| 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 | 43 | Very low | 66.8 | Low | 245 Ų | 245 | 162.4 Ų | 162.4 | 100% | 1.207 | 86% | 0.864 | S | S | * | * | 0 | 102.4 | 0 | -74.5 | 170.6 | 173.2 | 0 | 0 | 105.4 | |||||
| 2 | E | 48.4 | Very low | 67.4 | Low | 187 Ų | 187 | 158.8 Ų | 158.8 | 87% | 0.874 | 86% | 0.857 | S | S | * | * | P | Polyproline II helix | trans | -87.5 | 139.3 | 176.3 | -73.7 | -156.5 | 109.8 | 0 | 0 | 109.7 | ||
| 3 | P | 62.3 | Low | 68.2 | Low | 123 Ų | 123 | 161.2 Ų | 161.2 | 80% | 0.799 | 86% | 0.863 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 129.6 | 175.8 | -13.6 | 28.6 | 0 | 0 | 0 | 110.8 | E5 | P3-E5 PolarHBondContact O-N 3.37Š|
| 4 | T | 60.4 | Low | 69 | Low | 139 Ų | 139 | 162.1 Ų | 162.1 | 85% | 0.853 | 86% | 0.86 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 122.9 | 169.8 | -40.8 | 0 | 0 | 0 | 0 | 109.1 | ||
| 5 | E | 73.1 | Confident | 69.3 | Low | 178 Ų | 178 | 158.7 Ų | 158.7 | 83% | 0.832 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 144.2 | 176.3 | -63.7 | -147.5 | 124.3 | 0 | 0 | 111.5 | P3 | P3-E5 PolarHBondContact O-N 3.37Š|
| 6 | P | 69.2 | Low | 69.9 | Low | 121 Ų | 121 | 157.5 Ų | 157.5 | 79% | 0.786 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 141.9 | -177.8 | 29.9 | -32.2 | 0 | 0 | 0 | 110.8 | ||
| 7 | M | 71.8 | Confident | 70.5 | Confident | 192 Ų | 192 | 158.7 Ų | 158.7 | 95% | 0.946 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 137.5 | 169.3 | -106.2 | -177.9 | 157.7 | 0 | 0 | 110.3 | ||
| 8 | E | 75.3 | Confident | 70.7 | Confident | 177 Ų | 177 | 156.5 Ų | 156.5 | 83% | 0.827 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 141.5 | 173.3 | -81.5 | -91.7 | 111.2 | 0 | 0 | 111.4 | ||
| 9 | P | 73 | Confident | 70.8 | Confident | 108 Ų | 108 | 158.1 Ų | 158.1 | 70% | 0.701 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 138.2 | -179.6 | 28.5 | -31.9 | 0 | 0 | 0 | 111.8 | E11 | P9-E11 PolarHBondContact O-N 2.97Š|
| 10 | T | 77.8 | Confident | 71.1 | Confident | 140 Ų | 140 | 159 Ų | 159 | 86% | 0.859 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 129.9 | 171 | -48.4 | 0 | 0 | 0 | 0 | 110.1 | ||
| 11 | E | 80.5 | Confident | 71 | Confident | 176 Ų | 176 | 156.6 Ų | 156.6 | 82% | 0.822 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 143.3 | 176.4 | -65.9 | -136.2 | 121.3 | 0 | 0 | 111.8 | P9 | P9-E11 PolarHBondContact O-N 2.97Š|
| 12 | P | 74.6 | Confident | 72.4 | Confident | 120 Ų | 120 | 151.7 Ų | 151.7 | 78% | 0.779 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 144.5 | -178.7 | 29.3 | -33 | 0 | 0 | 0 | 110.9 | ||
| 13 | M | 77.2 | Confident | 73.7 | Confident | 189 Ų | 189 | 151 Ų | 151 | 93% | 0.931 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 138.4 | 172.8 | -154.3 | 173.9 | 179.7 | 0 | 0 | 109.6 | ||
| 14 | E | 79 | Confident | 73.8 | Confident | 175 Ų | 175 | 151 Ų | 151 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 140.5 | 177.9 | -79.3 | -101.4 | 109.2 | 0 | 0 | 111.5 | ||
| 15 | P | 74.3 | Confident | 74 | Confident | 110 Ų | 110 | 153.4 Ų | 153.4 | 71% | 0.714 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 138.2 | -179.4 | 27.6 | -32 | 0 | 0 | 0 | 111.4 | E17 | P15-E17 PolarHBondContact O-N 2.93Š|
| 16 | T | 78 | Confident | 73.6 | Confident | 140 Ų | 140 | 153.3 Ų | 153.3 | 86% | 0.859 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -65 | 130.2 | 170.7 | -47.9 | 0 | 0 | 0 | 0 | 109.8 | ||
| 17 | E | 81.4 | Confident | 73.3 | Confident | 178 Ų | 178 | 153 Ų | 153 | 83% | 0.832 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 143.2 | 176 | -65.8 | -132.1 | 117 | 0 | 0 | 111.7 | P15 | P15-E17 PolarHBondContact O-N 2.93Š|
| 18 | P | 73.1 | Confident | 73 | Confident | 119 Ų | 119 | 150.4 Ų | 150.4 | 77% | 0.773 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 145.2 | -179.2 | 28.3 | -32.8 | 0 | 0 | 0 | 111 | ||
| 19 | M | 73.4 | Confident | 72.6 | Confident | 187 Ų | 187 | 150.3 Ų | 150.3 | 92% | 0.921 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 136.5 | 172.8 | -153 | 174.7 | -170.8 | 0 | 0 | 109.5 | ||
| 20 | E | 76.8 | Confident | 72.2 | Confident | 175 Ų | 175 | 150 Ų | 150 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 138.8 | 177.3 | -78.4 | -106 | 109.1 | 0 | 0 | 111.3 | ||
| 21 | P | 68.7 | Low | 71.6 | Confident | 110 Ų | 110 | 152.4 Ų | 152.4 | 71% | 0.714 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 137.3 | -179.9 | 26.7 | -32 | 0 | 0 | 0 | 111.2 | E23 | P21-E23 PolarHBondContact O-N 2.86Š|
| 22 | T | 72.2 | Confident | 70.6 | Confident | 141 Ų | 141 | 152 Ų | 152 | 87% | 0.865 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 127.8 | 171.2 | -48.1 | 0 | 0 | 0 | 0 | 110 | ||
| 23 | E | 76.1 | Confident | 70 | Confident | 174 Ų | 174 | 149.5 Ų | 149.5 | 81% | 0.813 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 143.7 | 176.5 | -66 | -152.2 | 124.2 | 0 | 0 | 111.7 | P21 | P21-E23 PolarHBondContact O-N 2.86Š|
| 24 | P | 64.8 | Low | 69.1 | Low | 121 Ų | 121 | 144.6 Ų | 144.6 | 79% | 0.786 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 143.1 | 178.9 | 27 | -32.4 | 0 | 0 | 0 | 110.7 | E26 | P24-E26 PolarHBondContact O-N 3.36Š|
| 25 | M | 63.3 | Low | 68 | Low | 190 Ų | 190 | 147.6 Ų | 147.6 | 94% | 0.936 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -60 | 131.7 | 174.3 | -161.2 | 172.1 | -176.7 | 0 | 0 | 109.6 | ||
| 26 | E | 64.6 | Low | 67 | Low | 177 Ų | 177 | 147.8 Ų | 147.8 | 83% | 0.827 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 140.5 | -179.8 | -81.2 | -139.7 | 120.5 | 0 | 0 | 111.7 | P24 T28 | P24-E26 PolarHBondContact O-N 3.36Å; E26-T28 PolarHBondContact O-N 3.26Å |
| 27 | P | 64 | Low | 65.8 | Low | 113 Ų | 113 | 143.9 Ų | 143.9 | 73% | 0.734 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 138 | 176.6 | 25.8 | -31.8 | 0 | 0 | 0 | 110.2 | E29 | P27-E29 PolarHBondContact O-N 3.36Š|
| 28 | T | 64.8 | Low | 64.7 | Low | 138 Ų | 138 | 142.6 Ų | 142.6 | 85% | 0.847 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 126.6 | 174.1 | -54.7 | 0 | 0 | 0 | 0 | 109.7 | E26 | E26-T28 PolarHBondContact O-N 3.26Š|
| 29 | E | 66.9 | Low | 64 | Low | 176 Ų | 176 | 148.1 Ų | 148.1 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 137.3 | -179.6 | -69.4 | -162.4 | 134.2 | 0 | 0 | 111.6 | P27 | P27-E29 PolarHBondContact O-N 3.36Š|
| 30 | P | 64.8 | Low | 63.7 | Low | 101 Ų | 101 | 141.5 Ų | 141.5 | 66% | 0.656 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 135.6 | 179.3 | 27.1 | -31.3 | 0 | 0 | 0 | 110.6 | E32 | P30-E32 PolarHBondContact O-N 3.46Š|
| 31 | M | 64.6 | Low | 63.6 | Low | 190 Ų | 190 | 134.3 Ų | 134.3 | 94% | 0.936 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 126 | 177.9 | -160.2 | 167.4 | -164 | 0 | 0 | 110.3 | ||
| 32 | E | 60.9 | Low | 64 | Low | 167 Ų | 167 | 132.9 Ų | 132.9 | 78% | 0.78 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 129.6 | -177.4 | -81.1 | -164 | 126.3 | 0 | 0 | 112 | P30 | P30-E32 PolarHBondContact O-N 3.46Š|
| 33 | P | 60.5 | Low | 64.5 | Low | 68 Ų | 68 | 129 Ų | 129 | 44% | 0.442 | 70% | 0.698 | S | S | . | * | P | Polyproline II helix | trans | -70.5 | 134.6 | 176.4 | 28 | -31.5 | 0 | 0 | 0 | 110.5 | R35 L45 | P33-R35 PolarHBondContact O-N 3.5Å; P33-L45 HydrophobicContact CB-CD1 4.1Å; P33-L45 HydrophobicContact CG-CD1 4.41Å |
| 34 | A | 58.3 | Low | 64.9 | Low | 86 Ų | 86 | 126.1 Ų | 126.1 | 71% | 0.711 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 130.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | S36 | A34-S36 PolarHBondContact O-N 3.12Š|
| 35 | R | 56 | Low | 65.8 | Low | 238 Ų | 238 | 124.5 Ų | 124.5 | 90% | 0.898 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.7 | 37.7 | -165.5 | -70.3 | -178.7 | 176.2 | 152.9 | 1.9 | 118.5 | P33 | P33-R35 PolarHBondContact O-N 3.5Š|
| 36 | S | 52.8 | Low | 66.8 | Low | 115 Ų | 115 | 124.3 Ų | 124.3 | 80% | 0.804 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.9 | 3.1 | -179.1 | 58.5 | 0 | 0 | 0 | 0 | 116.7 | A34 | A34-S36 PolarHBondContact O-N 3.12Š|
| 37 | A | 53.9 | Low | 68.1 | Low | 57 Ų | 57 | 121.7 Ų | 121.7 | 47% | 0.471 | 65% | 0.649 | S | S | . | * | trans | -117.1 | 32.2 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | R39 G41 | A37-R39 PolarHBondContact O-N 3.44Å; A37-G41 PolarHBondContact O-N 2.82Å | ||
| 38 | H | 57.8 | Low | 69.4 | Low | 152 Ų | 152 | 121.2 Ų | 121.2 | 70% | 0.704 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.3 | 30 | -159.9 | -168.4 | 52.5 | 0 | 0 | 0 | 117.6 | E42 | H38-E42 IonicContact CE1-OE2 3.44Å; H38-E42 PolarHBondContact CE1-OE2 2.84Å; H38-E42 IonicContact CG-OE2 3.95Å; H38-E42 IonicContact ND1-OE2 2.82Å; H38-E42 PolarHBondContact ND1-OE2 3.19Å |
| 39 | R | 59 | Low | 70.7 | Confident | 235 Ų | 235 | 119.1 Ų | 119.1 | 89% | 0.887 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -150 | -40 | 166 | -148.8 | 173.8 | -146.4 | -178 | 6.1 | 114.7 | A37 | A37-R39 PolarHBondContact O-N 3.44Š|
| 40 | G | 66.5 | Low | 71.9 | Confident | 48 Ų | 48 | 115.3 Ų | 115.3 | 50% | 0.495 | 61% | 0.608 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -92.6 | -39.6 | 177 | 0 | 0 | 0 | 0 | 0 | 113 | A43 L44 | G40-A43 PolarHBondContact O-N 3.43Å; G40-L44 WeakPolarHBondContact O-CG 3.37Å; G40-L44 PolarHBondContact O-N 3.41Å |
| 41 | G | 75.6 | Confident | 73 | Confident | 23 Ų | 23 | 115.3 Ų | 115.3 | 24% | 0.237 | 60% | 0.602 | C | S | . | * | H | α-helix | trans | -67.8 | -41.1 | -176.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | A37 A43 L44 L45 | A37-G41 PolarHBondContact O-N 2.82Å; G41-A43 PolarHBondContact O-N 2.93Å; G41-L44 PolarHBondContact O-N 3.36Å; G41-L45 WeakPolarHBondContact O-CB 3.46Å; G41-L45 VanDerWaalsContact O-CG 3.3Å; G41-L45 WeakPolarHBondContact O-CG 3.27Å; G41-L45 PolarHBondContact O-N 2.88Å |
| 42 | E | 77 | Confident | 74.3 | Confident | 80 Ų | 80 | 110 Ų | 110 | 37% | 0.374 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -69.7 | -32 | -178.9 | -55 | -156.4 | 116 | 0 | 0 | 112.7 | H38 R46 | H38-E42 IonicContact CE1-OE2 3.44Å; H38-E42 PolarHBondContact CE1-OE2 2.84Å; H38-E42 IonicContact CG-OE2 3.95Å; H38-E42 IonicContact ND1-OE2 2.82Å; H38-E42 PolarHBondContact ND1-OE2 3.19Å; E42-R46 VanDerWaalsContact O-CG 3.3Å; E42-R46 WeakPolarHBondContact O-CG 3.3Å; E42-R46 PolarHBondContact O-N 2.86Å; E42-R46 VanDerWaalsContact O-N 3.12Å |
| 43 | A | 82.6 | Confident | 75.4 | Confident | 61 Ų | 61 | 107.1 Ų | 107.1 | 50% | 0.504 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -67.7 | -43.8 | 174 | 0 | 0 | 0 | 0 | 0 | 111.7 | G40 G41 R46 E47 | G40-A43 PolarHBondContact O-N 3.43Å; G41-A43 PolarHBondContact O-N 2.93Å; A43-R46 PolarHBondContact O-N 3.4Å; A43-E47 WeakPolarHBondContact O-CB 3.45Å; A43-E47 PolarHBondContact O-N 3.29Å |
| 44 | L | 83.8 | Confident | 76.7 | Confident | 113 Ų | 113 | 107.9 Ų | 107.9 | 59% | 0.592 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -66.7 | -37.1 | 177 | -70.6 | 170 | 0 | 0 | 0 | 112.4 | G40 G41 E47 L48 | G40-L44 WeakPolarHBondContact O-CG 3.37Å; G40-L44 PolarHBondContact O-N 3.41Å; G41-L44 PolarHBondContact O-N 3.36Å; L44-E47 PolarHBondContact O-N 2.97Å; L44-L48 VanDerWaalsContact O-CB 3.27Å; L44-L48 WeakPolarHBondContact O-CB 3.47Å; L44-L48 PolarHBondContact O-N 2.82Å |
| 45 | L | 84.3 | Confident | 78.1 | Confident | 86 Ų | 86 | 107.7 Ų | 107.7 | 45% | 0.45 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64 | -42.6 | 175 | -76.1 | 168.6 | 0 | 0 | 0 | 111.5 | P33 G41 L48 E49 | P33-L45 HydrophobicContact CB-CD1 4.1Å; P33-L45 HydrophobicContact CG-CD1 4.41Å; G41-L45 WeakPolarHBondContact O-CB 3.46Å; G41-L45 VanDerWaalsContact O-CG 3.3Å; G41-L45 WeakPolarHBondContact O-CG 3.27Å; G41-L45 PolarHBondContact O-N 2.88Å; L45-L48 PolarHBondContact O-N 2.88Å; L45-E49 WeakPolarHBondContact O-CB 3.49Å; L45-E49 PolarHBondContact O-N 3.44Å |
| 46 | R | 84.2 | Confident | 79.5 | Confident | 187 Ų | 187 | 100.7 Ų | 100.7 | 71% | 0.706 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -66.4 | -38.3 | 175.3 | -68.2 | -173.6 | 99.9 | -128.6 | -0.3 | 112.3 | E42 A43 E49 V50 | E42-R46 VanDerWaalsContact O-CG 3.3Å; E42-R46 WeakPolarHBondContact O-CG 3.3Å; E42-R46 PolarHBondContact O-N 2.86Å; E42-R46 VanDerWaalsContact O-N 3.12Å; A43-R46 PolarHBondContact O-N 3.4Å; R46-E49 PolarHBondContact O-N 3.49Å; R46-V50 WeakPolarHBondContact O-CB 3.3Å; R46-V50 VanDerWaalsContact O-CG2 3.25Å; R46-V50 WeakPolarHBondContact O-CG2 3.28Å; R46-V50 PolarHBondContact O-N 2.76Å |
| 47 | E | 91.8 | Very high | 80.8 | Confident | 122 Ų | 122 | 103.6 Ų | 103.6 | 57% | 0.57 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -66.9 | -42.5 | 177 | -158.5 | 178.9 | -152.7 | 0 | 0 | 111.4 | A43 L44 V50 L51 | A43-E47 WeakPolarHBondContact O-CB 3.45Å; A43-E47 PolarHBondContact O-N 3.29Å; L44-E47 PolarHBondContact O-N 2.97Å; E47-V50 PolarHBondContact O-N 3.35Å; E47-L51 WeakPolarHBondContact O-CG 3.33Å; E47-L51 PolarHBondContact O-N 2.84Å |
| 48 | L | 91.9 | Very high | 82.1 | Confident | 103 Ų | 103 | 104.8 Ų | 104.8 | 54% | 0.539 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.6 | -43.4 | 173 | -178.3 | 65.7 | 0 | 0 | 0 | 111.5 | L44 L45 L51 V52 | L44-L48 VanDerWaalsContact O-CB 3.27Å; L44-L48 WeakPolarHBondContact O-CB 3.47Å; L44-L48 PolarHBondContact O-N 2.82Å; L45-L48 PolarHBondContact O-N 2.88Å; L48-L51 PolarHBondContact O-N 3.38Å; L48-V52 HydrophobicContact CD1-CG2 4.41Å; L48-V52 HydrophobicContact CG-CG2 4.45Å; L48-V52 WeakPolarHBondContact O-CB 3.32Å; L48-V52 VanDerWaalsContact O-CG2 3.29Å; L48-V52 WeakPolarHBondContact O-CG2 3.25Å; L48-V52 PolarHBondContact O-N 3.34Å |
| 49 | E | 91.5 | Very high | 82.6 | Confident | 93 Ų | 93 | 100.4 Ų | 100.4 | 44% | 0.435 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.9 | -40.5 | 178.7 | -175.1 | 162.8 | -164.3 | 0 | 0 | 112.1 | L45 R46 L51 V52 Q53 | L45-E49 WeakPolarHBondContact O-CB 3.49Å; L45-E49 PolarHBondContact O-N 3.44Å; R46-E49 PolarHBondContact O-N 3.49Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 3.14Å; E49-V52 PolarHBondContact O-N 2.89Å; E49-Q53 HydrophobicContact CG-CG 4.48Å; E49-Q53 WeakPolarHBondContact O-CB 3.23Å; E49-Q53 VanDerWaalsContact O-CG 3.27Å; E49-Q53 WeakPolarHBondContact O-CG 3.47Å; E49-Q53 PolarHBondContact O-N 3.44Å |
| 50 | V | 92.1 | Very high | 82.9 | Confident | 96 Ų | 96 | 91.9 Ų | 91.9 | 58% | 0.582 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.9 | -44.1 | 172.7 | 168.7 | 0 | 0 | 0 | 0 | 110.9 | R46 E47 Q53 D54 | R46-V50 WeakPolarHBondContact O-CB 3.3Å; R46-V50 VanDerWaalsContact O-CG2 3.25Å; R46-V50 WeakPolarHBondContact O-CG2 3.28Å; R46-V50 PolarHBondContact O-N 2.76Å; E47-V50 PolarHBondContact O-N 3.35Å; V50-Q53 PolarHBondContact O-N 2.67Å; V50-D54 VanDerWaalsContact O-CB 3.32Å; V50-D54 WeakPolarHBondContact O-CB 3.24Å; V50-D54 PolarHBondContact O-N 3.1Å |
| 51 | L | 88.4 | Confident | 83 | Confident | 101 Ų | 101 | 97.3 Ų | 97.3 | 53% | 0.529 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.2 | -42.9 | 176.9 | -75.6 | 166.8 | 0 | 0 | 0 | 112.3 | E47 L48 E49 D54 V55 | E47-L51 WeakPolarHBondContact O-CG 3.33Å; E47-L51 PolarHBondContact O-N 2.84Å; L48-L51 PolarHBondContact O-N 3.38Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 3.14Å; L51-D54 PolarHBondContact O-N 3.3Å; L51-V55 WeakPolarHBondContact O-CB 3.47Å; L51-V55 VanDerWaalsContact O-CG2 3.28Å; L51-V55 WeakPolarHBondContact O-CG2 3.42Å; L51-V55 PolarHBondContact O-N 3.17Å |
| 52 | V | 91.6 | Very high | 82.5 | Confident | 79 Ų | 79 | 104.9 Ų | 104.9 | 48% | 0.479 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.2 | -45.1 | 175.9 | 168.5 | 0 | 0 | 0 | 0 | 110.2 | L48 E49 D54 V55 V56 | L48-V52 HydrophobicContact CD1-CG2 4.41Å; L48-V52 HydrophobicContact CG-CG2 4.45Å; L48-V52 WeakPolarHBondContact O-CB 3.32Å; L48-V52 VanDerWaalsContact O-CG2 3.29Å; L48-V52 WeakPolarHBondContact O-CG2 3.25Å; L48-V52 PolarHBondContact O-N 3.34Å; E49-V52 PolarHBondContact O-N 2.89Å; V52-D54 VanDerWaalsContact C-N 3.31Å; V52-D54 PolarHBondContact O-N 2.7Å; V52-V55 PolarHBondContact O-N 2.83Å; V52-V56 HydrophobicContact CG1-CG2 4.27Å; V52-V56 WeakPolarHBondContact O-CB 3.29Å; V52-V56 VanDerWaalsContact O-CG2 3.23Å; V52-V56 WeakPolarHBondContact O-CG2 3.46Å; V52-V56 PolarHBondContact O-N 2.82Å |
| 53 | Q | 84.4 | Confident | 82.1 | Confident | 106 Ų | 106 | 107.6 Ų | 107.6 | 50% | 0.495 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.3 | -37.1 | 176.3 | -75.1 | -177.6 | 10.1 | 0 | 0 | 112.1 | E49 V50 R57 | E49-Q53 HydrophobicContact CG-CG 4.48Å; E49-Q53 WeakPolarHBondContact O-CB 3.23Å; E49-Q53 VanDerWaalsContact O-CG 3.27Å; E49-Q53 WeakPolarHBondContact O-CG 3.47Å; E49-Q53 PolarHBondContact O-N 3.44Å; V50-Q53 PolarHBondContact O-N 2.67Å; Q53-R57 VanDerWaalsContact O-CB 3.24Å; Q53-R57 WeakPolarHBondContact O-CB 3.27Å; Q53-R57 PolarHBondContact O-N 3.1Å |
| 54 | D | 87.9 | Confident | 81.5 | Confident | 85 Ų | 85 | 113.9 Ų | 113.9 | 46% | 0.455 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -66.8 | -44.2 | 175.9 | -168 | 66.3 | 0 | 0 | 0 | 111.7 | V50 L51 V52 R57 T58 | V50-D54 VanDerWaalsContact O-CB 3.32Å; V50-D54 WeakPolarHBondContact O-CB 3.24Å; V50-D54 PolarHBondContact O-N 3.1Å; L51-D54 PolarHBondContact O-N 3.3Å; V52-D54 VanDerWaalsContact C-N 3.31Å; V52-D54 PolarHBondContact O-N 2.7Å; D54-R57 PolarHBondContact O-N 2.72Å; D54-T58 PolarHBondContact O-N 3.12Å; D54-T58 PolarHBondContact O-OG1 3.23Å |
| 55 | V | 86.7 | Confident | 81.1 | Confident | 82 Ų | 82 | 113 Ų | 113 | 50% | 0.497 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.6 | -43.4 | 174.6 | 171.3 | 0 | 0 | 0 | 0 | 111.5 | L51 V52 R57 T58 S59 | L51-V55 WeakPolarHBondContact O-CB 3.47Å; L51-V55 VanDerWaalsContact O-CG2 3.28Å; L51-V55 WeakPolarHBondContact O-CG2 3.42Å; L51-V55 PolarHBondContact O-N 3.17Å; V52-V55 PolarHBondContact O-N 2.83Å; V55-R57 VanDerWaalsContact C-N 3.35Å; V55-T58 VanDerWaalsContact CA-OG1 3.23Å; V55-T58 WeakPolarHBondContact CA-OG1 3.23Å; V55-T58 PolarHBondContact O-N 3.42Å; V55-T58 PolarHBondContact O-OG1 2.72Å; V55-T58 VanDerWaalsContact O-OG1 3.1Å; V55-S59 VanDerWaalsContact O-CB 3.23Å; V55-S59 WeakPolarHBondContact O-CB 3.37Å; V55-S59 PolarHBondContact O-N 2.86Å; V55-S59 PolarHBondContact O-OG 3.42Å |
| 56 | V | 86.7 | Confident | 80.9 | Confident | 90 Ų | 90 | 109.9 Ų | 109.9 | 55% | 0.545 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.1 | -41.9 | 176.9 | 167.6 | 0 | 0 | 0 | 0 | 110.4 | V52 S59 S60 | V52-V56 HydrophobicContact CG1-CG2 4.27Å; V52-V56 WeakPolarHBondContact O-CB 3.29Å; V52-V56 VanDerWaalsContact O-CG2 3.23Å; V52-V56 WeakPolarHBondContact O-CG2 3.46Å; V52-V56 PolarHBondContact O-N 2.82Å; V56-S59 PolarHBondContact O-N 3.33Å; V56-S60 VanDerWaalsContact O-CB 3.27Å; V56-S60 WeakPolarHBondContact O-CB 3.29Å; V56-S60 PolarHBondContact O-N 2.83Å; V56-S60 PolarHBondContact O-OG 3.38Å |
| 57 | R | 79.1 | Confident | 80.8 | Confident | 177 Ų | 177 | 105 Ų | 105 | 67% | 0.668 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -65.5 | -42.6 | 175.8 | -175.1 | -175.5 | -79.5 | 143.3 | -5.5 | 111.9 | Q53 D54 V55 S59 S60 W61 | Q53-R57 VanDerWaalsContact O-CB 3.24Å; Q53-R57 WeakPolarHBondContact O-CB 3.27Å; Q53-R57 PolarHBondContact O-N 3.1Å; D54-R57 PolarHBondContact O-N 2.72Å; V55-R57 VanDerWaalsContact C-N 3.35Å; R57-S59 VanDerWaalsContact C-N 3.35Å; R57-S60 WeakPolarHBondContact CA-OG 3.32Å; R57-S60 PolarHBondContact O-OG 3.04Å; R57-S60 VanDerWaalsContact O-OG 3.14Å; R57-W61 WeakPolarHBondContact O-CB 3.23Å; R57-W61 PolarHBondContact O-N 3.24Å; R57-W61 VanDerWaalsContact O-N 3.17Å |
| 58 | T | 80.8 | Confident | 80.4 | Confident | 81 Ų | 81 | 103.3 Ų | 103.3 | 50% | 0.497 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -67.9 | -34.9 | 176.5 | 31.2 | 0 | 0 | 0 | 0 | 112.3 | D54 V55 | D54-T58 PolarHBondContact O-N 3.12Å; D54-T58 PolarHBondContact O-OG1 3.23Å; V55-T58 VanDerWaalsContact CA-OG1 3.23Å; V55-T58 WeakPolarHBondContact CA-OG1 3.23Å; V55-T58 PolarHBondContact O-N 3.42Å; V55-T58 PolarHBondContact O-OG1 2.72Å; V55-T58 VanDerWaalsContact O-OG1 3.1Å |
| 59 | S | 69.8 | Low | 80 | Confident | 60 Ų | 60 | 102.3 Ų | 102.3 | 42% | 0.42 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -72.8 | -45 | 177.5 | -56.7 | 0 | 0 | 0 | 0 | 112.1 | V55 V56 R57 W61 W62 E63 | V55-S59 VanDerWaalsContact O-CB 3.23Å; V55-S59 WeakPolarHBondContact O-CB 3.37Å; V55-S59 PolarHBondContact O-N 2.86Å; V55-S59 PolarHBondContact O-OG 3.42Å; V56-S59 PolarHBondContact O-N 3.33Å; R57-S59 VanDerWaalsContact C-N 3.35Å; S59-W61 VanDerWaalsContact C-N 3.33Å; S59-W61 PolarHBondContact O-N 2.88Å; S59-W62 PolarHBondContact O-N 3.46Å; S59-W62 VanDerWaalsContact O-N 3.12Å; S59-E63 PolarHBondContact O-N 3.36Å |
| 60 | S | 65.1 | Low | 79.7 | Confident | 56 Ų | 56 | 100.8 Ų | 100.8 | 39% | 0.392 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -67.2 | -30.8 | -180 | 53.4 | 0 | 0 | 0 | 0 | 113.3 | V56 R57 W62 R64 | V56-S60 VanDerWaalsContact O-CB 3.27Å; V56-S60 WeakPolarHBondContact O-CB 3.29Å; V56-S60 PolarHBondContact O-N 2.83Å; V56-S60 PolarHBondContact O-OG 3.38Å; R57-S60 WeakPolarHBondContact CA-OG 3.32Å; R57-S60 PolarHBondContact O-OG 3.04Å; R57-S60 VanDerWaalsContact O-OG 3.14Å; S60-W62 VanDerWaalsContact C-N 3.34Å; S60-R64 PolarHBondContact O-N 2.98Å |
| 61 | W | 68.6 | Low | 79.5 | Confident | 163 Ų | 163 | 100.5 Ų | 100.5 | 62% | 0.617 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.8 | -39.7 | 170.9 | -175 | 81.4 | 0 | 0 | 0 | 111.9 | R57 S59 H65 | R57-W61 WeakPolarHBondContact O-CB 3.23Å; R57-W61 PolarHBondContact O-N 3.24Å; R57-W61 VanDerWaalsContact O-N 3.17Å; S59-W61 VanDerWaalsContact C-N 3.33Å; S59-W61 PolarHBondContact O-N 2.88Å; W61-H65 AromaticContact CE2-CD2 3.76Å; W61-H65 AromaticContact NE1-CD2 3.62Å; W61-H65 AromaticContact NE1-NE2 3.86Å; W61-H65 PolarHBondContact O-N 2.88Å |
| 62 | W | 63.9 | Low | 79.5 | Confident | 181 Ų | 181 | 101.4 Ų | 101.4 | 69% | 0.686 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -75.1 | -31.9 | 178.8 | -131.8 | 87.7 | 0 | 0 | 0 | 112.8 | S59 S60 G66 | S59-W62 PolarHBondContact O-N 3.46Å; S59-W62 VanDerWaalsContact O-N 3.12Å; S60-W62 VanDerWaalsContact C-N 3.34Å; W62-G66 WeakPolarHBondContact O-CA 3.27Å; W62-G66 PolarHBondContact O-N 2.88Å |
| 63 | E | 68.9 | Low | 79.5 | Confident | 138 Ų | 138 | 100.5 Ų | 100.5 | 65% | 0.645 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -68.5 | -40.4 | 175.4 | -77.7 | 178 | 149.4 | 0 | 0 | 112.2 | S59 V67 | S59-E63 PolarHBondContact O-N 3.36Å; E63-V67 WeakPolarHBondContact O-CB 3.16Å; E63-V67 WeakPolarHBondContact O-CG2 3.41Å; E63-V67 PolarHBondContact O-N 3.28Å |
| 64 | R | 70.9 | Confident | 79.8 | Confident | 193 Ų | 193 | 101.5 Ų | 101.5 | 73% | 0.728 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -78.4 | -21.1 | -179.8 | -163.9 | 175.3 | -106.7 | -102.5 | 5.2 | 113.7 | S60 | S60-R64 PolarHBondContact O-N 2.98Å |
| 65 | H | 73.7 | Confident | 80 | Confident | 93 Ų | 93 | 100.1 Ų | 100.1 | 43% | 0.431 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -107.5 | -29.5 | 177.3 | -68.2 | -9.4 | 0 | 0 | 0 | 113 | W61 C69 | W61-H65 AromaticContact CE2-CD2 3.76Å; W61-H65 AromaticContact NE1-CD2 3.62Å; W61-H65 AromaticContact NE1-NE2 3.86Å; W61-H65 PolarHBondContact O-N 2.88Å; H65-C69 VanDerWaalsContact O-CB 3.29Å; H65-C69 WeakPolarHBondContact O-CB 3.24Å; H65-C69 PolarHBondContact O-N 3.48Å; H65-C69 PolarHBondContact O-SG 3.31Å |
| 66 | G | 81.2 | Confident | 80.3 | Confident | 21 Ų | 21 | 102.7 Ų | 102.7 | 22% | 0.216 | 53% | 0.534 | C | S | . | . | H | α-helix | trans | -71.6 | -43.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | W62 A70 | W62-G66 WeakPolarHBondContact O-CA 3.27Å; W62-G66 PolarHBondContact O-N 2.88Å; G66-A70 VanDerWaalsContact O-CB 3.27Å; G66-A70 WeakPolarHBondContact O-CB 3.27Å; G66-A70 PolarHBondContact O-N 3.08Å |
| 67 | V | 82.4 | Confident | 80.4 | Confident | 84 Ų | 84 | 106 Ų | 106 | 51% | 0.509 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.5 | -44.9 | 178.8 | 175 | 0 | 0 | 0 | 0 | 110.9 | E63 A70 I71 | E63-V67 WeakPolarHBondContact O-CB 3.16Å; E63-V67 WeakPolarHBondContact O-CG2 3.41Å; E63-V67 PolarHBondContact O-N 3.28Å; V67-A70 PolarHBondContact O-N 3.35Å; V67-I71 HydrophobicContact CG1-CD1 3.72Å; V67-I71 HydrophobicContact CG1-CG1 4.35Å; V67-I71 VanDerWaalsContact O-CG1 3.26Å; V67-I71 WeakPolarHBondContact O-CG1 3.36Å; V67-I71 PolarHBondContact O-N 3.49Å |
| 68 | D | 83.5 | Confident | 80.9 | Confident | 88 Ų | 88 | 100.2 Ų | 100.2 | 47% | 0.471 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.9 | -45.3 | 176.9 | -73.2 | -37.8 | 0 | 0 | 0 | 111.7 | A70 I71 L72 | D68-A70 VanDerWaalsContact C-N 3.31Å; D68-A70 PolarHBondContact O-N 3.39Å; D68-I71 PolarHBondContact O-N 3.49Å; D68-L72 WeakPolarHBondContact O-CB 3.26Å; D68-L72 VanDerWaalsContact O-CG 3.24Å; D68-L72 WeakPolarHBondContact O-CG 3.35Å; D68-L72 PolarHBondContact O-N 2.9Å |
| 69 | C | 83.8 | Confident | 81.2 | Confident | 82 Ų | 82 | 102 Ų | 102 | 55% | 0.554 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61.3 | -39.2 | 174.8 | -71.5 | 0 | 0 | 0 | 0 | 112.3 | H65 L72 A73 | H65-C69 VanDerWaalsContact O-CB 3.29Å; H65-C69 WeakPolarHBondContact O-CB 3.24Å; H65-C69 PolarHBondContact O-N 3.48Å; H65-C69 PolarHBondContact O-SG 3.31Å; C69-L72 PolarHBondContact O-N 3.42Å; C69-A73 VanDerWaalsContact O-CB 3.24Å; C69-A73 WeakPolarHBondContact O-CB 3.24Å; C69-A73 PolarHBondContact O-N 2.9Å |
| 70 | A | 85.1 | Confident | 82 | Confident | 60 Ų | 60 | 102.7 Ų | 102.7 | 50% | 0.496 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -66.1 | -42.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | G66 V67 D68 A73 L74 | G66-A70 VanDerWaalsContact O-CB 3.27Å; G66-A70 WeakPolarHBondContact O-CB 3.27Å; G66-A70 PolarHBondContact O-N 3.08Å; V67-A70 PolarHBondContact O-N 3.35Å; D68-A70 VanDerWaalsContact C-N 3.31Å; D68-A70 PolarHBondContact O-N 3.39Å; A70-A73 PolarHBondContact O-N 3.44Å; A70-L74 VanDerWaalsContact O-CB 3.27Å; A70-L74 WeakPolarHBondContact O-CB 3.27Å; A70-L74 PolarHBondContact O-N 3.06Å |
| 71 | I | 86.6 | Confident | 82.9 | Confident | 91 Ų | 91 | 102.2 Ų | 102.2 | 47% | 0.467 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.3 | -44.8 | 175.6 | -68.3 | 166.1 | 0 | 0 | 0 | 110.5 | V67 D68 L74 S75 | V67-I71 HydrophobicContact CG1-CD1 3.72Å; V67-I71 HydrophobicContact CG1-CG1 4.35Å; V67-I71 VanDerWaalsContact O-CG1 3.26Å; V67-I71 WeakPolarHBondContact O-CG1 3.36Å; V67-I71 PolarHBondContact O-N 3.49Å; D68-I71 PolarHBondContact O-N 3.49Å; I71-L74 PolarHBondContact O-N 3.35Å; I71-S75 VanDerWaalsContact O-CB 3.3Å; I71-S75 WeakPolarHBondContact O-CB 3.42Å; I71-S75 PolarHBondContact O-N 3.3Å; I71-S75 PolarHBondContact O-OG 3.45Å |
| 72 | L | 89.9 | Confident | 83.7 | Confident | 120 Ų | 120 | 96.2 Ų | 96.2 | 63% | 0.628 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64.1 | -44.1 | 178.2 | -70.4 | 175 | 0 | 0 | 0 | 111.6 | D68 C69 S75 L76 | D68-L72 WeakPolarHBondContact O-CB 3.26Å; D68-L72 VanDerWaalsContact O-CG 3.24Å; D68-L72 WeakPolarHBondContact O-CG 3.35Å; D68-L72 PolarHBondContact O-N 2.9Å; C69-L72 PolarHBondContact O-N 3.42Å; L72-S75 PolarHBondContact O-N 2.88Å; L72-L76 WeakPolarHBondContact O-CB 2.85Å; L72-L76 PolarHBondContact O-N 3.24Å |
| 73 | A | 91 | Very high | 84.8 | Confident | 59 Ų | 59 | 92.3 Ų | 92.3 | 49% | 0.488 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.5 | -43.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | C69 A70 S75 L76 F77 | C69-A73 VanDerWaalsContact O-CB 3.24Å; C69-A73 WeakPolarHBondContact O-CB 3.24Å; C69-A73 PolarHBondContact O-N 2.9Å; A70-A73 PolarHBondContact O-N 3.44Å; A73-S75 VanDerWaalsContact C-N 3.34Å; A73-S75 PolarHBondContact O-N 3.42Å; A73-L76 PolarHBondContact O-N 3.49Å; A73-F77 PolarHBondContact O-N 2.87Å; A73-F77 VanDerWaalsContact O-N 3.08Å |
| 74 | L | 90.6 | Very high | 85.5 | Confident | 128 Ų | 128 | 91.3 Ų | 91.3 | 67% | 0.67 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.1 | -41.2 | 177.3 | -162.8 | 73.2 | 0 | 0 | 0 | 111.1 | A70 I71 F77 A78 | A70-L74 VanDerWaalsContact O-CB 3.27Å; A70-L74 WeakPolarHBondContact O-CB 3.27Å; A70-L74 PolarHBondContact O-N 3.06Å; I71-L74 PolarHBondContact O-N 3.35Å; L74-F77 PolarHBondContact O-N 2.82Å; L74-A78 WeakPolarHBondContact O-CB 3.3Å; L74-A78 PolarHBondContact O-N 2.81Å |
| 75 | S | 91.8 | Very high | 86.1 | Confident | 55 Ų | 55 | 84.8 Ų | 84.8 | 39% | 0.385 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.7 | -45.3 | 176.8 | -58.9 | 0 | 0 | 0 | 0 | 111.9 | I71 L72 A73 F77 A78 L79 | I71-S75 VanDerWaalsContact O-CB 3.3Å; I71-S75 WeakPolarHBondContact O-CB 3.42Å; I71-S75 PolarHBondContact O-N 3.3Å; I71-S75 PolarHBondContact O-OG 3.45Å; L72-S75 PolarHBondContact O-N 2.88Å; A73-S75 VanDerWaalsContact C-N 3.34Å; A73-S75 PolarHBondContact O-N 3.42Å; S75-F77 PolarHBondContact O-N 2.74Å; S75-A78 PolarHBondContact O-N 3.42Å; S75-L79 WeakPolarHBondContact O-CB 3.2Å; S75-L79 VanDerWaalsContact O-CG 3.25Å; S75-L79 WeakPolarHBondContact O-CG 3.49Å; S75-L79 PolarHBondContact O-N 3.39Å |
| 76 | L | 94 | Very high | 86.5 | Confident | 136 Ų | 136 | 86 Ų | 86 | 71% | 0.712 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60.2 | -34.1 | 176.7 | -179.8 | 64.8 | 0 | 0 | 0 | 112.2 | L72 A73 P80 | L72-L76 WeakPolarHBondContact O-CB 2.85Å; L72-L76 PolarHBondContact O-N 3.24Å; A73-L76 PolarHBondContact O-N 3.49Å; L76-P80 WeakPolarHBondContact O-CD 3.25Å; L76-P80 VanDerWaalsContact O-CG 3.23Å; L76-P80 WeakPolarHBondContact O-CG 3.23Å |
| 77 | F | 88.8 | Confident | 86.7 | Confident | 159 Ų | 159 | 90.1 Ų | 90.1 | 70% | 0.697 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -85.9 | -34.6 | 178.7 | -167.2 | -97.6 | 0 | 0 | 0 | 113.1 | A73 L74 S75 P80 A81 | A73-F77 PolarHBondContact O-N 2.87Å; A73-F77 VanDerWaalsContact O-N 3.08Å; L74-F77 PolarHBondContact O-N 2.82Å; S75-F77 PolarHBondContact O-N 2.74Å; F77-P80 WeakPolarHBondContact O-CD 3.34Å; F77-P80 WeakPolarHBondContact O-CG 3.33Å; F77-A81 PolarHBondContact O-N 3.13Å |
| 78 | A | 89.4 | Confident | 86.7 | Confident | 57 Ų | 57 | 87.6 Ų | 87.6 | 47% | 0.471 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -70.4 | -34.5 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L74 S75 A81 G82 | L74-A78 WeakPolarHBondContact O-CB 3.3Å; L74-A78 PolarHBondContact O-N 2.81Å; S75-A78 PolarHBondContact O-N 3.42Å; A78-A81 PolarHBondContact O-N 3.48Å; A78-G82 PolarHBondContact O-N 2.88Å |
| 79 | L | 86.7 | Confident | 86.6 | Confident | 119 Ų | 119 | 91.2 Ų | 91.2 | 62% | 0.623 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -59.7 | -54.9 | 176.9 | -74 | 169.6 | 0 | 0 | 0 | 113.6 | S75 A81 G82 V83 | S75-L79 WeakPolarHBondContact O-CB 3.2Å; S75-L79 VanDerWaalsContact O-CG 3.25Å; S75-L79 WeakPolarHBondContact O-CG 3.49Å; S75-L79 PolarHBondContact O-N 3.39Å; L79-A81 VanDerWaalsContact C-N 3.34Å; L79-A81 PolarHBondContact O-N 2.84Å; L79-G82 PolarHBondContact O-N 3.32Å; L79-V83 WeakPolarHBondContact O-CG2 3.45Å; L79-V83 PolarHBondContact O-N 2.89Å |
| 80 | P | 85.8 | Confident | 86.5 | Confident | 73 Ų | 73 | 89.6 Ų | 89.6 | 47% | 0.474 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.2 | -36 | 177.9 | 23.5 | -32 | 0 | 0 | 0 | 112.1 | L76 F77 H84 | L76-P80 WeakPolarHBondContact O-CD 3.25Å; L76-P80 VanDerWaalsContact O-CG 3.23Å; L76-P80 WeakPolarHBondContact O-CG 3.23Å; F77-P80 WeakPolarHBondContact O-CD 3.34Å; F77-P80 WeakPolarHBondContact O-CG 3.33Å; P80-H84 WeakPolarHBondContact O-CB 3.32Å; P80-H84 PolarHBondContact O-N 3.35Å |
| 81 | A | 83.9 | Confident | 86.2 | Confident | 46 Ų | 46 | 93.3 Ų | 93.3 | 38% | 0.38 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64 | -41 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112 | F77 A78 L79 S85 | F77-A81 PolarHBondContact O-N 3.13Å; A78-A81 PolarHBondContact O-N 3.48Å; L79-A81 VanDerWaalsContact C-N 3.34Å; L79-A81 PolarHBondContact O-N 2.84Å; A81-S85 VanDerWaalsContact O-CB 3.3Å; A81-S85 WeakPolarHBondContact O-CB 3.25Å; A81-S85 PolarHBondContact O-N 3.16Å; A81-S85 PolarHBondContact O-OG 3.34Å |
| 82 | G | 86 | Confident | 85.5 | Confident | 38 Ų | 38 | 95.3 Ų | 95.3 | 39% | 0.392 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.7 | -46.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | A78 L79 S85 L86 | A78-G82 PolarHBondContact O-N 2.88Å; L79-G82 PolarHBondContact O-N 3.32Å; G82-S85 PolarHBondContact O-N 3.45Å; G82-L86 WeakPolarHBondContact O-CB 3.14Å; G82-L86 PolarHBondContact O-N 2.88Å |
| 83 | V | 86.5 | Confident | 84.7 | Confident | 98 Ų | 98 | 92 Ų | 92 | 59% | 0.594 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.4 | -44.4 | 175.8 | 171.8 | 0 | 0 | 0 | 0 | 110.7 | L79 S85 L86 H87 | L79-V83 WeakPolarHBondContact O-CG2 3.45Å; L79-V83 PolarHBondContact O-N 2.89Å; V83-S85 VanDerWaalsContact C-N 3.34Å; V83-S85 PolarHBondContact O-N 3.29Å; V83-L86 PolarHBondContact O-N 3.24Å; V83-H87 VanDerWaalsContact O-CB 3.25Å; V83-H87 WeakPolarHBondContact O-CB 3.46Å; V83-H87 PolarHBondContact O-N 3.01Å |
| 84 | H | 84.8 | Confident | 83.3 | Confident | 118 Ų | 118 | 97.1 Ų | 97.1 | 55% | 0.546 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.7 | -41.3 | 176.5 | -166.7 | 84.7 | 0 | 0 | 0 | 111.7 | P80 H87 C88 | P80-H84 WeakPolarHBondContact O-CB 3.32Å; P80-H84 PolarHBondContact O-N 3.35Å; H84-H87 PolarHBondContact O-N 2.69Å; H84-C88 WeakPolarHBondContact O-CB 3.3Å; H84-C88 PolarHBondContact O-N 2.92Å; H84-C88 PolarHBondContact O-SG 3.38Å; H84-C88 VanDerWaalsContact O-SG 3.34Å |
| 85 | S | 82.8 | Confident | 82.1 | Confident | 56 Ų | 56 | 94.1 Ų | 94.1 | 39% | 0.392 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.3 | -38 | 176.9 | -59.3 | 0 | 0 | 0 | 0 | 112.8 | A81 G82 V83 R89 | A81-S85 VanDerWaalsContact O-CB 3.3Å; A81-S85 WeakPolarHBondContact O-CB 3.25Å; A81-S85 PolarHBondContact O-N 3.16Å; A81-S85 PolarHBondContact O-OG 3.34Å; G82-S85 PolarHBondContact O-N 3.45Å; V83-S85 VanDerWaalsContact C-N 3.34Å; V83-S85 PolarHBondContact O-N 3.29Å; S85-R89 WeakPolarHBondContact O-CB 3.46Å; S85-R89 WeakPolarHBondContact O-CG 3.34Å; S85-R89 PolarHBondContact O-N 2.82Å; S85-R89 PolarHBondContact O-NE 2.98Å |
| 86 | L | 82.9 | Confident | 80.6 | Confident | 118 Ų | 118 | 101.4 Ų | 101.4 | 62% | 0.618 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -70.5 | -41 | 175.4 | -157.5 | 76.3 | 0 | 0 | 0 | 110.9 | G82 V83 R89 A90 | G82-L86 WeakPolarHBondContact O-CB 3.14Å; G82-L86 PolarHBondContact O-N 2.88Å; V83-L86 PolarHBondContact O-N 3.24Å; L86-R89 PolarHBondContact O-N 2.83Å; L86-A90 WeakPolarHBondContact O-CB 3.44Å; L86-A90 PolarHBondContact O-N 2.93Å |
| 87 | H | 85 | Confident | 78.9 | Confident | 107 Ų | 107 | 102.6 Ų | 102.6 | 50% | 0.495 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.9 | -41.8 | 176.6 | -165 | 83 | 0 | 0 | 0 | 111.8 | V83 H84 A90 R91 | V83-H87 VanDerWaalsContact O-CB 3.25Å; V83-H87 WeakPolarHBondContact O-CB 3.46Å; V83-H87 PolarHBondContact O-N 3.01Å; H84-H87 PolarHBondContact O-N 2.69Å; H87-A90 PolarHBondContact O-N 2.84Å; H87-R91 PolarHBondContact CD2-NE 2.92Å; H87-R91 WeakPolarHBondContact O-CB 3.36Å; H87-R91 VanDerWaalsContact O-CG 3.28Å; H87-R91 WeakPolarHBondContact O-CG 3.37Å; H87-R91 PolarHBondContact O-N 3.46Å |
| 88 | C | 81.8 | Confident | 77.3 | Confident | 31 Ų | 31 | 100.2 Ų | 100.2 | 21% | 0.209 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -60.1 | -46.9 | 171.1 | -76.4 | 0 | 0 | 0 | 0 | 111.8 | H84 A90 R91 H92 | H84-C88 WeakPolarHBondContact O-CB 3.3Å; H84-C88 PolarHBondContact O-N 2.92Å; H84-C88 PolarHBondContact O-SG 3.38Å; H84-C88 VanDerWaalsContact O-SG 3.34Å; C88-A90 PolarHBondContact O-N 3.5Å; C88-R91 PolarHBondContact O-N 3.34Å; C88-R91 PolarHBondContact SG-NH2 3.48Å; C88-H92 PolarHBondContact O-CD2 3.41Å; C88-H92 PolarHBondContact O-N 2.83Å |
| 89 | R | 82.3 | Confident | 75.6 | Confident | 165 Ų | 165 | 100.1 Ų | 100.1 | 62% | 0.623 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -63.6 | -39.7 | 177.1 | -80.8 | -175.7 | -74 | -152.6 | 0.8 | 112.9 | S85 L86 H92 A93 | S85-R89 WeakPolarHBondContact O-CB 3.46Å; S85-R89 WeakPolarHBondContact O-CG 3.34Å; S85-R89 PolarHBondContact O-N 2.82Å; S85-R89 PolarHBondContact O-NE 2.98Å; L86-R89 PolarHBondContact O-N 2.83Å; R89-H92 PolarHBondContact O-N 3.05Å; R89-A93 VanDerWaalsContact O-CB 3.31Å; R89-A93 WeakPolarHBondContact O-CB 3.28Å; R89-A93 PolarHBondContact O-N 3.29Å |
| 90 | A | 82 | Confident | 74 | Confident | 48 Ų | 48 | 99.5 Ų | 99.5 | 40% | 0.397 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.9 | -42.7 | 176 | 0 | 0 | 0 | 0 | 0 | 111.6 | L86 H87 C88 H92 A93 W94 | L86-A90 WeakPolarHBondContact O-CB 3.44Å; L86-A90 PolarHBondContact O-N 2.93Å; H87-A90 PolarHBondContact O-N 2.84Å; C88-A90 PolarHBondContact O-N 3.5Å; A90-H92 PolarHBondContact O-N 3.14Å; A90-A93 PolarHBondContact O-N 3.38Å; A90-W94 PolarHBondContact O-N 2.94Å |
| 91 | R | 77.6 | Confident | 72.7 | Confident | 137 Ų | 137 | 102.1 Ų | 102.1 | 52% | 0.517 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.1 | -43.2 | 173.7 | -73.2 | -172.5 | -61.7 | 174.3 | 0.1 | 112.1 | H87 C88 A95 | H87-R91 PolarHBondContact CD2-NE 2.92Å; H87-R91 WeakPolarHBondContact O-CB 3.36Å; H87-R91 VanDerWaalsContact O-CG 3.28Å; H87-R91 WeakPolarHBondContact O-CG 3.37Å; H87-R91 PolarHBondContact O-N 3.46Å; C88-R91 PolarHBondContact O-N 3.34Å; C88-R91 PolarHBondContact SG-NH2 3.48Å; R91-A95 WeakPolarHBondContact O-CB 3.31Å; R91-A95 PolarHBondContact O-N 3.24Å |
| 92 | H | 71.3 | Confident | 71.2 | Confident | 133 Ų | 133 | 107.1 Ų | 107.1 | 62% | 0.616 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -68.7 | -32.8 | 175 | -79.9 | -69.2 | 0 | 0 | 0 | 113.4 | C88 R89 A90 R96 | C88-H92 PolarHBondContact O-CD2 3.41Å; C88-H92 PolarHBondContact O-N 2.83Å; R89-H92 PolarHBondContact O-N 3.05Å; A90-H92 PolarHBondContact O-N 3.14Å; H92-R96 PolarHBondContact O-N 3.38Å; H92-R96 VanDerWaalsContact O-N 3.08Å |
| 93 | A | 74.8 | Confident | 69.3 | Low | 50 Ų | 50 | 112.3 Ų | 112.3 | 41% | 0.413 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -69.6 | -43.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | R89 A90 R96 Q97 | R89-A93 VanDerWaalsContact O-CB 3.31Å; R89-A93 WeakPolarHBondContact O-CB 3.28Å; R89-A93 PolarHBondContact O-N 3.29Å; A90-A93 PolarHBondContact O-N 3.38Å; A93-R96 PolarHBondContact O-N 2.86Å; A93-Q97 PolarHBondContact O-N 3.12Å; A93-Q97 VanDerWaalsContact O-N 3.11Å |
| 94 | W | 60.8 | Low | 67.4 | Low | 168 Ų | 168 | 115.5 Ų | 115.5 | 64% | 0.636 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -59.3 | -46.9 | 170.7 | -99.4 | 91.7 | 0 | 0 | 0 | 111.7 | A90 R96 Q97 D98 | A90-W94 PolarHBondContact O-N 2.94Å; W94-R96 PolarHBondContact O-N 3.18Å; W94-Q97 PolarHBondContact O-N 3.48Å; W94-D98 PolarHBondContact O-N 2.99Å |
| 95 | A | 64.6 | Low | 65.8 | Low | 65 Ų | 65 | 120 Ų | 120 | 54% | 0.537 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -61.9 | -26.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114 | R91 | R91-A95 WeakPolarHBondContact O-CB 3.31Å; R91-A95 PolarHBondContact O-N 3.24Å |
| 96 | R | 60.4 | Low | 64 | Low | 207 Ų | 207 | 120.2 Ų | 120.2 | 78% | 0.781 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -82 | -21.9 | 172.6 | -79.4 | -143.6 | -65.6 | -109.2 | 2.1 | 113.6 | H92 A93 W94 | H92-R96 PolarHBondContact O-N 3.38Å; H92-R96 VanDerWaalsContact O-N 3.08Å; A93-R96 PolarHBondContact O-N 2.86Å; W94-R96 PolarHBondContact O-N 3.18Å |
| 97 | Q | 58.8 | Low | 62.4 | Low | 162 Ų | 162 | 118 Ų | 118 | 76% | 0.757 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -88.3 | -29.2 | -178.2 | -149.4 | 147.2 | 78.9 | 0 | 0 | 111.5 | A93 W94 A99 | A93-Q97 PolarHBondContact O-N 3.12Å; A93-Q97 VanDerWaalsContact O-N 3.11Å; W94-Q97 PolarHBondContact O-N 3.48Å; Q97-A99 VanDerWaalsContact C-N 3.3Å |
| 98 | D | 54.9 | Low | 60.8 | Low | 109 Ų | 109 | 119.4 Ų | 119.4 | 58% | 0.583 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -82.8 | 0.1 | 170 | -72.5 | -45.4 | 0 | 0 | 0 | 114 | W94 P100 | W94-D98 PolarHBondContact O-N 2.99Å; D98-P100 WeakPolarHBondContact O-CD 3.45Å |
| 99 | A | 53.4 | Low | 59.5 | Low | 54 Ų | 54 | 122 Ų | 122 | 45% | 0.446 | 67% | 0.669 | S | S | . | * | S | Bend | trans | -62.8 | 110.5 | 166.6 | 0 | 0 | 0 | 0 | 0 | 106.4 | Q97 C101 | Q97-A99 VanDerWaalsContact C-N 3.3Å; A99-C101 PolarHBondContact O-N 2.94Å |
| 100 | P | 54.8 | Low | 57.8 | Low | 107 Ų | 107 | 117.9 Ų | 117.9 | 70% | 0.695 | 68% | 0.677 | S | S | * | * | trans | -56.3 | 125 | -176.3 | 22.6 | -31.7 | 0 | 0 | 0 | 106.5 | D98 L102 | D98-P100 WeakPolarHBondContact O-CD 3.45Å; P100-L102 PolarHBondContact O-N 3.18Å | ||
| 101 | C | 57.2 | Low | 56.5 | Low | 127 Ų | 127 | 123.4 Ų | 123.4 | 86% | 0.858 | 70% | 0.699 | S | S | * | * | trans | -57.6 | 85 | 166.2 | -67.1 | 0 | 0 | 0 | 0 | 106.6 | A99 H103 | A99-C101 PolarHBondContact O-N 2.94Å; C101-H103 PolarHBondContact O-N 3.11Å | ||
| 102 | L | 52 | Low | 55.1 | Low | 152 Ų | 152 | 125.1 Ų | 125.1 | 80% | 0.796 | 71% | 0.713 | S | S | * | * | trans | -65.5 | 84.5 | 162.3 | -97 | 165.6 | 0 | 0 | 0 | 104.3 | P100 Q104 | P100-L102 PolarHBondContact O-N 3.18Å; L102-Q104 PolarHBondContact O-N 3.08Å | ||
| 103 | H | 47.3 | Very low | 53.7 | Low | 147 Ų | 147 | 126.6 Ų | 126.6 | 68% | 0.681 | 72% | 0.72 | S | S | * | * | trans | -50.5 | 88.2 | 158.6 | -170.7 | 75.7 | 0 | 0 | 0 | 105.9 | C101 R105 | C101-H103 PolarHBondContact O-N 3.11Å; H103-R105 VanDerWaalsContact CD2-CB 3.42Å; H103-R105 WeakPolarHBondContact CD2-CB 3.45Å; H103-R105 PolarHBondContact O-N 3.23Å | ||
| 104 | Q | 46.7 | Very low | 52.5 | Low | 165 Ų | 165 | 131 Ų | 131 | 77% | 0.771 | 74% | 0.742 | S | S | * | * | trans | -76.2 | 72.5 | 173.7 | -121.3 | -75 | 26.2 | 0 | 0 | 106.8 | L102 | L102-Q104 PolarHBondContact O-N 3.08Š| ||
| 105 | R | 51.7 | Low | 51.9 | Low | 211 Ų | 211 | 130.6 Ų | 130.6 | 80% | 0.796 | 75% | 0.747 | S | S | * | * | trans | -88.8 | 99.6 | 163.8 | -173.7 | -175.7 | -149.1 | -170.9 | 6.6 | 106.5 | H103 | H103-R105 VanDerWaalsContact CD2-CB 3.42Å; H103-R105 WeakPolarHBondContact CD2-CB 3.45Å; H103-R105 PolarHBondContact O-N 3.23Å | ||
| 106 | G | 44.7 | Very low | 51.2 | Low | 61 Ų | 61 | 131.4 Ų | 131.4 | 63% | 0.629 | 75% | 0.753 | S | S | * | * | trans | 96.8 | 117.8 | 145.5 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 107 | G | 47.9 | Very low | 50.7 | Low | 72 Ų | 72 | 126 Ų | 126 | 74% | 0.742 | 75% | 0.753 | S | S | * | * | 89.4 | 148.5 | 119.9 | 0 | 0 | 0 | 0 | 0 | 117.7 | |||||
| 108 | P | 52.1 | Low | 50.5 | Low | 137 Ų | 137 | 124.4 Ų | 124.4 | 89% | 0.89 | 75% | 0.749 | S | S | * | * | trans | -92.3 | 141.1 | -160.3 | 36.1 | -31.2 | 0 | 0 | 0 | 113 | ||||
| 109 | G | 55 | Low | 50.2 | Low | 85 Ų | 85 | 124.8 Ų | 124.8 | 88% | 0.876 | 76% | 0.757 | S | S | * | * | trans | 106.5 | 129.2 | 159.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 110 | G | 45.8 | Very low | 50.4 | Low | 78 Ų | 78 | 129 Ų | 129 | 80% | 0.804 | 77% | 0.768 | S | S | * | * | trans | 132.8 | 92.1 | 165.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q112 | G110-Q112 PolarHBondContact O-N 3.41Š| ||
| 111 | L | 55.3 | Low | 50.3 | Low | 164 Ų | 164 | 129.8 Ų | 129.8 | 86% | 0.859 | 77% | 0.773 | S | S | * | * | trans | -46.4 | 128.7 | 156.9 | -71.3 | 153.5 | 0 | 0 | 0 | 109.3 | ||||
| 112 | Q | 47.7 | Very low | 50.2 | Low | 173 Ų | 173 | 131.2 Ų | 131.2 | 81% | 0.808 | 77% | 0.771 | S | S | * | * | -172.3 | 130.9 | 129.8 | -70 | -40.2 | 22.1 | 0 | 0 | 111.1 | G110 | G110-Q112 PolarHBondContact O-N 3.41Š| |||
| 113 | H | 42.7 | Very low | 49.7 | Very low | 164 Ų | 164 | 133.5 Ų | 133.5 | 76% | 0.759 | 80% | 0.798 | S | S | * | * | trans | 58.3 | 88.5 | 150.6 | -109.7 | -115.1 | 0 | 0 | 0 | 118.6 | E115 | H113-E115 VanDerWaalsContact C-N 3.28Å; H113-E115 PolarHBondContact O-N 3.44Å; H113-E115 VanDerWaalsContact O-N 3.12Å | ||
| 114 | V | 49 | Very low | 49.8 | Very low | 143 Ų | 143 | 132.9 Ų | 132.9 | 87% | 0.867 | 80% | 0.803 | S | S | * | * | trans | -76.7 | 86.5 | 153.8 | 175.8 | 0 | 0 | 0 | 0 | 107.3 | A116 | V114-A116 PolarHBondContact O-N 2.64Š| ||
| 115 | E | 47.7 | Very low | 50 | Low | 160 Ų | 160 | 131.2 Ų | 131.2 | 75% | 0.748 | 81% | 0.805 | S | S | * | * | trans | -75.3 | 97.4 | 160.3 | -173 | 133.2 | 85.5 | 0 | 0 | 107 | H113 A117 | H113-E115 VanDerWaalsContact C-N 3.28Å; H113-E115 PolarHBondContact O-N 3.44Å; H113-E115 VanDerWaalsContact O-N 3.12Å; E115-A117 VanDerWaalsContact C-N 3.26Å; E115-A117 PolarHBondContact O-N 3.03Å | ||
| 116 | A | 49.8 | Very low | 49.9 | Very low | 81 Ų | 81 | 126.7 Ų | 126.7 | 67% | 0.669 | 81% | 0.806 | S | S | * | * | trans | -64.7 | 90.5 | 171.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | V114 L118 | V114-A116 PolarHBondContact O-N 2.64Å; A116-L118 PolarHBondContact O-N 2.72Å | ||
| 117 | A | 51.1 | Low | 50.2 | Low | 93 Ų | 93 | 130.6 Ų | 130.6 | 77% | 0.769 | 82% | 0.816 | S | S | * | * | trans | -64.1 | 90.6 | 167.3 | 0 | 0 | 0 | 0 | 0 | 108.1 | E115 P119 | E115-A117 VanDerWaalsContact C-N 3.26Å; E115-A117 PolarHBondContact O-N 3.03Å; A117-P119 WeakPolarHBondContact O-CD 3.12Å | ||
| 118 | L | 52.9 | Low | 50.3 | Low | 130 Ų | 130 | 134.3 Ų | 134.3 | 68% | 0.681 | 82% | 0.821 | S | S | * | * | trans | -59.2 | 120.7 | 170.2 | -146.7 | 101.9 | 0 | 0 | 0 | 107.5 | A116 Q120 | A116-L118 PolarHBondContact O-N 2.72Å; L118-Q120 PolarHBondContact O-N 2.76Å | ||
| 119 | P | 49.3 | Very low | 50.2 | Low | 116 Ų | 116 | 134.1 Ų | 134.1 | 75% | 0.753 | 82% | 0.816 | S | S | * | * | trans | -70.5 | 106.7 | 175.6 | 27.6 | -30.6 | 0 | 0 | 0 | 107.9 | A117 P121 | A117-P119 WeakPolarHBondContact O-CD 3.12Å; P119-P121 WeakPolarHBondContact O-CD 3.42Å | ||
| 120 | Q | 57.9 | Low | 49.8 | Very low | 144 Ų | 144 | 137.6 Ų | 137.6 | 67% | 0.673 | 81% | 0.812 | S | S | * | * | trans | -67.4 | 124.6 | 169.4 | -64.7 | -68 | -30.5 | 0 | 0 | 108.2 | L118 L122 | L118-Q120 PolarHBondContact O-N 2.76Å; Q120-L122 PolarHBondContact O-N 2.81Å; Q120-L122 VanDerWaalsContact O-N 3.13Å | ||
| 121 | P | 52.9 | Low | 50.2 | Low | 123 Ų | 123 | 142.2 Ų | 142.2 | 80% | 0.799 | 81% | 0.812 | S | S | * | * | trans | -77.3 | 98 | 169.4 | 30.9 | -29.2 | 0 | 0 | 0 | 107.9 | P119 | P119-P121 WeakPolarHBondContact O-CD 3.42Š| ||
| 122 | L | 53.9 | Low | 49.7 | Very low | 156 Ų | 156 | 140.3 Ų | 140.3 | 82% | 0.817 | 81% | 0.808 | S | S | * | * | trans | -89.2 | 110.6 | 164.2 | -85.6 | 156.2 | 0 | 0 | 0 | 107.9 | Q120 | Q120-L122 PolarHBondContact O-N 2.81Å; Q120-L122 VanDerWaalsContact O-N 3.13Å | ||
| 123 | C | 41.9 | Very low | 49.9 | Very low | 201 Ų | 201 | 137.4 Ų | 137.4 | 100% | 1.358 | 81% | 0.808 | S | S | * | * | trans | 38.6 | 0 | 160.1 | -64.3 | 0 | 0 | 0 | 0 | 119.1 |
Retrieved 123 of 123 residues in 94.7 ms
(Link to these results)