| 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 | 47.7 | Very low | 63 | Low | 225 Ų | 225 | 136.1 Ų | 136.1 | 100% | 1.108 | 79% | 0.786 | S | S | * | * | 0 | 106.6 | 0 | -149.5 | 172.1 | -176 | 0 | 0 | 106.5 | |||||
| 2 | L | 51.2 | Low | 62.1 | Low | 169 Ų | 169 | 129.7 Ų | 129.7 | 89% | 0.885 | 76% | 0.755 | S | S | * | * | trans | -82.8 | 129.1 | 178.2 | -85 | 97.9 | 0 | 0 | 0 | 109.2 | ||||
| 3 | H | 56.6 | Low | 61.8 | Low | 172 Ų | 172 | 134.8 Ų | 134.8 | 80% | 0.796 | 76% | 0.762 | S | S | * | * | trans | -92.9 | 117 | 170.9 | -75.8 | -103.6 | 0 | 0 | 0 | 108.9 | ||||
| 4 | T | 62.4 | Low | 61.3 | Low | 132 Ų | 132 | 136 Ų | 136 | 81% | 0.81 | 76% | 0.759 | S | S | * | * | trans | -104.6 | 124.2 | 172.8 | -51 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 5 | T | 71.8 | Confident | 60.7 | Low | 125 Ų | 125 | 135 Ų | 135 | 77% | 0.767 | 75% | 0.751 | S | S | * | * | trans | -104.6 | 120 | 173.2 | -54.6 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 6 | A | 66.2 | Low | 60.1 | Low | 90 Ų | 90 | 133.1 Ų | 133.1 | 74% | 0.744 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -93 | 133.3 | 171.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||
| 7 | C | 67.6 | Low | 59.4 | Low | 117 Ų | 117 | 134.7 Ų | 134.7 | 79% | 0.791 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -98.6 | 125.7 | 173.6 | -56.3 | 0 | 0 | 0 | 0 | 109.2 | ||
| 8 | I | 69.8 | Low | 58.6 | Low | 110 Ų | 110 | 133.1 Ų | 133.1 | 56% | 0.564 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -99.2 | 122.6 | 173.6 | -59 | 172.1 | 0 | 0 | 0 | 108.2 | T10 F103 | I8-T10 HydrophobicContact CG2-CG2 4.36Å; I8-F103 HydrophobicContact CD1-CE1 3.87Å; I8-F103 HydrophobicContact CD1-CZ 4.13Å |
| 9 | T | 66.4 | Low | 57.9 | Low | 128 Ų | 128 | 130.1 Ų | 130.1 | 79% | 0.785 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -101.3 | 123.5 | 169.3 | -55.7 | 0 | 0 | 0 | 0 | 108.1 | ||
| 10 | T | 66.3 | Low | 57 | Low | 119 Ų | 119 | 129.6 Ų | 129.6 | 73% | 0.73 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -98.9 | 139.5 | 171.4 | 51.7 | 0 | 0 | 0 | 0 | 109.6 | I8 | I8-T10 HydrophobicContact CG2-CG2 4.36Š|
| 11 | V | 66.4 | Low | 56.7 | Low | 110 Ų | 110 | 132.2 Ų | 132.2 | 67% | 0.667 | 75% | 0.746 | S | S | * | * | trans | -107.8 | 136.6 | 168.4 | -67.1 | 0 | 0 | 0 | 0 | 108.4 | V16 | V11-V16 HydrophobicContact CG2-CG2 4.28Š| ||
| 12 | S | 52.9 | Low | 56.5 | Low | 59 Ų | 59 | 126 Ų | 126 | 41% | 0.413 | 72% | 0.724 | S | S | . | * | trans | -66.7 | 143.4 | 173.8 | 60 | 0 | 0 | 0 | 0 | 109.8 | E14 N15 | S12-E14 WeakPolarHBondContact CB-OE1 3.36Å; S12-E14 PolarHBondContact O-N 3.33Å; S12-E14 WeakPolarHBondContact OG-CG 3.39Å; S12-E14 PolarHBondContact OG-OE1 3.31Å; S12-N15 PolarHBondContact O-N 3.11Å; S12-N15 VanDerWaalsContact O-N 3.11Å | ||
| 13 | K | 57.8 | Low | 55.9 | Low | 196 Ų | 196 | 123.7 Ų | 123.7 | 85% | 0.852 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.5 | -13.6 | -172.7 | -156.5 | 173.6 | -177.3 | 178 | 0 | 113.3 | ||
| 14 | E | 55.5 | Low | 55.5 | Low | 152 Ų | 152 | 121.4 Ų | 121.4 | 71% | 0.71 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.4 | -16.2 | 178.1 | 65.8 | -131 | 163.6 | 0 | 0 | 114.3 | S12 | S12-E14 WeakPolarHBondContact CB-OE1 3.36Å; S12-E14 PolarHBondContact O-N 3.33Å; S12-E14 WeakPolarHBondContact OG-CG 3.39Å; S12-E14 PolarHBondContact OG-OE1 3.31Å |
| 15 | N | 51.5 | Low | 54.6 | Low | 121 Ų | 121 | 121.5 Ų | 121.5 | 65% | 0.647 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -97.3 | -3.2 | -175.9 | -116.5 | 45.7 | 0 | 0 | 0 | 115.1 | S12 | S12-N15 PolarHBondContact O-N 3.11Å; S12-N15 VanDerWaalsContact O-N 3.11Å |
| 16 | V | 51.9 | Low | 53.4 | Low | 105 Ų | 105 | 123.2 Ų | 123.2 | 64% | 0.636 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.8 | -9.7 | -173.9 | -174.2 | 0 | 0 | 0 | 0 | 112.8 | V11 | V11-V16 HydrophobicContact CG2-CG2 4.28Š|
| 17 | L | 48.4 | Very low | 52.5 | Low | 160 Ų | 160 | 124.3 Ų | 124.3 | 84% | 0.838 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | 7.4 | -175.6 | -71.1 | 167 | 0 | 0 | 0 | 114.3 | ||
| 18 | S | 44.9 | Very low | 50.8 | Low | 105 Ų | 105 | 125.5 Ų | 125.5 | 73% | 0.734 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -147 | 50.1 | -170.2 | -49 | 0 | 0 | 0 | 0 | 113.7 | ||
| 19 | S | 44.7 | Very low | 49.6 | Very low | 76 Ų | 76 | 124.7 Ų | 124.7 | 53% | 0.531 | 73% | 0.733 | S | S | . | * | trans | -166.5 | 113.2 | 148.9 | 43.5 | 0 | 0 | 0 | 0 | 110.9 | F21 | S19-F21 PolarHBondContact O-N 3.07Å; S19-F21 VanDerWaalsContact O-N 3.1Å; S19-F21 WeakPolarHBondContact OG-CD2 3.4Å; S19-F21 VanDerWaalsContact OG-CE2 3.29Å; S19-F21 WeakPolarHBondContact OG-CE2 3.46Å | ||
| 20 | S | 40.2 | Very low | 48.2 | Very low | 121 Ų | 121 | 126.4 Ų | 126.4 | 85% | 0.846 | 74% | 0.737 | S | S | * | * | trans | -66.8 | 99.4 | 162.8 | -165.2 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 21 | F | 49.4 | Very low | 47.1 | Very low | 184 Ų | 184 | 128.9 Ų | 128.9 | 81% | 0.807 | 75% | 0.745 | S | S | * | * | trans | -96.7 | 108.2 | 170.4 | -86.4 | -74.7 | 0 | 0 | 0 | 109.5 | S19 | S19-F21 PolarHBondContact O-N 3.07Å; S19-F21 VanDerWaalsContact O-N 3.1Å; S19-F21 WeakPolarHBondContact OG-CD2 3.4Å; S19-F21 VanDerWaalsContact OG-CE2 3.29Å; S19-F21 WeakPolarHBondContact OG-CE2 3.46Å | ||
| 22 | S | 45.2 | Very low | 45.7 | Very low | 94 Ų | 94 | 130.4 Ų | 130.4 | 66% | 0.657 | 75% | 0.749 | S | S | * | * | trans | -53 | 142.9 | 175 | -47 | 0 | 0 | 0 | 0 | 111.5 | T24 | S22-T24 PolarHBondContact O-N 2.95Š| ||
| 23 | S | 37.4 | Very low | 44.9 | Very low | 121 Ų | 121 | 134.2 Ų | 134.2 | 85% | 0.846 | 77% | 0.77 | S | S | * | * | trans | -46.6 | 115.5 | 167.9 | 51 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 24 | T | 49 | Very low | 44.1 | Very low | 125 Ų | 125 | 129.7 Ų | 129.7 | 77% | 0.767 | 76% | 0.763 | S | S | * | * | trans | -128 | 114 | 162.3 | 42.5 | 0 | 0 | 0 | 0 | 109.7 | S22 | S22-T24 PolarHBondContact O-N 2.95Š| ||
| 25 | T | 44.2 | Very low | 43.2 | Very low | 134 Ų | 134 | 129.9 Ų | 129.9 | 82% | 0.822 | 77% | 0.768 | S | S | * | * | trans | -32.5 | 128 | 166.7 | 45.9 | 0 | 0 | 0 | 0 | 114 | P27 | T25-P27 WeakPolarHBondContact O-CD 3.37Š| ||
| 26 | L | 46 | Very low | 43.1 | Very low | 160 Ų | 160 | 130.2 Ų | 130.2 | 84% | 0.838 | 78% | 0.777 | S | S | * | * | trans | -64.1 | 125.9 | 163.2 | -92.7 | 79.7 | 0 | 0 | 0 | 109.1 | T28 | L26-T28 PolarHBondContact O-N 2.83Š| ||
| 27 | P | 46.5 | Very low | 42.5 | Very low | 114 Ų | 114 | 133.2 Ų | 133.2 | 74% | 0.74 | 78% | 0.784 | S | S | * | * | trans | -73.9 | 112.7 | 167.5 | 29 | -28.7 | 0 | 0 | 0 | 108.9 | T25 S29 | T25-P27 WeakPolarHBondContact O-CD 3.37Å; P27-S29 PolarHBondContact O-N 3Å | ||
| 28 | T | 33 | Very low | 42.3 | Very low | 141 Ų | 141 | 134.9 Ų | 134.9 | 87% | 0.865 | 79% | 0.788 | S | S | * | * | trans | -75.3 | 101 | 161.3 | 50 | 0 | 0 | 0 | 0 | 107.7 | L26 | L26-T28 PolarHBondContact O-N 2.83Š| ||
| 29 | S | 44.9 | Very low | 42.5 | Very low | 93 Ų | 93 | 134 Ų | 134 | 65% | 0.65 | 78% | 0.778 | S | S | * | * | trans | -150.9 | 120.6 | 166.9 | 59 | 0 | 0 | 0 | 0 | 110.7 | P27 L31 | P27-S29 PolarHBondContact O-N 3Å; S29-L31 PolarHBondContact O-N 3.17Å | ||
| 30 | N | 37 | Very low | 42.6 | Very low | 164 Ų | 164 | 134.3 Ų | 134.3 | 88% | 0.877 | 78% | 0.78 | S | S | * | * | trans | -23 | 116 | 173.2 | -55.4 | -46.6 | 0 | 0 | 0 | 114.5 | D32 | N30-D32 VanDerWaalsContact C-N 3.31Å; N30-D32 PolarHBondContact O-N 2.87Å | ||
| 31 | L | 41.4 | Very low | 43.3 | Very low | 171 Ų | 171 | 135.7 Ų | 135.7 | 90% | 0.895 | 77% | 0.771 | S | S | * | * | trans | -76.1 | 88.1 | 165.7 | -85.8 | 150 | 0 | 0 | 0 | 108.1 | S29 T33 | S29-L31 PolarHBondContact O-N 3.17Å; L31-T33 PolarHBondContact O-N 3.04Å | ||
| 32 | D | 37.2 | Very low | 43.4 | Very low | 143 Ų | 143 | 131.5 Ų | 131.5 | 77% | 0.765 | 77% | 0.765 | S | S | * | * | trans | -64.6 | 124.9 | 163.4 | -153.3 | -12.9 | 0 | 0 | 0 | 108.3 | N30 S34 | N30-D32 VanDerWaalsContact C-N 3.31Å; N30-D32 PolarHBondContact O-N 2.87Å; D32-S34 PolarHBondContact O-N 2.8Å; D32-S34 VanDerWaalsContact O-N 3.16Å | ||
| 33 | T | 37.4 | Very low | 43.6 | Very low | 139 Ų | 139 | 134.1 Ų | 134.1 | 85% | 0.853 | 77% | 0.771 | S | S | * | * | trans | -86.6 | 87.5 | -174.3 | 17.5 | 0 | 0 | 0 | 0 | 108.8 | L31 | L31-T33 PolarHBondContact O-N 3.04Š| ||
| 34 | S | 39.9 | Very low | 44.5 | Very low | 100 Ų | 100 | 135 Ų | 135 | 70% | 0.699 | 77% | 0.766 | S | S | * | * | trans | -141.6 | 122.1 | 161.2 | 62.2 | 0 | 0 | 0 | 0 | 112.3 | D32 | D32-S34 PolarHBondContact O-N 2.8Å; D32-S34 VanDerWaalsContact O-N 3.16Å | ||
| 35 | L | 38.2 | Very low | 44.9 | Very low | 156 Ų | 156 | 135.5 Ų | 135.5 | 82% | 0.817 | 76% | 0.763 | S | S | * | * | trans | 65.3 | 113.1 | 165.5 | -144.8 | 70.2 | 0 | 0 | 0 | 117.5 | Q37 | L35-Q37 VanDerWaalsContact C-N 3.35Å; L35-Q37 PolarHBondContact O-N 2.89Å | ||
| 36 | P | 47.5 | Very low | 45.3 | Very low | 129 Ų | 129 | 133.2 Ų | 133.2 | 84% | 0.838 | 75% | 0.751 | S | S | * | * | trans | -70.1 | 94.6 | 169.1 | 29.2 | -30.1 | 0 | 0 | 0 | 108.5 | Q38 | P36-Q38 PolarHBondContact O-N 3.35Å; P36-Q38 VanDerWaalsContact O-N 3.17Å | ||
| 37 | Q | 40 | Very low | 45.8 | Very low | 168 Ų | 168 | 132 Ų | 132 | 79% | 0.785 | 76% | 0.755 | S | S | * | * | trans | -70.2 | 110.7 | 167.5 | -141.6 | 177 | 15.1 | 0 | 0 | 106.9 | L35 T39 | L35-Q37 VanDerWaalsContact C-N 3.35Å; L35-Q37 PolarHBondContact O-N 2.89Å; Q37-T39 VanDerWaalsContact C-N 3.29Å; Q37-T39 PolarHBondContact O-N 2.87Å | ||
| 38 | Q | 44.3 | Very low | 46.1 | Very low | 195 Ų | 195 | 132.9 Ų | 132.9 | 91% | 0.911 | 75% | 0.751 | S | S | * | * | trans | -63.4 | 88.8 | 177.4 | -170.6 | -175.6 | 5.9 | 0 | 0 | 109 | P36 S40 | P36-Q38 PolarHBondContact O-N 3.35Å; P36-Q38 VanDerWaalsContact O-N 3.17Å; Q38-S40 PolarHBondContact O-N 3.15Å | ||
| 39 | T | 48.6 | Very low | 47.2 | Very low | 86 Ų | 86 | 131.6 Ų | 131.6 | 53% | 0.528 | 75% | 0.748 | S | S | . | * | trans | -73 | 118.9 | 171.1 | 52.1 | 0 | 0 | 0 | 0 | 108.2 | Q37 F41 | Q37-T39 VanDerWaalsContact C-N 3.29Å; Q37-T39 PolarHBondContact O-N 2.87Å; T39-F41 WeakPolarHBondContact O-CD2 3.45Å; T39-F41 PolarHBondContact O-N 2.95Å | ||
| 40 | S | 46.9 | Very low | 48 | Very low | 82 Ų | 82 | 134 Ų | 134 | 57% | 0.573 | 75% | 0.752 | S | S | * | * | trans | -63.1 | 107.1 | 168.6 | -177 | 0 | 0 | 0 | 0 | 108.8 | Q38 S42 | Q38-S40 PolarHBondContact O-N 3.15Å; S40-S42 PolarHBondContact O-N 2.66Å; S40-S42 VanDerWaalsContact O-N 3.12Å; S40-S42 PolarHBondContact OG-OG 2.94Å | ||
| 41 | F | 56.2 | Low | 49.3 | Very low | 150 Ų | 150 | 128.4 Ų | 128.4 | 66% | 0.658 | 73% | 0.733 | S | S | * | * | G | 310 helix | trans | -69 | 0.7 | 174.8 | -70.8 | -80.5 | 0 | 0 | 0 | 113.1 | T39 N43 L44 | T39-F41 WeakPolarHBondContact O-CD2 3.45Å; T39-F41 PolarHBondContact O-N 2.95Å; F41-N43 PolarHBondContact O-N 3.08Å; F41-N43 VanDerWaalsContact O-N 3.15Å; F41-L44 PolarHBondContact O-N 3.44Å |
| 42 | S | 51.3 | Low | 50.3 | Low | 96 Ų | 96 | 126.6 Ų | 126.6 | 67% | 0.671 | 73% | 0.731 | S | S | * | * | G | 310 helix | trans | -64.9 | -18.7 | -174.2 | -62.6 | 0 | 0 | 0 | 0 | 114.6 | S40 | S40-S42 PolarHBondContact O-N 2.66Å; S40-S42 VanDerWaalsContact O-N 3.12Å; S40-S42 PolarHBondContact OG-OG 2.94Å |
| 43 | N | 49.6 | Very low | 51.9 | Low | 150 Ų | 150 | 129.1 Ų | 129.1 | 80% | 0.802 | 73% | 0.73 | S | S | * | * | G | 310 helix | trans | -109.7 | 3.3 | -174 | -64.6 | -21.6 | 0 | 0 | 0 | 114.6 | F41 | F41-N43 PolarHBondContact O-N 3.08Å; F41-N43 VanDerWaalsContact O-N 3.15Å |
| 44 | L | 54.6 | Low | 53 | Low | 138 Ų | 138 | 129.8 Ų | 129.8 | 72% | 0.723 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -106.2 | -4 | -174.9 | -70.9 | 175.9 | 0 | 0 | 0 | 114.4 | F41 P46 | F41-L44 PolarHBondContact O-N 3.44Å; L44-P46 WeakPolarHBondContact O-CD 3.15Å |
| 45 | L | 58.4 | Low | 54.6 | Low | 137 Ų | 137 | 130.7 Ų | 130.7 | 72% | 0.717 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -90.2 | 118.4 | 174.2 | -68.8 | 165.3 | 0 | 0 | 0 | 107.7 | ||
| 46 | P | 52.8 | Low | 55.8 | Low | 86 Ų | 86 | 128.9 Ų | 128.9 | 56% | 0.558 | 72% | 0.719 | S | S | * | * | trans | -49.8 | 147.7 | 164.5 | -19.5 | 30.5 | 0 | 0 | 0 | 108 | L44 M48 | L44-P46 WeakPolarHBondContact O-CD 3.15Å; P46-M48 HydrophobicContact CB-CE 4.13Å; P46-M48 HydrophobicContact CB-CG 4.11Å; P46-M48 HydrophobicContact CG-CE 3.99Å; P46-M48 PolarHBondContact O-N 3.06Å | ||
| 47 | S | 55.7 | Low | 56.7 | Low | 133 Ų | 133 | 129.5 Ų | 129.5 | 93% | 0.93 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -64 | 31.8 | 178.9 | 62.4 | 0 | 0 | 0 | 0 | 114.1 | ||
| 48 | M | 53.1 | Low | 57.6 | Low | 133 Ų | 133 | 123.6 Ų | 123.6 | 66% | 0.655 | 70% | 0.695 | S | S | * | * | trans | -64.2 | 133.1 | 170.7 | -68.2 | -176.8 | -56.4 | 0 | 0 | 108.3 | P46 I50 | P46-M48 HydrophobicContact CB-CE 4.13Å; P46-M48 HydrophobicContact CB-CG 4.11Å; P46-M48 HydrophobicContact CG-CE 3.99Å; P46-M48 PolarHBondContact O-N 3.06Å; M48-I50 PolarHBondContact O-N 3.38Å | ||
| 49 | S | 57 | Low | 58.5 | Low | 115 Ų | 115 | 126.7 Ų | 126.7 | 80% | 0.804 | 70% | 0.698 | S | S | * | * | trans | -43.6 | 112 | 166.7 | 175.4 | 0 | 0 | 0 | 0 | 108.7 | G51 | S49-G51 PolarHBondContact O-N 2.82Š| ||
| 50 | I | 61.4 | Low | 58.9 | Low | 144 Ų | 144 | 131.1 Ų | 131.1 | 74% | 0.738 | 71% | 0.713 | S | S | * | * | trans | -58.7 | 110.4 | 172 | -66.7 | 152.8 | 0 | 0 | 0 | 105.1 | M48 | M48-I50 PolarHBondContact O-N 3.38Š| ||
| 51 | G | 64.6 | Low | 59.2 | Low | 45 Ų | 45 | 130 Ų | 130 | 46% | 0.464 | 71% | 0.706 | S | S | . | * | trans | -58.6 | 176.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | S49 R53 | S49-G51 PolarHBondContact O-N 2.82Å; G51-R53 PolarHBondContact O-N 3.34Å | ||
| 52 | P | 61.3 | Low | 59 | Low | 133 Ų | 133 | 130.3 Ų | 130.3 | 86% | 0.864 | 71% | 0.714 | S | S | * | * | trans | -50 | 120.8 | -177.3 | 19.9 | -31.5 | 0 | 0 | 0 | 111 | I54 | P52-I54 PolarHBondContact O-N 3.44Š| ||
| 53 | R | 70.7 | Confident | 59.1 | Low | 197 Ų | 197 | 133 Ų | 133 | 74% | 0.743 | 72% | 0.72 | S | S | * | * | trans | -76.8 | 116 | -178 | -162.2 | -179 | -145.9 | -88.2 | -0.6 | 108.4 | G51 E55 | G51-R53 PolarHBondContact O-N 3.34Å; R53-E55 PolarHBondContact O-N 3.12Å | ||
| 54 | I | 61.2 | Low | 59.2 | Low | 152 Ų | 152 | 131.7 Ų | 131.7 | 78% | 0.779 | 72% | 0.72 | S | S | * | * | trans | -83.2 | 110.6 | 170.3 | -59 | 173.8 | 0 | 0 | 0 | 107.2 | P52 | P52-I54 PolarHBondContact O-N 3.44Š| ||
| 55 | E | 73.7 | Confident | 59.2 | Low | 120 Ų | 120 | 127.4 Ų | 127.4 | 56% | 0.561 | 71% | 0.709 | S | S | * | * | trans | -99.8 | 111.5 | 170.5 | -172.7 | 179 | 150.1 | 0 | 0 | 108.7 | R53 Q57 | R53-E55 PolarHBondContact O-N 3.12Å; E55-Q57 HydrophobicContact CG-CG 4.42Å; E55-Q57 PolarHBondContact O-N 2.91Å; E55-Q57 PolarHBondContact OE1-NE2 3.05Å; E55-Q57 VanDerWaalsContact OE1-NE2 3.08Å | ||
| 56 | C | 62.7 | Low | 59 | Low | 117 Ų | 117 | 126.6 Ų | 126.6 | 79% | 0.791 | 71% | 0.712 | S | S | * | * | trans | -88 | 102.5 | 171.8 | -63.7 | 0 | 0 | 0 | 0 | 108.6 | G58 | C56-G58 PolarHBondContact O-N 3.49Š| ||
| 57 | Q | 66.2 | Low | 58.6 | Low | 142 Ų | 142 | 130.4 Ų | 130.4 | 66% | 0.664 | 73% | 0.726 | S | S | * | * | trans | -79.9 | 112 | 166.4 | -72.9 | -178.7 | 10.4 | 0 | 0 | 108.8 | E55 | E55-Q57 HydrophobicContact CG-CG 4.42Å; E55-Q57 PolarHBondContact O-N 2.91Å; E55-Q57 PolarHBondContact OE1-NE2 3.05Å; E55-Q57 VanDerWaalsContact OE1-NE2 3.08Å | ||
| 58 | G | 59.8 | Low | 58.3 | Low | 45 Ų | 45 | 129.2 Ų | 129.2 | 46% | 0.464 | 71% | 0.712 | S | S | . | * | trans | -62.3 | 152.7 | 167.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | C56 E60 S61 | C56-G58 PolarHBondContact O-N 3.49Å; G58-E60 PolarHBondContact O-N 2.65Å; G58-S61 WeakPolarHBondContact CA-OG 3.39Å; G58-S61 PolarHBondContact N-OG 3.42Å; G58-S61 WeakPolarHBondContact O-CB 3.29Å; G58-S61 PolarHBondContact O-N 2.97Å; G58-S61 PolarHBondContact O-OG 2.66Å | ||
| 59 | R | 62.1 | Low | 58 | Low | 259 Ų | 259 | 128.2 Ų | 128.2 | 98% | 0.977 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.3 | -9 | -178.1 | -152.5 | 178.9 | -179 | 171.3 | 0 | 114.2 | ||
| 60 | E | 57.3 | Low | 57.4 | Low | 180 Ų | 180 | 128.3 Ų | 128.3 | 84% | 0.841 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.3 | 6.1 | -177.8 | -43.4 | -159.4 | 158.3 | 0 | 0 | 113.1 | G58 N62 | G58-E60 PolarHBondContact O-N 2.65Å; E60-N62 VanDerWaalsContact C-N 3.34Å; E60-N62 PolarHBondContact O-N 3.11Å |
| 61 | S | 52.6 | Low | 56.6 | Low | 59 Ų | 59 | 125.4 Ų | 125.4 | 41% | 0.413 | 71% | 0.714 | S | S | . | * | trans | -77.3 | 78.3 | -176.9 | -37.5 | 0 | 0 | 0 | 0 | 111.1 | G58 L63 | G58-S61 WeakPolarHBondContact CA-OG 3.39Å; G58-S61 PolarHBondContact N-OG 3.42Å; G58-S61 WeakPolarHBondContact O-CB 3.29Å; G58-S61 PolarHBondContact O-N 2.97Å; G58-S61 PolarHBondContact O-OG 2.66Å; S61-L63 VanDerWaalsContact C-N 3.27Å | ||
| 62 | N | 53 | Low | 55.4 | Low | 156 Ų | 156 | 131.2 Ų | 131.2 | 83% | 0.834 | 73% | 0.734 | S | S | * | * | trans | -89.4 | 15.7 | 168.7 | -76.5 | -59.2 | 0 | 0 | 0 | 113 | E60 | E60-N62 VanDerWaalsContact C-N 3.34Å; E60-N62 PolarHBondContact O-N 3.11Å | ||
| 63 | L | 52.8 | Low | 54.5 | Low | 152 Ų | 152 | 132 Ų | 132 | 80% | 0.796 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -86.9 | 125.2 | 175.9 | -81.7 | 123.7 | 0 | 0 | 0 | 109.7 | S61 G65 | S61-L63 VanDerWaalsContact C-N 3.27Å; L63-G65 PolarHBondContact O-N 2.98Å |
| 64 | P | 53.4 | Low | 53.1 | Low | 123 Ų | 123 | 130.3 Ų | 130.3 | 80% | 0.799 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 116.9 | 168.4 | 23.5 | -29.6 | 0 | 0 | 0 | 107.7 | ||
| 65 | G | 53.6 | Low | 52.2 | Low | 48 Ų | 48 | 129.7 Ų | 129.7 | 50% | 0.495 | 73% | 0.733 | S | S | . | * | P | Polyproline II helix | trans | -56.7 | 142.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | L63 I67 | L63-G65 PolarHBondContact O-N 2.98Å; G65-I67 PolarHBondContact O-N 2.99Å |
| 66 | P | 53.3 | Low | 50.8 | Low | 119 Ų | 119 | 129.4 Ų | 129.4 | 77% | 0.773 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 125 | 175.2 | 24 | -31.3 | 0 | 0 | 0 | 109 | V68 | P66-V68 VanDerWaalsContact C-N 3.34Å; P66-V68 PolarHBondContact O-N 2.87Å |
| 67 | I | 45.6 | Very low | 49.7 | Very low | 167 Ų | 167 | 129.8 Ų | 129.8 | 86% | 0.856 | 74% | 0.741 | S | S | * | * | trans | -62.3 | 97.3 | 172.8 | -59.7 | 166.2 | 0 | 0 | 0 | 106.6 | G65 | G65-I67 PolarHBondContact O-N 2.99Š| ||
| 68 | V | 48.8 | Very low | 48.3 | Very low | 107 Ų | 107 | 127.8 Ų | 127.8 | 65% | 0.648 | 74% | 0.742 | S | S | * | * | trans | -74.3 | 123.8 | 166.7 | -179.3 | 0 | 0 | 0 | 0 | 106.3 | P66 S70 | P66-V68 VanDerWaalsContact C-N 3.34Å; P66-V68 PolarHBondContact O-N 2.87Å; V68-S70 PolarHBondContact O-N 2.74Å; V68-S70 VanDerWaalsContact O-N 3.07Å | ||
| 69 | P | 46.9 | Very low | 47.5 | Very low | 113 Ų | 113 | 131.8 Ų | 131.8 | 73% | 0.734 | 76% | 0.76 | S | S | * | * | trans | -59.2 | 118.5 | 177.7 | -16.9 | 28.8 | 0 | 0 | 0 | 108.7 | A71 | P69-A71 PolarHBondContact O-N 3.47Š| ||
| 70 | S | 44.4 | Very low | 46.7 | Very low | 116 Ų | 116 | 124.2 Ų | 124.2 | 81% | 0.811 | 75% | 0.747 | S | S | * | * | trans | -63.1 | 101.9 | 172.1 | -55.4 | 0 | 0 | 0 | 0 | 108.3 | V68 N72 | V68-S70 PolarHBondContact O-N 2.74Å; V68-S70 VanDerWaalsContact O-N 3.07Å; S70-N72 PolarHBondContact O-N 3Å | ||
| 71 | A | 44.8 | Very low | 45.9 | Very low | 84 Ų | 84 | 122.3 Ų | 122.3 | 69% | 0.694 | 74% | 0.742 | S | S | * | * | trans | -62.5 | 124.6 | 161 | 0 | 0 | 0 | 0 | 0 | 106.9 | P69 I73 | P69-A71 PolarHBondContact O-N 3.47Å; A71-I73 PolarHBondContact O-N 2.82Å | ||
| 72 | N | 39.3 | Very low | 45.3 | Very low | 166 Ų | 166 | 127.7 Ų | 127.7 | 89% | 0.888 | 76% | 0.763 | S | S | * | * | trans | -44.7 | 96.8 | -179.9 | -78.3 | -17.3 | 0 | 0 | 0 | 112.1 | S70 L74 | S70-N72 PolarHBondContact O-N 3Å; N72-L74 PolarHBondContact O-N 3.17Å | ||
| 73 | I | 42.4 | Very low | 44.6 | Very low | 149 Ų | 149 | 124.4 Ų | 124.4 | 76% | 0.764 | 75% | 0.749 | S | S | * | * | trans | -87.1 | 99.7 | 164.4 | -56.6 | 177.4 | 0 | 0 | 0 | 105.6 | A71 N75 | A71-I73 PolarHBondContact O-N 2.82Å; I73-N75 PolarHBondContact O-N 3.1Å; I73-N75 VanDerWaalsContact O-N 3.11Å | ||
| 74 | L | 41.9 | Very low | 44.3 | Very low | 163 Ų | 163 | 125.5 Ų | 125.5 | 85% | 0.853 | 75% | 0.754 | S | S | * | * | trans | -53.4 | 113.2 | 165.8 | -151.1 | 86.2 | 0 | 0 | 0 | 107.5 | N72 P76 | N72-L74 PolarHBondContact O-N 3.17Å; L74-P76 WeakPolarHBondContact O-CD 3.25Å | ||
| 75 | N | 41.5 | Very low | 43.9 | Very low | 139 Ų | 139 | 124.9 Ų | 124.9 | 74% | 0.743 | 75% | 0.748 | S | S | * | * | trans | -46.3 | 126.4 | 177.3 | -88.5 | -26.2 | 0 | 0 | 0 | 111.9 | I73 | I73-N75 PolarHBondContact O-N 3.1Å; I73-N75 VanDerWaalsContact O-N 3.11Å | ||
| 76 | P | 45.4 | Very low | 43.3 | Very low | 114 Ų | 114 | 130.9 Ų | 130.9 | 74% | 0.74 | 76% | 0.76 | S | S | * | * | trans | -82.1 | 103.4 | 136.7 | 29.1 | -19.3 | 0 | 0 | 0 | 107.1 | L74 S78 | L74-P76 WeakPolarHBondContact O-CD 3.25Å; P76-S78 PolarHBondContact O-N 2.82Å | ||
| 77 | T | 38.4 | Very low | 42.9 | Very low | 125 Ų | 125 | 132.4 Ų | 132.4 | 77% | 0.767 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -47.6 | 103.9 | 171 | -45.6 | 0 | 0 | 0 | 0 | 111 | ||
| 78 | S | 36.6 | Very low | 42.6 | Very low | 100 Ų | 100 | 130.5 Ų | 130.5 | 70% | 0.699 | 75% | 0.753 | S | S | * | * | trans | 177.9 | 108 | 149.3 | -73.7 | 0 | 0 | 0 | 0 | 108.1 | P76 S80 | P76-S78 PolarHBondContact O-N 2.82Å; S78-S80 VanDerWaalsContact C-N 3.29Å; S78-S80 PolarHBondContact O-N 2.78Å | ||
| 79 | P | 44.3 | Very low | 42.1 | Very low | 129 Ų | 129 | 131 Ų | 131 | 84% | 0.838 | 75% | 0.752 | S | S | * | * | trans | -68.9 | 95.5 | 165.1 | 29.1 | -28.9 | 0 | 0 | 0 | 106.9 | N81 | P79-N81 PolarHBondContact O-N 3.18Š| ||
| 80 | S | 43.6 | Very low | 41.8 | Very low | 99 Ų | 99 | 131.8 Ų | 131.8 | 69% | 0.692 | 76% | 0.757 | S | S | * | * | trans | -65.3 | 96 | 160.8 | -176.1 | 0 | 0 | 0 | 0 | 105.9 | S78 M82 | S78-S80 VanDerWaalsContact C-N 3.29Å; S78-S80 PolarHBondContact O-N 2.78Å; S80-M82 PolarHBondContact O-N 2.87Å | ||
| 81 | N | 41.3 | Very low | 41.5 | Very low | 140 Ų | 140 | 131 Ų | 131 | 75% | 0.749 | 75% | 0.752 | S | S | * | * | trans | -68.2 | 82.9 | 177.5 | -155.9 | -1.3 | 0 | 0 | 0 | 106.7 | P79 T83 | P79-N81 PolarHBondContact O-N 3.18Å; N81-T83 PolarHBondContact O-N 3.06Å | ||
| 82 | M | 39.2 | Very low | 41 | Very low | 173 Ų | 173 | 132.1 Ų | 132.1 | 85% | 0.852 | 75% | 0.753 | S | S | * | * | trans | -75.8 | 68.2 | 176.1 | -132.8 | -174.2 | -68 | 0 | 0 | 107.8 | S80 L84 | S80-M82 PolarHBondContact O-N 2.87Å; M82-L84 PolarHBondContact O-N 2.85Å | ||
| 83 | T | 39.6 | Very low | 40.8 | Very low | 86 Ų | 86 | 130.6 Ų | 130.6 | 53% | 0.528 | 76% | 0.756 | S | S | . | * | trans | -64.9 | 128.3 | 167.1 | -59.2 | 0 | 0 | 0 | 0 | 106.7 | N81 V85 | N81-T83 PolarHBondContact O-N 3.06Å; T83-V85 PolarHBondContact O-N 3.43Å | ||
| 84 | L | 46.4 | Very low | 40.8 | Very low | 175 Ų | 175 | 126 Ų | 126 | 92% | 0.916 | 75% | 0.745 | S | S | * | * | trans | -62.2 | 87.8 | 162.8 | -71.3 | 172.8 | 0 | 0 | 0 | 107.3 | M82 K86 | M82-L84 PolarHBondContact O-N 2.85Å; L84-K86 PolarHBondContact O-N 3.16Å | ||
| 85 | V | 43.8 | Very low | 40.9 | Very low | 110 Ų | 110 | 124.2 Ų | 124.2 | 67% | 0.667 | 75% | 0.746 | S | S | * | * | trans | -67.5 | 107.9 | 174.7 | -177.4 | 0 | 0 | 0 | 0 | 105.6 | T83 L87 | T83-V85 PolarHBondContact O-N 3.43Å; V85-L87 PolarHBondContact O-N 3.37Å | ||
| 86 | K | 42.4 | Very low | 41.5 | Very low | 174 Ų | 174 | 120.9 Ų | 120.9 | 76% | 0.757 | 75% | 0.745 | S | S | * | * | trans | -59.5 | 97.3 | 164.2 | -168.4 | 171.9 | -179.4 | 174.5 | 0 | 106 | L84 N88 | L84-K86 PolarHBondContact O-N 3.16Å; K86-N88 PolarHBondContact O-N 2.88Å | ||
| 87 | L | 43.4 | Very low | 42.3 | Very low | 151 Ų | 151 | 124 Ų | 124 | 79% | 0.791 | 75% | 0.747 | S | S | * | * | trans | -62.8 | 89 | 170.1 | -90 | 155.6 | 0 | 0 | 0 | 106.5 | V85 N89 | V85-L87 PolarHBondContact O-N 3.37Å; L87-N89 PolarHBondContact O-N 3.16Å | ||
| 88 | N | 40.2 | Very low | 43.9 | Very low | 128 Ų | 128 | 124.8 Ų | 124.8 | 68% | 0.684 | 75% | 0.746 | S | S | * | * | trans | -69.3 | 74 | 163.9 | -77 | 0.9 | 0 | 0 | 0 | 106.8 | K86 P90 | K86-N88 PolarHBondContact O-N 2.88Å; N88-P90 VanDerWaalsContact O-CD 3.25Å; N88-P90 WeakPolarHBondContact O-CD 3.49Å | ||
| 89 | N | 37.6 | Very low | 45.9 | Very low | 116 Ų | 116 | 123 Ų | 123 | 62% | 0.62 | 73% | 0.731 | S | S | * | * | trans | -75.9 | 109.8 | 165.6 | -131.5 | -10.3 | 0 | 0 | 0 | 105.9 | L87 S91 | L87-N89 PolarHBondContact O-N 3.16Å; N89-S91 PolarHBondContact O-N 3.24Å | ||
| 90 | P | 40.9 | Very low | 47.6 | Very low | 131 Ų | 131 | 122 Ų | 122 | 85% | 0.851 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.7 | 9.9 | -175.9 | 11.8 | 1.5 | 0 | 0 | 0 | 113 | N88 | N88-P90 VanDerWaalsContact O-CD 3.25Å; N88-P90 WeakPolarHBondContact O-CD 3.49Å |
| 91 | S | 39.3 | Very low | 49.5 | Very low | 99 Ų | 99 | 118.8 Ų | 118.8 | 69% | 0.692 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.2 | 16 | -174.1 | 51.8 | 0 | 0 | 0 | 0 | 114.7 | N89 | N89-S91 PolarHBondContact O-N 3.24Š|
| 92 | C | 34.6 | Very low | 51.5 | Low | 108 Ų | 108 | 116.1 Ų | 116.1 | 73% | 0.73 | 69% | 0.687 | S | S | * | * | trans | -129.5 | 83 | 167.6 | -144.4 | 0 | 0 | 0 | 0 | 110.4 | G94 | C92-G94 PolarHBondContact O-N 2.95Š| ||
| 93 | S | 34.8 | Very low | 53.7 | Low | 134 Ų | 134 | 111.9 Ų | 111.9 | 94% | 0.937 | 66% | 0.664 | S | S | * | * | trans | -64.4 | 87.2 | 160.8 | 161.6 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 94 | G | 41.4 | Very low | 56.1 | Low | 53 Ų | 53 | 108.6 Ų | 108.6 | 55% | 0.546 | 64% | 0.644 | S | S | . | * | trans | -170.5 | 117.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | C92 G96 | C92-G94 PolarHBondContact O-N 2.95Å; G94-G96 PolarHBondContact O-N 3.5Å | ||
| 95 | S | 44.9 | Very low | 57.9 | Low | 124 Ų | 124 | 105 Ų | 105 | 87% | 0.867 | 62% | 0.624 | S | S | * | * | trans | -64.2 | 60.3 | 164 | 51.1 | 0 | 0 | 0 | 0 | 110.2 | K97 | S95-K97 VanDerWaalsContact C-N 3.26Å; S95-K97 PolarHBondContact O-N 3.24Å | ||
| 96 | G | 54.3 | Low | 59.9 | Low | 70 Ų | 70 | 104.6 Ų | 104.6 | 72% | 0.722 | 63% | 0.626 | S | S | * | * | trans | -66 | 89.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 107.9 | G94 L98 | G94-G96 PolarHBondContact O-N 3.5Å; G96-L98 PolarHBondContact O-N 3.19Å | ||
| 97 | K | 62.3 | Low | 62.1 | Low | 178 Ų | 178 | 100 Ų | 100 | 77% | 0.774 | 61% | 0.61 | S | S | * | * | trans | -48.6 | 119.7 | 167.5 | -73 | 177.7 | 176.4 | 177.7 | 0 | 106.2 | S95 T99 | S95-K97 VanDerWaalsContact C-N 3.26Å; S95-K97 PolarHBondContact O-N 3.24Å; K97-T99 PolarHBondContact O-N 2.97Å | ||
| 98 | L | 70.1 | Confident | 64.2 | Low | 143 Ų | 143 | 96.1 Ų | 96.1 | 75% | 0.749 | 61% | 0.605 | S | S | * | * | trans | -63.8 | 95 | 171 | -168 | 90.5 | 0 | 0 | 0 | 106.2 | G96 | G96-L98 PolarHBondContact O-N 3.19Š| ||
| 99 | T | 78.6 | Confident | 66.5 | Low | 63 Ų | 63 | 93.3 Ų | 93.3 | 39% | 0.387 | 59% | 0.59 | S | S | . | * | trans | -77.6 | 149.4 | 175.6 | 62.8 | 0 | 0 | 0 | 0 | 108.5 | K97 A101 N102 F103 | K97-T99 PolarHBondContact O-N 2.97Å; T99-A101 PolarHBondContact O-N 3.06Å; T99-N102 PolarHBondContact O-N 3.25Å; T99-N102 WeakPolarHBondContact OG1-CB 3.42Å; T99-N102 PolarHBondContact OG1-N 3.35Å; T99-N102 VanDerWaalsContact OG1-N 3.15Å; T99-N102 PolarHBondContact OG1-ND2 3.02Å; T99-N102 PolarHBondContact OG1-OD1 2.7Å; T99-F103 PolarHBondContact O-N 3.05Å | ||
| 100 | T | 80.6 | Confident | 68.7 | Low | 108 Ų | 108 | 89.4 Ų | 89.4 | 66% | 0.663 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -53.2 | -37.6 | 174.1 | -50.4 | 0 | 0 | 0 | 0 | 111 | F103 L104 | T100-F103 PolarHBondContact O-N 3.01Å; T100-L104 HydrophobicContact CG2-CD1 4.12Å; T100-L104 HydrophobicContact CG2-CG 4.47Å; T100-L104 VanDerWaalsContact O-CG 3.3Å; T100-L104 WeakPolarHBondContact O-CG 3.5Å; T100-L104 PolarHBondContact O-N 3.32Å |
| 101 | A | 84 | Confident | 70.8 | Confident | 31 Ų | 31 | 91.2 Ų | 91.2 | 26% | 0.256 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -58.9 | -50 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | T99 F103 L104 I105 V113 | T99-A101 PolarHBondContact O-N 3.06Å; A101-F103 VanDerWaalsContact C-N 3.28Å; A101-F103 PolarHBondContact O-N 3.4Å; A101-L104 PolarHBondContact O-N 3.16Å; A101-I105 WeakPolarHBondContact O-CB 3.34Å; A101-I105 WeakPolarHBondContact O-CD1 3.42Å; A101-I105 VanDerWaalsContact O-CG1 3.24Å; A101-I105 WeakPolarHBondContact O-CG1 3.4Å; A101-I105 PolarHBondContact O-N 3.36Å; A101-V113 HydrophobicContact CB-CG1 3.82Å; A101-V113 HydrophobicContact CB-CG2 4.29Å |
| 102 | N | 83.8 | Confident | 73.1 | Confident | 83 Ų | 83 | 89.7 Ų | 89.7 | 44% | 0.444 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -62.9 | -36.7 | 179.5 | -71.6 | -6.7 | 0 | 0 | 0 | 112.1 | T99 S106 | T99-N102 PolarHBondContact O-N 3.25Å; T99-N102 WeakPolarHBondContact OG1-CB 3.42Å; T99-N102 PolarHBondContact OG1-N 3.35Å; T99-N102 VanDerWaalsContact OG1-N 3.15Å; T99-N102 PolarHBondContact OG1-ND2 3.02Å; T99-N102 PolarHBondContact OG1-OD1 2.7Å; N102-S106 WeakPolarHBondContact O-CB 2.97Å; N102-S106 PolarHBondContact O-N 2.91Å; N102-S106 PolarHBondContact O-OG 3.47Å |
| 103 | F | 85.6 | Confident | 75.4 | Confident | 84 Ų | 84 | 85.4 Ų | 85.4 | 37% | 0.368 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64 | -49.1 | 174.6 | 176.9 | -103.5 | 0 | 0 | 0 | 111.8 | I8 T99 T100 A101 I105 S106 L107 | I8-F103 HydrophobicContact CD1-CE1 3.87Å; I8-F103 HydrophobicContact CD1-CZ 4.13Å; T99-F103 PolarHBondContact O-N 3.05Å; T100-F103 PolarHBondContact O-N 3.01Å; A101-F103 VanDerWaalsContact C-N 3.28Å; A101-F103 PolarHBondContact O-N 3.4Å; F103-I105 PolarHBondContact O-N 3.32Å; F103-S106 PolarHBondContact O-N 3.27Å; F103-L107 HydrophobicContact CD1-CD1 4.13Å; F103-L107 HydrophobicContact CE1-CD1 3.52Å; F103-L107 HydrophobicContact CE2-CD1 4.18Å; F103-L107 HydrophobicContact CZ-CD1 3.56Å; F103-L107 HydrophobicContact CZ-CG 4.41Å; F103-L107 WeakPolarHBondContact O-CG 3.3Å; F103-L107 PolarHBondContact O-N 2.97Å |
| 104 | L | 88.4 | Confident | 77.7 | Confident | 18 Ų | 18 | 84 Ų | 84 | 9% | 0.094 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -63.5 | -42.8 | 178.8 | -69.7 | 172.4 | 0 | 0 | 0 | 112.1 | T100 A101 S106 L107 G108 L109 L112 V113 F116 | T100-L104 HydrophobicContact CG2-CD1 4.12Å; T100-L104 HydrophobicContact CG2-CG 4.47Å; T100-L104 VanDerWaalsContact O-CG 3.3Å; T100-L104 WeakPolarHBondContact O-CG 3.5Å; T100-L104 PolarHBondContact O-N 3.32Å; A101-L104 PolarHBondContact O-N 3.16Å; L104-S106 VanDerWaalsContact C-N 3.31Å; L104-S106 PolarHBondContact O-N 3.4Å; L104-L107 PolarHBondContact O-N 3.35Å; L104-L107 VanDerWaalsContact O-N 3.16Å; L104-G108 PolarHBondContact O-N 2.88Å; L104-L109 HydrophobicContact CB-CB 4.31Å; L104-L109 HydrophobicContact CD2-CB 4.24Å; L104-L109 HydrophobicContact CD2-CD1 4.03Å; L104-L109 WeakPolarHBondContact O-CA 3.24Å; L104-L109 WeakPolarHBondContact O-CB 3.43Å; L104-L109 PolarHBondContact O-N 3.2Å; L104-L112 HydrophobicContact CD1-CB 4.45Å; L104-V113 HydrophobicContact CB-CG2 3.7Å; L104-V113 HydrophobicContact CD1-CG2 3.96Å; L104-V113 HydrophobicContact CG-CG2 4.49Å; L104-F116 HydrophobicContact CD1-CD2 3.91Å; L104-F116 HydrophobicContact CD1-CE2 3.83Å |
| 105 | I | 86 | Confident | 79.8 | Confident | 98 Ų | 98 | 86.3 Ų | 86.3 | 50% | 0.503 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.1 | -43.2 | 175.4 | -68.4 | 164.6 | 0 | 0 | 0 | 110.5 | A101 F103 L107 G108 V113 | A101-I105 WeakPolarHBondContact O-CB 3.34Å; A101-I105 WeakPolarHBondContact O-CD1 3.42Å; A101-I105 VanDerWaalsContact O-CG1 3.24Å; A101-I105 WeakPolarHBondContact O-CG1 3.4Å; A101-I105 PolarHBondContact O-N 3.36Å; F103-I105 PolarHBondContact O-N 3.32Å; I105-L107 PolarHBondContact O-N 3.41Å; I105-G108 PolarHBondContact O-N 3.15Å; I105-V113 HydrophobicContact CG1-CG2 4.14Å |
| 106 | S | 85.8 | Confident | 81.7 | Confident | 102 Ų | 102 | 85.5 Ų | 85.5 | 71% | 0.713 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -64.3 | -24.6 | 179 | -58.9 | 0 | 0 | 0 | 0 | 113.4 | N102 F103 L104 G108 | N102-S106 WeakPolarHBondContact O-CB 2.97Å; N102-S106 PolarHBondContact O-N 2.91Å; N102-S106 PolarHBondContact O-OG 3.47Å; F103-S106 PolarHBondContact O-N 3.27Å; L104-S106 VanDerWaalsContact C-N 3.31Å; L104-S106 PolarHBondContact O-N 3.4Å; S106-G108 VanDerWaalsContact C-N 3.35Å |
| 107 | L | 87.7 | Confident | 82.9 | Confident | 79 Ų | 79 | 88.1 Ų | 88.1 | 41% | 0.414 | 48% | 0.481 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87 | -0.1 | 174 | -65.9 | 178.4 | 0 | 0 | 0 | 113.6 | F103 L104 I105 L109 | F103-L107 HydrophobicContact CD1-CD1 4.13Å; F103-L107 HydrophobicContact CE1-CD1 3.52Å; F103-L107 HydrophobicContact CE2-CD1 4.18Å; F103-L107 HydrophobicContact CZ-CD1 3.56Å; F103-L107 HydrophobicContact CZ-CG 4.41Å; F103-L107 WeakPolarHBondContact O-CG 3.3Å; F103-L107 PolarHBondContact O-N 2.97Å; L104-L107 PolarHBondContact O-N 3.35Å; L104-L107 VanDerWaalsContact O-N 3.16Å; I105-L107 PolarHBondContact O-N 3.41Å; L107-L109 VanDerWaalsContact C-N 3.28Å; L107-L109 HydrophobicContact CB-CD1 4.08Å; L107-L109 HydrophobicContact CB-CG 4.08Å; L107-L109 HydrophobicContact CD1-CD1 4.24Å |
| 108 | G | 86.5 | Confident | 83.8 | Confident | 68 Ų | 68 | 86.1 Ų | 86.1 | 70% | 0.701 | 47% | 0.472 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.7 | 11 | -173.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | L104 I105 S106 G110 | L104-G108 PolarHBondContact O-N 2.88Å; I105-G108 PolarHBondContact O-N 3.15Å; S106-G108 VanDerWaalsContact C-N 3.35Å; G108-G110 VanDerWaalsContact C-N 3.3Å; G108-G110 PolarHBondContact O-N 3.01Å |
| 109 | L | 88.5 | Confident | 84.2 | Confident | 70 Ų | 70 | 86.1 Ų | 86.1 | 37% | 0.366 | 47% | 0.468 | S | S | . | . | trans | -94.5 | 33 | -179.4 | -58.6 | 174.7 | 0 | 0 | 0 | 112.2 | L104 L107 Q111 L112 | L104-L109 HydrophobicContact CB-CB 4.31Å; L104-L109 HydrophobicContact CD2-CB 4.24Å; L104-L109 HydrophobicContact CD2-CD1 4.03Å; L104-L109 WeakPolarHBondContact O-CA 3.24Å; L104-L109 WeakPolarHBondContact O-CB 3.43Å; L104-L109 PolarHBondContact O-N 3.2Å; L107-L109 VanDerWaalsContact C-N 3.28Å; L107-L109 HydrophobicContact CB-CD1 4.08Å; L107-L109 HydrophobicContact CB-CG 4.08Å; L107-L109 HydrophobicContact CD1-CD1 4.24Å; L109-Q111 PolarHBondContact O-N 2.82Å; L109-Q111 VanDerWaalsContact O-N 3.16Å; L109-L112 HydrophobicContact CB-CD1 4Å; L109-L112 HydrophobicContact CB-CG 4.34Å; L109-L112 HydrophobicContact CD1-CD1 4.09Å; L109-L112 HydrophobicContact CD2-CD1 4.31Å; L109-L112 HydrophobicContact CG-CD1 4.37Å; L109-L112 WeakPolarHBondContact O-CB 3.5Å; L109-L112 PolarHBondContact O-N 2.78Å | ||
| 110 | G | 85.7 | Confident | 83.6 | Confident | 33 Ų | 33 | 90.1 Ų | 90.1 | 34% | 0.34 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -56.8 | -32.3 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | G108 L112 V113 E114 | G108-G110 VanDerWaalsContact C-N 3.3Å; G108-G110 PolarHBondContact O-N 3.01Å; G110-L112 VanDerWaalsContact C-N 3.26Å; G110-L112 PolarHBondContact O-N 2.71Å; G110-V113 WeakPolarHBondContact O-CB 3.45Å; G110-V113 PolarHBondContact O-N 3.43Å; G110-V113 VanDerWaalsContact O-N 3.07Å; G110-E114 PolarHBondContact O-N 2.89Å |
| 111 | Q | 84.6 | Confident | 82.6 | Confident | 169 Ų | 169 | 91.2 Ų | 91.2 | 79% | 0.79 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63.4 | -29.6 | 176.1 | -65.3 | -178.2 | 1.4 | 0 | 0 | 113.1 | L109 V113 E114 L115 | L109-Q111 PolarHBondContact O-N 2.82Å; L109-Q111 VanDerWaalsContact O-N 3.16Å; Q111-V113 VanDerWaalsContact C-N 3.3Å; Q111-E114 PolarHBondContact O-N 3.09Å; Q111-L115 PolarHBondContact O-N 3.29Å; Q111-L115 VanDerWaalsContact O-N 3.12Å |
| 112 | L | 86.3 | Confident | 80.8 | Confident | 67 Ų | 67 | 97.3 Ų | 97.3 | 35% | 0.351 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -69.3 | -31.1 | 174.9 | -67.8 | -178.3 | 0 | 0 | 0 | 111.6 | L104 L109 G110 E114 L115 F116 | L104-L112 HydrophobicContact CD1-CB 4.45Å; L109-L112 HydrophobicContact CB-CD1 4Å; L109-L112 HydrophobicContact CB-CG 4.34Å; L109-L112 HydrophobicContact CD1-CD1 4.09Å; L109-L112 HydrophobicContact CD2-CD1 4.31Å; L109-L112 HydrophobicContact CG-CD1 4.37Å; L109-L112 WeakPolarHBondContact O-CB 3.5Å; L109-L112 PolarHBondContact O-N 2.78Å; G110-L112 VanDerWaalsContact C-N 3.26Å; G110-L112 PolarHBondContact O-N 2.71Å; L112-E114 VanDerWaalsContact C-N 3.33Å; L112-L115 PolarHBondContact O-N 2.87Å; L112-F116 HydrophobicContact CB-CD2 4.31Å; L112-F116 HydrophobicContact CB-CE2 4.04Å; L112-F116 WeakPolarHBondContact O-CB 3.4Å; L112-F116 WeakPolarHBondContact O-CD2 3.33Å; L112-F116 WeakPolarHBondContact O-CG 3.4Å; L112-F116 PolarHBondContact O-N 3.12Å |
| 113 | V | 84 | Confident | 80.6 | Confident | 18 Ų | 18 | 98 Ų | 98 | 11% | 0.109 | 54% | 0.538 | C | S | . | . | H | α-helix | trans | -61.6 | -46.8 | 175.4 | -176.5 | 0 | 0 | 0 | 0 | 109.8 | A101 L104 I105 G110 Q111 L115 F116 E117 | A101-V113 HydrophobicContact CB-CG1 3.82Å; A101-V113 HydrophobicContact CB-CG2 4.29Å; L104-V113 HydrophobicContact CB-CG2 3.7Å; L104-V113 HydrophobicContact CD1-CG2 3.96Å; L104-V113 HydrophobicContact CG-CG2 4.49Å; I105-V113 HydrophobicContact CG1-CG2 4.14Å; G110-V113 WeakPolarHBondContact O-CB 3.45Å; G110-V113 PolarHBondContact O-N 3.43Å; G110-V113 VanDerWaalsContact O-N 3.07Å; Q111-V113 VanDerWaalsContact C-N 3.3Å; V113-L115 VanDerWaalsContact C-N 3.3Å; V113-L115 PolarHBondContact O-N 2.99Å; V113-F116 PolarHBondContact O-N 3.4Å; V113-E117 WeakPolarHBondContact O-CG 3.38Å; V113-E117 PolarHBondContact O-N 3.49Å |
| 114 | E | 82.3 | Confident | 80.3 | Confident | 105 Ų | 105 | 98.7 Ų | 98.7 | 49% | 0.491 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.5 | -37.9 | 176.9 | -165.1 | -170.9 | 154.3 | 0 | 0 | 112 | G110 Q111 L112 E117 K118 | G110-E114 PolarHBondContact O-N 2.89Å; Q111-E114 PolarHBondContact O-N 3.09Å; L112-E114 VanDerWaalsContact C-N 3.33Å; E114-E117 PolarHBondContact O-N 3.07Å; E114-K118 HydrophobicContact CG-CD 4.46Å; E114-K118 WeakPolarHBondContact O-CB 3.44Å; E114-K118 WeakPolarHBondContact O-CG 3.35Å; E114-K118 PolarHBondContact O-N 3.4Å; E114-K118 IonicContact OE1-NZ 2.73Å; E114-K118 PolarHBondContact OE1-NZ 3.42Å |
| 115 | L | 85.3 | Confident | 79.9 | Confident | 102 Ų | 102 | 103.2 Ų | 103.2 | 53% | 0.534 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -67.8 | -42 | 178 | -159.7 | 143.4 | 0 | 0 | 0 | 111.6 | Q111 L112 V113 K118 E119 | Q111-L115 PolarHBondContact O-N 3.29Å; Q111-L115 VanDerWaalsContact O-N 3.12Å; L112-L115 PolarHBondContact O-N 2.87Å; V113-L115 VanDerWaalsContact C-N 3.3Å; V113-L115 PolarHBondContact O-N 2.99Å; L115-K118 PolarHBondContact O-N 3.42Å; L115-E119 WeakPolarHBondContact O-CB 3.48Å; L115-E119 PolarHBondContact O-N 3.27Å |
| 116 | F | 84.7 | Confident | 79.5 | Confident | 106 Ų | 106 | 103.5 Ų | 103.5 | 47% | 0.465 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -66 | -38.9 | 174.1 | -71.2 | -53.1 | 0 | 0 | 0 | 112.3 | L104 L112 V113 L120 | L104-F116 HydrophobicContact CD1-CD2 3.91Å; L104-F116 HydrophobicContact CD1-CE2 3.83Å; L112-F116 HydrophobicContact CB-CD2 4.31Å; L112-F116 HydrophobicContact CB-CE2 4.04Å; L112-F116 WeakPolarHBondContact O-CB 3.4Å; L112-F116 WeakPolarHBondContact O-CD2 3.33Å; L112-F116 WeakPolarHBondContact O-CG 3.4Å; L112-F116 PolarHBondContact O-N 3.12Å; V113-F116 PolarHBondContact O-N 3.4Å; F116-L120 WeakPolarHBondContact O-CB 3.37Å; F116-L120 WeakPolarHBondContact O-CD1 3.5Å; F116-L120 WeakPolarHBondContact O-CG 3.41Å; F116-L120 PolarHBondContact O-N 3.42Å; F116-L120 VanDerWaalsContact O-N 3.09Å |
| 117 | E | 80.9 | Confident | 79.2 | Confident | 125 Ų | 125 | 103.6 Ų | 103.6 | 58% | 0.584 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -65.5 | -38.6 | 175.8 | -75.7 | -178.2 | 179.2 | 0 | 0 | 112.2 | V113 E114 V121 | V113-E117 WeakPolarHBondContact O-CG 3.38Å; V113-E117 PolarHBondContact O-N 3.49Å; E114-E117 PolarHBondContact O-N 3.07Å; E117-V121 WeakPolarHBondContact O-CG2 3.43Å |
| 118 | K | 80.6 | Confident | 78.6 | Confident | 137 Ų | 137 | 105.3 Ų | 105.3 | 60% | 0.596 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -67.7 | -43.5 | 175.4 | -83.3 | 170.8 | 165.2 | 159.3 | 0 | 112.7 | E114 L115 L120 V121 | E114-K118 HydrophobicContact CG-CD 4.46Å; E114-K118 WeakPolarHBondContact O-CB 3.44Å; E114-K118 WeakPolarHBondContact O-CG 3.35Å; E114-K118 PolarHBondContact O-N 3.4Å; E114-K118 IonicContact OE1-NZ 2.73Å; E114-K118 PolarHBondContact OE1-NZ 3.42Å; L115-K118 PolarHBondContact O-N 3.42Å; K118-L120 VanDerWaalsContact C-N 3.34Å; K118-L120 PolarHBondContact O-N 3.49Å; K118-V121 PolarHBondContact O-N 2.95Å |
| 119 | E | 78.5 | Confident | 78 | Confident | 143 Ų | 143 | 107.9 Ų | 107.9 | 67% | 0.668 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -69.6 | -31.6 | -178.2 | -165 | 69.3 | -172.2 | 0 | 0 | 112.2 | L115 V121 | L115-E119 WeakPolarHBondContact O-CB 3.48Å; L115-E119 PolarHBondContact O-N 3.27Å; E119-V121 VanDerWaalsContact C-N 3.28Å; E119-V121 PolarHBondContact O-N 2.73Å |
| 120 | L | 65.4 | Low | 77.2 | Confident | 146 Ų | 146 | 110.8 Ų | 110.8 | 76% | 0.764 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | -10.8 | 179.5 | -82.3 | 162.3 | 0 | 0 | 0 | 114.5 | F116 K118 | F116-L120 WeakPolarHBondContact O-CB 3.37Å; F116-L120 WeakPolarHBondContact O-CD1 3.5Å; F116-L120 WeakPolarHBondContact O-CG 3.41Å; F116-L120 PolarHBondContact O-N 3.42Å; F116-L120 VanDerWaalsContact O-N 3.09Å; K118-L120 VanDerWaalsContact C-N 3.34Å; K118-L120 PolarHBondContact O-N 3.49Å |
| 121 | V | 59.5 | Low | 76.5 | Confident | 131 Ų | 131 | 117.3 Ų | 117.3 | 79% | 0.794 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.1 | -4.3 | -177.7 | 178.9 | 0 | 0 | 0 | 0 | 112.5 | E117 K118 E119 | E117-V121 WeakPolarHBondContact O-CG2 3.43Å; K118-V121 PolarHBondContact O-N 2.95Å; E119-V121 VanDerWaalsContact C-N 3.28Å; E119-V121 PolarHBondContact O-N 2.73Å |
| 122 | S | 46.2 | Very low | 75.8 | Confident | 159 Ų | 159 | 112.6 Ų | 112.6 | 100% | 1.112 | 59% | 0.588 | S | S | * | * | trans | -91.8 | 0 | 173.3 | -170.8 | 0 | 0 | 0 | 0 | 113 |
Retrieved 122 of 122 residues in 67.4 ms
(Link to these results)