1-CD1 3.56Å; L119-L123 HydrophobicContact CG-CD1 3.99Å; L119-L123 WeakPolarHBondContact O-CB 3.4Å; L119-L123 WeakPolarHBondContact O-CD1 3.37Å; L119-L123 PolarHBondContact O-N 3.22Å; K120-L123 PolarHBondContact O-N 2.75Å; L123-C125 VanDerWaalsContact C-N 3.34Å; L123-A126 PolarHBondContact O-N 3.35Å; L123-Q127 WeakPolarHBondContact O-CB 3.46Å; L123-Q127 PolarHBondContact O-N 3.46Å |
| 124 | E | 88 | Confident | 84.6 | Confident | 107 Ų | 107 | 87.6 Ų | 87.6 | 50% | 0.5 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -64.8 | -42.2 | 177.5 | -171.6 | 175.3 | 101.6 | 0 | 0 | 110.5 | K120 Q127 N128 | K120-E124 WeakPolarHBondContact O-CB 3.38Å; K120-E124 PolarHBondContact O-N 3.28Å; E124-Q127 PolarHBondContact O-N 3.48Å; E124-N128 VanDerWaalsContact O-CB 3.26Å; E124-N128 WeakPolarHBondContact O-CB 3.47Å; E124-N128 PolarHBondContact O-N 3.03Å |
| 125 | C | 89.1 | Confident | 85 | Confident | 24 Ų | 24 | 84.4 Ų | 84.4 | 16% | 0.162 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -62.9 | -49.4 | 173.7 | -173 | 0 | 0 | 0 | 0 | 111.5 | Q121 F122 L123 Q127 N128 Q129 C135 F138 | Q121-C125 VanDerWaalsContact O-CB 3.26Å; Q121-C125 WeakPolarHBondContact O-CB 3.38Å; Q121-C125 PolarHBondContact O-N 3.22Å; F122-C125 PolarHBondContact O-N 3.49Å; L123-C125 VanDerWaalsContact C-N 3.34Å; C125-Q127 VanDerWaalsContact C-N 3.31Å; C125-Q127 PolarHBondContact O-N 3.06Å; C125-N128 PolarHBondContact O-N 2.74Å; C125-Q129 CarbonylContact O-C 3.47Å; C125-Q129 WeakPolarHBondContact O-CA 3.3Å; C125-Q129 WeakPolarHBondContact O-CB 2.85Å; C125-Q129 PolarHBondContact O-N 3.39Å; C125-C135 HydrophobicContact CB-CB 3.81Å; C125-C135 WeakPolarHBondContact CB-SG 2.86Å; C125-C135 WeakPolarHBondContact SG-CA 3.5Å; C125-C135 WeakPolarHBondContact SG-CB 3.39Å; C125-C135 CovalentContact SG-SG 2.03Å; C125-C135 PolarHBondContact SG-SG 2.88Å; C125-F138 HydrophobicContact CB-CD2 4.2Å |
| 126 | A | 87.5 | Confident | 84.9 | Confident | 33 Ų | 33 | 90.5 Ų | 90.5 | 27% | 0.273 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -66.3 | -30.8 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | F122 L123 Q129 L132 | F122-A126 VanDerWaalsContact O-CB 3.32Å; F122-A126 WeakPolarHBondContact O-CB 3.21Å; F122-A126 PolarHBondContact O-N 3.29Å; L123-A126 PolarHBondContact O-N 3.35Å; A126-Q129 CarbonylContact C-O 3.58Å; A126-Q129 WeakPolarHBondContact CA-O 3.4Å; A126-L132 HydrophobicContact CB-CD2 3.85Å |
| 127 | Q | 85.3 | Confident | 85 | Confident | 176 Ų | 176 | 90 Ų | 90 | 82% | 0.822 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -76.8 | -36.9 | 178.8 | -171.5 | -175.6 | 110.1 | 0 | 0 | 111.6 | L123 E124 C125 | L123-Q127 WeakPolarHBondContact O-CB 3.46Å; L123-Q127 PolarHBondContact O-N 3.46Å; E124-Q127 PolarHBondContact O-N 3.48Å; C125-Q127 VanDerWaalsContact C-N 3.31Å; C125-Q127 PolarHBondContact O-N 3.06Å |
| 128 | N | 85.1 | Confident | 84.8 | Confident | 127 Ų | 127 | 86.4 Ų | 86.4 | 68% | 0.679 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -88.3 | -27.5 | 179.9 | -166.3 | 73.7 | 0 | 0 | 0 | 112.8 | E124 C125 | E124-N128 VanDerWaalsContact O-CB 3.26Å; E124-N128 WeakPolarHBondContact O-CB 3.47Å; E124-N128 PolarHBondContact O-N 3.03Å; C125-N128 PolarHBondContact O-N 2.74Å |
| 129 | Q | 74.6 | Confident | 84.7 | Confident | 97 Ų | 97 | 85.8 Ų | 85.8 | 45% | 0.453 | 45% | 0.448 | S | S | . | . | trans | -137.5 | 109.1 | -179.2 | -66.1 | -68.2 | -18.1 | 0 | 0 | 108.8 | C125 A126 D131 | C125-Q129 CarbonylContact O-C 3.47Å; C125-Q129 WeakPolarHBondContact O-CA 3.3Å; C125-Q129 WeakPolarHBondContact O-CB 2.85Å; C125-Q129 PolarHBondContact O-N 3.39Å; A126-Q129 CarbonylContact C-O 3.58Å; A126-Q129 WeakPolarHBondContact CA-O 3.4Å; Q129-D131 PolarHBondContact O-N 3.4Å | ||
| 130 | S | 75.3 | Confident | 84.8 | Confident | 109 Ų | 109 | 90.2 Ų | 90.2 | 76% | 0.762 | 47% | 0.468 | S | S | * | . | trans | -68.4 | -10.1 | 177.8 | 43.6 | 0 | 0 | 0 | 0 | 113.6 | L132 | S130-L132 PolarHBondContact O-N 2.83Å; S130-L132 VanDerWaalsContact O-N 3.12Å | ||
| 131 | D | 81.4 | Confident | 84.9 | Confident | 95 Ų | 95 | 87.1 Ų | 87.1 | 51% | 0.508 | 46% | 0.46 | S | S | . | . | trans | -79.8 | 87.7 | 174.6 | -110.2 | -71.6 | 0 | 0 | 0 | 111.3 | Q129 K133 L134 | Q129-D131 PolarHBondContact O-N 3.4Å; D131-K133 PolarHBondContact O-N 3.22Å; D131-L134 HydrophobicContact CB-CD1 4.06Å; D131-L134 PolarHBondContact O-N 2.95Å | ||
| 132 | L | 79.8 | Confident | 84.8 | Confident | 101 Ų | 101 | 86.2 Ų | 86.2 | 53% | 0.529 | 46% | 0.457 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.2 | -16.9 | -178.7 | -59.3 | 178.4 | 0 | 0 | 0 | 114.2 | F122 A126 S130 L134 C135 E136 | F122-L132 HydrophobicContact CZ-CD2 4.26Å; A126-L132 HydrophobicContact CB-CD2 3.85Å; S130-L132 PolarHBondContact O-N 2.83Å; S130-L132 VanDerWaalsContact O-N 3.12Å; L132-L134 VanDerWaalsContact C-N 3.32Å; L132-C135 CarbonylContact O-C 3.46Å; L132-C135 PolarHBondContact O-N 3.45Å; L132-C135 VanDerWaalsContact O-N 3.16Å; L132-E136 PolarHBondContact O-N 3.42Å; L132-E136 VanDerWaalsContact O-N 3.16Å |
| 133 | K | 83.9 | Confident | 84.7 | Confident | 167 Ų | 167 | 90.6 Ų | 90.6 | 73% | 0.726 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.8 | -34.3 | 173.8 | -78.2 | -177.2 | 170.1 | 173.4 | 0 | 112.8 | D131 E136 | D131-K133 PolarHBondContact O-N 3.22Å; K133-E136 WeakPolarHBondContact O-CB 3.5Å; K133-E136 PolarHBondContact O-N 3.42Å |
| 134 | L | 82.8 | Confident | 84.8 | Confident | 123 Ų | 123 | 91.8 Ų | 91.8 | 64% | 0.644 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.1 | -23.7 | 175.1 | -80.8 | 77 | 0 | 0 | 0 | 111.1 | D131 L132 | D131-L134 HydrophobicContact CB-CD1 4.06Å; D131-L134 PolarHBondContact O-N 2.95Å; L132-L134 VanDerWaalsContact C-N 3.32Å |
| 135 | C | 87.9 | Confident | 84.8 | Confident | 0 Ų | 0 | 87.4 Ų | 87.4 | 0% | 0 | 46% | 0.46 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.7 | 3.6 | 177.5 | -46.9 | 0 | 0 | 0 | 0 | 113.3 | F122 C125 L132 G137 F138 S139 | F122-C135 HydrophobicContact CD2-CB 4.12Å; F122-C135 HydrophobicContact CE2-CB 4.13Å; C125-C135 HydrophobicContact CB-CB 3.81Å; C125-C135 WeakPolarHBondContact CB-SG 2.86Å; C125-C135 WeakPolarHBondContact SG-CA 3.5Å; C125-C135 WeakPolarHBondContact SG-CB 3.39Å; C125-C135 CovalentContact SG-SG 2.03Å; C125-C135 PolarHBondContact SG-SG 2.88Å; L132-C135 CarbonylContact O-C 3.46Å; L132-C135 PolarHBondContact O-N 3.45Å; L132-C135 VanDerWaalsContact O-N 3.16Å; C135-G137 VanDerWaalsContact C-N 3.26Å; C135-G137 PolarHBondContact O-N 2.8Å; C135-F138 PolarHBondContact O-N 3.13Å; C135-S139 PolarHBondContact O-N 2.93Å |
| 136 | E | 86.3 | Confident | 84.6 | Confident | 129 Ų | 129 | 91.2 Ų | 91.2 | 60% | 0.603 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -59.5 | -38.3 | -175.7 | -169.1 | 171.4 | 96 | 0 | 0 | 111.5 | L132 K133 F138 S139 E140 | L132-E136 PolarHBondContact O-N 3.42Å; L132-E136 VanDerWaalsContact O-N 3.16Å; K133-E136 WeakPolarHBondContact O-CB 3.5Å; K133-E136 PolarHBondContact O-N 3.42Å; E136-F138 VanDerWaalsContact C-N 3.33Å; E136-F138 PolarHBondContact O-N 3.49Å; E136-S139 WeakPolarHBondContact O-CB 3.31Å; E136-S139 PolarHBondContact O-N 2.03Å; E136-S139 VanDerWaalsContact O-N 3.14Å; E136-S139 PolarHBondContact O-OG 2.9Å; E136-E140 PolarHBondContact O-N 3.34Å |
| 137 | G | 85.8 | Confident | 84.5 | Confident | 52 Ų | 52 | 93.4 Ų | 93.4 | 54% | 0.536 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.4 | -40 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | C135 E140 V141 | C135-G137 VanDerWaalsContact C-N 3.26Å; C135-G137 PolarHBondContact O-N 2.8Å; G137-E140 PolarHBondContact O-N 3.26Å; G137-V141 WeakPolarHBondContact O-CG2 3.29Å |
| 138 | F | 84.3 | Confident | 84.5 | Confident | 82 Ų | 82 | 89 Ų | 89 | 36% | 0.36 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -73.4 | -32.1 | 176.6 | -62 | -69.3 | 0 | 0 | 0 | 112.1 | Q121 F122 C125 C135 E136 E140 L142 | Q121-F138 HydrophobicContact CB-CD1 3.6Å; Q121-F138 HydrophobicContact CB-CE1 3.97Å; Q121-F138 HydrophobicContact CB-CG 4.21Å; Q121-F138 HydrophobicContact CG-CD1 4.39Å; Q121-F138 HydrophobicContact CG-CE1 4.39Å; F122-F138 HydrophobicContact CB-CB 4.21Å; F122-F138 HydrophobicContact CD2-CB 4.45Å; C125-F138 HydrophobicContact CB-CD2 4.2Å; C135-F138 PolarHBondContact O-N 3.13Å; E136-F138 VanDerWaalsContact C-N 3.33Å; E136-F138 PolarHBondContact O-N 3.49Å; F138-E140 VanDerWaalsContact C-N 3.3Å; F138-E140 PolarHBondContact O-N 3.45Å; F138-L142 WeakPolarHBondContact O-CB 3Å; F138-L142 PolarHBondContact O-N 2.94Å |
| 139 | S | 84.4 | Confident | 84.4 | Confident | 33 Ų | 33 | 86.8 Ų | 86.8 | 23% | 0.231 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -65.8 | -34 | 175.8 | 83.8 | 0 | 0 | 0 | 0 | 112.4 | C135 E136 K143 | C135-S139 PolarHBondContact O-N 2.93Å; E136-S139 WeakPolarHBondContact O-CB 3.31Å; E136-S139 PolarHBondContact O-N 2.03Å; E136-S139 VanDerWaalsContact O-N 3.14Å; E136-S139 PolarHBondContact O-OG 2.9Å; S139-K143 WeakPolarHBondContact O-CB 3.41Å; S139-K143 WeakPolarHBondContact O-CG 3.3Å; S139-K143 PolarHBondContact O-N 3.42Å |
| 140 | E | 88.9 | Confident | 84.5 | Confident | 124 Ų | 124 | 84.9 Ų | 84.9 | 58% | 0.579 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -68.1 | -46.1 | 179.3 | -160.5 | -170.3 | 95.1 | 0 | 0 | 111.1 | E136 G137 F138 K143 Q144 | E136-E140 PolarHBondContact O-N 3.34Å; G137-E140 PolarHBondContact O-N 3.26Å; F138-E140 VanDerWaalsContact C-N 3.3Å; F138-E140 PolarHBondContact O-N 3.45Å; E140-K143 PolarHBondContact O-N 3.31Å; E140-Q144 WeakPolarHBondContact O-CG 3.21Å; E140-Q144 PolarHBondContact O-N 3.46Å; E140-Q144 PolarHBondContact OE1-NE2 3.22Å; E140-Q144 VanDerWaalsContact OE1-NE2 3.12Å |
| 141 | V | 88.6 | Confident | 84.2 | Confident | 68 Ų | 68 | 81.7 Ų | 81.7 | 41% | 0.412 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -66.2 | -41 | 178.4 | -166 | 0 | 0 | 0 | 0 | 110.8 | E118 G137 K143 Q144 C145 | E118-V141 HydrophobicContact CG-CB 4Å; E118-V141 HydrophobicContact CG-CG1 3.46Å; E118-V141 VanDerWaalsContact CG-CG1 3.46Å; G137-V141 WeakPolarHBondContact O-CG2 3.29Å; V141-K143 VanDerWaalsContact C-N 3.31Å; V141-K143 PolarHBondContact O-N 3.11Å; V141-Q144 WeakPolarHBondContact O-CB 3.04Å; V141-Q144 PolarHBondContact O-N 3.3Å; V141-Q144 VanDerWaalsContact O-N 3.17Å; V141-C145 PolarHBondContact O-N 3.42Å |
| 142 | L | 86.5 | Confident | 83 | Confident | 27 Ų | 27 | 83.9 Ų | 83.9 | 14% | 0.141 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -59.9 | -41.9 | 175.2 | -178.9 | 60.9 | 0 | 0 | 0 | 111.8 | C115 E118 L119 F122 F138 C145 R146 | C115-L142 HydrophobicContact CB-CD1 3.95Å; E118-L142 HydrophobicContact CB-CB 4.11Å; E118-L142 HydrophobicContact CB-CD1 3.99Å; L119-L142 HydrophobicContact CB-CD1 3.81Å; L119-L142 HydrophobicContact CD1-CD1 4.24Å; L119-L142 HydrophobicContact CD1-CD2 3.8Å; F122-L142 HydrophobicContact CB-CD2 4.22Å; F122-L142 HydrophobicContact CD1-CD2 4.3Å; F122-L142 HydrophobicContact CG-CD2 4.34Å; F138-L142 WeakPolarHBondContact O-CB 3Å; F138-L142 PolarHBondContact O-N 2.94Å; L142-C145 PolarHBondContact O-N 2.98Å; L142-R146 VanDerWaalsContact O-CB 3.31Å; L142-R146 WeakPolarHBondContact O-CB 3.44Å; L142-R146 PolarHBondContact O-N 3.48Å |
| 143 | K | 86.4 | Confident | 83.2 | Confident | 143 Ų | 143 | 83.1 Ų | 83.1 | 62% | 0.622 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -67.4 | -36.2 | 176.4 | -73.6 | 171.3 | 78.8 | 169.4 | 0 | 112.2 | S139 E140 V141 R146 S147 | S139-K143 WeakPolarHBondContact O-CB 3.41Å; S139-K143 WeakPolarHBondContact O-CG 3.3Å; S139-K143 PolarHBondContact O-N 3.42Å; E140-K143 PolarHBondContact O-N 3.31Å; V141-K143 VanDerWaalsContact C-N 3.31Å; V141-K143 PolarHBondContact O-N 3.11Å; K143-R146 PolarHBondContact O-N 3.13Å; K143-S147 WeakPolarHBondContact O-CB 3.49Å; K143-S147 PolarHBondContact O-N 3.18Å; K143-S147 PolarHBondContact O-OG 3.29Å |
| 144 | Q | 88.2 | Confident | 83.1 | Confident | 110 Ų | 110 | 78.6 Ų | 78.6 | 51% | 0.514 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -65.2 | -46.5 | 173.7 | -73.7 | 176.3 | 49.8 | 0 | 0 | 111.3 | E140 V141 R146 S147 A148 | E140-Q144 WeakPolarHBondContact O-CG 3.21Å; E140-Q144 PolarHBondContact O-N 3.46Å; E140-Q144 PolarHBondContact OE1-NE2 3.22Å; E140-Q144 VanDerWaalsContact OE1-NE2 3.12Å; V141-Q144 WeakPolarHBondContact O-CB 3.04Å; V141-Q144 PolarHBondContact O-N 3.3Å; V141-Q144 VanDerWaalsContact O-N 3.17Å; Q144-R146 VanDerWaalsContact C-N 3.32Å; Q144-R146 PolarHBondContact O-N 3.16Å; Q144-S147 PolarHBondContact O-N 3.02Å; Q144-A148 VanDerWaalsContact O-CB 3.29Å; Q144-A148 WeakPolarHBondContact O-CB 3.18Å; Q144-A148 PolarHBondContact O-N 3.37Å |
| 145 | C | 89.4 | Confident | 83.1 | Confident | 16 Ų | 16 | 76.2 Ų | 76.2 | 11% | 0.108 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -60.4 | -43.1 | 175.7 | 179.2 | 0 | 0 | 0 | 0 | 111.6 | C115 E118 V141 L142 S147 A148 N149 | C115-C145 WeakPolarHBondContact CA-SG 3.17Å; C115-C145 HydrophobicContact CB-CB 3.86Å; C115-C145 WeakPolarHBondContact CB-SG 3.42Å; C115-C145 WeakPolarHBondContact SG-CB 3.33Å; C115-C145 CovalentContact SG-SG 2.03Å; C115-C145 PolarHBondContact SG-SG 3.45Å; E118-C145 VanDerWaalsContact OE1-CB 3.3Å; E118-C145 WeakPolarHBondContact OE1-CB 3.26Å; V141-C145 PolarHBondContact O-N 3.42Å; L142-C145 PolarHBondContact O-N 2.98Å; C145-S147 PolarHBondContact O-N 3.23Å; C145-A148 PolarHBondContact O-N 3.36Å; C145-N149 WeakPolarHBondContact O-CB 3.49Å; C145-N149 PolarHBondContact O-N 3.31Å; C145-N149 VanDerWaalsContact O-N 3.13Å; C145-N149 PolarHBondContact O-ND2 2.79Å |
| 146 | R | 84.7 | Confident | 82.9 | Confident | 103 Ų | 103 | 80.6 Ų | 80.6 | 39% | 0.389 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -56.4 | -48.6 | 174.3 | 170.8 | 162.5 | -179.8 | 175.6 | -3 | 112 | L142 K143 Q144 N149 G150 F151 S152 | L142-R146 VanDerWaalsContact O-CB 3.31Å; L142-R146 WeakPolarHBondContact O-CB 3.44Å; L142-R146 PolarHBondContact O-N 3.48Å; K143-R146 PolarHBondContact O-N 3.13Å; Q144-R146 VanDerWaalsContact C-N 3.32Å; Q144-R146 PolarHBondContact O-N 3.16Å; R146-N149 PolarHBondContact O-N 2.87Å; R146-G150 PolarHBondContact O-N 3.28Å; R146-F151 WeakPolarHBondContact CD-O 3.5Å; R146-F151 HydrophobicContact CG-CB 3.89Å; R146-F151 WeakPolarHBondContact CG-O 2.94Å; R146-F151 PolarHBondContact NE-O 3.24Å; R146-F151 WeakPolarHBondContact O-CB 3.46Å; R146-F151 PolarHBondContact O-N 3.32Å; R146-S152 PolarHBondContact NH2-OXT 2.76Å |
| 147 | S | 85.3 | Confident | 82.7 | Confident | 79 Ų | 79 | 77.6 Ų | 77.6 | 55% | 0.552 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -69.1 | -40.4 | -178.9 | -53.7 | 0 | 0 | 0 | 0 | 112.2 | K143 Q144 C145 N149 G150 | K143-S147 WeakPolarHBondContact O-CB 3.49Å; K143-S147 PolarHBondContact O-N 3.18Å; K143-S147 PolarHBondContact O-OG 3.29Å; Q144-S147 PolarHBondContact O-N 3.02Å; C145-S147 PolarHBondContact O-N 3.23Å; S147-N149 VanDerWaalsContact C-N 3.26Å; S147-N149 PolarHBondContact O-N 3.42Å; S147-G150 PolarHBondContact O-N 3.12Å |
| 148 | A | 85.6 | Confident | 82.4 | Confident | 85 Ų | 85 | 79.3 Ų | 79.3 | 70% | 0.702 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -63.7 | -31.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q144 C145 | Q144-A148 VanDerWaalsContact O-CB 3.29Å; Q144-A148 WeakPolarHBondContact O-CB 3.18Å; Q144-A148 PolarHBondContact O-N 3.37Å; C145-A148 PolarHBondContact O-N 3.36Å |
| 149 | N | 83.1 | Confident | 82.3 | Confident | 79 Ų | 79 | 79.1 Ų | 79.1 | 42% | 0.422 | 46% | 0.46 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.1 | 9.7 | -179.8 | -70.1 | -77.7 | 0 | 0 | 0 | 113.6 | V114 C145 R146 S147 F151 | V114-N149 HydrophobicContact CG1-CB 4.04Å; V114-N149 WeakPolarHBondContact CG1-ND2 3.18Å; V114-N149 WeakPolarHBondContact CG1-OD1 2.88Å; C145-N149 WeakPolarHBondContact O-CB 3.49Å; C145-N149 PolarHBondContact O-N 3.31Å; C145-N149 VanDerWaalsContact O-N 3.13Å; C145-N149 PolarHBondContact O-ND2 2.79Å; R146-N149 PolarHBondContact O-N 2.87Å; S147-N149 VanDerWaalsContact C-N 3.26Å; S147-N149 PolarHBondContact O-N 3.42Å; N149-F151 HydrophobicContact CB-CD2 3.52Å; N149-F151 HydrophobicContact CB-CE2 3.54Å; N149-F151 PolarHBondContact O-N 3.21Å |
| 150 | G | 75.1 | Confident | 82.2 | Confident | 58 Ų | 58 | 82.7 Ų | 82.7 | 60% | 0.598 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 73.6 | 11.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | R146 S147 S152 | R146-G150 PolarHBondContact O-N 3.28Å; S147-G150 PolarHBondContact O-N 3.12Å; G150-S152 PolarHBondContact O-N 3.5Å |
| 151 | F | 69 | Low | 81.6 | Confident | 41 Ų | 41 | 79.3 Ų | 79.3 | 18% | 0.18 | 47% | 0.47 | C | S | . | . | trans | -81.1 | 66.8 | 171.5 | -60.2 | -72 | 0 | 0 | 0 | 108.5 | Q110 V114 R146 N149 | Q110-F151 HydrophobicContact CB-CE1 4.33Å; Q110-F151 HydrophobicContact CB-CZ 4.38Å; Q110-F151 HydrophobicContact CG-CZ 4.28Å; V114-F151 HydrophobicContact CB-CE2 4.23Å; V114-F151 HydrophobicContact CG1-CE2 4.48Å; V114-F151 HydrophobicContact CG2-CE2 4.34Å; V114-F151 HydrophobicContact CG2-CZ 4.46Å; R146-F151 WeakPolarHBondContact CD-O 3.5Å; R146-F151 HydrophobicContact CG-CB 3.89Å; R146-F151 WeakPolarHBondContact CG-O 2.94Å; R146-F151 PolarHBondContact NE-O 3.24Å; R146-F151 WeakPolarHBondContact O-CB 3.46Å; R146-F151 PolarHBondContact O-N 3.32Å; N149-F151 HydrophobicContact CB-CD2 3.52Å; N149-F151 HydrophobicContact CB-CE2 3.54Å; N149-F151 PolarHBondContact O-N 3.21Å | ||
| 152 | S | 57.2 | Low | 81 | Confident | 142 Ų | 142 | 80.3 Ų | 80.3 | 99% | 0.993 | 48% | 0.475 | S | S | * | . | trans | -83.4 | 0 | 177.5 | -52.3 | 0 | 0 | 0 | 0 | 110.7 | R146 G150 | R146-S152 PolarHBondContact NH2-OXT 2.76Å; G150-S152 PolarHBondContact O-N 3.5Å |
Retrieved 152 of 152 residues in 25.1 ms
(Link to these results)