| 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 | 43.7 | Very low | 40.3 | Very low | 252 Ų | 252 | 132.7 Ų | 132.7 | 100% | 1.241 | 79% | 0.792 | S | S | * | * | 0 | 143 | 0 | -108.7 | 160.1 | 161 | 0 | 0 | 107.6 | |||||
| 2 | A | 42.1 | Very low | 40.1 | Very low | 103 Ų | 103 | 130.9 Ų | 130.9 | 85% | 0.851 | 78% | 0.783 | S | S | * | * | trans | -59.9 | 146.8 | -159.8 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 3 | E | 42 | Very low | 39.8 | Very low | 157 Ų | 157 | 131.1 Ų | 131.1 | 73% | 0.734 | 79% | 0.785 | S | S | * | * | trans | -50.2 | 172.4 | 151.6 | -73 | -98.4 | 166.8 | 0 | 0 | 112.4 | ||||
| 4 | P | 49.3 | Very low | 40 | Very low | 111 Ų | 111 | 129.3 Ų | 129.3 | 72% | 0.721 | 78% | 0.778 | S | S | * | * | cis | -145 | 161.7 | 19.9 | 31.5 | -7.5 | 0 | 0 | 0 | 119.2 | ||||
| 5 | T | 41.6 | Very low | 39.6 | Very low | 98 Ų | 98 | 137.3 Ų | 137.3 | 60% | 0.601 | 79% | 0.789 | S | S | * | * | trans | -24.3 | 141.2 | 142.6 | -59.4 | 0 | 0 | 0 | 0 | 117.4 | V7 | T5-V7 HydrophobicContact CG2-CG2 4.2Š| ||
| 6 | V | 41.3 | Very low | 39.3 | Very low | 124 Ų | 124 | 138.2 Ų | 138.2 | 75% | 0.752 | 78% | 0.784 | S | S | * | * | trans | -138.3 | 106.7 | 149 | -179.1 | 0 | 0 | 0 | 0 | 110.5 | I8 | V6-I8 HydrophobicContact CG1-CD1 3.8Å; V6-I8 HydrophobicContact CG1-CG1 3.73Å | ||
| 7 | V | 38.8 | Very low | 39 | Very low | 126 Ų | 126 | 137.5 Ų | 137.5 | 76% | 0.764 | 78% | 0.778 | S | S | * | * | trans | -94.6 | 131.8 | 161 | 170.7 | 0 | 0 | 0 | 0 | 107 | T5 | T5-V7 HydrophobicContact CG2-CG2 4.2Š| ||
| 8 | I | 37.8 | Very low | 38.8 | Very low | 149 Ų | 149 | 138.7 Ų | 138.7 | 76% | 0.764 | 78% | 0.781 | S | S | * | * | trans | -136.2 | 117 | 164.6 | -58 | 176.4 | 0 | 0 | 0 | 109.2 | V6 | V6-I8 HydrophobicContact CG1-CD1 3.8Å; V6-I8 HydrophobicContact CG1-CG1 3.73Å | ||
| 9 | A | 37.4 | Very low | 38.4 | Very low | 73 Ų | 73 | 134.9 Ų | 134.9 | 60% | 0.603 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 163 | 171.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 10 | P | 36.4 | Very low | 38 | Very low | 128 Ų | 128 | 138.2 Ų | 138.2 | 83% | 0.831 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 128.6 | -176 | 30.7 | -33.4 | 0 | 0 | 0 | 112.8 | ||
| 11 | T | 32.8 | Very low | 37.8 | Very low | 139 Ų | 139 | 135.4 Ų | 135.4 | 85% | 0.853 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 129.5 | 173.6 | -56.5 | 0 | 0 | 0 | 0 | 110.4 | ||
| 12 | T | 37.4 | Very low | 37.7 | Very low | 111 Ų | 111 | 132.5 Ų | 132.5 | 68% | 0.681 | 77% | 0.768 | S | S | * | * | trans | -108.1 | 160.1 | 170.7 | 46.3 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 13 | V | 36.5 | Very low | 37.9 | Very low | 133 Ų | 133 | 132.2 Ų | 132.2 | 81% | 0.806 | 76% | 0.758 | S | S | * | * | trans | 72.1 | 159.5 | 157.5 | -74.4 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 14 | P | 43.2 | Very low | 37.7 | Very low | 106 Ų | 106 | 132.5 Ų | 132.5 | 69% | 0.688 | 76% | 0.763 | S | S | * | * | cis | -137.5 | 173.9 | -32.2 | 32.5 | -14.1 | 0 | 0 | 0 | 112.8 | ||||
| 15 | R | 33.2 | Very low | 37.7 | Very low | 250 Ų | 250 | 133.4 Ų | 133.4 | 94% | 0.943 | 76% | 0.762 | S | S | * | * | trans | -153.3 | 119.4 | 148.4 | -151.4 | 173.7 | 179.6 | 142.4 | -0.1 | 112.2 | ||||
| 16 | E | 35.7 | Very low | 37.6 | Very low | 151 Ų | 151 | 136.7 Ų | 136.7 | 71% | 0.706 | 77% | 0.772 | S | S | * | * | trans | -79.9 | 154 | 171.5 | -46.5 | -177.9 | 165.6 | 0 | 0 | 107.5 | ||||
| 17 | D | 34.3 | Very low | 37.7 | Very low | 127 Ų | 127 | 136.3 Ų | 136.3 | 68% | 0.679 | 77% | 0.77 | S | S | * | * | -176.9 | 150.7 | 54.6 | -114.2 | -28.3 | 0 | 0 | 0 | 113 | |||||
| 18 | L | 34.8 | Very low | 37.9 | Very low | 159 Ų | 159 | 134.8 Ų | 134.8 | 83% | 0.832 | 77% | 0.771 | S | S | * | * | trans | 55.9 | 123.1 | 138.1 | -68.2 | 152.3 | 0 | 0 | 0 | 123.5 | ||||
| 19 | G | 31.3 | Very low | 38.3 | Very low | 67 Ų | 67 | 136.7 Ų | 136.7 | 69% | 0.691 | 77% | 0.774 | S | S | * | * | trans | 147.9 | 77.3 | 140.6 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 20 | H | 30.8 | Very low | 38.8 | Very low | 200 Ų | 200 | 142.1 Ų | 142.1 | 93% | 0.926 | 79% | 0.786 | S | S | * | * | trans | 60.2 | 115.3 | 145 | -65.8 | -54.2 | 0 | 0 | 0 | 123.7 | ||||
| 21 | G | 33.8 | Very low | 39.2 | Very low | 79 Ų | 79 | 141.1 Ų | 141.1 | 81% | 0.814 | 78% | 0.778 | S | S | * | * | trans | 177 | 98.6 | 154.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 22 | E | 40.7 | Very low | 40.2 | Very low | 192 Ų | 192 | 144.1 Ų | 144.1 | 90% | 0.897 | 78% | 0.779 | S | S | * | * | trans | -61.8 | 169.3 | -179.3 | -90.3 | -87.7 | 132.8 | 0 | 0 | 115.2 | ||||
| 23 | P | 46.4 | Very low | 40.7 | Very low | 97 Ų | 97 | 147.8 Ų | 147.8 | 63% | 0.63 | 79% | 0.785 | S | S | * | * | trans | -105.3 | 157.3 | -137.4 | 39.4 | -36.6 | 0 | 0 | 0 | 114.5 | ||||
| 24 | L | 39.2 | Very low | 41.6 | Very low | 162 Ų | 162 | 147.4 Ų | 147.4 | 85% | 0.848 | 78% | 0.784 | S | S | * | * | trans | -107.6 | 99.5 | 162.5 | -117.3 | 164.8 | 0 | 0 | 0 | 110 | M26 | L24-M26 PolarHBondContact O-N 3.32Š| ||
| 25 | L | 48.2 | Very low | 42.1 | Very low | 131 Ų | 131 | 148.5 Ų | 148.5 | 69% | 0.686 | 79% | 0.79 | S | S | * | * | trans | -51 | 117 | 166.6 | -117.6 | 158.6 | 0 | 0 | 0 | 110.3 | T27 | L25-T27 HydrophobicContact CD2-CG2 3.77Š| ||
| 26 | M | 39.8 | Very low | 43 | Very low | 166 Ų | 166 | 138.7 Ų | 138.7 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | trans | -133.3 | 97.1 | 160.3 | -77.3 | -79 | 94.4 | 0 | 0 | 109.1 | L24 A28 | L24-M26 PolarHBondContact O-N 3.32Å; M26-A28 PolarHBondContact O-N 3.35Å | ||
| 27 | T | 43 | Very low | 44.1 | Very low | 117 Ų | 117 | 139.8 Ų | 139.8 | 72% | 0.718 | 78% | 0.777 | S | S | * | * | trans | -69.7 | 109.4 | 169.8 | 59.4 | 0 | 0 | 0 | 0 | 109 | L25 | L25-T27 HydrophobicContact CD2-CG2 3.77Š| ||
| 28 | A | 43.4 | Very low | 45.4 | Very low | 93 Ų | 93 | 140.3 Ų | 140.3 | 77% | 0.769 | 78% | 0.776 | S | S | * | * | trans | -87.3 | 110.3 | 168.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | M26 Q30 | M26-A28 PolarHBondContact O-N 3.35Å; A28-Q30 PolarHBondContact O-N 3.27Å | ||
| 29 | K | 46.2 | Very low | 46.7 | Very low | 190 Ų | 190 | 143.8 Ų | 143.8 | 83% | 0.826 | 78% | 0.778 | S | S | * | * | trans | -53.9 | 124.9 | 175.3 | -76.1 | 171.1 | 174.6 | 174.1 | 0 | 110.7 | V31 | K29-V31 PolarHBondContact O-N 3.34Š| ||
| 30 | Q | 48.7 | Very low | 48.3 | Very low | 186 Ų | 186 | 144.4 Ų | 144.4 | 87% | 0.869 | 76% | 0.763 | S | S | * | * | trans | -70.5 | 95.3 | 166.7 | -73 | -71.5 | -16.1 | 0 | 0 | 109.1 | A28 K32 | A28-Q30 PolarHBondContact O-N 3.27Å; Q30-K32 PolarHBondContact O-N 3.02Å | ||
| 31 | V | 43 | Very low | 50.1 | Low | 107 Ų | 107 | 136.1 Ų | 136.1 | 65% | 0.648 | 73% | 0.731 | S | S | * | * | trans | -81 | 105 | 171.1 | 177 | 0 | 0 | 0 | 0 | 107.8 | K29 K33 | K29-V31 PolarHBondContact O-N 3.34Å; V31-K33 HydrophobicContact CG1-CG 4.43Å; V31-K33 PolarHBondContact O-N 3.39Å | ||
| 32 | K | 55.2 | Low | 51.8 | Low | 202 Ų | 202 | 141.7 Ų | 141.7 | 88% | 0.878 | 73% | 0.728 | S | S | * | * | trans | -63.3 | 102.8 | 165.9 | -68.8 | 179.9 | 179.1 | 179.5 | 0 | 108 | Q30 T34 | Q30-K32 PolarHBondContact O-N 3.02Å; K32-T34 PolarHBondContact O-N 3.04Å | ||
| 33 | K | 47.4 | Very low | 53.1 | Low | 189 Ų | 189 | 137.5 Ų | 137.5 | 82% | 0.822 | 70% | 0.704 | S | S | * | * | trans | -76.2 | 114.2 | 170.2 | -68.8 | -177.4 | 178.9 | -179.9 | 0 | 108.2 | V31 | V31-K33 HydrophobicContact CG1-CG 4.43Å; V31-K33 PolarHBondContact O-N 3.39Å | ||
| 34 | T | 56.3 | Low | 54.2 | Low | 125 Ų | 125 | 139.4 Ų | 139.4 | 77% | 0.767 | 70% | 0.698 | S | S | * | * | trans | -56.3 | 143.1 | 162.7 | 43.4 | 0 | 0 | 0 | 0 | 109.2 | K32 G36 | K32-T34 PolarHBondContact O-N 3.04Å; T34-G36 VanDerWaalsContact C-N 3.29Å; T34-G36 PolarHBondContact O-N 3.19Å | ||
| 35 | P | 53.3 | Low | 55.5 | Low | 128 Ų | 128 | 137.7 Ų | 137.7 | 83% | 0.831 | 69% | 0.69 | S | S | * | * | trans | -74.4 | 92.9 | 179.5 | 32.4 | -29.6 | 0 | 0 | 0 | 106.9 | L37 | P35-L37 PolarHBondContact O-N 3.47Š| ||
| 36 | G | 51.1 | Low | 56.2 | Low | 45 Ų | 45 | 135.4 Ų | 135.4 | 46% | 0.464 | 68% | 0.681 | S | S | . | * | trans | -58.3 | 105.2 | 167.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | T34 E38 | T34-G36 VanDerWaalsContact C-N 3.29Å; T34-G36 PolarHBondContact O-N 3.19Å; G36-E38 PolarHBondContact O-N 3.32Å | ||
| 37 | L | 59.7 | Low | 57.3 | Low | 174 Ų | 174 | 132.2 Ų | 132.2 | 91% | 0.911 | 67% | 0.666 | S | S | * | * | trans | -71 | 48.2 | 160.6 | -144 | 120.4 | 0 | 0 | 0 | 108.1 | P35 | P35-L37 PolarHBondContact O-N 3.47Š| ||
| 38 | E | 60.8 | Low | 58.2 | Low | 138 Ų | 138 | 131.9 Ų | 131.9 | 65% | 0.645 | 66% | 0.664 | S | S | * | * | trans | -89.8 | 129.2 | -176.4 | -70.6 | -178.7 | 158.1 | 0 | 0 | 106.8 | G36 E40 G41 | G36-E38 PolarHBondContact O-N 3.32Å; E38-E40 WeakPolarHBondContact O-CA 3.46Å; E38-E40 VanDerWaalsContact O-CG 3.25Å; E38-E40 WeakPolarHBondContact O-CG 3.35Å; E38-E40 PolarHBondContact O-N 3.09Å; E38-G41 PolarHBondContact O-N 3.01Å | ||
| 39 | R | 62.3 | Low | 59.2 | Low | 232 Ų | 232 | 133.9 Ų | 133.9 | 88% | 0.875 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 35.3 | -37.3 | 158.8 | -171.8 | 177.2 | -77.9 | -119.9 | 0.4 | 120.4 | W42 | R39-W42 PolarHBondContact O-NE1 3.41Å; R39-W42 VanDerWaalsContact O-NE1 3.13Å |
| 40 | E | 64.3 | Low | 60.2 | Low | 80 Ų | 80 | 129.1 Ų | 129.1 | 37% | 0.374 | 65% | 0.649 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -98.1 | -2.5 | 179.9 | 38.7 | -168.7 | 140.7 | 0 | 0 | 114.2 | E38 W42 W43 R44 | E38-E40 WeakPolarHBondContact O-CA 3.46Å; E38-E40 VanDerWaalsContact O-CG 3.25Å; E38-E40 WeakPolarHBondContact O-CG 3.35Å; E38-E40 PolarHBondContact O-N 3.09Å; E40-W42 PolarHBondContact O-N 2.92Å; E40-W43 HydrophobicContact CB-CZ2 3.88Å; E40-W43 VanDerWaalsContact CB-NE1 3.28Å; E40-W43 PolarHBondContact O-NE1 2.96Å; E40-R44 WeakPolarHBondContact O-CG 3.49Å; E40-R44 PolarHBondContact O-N 3.33Å; E40-R44 IonicContact OE2-CZ 3.3Å; E40-R44 VanDerWaalsContact OE2-CZ 3.3Å; E40-R44 IonicContact OE2-NH1 3.4Å; E40-R44 PolarHBondContact OE2-NH1 2.97Å; E40-R44 IonicContact OE2-NH2 2.77Å; E40-R44 PolarHBondContact OE2-NH2 2.98Å |
| 41 | G | 68.9 | Low | 61.2 | Low | 26 Ų | 26 | 123.1 Ų | 123.1 | 27% | 0.268 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -63.1 | -36.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | E38 W43 R44 L45 | E38-G41 PolarHBondContact O-N 3.01Å; G41-W43 PolarHBondContact O-N 3.01Å; G41-R44 PolarHBondContact O-N 3.32Å; G41-L45 WeakPolarHBondContact O-CG 3.43Å; G41-L45 PolarHBondContact O-N 2.98Å |
| 42 | W | 70.6 | Confident | 62.8 | Low | 195 Ų | 195 | 124 Ų | 124 | 74% | 0.739 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -70.3 | -33 | -173.2 | 71.5 | -85.1 | 0 | 0 | 0 | 113.7 | R39 E40 | R39-W42 PolarHBondContact O-NE1 3.41Å; R39-W42 VanDerWaalsContact O-NE1 3.13Å; E40-W42 PolarHBondContact O-N 2.92Å |
| 43 | W | 67.9 | Low | 63.6 | Low | 105 Ų | 105 | 120 Ų | 120 | 40% | 0.398 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -90.7 | -19.2 | 178.6 | 65.3 | -97.8 | 0 | 0 | 0 | 113.3 | E40 G41 T46 I47 | E40-W43 HydrophobicContact CB-CZ2 3.88Å; E40-W43 VanDerWaalsContact CB-NE1 3.28Å; E40-W43 PolarHBondContact O-NE1 2.96Å; G41-W43 PolarHBondContact O-N 3.01Å; W43-T46 WeakPolarHBondContact CA-OG1 3.42Å; W43-T46 PolarHBondContact O-OG1 2.94Å; W43-I47 HydrophobicContact CE3-CD1 3.47Å; W43-I47 VanDerWaalsContact CE3-CD1 3.47Å; W43-I47 HydrophobicContact CZ3-CD1 3.49Å; W43-I47 VanDerWaalsContact CZ3-CD1 3.49Å; W43-I47 WeakPolarHBondContact O-CG1 3.35Å; W43-I47 PolarHBondContact O-N 2.83Å |
| 44 | R | 69.9 | Low | 64.8 | Low | 136 Ų | 136 | 114.4 Ų | 114.4 | 51% | 0.513 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -74.5 | -35 | 173 | -76.5 | -174.9 | 174.4 | 143 | 12 | 112.8 | E40 G41 T46 I47 | E40-R44 WeakPolarHBondContact O-CG 3.49Å; E40-R44 PolarHBondContact O-N 3.33Å; E40-R44 IonicContact OE2-CZ 3.3Å; E40-R44 VanDerWaalsContact OE2-CZ 3.3Å; E40-R44 IonicContact OE2-NH1 3.4Å; E40-R44 PolarHBondContact OE2-NH1 2.97Å; E40-R44 IonicContact OE2-NH2 2.77Å; E40-R44 PolarHBondContact OE2-NH2 2.98Å; G41-R44 PolarHBondContact O-N 3.32Å; R44-T46 VanDerWaalsContact C-N 3.26Å; R44-T46 PolarHBondContact O-N 2.93Å; R44-I47 PolarHBondContact O-N 3.24Å |
| 45 | L | 65.6 | Low | 65.8 | Low | 127 Ų | 127 | 113 Ų | 113 | 67% | 0.665 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -63.8 | -32.7 | 173.4 | -67.9 | 170.3 | 0 | 0 | 0 | 111.9 | G41 T48 | G41-L45 WeakPolarHBondContact O-CG 3.43Å; G41-L45 PolarHBondContact O-N 2.98Å; L45-T48 PolarHBondContact O-OG1 2.74Å; L45-T48 VanDerWaalsContact O-OG1 3.09Å |
| 46 | T | 62.6 | Low | 66.9 | Low | 82 Ų | 82 | 112.2 Ų | 112.2 | 50% | 0.503 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -79.1 | -17 | 179.7 | 53.2 | 0 | 0 | 0 | 0 | 114.2 | W43 R44 T48 | W43-T46 WeakPolarHBondContact CA-OG1 3.42Å; W43-T46 PolarHBondContact O-OG1 2.94Å; R44-T46 VanDerWaalsContact C-N 3.26Å; R44-T46 PolarHBondContact O-N 2.93Å; T46-T48 VanDerWaalsContact C-N 3.35Å |
| 47 | I | 63.7 | Low | 68.5 | Low | 99 Ų | 99 | 116.4 Ų | 116.4 | 51% | 0.508 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -73.9 | -28.3 | -180 | -74.6 | 169.3 | 0 | 0 | 0 | 111.5 | W43 R44 T50 | W43-I47 HydrophobicContact CE3-CD1 3.47Å; W43-I47 VanDerWaalsContact CE3-CD1 3.47Å; W43-I47 HydrophobicContact CZ3-CD1 3.49Å; W43-I47 VanDerWaalsContact CZ3-CD1 3.49Å; W43-I47 WeakPolarHBondContact O-CG1 3.35Å; W43-I47 PolarHBondContact O-N 2.83Å; R44-I47 PolarHBondContact O-N 3.24Å; I47-T50 PolarHBondContact O-OG1 3.05Å |
| 48 | T | 61.8 | Low | 69.6 | Low | 111 Ų | 111 | 116.5 Ų | 116.5 | 68% | 0.681 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -80.4 | -20.6 | 178.9 | 52.6 | 0 | 0 | 0 | 0 | 113.4 | L45 T46 T50 | L45-T48 PolarHBondContact O-OG1 2.74Å; L45-T48 VanDerWaalsContact O-OG1 3.09Å; T46-T48 VanDerWaalsContact C-N 3.35Å; T48-T50 VanDerWaalsContact C-N 3.34Å |
| 49 | D | 64.1 | Low | 70.9 | Confident | 135 Ų | 135 | 116.9 Ų | 116.9 | 72% | 0.722 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.5 | 15.1 | -177 | -73 | -7.3 | 0 | 0 | 0 | 113.1 | P51 | D49-P51 WeakPolarHBondContact O-CD 3.3Š|
| 50 | T | 66.5 | Low | 72.1 | Confident | 90 Ų | 90 | 109.3 Ų | 109.3 | 55% | 0.552 | 57% | 0.565 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 116.2 | 171.1 | 57.3 | 0 | 0 | 0 | 0 | 108.6 | I47 T48 | I47-T50 PolarHBondContact O-OG1 3.05Å; T48-T50 VanDerWaalsContact C-N 3.34Å |
| 51 | P | 70.4 | Confident | 73 | Confident | 60 Ų | 60 | 113.8 Ų | 113.8 | 39% | 0.39 | 58% | 0.583 | S | S | . | * | P | Polyproline II helix | trans | -63.5 | 153.3 | 177.9 | 29.2 | -34.2 | 0 | 0 | 0 | 109.3 | D49 Y56 | D49-P51 WeakPolarHBondContact O-CD 3.3Å; P51-Y56 HydrophobicContact CG-CD1 3.59Å; P51-Y56 HydrophobicContact CG-CE1 3.21Å; P51-Y56 HydrophobicContact CG-CE2 4.38Å; P51-Y56 HydrophobicContact CG-CG 4.34Å; P51-Y56 VanDerWaalsContact O-CZ 3.28Å; P51-Y56 PolarHBondContact O-OH 3.26Å |
| 52 | I | 75.8 | Confident | 73.9 | Confident | 124 Ų | 124 | 117.1 Ų | 117.1 | 64% | 0.636 | 60% | 0.598 | S | S | * | * | P | Polyproline II helix | trans | -50 | 132.1 | -175.1 | -60.9 | 165.5 | 0 | 0 | 0 | 109.3 | G54 T55 | I52-G54 PolarHBondContact O-N 2.87Å; I52-G54 VanDerWaalsContact O-N 3.08Å; I52-T55 WeakPolarHBondContact O-CB 3.04Å; I52-T55 PolarHBondContact O-N 2.93Å; I52-T55 PolarHBondContact O-OG1 2.83Å |
| 53 | P | 71.7 | Confident | 74.8 | Confident | 120 Ų | 120 | 111.5 Ų | 111.5 | 78% | 0.779 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.4 | 119 | 178.2 | 21.1 | -31.9 | 0 | 0 | 0 | 110.7 | ||
| 54 | G | 74.5 | Confident | 75.7 | Confident | 70 Ų | 70 | 111.7 Ų | 111.7 | 72% | 0.722 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 102.1 | -8.3 | -174.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | I52 | I52-G54 PolarHBondContact O-N 2.87Å; I52-G54 VanDerWaalsContact O-N 3.08Å |
| 55 | T | 76.6 | Confident | 76.2 | Confident | 96 Ų | 96 | 107.6 Ų | 107.6 | 59% | 0.589 | 58% | 0.581 | S | S | * | * | trans | -95 | 1.5 | 174.1 | -51.9 | 0 | 0 | 0 | 0 | 112.7 | I52 H57 | I52-T55 WeakPolarHBondContact O-CB 3.04Å; I52-T55 PolarHBondContact O-N 2.93Å; I52-T55 PolarHBondContact O-OG1 2.83Å; T55-H57 PolarHBondContact O-N 2.77Å | ||
| 56 | Y | 76.9 | Confident | 77.2 | Confident | 111 Ų | 111 | 108.1 Ų | 108.1 | 44% | 0.435 | 58% | 0.584 | S | S | . | * | trans | -66.3 | 126.1 | 175.2 | -60.9 | -87.8 | 0 | 0 | 0 | 110.1 | P51 F58 | P51-Y56 HydrophobicContact CG-CD1 3.59Å; P51-Y56 HydrophobicContact CG-CE1 3.21Å; P51-Y56 HydrophobicContact CG-CE2 4.38Å; P51-Y56 HydrophobicContact CG-CG 4.34Å; P51-Y56 VanDerWaalsContact O-CZ 3.28Å; P51-Y56 PolarHBondContact O-OH 3.26Å; Y56-F58 PolarHBondContact O-N 3.09Å; Y56-F58 VanDerWaalsContact O-N 3.14Å | ||
| 57 | H | 84.6 | Confident | 78.4 | Confident | 133 Ų | 133 | 110.1 Ų | 110.1 | 62% | 0.616 | 59% | 0.591 | S | S | * | * | trans | -68.7 | 108.6 | 166.1 | -177.9 | 60.4 | 0 | 0 | 0 | 108.8 | T55 R59 E63 | T55-H57 PolarHBondContact O-N 2.77Å; H57-R59 PolarHBondContact O-N 3.35Å; H57-E63 IonicContact CD2-OE2 3.71Å; H57-E63 IonicContact CE1-OE2 2.77Å; H57-E63 IonicContact NE2-OE1 3.97Å; H57-E63 IonicContact NE2-OE2 2.78Å; H57-E63 PolarHBondContact NE2-OE2 3.23Å | ||
| 58 | F | 83 | Confident | 79.3 | Confident | 176 Ų | 176 | 111.1 Ų | 111.1 | 77% | 0.772 | 60% | 0.597 | S | S | * | * | trans | -72.8 | 98 | 170.7 | -70.6 | -79.8 | 0 | 0 | 0 | 108.4 | Y56 T60 | Y56-F58 PolarHBondContact O-N 3.09Å; Y56-F58 VanDerWaalsContact O-N 3.14Å; F58-T60 PolarHBondContact O-N 3.4Å | ||
| 59 | R | 86.7 | Confident | 80.3 | Confident | 146 Ų | 146 | 110.2 Ų | 110.2 | 55% | 0.551 | 59% | 0.593 | S | S | * | * | trans | -60 | 133.8 | 177.4 | -71.7 | -176 | -72.1 | -127.1 | 0.6 | 110.2 | H57 E63 | H57-R59 PolarHBondContact O-N 3.35Å; R59-E63 WeakPolarHBondContact CA-OE2 3.47Å; R59-E63 HydrophobicContact CB-CB 4.32Å | ||
| 60 | T | 88.8 | Confident | 80.9 | Confident | 73 Ų | 73 | 109.7 Ų | 109.7 | 45% | 0.448 | 60% | 0.595 | S | S | . | * | trans | -71.6 | 158.4 | 169.4 | 62.6 | 0 | 0 | 0 | 0 | 110.1 | F58 T62 E63 E64 | F58-T60 PolarHBondContact O-N 3.4Å; T60-T62 PolarHBondContact O-N 3.28Å; T60-T62 VanDerWaalsContact O-N 3.09Å; T60-E63 PolarHBondContact N-OE2 2.56Å; T60-E63 PolarHBondContact O-N 3.23Å; T60-E63 WeakPolarHBondContact OG1-CG 3.25Å; T60-E63 PolarHBondContact OG1-N 3.42Å; T60-E64 PolarHBondContact O-N 3.48Å | ||
| 61 | F | 83.1 | Confident | 81.4 | Confident | 175 Ų | 175 | 114 Ų | 114 | 77% | 0.768 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -52.6 | -33.9 | 176.8 | 180 | -100 | 0 | 0 | 0 | 112.6 | A65 | F61-A65 WeakPolarHBondContact O-CB 3.42Å; F61-A65 PolarHBondContact O-N 3.48Å; F61-A65 VanDerWaalsContact O-N 3.12Å |
| 62 | T | 87 | Confident | 81.5 | Confident | 95 Ų | 95 | 117.3 Ų | 117.3 | 58% | 0.583 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -68.7 | -46.4 | 176.7 | -49.1 | 0 | 0 | 0 | 0 | 112.4 | T60 E64 A65 L66 | T60-T62 PolarHBondContact O-N 3.28Å; T60-T62 VanDerWaalsContact O-N 3.09Å; T62-E64 VanDerWaalsContact C-N 3.34Å; T62-E64 PolarHBondContact O-N 3.41Å; T62-A65 PolarHBondContact O-N 3.46Å; T62-L66 WeakPolarHBondContact O-CG 3.4Å; T62-L66 PolarHBondContact O-N 3.43Å; T62-L66 VanDerWaalsContact O-N 3.16Å |
| 63 | E | 89.3 | Confident | 81.5 | Confident | 78 Ų | 78 | 118 Ų | 118 | 36% | 0.364 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -65.2 | -38.9 | 179.8 | -72 | 167 | -163.4 | 0 | 0 | 112 | H57 R59 T60 L66 L67 | H57-E63 IonicContact CD2-OE2 3.71Å; H57-E63 IonicContact CE1-OE2 2.77Å; H57-E63 IonicContact NE2-OE1 3.97Å; H57-E63 IonicContact NE2-OE2 2.78Å; H57-E63 PolarHBondContact NE2-OE2 3.23Å; R59-E63 WeakPolarHBondContact CA-OE2 3.47Å; R59-E63 HydrophobicContact CB-CB 4.32Å; T60-E63 PolarHBondContact N-OE2 2.56Å; T60-E63 PolarHBondContact O-N 3.23Å; T60-E63 WeakPolarHBondContact OG1-CG 3.25Å; T60-E63 PolarHBondContact OG1-N 3.42Å; E63-L66 PolarHBondContact O-N 3.35Å; E63-L67 PolarHBondContact O-N 3.27Å |
| 64 | E | 87 | Confident | 81.3 | Confident | 109 Ų | 109 | 120.9 Ų | 120.9 | 51% | 0.509 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -65.4 | -41.8 | 175.7 | -174.9 | 172.2 | -156.9 | 0 | 0 | 112 | T60 T62 L66 L67 N68 | T60-E64 PolarHBondContact O-N 3.48Å; T62-E64 VanDerWaalsContact C-N 3.34Å; T62-E64 PolarHBondContact O-N 3.41Å; E64-L66 VanDerWaalsContact C-N 3.28Å; E64-L66 PolarHBondContact O-N 2.98Å; E64-L67 PolarHBondContact O-N 3.13Å; E64-N68 PolarHBondContact O-N 3.49Å |
| 65 | A | 81.1 | Confident | 81 | Confident | 49 Ų | 49 | 123 Ų | 123 | 41% | 0.405 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -64 | -31.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | F61 T62 N68 P69 | F61-A65 WeakPolarHBondContact O-CB 3.42Å; F61-A65 PolarHBondContact O-N 3.48Å; F61-A65 VanDerWaalsContact O-N 3.12Å; T62-A65 PolarHBondContact O-N 3.46Å; A65-N68 CarbonylContact O-C 3.56Å; A65-P69 WeakPolarHBondContact O-CA 3.32Å |
| 66 | L | 86.8 | Confident | 80.7 | Confident | 138 Ų | 138 | 125.3 Ų | 125.3 | 72% | 0.723 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -73.4 | -34 | 174.9 | -69.3 | 176 | 0 | 0 | 0 | 112.6 | T62 E63 E64 | T62-L66 WeakPolarHBondContact O-CG 3.4Å; T62-L66 PolarHBondContact O-N 3.43Å; T62-L66 VanDerWaalsContact O-N 3.16Å; E63-L66 PolarHBondContact O-N 3.35Å; E64-L66 VanDerWaalsContact C-N 3.28Å; E64-L66 PolarHBondContact O-N 2.98Å |
| 67 | L | 88.1 | Confident | 80.2 | Confident | 124 Ų | 124 | 129.4 Ų | 129.4 | 65% | 0.649 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -72.4 | -33.8 | -179.7 | -168.4 | 69.4 | 0 | 0 | 0 | 112.2 | E63 E64 | E63-L67 PolarHBondContact O-N 3.27Å; E64-L67 PolarHBondContact O-N 3.13Å |
| 68 | N | 81.7 | Confident | 79.1 | Confident | 121 Ų | 121 | 127.7 Ų | 127.7 | 65% | 0.647 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -132 | 80.8 | 175.1 | -173.7 | 21.9 | 0 | 0 | 0 | 110.7 | E64 A65 V70 | E64-N68 PolarHBondContact O-N 3.49Å; A65-N68 CarbonylContact O-C 3.56Å; N68-V70 PolarHBondContact O-N 2.8Å |
| 69 | P | 82.9 | Confident | 78.2 | Confident | 91 Ų | 91 | 126 Ų | 126 | 59% | 0.591 | 63% | 0.632 | S | S | * | * | trans | -65.3 | 109.7 | -178.2 | 26 | -33.2 | 0 | 0 | 0 | 109.9 | A65 K71 | A65-P69 WeakPolarHBondContact O-CA 3.32Å; P69-K71 PolarHBondContact O-N 3.35Å; P69-K71 VanDerWaalsContact O-N 3.12Å | ||
| 70 | V | 77.6 | Confident | 77.3 | Confident | 125 Ų | 125 | 121.8 Ų | 121.8 | 76% | 0.758 | 63% | 0.634 | S | S | * | * | trans | -66 | 113.4 | 174 | 179.4 | 0 | 0 | 0 | 0 | 108.1 | N68 I72 | N68-V70 PolarHBondContact O-N 2.8Å; V70-I72 PolarHBondContact O-N 3.5Å; V70-I72 VanDerWaalsContact O-N 3.14Å | ||
| 71 | K | 75 | Confident | 76.2 | Confident | 181 Ų | 181 | 130 Ų | 130 | 79% | 0.787 | 66% | 0.657 | S | S | * | * | trans | -60.3 | 119.1 | 176 | -63.4 | -176.2 | -176.8 | -178.9 | 0 | 108.7 | P69 T73 | P69-K71 PolarHBondContact O-N 3.35Å; P69-K71 VanDerWaalsContact O-N 3.12Å; K71-T73 PolarHBondContact O-N 3.09Å | ||
| 72 | I | 74.5 | Confident | 75.4 | Confident | 129 Ų | 129 | 128.7 Ų | 128.7 | 66% | 0.662 | 65% | 0.651 | S | S | * | * | trans | -71 | 104.8 | 177.1 | -54.5 | 170.9 | 0 | 0 | 0 | 107.6 | V70 N75 | V70-I72 PolarHBondContact O-N 3.5Å; V70-I72 VanDerWaalsContact O-N 3.14Å; I72-N75 WeakPolarHBondContact CG2-ND2 3.39Å; I72-N75 WeakPolarHBondContact CG2-OD1 3.37Å | ||
| 73 | T | 74.6 | Confident | 74.1 | Confident | 138 Ų | 138 | 133.5 Ų | 133.5 | 85% | 0.847 | 66% | 0.664 | S | S | * | * | trans | -88.7 | -15.1 | -173.4 | 47 | 0 | 0 | 0 | 0 | 113.3 | K71 | K71-T73 PolarHBondContact O-N 3.09Š| ||
| 74 | Y | 68.4 | Low | 72.8 | Confident | 180 Ų | 180 | 135.5 Ų | 135.5 | 71% | 0.706 | 68% | 0.677 | S | S | * | * | trans | -168.5 | 130.6 | 178.3 | -176.7 | -107.5 | 0 | 0 | 0 | 109.9 | ||||
| 75 | N | 67.4 | Low | 71.6 | Confident | 115 Ų | 115 | 134.3 Ų | 134.3 | 62% | 0.615 | 68% | 0.678 | S | S | * | * | trans | -112.7 | 143.6 | 166.1 | -74.3 | -42.3 | 0 | 0 | 0 | 108.3 | I72 K77 | I72-N75 WeakPolarHBondContact CG2-ND2 3.39Å; I72-N75 WeakPolarHBondContact CG2-OD1 3.37Å; N75-K77 PolarHBondContact O-N 3.36Å | ||
| 76 | F | 69.9 | Low | 70.4 | Confident | 145 Ų | 145 | 137.1 Ų | 137.1 | 64% | 0.636 | 69% | 0.686 | S | S | * | * | trans | -56.9 | 126.1 | 165.9 | -170.7 | -122.2 | 0 | 0 | 0 | 107 | N78 | F76-N78 HydrophobicContact CD1-CB 3.75Å; F76-N78 WeakPolarHBondContact CD1-O 3.33Å; F76-N78 HydrophobicContact CE1-CB 3.57Å; F76-N78 WeakPolarHBondContact CE1-OD1 3.39Å; F76-N78 HydrophobicContact CZ-CB 4.44Å; F76-N78 WeakPolarHBondContact CZ-OD1 3.46Å; F76-N78 CarbonylContact O-C 3.45Å; F76-N78 PolarHBondContact O-N 3.04Å | ||
| 77 | K | 67.8 | Low | 69.1 | Low | 197 Ų | 197 | 136.1 Ų | 136.1 | 86% | 0.857 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -58.5 | -10.6 | -173.6 | -73.9 | -159.8 | 177.3 | -173 | 0 | 113.8 | N75 | N75-K77 PolarHBondContact O-N 3.36Š|
| 78 | N | 60 | Low | 67.7 | Low | 96 Ų | 96 | 134.5 Ų | 134.5 | 51% | 0.513 | 68% | 0.677 | S | S | . | * | S | Bend | trans | -112.7 | 94.3 | 177.5 | -29.1 | 48 | 0 | 0 | 0 | 103.4 | F76 G80 | F76-N78 HydrophobicContact CD1-CB 3.75Å; F76-N78 WeakPolarHBondContact CD1-O 3.33Å; F76-N78 HydrophobicContact CE1-CB 3.57Å; F76-N78 WeakPolarHBondContact CE1-OD1 3.39Å; F76-N78 HydrophobicContact CZ-CB 4.44Å; F76-N78 WeakPolarHBondContact CZ-OD1 3.46Å; F76-N78 CarbonylContact O-C 3.45Å; F76-N78 PolarHBondContact O-N 3.04Å; N78-G80 PolarHBondContact O-N 3.24Å |
| 79 | E | 65.3 | Low | 66.5 | Low | 141 Ų | 141 | 136.5 Ų | 136.5 | 66% | 0.659 | 68% | 0.675 | S | S | * | * | trans | -46.9 | 115.7 | 151.5 | 45.7 | -174.3 | 172.8 | 0 | 0 | 105.9 | K82 | E79-K82 WeakPolarHBondContact OE1-CE 3.45Å; E79-K82 IonicContact OE1-NZ 3.11Å; E79-K82 PolarHBondContact OE1-NZ 2.83Å; E79-K82 WeakPolarHBondContact OE2-CE 3.39Å; E79-K82 IonicContact OE2-NZ 2.72Å; E79-K82 PolarHBondContact OE2-NZ 3.37Å; E79-K82 VanDerWaalsContact OE2-NZ 3.11Å | ||
| 80 | G | 67.3 | Low | 65.5 | Low | 58 Ų | 58 | 137.5 Ų | 137.5 | 60% | 0.598 | 68% | 0.676 | S | S | * | * | trans | -54.4 | 167.4 | -179.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | N78 K82 | N78-G80 PolarHBondContact O-N 3.24Å; G80-K82 PolarHBondContact O-N 3.34Å | ||
| 81 | R | 64.7 | Low | 64.6 | Low | 246 Ų | 246 | 136 Ų | 136 | 93% | 0.928 | 66% | 0.663 | S | S | * | * | trans | -32.5 | 108.3 | -178.5 | -65.9 | 177.9 | -178.9 | 161.7 | -0.3 | 111.8 | K83 | R81-K83 PolarHBondContact O-N 2.69Š| ||
| 82 | K | 66.4 | Low | 64.1 | Low | 147 Ų | 147 | 133.4 Ų | 133.4 | 64% | 0.639 | 67% | 0.665 | S | S | * | * | trans | -58 | 110.1 | 174.9 | -65.2 | -163.7 | -179.7 | -167.8 | 0 | 107.4 | E79 G80 L84 | E79-K82 WeakPolarHBondContact OE1-CE 3.45Å; E79-K82 IonicContact OE1-NZ 3.11Å; E79-K82 PolarHBondContact OE1-NZ 2.83Å; E79-K82 WeakPolarHBondContact OE2-CE 3.39Å; E79-K82 IonicContact OE2-NZ 2.72Å; E79-K82 PolarHBondContact OE2-NZ 3.37Å; E79-K82 VanDerWaalsContact OE2-NZ 3.11Å; G80-K82 PolarHBondContact O-N 3.34Å; K82-L84 PolarHBondContact O-N 2.77Å | ||
| 83 | K | 60.9 | Low | 63.6 | Low | 195 Ų | 195 | 131.9 Ų | 131.9 | 85% | 0.848 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 123.6 | 170.3 | -67.2 | -151.7 | 179.1 | -172.1 | 0 | 107 | R81 | R81-K83 PolarHBondContact O-N 2.69Š|
| 84 | L | 61 | Low | 62.8 | Low | 121 Ų | 121 | 129.4 Ų | 129.4 | 63% | 0.634 | 65% | 0.648 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 141.6 | 174.4 | -65.3 | 174.9 | 0 | 0 | 0 | 109.6 | K82 L88 | K82-L84 PolarHBondContact O-N 2.77Å; L84-L88 HydrophobicContact CB-CD2 4.15Å; L84-L88 HydrophobicContact CD1-CD2 3.92Å; L84-L88 HydrophobicContact CD2-CD2 4.1Å; L84-L88 HydrophobicContact CG-CD2 4.26Å |
| 85 | P | 62.8 | Low | 62.4 | Low | 84 Ų | 84 | 126 Ų | 126 | 55% | 0.545 | 65% | 0.646 | S | S | . | * | P | Polyproline II helix | trans | -59.6 | 156.2 | -174.2 | 23.4 | -33.5 | 0 | 0 | 0 | 112.6 | V87 L88 | P85-V87 PolarHBondContact O-N 3.17Å; P85-L88 HydrophobicContact CG-CB 4.44Å; P85-L88 PolarHBondContact O-N 3.37Å; P85-L88 VanDerWaalsContact O-N 3.08Å |
| 86 | L | 55.8 | Low | 62.3 | Low | 107 Ų | 107 | 127.5 Ų | 127.5 | 56% | 0.56 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.7 | -23.3 | -173.5 | -164.7 | 124.1 | 0 | 0 | 0 | 114.2 | R89 | L86-R89 VanDerWaalsContact CG-CZ 3.41Å; L86-R89 WeakPolarHBondContact O-CG 3.36Å |
| 87 | V | 58.7 | Low | 62.2 | Low | 118 Ų | 118 | 126.8 Ų | 126.8 | 72% | 0.715 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | -33.6 | -176.9 | 178.7 | 0 | 0 | 0 | 0 | 111.7 | P85 R89 | P85-V87 PolarHBondContact O-N 3.17Å; V87-R89 VanDerWaalsContact C-N 3.27Å; V87-R89 PolarHBondContact O-N 3.48Å |
| 88 | L | 59.3 | Low | 62.4 | Low | 90 Ų | 90 | 122.7 Ų | 122.7 | 47% | 0.471 | 65% | 0.65 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.4 | -11 | -179 | -170.7 | 60.3 | 0 | 0 | 0 | 113.3 | L84 P85 | L84-L88 HydrophobicContact CB-CD2 4.15Å; L84-L88 HydrophobicContact CD1-CD2 3.92Å; L84-L88 HydrophobicContact CD2-CD2 4.1Å; L84-L88 HydrophobicContact CG-CD2 4.26Å; P85-L88 HydrophobicContact CG-CB 4.44Å; P85-L88 PolarHBondContact O-N 3.37Å; P85-L88 VanDerWaalsContact O-N 3.08Å |
| 89 | R | 55.9 | Low | 63.3 | Low | 163 Ų | 163 | 126.5 Ų | 126.5 | 62% | 0.615 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.7 | 0.5 | 178 | 54.7 | 170.8 | 162.4 | -141.3 | -25.9 | 114.2 | L86 V87 | L86-R89 VanDerWaalsContact CG-CZ 3.41Å; L86-R89 WeakPolarHBondContact O-CG 3.36Å; V87-R89 VanDerWaalsContact C-N 3.27Å; V87-R89 PolarHBondContact O-N 3.48Å |
| 90 | N | 61.9 | Low | 63.9 | Low | 112 Ų | 112 | 128.3 Ų | 128.3 | 60% | 0.599 | 67% | 0.666 | S | S | * | * | trans | -104.3 | 2.3 | -176.6 | -68.3 | -15.6 | 0 | 0 | 0 | 113.6 | P92 | N90-P92 WeakPolarHBondContact O-CD 3.41Š| ||
| 91 | D | 60.3 | Low | 64.6 | Low | 93 Ų | 93 | 130.3 Ų | 130.3 | 50% | 0.497 | 67% | 0.671 | S | S | . | * | trans | -71 | 122.7 | 171.1 | -64.8 | -36.5 | 0 | 0 | 0 | 108.7 | V93 | D91-V93 PolarHBondContact O-N 2.87Å; D91-V93 VanDerWaalsContact O-N 3.12Å | ||
| 92 | P | 63.3 | Low | 65.6 | Low | 126 Ų | 126 | 122.4 Ų | 122.4 | 82% | 0.818 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -69.4 | -9.7 | -175.3 | 27.8 | -34.8 | 0 | 0 | 0 | 113.1 | N90 | N90-P92 WeakPolarHBondContact O-CD 3.41Š|
| 93 | V | 63.8 | Low | 66.4 | Low | 97 Ų | 97 | 117.3 Ų | 117.3 | 59% | 0.588 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -102.1 | 113.9 | 170 | -177.4 | 0 | 0 | 0 | 0 | 106.6 | D91 T95 | D91-V93 PolarHBondContact O-N 2.87Å; D91-V93 VanDerWaalsContact O-N 3.12Å; V93-T95 PolarHBondContact O-N 3.08Å; V93-T95 PolarHBondContact O-OG1 2.76Å; V93-T95 VanDerWaalsContact O-OG1 3.1Å |
| 94 | P | 58.2 | Low | 67.8 | Low | 87 Ų | 87 | 112.6 Ų | 112.6 | 57% | 0.565 | 62% | 0.618 | S | S | * | * | trans | -63.6 | 82.3 | 165.7 | -19.7 | 32.7 | 0 | 0 | 0 | 109.1 | D96 L97 | P94-D96 PolarHBondContact O-N 3.2Å; P94-D96 VanDerWaalsContact O-N 3.12Å; P94-L97 HydrophobicContact CB-CB 4.19Å; P94-L97 HydrophobicContact CB-CD1 3.44Å; P94-L97 VanDerWaalsContact CB-CD1 3.44Å; P94-L97 HydrophobicContact CB-CG 3.8Å; P94-L97 HydrophobicContact CG-CD1 4.04Å; P94-L97 PolarHBondContact O-N 3.33Å | ||
| 95 | T | 60.6 | Low | 69 | Low | 107 Ų | 107 | 113.5 Ų | 113.5 | 66% | 0.656 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.9 | -17.5 | -170.1 | -52.6 | 0 | 0 | 0 | 0 | 112.9 | V93 | V93-T95 PolarHBondContact O-N 3.08Å; V93-T95 PolarHBondContact O-OG1 2.76Å; V93-T95 VanDerWaalsContact O-OG1 3.1Å |
| 96 | D | 64.1 | Low | 70.1 | Confident | 147 Ų | 147 | 114.4 Ų | 114.4 | 79% | 0.786 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124 | 14.5 | -176.3 | -67.1 | -28.6 | 0 | 0 | 0 | 114.3 | P94 P98 | P94-D96 PolarHBondContact O-N 3.2Å; P94-D96 VanDerWaalsContact O-N 3.12Å; D96-P98 VanDerWaalsContact O-CD 3.31Å; D96-P98 WeakPolarHBondContact O-CD 3.37Å |
| 97 | L | 67.4 | Low | 71.3 | Confident | 130 Ų | 130 | 114.4 Ų | 114.4 | 68% | 0.681 | 61% | 0.614 | S | S | * | * | S | Bend | trans | -72.5 | 118.5 | 167 | -79.2 | 174.2 | 0 | 0 | 0 | 107.4 | P94 Q99 | P94-L97 HydrophobicContact CB-CB 4.19Å; P94-L97 HydrophobicContact CB-CD1 3.44Å; P94-L97 VanDerWaalsContact CB-CD1 3.44Å; P94-L97 HydrophobicContact CB-CG 3.8Å; P94-L97 HydrophobicContact CG-CD1 4.04Å; P94-L97 PolarHBondContact O-N 3.33Å; L97-Q99 PolarHBondContact O-N 3.14Å; L97-Q99 VanDerWaalsContact O-N 3.17Å |
| 98 | P | 71.9 | Confident | 72.5 | Confident | 112 Ų | 112 | 113.1 Ų | 113.1 | 73% | 0.727 | 60% | 0.602 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 130.6 | 172.4 | 25 | -32.7 | 0 | 0 | 0 | 107.5 | D96 Y100 | D96-P98 VanDerWaalsContact O-CD 3.31Å; D96-P98 WeakPolarHBondContact O-CD 3.37Å; P98-Y100 PolarHBondContact O-N 3.15Å |
| 99 | Q | 79.3 | Confident | 73.3 | Confident | 176 Ų | 176 | 114.4 Ų | 114.4 | 82% | 0.822 | 61% | 0.609 | S | S | * | * | P | Polyproline II helix | trans | -48.2 | 118.4 | 172 | 176.6 | 64.6 | 18.4 | 0 | 0 | 107.7 | L97 S101 | L97-Q99 PolarHBondContact O-N 3.14Å; L97-Q99 VanDerWaalsContact O-N 3.17Å; Q99-S101 PolarHBondContact O-N 3.22Å |
| 100 | Y | 78.2 | Confident | 74.2 | Confident | 178 Ų | 178 | 114.9 Ų | 114.9 | 70% | 0.698 | 62% | 0.616 | S | S | * | * | trans | -64.1 | 106 | -180 | 178.2 | -99.9 | 0 | 0 | 0 | 108.3 | P98 P102 | P98-Y100 PolarHBondContact O-N 3.15Å; Y100-P102 HydrophobicContact CE1-CB 3.92Å | ||
| 101 | S | 81.8 | Confident | 74.9 | Confident | 101 Ų | 101 | 115.9 Ų | 115.9 | 71% | 0.706 | 62% | 0.615 | S | S | * | * | trans | -99.8 | 111.2 | 169.6 | -165 | 0 | 0 | 0 | 0 | 106.4 | Q99 | Q99-S101 PolarHBondContact O-N 3.22Š| ||
| 102 | P | 86.3 | Confident | 75 | Confident | 80 Ų | 80 | 117.5 Ų | 117.5 | 52% | 0.519 | 62% | 0.619 | S | S | . | * | P | Polyproline II helix | trans | -60.4 | 142.6 | 178.1 | 26.4 | -32.7 | 0 | 0 | 0 | 109 | Y100 D104 | Y100-P102 HydrophobicContact CE1-CB 3.92Å; P102-D104 PolarHBondContact O-N 3.06Å |
| 103 | P | 83.8 | Confident | 75 | Confident | 40 Ų | 40 | 117.6 Ų | 117.6 | 26% | 0.26 | 62% | 0.618 | S | S | . | * | P | Polyproline II helix | trans | -59.1 | 134.5 | -179.7 | 24.9 | -34.1 | 0 | 0 | 0 | 110.5 | E107 L108 | P103-E107 WeakPolarHBondContact CA-OE2 3.43Å; P103-E107 HydrophobicContact CB-CB 4.34Å; P103-L108 HydrophobicContact CB-CD2 4.04Å; P103-L108 HydrophobicContact CB-CG 4.24Å; P103-L108 HydrophobicContact CG-CD2 3.71Å; P103-L108 HydrophobicContact CG-CG 4.22Å |
| 104 | D | 88.9 | Confident | 74.6 | Confident | 95 Ų | 95 | 117 Ų | 117 | 51% | 0.508 | 62% | 0.623 | S | S | . | * | P | Polyproline II helix | trans | -66.5 | 157.2 | 178.2 | 179.2 | 35.7 | 0 | 0 | 0 | 110.9 | P102 L106 E107 L108 | P102-D104 PolarHBondContact O-N 3.06Å; D104-L106 PolarHBondContact O-N 3.43Å; D104-E107 HydrophobicContact CB-CG 4.16Å; D104-E107 PolarHBondContact N-OE2 2.99Å; D104-E107 WeakPolarHBondContact O-CA 3.36Å; D104-E107 WeakPolarHBondContact O-CB 3.34Å; D104-E107 PolarHBondContact O-N 3.27Å; D104-L108 PolarHBondContact O-N 3.17Å |
| 105 | F | 86.3 | Confident | 74.7 | Confident | 141 Ų | 141 | 116.5 Ų | 116.5 | 62% | 0.618 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -55.7 | -38.2 | -179.2 | -179.1 | -102.8 | 0 | 0 | 0 | 112.3 | E107 L108 L109 | F105-E107 VanDerWaalsContact C-N 3.33Å; F105-E107 PolarHBondContact O-N 3.26Å; F105-L108 PolarHBondContact O-N 3.12Å; F105-L109 HydrophobicContact CD1-CD1 3.95Å; F105-L109 HydrophobicContact CE1-CD1 3.48Å; F105-L109 VanDerWaalsContact CE1-CD1 3.48Å; F105-L109 HydrophobicContact CE1-CG 4.18Å; F105-L109 HydrophobicContact CZ-CD1 4.03Å; F105-L109 HydrophobicContact CZ-CG 4.34Å; F105-L109 WeakPolarHBondContact O-CG 3.49Å; F105-L109 PolarHBondContact O-N 3.35Å |
| 106 | L | 86.3 | Confident | 74.7 | Confident | 102 Ų | 102 | 120.8 Ų | 120.8 | 53% | 0.534 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -69.3 | -31.4 | 175.8 | -61.4 | -177.1 | 0 | 0 | 0 | 112.6 | D104 L109 K110 | D104-L106 PolarHBondContact O-N 3.43Å; L106-L109 HydrophobicContact CD2-CD1 4.38Å; L106-L109 PolarHBondContact O-N 3.37Å; L106-K110 VanDerWaalsContact O-CG 3.32Å; L106-K110 WeakPolarHBondContact O-CG 3.33Å; L106-K110 PolarHBondContact O-N 3.2Å; L106-K110 VanDerWaalsContact O-N 3.08Å |
| 107 | E | 81.4 | Confident | 74.4 | Confident | 108 Ų | 108 | 116.5 Ų | 116.5 | 51% | 0.505 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -72.7 | -35.5 | 175.3 | -63.4 | -174.1 | 159.7 | 0 | 0 | 111.8 | P103 D104 F105 K110 K111 | P103-E107 WeakPolarHBondContact CA-OE2 3.43Å; P103-E107 HydrophobicContact CB-CB 4.34Å; D104-E107 HydrophobicContact CB-CG 4.16Å; D104-E107 PolarHBondContact N-OE2 2.99Å; D104-E107 WeakPolarHBondContact O-CA 3.36Å; D104-E107 WeakPolarHBondContact O-CB 3.34Å; D104-E107 PolarHBondContact O-N 3.27Å; F105-E107 VanDerWaalsContact C-N 3.33Å; F105-E107 PolarHBondContact O-N 3.26Å; E107-K110 PolarHBondContact O-N 3.23Å; E107-K111 WeakPolarHBondContact O-CB 3.47Å; E107-K111 WeakPolarHBondContact O-CG 3.14Å; E107-K111 PolarHBondContact O-N 3.5Å |
| 108 | L | 83 | Confident | 74.1 | Confident | 91 Ų | 91 | 117.5 Ų | 117.5 | 48% | 0.476 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -65.3 | -40.1 | 172.2 | -68.4 | 176.3 | 0 | 0 | 0 | 111.5 | P103 D104 F105 K110 K111 | P103-L108 HydrophobicContact CB-CD2 4.04Å; P103-L108 HydrophobicContact CB-CG 4.24Å; P103-L108 HydrophobicContact CG-CD2 3.71Å; P103-L108 HydrophobicContact CG-CG 4.22Å; D104-L108 PolarHBondContact O-N 3.17Å; F105-L108 PolarHBondContact O-N 3.12Å; L108-K110 VanDerWaalsContact C-N 3.31Å; L108-K110 PolarHBondContact O-N 3.4Å; L108-K111 HydrophobicContact CD2-CD 4.37Å; L108-K111 WeakPolarHBondContact O-CB 3.39Å; L108-K111 PolarHBondContact O-N 3.03Å |
| 109 | L | 75.9 | Confident | 73.1 | Confident | 117 Ų | 117 | 121.2 Ų | 121.2 | 61% | 0.613 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -65.2 | -34 | 174 | -76.2 | 174.2 | 0 | 0 | 0 | 112.8 | F105 L106 | F105-L109 HydrophobicContact CD1-CD1 3.95Å; F105-L109 HydrophobicContact CE1-CD1 3.48Å; F105-L109 VanDerWaalsContact CE1-CD1 3.48Å; F105-L109 HydrophobicContact CE1-CG 4.18Å; F105-L109 HydrophobicContact CZ-CD1 4.03Å; F105-L109 HydrophobicContact CZ-CG 4.34Å; F105-L109 WeakPolarHBondContact O-CG 3.49Å; F105-L109 PolarHBondContact O-N 3.35Å; L106-L109 HydrophobicContact CD2-CD1 4.38Å; L106-L109 PolarHBondContact O-N 3.37Å |
| 110 | K | 76.3 | Confident | 72.2 | Confident | 172 Ų | 172 | 119 Ų | 119 | 75% | 0.748 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -76.8 | -22.9 | 175.2 | -73.4 | 173.2 | -178.1 | 176.5 | 0 | 113.2 | L106 E107 L108 Q112 | L106-K110 VanDerWaalsContact O-CG 3.32Å; L106-K110 WeakPolarHBondContact O-CG 3.33Å; L106-K110 PolarHBondContact O-N 3.2Å; L106-K110 VanDerWaalsContact O-N 3.08Å; E107-K110 PolarHBondContact O-N 3.23Å; L108-K110 VanDerWaalsContact C-N 3.31Å; L108-K110 PolarHBondContact O-N 3.4Å; K110-Q112 PolarHBondContact O-N 3.02Å |
| 111 | K | 74.9 | Confident | 71.4 | Confident | 133 Ų | 133 | 118.9 Ų | 118.9 | 58% | 0.578 | 61% | 0.609 | S | S | * | * | S | Bend | trans | -72.8 | 77.2 | 172.3 | -85.3 | 171.7 | 164.2 | 172.4 | 0 | 109.7 | E107 L108 T113 | E107-K111 WeakPolarHBondContact O-CB 3.47Å; E107-K111 WeakPolarHBondContact O-CG 3.14Å; E107-K111 PolarHBondContact O-N 3.5Å; L108-K111 HydrophobicContact CD2-CD 4.37Å; L108-K111 WeakPolarHBondContact O-CB 3.39Å; L108-K111 PolarHBondContact O-N 3.03Å; K111-T113 PolarHBondContact O-N 3.09Å |
| 112 | Q | 64.3 | Low | 70.4 | Confident | 128 Ų | 128 | 119.8 Ų | 119.8 | 60% | 0.598 | 61% | 0.613 | S | S | * | * | trans | -50.7 | 121.8 | 167.1 | -173.6 | -179 | -54.4 | 0 | 0 | 109.9 | K110 A114 P126 | K110-Q112 PolarHBondContact O-N 3.02Å; Q112-A114 PolarHBondContact O-N 3.47Å; Q112-P126 HydrophobicContact CG-CB 3.55Å; Q112-P126 HydrophobicContact CG-CG 3.82Å | ||
| 113 | T | 62.1 | Low | 69.3 | Low | 128 Ų | 128 | 121 Ų | 121 | 79% | 0.785 | 61% | 0.607 | S | S | * | * | trans | -70.7 | 90.6 | 177.8 | 42.3 | 0 | 0 | 0 | 0 | 109.5 | K111 S115 | K111-T113 PolarHBondContact O-N 3.09Å; T113-S115 VanDerWaalsContact C-N 3.33Å; T113-S115 PolarHBondContact O-N 2.75Å | ||
| 114 | A | 56.5 | Low | 68.5 | Low | 85 Ų | 85 | 123.7 Ų | 123.7 | 70% | 0.702 | 63% | 0.633 | S | S | * | * | trans | -72.8 | 89.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | Q112 Y116 | Q112-A114 PolarHBondContact O-N 3.47Å; A114-Y116 PolarHBondContact O-N 3.38Å; A114-Y116 VanDerWaalsContact O-N 3.16Å | ||
| 115 | S | 58.5 | Low | 67.2 | Low | 75 Ų | 75 | 123.8 Ų | 123.8 | 52% | 0.524 | 63% | 0.633 | S | S | . | * | trans | -68.7 | 107.5 | 161.8 | -69 | 0 | 0 | 0 | 0 | 107.7 | T113 | T113-S115 VanDerWaalsContact C-N 3.33Å; T113-S115 PolarHBondContact O-N 2.75Å | ||
| 116 | Y | 61.4 | Low | 66.1 | Low | 198 Ų | 198 | 120.2 Ų | 120.2 | 78% | 0.776 | 62% | 0.624 | S | S | * | * | trans | 36.9 | 97.7 | 163 | -171.2 | -102.1 | 0 | 0 | 0 | 116.3 | A114 | A114-Y116 PolarHBondContact O-N 3.38Å; A114-Y116 VanDerWaalsContact O-N 3.16Å | ||
| 117 | S | 57.5 | Low | 64.8 | Low | 57 Ų | 57 | 120.4 Ų | 120.4 | 40% | 0.399 | 63% | 0.634 | S | S | . | * | trans | -104 | 138.2 | 169 | 60.1 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 118 | F | 60.8 | Low | 63.8 | Low | 150 Ų | 150 | 116.5 Ų | 116.5 | 66% | 0.658 | 62% | 0.617 | S | S | * | * | trans | -68 | 132.8 | 169.3 | -169.7 | -105.8 | 0 | 0 | 0 | 109.2 | D120 | F118-D120 HydrophobicContact CD1-CB 4.05Å; F118-D120 HydrophobicContact CE1-CB 4.02Å; F118-D120 VanDerWaalsContact CE1-OD2 3.3Å; F118-D120 WeakPolarHBondContact CE1-OD2 2.98Å; F118-D120 PolarHBondContact O-N 3.5Å | ||
| 119 | K | 51.5 | Low | 62.5 | Low | 191 Ų | 191 | 116.2 Ų | 116.2 | 83% | 0.83 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | -6.1 | -160.8 | -67.5 | -65.7 | -176.3 | -177 | 0 | 115.7 | ||
| 120 | D | 60 | Low | 61.5 | Low | 129 Ų | 129 | 116.4 Ų | 116.4 | 69% | 0.69 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | -25 | -172.7 | -72.9 | -11.7 | 0 | 0 | 0 | 113.7 | F118 | F118-D120 HydrophobicContact CD1-CB 4.05Å; F118-D120 HydrophobicContact CE1-CB 4.02Å; F118-D120 VanDerWaalsContact CE1-OD2 3.3Å; F118-D120 WeakPolarHBondContact CE1-OD2 2.98Å; F118-D120 PolarHBondContact O-N 3.5Å |
| 121 | K | 61.2 | Low | 60.4 | Low | 175 Ų | 175 | 115 Ų | 115 | 76% | 0.761 | 62% | 0.622 | S | S | * | * | trans | -153.1 | 135.3 | 171.6 | -63.8 | -174.4 | -177.4 | 170.5 | 0 | 112.2 | ||||
| 122 | P | 61.7 | Low | 59.5 | Low | 120 Ų | 120 | 115 Ų | 115 | 78% | 0.779 | 62% | 0.623 | S | S | * | * | trans | -65.5 | 142 | 168.4 | 28.6 | -32.5 | 0 | 0 | 0 | 110.2 | ||||
| 123 | R | 63.1 | Low | 59.1 | Low | 106 Ų | 106 | 112 Ų | 112 | 40% | 0.4 | 61% | 0.611 | S | S | . | * | trans | -62.2 | 144.9 | 171.5 | -77.4 | -176.4 | 170.9 | 146.1 | -10.3 | 109.9 | D133 | R123-D133 IonicContact CZ-OD2 3.73Å; R123-D133 IonicContact NH2-OD2 2.8Å; R123-D133 PolarHBondContact NH2-OD2 3.12Å | ||
| 124 | A | 66.4 | Low | 58.9 | Low | 97 Ų | 97 | 113.8 Ų | 113.8 | 80% | 0.802 | 61% | 0.61 | S | S | * | * | S | Bend | trans | -67.7 | -44.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 125 | D | 62.1 | Low | 59 | Low | 96 Ų | 96 | 117.5 Ų | 117.5 | 51% | 0.513 | 61% | 0.612 | S | S | . | * | trans | -126.7 | 134.4 | 178.8 | -66.7 | -39.4 | 0 | 0 | 0 | 111.2 | T128 | D125-T128 HydrophobicContact CB-CG2 4.18Å; D125-T128 PolarHBondContact O-OG1 3.42Å | ||
| 126 | P | 62.3 | Low | 59.4 | Low | 67 Ų | 67 | 120 Ų | 120 | 44% | 0.435 | 62% | 0.616 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -78.6 | -15.2 | 177.6 | 28.6 | -35.8 | 0 | 0 | 0 | 115.9 | Q112 | Q112-P126 HydrophobicContact CG-CB 3.55Å; Q112-P126 HydrophobicContact CG-CG 3.82Å |
| 127 | S | 60.7 | Low | 59.7 | Low | 106 Ų | 106 | 112.8 Ų | 112.8 | 74% | 0.741 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90 | -6 | -169.9 | 54.2 | 0 | 0 | 0 | 0 | 113.6 | L129 | S127-L129 VanDerWaalsContact C-N 3.34Å; S127-L129 PolarHBondContact O-N 2.99Å |
| 128 | T | 59.1 | Low | 60.5 | Low | 25 Ų | 25 | 113.5 Ų | 113.5 | 15% | 0.153 | 61% | 0.605 | C | S | . | * | trans | -93.3 | 17.2 | -171.5 | 52.1 | 0 | 0 | 0 | 0 | 114.3 | D125 V130 K132 | D125-T128 HydrophobicContact CB-CG2 4.18Å; D125-T128 PolarHBondContact O-OG1 3.42Å; T128-V130 PolarHBondContact O-N 3.04Å; T128-K132 HydrophobicContact CG2-CD 4.3Å | ||
| 129 | L | 56 | Low | 61.3 | Low | 86 Ų | 86 | 107.5 Ų | 107.5 | 45% | 0.45 | 59% | 0.586 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -57.6 | -18.6 | -166.5 | -166.1 | 148.5 | 0 | 0 | 0 | 115.6 | S127 | S127-L129 VanDerWaalsContact C-N 3.34Å; S127-L129 PolarHBondContact O-N 2.99Å |
| 130 | V | 56.3 | Low | 62.6 | Low | 121 Ų | 121 | 105 Ų | 105 | 73% | 0.733 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120 | -20.5 | -161.8 | -170.2 | 0 | 0 | 0 | 0 | 115.4 | T128 | T128-V130 PolarHBondContact O-N 3.04Š|
| 131 | D | 53.2 | Low | 63.2 | Low | 141 Ų | 141 | 102 Ų | 102 | 75% | 0.754 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -139.3 | -5 | -170.3 | -103.7 | -18.9 | 0 | 0 | 0 | 116.2 | ||
| 132 | K | 55.4 | Low | 64.1 | Low | 135 Ų | 135 | 99.4 Ų | 99.4 | 59% | 0.587 | 58% | 0.583 | S | S | * | * | S | Bend | trans | -117.1 | -5.8 | -175.3 | -68.9 | -175.3 | 179.5 | 178.4 | 0 | 115 | T128 E134 H135 | T128-K132 HydrophobicContact CG2-CD 4.3Å; K132-E134 PolarHBondContact O-N 3.14Å; K132-E134 VanDerWaalsContact O-N 3.16Å; K132-H135 PolarHBondContact O-N 3.16Å |
| 133 | D | 55.3 | Low | 65 | Low | 65 Ų | 65 | 100.8 Ų | 100.8 | 35% | 0.348 | 57% | 0.573 | S | S | . | * | G | 310 helix | trans | -67.6 | -11.5 | 175.6 | -73.2 | 11.3 | 0 | 0 | 0 | 111.7 | R123 H135 E136 | R123-D133 IonicContact CZ-OD2 3.73Å; R123-D133 IonicContact NH2-OD2 2.8Å; R123-D133 PolarHBondContact NH2-OD2 3.12Å; D133-H135 PolarHBondContact O-N 3.05Å; D133-E136 PolarHBondContact O-N 2.73Å |
| 134 | E | 57.3 | Low | 65.8 | Low | 164 Ų | 164 | 102.7 Ų | 102.7 | 77% | 0.766 | 59% | 0.587 | S | S | * | * | G | 310 helix | trans | -61.8 | -22.3 | 173.9 | -71.6 | -165.5 | 158.8 | 0 | 0 | 113.8 | K132 | K132-E134 PolarHBondContact O-N 3.14Å; K132-E134 VanDerWaalsContact O-N 3.16Å |
| 135 | H | 59.6 | Low | 66.3 | Low | 164 Ų | 164 | 105.6 Ų | 105.6 | 76% | 0.759 | 59% | 0.588 | S | S | * | * | G | 310 helix | trans | -113.2 | -1 | -177.3 | -60.6 | -46.3 | 0 | 0 | 0 | 114.2 | K132 D133 G137 | K132-H135 PolarHBondContact O-N 3.16Å; D133-H135 PolarHBondContact O-N 3.05Å; H135-G137 VanDerWaalsContact C-N 3.3Å; H135-G137 PolarHBondContact O-N 3.2Å |
| 136 | E | 66.6 | Low | 67.1 | Low | 127 Ų | 127 | 108.1 Ų | 108.1 | 59% | 0.593 | 59% | 0.594 | S | S | * | * | S | Bend | trans | -86.5 | 6.5 | -174.7 | -68.8 | -163.8 | 171.6 | 0 | 0 | 114.3 | D133 | D133-E136 PolarHBondContact O-N 2.73Š|
| 137 | G | 67.9 | Low | 67.7 | Low | 47 Ų | 47 | 109.4 Ų | 109.4 | 49% | 0.485 | 61% | 0.611 | S | S | . | * | S | Bend | trans | -131.1 | 158.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | H135 G139 | H135-G137 VanDerWaalsContact C-N 3.3Å; H135-G137 PolarHBondContact O-N 3.2Å; G137-G139 PolarHBondContact O-N 2.81Å |
| 138 | P | 74.8 | Confident | 68 | Low | 71 Ų | 71 | 109.2 Ų | 109.2 | 46% | 0.461 | 61% | 0.61 | S | S | . | * | trans | -53.7 | 138.7 | 164.6 | 26 | -33.7 | 0 | 0 | 0 | 108.9 | D142 Y143 | P138-D142 HydrophobicContact CB-CB 3.83Å; P138-Y143 HydrophobicContact CB-CD1 4.46Å; P138-Y143 HydrophobicContact CG-CD1 3.63Å; P138-Y143 HydrophobicContact CG-CE1 3.51Å; P138-Y143 HydrophobicContact CG-CG 4.49Å | ||
| 139 | G | 77.8 | Confident | 68.4 | Low | 25 Ų | 25 | 112.7 Ų | 112.7 | 26% | 0.258 | 63% | 0.632 | S | S | . | * | trans | -57.2 | 162 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | G137 G141 D142 | G137-G139 PolarHBondContact O-N 2.81Å; G139-G141 PolarHBondContact O-N 3.33Å; G139-D142 PolarHBondContact N-OD2 3.21Å; G139-D142 PolarHBondContact O-N 3.12Å | ||
| 140 | P | 77.3 | Confident | 69 | Low | 139 Ų | 139 | 119.5 Ų | 119.5 | 90% | 0.903 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.8 | 102.8 | 176.6 | 25.2 | -33.3 | 0 | 0 | 0 | 109.8 | ||
| 141 | G | 73.1 | Confident | 69.5 | Low | 65 Ų | 65 | 116 Ų | 116 | 67% | 0.67 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 115.7 | -13.4 | -176.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | G139 Y143 | G139-G141 PolarHBondContact O-N 3.33Å; G141-Y143 PolarHBondContact O-N 3.15Å |
| 142 | D | 79.6 | Confident | 70.1 | Confident | 120 Ų | 120 | 114 Ų | 114 | 64% | 0.642 | 64% | 0.644 | S | S | * | * | trans | -87.9 | 16.1 | -178.7 | -64.2 | -34.4 | 0 | 0 | 0 | 113.3 | P138 G139 E144 | P138-D142 HydrophobicContact CB-CB 3.83Å; G139-D142 PolarHBondContact N-OD2 3.21Å; G139-D142 PolarHBondContact O-N 3.12Å; D142-E144 PolarHBondContact O-N 2.92Å | ||
| 143 | Y | 81.1 | Confident | 70.5 | Confident | 149 Ų | 149 | 115.7 Ų | 115.7 | 58% | 0.584 | 66% | 0.657 | S | S | * | * | trans | -72.8 | 118.1 | 177.6 | -59.1 | -77.9 | 0 | 0 | 0 | 110.1 | P138 G141 L145 | P138-Y143 HydrophobicContact CB-CD1 4.46Å; P138-Y143 HydrophobicContact CG-CD1 3.63Å; P138-Y143 HydrophobicContact CG-CE1 3.51Å; P138-Y143 HydrophobicContact CG-CG 4.49Å; G141-Y143 PolarHBondContact O-N 3.15Å; Y143-L145 PolarHBondContact O-N 2.87Å | ||
| 144 | E | 80.6 | Confident | 71.1 | Confident | 147 Ų | 147 | 115.8 Ų | 115.8 | 69% | 0.687 | 66% | 0.661 | S | S | * | * | trans | -69.1 | 95.6 | 170.1 | -162.5 | -167.4 | 164.7 | 0 | 0 | 109.1 | D142 K146 | D142-E144 PolarHBondContact O-N 2.92Å; E144-K146 VanDerWaalsContact C-N 3.33Å; E144-K146 PolarHBondContact O-N 3.3Å; E144-K146 IonicContact OE1-NZ 3.67Å; E144-K146 PolarHBondContact OE1-NZ 2.82Å; E144-K146 WeakPolarHBondContact OE2-CE 3.48Å; E144-K146 IonicContact OE2-NZ 2.75Å; E144-K146 PolarHBondContact OE2-NZ 2.85Å | ||
| 145 | L | 76.5 | Confident | 71.8 | Confident | 158 Ų | 158 | 111.6 Ų | 111.6 | 83% | 0.827 | 65% | 0.65 | S | S | * | * | trans | -68.2 | 91.8 | 174.7 | -62 | 179.2 | 0 | 0 | 0 | 108.8 | Y143 A147 | Y143-L145 PolarHBondContact O-N 2.87Å; L145-A147 PolarHBondContact O-N 2.92Å; L145-A147 VanDerWaalsContact O-N 3.12Å | ||
| 146 | K | 77.8 | Confident | 72.2 | Confident | 148 Ų | 148 | 110.7 Ų | 110.7 | 64% | 0.643 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 123.6 | 169 | -60.9 | -66.6 | 174.4 | -166.7 | 0 | 107.2 | E144 S148 | E144-K146 VanDerWaalsContact C-N 3.33Å; E144-K146 PolarHBondContact O-N 3.3Å; E144-K146 IonicContact OE1-NZ 3.67Å; E144-K146 PolarHBondContact OE1-NZ 2.82Å; E144-K146 WeakPolarHBondContact OE2-CE 3.48Å; E144-K146 IonicContact OE2-NZ 2.75Å; E144-K146 PolarHBondContact OE2-NZ 2.85Å; K146-S148 PolarHBondContact O-N 3.11Å; K146-S148 VanDerWaalsContact O-N 3.15Å |
| 147 | A | 74.9 | Confident | 72.3 | Confident | 95 Ų | 95 | 113.1 Ų | 113.1 | 79% | 0.785 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 126.8 | 177 | 0 | 0 | 0 | 0 | 0 | 108.7 | L145 | L145-A147 PolarHBondContact O-N 2.92Å; L145-A147 VanDerWaalsContact O-N 3.12Å |
| 148 | S | 68.4 | Low | 72.1 | Confident | 102 Ų | 102 | 120 Ų | 120 | 71% | 0.713 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -49.7 | 127.4 | -178.4 | -175.2 | 0 | 0 | 0 | 0 | 108.7 | K146 K150 | K146-S148 PolarHBondContact O-N 3.11Å; K146-S148 VanDerWaalsContact O-N 3.15Å; S148-K150 PolarHBondContact O-N 2.91Å |
| 149 | P | 67.8 | Low | 72.2 | Confident | 97 Ų | 97 | 119.5 Ų | 119.5 | 63% | 0.63 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 132.1 | 178.5 | 17.8 | -28.5 | 0 | 0 | 0 | 108.2 | G151 | P149-G151 PolarHBondContact O-N 2.78Š|
| 150 | K | 67.2 | Low | 71.9 | Confident | 229 Ų | 229 | 128.3 Ų | 128.3 | 100% | 0.996 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -65 | 17 | -176.1 | -64.9 | -174.7 | 179.9 | 177.4 | 0 | 114 | S148 | S148-K150 PolarHBondContact O-N 2.91Š|
| 151 | G | 66.7 | Low | 71.8 | Confident | 47 Ų | 47 | 127 Ų | 127 | 49% | 0.485 | 70% | 0.699 | S | S | . | * | S | Bend | trans | -126.5 | 130.5 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | P149 I153 | P149-G151 PolarHBondContact O-N 2.78Å; G151-I153 PolarHBondContact O-N 2.77Å |
| 152 | S | 67.2 | Low | 71.8 | Confident | 100 Ų | 100 | 129.1 Ų | 129.1 | 70% | 0.699 | 70% | 0.701 | S | S | * | * | trans | -55.3 | 132.8 | 166.5 | 68.5 | 0 | 0 | 0 | 0 | 108.4 | T154 | S152-T154 VanDerWaalsContact C-N 3.35Å; S152-T154 WeakPolarHBondContact O-CG2 3.3Å; S152-T154 PolarHBondContact O-N 3.29Å | ||
| 153 | I | 64 | Low | 71.4 | Confident | 170 Ų | 170 | 132.8 Ų | 132.8 | 87% | 0.872 | 71% | 0.705 | S | S | * | * | trans | -55.4 | 102.8 | 168.8 | -64.6 | 166.5 | 0 | 0 | 0 | 107 | G151 | G151-I153 PolarHBondContact O-N 2.77Š| ||
| 154 | T | 66.8 | Low | 71.2 | Confident | 68 Ų | 68 | 133.4 Ų | 133.4 | 42% | 0.417 | 71% | 0.712 | S | S | . | * | trans | -91.5 | 129.6 | 177.1 | 61 | 0 | 0 | 0 | 0 | 108.2 | S152 R158 | S152-T154 VanDerWaalsContact C-N 3.35Å; S152-T154 WeakPolarHBondContact O-CG2 3.3Å; S152-T154 PolarHBondContact O-N 3.29Å; T154-R158 HydrophobicContact CG2-CG 4.48Å; T154-R158 WeakPolarHBondContact OG1-CD 2.93Å | ||
| 155 | S | 72.6 | Confident | 70.8 | Confident | 76 Ų | 76 | 133.8 Ų | 133.8 | 53% | 0.531 | 72% | 0.717 | S | S | . | * | trans | -38.9 | 141.4 | 161.7 | 164 | 0 | 0 | 0 | 0 | 111.1 | F157 R158 | S155-F157 CarbonylContact O-C 3.42Å; S155-F157 PolarHBondContact O-N 3.31Å; S155-F157 PolarHBondContact OG-N 2.9Å; S155-F157 PolarHBondContact OG-O 2.72Å; S155-R158 WeakPolarHBondContact O-CG 2.86Å; S155-R158 PolarHBondContact O-N 2.97Å | ||
| 156 | C | 68.6 | Low | 70.5 | Confident | 145 Ų | 145 | 131.4 Ų | 131.4 | 98% | 0.98 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -56 | -19.6 | 170.7 | 48.6 | 0 | 0 | 0 | 0 | 112.4 | ||
| 157 | F | 66.7 | Low | 70 | Confident | 177 Ų | 177 | 131.5 Ų | 131.5 | 78% | 0.776 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -97.3 | 80.5 | 169 | -157.6 | -101.9 | 0 | 0 | 0 | 110.5 | S155 S159 | S155-F157 CarbonylContact O-C 3.42Å; S155-F157 PolarHBondContact O-N 3.31Å; S155-F157 PolarHBondContact OG-N 2.9Å; S155-F157 PolarHBondContact OG-O 2.72Å; F157-S159 PolarHBondContact O-N 3.38Å |
| 158 | R | 65.2 | Low | 69.6 | Low | 191 Ų | 191 | 131.6 Ų | 131.6 | 72% | 0.721 | 72% | 0.719 | S | S | * | * | trans | -78.3 | 102.4 | 172.2 | -67.7 | -179.1 | 70.6 | -172.9 | 1.1 | 109.2 | T154 S155 K160 | T154-R158 HydrophobicContact CG2-CG 4.48Å; T154-R158 WeakPolarHBondContact OG1-CD 2.93Å; S155-R158 WeakPolarHBondContact O-CG 2.86Å; S155-R158 PolarHBondContact O-N 2.97Å; R158-K160 PolarHBondContact O-N 3.37Å | ||
| 159 | S | 75.7 | Confident | 69.7 | Low | 61 Ų | 61 | 130.7 Ų | 130.7 | 43% | 0.427 | 71% | 0.713 | S | S | . | * | trans | -62.3 | 123.3 | 167.8 | 59.8 | 0 | 0 | 0 | 0 | 109.1 | F157 V161 | F157-S159 PolarHBondContact O-N 3.38Å; S159-V161 PolarHBondContact O-N 3.08Å; S159-V161 VanDerWaalsContact O-N 3.15Å | ||
| 160 | K | 72.2 | Confident | 69.8 | Low | 211 Ų | 211 | 136.1 Ų | 136.1 | 92% | 0.917 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -67.6 | -5.3 | 171.5 | -67.7 | -176.2 | 179.8 | 177.1 | 0 | 113 | R158 P162 | R158-K160 PolarHBondContact O-N 3.37Å; K160-P162 WeakPolarHBondContact O-CD 3.49Å |
| 161 | V | 75.1 | Confident | 70.2 | Confident | 111 Ų | 111 | 129.6 Ų | 129.6 | 67% | 0.673 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -81.3 | 118 | 179.1 | -177.1 | 0 | 0 | 0 | 0 | 109.2 | S159 R163 | S159-V161 PolarHBondContact O-N 3.08Å; S159-V161 VanDerWaalsContact O-N 3.15Å; V161-R163 PolarHBondContact O-N 2.98Å |
| 162 | P | 72.7 | Confident | 70.9 | Confident | 109 Ų | 109 | 130.3 Ų | 130.3 | 71% | 0.708 | 70% | 0.702 | S | S | * | * | trans | -66 | 117.5 | 174.8 | 26.7 | -31.7 | 0 | 0 | 0 | 109.2 | K160 F164 | K160-P162 WeakPolarHBondContact O-CD 3.49Å; P162-F164 VanDerWaalsContact C-N 3.31Å | ||
| 163 | R | 72.4 | Confident | 71.6 | Confident | 197 Ų | 197 | 127.4 Ų | 127.4 | 74% | 0.743 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -73.1 | -27.3 | -178.3 | -160.3 | -177.4 | -63.6 | 121.9 | -1 | 112.5 | V161 | V161-R163 PolarHBondContact O-N 2.98Š|
| 164 | F | 76.6 | Confident | 72.3 | Confident | 163 Ų | 163 | 126 Ų | 126 | 72% | 0.715 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -124.1 | 135.4 | 179.9 | -59.1 | -63.9 | 0 | 0 | 0 | 109.5 | P162 | P162-F164 VanDerWaalsContact C-N 3.31Š|
| 165 | L | 71.6 | Confident | 72.7 | Confident | 154 Ų | 154 | 126.4 Ų | 126.4 | 81% | 0.806 | 71% | 0.707 | S | S | * | * | trans | -64.4 | 144.2 | 170.3 | -62.6 | 175.9 | 0 | 0 | 0 | 108.8 | V167 | L165-V167 PolarHBondContact O-N 3.42Š| ||
| 166 | P | 70.9 | Confident | 73.1 | Confident | 108 Ų | 108 | 125.8 Ų | 125.8 | 70% | 0.701 | 71% | 0.707 | S | S | * | * | trans | -55.4 | 128.3 | 172 | 23.8 | -32.2 | 0 | 0 | 0 | 108.4 | S168 | P166-S168 VanDerWaalsContact C-N 3.27Å; P166-S168 PolarHBondContact O-N 3.41Å; P166-S168 PolarHBondContact O-OG 3Å | ||
| 167 | V | 67.1 | Low | 73.7 | Confident | 151 Ų | 151 | 126.2 Ų | 126.2 | 92% | 0.915 | 69% | 0.689 | S | S | * | * | trans | -62.6 | 92.3 | 179 | -179.7 | 0 | 0 | 0 | 0 | 107.7 | L165 | L165-V167 PolarHBondContact O-N 3.42Š| ||
| 168 | S | 67.1 | Low | 74.1 | Confident | 96 Ų | 96 | 124.3 Ų | 124.3 | 67% | 0.671 | 69% | 0.692 | S | S | * | * | trans | -119.6 | 88.2 | 172.6 | 52.4 | 0 | 0 | 0 | 0 | 107 | P166 K170 | P166-S168 VanDerWaalsContact C-N 3.27Å; P166-S168 PolarHBondContact O-N 3.41Å; P166-S168 PolarHBondContact O-OG 3Å; S168-K170 PolarHBondContact O-N 3.23Å; S168-K170 VanDerWaalsContact O-N 3.17Å | ||
| 169 | S | 69.6 | Low | 74.1 | Confident | 83 Ų | 83 | 120.4 Ų | 120.4 | 58% | 0.58 | 69% | 0.694 | S | S | * | * | trans | -70.9 | 106.4 | 172.6 | 173.3 | 0 | 0 | 0 | 0 | 108.1 | T171 | S169-T171 PolarHBondContact O-N 2.8Å; S169-T171 PolarHBondContact OG-N 3.16Å; S169-T171 PolarHBondContact OG-O 3.12Å; S169-T171 PolarHBondContact OG-OG1 3.45Å | ||
| 170 | K | 70.1 | Confident | 73.7 | Confident | 212 Ų | 212 | 122.5 Ų | 122.5 | 92% | 0.922 | 71% | 0.709 | S | S | * | * | trans | -67.6 | -14.3 | 165.8 | -71.2 | 178.7 | 178.1 | 178.8 | 0 | 112 | S168 | S168-K170 PolarHBondContact O-N 3.23Å; S168-K170 VanDerWaalsContact O-N 3.17Å | ||
| 171 | T | 76.4 | Confident | 73.3 | Confident | 92 Ų | 92 | 122.7 Ų | 122.7 | 56% | 0.564 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -75.8 | 120.8 | 172.7 | 22.2 | 0 | 0 | 0 | 0 | 109.4 | S169 | S169-T171 PolarHBondContact O-N 2.8Å; S169-T171 PolarHBondContact OG-N 3.16Å; S169-T171 PolarHBondContact OG-O 3.12Å; S169-T171 PolarHBondContact OG-OG1 3.45Å |
| 172 | P | 81.1 | Confident | 72.7 | Confident | 62 Ų | 62 | 124.6 Ų | 124.6 | 40% | 0.403 | 71% | 0.705 | S | S | . | * | P | Polyproline II helix | trans | -61.2 | 143.7 | 174.6 | 27.7 | -33.5 | 0 | 0 | 0 | 109.1 | A176 Y177 | P172-A176 HydrophobicContact CB-CB 3.78Å; P172-Y177 HydrophobicContact CG-CD1 4.21Å; P172-Y177 HydrophobicContact CG-CE1 3.56Å; P172-Y177 HydrophobicContact CG-CE2 4.11Å |
| 173 | G | 80.4 | Confident | 72.2 | Confident | 39 Ų | 39 | 126.5 Ų | 126.5 | 40% | 0.402 | 70% | 0.702 | S | S | . | * | P | Polyproline II helix | trans | -60.5 | 162.3 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | G175 A176 | G173-G175 PolarHBondContact O-N 3.32Å; G173-A176 WeakPolarHBondContact O-CB 3.31Å; G173-A176 PolarHBondContact O-N 3.16Å |
| 174 | P | 78.8 | Confident | 72 | Confident | 140 Ų | 140 | 123 Ų | 123 | 91% | 0.909 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.6 | 129.2 | 172.3 | 24.6 | -33.3 | 0 | 0 | 0 | 109.8 | ||
| 175 | G | 75.8 | Confident | 71.5 | Confident | 76 Ų | 76 | 122.5 Ų | 122.5 | 78% | 0.784 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 89.1 | -3.5 | -176.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | G173 | G173-G175 PolarHBondContact O-N 3.32Š|
| 176 | A | 81.8 | Confident | 71.6 | Confident | 64 Ų | 64 | 118.3 Ų | 118.3 | 53% | 0.529 | 68% | 0.679 | S | S | . | * | trans | -89.3 | 1.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | P172 G173 | P172-A176 HydrophobicContact CB-CB 3.78Å; G173-A176 WeakPolarHBondContact O-CB 3.31Å; G173-A176 PolarHBondContact O-N 3.16Å | ||
| 177 | Y | 80 | Confident | 72 | Confident | 153 Ų | 153 | 115.8 Ų | 115.8 | 60% | 0.6 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -83.1 | 133.4 | 173.1 | -60.2 | -85.2 | 0 | 0 | 0 | 109.9 | P172 | P172-Y177 HydrophobicContact CG-CD1 4.21Å; P172-Y177 HydrophobicContact CG-CE1 3.56Å; P172-Y177 HydrophobicContact CG-CE2 4.11Å |
| 178 | T | 76.1 | Confident | 72.6 | Confident | 138 Ų | 138 | 112.7 Ų | 112.7 | 85% | 0.847 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 130.2 | 172 | 53.9 | 0 | 0 | 0 | 0 | 109.3 | S180 | T178-S180 PolarHBondContact O-N 2.92Š|
| 179 | S | 65.3 | Low | 73.3 | Confident | 109 Ų | 109 | 113 Ų | 113 | 76% | 0.762 | 65% | 0.647 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 120 | 177.8 | 51.9 | 0 | 0 | 0 | 0 | 109.9 | R181 | S179-R181 PolarHBondContact O-N 3.43Š|
| 180 | S | 65.8 | Low | 73.6 | Confident | 104 Ų | 104 | 112.5 Ų | 112.5 | 73% | 0.727 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 127.7 | 175.8 | 68.6 | 0 | 0 | 0 | 0 | 109.5 | T178 Q182 | T178-S180 PolarHBondContact O-N 2.92Å; S180-Q182 PolarHBondContact O-N 2.93Å |
| 181 | R | 64.8 | Low | 74.1 | Confident | 216 Ų | 216 | 104 Ų | 104 | 82% | 0.815 | 61% | 0.607 | S | S | * | * | trans | -71.2 | 95.2 | 174.8 | -75.7 | -172.5 | 177.6 | -141.3 | -1.8 | 108.5 | S179 F183 | S179-R181 PolarHBondContact O-N 3.43Å; R181-F183 HydrophobicContact CB-CE2 4.49Å | ||
| 182 | Q | 63.1 | Low | 74.3 | Confident | 151 Ų | 151 | 106 Ų | 106 | 71% | 0.706 | 61% | 0.607 | S | S | * | * | trans | -76.6 | 127.1 | 178.6 | -161.2 | 169 | -21.3 | 0 | 0 | 110.3 | S180 | S180-Q182 PolarHBondContact O-N 2.93Š| ||
| 183 | F | 61.9 | Low | 74.4 | Confident | 148 Ų | 148 | 107.2 Ų | 107.2 | 65% | 0.649 | 61% | 0.609 | S | S | * | * | S | Bend | trans | -105.5 | 146.8 | 166.5 | -71.2 | -88.4 | 0 | 0 | 0 | 108 | R181 | R181-F183 HydrophobicContact CB-CE2 4.49Š|
| 184 | P | 66.7 | Low | 74.6 | Confident | 123 Ų | 123 | 105.5 Ų | 105.5 | 80% | 0.799 | 59% | 0.591 | S | S | * | * | S | Bend | cis | -87.7 | 143.7 | 9.8 | 32.6 | -33.5 | 0 | 0 | 0 | 113.8 | Q186 | P184-Q186 PolarHBondContact O-N 3.44Š|
| 185 | K | 67.3 | Low | 74.7 | Confident | 154 Ų | 154 | 106.8 Ų | 106.8 | 67% | 0.67 | 58% | 0.577 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 132.7 | 168.1 | -71.8 | 176.8 | 178.6 | 179.1 | 0 | 108.8 | S187 | K185-S187 PolarHBondContact O-N 3.1Š|
| 186 | Q | 73.4 | Confident | 75.2 | Confident | 65 Ų | 65 | 110.4 Ų | 110.4 | 30% | 0.304 | 57% | 0.574 | S | S | . | * | P | Polyproline II helix | trans | -52.8 | 130.9 | 173.6 | -175.4 | 176.3 | -31 | 0 | 0 | 110 | P184 I190 N203 | P184-Q186 PolarHBondContact O-N 3.44Å; Q186-I190 HydrophobicContact CG-CB 3.99Å; Q186-I190 HydrophobicContact CG-CG2 3.9Å; Q186-N203 PolarHBondContact OE1-ND2 3.12Å |
| 187 | S | 79.9 | Confident | 75.3 | Confident | 56 Ų | 56 | 113.3 Ų | 113.3 | 39% | 0.392 | 58% | 0.577 | S | S | . | * | P | Polyproline II helix | trans | -64.9 | 148.1 | -179.2 | 72.6 | 0 | 0 | 0 | 0 | 110.6 | K185 T189 I190 A191 | K185-S187 PolarHBondContact O-N 3.1Å; S187-T189 PolarHBondContact O-N 3.25Å; S187-I190 PolarHBondContact O-N 3.17Å; S187-I190 VanDerWaalsContact O-N 3.09Å; S187-I190 WeakPolarHBondContact OG-CD1 3.43Å; S187-I190 WeakPolarHBondContact OG-CG1 3.35Å; S187-A191 PolarHBondContact O-N 2.75Å |
| 188 | S | 78.4 | Confident | 75.3 | Confident | 85 Ų | 85 | 110.2 Ų | 110.2 | 59% | 0.594 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -59.4 | -31.6 | -177.5 | 60.2 | 0 | 0 | 0 | 0 | 112.5 | A191 K192 | S188-A191 PolarHBondContact O-N 3.31Å; S188-K192 WeakPolarHBondContact O-CB 3.49Å; S188-K192 WeakPolarHBondContact O-CG 3.5Å; S188-K192 PolarHBondContact O-N 2.92Å |
| 189 | T | 82.7 | Confident | 75.5 | Confident | 104 Ų | 104 | 108.1 Ų | 108.1 | 64% | 0.638 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -61.9 | -48.1 | 174.8 | -49.2 | 0 | 0 | 0 | 0 | 111.6 | S187 A191 K192 M193 | S187-T189 PolarHBondContact O-N 3.25Å; T189-A191 VanDerWaalsContact C-N 3.34Å; T189-K192 PolarHBondContact O-N 3.01Å; T189-M193 WeakPolarHBondContact O-CB 3.43Å; T189-M193 PolarHBondContact O-N 2.9Å |
| 190 | I | 76.8 | Confident | 76 | Confident | 72 Ų | 72 | 110.1 Ų | 110.1 | 37% | 0.369 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -68.4 | -37.3 | 179 | -61.3 | 170.4 | 0 | 0 | 0 | 110.1 | Q186 S187 G194 F201 | Q186-I190 HydrophobicContact CG-CB 3.99Å; Q186-I190 HydrophobicContact CG-CG2 3.9Å; S187-I190 PolarHBondContact O-N 3.17Å; S187-I190 VanDerWaalsContact O-N 3.09Å; S187-I190 WeakPolarHBondContact OG-CD1 3.43Å; S187-I190 WeakPolarHBondContact OG-CG1 3.35Å; I190-G194 PolarHBondContact O-N 2.84Å; I190-F201 HydrophobicContact CG2-CD2 4.3Å; I190-F201 HydrophobicContact CG2-CE2 4.09Å |
| 191 | A | 78.9 | Confident | 76.1 | Confident | 34 Ų | 34 | 110.3 Ų | 110.3 | 28% | 0.281 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67.7 | -31.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | S187 S188 T189 R195 | S187-A191 PolarHBondContact O-N 2.75Å; S188-A191 PolarHBondContact O-N 3.31Å; T189-A191 VanDerWaalsContact C-N 3.34Å; A191-R195 PolarHBondContact O-N 3.24Å |
| 192 | K | 81.1 | Confident | 76.2 | Confident | 133 Ų | 133 | 106.9 Ų | 106.9 | 58% | 0.578 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -71.2 | -51.2 | 172.5 | -77.5 | 177.7 | 178.6 | -177.1 | 0 | 110.7 | S188 T189 G194 R195 E196 | S188-K192 WeakPolarHBondContact O-CB 3.49Å; S188-K192 WeakPolarHBondContact O-CG 3.5Å; S188-K192 PolarHBondContact O-N 2.92Å; T189-K192 PolarHBondContact O-N 3.01Å; K192-G194 PolarHBondContact O-N 3.08Å; K192-R195 PolarHBondContact O-N 3.5Å; K192-E196 WeakPolarHBondContact O-CG 3.5Å; K192-E196 PolarHBondContact O-N 3.35Å |
| 193 | M | 83.8 | Confident | 76.1 | Confident | 88 Ų | 88 | 104.8 Ų | 104.8 | 43% | 0.433 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -55.7 | -39.5 | 177.7 | -172.9 | -108.2 | -80 | 0 | 0 | 111.9 | T189 H197 | T189-M193 WeakPolarHBondContact O-CB 3.43Å; T189-M193 PolarHBondContact O-N 2.9Å; M193-H197 PolarHBondContact O-CD2 3.46Å; M193-H197 VanDerWaalsContact O-CD2 3.26Å; M193-H197 PolarHBondContact O-N 2.94Å |
| 194 | G | 83.7 | Confident | 75.7 | Confident | 2 Ų | 2 | 103.3 Ų | 103.3 | 2% | 0.021 | 54% | 0.538 | C | S | . | . | H | α-helix | trans | -62.2 | -41.9 | 173 | 0 | 0 | 0 | 0 | 0 | 114.3 | I190 K192 S198 L199 | I190-G194 PolarHBondContact O-N 2.84Å; K192-G194 PolarHBondContact O-N 3.08Å; G194-S198 CarbonylContact O-C 3.38Å; G194-S198 VanDerWaalsContact O-CA 3.3Å; G194-S198 WeakPolarHBondContact O-CA 3.32Å; G194-S198 PolarHBondContact O-N 3.34Å; G194-L199 CarbonylContact C-O 3.41Å; G194-L199 WeakPolarHBondContact CA-O 3.38Å; G194-L199 PolarHBondContact O-N 3.02Å |
| 195 | R | 81.6 | Confident | 74.9 | Confident | 167 Ų | 167 | 104.6 Ų | 104.6 | 63% | 0.63 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -68.4 | -43.3 | 176.7 | -83.9 | -174.1 | -81.9 | 177.3 | -7.6 | 112.6 | A191 K192 H197 S198 F200 | A191-R195 PolarHBondContact O-N 3.24Å; K192-R195 PolarHBondContact O-N 3.5Å; R195-H197 VanDerWaalsContact C-N 3.29Å; R195-H197 PolarHBondContact O-N 2.93Å; R195-S198 PolarHBondContact O-N 3.37Å; R195-F200 HydrophobicContact CG-CE1 4.35Å |
| 196 | E | 85.5 | Confident | 74 | Confident | 153 Ų | 153 | 100 Ų | 100 | 72% | 0.715 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.3 | -39.4 | 178.3 | -64.2 | -57.8 | 148 | 0 | 0 | 111.7 | K192 | K192-E196 WeakPolarHBondContact O-CG 3.5Å; K192-E196 PolarHBondContact O-N 3.35Å |
| 197 | H | 85.6 | Confident | 72.8 | Confident | 125 Ų | 125 | 109.2 Ų | 109.2 | 58% | 0.579 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.6 | 11.3 | -178.3 | -58.1 | -50.1 | 0 | 0 | 0 | 114 | M193 R195 L199 | M193-H197 PolarHBondContact O-CD2 3.46Å; M193-H197 VanDerWaalsContact O-CD2 3.26Å; M193-H197 PolarHBondContact O-N 2.94Å; R195-H197 VanDerWaalsContact C-N 3.29Å; R195-H197 PolarHBondContact O-N 2.93Å; H197-L199 HydrophobicContact CB-CD1 4.15Å; H197-L199 HydrophobicContact CB-CG 4.09Å; H197-L199 PolarHBondContact O-N 3.21Å; H197-L199 VanDerWaalsContact O-N 3.09Å |
| 198 | S | 79.8 | Confident | 72.5 | Confident | 88 Ų | 88 | 111.9 Ų | 111.9 | 62% | 0.615 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 52.5 | 27.3 | -175.3 | -56.1 | 0 | 0 | 0 | 0 | 114.5 | G194 R195 | G194-S198 CarbonylContact O-C 3.38Å; G194-S198 VanDerWaalsContact O-CA 3.3Å; G194-S198 WeakPolarHBondContact O-CA 3.32Å; G194-S198 PolarHBondContact O-N 3.34Å; R195-S198 PolarHBondContact O-N 3.37Å |
| 199 | L | 79.8 | Confident | 72.1 | Confident | 93 Ų | 93 | 113.3 Ų | 113.3 | 49% | 0.487 | 58% | 0.581 | S | S | . | * | trans | -92.8 | 96.3 | 173.9 | -60.6 | 176.1 | 0 | 0 | 0 | 109.3 | G194 H197 | G194-L199 CarbonylContact C-O 3.41Å; G194-L199 WeakPolarHBondContact CA-O 3.38Å; G194-L199 PolarHBondContact O-N 3.02Å; H197-L199 HydrophobicContact CB-CD1 4.15Å; H197-L199 HydrophobicContact CB-CG 4.09Å; H197-L199 PolarHBondContact O-N 3.21Å; H197-L199 VanDerWaalsContact O-N 3.09Å | ||
| 200 | F | 75 | Confident | 71.6 | Confident | 152 Ų | 152 | 113.8 Ų | 113.8 | 67% | 0.667 | 58% | 0.578 | S | S | * | * | trans | -91.9 | 111.4 | 175.9 | -59.7 | -79.2 | 0 | 0 | 0 | 110 | R195 | R195-F200 HydrophobicContact CG-CE1 4.35Š| ||
| 201 | F | 69 | Low | 71.3 | Confident | 107 Ų | 107 | 116.3 Ų | 116.3 | 47% | 0.469 | 59% | 0.591 | S | S | . | * | trans | -82.4 | 117.2 | 171 | -60.6 | -77.7 | 0 | 0 | 0 | 109 | I190 N203 | I190-F201 HydrophobicContact CG2-CD2 4.3Å; I190-F201 HydrophobicContact CG2-CE2 4.09Å; F201-N203 PolarHBondContact O-N 3.37Å | ||
| 202 | N | 65.7 | Low | 70.8 | Confident | 145 Ų | 145 | 121.4 Ų | 121.4 | 78% | 0.775 | 61% | 0.61 | S | S | * | * | trans | -74 | 72.6 | 171.9 | -69.8 | -53.4 | 0 | 0 | 0 | 109.9 | T204 | N202-T204 PolarHBondContact O-N 2.92Š| ||
| 203 | N | 61.6 | Low | 70.1 | Confident | 107 Ų | 107 | 120.7 Ų | 120.7 | 57% | 0.572 | 61% | 0.612 | S | S | * | * | trans | -81.8 | 20.4 | 171.7 | -78.1 | -53.9 | 0 | 0 | 0 | 113 | Q186 F201 | Q186-N203 PolarHBondContact OE1-ND2 3.12Å; F201-N203 PolarHBondContact O-N 3.37Å | ||
| 204 | T | 54.3 | Low | 69.1 | Low | 116 Ų | 116 | 123 Ų | 123 | 71% | 0.712 | 63% | 0.625 | S | S | * | * | trans | -136.7 | 98 | 174.7 | 13.1 | 0 | 0 | 0 | 0 | 106.3 | N202 G206 | N202-T204 PolarHBondContact O-N 2.92Å; T204-G206 PolarHBondContact O-N 3.5Å | ||
| 205 | I | 49.9 | Very low | 68 | Low | 151 Ų | 151 | 132.3 Ų | 132.3 | 77% | 0.774 | 67% | 0.671 | S | S | * | * | trans | -69.3 | 94.5 | 156.4 | -73.4 | 160.2 | 0 | 0 | 0 | 104.6 | F207 | I205-F207 HydrophobicContact CG2-CD2 4.46Å; I205-F207 HydrophobicContact CG2-CE2 4.23Å | ||
| 206 | G | 47.9 | Very low | 66.9 | Low | 58 Ų | 58 | 129.4 Ų | 129.4 | 60% | 0.598 | 68% | 0.675 | S | S | * | * | trans | -70.7 | 131.4 | 169.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | T204 | T204-G206 PolarHBondContact O-N 3.5Š| ||
| 207 | F | 48.3 | Very low | 65.2 | Low | 258 Ų | 258 | 127.3 Ų | 127.3 | 100% | 1.132 | 67% | 0.671 | S | S | * | * | trans | -119.8 | 0 | 137.5 | -71.2 | -73 | 0 | 0 | 0 | 106.8 | I205 | I205-F207 HydrophobicContact CG2-CD2 4.46Å; I205-F207 HydrophobicContact CG2-CE2 4.23Å |
Retrieved 207 of 207 residues in 108.6 ms
(Link to these results)