| 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 | 37.7 | Very low | 39.4 | Very low | 243 Ų | 243 | 175.4 Ų | 175.4 | 100% | 1.197 | 83% | 0.826 | S | S | * | * | 0 | 120.7 | 0 | -172.7 | 136.9 | 76.7 | 0 | 0 | 107.9 | |||||
| 2 | N | 37 | Very low | 39.3 | Very low | 152 Ų | 152 | 174 Ų | 174 | 81% | 0.813 | 82% | 0.815 | S | S | * | * | trans | -84.7 | 148.9 | -176.9 | -89.6 | -11.1 | 0 | 0 | 0 | 112.2 | ||||
| 3 | R | 38 | Very low | 39.3 | Very low | 241 Ų | 241 | 169.3 Ų | 169.3 | 91% | 0.909 | 81% | 0.805 | S | S | * | * | trans | -162.5 | 86.7 | 155.1 | -109.4 | 164.7 | -160.8 | -171 | 4.9 | 113.8 | ||||
| 4 | N | 35.3 | Very low | 39.1 | Very low | 152 Ų | 152 | 167.4 Ų | 167.4 | 81% | 0.813 | 80% | 0.802 | S | S | * | * | trans | 45.5 | 137.8 | 135.9 | -58 | -0.7 | 0 | 0 | 0 | 123.6 | ||||
| 5 | I | 45.1 | Very low | 38.7 | Very low | 156 Ų | 156 | 160.5 Ų | 160.5 | 80% | 0.8 | 79% | 0.792 | S | S | * | * | trans | -90.9 | 157 | 170.6 | -38.7 | 165.5 | 0 | 0 | 0 | 109.8 | ||||
| 6 | P | 48.3 | Very low | 38.5 | Very low | 123 Ų | 123 | 162.1 Ų | 162.1 | 80% | 0.799 | 80% | 0.797 | S | S | * | * | -138.1 | 140.5 | 118.1 | 36.6 | -25.7 | 0 | 0 | 0 | 112.6 | |||||
| 7 | R | 39.3 | Very low | 39.3 | Very low | 229 Ų | 229 | 158.4 Ų | 158.4 | 86% | 0.864 | 79% | 0.788 | S | S | * | * | cis | 96.8 | 96.5 | 24.7 | -165.1 | -169.6 | -159.7 | -166.4 | 9 | 115.2 | ||||
| 8 | K | 39.4 | Very low | 39.2 | Very low | 208 Ų | 208 | 159.3 Ų | 159.3 | 90% | 0.904 | 79% | 0.789 | S | S | * | * | trans | -159.6 | 128.5 | 150.1 | -93.2 | 175.1 | -178.9 | 179.3 | 0 | 106.2 | ||||
| 9 | R | 39.3 | Very low | 39.1 | Very low | 213 Ų | 213 | 161.4 Ų | 161.4 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | cis | 92.1 | 103.2 | 20.7 | -166 | -168.6 | -170.6 | -172.9 | 5.1 | 115.1 | ||||
| 10 | S | 35.2 | Very low | 38.6 | Very low | 82 Ų | 82 | 156.6 Ų | 156.6 | 57% | 0.573 | 79% | 0.79 | S | S | * | * | -174.8 | 122.9 | 114.2 | -97.8 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 11 | E | 39.1 | Very low | 38.3 | Very low | 130 Ų | 130 | 156.9 Ų | 156.9 | 61% | 0.607 | 79% | 0.794 | S | S | * | * | 87.3 | 145.1 | 99.4 | -72.5 | -179.9 | 100 | 0 | 0 | 113.1 | |||||
| 12 | K | 38 | Very low | 38.4 | Very low | 159 Ų | 159 | 154.3 Ų | 154.3 | 69% | 0.691 | 78% | 0.779 | S | S | * | * | cis | -162.6 | 153.1 | 7.9 | -131.2 | 171.9 | 175 | 140.4 | 0 | 112.8 | ||||
| 13 | V | 39.7 | Very low | 38.7 | Very low | 113 Ų | 113 | 152.2 Ų | 152.2 | 69% | 0.685 | 77% | 0.774 | S | S | * | * | trans | 52.1 | 141 | 132.7 | 154.5 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 14 | N | 36.1 | Very low | 38.5 | Very low | 143 Ų | 143 | 146.6 Ų | 146.6 | 77% | 0.765 | 77% | 0.767 | S | S | * | * | cis | -160.8 | 169.7 | -7.6 | -104.6 | 0.6 | 0 | 0 | 0 | 108.3 | ||||
| 15 | G | 32.8 | Very low | 38.4 | Very low | 64 Ų | 64 | 145.6 Ų | 145.6 | 66% | 0.66 | 77% | 0.766 | S | S | * | * | cis | 155.3 | 140.6 | -11.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 16 | Q | 35.1 | Very low | 37.9 | Very low | 186 Ų | 186 | 142.9 Ų | 142.9 | 87% | 0.869 | 76% | 0.76 | S | S | * | * | trans | 69.4 | 164 | 137.3 | -89.1 | -159.7 | -97.9 | 0 | 0 | 122.2 | ||||
| 17 | P | 53.2 | Low | 37.3 | Very low | 98 Ų | 98 | 141.4 Ų | 141.4 | 64% | 0.636 | 75% | 0.753 | S | S | * | * | trans | -142 | -152.1 | -134 | 37.4 | -10.6 | 0 | 0 | 0 | 115.5 | ||||
| 18 | E | 36.8 | Very low | 37.4 | Very low | 175 Ų | 175 | 137.7 Ų | 137.7 | 82% | 0.818 | 75% | 0.75 | S | S | * | * | trans | 98 | 130.3 | 156.5 | -46.2 | -145.1 | 122.2 | 0 | 0 | 120 | ||||
| 19 | E | 37.6 | Very low | 37.6 | Very low | 200 Ų | 200 | 135 Ų | 135 | 94% | 0.935 | 75% | 0.745 | S | S | * | * | trans | 41.8 | 127.9 | 138.2 | -154.5 | 160.7 | -119 | 0 | 0 | 122 | ||||
| 20 | G | 29.8 | Very low | 37.3 | Very low | 64 Ų | 64 | 130.5 Ų | 130.5 | 66% | 0.66 | 75% | 0.745 | S | S | * | * | trans | 179 | 133.5 | 168.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 21 | D | 31.5 | Very low | 37.6 | Very low | 164 Ų | 164 | 132.7 Ų | 132.7 | 88% | 0.877 | 76% | 0.761 | S | S | * | * | trans | 58.4 | 93.2 | 154.4 | -53 | -18.4 | 0 | 0 | 0 | 121.6 | ||||
| 22 | E | 39.7 | Very low | 37.5 | Very low | 188 Ų | 188 | 131.5 Ų | 131.5 | 88% | 0.879 | 77% | 0.767 | S | S | * | * | trans | -84.8 | 152.7 | 134.1 | -82.7 | -154.6 | 138.7 | 0 | 0 | 109.2 | ||||
| 23 | P | 43.1 | Very low | 37.8 | Very low | 108 Ų | 108 | 131.4 Ų | 131.4 | 70% | 0.701 | 77% | 0.774 | S | S | * | * | -152.3 | 162.9 | 99.8 | 40.5 | -24.1 | 0 | 0 | 0 | 116.4 | |||||
| 24 | T | 33.5 | Very low | 37.5 | Very low | 124 Ų | 124 | 131.2 Ų | 131.2 | 76% | 0.761 | 78% | 0.778 | S | S | * | * | trans | 61.3 | 112.6 | 136.8 | -71.5 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 25 | V | 33.1 | Very low | 37.8 | Very low | 131 Ų | 131 | 128.9 Ų | 128.9 | 79% | 0.794 | 77% | 0.768 | S | S | * | * | cis | -162.2 | -173.9 | -4.1 | -118.4 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 26 | S | 35.8 | Very low | 37.7 | Very low | 98 Ų | 98 | 131.3 Ų | 131.3 | 69% | 0.685 | 78% | 0.775 | S | S | * | * | cis | -156.3 | 146.5 | 17.5 | -150.1 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 27 | S | 35.9 | Very low | 38 | Very low | 92 Ų | 92 | 130.1 Ų | 130.1 | 64% | 0.643 | 77% | 0.769 | S | S | * | * | trans | 30.1 | 116.1 | 136.5 | -52.6 | 0 | 0 | 0 | 0 | 123 | ||||
| 28 | L | 40.7 | Very low | 37 | Very low | 152 Ų | 152 | 133 Ų | 133 | 80% | 0.796 | 77% | 0.774 | S | S | * | * | 62.3 | 129.6 | 123.8 | -59.7 | 171.9 | 0 | 0 | 0 | 121.9 | |||||
| 29 | L | 43.5 | Very low | 37.2 | Very low | 152 Ų | 152 | 129.9 Ų | 129.9 | 80% | 0.796 | 77% | 0.772 | S | S | * | * | trans | 38 | 114.7 | 150.4 | -75.3 | 81.6 | 0 | 0 | 0 | 119.2 | ||||
| 30 | S | 32.5 | Very low | 37 | Very low | 117 Ų | 117 | 125.9 Ų | 125.9 | 82% | 0.818 | 76% | 0.757 | S | S | * | * | -155.6 | 137 | 124.2 | -85.5 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 31 | S | 42.4 | Very low | 37.8 | Very low | 129 Ų | 129 | 128.8 Ų | 128.8 | 90% | 0.902 | 77% | 0.767 | S | S | * | * | trans | -76 | 121.4 | 171.8 | -62.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 32 | S | 36.7 | Very low | 38.3 | Very low | 104 Ų | 104 | 126 Ų | 126 | 73% | 0.727 | 76% | 0.756 | S | S | * | * | trans | -130 | 90.6 | 173.8 | -66.2 | 0 | 0 | 0 | 0 | 110.4 | S34 | S32-S34 PolarHBondContact O-N 2.86Š| ||
| 33 | N | 43.8 | Very low | 38.8 | Very low | 158 Ų | 158 | 124.4 Ų | 124.4 | 85% | 0.845 | 75% | 0.753 | S | S | * | * | trans | -68.5 | 94.6 | 168.6 | -106.4 | -4.9 | 0 | 0 | 0 | 109.4 | T35 | N33-T35 VanDerWaalsContact C-N 3.3Å; N33-T35 PolarHBondContact O-N 2.81Å | ||
| 34 | S | 34 | Very low | 39.2 | Very low | 109 Ų | 109 | 129.6 Ų | 129.6 | 76% | 0.762 | 76% | 0.759 | S | S | * | * | trans | -87.6 | 70.2 | 165.9 | 47.3 | 0 | 0 | 0 | 0 | 110.1 | S32 S36 | S32-S34 PolarHBondContact O-N 2.86Å; S34-S36 VanDerWaalsContact C-N 3.32Å; S34-S36 PolarHBondContact O-N 2.9Å | ||
| 35 | T | 43 | Very low | 40.2 | Very low | 93 Ų | 93 | 134.7 Ų | 134.7 | 57% | 0.571 | 76% | 0.764 | S | S | * | * | trans | -65.7 | 88.8 | 173.2 | 49 | 0 | 0 | 0 | 0 | 110.8 | N33 H37 | N33-T35 VanDerWaalsContact C-N 3.3Å; N33-T35 PolarHBondContact O-N 2.81Å; T35-H37 PolarHBondContact O-N 3.2Å | ||
| 36 | S | 30.2 | Very low | 41.4 | Very low | 115 Ų | 115 | 134.3 Ų | 134.3 | 80% | 0.804 | 76% | 0.756 | S | S | * | * | trans | -71.6 | 75 | 173.6 | 47.4 | 0 | 0 | 0 | 0 | 110.9 | S34 H38 | S34-S36 VanDerWaalsContact C-N 3.32Å; S34-S36 PolarHBondContact O-N 2.9Å; S36-H38 PolarHBondContact O-N 3.34Å | ||
| 37 | H | 41.8 | Very low | 42.6 | Very low | 161 Ų | 161 | 133 Ų | 133 | 75% | 0.745 | 75% | 0.745 | S | S | * | * | trans | -65.3 | 79.7 | 171.2 | -81.4 | -82.5 | 0 | 0 | 0 | 111.1 | T35 S39 | T35-H37 PolarHBondContact O-N 3.2Å; H37-S39 PolarHBondContact O-N 3.2Å | ||
| 38 | H | 31.3 | Very low | 43.6 | Very low | 159 Ų | 159 | 135.6 Ų | 135.6 | 74% | 0.736 | 75% | 0.75 | S | S | * | * | trans | -89 | 81.8 | 167.7 | -147.7 | 55.4 | 0 | 0 | 0 | 109.6 | S36 N40 | S36-H38 PolarHBondContact O-N 3.34Å; H38-N40 PolarHBondContact O-N 3.47Å | ||
| 39 | S | 40.5 | Very low | 44.4 | Very low | 110 Ų | 110 | 135.7 Ų | 135.7 | 77% | 0.769 | 75% | 0.749 | S | S | * | * | trans | -72.6 | 67 | -177.8 | 56.3 | 0 | 0 | 0 | 0 | 112.4 | H37 S41 | H37-S39 PolarHBondContact O-N 3.2Å; S39-S41 PolarHBondContact O-N 3.06Å | ||
| 40 | N | 34.2 | Very low | 45 | Very low | 115 Ų | 115 | 131.2 Ų | 131.2 | 62% | 0.615 | 73% | 0.726 | S | S | * | * | trans | -69.7 | 98.4 | 171.9 | -86.2 | -22.3 | 0 | 0 | 0 | 110.1 | H38 T42 | H38-N40 PolarHBondContact O-N 3.47Å; N40-T42 VanDerWaalsContact C-N 3.25Å; N40-T42 PolarHBondContact O-N 3.2Å | ||
| 41 | S | 47.5 | Very low | 46.2 | Very low | 125 Ų | 125 | 132.5 Ų | 132.5 | 87% | 0.874 | 72% | 0.717 | S | S | * | * | trans | -72.7 | 73.6 | 177.4 | -170.4 | 0 | 0 | 0 | 0 | 111.4 | S39 | S39-S41 PolarHBondContact O-N 3.06Š| ||
| 42 | T | 41.3 | Very low | 46.9 | Very low | 107 Ų | 107 | 134.4 Ų | 134.4 | 66% | 0.656 | 71% | 0.709 | S | S | * | * | trans | -101.7 | 75.6 | 176 | 47.4 | 0 | 0 | 0 | 0 | 111.3 | N40 R44 | N40-T42 VanDerWaalsContact C-N 3.25Å; N40-T42 PolarHBondContact O-N 3.2Å; T42-R44 PolarHBondContact O-N 3.32Å | ||
| 43 | N | 50.2 | Low | 47.5 | Very low | 153 Ų | 153 | 132.4 Ų | 132.4 | 82% | 0.818 | 69% | 0.69 | S | S | * | * | trans | 17.1 | 69.4 | 155.3 | -163.4 | -10 | 0 | 0 | 0 | 115.6 | R45 | N43-R45 PolarHBondContact O-N 2.65Š| ||
| 44 | R | 51 | Low | 48 | Very low | 218 Ų | 218 | 130 Ų | 130 | 82% | 0.823 | 68% | 0.681 | S | S | * | * | trans | -74.2 | 96.8 | 179.2 | -79.5 | -173.4 | 173.4 | 171.5 | -2.6 | 109.6 | T42 I46 | T42-R44 PolarHBondContact O-N 3.32Å; R44-I46 VanDerWaalsContact C-N 3.32Å; R44-I46 WeakPolarHBondContact O-CG1 3.25Å; R44-I46 PolarHBondContact O-N 2.88Å | ||
| 45 | R | 54 | Low | 49.1 | Very low | 231 Ų | 231 | 133.3 Ų | 133.3 | 87% | 0.872 | 68% | 0.677 | S | S | * | * | trans | -62.8 | 90.5 | 169.8 | -158.8 | -178.9 | -158.7 | -178.8 | 6.5 | 108.9 | N43 T47 | N43-R45 PolarHBondContact O-N 2.65Å; R45-T47 PolarHBondContact O-N 2.9Å | ||
| 46 | I | 59.3 | Low | 49.5 | Very low | 122 Ų | 122 | 134.1 Ų | 134.1 | 63% | 0.626 | 67% | 0.672 | S | S | * | * | trans | -56.7 | 122.5 | -174.9 | -52.3 | 179 | 0 | 0 | 0 | 108.9 | R44 D50 F51 | R44-I46 VanDerWaalsContact C-N 3.32Å; R44-I46 WeakPolarHBondContact O-CG1 3.25Å; R44-I46 PolarHBondContact O-N 2.88Å; I46-D50 HydrophobicContact CG2-CB 4.02Å; I46-F51 HydrophobicContact CG2-CD2 4.33Å; I46-F51 HydrophobicContact CG2-CE2 3.6Å; I46-F51 HydrophobicContact CG2-CZ 4.09Å | ||
| 47 | T | 60.4 | Low | 50.4 | Low | 72 Ų | 72 | 136 Ų | 136 | 44% | 0.442 | 67% | 0.666 | S | S | . | * | trans | -93.7 | 157.3 | 178 | 68.9 | 0 | 0 | 0 | 0 | 110.2 | R45 M49 D50 | R45-T47 PolarHBondContact O-N 2.9Å; T47-M49 PolarHBondContact O-N 2.98Å; T47-M49 VanDerWaalsContact O-N 3.13Å; T47-D50 PolarHBondContact N-OD2 2.77Å; T47-D50 WeakPolarHBondContact O-CB 3.44Å; T47-D50 PolarHBondContact O-N 3.01Å; T47-D50 PolarHBondContact OG1-OD2 3.28Å | ||
| 48 | L | 58.2 | Low | 50.8 | Low | 145 Ų | 145 | 135.6 Ų | 135.6 | 76% | 0.759 | 66% | 0.664 | S | S | * | * | G | 310 helix | trans | -59.9 | -23.7 | 173.9 | -80.2 | 168.2 | 0 | 0 | 0 | 112.6 | D50 F51 F52 | L48-D50 VanDerWaalsContact C-N 3.33Å; L48-D50 PolarHBondContact O-N 3.05Å; L48-F51 PolarHBondContact O-N 3.48Å; L48-F52 WeakPolarHBondContact O-CD2 3.44Å |
| 49 | M | 56.1 | Low | 51.6 | Low | 154 Ų | 154 | 132.8 Ų | 132.8 | 76% | 0.759 | 66% | 0.663 | S | S | * | * | G | 310 helix | trans | -67.1 | -32 | 175.5 | -150.1 | 78.5 | 79.5 | 0 | 0 | 112.6 | T47 F51 F52 | T47-M49 PolarHBondContact O-N 2.98Å; T47-M49 VanDerWaalsContact O-N 3.13Å; M49-F51 PolarHBondContact O-N 2.95Å; M49-F52 PolarHBondContact O-N 3.11Å; M49-F52 VanDerWaalsContact O-N 3.13Å |
| 50 | D | 56.8 | Low | 52 | Low | 59 Ų | 59 | 132.4 Ų | 132.4 | 32% | 0.316 | 66% | 0.66 | S | S | . | * | G | 310 helix | trans | -63.2 | -20.9 | 179.4 | -76.5 | -85.4 | 0 | 0 | 0 | 113.6 | I46 T47 L48 K56 | I46-D50 HydrophobicContact CG2-CB 4.02Å; T47-D50 PolarHBondContact N-OD2 2.77Å; T47-D50 WeakPolarHBondContact O-CB 3.44Å; T47-D50 PolarHBondContact O-N 3.01Å; T47-D50 PolarHBondContact OG1-OD2 3.28Å; L48-D50 VanDerWaalsContact C-N 3.33Å; L48-D50 PolarHBondContact O-N 3.05Å; D50-K56 IonicContact OD1-NZ 2.65Å; D50-K56 PolarHBondContact OD1-NZ 3.31Å |
| 51 | F | 57.5 | Low | 52.5 | Low | 143 Ų | 143 | 134.5 Ų | 134.5 | 63% | 0.627 | 67% | 0.666 | S | S | * | * | G | 310 helix | trans | -83 | -13.6 | 178.3 | -70.6 | -87.2 | 0 | 0 | 0 | 113.5 | I46 L48 M49 | I46-F51 HydrophobicContact CG2-CD2 4.33Å; I46-F51 HydrophobicContact CG2-CE2 3.6Å; I46-F51 HydrophobicContact CG2-CZ 4.09Å; L48-F51 PolarHBondContact O-N 3.48Å; M49-F51 PolarHBondContact O-N 2.95Å |
| 52 | F | 56.8 | Low | 52.4 | Low | 170 Ų | 170 | 138.3 Ų | 138.3 | 75% | 0.746 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.8 | -9.9 | -178 | -73.2 | -83.3 | 0 | 0 | 0 | 114.3 | L48 M49 V54 | L48-F52 WeakPolarHBondContact O-CD2 3.44Å; M49-F52 PolarHBondContact O-N 3.11Å; M49-F52 VanDerWaalsContact O-N 3.13Å; F52-V54 PolarHBondContact O-N 3.36Å |
| 53 | D | 50.3 | Low | 52.7 | Low | 62 Ų | 62 | 139.4 Ų | 139.4 | 33% | 0.332 | 66% | 0.663 | S | S | . | * | trans | -80.6 | 85.9 | 175.5 | -162 | -12.7 | 0 | 0 | 0 | 111.7 | R55 K56 | D53-R55 PolarHBondContact O-N 3.23Å; D53-R55 WeakPolarHBondContact OD1-CB 3.35Å; D53-R55 IonicContact OD1-CZ 3.71Å; D53-R55 PolarHBondContact OD1-N 3.01Å; D53-R55 IonicContact OD1-NE 3.64Å; D53-R55 PolarHBondContact OD1-NE 3.26Å; D53-R55 IonicContact OD1-NH2 2.9Å; D53-R55 PolarHBondContact OD1-NH2 3.21Å; D53-R55 IonicContact OD2-CZ 3.32Å; D53-R55 IonicContact OD2-NE 3.17Å; D53-R55 IonicContact OD2-NH2 2.67Å; D53-R55 PolarHBondContact OD2-NH2 3.35Å; D53-K56 WeakPolarHBondContact O-CB 3.44Å; D53-K56 PolarHBondContact O-N 3.35Å | ||
| 54 | V | 53.9 | Low | 52.2 | Low | 106 Ų | 106 | 141.1 Ų | 141.1 | 64% | 0.642 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51 | -28.9 | 179.1 | -177.3 | 0 | 0 | 0 | 0 | 112.9 | F52 K56 F57 | F52-V54 PolarHBondContact O-N 3.36Å; V54-K56 PolarHBondContact O-N 3.36Å; V54-F57 PolarHBondContact O-N 3Å; V54-F57 VanDerWaalsContact O-N 3.1Å |
| 55 | R | 55.6 | Low | 51.7 | Low | 180 Ų | 180 | 136.6 Ų | 136.6 | 68% | 0.679 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -64.4 | -22.7 | -179.9 | -60.6 | 173.5 | -65 | -177.3 | 4.8 | 112.8 | D53 F57 | D53-R55 PolarHBondContact O-N 3.23Å; D53-R55 WeakPolarHBondContact OD1-CB 3.35Å; D53-R55 IonicContact OD1-CZ 3.71Å; D53-R55 PolarHBondContact OD1-N 3.01Å; D53-R55 IonicContact OD1-NE 3.64Å; D53-R55 PolarHBondContact OD1-NE 3.26Å; D53-R55 IonicContact OD1-NH2 2.9Å; D53-R55 PolarHBondContact OD1-NH2 3.21Å; D53-R55 IonicContact OD2-CZ 3.32Å; D53-R55 IonicContact OD2-NE 3.17Å; D53-R55 IonicContact OD2-NH2 2.67Å; D53-R55 PolarHBondContact OD2-NH2 3.35Å; R55-F57 VanDerWaalsContact C-N 3.26Å; R55-F57 PolarHBondContact O-N 3.49Å |
| 56 | K | 53 | Low | 51.3 | Low | 109 Ų | 109 | 132.4 Ų | 132.4 | 47% | 0.474 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -71.8 | -18.2 | 177.5 | -154.3 | 174.4 | -176 | -176.3 | 0 | 113.1 | D50 D53 V54 | D50-K56 IonicContact OD1-NZ 2.65Å; D50-K56 PolarHBondContact OD1-NZ 3.31Å; D53-K56 WeakPolarHBondContact O-CB 3.44Å; D53-K56 PolarHBondContact O-N 3.35Å; V54-K56 PolarHBondContact O-N 3.36Å |
| 57 | F | 49.3 | Very low | 50.5 | Low | 154 Ų | 154 | 132.8 Ų | 132.8 | 68% | 0.675 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -95.1 | -26.3 | 176.2 | -77 | -87.1 | 0 | 0 | 0 | 113.5 | V54 R55 S59 | V54-F57 PolarHBondContact O-N 3Å; V54-F57 VanDerWaalsContact O-N 3.1Å; R55-F57 VanDerWaalsContact C-N 3.26Å; R55-F57 PolarHBondContact O-N 3.49Å; F57-S59 PolarHBondContact O-N 3.07Å |
| 58 | Q | 48.9 | Very low | 49.6 | Very low | 153 Ų | 153 | 135.7 Ų | 135.7 | 72% | 0.715 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -71.5 | -25.5 | -178.3 | -76.3 | -170.4 | -50 | 0 | 0 | 114.2 | S60 | Q58-S60 PolarHBondContact O-N 3.18Å; Q58-S60 VanDerWaalsContact O-N 3.17Å |
| 59 | S | 48.8 | Very low | 49.1 | Very low | 101 Ų | 101 | 133 Ų | 133 | 71% | 0.706 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.4 | -0.4 | -175.3 | 56.1 | 0 | 0 | 0 | 0 | 115.4 | F57 | F57-S59 PolarHBondContact O-N 3.07Š|
| 60 | S | 48.3 | Very low | 48.7 | Very low | 102 Ų | 102 | 136.9 Ų | 136.9 | 71% | 0.713 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121 | 10.1 | -174.4 | -164.9 | 0 | 0 | 0 | 0 | 115.3 | Q58 | Q58-S60 PolarHBondContact O-N 3.18Å; Q58-S60 VanDerWaalsContact O-N 3.17Å |
| 61 | H | 45 | Very low | 48.1 | Very low | 158 Ų | 158 | 140.1 Ų | 140.1 | 73% | 0.731 | 71% | 0.706 | S | S | * | * | trans | -107.8 | 83.1 | 166.2 | -95.7 | -77.6 | 0 | 0 | 0 | 110.4 | ||||
| 62 | R | 46.5 | Very low | 47.5 | Very low | 205 Ų | 205 | 140.7 Ų | 140.7 | 77% | 0.774 | 71% | 0.711 | S | S | * | * | trans | -79.7 | 136.7 | 165.8 | -82 | -168.4 | -173.1 | -110.6 | 8.9 | 110.7 | F64 | R62-F64 PolarHBondContact O-N 2.69Š| ||
| 63 | D | 47.3 | Very low | 47.1 | Very low | 131 Ų | 131 | 138 Ų | 138 | 70% | 0.701 | 71% | 0.708 | S | S | * | * | trans | 50.2 | 61.5 | 132.3 | -42.3 | -30.4 | 0 | 0 | 0 | 116.6 | ||||
| 64 | F | 39.2 | Very low | 47.1 | Very low | 189 Ų | 189 | 139.6 Ų | 139.6 | 83% | 0.829 | 72% | 0.72 | S | S | * | * | trans | -102.7 | 108.7 | 158 | -142.8 | -89.1 | 0 | 0 | 0 | 110.1 | R62 V66 | R62-F64 PolarHBondContact O-N 2.69Å; F64-V66 PolarHBondContact O-N 3.18Å | ||
| 65 | V | 40 | Very low | 46.9 | Very low | 122 Ų | 122 | 136.8 Ų | 136.8 | 74% | 0.739 | 71% | 0.705 | S | S | * | * | trans | -63.8 | 127 | -179.3 | 174.5 | 0 | 0 | 0 | 0 | 109.7 | N67 | V65-N67 PolarHBondContact O-N 3.04Š| ||
| 66 | V | 45.9 | Very low | 46.6 | Very low | 144 Ų | 144 | 132.1 Ų | 132.1 | 87% | 0.873 | 70% | 0.696 | S | S | * | * | trans | -72.7 | 99.9 | 172 | 179.5 | 0 | 0 | 0 | 0 | 108.6 | F64 | F64-V66 PolarHBondContact O-N 3.18Š| ||
| 67 | N | 41.7 | Very low | 46.6 | Very low | 129 Ų | 129 | 130.3 Ų | 130.3 | 69% | 0.69 | 70% | 0.697 | S | S | * | * | trans | -126.2 | 150.3 | 162.3 | -162.5 | 16.4 | 0 | 0 | 0 | 109.5 | V65 | V65-N67 PolarHBondContact O-N 3.04Š| ||
| 68 | D | 42.1 | Very low | 46.8 | Very low | 133 Ų | 133 | 127 Ų | 127 | 71% | 0.711 | 69% | 0.686 | S | S | * | * | S | Bend | trans | 46.7 | 76 | -178.3 | -75 | -44 | 0 | 0 | 0 | 116.8 | R70 | D68-R70 PolarHBondContact O-N 3.38Š|
| 69 | G | 48 | Very low | 47.1 | Very low | 90 Ų | 90 | 127 Ų | 127 | 93% | 0.928 | 68% | 0.681 | S | S | * | * | S | Bend | 49 | 2.7 | 118.5 | 0 | 0 | 0 | 0 | 0 | 122.7 | |||
| 70 | R | 46.9 | Very low | 47.6 | Very low | 235 Ų | 235 | 125.3 Ų | 125.3 | 89% | 0.887 | 67% | 0.669 | S | S | * | * | trans | -137 | -3.7 | -165.9 | -142.6 | 175.1 | -175.7 | -173.3 | 0.3 | 114.6 | D68 H72 | D68-R70 PolarHBondContact O-N 3.38Å; R70-H72 PolarHBondContact O-N 2.83Å | ||
| 71 | L | 46.1 | Very low | 48.1 | Very low | 126 Ų | 126 | 125.9 Ų | 125.9 | 66% | 0.66 | 66% | 0.664 | S | S | * | * | trans | -96.2 | 30.9 | -176.5 | -154.9 | 76.2 | 0 | 0 | 0 | 114.1 | ||||
| 72 | H | 43.7 | Very low | 49 | Very low | 155 Ų | 155 | 123.7 Ų | 123.7 | 72% | 0.718 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -105.8 | 13.7 | -173.8 | -148.8 | -65 | 0 | 0 | 0 | 114.8 | R70 | R70-H72 PolarHBondContact O-N 2.83Š|
| 73 | V | 47.8 | Very low | 49.8 | Very low | 114 Ų | 114 | 117.1 Ų | 117.1 | 69% | 0.691 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -115.8 | -35.7 | -178.7 | -176.2 | 0 | 0 | 0 | 0 | 112.7 | S77 | V73-S77 PolarHBondContact O-OG 3.11Å; V73-S77 VanDerWaalsContact O-OG 3.05Å |
| 74 | V | 50.1 | Low | 50.5 | Low | 95 Ų | 95 | 115 Ų | 115 | 58% | 0.576 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -73.4 | -61.6 | -177.5 | -175.3 | 0 | 0 | 0 | 0 | 110.8 | V76 S77 | V74-V76 VanDerWaalsContact C-N 3.31Å; V74-V76 PolarHBondContact O-N 2.96Å; V74-S77 VanDerWaalsContact O-CB 3.27Å; V74-S77 WeakPolarHBondContact O-CB 3.39Å; V74-S77 PolarHBondContact O-N 3.04Å |
| 75 | S | 50 | Low | 52 | Low | 48 Ų | 48 | 111.4 Ų | 111.4 | 34% | 0.336 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -58 | -35.9 | -173.7 | 50.5 | 0 | 0 | 0 | 0 | 114.7 | S77 D78 Y79 | S75-S77 PolarHBondContact O-N 3.4Å; S75-D78 PolarHBondContact O-N 3.37Å; S75-Y79 WeakPolarHBondContact O-CD2 3.47Å; S75-Y79 PolarHBondContact O-N 2.98Å |
| 76 | V | 50.8 | Low | 53.7 | Low | 81 Ų | 81 | 109.1 Ų | 109.1 | 49% | 0.491 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -63.8 | -30.6 | 177.9 | -173.7 | 0 | 0 | 0 | 0 | 111.5 | V74 S80 | V74-V76 VanDerWaalsContact C-N 3.31Å; V74-V76 PolarHBondContact O-N 2.96Å; V76-S80 WeakPolarHBondContact O-CB 3.28Å; V76-S80 PolarHBondContact O-N 2.66Å |
| 77 | S | 51.4 | Low | 55.3 | Low | 71 Ų | 71 | 106.9 Ų | 106.9 | 50% | 0.497 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -72.3 | -42.9 | 179.5 | -56.3 | 0 | 0 | 0 | 0 | 111.6 | V73 V74 S75 S80 L81 | V73-S77 PolarHBondContact O-OG 3.11Å; V73-S77 VanDerWaalsContact O-OG 3.05Å; V74-S77 VanDerWaalsContact O-CB 3.27Å; V74-S77 WeakPolarHBondContact O-CB 3.39Å; V74-S77 PolarHBondContact O-N 3.04Å; S75-S77 PolarHBondContact O-N 3.4Å; S77-S80 WeakPolarHBondContact O-CB 3.5Å; S77-S80 PolarHBondContact O-N 3.01Å; S77-L81 WeakPolarHBondContact O-CB 3.41Å; S77-L81 PolarHBondContact O-N 3.03Å |
| 78 | D | 54.3 | Low | 57.2 | Low | 84 Ų | 84 | 105.1 Ų | 105.1 | 45% | 0.449 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -68.6 | -43.7 | -175.1 | -61.5 | -44.2 | 0 | 0 | 0 | 112.5 | S75 S80 L81 I82 | S75-D78 PolarHBondContact O-N 3.37Å; D78-S80 VanDerWaalsContact C-N 3.3Å; D78-S80 PolarHBondContact O-N 2.76Å; D78-L81 PolarHBondContact O-N 3.14Å; D78-I82 WeakPolarHBondContact O-CG1 3.37Å; D78-I82 PolarHBondContact O-N 3.41Å |
| 79 | Y | 55.6 | Low | 59 | Low | 153 Ų | 153 | 104.3 Ų | 104.3 | 60% | 0.6 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -65.1 | -34 | 175 | -65.5 | -60.8 | 0 | 0 | 0 | 112.4 | S75 A83 | S75-Y79 WeakPolarHBondContact O-CD2 3.47Å; S75-Y79 PolarHBondContact O-N 2.98Å; Y79-A83 WeakPolarHBondContact O-CB 3.38Å; Y79-A83 PolarHBondContact O-N 3.13Å |
| 80 | S | 58.3 | Low | 60.6 | Low | 66 Ų | 66 | 104 Ų | 104 | 46% | 0.462 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -67.5 | -43.6 | 174.1 | -172.1 | 0 | 0 | 0 | 0 | 111.8 | V76 S77 D78 I82 A83 L84 | V76-S80 WeakPolarHBondContact O-CB 3.28Å; V76-S80 PolarHBondContact O-N 2.66Å; S77-S80 WeakPolarHBondContact O-CB 3.5Å; S77-S80 PolarHBondContact O-N 3.01Å; D78-S80 VanDerWaalsContact C-N 3.3Å; D78-S80 PolarHBondContact O-N 2.76Å; S80-I82 VanDerWaalsContact C-N 3.33Å; S80-I82 PolarHBondContact O-N 3.11Å; S80-A83 PolarHBondContact O-N 3.46Å; S80-A83 VanDerWaalsContact O-N 3.17Å; S80-L84 WeakPolarHBondContact O-CG 3.39Å; S80-L84 PolarHBondContact O-N 3.32Å |
| 81 | L | 60.4 | Low | 62.4 | Low | 115 Ų | 115 | 94.4 Ų | 94.4 | 60% | 0.602 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.2 | -41.5 | 177.2 | -165.1 | 74.3 | 0 | 0 | 0 | 111.8 | S77 D78 L84 L85 | S77-L81 WeakPolarHBondContact O-CB 3.41Å; S77-L81 PolarHBondContact O-N 3.03Å; D78-L81 PolarHBondContact O-N 3.14Å; L81-L84 PolarHBondContact O-N 2.69Å; L81-L85 PolarHBondContact O-N 3.22Å |
| 82 | I | 63.6 | Low | 64.2 | Low | 112 Ų | 112 | 93.3 Ų | 93.3 | 57% | 0.574 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -66.3 | -36.7 | 175.6 | -74.5 | 165.8 | 0 | 0 | 0 | 111.8 | D78 S80 L84 L85 P86 | D78-I82 WeakPolarHBondContact O-CG1 3.37Å; D78-I82 PolarHBondContact O-N 3.41Å; S80-I82 VanDerWaalsContact C-N 3.33Å; S80-I82 PolarHBondContact O-N 3.11Å; I82-L84 VanDerWaalsContact C-N 3.35Å; I82-L85 WeakPolarHBondContact O-CB 3.39Å; I82-L85 PolarHBondContact O-N 3.35Å; I82-P86 WeakPolarHBondContact O-CD 3.26Å |
| 83 | A | 63.3 | Low | 66.2 | Low | 67 Ų | 67 | 90.7 Ų | 90.7 | 55% | 0.554 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -69.3 | -29.6 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y79 S80 P86 | Y79-A83 WeakPolarHBondContact O-CB 3.38Å; Y79-A83 PolarHBondContact O-N 3.13Å; S80-A83 PolarHBondContact O-N 3.46Å; S80-A83 VanDerWaalsContact O-N 3.17Å; A83-P86 WeakPolarHBondContact O-CD 3.2Å; A83-P86 WeakPolarHBondContact O-CG 3.44Å |
| 84 | L | 62.5 | Low | 67.9 | Low | 85 Ų | 85 | 90 Ų | 90 | 45% | 0.445 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -80.2 | -25.3 | 175.4 | -69.6 | 170.4 | 0 | 0 | 0 | 113.3 | S80 L81 I82 V87 I88 | S80-L84 WeakPolarHBondContact O-CG 3.39Å; S80-L84 PolarHBondContact O-N 3.32Å; L81-L84 PolarHBondContact O-N 2.69Å; I82-L84 VanDerWaalsContact C-N 3.35Å; L84-V87 WeakPolarHBondContact O-CA 3.32Å; L84-V87 WeakPolarHBondContact O-CB 3.25Å; L84-V87 PolarHBondContact O-N 3.42Å; L84-I88 HydrophobicContact CB-CD1 4.2Å; L84-I88 WeakPolarHBondContact O-CG1 3.17Å; L84-I88 PolarHBondContact O-N 3.47Å |
| 85 | L | 70.2 | Confident | 69.4 | Low | 114 Ų | 114 | 89 Ų | 89 | 60% | 0.597 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -48.8 | -48.3 | 179.5 | -167.4 | 70.9 | 0 | 0 | 0 | 114.6 | L81 I82 V87 I88 L89 | L81-L85 PolarHBondContact O-N 3.22Å; I82-L85 WeakPolarHBondContact O-CB 3.39Å; I82-L85 PolarHBondContact O-N 3.35Å; L85-V87 VanDerWaalsContact C-N 3.34Å; L85-V87 PolarHBondContact O-N 3.1Å; L85-I88 PolarHBondContact O-N 2.86Å; L85-L89 WeakPolarHBondContact O-CB 3.49Å; L85-L89 PolarHBondContact O-N 2.92Å |
| 86 | P | 74.6 | Confident | 70.9 | Confident | 74 Ų | 74 | 90.8 Ų | 90.8 | 48% | 0.481 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.8 | -32.6 | 176 | 25.4 | -35.4 | 0 | 0 | 0 | 113.4 | I82 A83 L89 V90 | I82-P86 WeakPolarHBondContact O-CD 3.26Å; A83-P86 WeakPolarHBondContact O-CD 3.2Å; A83-P86 WeakPolarHBondContact O-CG 3.44Å; P86-L89 PolarHBondContact O-N 3.42Å; P86-V90 WeakPolarHBondContact O-CG2 3.47Å; P86-V90 PolarHBondContact O-N 3.17Å |
| 87 | V | 80.9 | Confident | 72.3 | Confident | 98 Ų | 98 | 91 Ų | 91 | 59% | 0.594 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -68.5 | -43.2 | 177.1 | -174.6 | 0 | 0 | 0 | 0 | 110.3 | L84 L85 V90 G91 | L84-V87 WeakPolarHBondContact O-CA 3.32Å; L84-V87 WeakPolarHBondContact O-CB 3.25Å; L84-V87 PolarHBondContact O-N 3.42Å; L85-V87 VanDerWaalsContact C-N 3.34Å; L85-V87 PolarHBondContact O-N 3.1Å; V87-V90 PolarHBondContact O-N 2.87Å; V87-G91 PolarHBondContact O-N 3.46Å |
| 88 | I | 81.1 | Confident | 73.4 | Confident | 91 Ų | 91 | 93.7 Ų | 93.7 | 47% | 0.467 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.9 | -43.4 | 174.4 | -64.7 | 164.2 | 0 | 0 | 0 | 110.3 | L84 L85 G91 L92 | L84-I88 HydrophobicContact CB-CD1 4.2Å; L84-I88 WeakPolarHBondContact O-CG1 3.17Å; L84-I88 PolarHBondContact O-N 3.47Å; L85-I88 PolarHBondContact O-N 2.86Å; I88-G91 PolarHBondContact O-N 3.33Å; I88-L92 HydrophobicContact CG2-CD1 3.97Å; I88-L92 HydrophobicContact CG2-CG 4.38Å; I88-L92 WeakPolarHBondContact O-CB 3.27Å; I88-L92 WeakPolarHBondContact O-CG 3.39Å; I88-L92 PolarHBondContact O-N 2.84Å |
| 89 | L | 78.6 | Confident | 74.3 | Confident | 116 Ų | 116 | 93.7 Ų | 93.7 | 61% | 0.607 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59.5 | -47.9 | 177 | -169.9 | 76.5 | 0 | 0 | 0 | 111.7 | L85 P86 L92 L93 | L85-L89 WeakPolarHBondContact O-CB 3.49Å; L85-L89 PolarHBondContact O-N 2.92Å; P86-L89 PolarHBondContact O-N 3.42Å; L89-L92 PolarHBondContact O-N 2.99Å; L89-L93 WeakPolarHBondContact O-CB 3.44Å; L89-L93 PolarHBondContact O-N 3.32Å |
| 90 | V | 83.1 | Confident | 75 | Confident | 85 Ų | 85 | 90.6 Ų | 90.6 | 52% | 0.515 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.2 | -42 | 176.7 | 170.2 | 0 | 0 | 0 | 0 | 111.2 | P86 V87 L93 I94 | P86-V90 WeakPolarHBondContact O-CG2 3.47Å; P86-V90 PolarHBondContact O-N 3.17Å; V87-V90 PolarHBondContact O-N 2.87Å; V90-L93 PolarHBondContact O-N 3.3Å; V90-I94 HydrophobicContact CG1-CD1 3.76Å; V90-I94 HydrophobicContact CG1-CG1 4.43Å; V90-I94 VanDerWaalsContact O-CG1 3.31Å; V90-I94 WeakPolarHBondContact O-CG1 3.3Å; V90-I94 PolarHBondContact O-N 3.11Å |
| 91 | G | 83.8 | Confident | 75.4 | Confident | 32 Ų | 32 | 95.2 Ų | 95.2 | 33% | 0.33 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.6 | -44.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | V87 I88 L93 I94 T95 | V87-G91 PolarHBondContact O-N 3.46Å; I88-G91 PolarHBondContact O-N 3.33Å; G91-L93 VanDerWaalsContact C-N 3.35Å; G91-I94 PolarHBondContact O-N 2.8Å; G91-T95 WeakPolarHBondContact O-CB 3.37Å; G91-T95 WeakPolarHBondContact O-CG2 3.29Å; G91-T95 PolarHBondContact O-N 3.02Å; G91-T95 PolarHBondContact O-OG1 3.02Å |
| 92 | L | 84.7 | Confident | 75.4 | Confident | 103 Ų | 103 | 98 Ų | 98 | 54% | 0.539 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.1 | -37.1 | 175 | -72.8 | 172.7 | 0 | 0 | 0 | 112.2 | I88 L89 T95 T96 | I88-L92 HydrophobicContact CG2-CD1 3.97Å; I88-L92 HydrophobicContact CG2-CG 4.38Å; I88-L92 WeakPolarHBondContact O-CB 3.27Å; I88-L92 WeakPolarHBondContact O-CG 3.39Å; I88-L92 PolarHBondContact O-N 2.84Å; L89-L92 PolarHBondContact O-N 2.99Å; L92-T95 WeakPolarHBondContact CA-OG1 3.48Å; L92-T95 PolarHBondContact O-OG1 3.43Å; L92-T95 VanDerWaalsContact O-OG1 3.12Å; L92-T96 WeakPolarHBondContact O-CB 3.45Å; L92-T96 PolarHBondContact O-N 3.47Å; L92-T96 PolarHBondContact O-OG1 3.42Å |
| 93 | L | 85.1 | Confident | 75.2 | Confident | 101 Ų | 101 | 99.2 Ų | 99.2 | 53% | 0.529 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -68.4 | -45.1 | 178.4 | -155.8 | 161 | 0 | 0 | 0 | 110.7 | L89 V90 G91 T96 I97 | L89-L93 WeakPolarHBondContact O-CB 3.44Å; L89-L93 PolarHBondContact O-N 3.32Å; V90-L93 PolarHBondContact O-N 3.3Å; G91-L93 VanDerWaalsContact C-N 3.35Å; L93-T96 PolarHBondContact O-N 3.21Å; L93-I97 HydrophobicContact CD2-CD1 3.52Å; L93-I97 HydrophobicContact CD2-CG1 4.25Å; L93-I97 WeakPolarHBondContact O-CB 3.39Å; L93-I97 WeakPolarHBondContact O-CG1 3.45Å; L93-I97 PolarHBondContact O-N 2.89Å |
| 94 | I | 83.8 | Confident | 74.9 | Confident | 99 Ų | 99 | 104.7 Ų | 104.7 | 51% | 0.508 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.2 | -48.2 | 174.7 | -67.5 | 166.8 | 0 | 0 | 0 | 111.2 | V90 G91 T96 I97 F98 | V90-I94 HydrophobicContact CG1-CD1 3.76Å; V90-I94 HydrophobicContact CG1-CG1 4.43Å; V90-I94 VanDerWaalsContact O-CG1 3.31Å; V90-I94 WeakPolarHBondContact O-CG1 3.3Å; V90-I94 PolarHBondContact O-N 3.11Å; G91-I94 PolarHBondContact O-N 2.8Å; I94-T96 PolarHBondContact O-N 3.3Å; I94-I97 PolarHBondContact O-N 3.24Å; I94-F98 WeakPolarHBondContact O-CB 3.34Å; I94-F98 PolarHBondContact O-N 3.29Å |
| 95 | T | 81.6 | Confident | 74.4 | Confident | 75 Ų | 75 | 109.6 Ų | 109.6 | 46% | 0.46 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -66 | -37.3 | 179.1 | 51.7 | 0 | 0 | 0 | 0 | 112.1 | G91 L92 F98 C99 | G91-T95 WeakPolarHBondContact O-CB 3.37Å; G91-T95 WeakPolarHBondContact O-CG2 3.29Å; G91-T95 PolarHBondContact O-N 3.02Å; G91-T95 PolarHBondContact O-OG1 3.02Å; L92-T95 WeakPolarHBondContact CA-OG1 3.48Å; L92-T95 PolarHBondContact O-OG1 3.43Å; L92-T95 VanDerWaalsContact O-OG1 3.12Å; T95-F98 PolarHBondContact O-N 3.24Å; T95-C99 VanDerWaalsContact O-CB 3.26Å; T95-C99 WeakPolarHBondContact O-CB 3.25Å; T95-C99 PolarHBondContact O-N 3.29Å; T95-C99 PolarHBondContact O-SG 2.96Å |
| 96 | T | 80.1 | Confident | 73.4 | Confident | 85 Ų | 85 | 111.2 Ų | 111.2 | 52% | 0.521 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -61.4 | -46.8 | 173.3 | -61.3 | 0 | 0 | 0 | 0 | 111.2 | L92 L93 I94 F98 C99 V100 | L92-T96 WeakPolarHBondContact O-CB 3.45Å; L92-T96 PolarHBondContact O-N 3.47Å; L92-T96 PolarHBondContact O-OG1 3.42Å; L93-T96 PolarHBondContact O-N 3.21Å; I94-T96 PolarHBondContact O-N 3.3Å; T96-F98 PolarHBondContact O-N 2.94Å; T96-C99 PolarHBondContact O-N 3.46Å; T96-V100 WeakPolarHBondContact O-CB 3.31Å; T96-V100 WeakPolarHBondContact O-CG2 3.38Å; T96-V100 PolarHBondContact O-N 3.01Å |
| 97 | I | 80.9 | Confident | 72.3 | Confident | 84 Ų | 84 | 114.9 Ų | 114.9 | 43% | 0.431 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -58.6 | -48.4 | 174.1 | -73.5 | 175.5 | 0 | 0 | 0 | 110.5 | L93 I94 C99 V100 Y101 | L93-I97 HydrophobicContact CD2-CD1 3.52Å; L93-I97 HydrophobicContact CD2-CG1 4.25Å; L93-I97 WeakPolarHBondContact O-CB 3.39Å; L93-I97 WeakPolarHBondContact O-CG1 3.45Å; L93-I97 PolarHBondContact O-N 2.89Å; I94-I97 PolarHBondContact O-N 3.24Å; I97-C99 PolarHBondContact O-N 2.95Å; I97-V100 PolarHBondContact O-N 3.27Å; I97-Y101 HydrophobicContact CG2-CD2 3.63Å; I97-Y101 HydrophobicContact CG2-CE2 3.73Å; I97-Y101 WeakPolarHBondContact O-CD2 3.37Å; I97-Y101 PolarHBondContact O-N 3.11Å |
| 98 | F | 75.3 | Confident | 70.9 | Confident | 128 Ų | 128 | 117 Ų | 117 | 56% | 0.561 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -63.6 | -39.8 | -179.5 | -127.7 | -94 | 0 | 0 | 0 | 112.5 | I94 T95 T96 Y101 R102 | I94-F98 WeakPolarHBondContact O-CB 3.34Å; I94-F98 PolarHBondContact O-N 3.29Å; T95-F98 PolarHBondContact O-N 3.24Å; T96-F98 PolarHBondContact O-N 2.94Å; F98-Y101 PolarHBondContact O-N 3.04Å; F98-R102 HydrophobicContact CD1-CG 4.33Å; F98-R102 VanDerWaalsContact O-CB 3.25Å; F98-R102 WeakPolarHBondContact O-CB 3.48Å; F98-R102 WeakPolarHBondContact O-CG 3.26Å; F98-R102 PolarHBondContact O-N 2.78Å |
| 99 | C | 72.4 | Confident | 69.3 | Low | 85 Ų | 85 | 116.4 Ų | 116.4 | 57% | 0.574 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.1 | -43.8 | 173.7 | -76.8 | 0 | 0 | 0 | 0 | 111.5 | T95 T96 I97 R102 F103 | T95-C99 VanDerWaalsContact O-CB 3.26Å; T95-C99 WeakPolarHBondContact O-CB 3.25Å; T95-C99 PolarHBondContact O-N 3.29Å; T95-C99 PolarHBondContact O-SG 2.96Å; T96-C99 PolarHBondContact O-N 3.46Å; I97-C99 PolarHBondContact O-N 2.95Å; C99-R102 PolarHBondContact O-N 3.3Å; C99-F103 WeakPolarHBondContact O-CB 3.48Å; C99-F103 PolarHBondContact O-N 3.29Å |
| 100 | V | 70.8 | Confident | 67.8 | Low | 87 Ų | 87 | 116.2 Ų | 116.2 | 53% | 0.527 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -65.2 | -42.2 | 176 | 170.7 | 0 | 0 | 0 | 0 | 111.5 | T96 I97 F103 R104 | T96-V100 WeakPolarHBondContact O-CB 3.31Å; T96-V100 WeakPolarHBondContact O-CG2 3.38Å; T96-V100 PolarHBondContact O-N 3.01Å; I97-V100 PolarHBondContact O-N 3.27Å; V100-F103 PolarHBondContact O-N 3.4Å; V100-R104 WeakPolarHBondContact O-CB 3.1Å; V100-R104 PolarHBondContact O-N 3.02Å |
| 101 | Y | 66.9 | Low | 66.1 | Low | 164 Ų | 164 | 119.5 Ų | 119.5 | 64% | 0.643 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -66.8 | -43.9 | 175.1 | -86.1 | -73.5 | 0 | 0 | 0 | 112.6 | I97 F98 R104 R105 | I97-Y101 HydrophobicContact CG2-CD2 3.63Å; I97-Y101 HydrophobicContact CG2-CE2 3.73Å; I97-Y101 WeakPolarHBondContact O-CD2 3.37Å; I97-Y101 PolarHBondContact O-N 3.11Å; F98-Y101 PolarHBondContact O-N 3.04Å; Y101-R104 PolarHBondContact O-N 3.12Å; Y101-R105 WeakPolarHBondContact O-CB 3.5Å; Y101-R105 PolarHBondContact O-N 2.85Å |
| 102 | R | 59.9 | Low | 64.3 | Low | 173 Ų | 173 | 123.7 Ų | 123.7 | 65% | 0.653 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -59.9 | -47.5 | 173.2 | -80.9 | -79.5 | 174.1 | 100.6 | -6.4 | 110.7 | F98 C99 R105 W106 | F98-R102 HydrophobicContact CD1-CG 4.33Å; F98-R102 VanDerWaalsContact O-CB 3.25Å; F98-R102 WeakPolarHBondContact O-CB 3.48Å; F98-R102 WeakPolarHBondContact O-CG 3.26Å; F98-R102 PolarHBondContact O-N 2.78Å; C99-R102 PolarHBondContact O-N 3.3Å; R102-R105 PolarHBondContact O-N 3.18Å; R102-W106 VanDerWaalsContact O-CB 3.29Å; R102-W106 WeakPolarHBondContact O-CB 3.32Å; R102-W106 PolarHBondContact O-N 3.32Å |
| 103 | F | 59.1 | Low | 62.4 | Low | 138 Ų | 138 | 123.9 Ų | 123.9 | 61% | 0.605 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -66.1 | -36.6 | 179.1 | -170 | -96.8 | 0 | 0 | 0 | 112.6 | C99 V100 W106 K107 | C99-F103 WeakPolarHBondContact O-CB 3.48Å; C99-F103 PolarHBondContact O-N 3.29Å; V100-F103 PolarHBondContact O-N 3.4Å; F103-W106 CarbonylContact O-C 3.56Å; F103-W106 PolarHBondContact O-N 2.78Å; F103-K107 VanDerWaalsContact O-CB 3.31Å; F103-K107 WeakPolarHBondContact O-CB 3.33Å; F103-K107 PolarHBondContact O-N 3.49Å |
| 104 | R | 57 | Low | 60.7 | Low | 182 Ų | 182 | 122.2 Ų | 122.2 | 69% | 0.687 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -68.3 | -40.3 | 174.7 | -167.3 | 171.1 | -175.5 | 163.7 | -0 | 111.6 | V100 Y101 K107 H108 | V100-R104 WeakPolarHBondContact O-CB 3.1Å; V100-R104 PolarHBondContact O-N 3.02Å; Y101-R104 PolarHBondContact O-N 3.12Å; R104-K107 PolarHBondContact O-N 3Å; R104-H108 PolarHBondContact O-N 3.38Å; R104-H108 VanDerWaalsContact O-N 3.16Å |
| 105 | R | 52.8 | Low | 58.9 | Low | 188 Ų | 188 | 122.9 Ų | 122.9 | 71% | 0.709 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -64.7 | -39.2 | 170.7 | -171.8 | 171.3 | 178.8 | 163.6 | -0.8 | 111.5 | Y101 R102 H108 N109 | Y101-R105 WeakPolarHBondContact O-CB 3.5Å; Y101-R105 PolarHBondContact O-N 2.85Å; R102-R105 PolarHBondContact O-N 3.18Å; R105-H108 PolarHBondContact O-N 3.19Å; R105-N109 PolarHBondContact O-N 3.41Å; R105-N109 PolarHBondContact O-ND2 3.3Å |
| 106 | W | 49.3 | Very low | 57.2 | Low | 148 Ų | 148 | 123.7 Ų | 123.7 | 56% | 0.561 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -71.4 | -32.4 | 176.8 | -150.6 | 55.6 | 0 | 0 | 0 | 112.4 | R102 F103 N109 K110 | R102-W106 VanDerWaalsContact O-CB 3.29Å; R102-W106 WeakPolarHBondContact O-CB 3.32Å; R102-W106 PolarHBondContact O-N 3.32Å; F103-W106 CarbonylContact O-C 3.56Å; F103-W106 PolarHBondContact O-N 2.78Å; W106-N109 CarbonylContact O-C 3.54Å; W106-N109 PolarHBondContact O-N 3.17Å; W106-K110 HydrophobicContact CE3-CD 4.41Å; W106-K110 VanDerWaalsContact CZ3-CE 3.44Å; W106-K110 WeakPolarHBondContact O-CB 3.2Å; W106-K110 WeakPolarHBondContact O-CG 3.36Å; W106-K110 PolarHBondContact O-N 2.77Å |
| 107 | K | 51.9 | Low | 55.7 | Low | 151 Ų | 151 | 124.8 Ų | 124.8 | 66% | 0.657 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -67.2 | -34.9 | 172.4 | -170.5 | 173.2 | -177.8 | 176.8 | 0 | 112.1 | F103 R104 K111 | F103-K107 VanDerWaalsContact O-CB 3.31Å; F103-K107 WeakPolarHBondContact O-CB 3.33Å; F103-K107 PolarHBondContact O-N 3.49Å; R104-K107 PolarHBondContact O-N 3Å; K107-K111 PolarHBondContact O-N 3.16Å |
| 108 | H | 50 | Low | 54.3 | Low | 141 Ų | 141 | 122.8 Ų | 122.8 | 65% | 0.653 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -65.4 | -47.7 | 167.1 | -101.3 | -92.8 | 0 | 0 | 0 | 111.9 | R104 R105 K110 K111 Q112 | R104-H108 PolarHBondContact O-N 3.38Å; R104-H108 VanDerWaalsContact O-N 3.16Å; R105-H108 PolarHBondContact O-N 3.19Å; H108-K110 VanDerWaalsContact C-N 3.25Å; H108-K110 PolarHBondContact O-N 3.25Å; H108-K111 PolarHBondContact O-N 2.83Å; H108-K111 VanDerWaalsContact O-N 3.17Å; H108-Q112 PolarHBondContact O-N 3.46Å |
| 109 | N | 48.5 | Very low | 53.1 | Low | 79 Ų | 79 | 123.3 Ų | 123.3 | 42% | 0.422 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63 | -30.7 | 177.8 | -80.7 | -110.1 | 0 | 0 | 0 | 112.1 | R105 W106 K111 Q112 L113 | R105-N109 PolarHBondContact O-N 3.41Å; R105-N109 PolarHBondContact O-ND2 3.3Å; W106-N109 CarbonylContact O-C 3.54Å; W106-N109 PolarHBondContact O-N 3.17Å; N109-K111 PolarHBondContact O-N 3.49Å; N109-Q112 CarbonylContact O-C 3.58Å; N109-Q112 PolarHBondContact O-N 2.94Å; N109-L113 VanDerWaalsContact O-CB 3.3Å; N109-L113 WeakPolarHBondContact O-CB 3.31Å; N109-L113 PolarHBondContact O-N 3.42Å |
| 110 | K | 45.8 | Very low | 51.9 | Low | 112 Ų | 112 | 126.7 Ų | 126.7 | 49% | 0.487 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -69.5 | -26.3 | 175.9 | -83.5 | -167 | 171.5 | -168.9 | 0 | 114.2 | W106 H108 A114 | W106-K110 HydrophobicContact CE3-CD 4.41Å; W106-K110 VanDerWaalsContact CZ3-CE 3.44Å; W106-K110 WeakPolarHBondContact O-CB 3.2Å; W106-K110 WeakPolarHBondContact O-CG 3.36Å; W106-K110 PolarHBondContact O-N 2.77Å; H108-K110 VanDerWaalsContact C-N 3.25Å; H108-K110 PolarHBondContact O-N 3.25Å; K110-A114 PolarHBondContact O-N 3.33Å; K110-A114 VanDerWaalsContact O-N 3.11Å |
| 111 | K | 48.4 | Very low | 50.7 | Low | 154 Ų | 154 | 128.9 Ų | 128.9 | 67% | 0.67 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -67.5 | -49.4 | 167.5 | -90.9 | -161.2 | 165.1 | -158.6 | 0 | 110.7 | K107 H108 N109 L113 A114 E115 | K107-K111 PolarHBondContact O-N 3.16Å; H108-K111 PolarHBondContact O-N 2.83Å; H108-K111 VanDerWaalsContact O-N 3.17Å; N109-K111 PolarHBondContact O-N 3.49Å; K111-L113 VanDerWaalsContact C-N 3.25Å; K111-L113 PolarHBondContact O-N 3.48Å; K111-A114 PolarHBondContact O-N 2.82Å; K111-A114 VanDerWaalsContact O-N 3.12Å; K111-E115 PolarHBondContact O-N 2.75Å |
| 112 | Q | 45.5 | Very low | 50 | Low | 121 Ų | 121 | 126.3 Ų | 126.3 | 57% | 0.565 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -63.8 | -30.3 | 177.8 | -63.8 | -178.9 | -60.2 | 0 | 0 | 112.5 | H108 N109 L116 | H108-Q112 PolarHBondContact O-N 3.46Å; N109-Q112 CarbonylContact O-C 3.58Å; N109-Q112 PolarHBondContact O-N 2.94Å; Q112-L116 VanDerWaalsContact O-CB 3.25Å; Q112-L116 WeakPolarHBondContact O-CB 3.35Å; Q112-L116 PolarHBondContact O-N 3.42Å |
| 113 | L | 45.5 | Very low | 49.5 | Very low | 107 Ų | 107 | 121.5 Ų | 121.5 | 56% | 0.56 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -74.7 | -32.1 | 175 | -170.2 | 65.3 | 0 | 0 | 0 | 112.5 | N109 K111 L116 N117 | N109-L113 VanDerWaalsContact O-CB 3.3Å; N109-L113 WeakPolarHBondContact O-CB 3.31Å; N109-L113 PolarHBondContact O-N 3.42Å; K111-L113 VanDerWaalsContact C-N 3.25Å; K111-L113 PolarHBondContact O-N 3.48Å; L113-L116 HydrophobicContact CD1-CD2 4.28Å; L113-L116 PolarHBondContact O-N 3.29Å; L113-N117 WeakPolarHBondContact O-CB 3.5Å; L113-N117 PolarHBondContact O-N 2.87Å |
| 114 | A | 48.4 | Very low | 48.7 | Very low | 65 Ų | 65 | 122.5 Ų | 122.5 | 54% | 0.537 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -69.2 | -41.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | K110 K111 N117 A118 | K110-A114 PolarHBondContact O-N 3.33Å; K110-A114 VanDerWaalsContact O-N 3.11Å; K111-A114 PolarHBondContact O-N 2.82Å; K111-A114 VanDerWaalsContact O-N 3.12Å; A114-N117 PolarHBondContact O-N 3.49Å; A114-A118 PolarHBondContact O-N 2.79Å; A114-A118 VanDerWaalsContact O-N 3.11Å |
| 115 | E | 46.7 | Very low | 47.8 | Very low | 114 Ų | 114 | 118.1 Ų | 118.1 | 53% | 0.533 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -61.9 | -42.8 | 171 | -70.3 | 158.4 | -167 | 0 | 0 | 111 | K111 N117 A118 F119 | K111-E115 PolarHBondContact O-N 2.75Å; E115-N117 PolarHBondContact O-N 3.32Å; E115-A118 PolarHBondContact O-N 3.48Å; E115-F119 VanDerWaalsContact O-CD2 3.27Å; E115-F119 WeakPolarHBondContact O-CD2 3.21Å; E115-F119 PolarHBondContact O-N 2.77Å |
| 116 | L | 46.7 | Very low | 47.2 | Very low | 91 Ų | 91 | 110.3 Ų | 110.3 | 48% | 0.476 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -66.3 | -33.2 | 175.7 | -168.1 | 69.7 | 0 | 0 | 0 | 113 | Q112 L113 F119 Y120 | Q112-L116 VanDerWaalsContact O-CB 3.25Å; Q112-L116 WeakPolarHBondContact O-CB 3.35Å; Q112-L116 PolarHBondContact O-N 3.42Å; L113-L116 HydrophobicContact CD1-CD2 4.28Å; L113-L116 PolarHBondContact O-N 3.29Å; L116-F119 PolarHBondContact O-N 3.28Å; L116-Y120 PolarHBondContact O-N 2.92Å |
| 117 | N | 47.5 | Very low | 46.8 | Very low | 109 Ų | 109 | 109 Ų | 109 | 58% | 0.583 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -66.6 | -41.6 | 174.7 | -165.2 | 96 | 0 | 0 | 0 | 111.1 | L113 A114 E115 F119 Y120 E121 | L113-N117 WeakPolarHBondContact O-CB 3.5Å; L113-N117 PolarHBondContact O-N 2.87Å; A114-N117 PolarHBondContact O-N 3.49Å; E115-N117 PolarHBondContact O-N 3.32Å; N117-F119 VanDerWaalsContact C-N 3.33Å; N117-Y120 WeakPolarHBondContact O-CB 3.34Å; N117-Y120 PolarHBondContact O-N 2.97Å; N117-E121 PolarHBondContact O-N 2.88Å |
| 118 | A | 52.6 | Low | 46.4 | Very low | 42 Ų | 42 | 105.2 Ų | 105.2 | 35% | 0.347 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.4 | -37.9 | 172 | 0 | 0 | 0 | 0 | 0 | 111.8 | A114 E115 E121 I122 | A114-A118 PolarHBondContact O-N 2.79Å; A114-A118 VanDerWaalsContact O-N 3.11Å; E115-A118 PolarHBondContact O-N 3.48Å; A118-E121 PolarHBondContact O-N 3.24Å; A118-I122 WeakPolarHBondContact O-CB 3.41Å; A118-I122 WeakPolarHBondContact O-CD1 3.49Å; A118-I122 WeakPolarHBondContact O-CG1 3.42Å; A118-I122 PolarHBondContact O-N 3.37Å |
| 119 | F | 49.4 | Very low | 46.2 | Very low | 138 Ų | 138 | 103.4 Ų | 103.4 | 61% | 0.605 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63.4 | -38.3 | 170.6 | -85 | -69.1 | 0 | 0 | 0 | 112.9 | E115 L116 N117 I122 V123 | E115-F119 VanDerWaalsContact O-CD2 3.27Å; E115-F119 WeakPolarHBondContact O-CD2 3.21Å; E115-F119 PolarHBondContact O-N 2.77Å; L116-F119 PolarHBondContact O-N 3.28Å; N117-F119 VanDerWaalsContact C-N 3.33Å; F119-I122 PolarHBondContact O-N 2.86Å; F119-V123 WeakPolarHBondContact O-CB 3.35Å; F119-V123 VanDerWaalsContact O-CG2 3.26Å; F119-V123 WeakPolarHBondContact O-CG2 3.36Å; F119-V123 PolarHBondContact O-N 3.37Å |
| 120 | Y | 46.9 | Very low | 45.7 | Very low | 156 Ų | 156 | 104.6 Ų | 104.6 | 61% | 0.612 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -64.4 | -44.8 | 174.7 | -111.9 | -89.8 | 0 | 0 | 0 | 111.9 | L116 N117 I122 V123 E124 | L116-Y120 PolarHBondContact O-N 2.92Å; N117-Y120 WeakPolarHBondContact O-CB 3.34Å; N117-Y120 PolarHBondContact O-N 2.97Å; Y120-I122 VanDerWaalsContact C-N 3.31Å; Y120-I122 PolarHBondContact O-N 3.49Å; Y120-V123 PolarHBondContact O-N 3.12Å; Y120-V123 VanDerWaalsContact O-N 3.11Å; Y120-E124 WeakPolarHBondContact O-CB 3.49Å; Y120-E124 PolarHBondContact O-N 3.49Å |
| 121 | E | 47 | Very low | 45.5 | Very low | 133 Ų | 133 | 101.8 Ų | 101.8 | 62% | 0.621 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -60.6 | -38.2 | 175.5 | -170.5 | 172.8 | -163.6 | 0 | 0 | 112 | N117 A118 S125 | N117-E121 PolarHBondContact O-N 2.88Å; A118-E121 PolarHBondContact O-N 3.24Å; E121-S125 VanDerWaalsContact O-CB 3.28Å; E121-S125 WeakPolarHBondContact O-CB 3.39Å; E121-S125 PolarHBondContact O-N 2.88Å; E121-S125 PolarHBondContact O-OG 3.44Å |
| 122 | I | 50.9 | Low | 45.2 | Very low | 111 Ų | 111 | 98.7 Ų | 98.7 | 57% | 0.569 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -70.6 | -31.9 | 174.1 | -69.3 | 164.2 | 0 | 0 | 0 | 112.4 | A118 F119 Y120 S125 | A118-I122 WeakPolarHBondContact O-CB 3.41Å; A118-I122 WeakPolarHBondContact O-CD1 3.49Å; A118-I122 WeakPolarHBondContact O-CG1 3.42Å; A118-I122 PolarHBondContact O-N 3.37Å; F119-I122 PolarHBondContact O-N 2.86Å; Y120-I122 VanDerWaalsContact C-N 3.31Å; Y120-I122 PolarHBondContact O-N 3.49Å; I122-S125 WeakPolarHBondContact CA-OG 3.42Å; I122-S125 PolarHBondContact O-OG 2.93Å |
| 123 | V | 48.8 | Very low | 44.9 | Very low | 71 Ų | 71 | 99.8 Ų | 99.8 | 43% | 0.43 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -76.5 | -43.4 | 176.7 | 167 | 0 | 0 | 0 | 0 | 111.2 | F119 Y120 S126 L129 | F119-V123 WeakPolarHBondContact O-CB 3.35Å; F119-V123 VanDerWaalsContact O-CG2 3.26Å; F119-V123 WeakPolarHBondContact O-CG2 3.36Å; F119-V123 PolarHBondContact O-N 3.37Å; Y120-V123 PolarHBondContact O-N 3.12Å; Y120-V123 VanDerWaalsContact O-N 3.11Å; V123-S126 WeakPolarHBondContact O-CB 3.46Å; V123-S126 PolarHBondContact O-N 2.88Å; V123-S126 PolarHBondContact O-OG 3.27Å; V123-L129 HydrophobicContact CG1-CD1 3.46Å; V123-L129 VanDerWaalsContact CG1-CD1 3.46Å |
| 124 | E | 42.3 | Very low | 44.5 | Very low | 160 Ų | 160 | 101 Ų | 101 | 75% | 0.748 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -75.5 | -26.7 | -177.4 | -169 | 162.2 | -164.4 | 0 | 0 | 112.8 | Y120 S126 | Y120-E124 WeakPolarHBondContact O-CB 3.49Å; Y120-E124 PolarHBondContact O-N 3.49Å; E124-S126 PolarHBondContact O-N 2.92Å |
| 125 | S | 39.4 | Very low | 44.3 | Very low | 89 Ų | 89 | 106.1 Ų | 106.1 | 62% | 0.622 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -3.3 | 168.4 | 55.7 | 0 | 0 | 0 | 0 | 114.4 | E121 I122 | E121-S125 VanDerWaalsContact O-CB 3.28Å; E121-S125 WeakPolarHBondContact O-CB 3.39Å; E121-S125 PolarHBondContact O-N 2.88Å; E121-S125 PolarHBondContact O-OG 3.44Å; I122-S125 WeakPolarHBondContact CA-OG 3.42Å; I122-S125 PolarHBondContact O-OG 2.93Å |
| 126 | S | 39.3 | Very low | 43.7 | Very low | 25 Ų | 25 | 108 Ų | 108 | 18% | 0.175 | 61% | 0.605 | C | S | . | * | trans | -86.4 | 118.8 | 174.2 | 78.8 | 0 | 0 | 0 | 0 | 111.3 | V123 E124 C128 | V123-S126 WeakPolarHBondContact O-CB 3.46Å; V123-S126 PolarHBondContact O-N 2.88Å; V123-S126 PolarHBondContact O-OG 3.27Å; E124-S126 PolarHBondContact O-N 2.92Å; S126-C128 PolarHBondContact O-N 2.7Å | ||
| 127 | P | 42.2 | Very low | 43.6 | Very low | 121 Ų | 121 | 108 Ų | 108 | 79% | 0.786 | 60% | 0.604 | S | S | * | * | G | 310 helix | trans | -71.2 | -0.5 | -173.7 | 29.3 | -36.2 | 0 | 0 | 0 | 114.2 | ||
| 128 | C | 43.5 | Very low | 43 | Very low | 70 Ų | 70 | 110.5 Ų | 110.5 | 47% | 0.473 | 61% | 0.612 | S | S | . | * | G | 310 helix | trans | -79.6 | -16.9 | -174.8 | -54.5 | 0 | 0 | 0 | 0 | 113.7 | S126 A130 | S126-C128 PolarHBondContact O-N 2.7Å; C128-A130 PolarHBondContact O-N 2.86Å |
| 129 | L | 43.9 | Very low | 42.5 | Very low | 104 Ų | 104 | 115.7 Ų | 115.7 | 55% | 0.545 | 63% | 0.629 | S | S | . | * | G | 310 helix | trans | -87.2 | 3.2 | -172.2 | -99.5 | 163.5 | 0 | 0 | 0 | 115.3 | V123 S131 | V123-L129 HydrophobicContact CG1-CD1 3.46Å; V123-L129 VanDerWaalsContact CG1-CD1 3.46Å; L129-S131 PolarHBondContact O-N 3.43Å |
| 130 | A | 38.8 | Very low | 41.8 | Very low | 104 Ų | 104 | 113.5 Ų | 113.5 | 86% | 0.86 | 63% | 0.63 | S | S | * | * | G | 310 helix | trans | -66.5 | -5.8 | -178 | 0 | 0 | 0 | 0 | 0 | 115.3 | C128 | C128-A130 PolarHBondContact O-N 2.86Š|
| 131 | S | 42.3 | Very low | 41.5 | Very low | 53 Ų | 53 | 115.5 Ų | 115.5 | 37% | 0.371 | 64% | 0.642 | S | S | . | * | S | Bend | trans | -112.3 | 104 | 173 | -151.7 | 0 | 0 | 0 | 0 | 110.4 | L129 K133 | L129-S131 PolarHBondContact O-N 3.43Å; S131-K133 PolarHBondContact O-N 2.92Å |
| 132 | G | 40.6 | Very low | 41.3 | Very low | 88 Ų | 88 | 116.1 Ų | 116.1 | 91% | 0.907 | 65% | 0.649 | S | S | * | * | trans | -70 | 64.5 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 133 | K | 39.6 | Very low | 40.7 | Very low | 145 Ų | 145 | 116.5 Ų | 116.5 | 63% | 0.63 | 66% | 0.656 | S | S | * | * | trans | -119.9 | 134.5 | 177.6 | -64.8 | 179.9 | -178.4 | 177.1 | 0 | 109.6 | S131 Y135 | S131-K133 PolarHBondContact O-N 2.92Å; K133-Y135 VanDerWaalsContact O-CD2 3.25Å; K133-Y135 WeakPolarHBondContact O-CD2 3.4Å; K133-Y135 PolarHBondContact O-N 2.93Å | ||
| 134 | P | 38.5 | Very low | 40.2 | Very low | 132 Ų | 132 | 121.6 Ų | 121.6 | 86% | 0.857 | 68% | 0.676 | S | S | * | * | trans | -70.9 | 113.2 | 176.5 | 28.5 | -33 | 0 | 0 | 0 | 110.1 | L136 | P134-L136 PolarHBondContact O-N 3.4Š| ||
| 135 | Y | 43.2 | Very low | 40.5 | Very low | 173 Ų | 173 | 124.6 Ų | 124.6 | 68% | 0.678 | 69% | 0.686 | S | S | * | * | trans | -77 | 112.9 | 179.1 | -75.8 | -90.6 | 0 | 0 | 0 | 111.3 | K133 I137 | K133-Y135 VanDerWaalsContact O-CD2 3.25Å; K133-Y135 WeakPolarHBondContact O-CD2 3.4Å; K133-Y135 PolarHBondContact O-N 2.93Å; Y135-I137 PolarHBondContact O-N 2.99Å | ||
| 136 | L | 34.9 | Very low | 40.7 | Very low | 153 Ų | 153 | 123.7 Ų | 123.7 | 80% | 0.801 | 68% | 0.68 | S | S | * | * | trans | -73.1 | 120 | 164.9 | -162.5 | 84.6 | 0 | 0 | 0 | 108.3 | P134 Q138 | P134-L136 PolarHBondContact O-N 3.4Å; L136-Q138 VanDerWaalsContact C-N 3.28Å; L136-Q138 PolarHBondContact O-N 3.28Å | ||
| 137 | I | 44 | Very low | 41 | Very low | 90 Ų | 90 | 129.4 Ų | 129.4 | 46% | 0.462 | 70% | 0.704 | S | S | . | * | trans | -75.7 | 82.8 | 179.8 | -55.2 | 174.6 | 0 | 0 | 0 | 109.4 | Y135 T152 V155 | Y135-I137 PolarHBondContact O-N 2.99Å; I137-T152 HydrophobicContact CG2-CG2 3.78Å; I137-V155 HydrophobicContact CD1-CG1 3.91Å | ||
| 138 | Q | 34.9 | Very low | 40.9 | Very low | 163 Ų | 163 | 126 Ų | 126 | 76% | 0.762 | 68% | 0.682 | S | S | * | * | trans | -93.2 | 114.2 | 170.7 | -170.6 | 162.2 | 3.5 | 0 | 0 | 109 | L136 C140 | L136-Q138 VanDerWaalsContact C-N 3.28Å; L136-Q138 PolarHBondContact O-N 3.28Å; Q138-C140 VanDerWaalsContact C-N 3.28Å; Q138-C140 PolarHBondContact O-N 3.43Å | ||
| 139 | H | 42.5 | Very low | 40.9 | Very low | 151 Ų | 151 | 126.1 Ų | 126.1 | 70% | 0.699 | 68% | 0.678 | S | S | * | * | trans | -66.5 | 84.7 | 175.3 | -105.3 | -69.7 | 0 | 0 | 0 | 110.3 | ||||
| 140 | C | 33.4 | Very low | 41 | Very low | 92 Ų | 92 | 129.7 Ų | 129.7 | 62% | 0.622 | 68% | 0.684 | S | S | * | * | trans | -75.4 | 138.7 | 163.8 | -159.4 | 0 | 0 | 0 | 0 | 108.8 | Q138 V143 | Q138-C140 VanDerWaalsContact C-N 3.28Å; Q138-C140 PolarHBondContact O-N 3.43Å; C140-V143 HydrophobicContact CB-CG2 4.42Å | ||
| 141 | K | 41.6 | Very low | 41.4 | Very low | 198 Ų | 198 | 129.1 Ų | 129.1 | 86% | 0.861 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -87.4 | -16 | -166.6 | -137.9 | 179.2 | -177 | -174 | 0 | 114.1 | ||
| 142 | D | 42 | Very low | 41.7 | Very low | 145 Ų | 145 | 129 Ų | 129 | 78% | 0.775 | 66% | 0.663 | S | S | * | * | trans | -136.8 | 87.7 | -171.7 | -60.2 | -81.5 | 0 | 0 | 0 | 110 | ||||
| 143 | V | 39.9 | Very low | 41.9 | Very low | 119 Ų | 119 | 132.5 Ų | 132.5 | 72% | 0.721 | 65% | 0.649 | S | S | * | * | trans | -138 | 135.9 | 166.2 | -179.5 | 0 | 0 | 0 | 0 | 107.7 | C140 | C140-V143 HydrophobicContact CB-CG2 4.42Š| ||
| 144 | E | 37.2 | Very low | 42.1 | Very low | 179 Ų | 179 | 129.3 Ų | 129.3 | 84% | 0.836 | 65% | 0.649 | S | S | * | * | trans | -70.8 | 163.5 | -172.4 | -64.1 | -158.7 | 120.3 | 0 | 0 | 114.5 | S146 | E144-S146 PolarHBondContact O-N 2.98Š| ||
| 145 | K | 48.8 | Very low | 42.4 | Very low | 223 Ų | 223 | 127.8 Ų | 127.8 | 97% | 0.97 | 64% | 0.637 | S | S | * | * | trans | -54.1 | 97.1 | -177.4 | -64.3 | 166.1 | -177.2 | 165.1 | 0 | 112.1 | ||||
| 146 | S | 43.3 | Very low | 42.4 | Very low | 69 Ų | 69 | 122.6 Ų | 122.6 | 48% | 0.483 | 63% | 0.626 | S | S | . | * | trans | -131.4 | 153.6 | 165.6 | 59.3 | 0 | 0 | 0 | 0 | 109.6 | E144 C148 D149 | E144-S146 PolarHBondContact O-N 2.98Å; S146-C148 PolarHBondContact O-N 3.42Å; S146-D149 PolarHBondContact O-N 3.3Å | ||
| 147 | E | 44.8 | Very low | 42.8 | Very low | 145 Ų | 145 | 120.3 Ų | 120.3 | 68% | 0.678 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | -17.8 | -165.4 | -60.1 | -167.2 | 96.1 | 0 | 0 | 114.2 | D149 R150 | E147-D149 PolarHBondContact O-N 2.93Å; E147-R150 WeakPolarHBondContact O-CB 3.44Å; E147-R150 PolarHBondContact O-N 2.97Å; E147-R150 VanDerWaalsContact O-N 3.11Å; E147-R150 IonicContact OE1-NH1 3.47Å |
| 148 | C | 41.8 | Very low | 42.5 | Very low | 50 Ų | 50 | 121.5 Ų | 121.5 | 34% | 0.338 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -53.8 | -35 | 172.9 | -63.3 | 0 | 0 | 0 | 0 | 113.5 | S146 R150 I151 T152 | S146-C148 PolarHBondContact O-N 3.42Å; C148-R150 PolarHBondContact O-N 3.28Å; C148-I151 WeakPolarHBondContact O-CB 3.39Å; C148-I151 PolarHBondContact O-N 3.17Å; C148-T152 PolarHBondContact O-N 3.05Å; C148-T152 PolarHBondContact O-OG1 3.43Å |
| 149 | D | 43.4 | Very low | 43 | Very low | 72 Ų | 72 | 120.3 Ų | 120.3 | 39% | 0.385 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -64.8 | -28.1 | -179.7 | 174.9 | 55 | 0 | 0 | 0 | 112.6 | S146 E147 I151 R153 | S146-D149 PolarHBondContact O-N 3.3Å; E147-D149 PolarHBondContact O-N 2.93Å; D149-I151 VanDerWaalsContact C-N 3.31Å; D149-I151 PolarHBondContact O-N 3.45Å; D149-R153 WeakPolarHBondContact O-CB 3.47Å; D149-R153 WeakPolarHBondContact O-CG 3.41Å; D149-R153 PolarHBondContact O-N 3.42Å; D149-R153 IonicContact OD1-NE 2.88Å; D149-R153 PolarHBondContact OD1-NE 3.41Å; D149-R153 IonicContact OD2-CZ 3.87Å; D149-R153 IonicContact OD2-NE 2.9Å; D149-R153 PolarHBondContact OD2-NE 3.45Å; D149-R153 IonicContact OD2-NH2 3.64Å; D149-R153 PolarHBondContact OD2-NH2 2.91Å |
| 150 | R | 45.7 | Very low | 42.9 | Very low | 179 Ų | 179 | 120.4 Ų | 120.4 | 68% | 0.675 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -67 | -34.7 | 172.4 | -65.2 | 173 | 64.7 | -161.8 | -0.3 | 111.8 | E147 C148 A154 | E147-R150 WeakPolarHBondContact O-CB 3.44Å; E147-R150 PolarHBondContact O-N 2.97Å; E147-R150 VanDerWaalsContact O-N 3.11Å; E147-R150 IonicContact OE1-NH1 3.47Å; C148-R150 PolarHBondContact O-N 3.28Å; R150-A154 PolarHBondContact O-N 3.31Å |
| 151 | I | 47.5 | Very low | 43.5 | Very low | 93 Ų | 93 | 122.1 Ų | 122.1 | 48% | 0.477 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -75.3 | -47.2 | 178.8 | -57 | 173.6 | 0 | 0 | 0 | 109.6 | C148 D149 R153 A154 V155 | C148-I151 WeakPolarHBondContact O-CB 3.39Å; C148-I151 PolarHBondContact O-N 3.17Å; D149-I151 VanDerWaalsContact C-N 3.31Å; D149-I151 PolarHBondContact O-N 3.45Å; I151-R153 VanDerWaalsContact C-N 3.31Å; I151-R153 PolarHBondContact O-N 3.01Å; I151-A154 WeakPolarHBondContact O-CB 3.34Å; I151-A154 PolarHBondContact O-N 3.33Å; I151-V155 PolarHBondContact O-N 3.4Å |
| 152 | T | 46.9 | Very low | 43.3 | Very low | 51 Ų | 51 | 116 Ų | 116 | 31% | 0.313 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -59 | -41.8 | 176.9 | -51.3 | 0 | 0 | 0 | 0 | 111.8 | I137 C148 A154 V155 C156 | I137-T152 HydrophobicContact CG2-CG2 3.78Å; C148-T152 PolarHBondContact O-N 3.05Å; C148-T152 PolarHBondContact O-OG1 3.43Å; T152-A154 VanDerWaalsContact C-N 3.27Å; T152-A154 PolarHBondContact O-N 2.96Å; T152-V155 PolarHBondContact O-N 3.03Å; T152-C156 PolarHBondContact O-N 3.05Å |
| 153 | R | 46.2 | Very low | 43.6 | Very low | 161 Ų | 161 | 117.4 Ų | 117.4 | 61% | 0.608 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -70.2 | -16.7 | 175.2 | -72 | -167.7 | -83.6 | 141.2 | -11.1 | 114.6 | D149 I151 | D149-R153 WeakPolarHBondContact O-CB 3.47Å; D149-R153 WeakPolarHBondContact O-CG 3.41Å; D149-R153 PolarHBondContact O-N 3.42Å; D149-R153 IonicContact OD1-NE 2.88Å; D149-R153 PolarHBondContact OD1-NE 3.41Å; D149-R153 IonicContact OD2-CZ 3.87Å; D149-R153 IonicContact OD2-NE 2.9Å; D149-R153 PolarHBondContact OD2-NE 3.45Å; D149-R153 IonicContact OD2-NH2 3.64Å; D149-R153 PolarHBondContact OD2-NH2 2.91Å; I151-R153 VanDerWaalsContact C-N 3.31Å; I151-R153 PolarHBondContact O-N 3.01Å |
| 154 | A | 44.4 | Very low | 43.8 | Very low | 77 Ų | 77 | 120.8 Ų | 120.8 | 64% | 0.636 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -83.3 | -25.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | R150 I151 T152 | R150-A154 PolarHBondContact O-N 3.31Å; I151-A154 WeakPolarHBondContact O-CB 3.34Å; I151-A154 PolarHBondContact O-N 3.33Å; T152-A154 VanDerWaalsContact C-N 3.27Å; T152-A154 PolarHBondContact O-N 2.96Å |
| 155 | V | 44.8 | Very low | 44.3 | Very low | 100 Ų | 100 | 120.4 Ų | 120.4 | 61% | 0.606 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -82.7 | -28.1 | 180 | 175.1 | 0 | 0 | 0 | 0 | 112.4 | I137 I151 T152 V157 | I137-V155 HydrophobicContact CD1-CG1 3.91Å; I151-V155 PolarHBondContact O-N 3.4Å; T152-V155 PolarHBondContact O-N 3.03Å; V155-V157 PolarHBondContact O-N 3.38Å |
| 156 | C | 42.3 | Very low | 43.9 | Very low | 64 Ų | 64 | 118.6 Ų | 118.6 | 43% | 0.432 | 63% | 0.633 | S | S | . | * | trans | -93.1 | 82.1 | -175.9 | -71.3 | 0 | 0 | 0 | 0 | 113.8 | T152 | T152-C156 PolarHBondContact O-N 3.05Š| ||
| 157 | V | 42.3 | Very low | 43.7 | Very low | 106 Ų | 106 | 120.8 Ų | 120.8 | 64% | 0.642 | 65% | 0.646 | S | S | * | * | trans | -126.4 | 139.3 | 170.3 | -176.2 | 0 | 0 | 0 | 0 | 110.5 | V155 | V155-V157 PolarHBondContact O-N 3.38Š| ||
| 158 | P | 39.2 | Very low | 43.6 | Very low | 114 Ų | 114 | 121.5 Ų | 121.5 | 74% | 0.74 | 65% | 0.653 | S | S | * | * | trans | -70.5 | 136.9 | -160.2 | -23 | 35.5 | 0 | 0 | 0 | 116.6 | Q160 | P158-Q160 VanDerWaalsContact C-N 3.25Å; P158-Q160 PolarHBondContact O-N 3.45Å | ||
| 159 | T | 43.8 | Very low | 43.3 | Very low | 139 Ų | 139 | 124.1 Ų | 124.1 | 85% | 0.853 | 67% | 0.669 | S | S | * | * | trans | -84 | 42.1 | -177.7 | 49.8 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 160 | Q | 41.4 | Very low | 43.2 | Very low | 153 Ų | 153 | 126.9 Ų | 126.9 | 72% | 0.715 | 69% | 0.691 | S | S | * | * | trans | -120 | 135.5 | -178.9 | -65.5 | -70.5 | -21.5 | 0 | 0 | 110.8 | P158 | P158-Q160 VanDerWaalsContact C-N 3.25Å; P158-Q160 PolarHBondContact O-N 3.45Å | ||
| 161 | S | 46 | Very low | 42.8 | Very low | 127 Ų | 127 | 128.1 Ų | 128.1 | 89% | 0.888 | 70% | 0.702 | S | S | * | * | trans | 61.8 | 68.7 | -179.9 | 63.9 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 162 | S | 37.7 | Very low | 42.5 | Very low | 71 Ų | 71 | 128.4 Ų | 128.4 | 50% | 0.497 | 72% | 0.718 | S | S | . | * | trans | -134.6 | 128.6 | 151.2 | -179.7 | 0 | 0 | 0 | 0 | 110.1 | F164 F165 | S162-F164 PolarHBondContact O-N 3.5Å; S162-F164 VanDerWaalsContact O-N 3.13Å; S162-F165 PolarHBondContact O-N 3.47Å; S162-F165 VanDerWaalsContact O-N 3.14Å | ||
| 163 | I | 47.2 | Very low | 41.9 | Very low | 173 Ų | 173 | 135.9 Ų | 135.9 | 89% | 0.887 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.3 | -15.3 | -171.1 | -51.3 | 173.9 | 0 | 0 | 0 | 112 | ||
| 164 | F | 45.4 | Very low | 41.5 | Very low | 190 Ų | 190 | 133.8 Ų | 133.8 | 83% | 0.833 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.4 | -4.1 | 176.1 | -84.6 | -82.6 | 0 | 0 | 0 | 115.2 | S162 | S162-F164 PolarHBondContact O-N 3.5Å; S162-F164 VanDerWaalsContact O-N 3.13Å |
| 165 | F | 46.9 | Very low | 40.7 | Very low | 172 Ų | 172 | 136.9 Ų | 136.9 | 75% | 0.754 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -128 | 104.1 | 173.6 | -68.5 | -80.1 | 0 | 0 | 0 | 110.1 | S162 | S162-F165 PolarHBondContact O-N 3.47Å; S162-F165 VanDerWaalsContact O-N 3.14Å |
| 166 | Q | 40.2 | Very low | 40.3 | Very low | 184 Ų | 184 | 142.3 Ų | 142.3 | 86% | 0.86 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 136.9 | 175.8 | -71 | -179.8 | -28.8 | 0 | 0 | 110.6 | ||
| 167 | P | 40.3 | Very low | 39.7 | Very low | 116 Ų | 116 | 145.3 Ų | 145.3 | 75% | 0.753 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 137.9 | 178.1 | 28.7 | -34.2 | 0 | 0 | 0 | 111.4 | ||
| 168 | I | 42.2 | Very low | 39.7 | Very low | 159 Ų | 159 | 146.9 Ų | 146.9 | 82% | 0.815 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 138.2 | 169.8 | -63.4 | 172.5 | 0 | 0 | 0 | 108.6 | ||
| 169 | P | 35.4 | Very low | 39.5 | Very low | 105 Ų | 105 | 146.3 Ų | 146.3 | 68% | 0.682 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 153.7 | -167.1 | 18.4 | -32.3 | 0 | 0 | 0 | 115.5 | K171 | P169-K171 PolarHBondContact O-N 3.2Š|
| 170 | P | 42.4 | Very low | 39.4 | Very low | 131 Ų | 131 | 147.7 Ų | 147.7 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | S | Bend | trans | -77.8 | 84.3 | -161.6 | 31.4 | -37.6 | 0 | 0 | 0 | 113.9 | ||
| 171 | K | 36.4 | Very low | 39.3 | Very low | 205 Ų | 205 | 145.8 Ų | 145.8 | 89% | 0.891 | 80% | 0.801 | S | S | * | * | trans | -129.3 | -0.6 | 159.7 | -73.3 | -166.2 | 175.5 | -177.3 | 0 | 114.9 | P169 | P169-K171 PolarHBondContact O-N 3.2Š| ||
| 172 | A | 40.6 | Very low | 39.2 | Very low | 99 Ų | 99 | 148.4 Ų | 148.4 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | S | Bend | trans | -82.2 | 138.9 | 167.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 173 | K | 34.3 | Very low | 39.3 | Very low | 207 Ų | 207 | 153.5 Ų | 153.5 | 90% | 0.9 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -82 | 154.9 | -173.7 | -64.2 | 175 | -177.5 | 175.6 | 0 | 111.9 | ||
| 174 | S | 38.8 | Very low | 39.1 | Very low | 117 Ų | 117 | 147.6 Ų | 147.6 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 144.3 | -177.6 | 49.7 | 0 | 0 | 0 | 0 | 113.7 | ||
| 175 | V | 28.3 | Very low | 39.1 | Very low | 143 Ų | 143 | 145 Ų | 145 | 87% | 0.867 | 79% | 0.793 | S | S | * | * | trans | -132.7 | 137.2 | 153.1 | -178.9 | 0 | 0 | 0 | 0 | 108 | ||||
| 176 | R | 36 | Very low | 38.8 | Very low | 214 Ų | 214 | 141.5 Ų | 141.5 | 81% | 0.808 | 78% | 0.783 | S | S | * | * | trans | -116.2 | 131.6 | -175.5 | 174.9 | -166.2 | -168.4 | 176.3 | 6.7 | 108.4 | ||||
| 177 | C | 29.9 | Very low | 39.1 | Very low | 127 Ų | 127 | 136.3 Ų | 136.3 | 86% | 0.858 | 77% | 0.772 | S | S | * | * | trans | -146.1 | 132.7 | 162.2 | -100.1 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 178 | N | 40.7 | Very low | 39.2 | Very low | 138 Ų | 138 | 134.3 Ų | 134.3 | 74% | 0.738 | 76% | 0.76 | S | S | * | * | trans | -89.1 | 138.9 | 170.6 | -58.4 | -6 | 0 | 0 | 0 | 108.7 | ||||
| 179 | S | 35.5 | Very low | 39 | Very low | 103 Ų | 103 | 130.4 Ų | 130.4 | 72% | 0.72 | 74% | 0.738 | S | S | * | * | trans | -164.3 | 117.5 | 155 | -174.4 | 0 | 0 | 0 | 0 | 108.4 | V181 | S179-V181 PolarHBondContact O-N 3.02Š| ||
| 180 | D | 41.4 | Very low | 39.5 | Very low | 167 Ų | 167 | 128.8 Ų | 128.8 | 89% | 0.893 | 73% | 0.727 | S | S | * | * | trans | -73.5 | 105.6 | 178.7 | -60.2 | -76.5 | 0 | 0 | 0 | 110.2 | ||||
| 181 | V | 40.6 | Very low | 39.7 | Very low | 114 Ų | 114 | 128.5 Ų | 128.5 | 69% | 0.691 | 72% | 0.717 | S | S | * | * | trans | -120.5 | 111.4 | 173.1 | -177.8 | 0 | 0 | 0 | 0 | 108.2 | S179 K183 | S179-V181 PolarHBondContact O-N 3.02Å; V181-K183 PolarHBondContact O-N 2.99Å | ||
| 182 | L | 43.6 | Very low | 40.1 | Very low | 181 Ų | 181 | 124.4 Ų | 124.4 | 95% | 0.948 | 70% | 0.699 | S | S | * | * | trans | -57.1 | 110.2 | 173.6 | -76.5 | 159.1 | 0 | 0 | 0 | 109.1 | ||||
| 183 | K | 40 | Very low | 40.1 | Very low | 179 Ų | 179 | 125 Ų | 125 | 78% | 0.778 | 69% | 0.685 | S | S | * | * | trans | -94.2 | 113.3 | -168.4 | -171.5 | 176.7 | -177 | 179 | 0 | 110.4 | V181 V185 | V181-K183 PolarHBondContact O-N 2.99Å; K183-V185 WeakPolarHBondContact O-CG2 3.46Å; K183-V185 PolarHBondContact O-N 3.03Å | ||
| 184 | A | 42.4 | Very low | 40.6 | Very low | 49 Ų | 49 | 121.8 Ų | 121.8 | 41% | 0.405 | 67% | 0.671 | S | S | . | * | trans | -52.2 | 134.4 | 169.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | E189 | A184-E189 WeakPolarHBondContact CA-OE2 3.27Å; A184-E189 HydrophobicContact CB-CB 4.41Å; A184-E189 HydrophobicContact CB-CG 4.36Å | ||
| 185 | V | 44.7 | Very low | 40.9 | Very low | 134 Ų | 134 | 120 Ų | 120 | 81% | 0.812 | 66% | 0.664 | S | S | * | * | trans | -99.8 | -17.9 | -162.6 | -172.2 | 0 | 0 | 0 | 0 | 111.7 | K183 E189 | K183-V185 WeakPolarHBondContact O-CG2 3.46Å; K183-V185 PolarHBondContact O-N 3.03Å; V185-E189 PolarHBondContact N-OE2 2.9Å | ||
| 186 | N | 40.9 | Very low | 41.5 | Very low | 99 Ų | 99 | 119.2 Ų | 119.2 | 53% | 0.529 | 65% | 0.651 | S | S | . | * | trans | -141.9 | 151.7 | -174.5 | -160.1 | -11.1 | 0 | 0 | 0 | 113.9 | S188 E189 V190 | N186-S188 VanDerWaalsContact CG-OG 3.26Å; N186-S188 PolarHBondContact ND2-OG 3.04Å; N186-S188 PolarHBondContact O-N 3.18Å; N186-E189 HydrophobicContact CB-CB 4.49Å; N186-E189 PolarHBondContact N-OE2 3.22Å; N186-E189 WeakPolarHBondContact O-CA 3.5Å; N186-E189 WeakPolarHBondContact O-CB 3.45Å; N186-E189 PolarHBondContact O-N 3.47Å; N186-V190 PolarHBondContact O-N 3Å | ||
| 187 | A | 45.8 | Very low | 41.8 | Very low | 76 Ų | 76 | 114.1 Ų | 114.1 | 63% | 0.628 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -63.6 | -26.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | E189 V190 L191 | A187-E189 PolarHBondContact O-N 3.13Å; A187-V190 PolarHBondContact O-N 2.66Å; A187-L191 PolarHBondContact O-N 3.18Å |
| 188 | S | 42.9 | Very low | 42.3 | Very low | 73 Ų | 73 | 113.2 Ų | 113.2 | 51% | 0.51 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -63.7 | -29.8 | 169.6 | 59 | 0 | 0 | 0 | 0 | 112.9 | N186 F192 | N186-S188 VanDerWaalsContact CG-OG 3.26Å; N186-S188 PolarHBondContact ND2-OG 3.04Å; N186-S188 PolarHBondContact O-N 3.18Å; S188-F192 WeakPolarHBondContact O-CB 3.11Å; S188-F192 PolarHBondContact O-N 3.27Å |
| 189 | E | 38.2 | Very low | 42.4 | Very low | 77 Ų | 77 | 112.6 Ų | 112.6 | 36% | 0.36 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -80.2 | -37.2 | -179.4 | -148.3 | 168.1 | -151.3 | 0 | 0 | 110.6 | A184 V185 N186 A187 L191 F192 H193 | A184-E189 WeakPolarHBondContact CA-OE2 3.27Å; A184-E189 HydrophobicContact CB-CB 4.41Å; A184-E189 HydrophobicContact CB-CG 4.36Å; V185-E189 PolarHBondContact N-OE2 2.9Å; N186-E189 HydrophobicContact CB-CB 4.49Å; N186-E189 PolarHBondContact N-OE2 3.22Å; N186-E189 WeakPolarHBondContact O-CA 3.5Å; N186-E189 WeakPolarHBondContact O-CB 3.45Å; N186-E189 PolarHBondContact O-N 3.47Å; A187-E189 PolarHBondContact O-N 3.13Å; E189-L191 VanDerWaalsContact C-N 3.35Å; E189-F192 WeakPolarHBondContact O-CB 3.2Å; E189-F192 PolarHBondContact O-N 2.9Å; E189-H193 PolarHBondContact O-CD2 3Å; E189-H193 PolarHBondContact O-N 3.13Å |
| 190 | V | 45.8 | Very low | 42.8 | Very low | 72 Ų | 72 | 115.4 Ų | 115.4 | 44% | 0.436 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -58.3 | -47.3 | 166.5 | 179.1 | 0 | 0 | 0 | 0 | 110.5 | N186 A187 F192 H193 F194 | N186-V190 PolarHBondContact O-N 3Å; A187-V190 PolarHBondContact O-N 2.66Å; V190-F192 VanDerWaalsContact C-N 3.31Å; V190-F192 PolarHBondContact O-N 3.46Å; V190-H193 PolarHBondContact O-N 3.43Å; V190-F194 HydrophobicContact CG1-CD2 3.95Å; V190-F194 HydrophobicContact CG1-CE2 3.86Å; V190-F194 WeakPolarHBondContact O-CD2 3.48Å; V190-F194 PolarHBondContact O-N 3.1Å |
| 191 | L | 47.2 | Very low | 42.7 | Very low | 124 Ų | 124 | 114.8 Ų | 114.8 | 65% | 0.649 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -64.2 | -35.3 | 176.7 | -169.1 | 68.4 | 0 | 0 | 0 | 112.4 | A187 E189 F194 A195 | A187-L191 PolarHBondContact O-N 3.18Å; E189-L191 VanDerWaalsContact C-N 3.35Å; L191-F194 PolarHBondContact O-N 3.06Å; L191-A195 WeakPolarHBondContact O-CB 3.36Å; L191-A195 PolarHBondContact O-N 3.39Å |
| 192 | F | 44 | Very low | 42.9 | Very low | 119 Ų | 119 | 119.3 Ų | 119.3 | 52% | 0.522 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -64 | -43 | 175.1 | -164.8 | -103.2 | 0 | 0 | 0 | 111.7 | S188 E189 V190 A195 Q196 | S188-F192 WeakPolarHBondContact O-CB 3.11Å; S188-F192 PolarHBondContact O-N 3.27Å; E189-F192 WeakPolarHBondContact O-CB 3.2Å; E189-F192 PolarHBondContact O-N 2.9Å; V190-F192 VanDerWaalsContact C-N 3.31Å; V190-F192 PolarHBondContact O-N 3.46Å; F192-A195 PolarHBondContact O-N 3.33Å; F192-Q196 HydrophobicContact CE1-CG 4.42Å; F192-Q196 WeakPolarHBondContact O-CG 3.37Å; F192-Q196 PolarHBondContact O-N 2.67Å |
| 193 | H | 40.7 | Very low | 42.6 | Very low | 112 Ų | 112 | 117.8 Ų | 117.8 | 52% | 0.519 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -64.3 | -37.3 | 172.3 | -72.9 | -55.5 | 0 | 0 | 0 | 113 | E189 V190 Q196 L197 | E189-H193 PolarHBondContact O-CD2 3Å; E189-H193 PolarHBondContact O-N 3.13Å; V190-H193 PolarHBondContact O-N 3.43Å; H193-Q196 PolarHBondContact O-N 2.74Å; H193-L197 PolarHBondContact O-N 2.87Å |
| 194 | F | 44.3 | Very low | 42.6 | Very low | 139 Ų | 139 | 116.4 Ų | 116.4 | 61% | 0.61 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -65.7 | -37.2 | 172 | -86.5 | -73 | 0 | 0 | 0 | 112.8 | V190 L191 Q196 L197 | V190-F194 HydrophobicContact CG1-CD2 3.95Å; V190-F194 HydrophobicContact CG1-CE2 3.86Å; V190-F194 WeakPolarHBondContact O-CD2 3.48Å; V190-F194 PolarHBondContact O-N 3.1Å; L191-F194 PolarHBondContact O-N 3.06Å; F194-Q196 VanDerWaalsContact C-N 3.34Å; F194-L197 HydrophobicContact CD1-CD1 4.07Å |
| 195 | A | 45.3 | Very low | 42.5 | Very low | 81 Ų | 81 | 121.2 Ų | 121.2 | 67% | 0.669 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -76.2 | -17.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | L191 F192 | L191-A195 WeakPolarHBondContact O-CB 3.36Å; L191-A195 PolarHBondContact O-N 3.39Å; F192-A195 PolarHBondContact O-N 3.33Å |
| 196 | Q | 42.4 | Very low | 42.2 | Very low | 125 Ų | 125 | 121.4 Ų | 121.4 | 58% | 0.584 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -94.7 | -6.2 | 174.7 | -72.9 | -170.9 | -25.8 | 0 | 0 | 114 | F192 H193 F194 | F192-Q196 HydrophobicContact CE1-CG 4.42Å; F192-Q196 WeakPolarHBondContact O-CG 3.37Å; F192-Q196 PolarHBondContact O-N 2.67Å; H193-Q196 PolarHBondContact O-N 2.74Å; F194-Q196 VanDerWaalsContact C-N 3.34Å |
| 197 | L | 41.5 | Very low | 42.3 | Very low | 108 Ų | 108 | 122.9 Ų | 122.9 | 57% | 0.565 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -63 | 130.6 | 164.6 | -73.5 | 168.7 | 0 | 0 | 0 | 108.5 | H193 F194 T199 | H193-L197 PolarHBondContact O-N 2.87Å; F194-L197 HydrophobicContact CD1-CD1 4.07Å; L197-T199 PolarHBondContact O-N 3.17Å |
| 198 | P | 40.4 | Very low | 42 | Very low | 108 Ų | 108 | 126.2 Ų | 126.2 | 70% | 0.701 | 66% | 0.663 | S | S | * | * | trans | -62.8 | 116.2 | 179 | 25.3 | -32.9 | 0 | 0 | 0 | 109.1 | I200 | P198-I200 PolarHBondContact O-N 2.88Š| ||
| 199 | T | 41.9 | Very low | 42.3 | Very low | 125 Ų | 125 | 132.4 Ų | 132.4 | 77% | 0.767 | 68% | 0.681 | S | S | * | * | trans | -58.7 | 111.3 | 164.9 | 44.1 | 0 | 0 | 0 | 0 | 107.6 | L197 E201 | L197-T199 PolarHBondContact O-N 3.17Å; T199-E201 PolarHBondContact O-N 2.89Å | ||
| 200 | I | 43.6 | Very low | 42.3 | Very low | 161 Ų | 161 | 138.5 Ų | 138.5 | 83% | 0.826 | 71% | 0.707 | S | S | * | * | trans | -72.5 | 79.8 | 173.5 | -52.8 | 177.7 | 0 | 0 | 0 | 107.3 | P198 | P198-I200 PolarHBondContact O-N 2.88Š| ||
| 201 | E | 40.6 | Very low | 42.1 | Very low | 154 Ų | 154 | 139.9 Ų | 139.9 | 72% | 0.72 | 72% | 0.719 | S | S | * | * | trans | -52.8 | 138.9 | 158.2 | -68.6 | -165.1 | 135.1 | 0 | 0 | 108.1 | T199 I203 | T199-E201 PolarHBondContact O-N 2.89Å; E201-I203 PolarHBondContact O-N 3Å | ||
| 202 | K | 45.1 | Very low | 41.8 | Very low | 209 Ų | 209 | 141.3 Ų | 141.3 | 91% | 0.909 | 73% | 0.727 | S | S | * | * | trans | -72.9 | 70.7 | 178.2 | -74.7 | -176.6 | 174.5 | 178.5 | 0 | 110.6 | N204 | K202-N204 PolarHBondContact O-N 3.25Š| ||
| 203 | I | 37.2 | Very low | 41.4 | Very low | 149 Ų | 149 | 143.5 Ų | 143.5 | 76% | 0.764 | 74% | 0.738 | S | S | * | * | trans | -65.3 | 106 | 165.3 | -60.8 | -179.1 | 0 | 0 | 0 | 106.6 | E201 | E201-I203 PolarHBondContact O-N 3Š| ||
| 204 | N | 38.5 | Very low | 41.3 | Very low | 151 Ų | 151 | 147.6 Ų | 147.6 | 81% | 0.807 | 76% | 0.755 | S | S | * | * | trans | -60.2 | 144.2 | 178.5 | -169.7 | 15 | 0 | 0 | 0 | 110.1 | K202 N206 | K202-N204 PolarHBondContact O-N 3.25Å; N204-N206 PolarHBondContact O-N 2.85Å; N204-N206 VanDerWaalsContact O-N 3.11Å | ||
| 205 | N | 42 | Very low | 41 | Very low | 150 Ų | 150 | 148 Ų | 148 | 80% | 0.802 | 76% | 0.762 | S | S | * | * | trans | -71.2 | 107.9 | -165.2 | -139.8 | -0.4 | 0 | 0 | 0 | 110.9 | ||||
| 206 | N | 38.5 | Very low | 40.4 | Very low | 138 Ų | 138 | 151.8 Ų | 151.8 | 74% | 0.738 | 77% | 0.766 | S | S | * | * | trans | -160.9 | 100.2 | 157.9 | -110.3 | -37.8 | 0 | 0 | 0 | 113.5 | N204 | N204-N206 PolarHBondContact O-N 2.85Å; N204-N206 VanDerWaalsContact O-N 3.11Å | ||
| 207 | N | 42.9 | Very low | 40.1 | Very low | 129 Ų | 129 | 156.7 Ų | 156.7 | 69% | 0.69 | 78% | 0.778 | S | S | * | * | trans | 57 | 137.1 | 144 | -58.4 | -31.2 | 0 | 0 | 0 | 121.7 | ||||
| 208 | N | 38.8 | Very low | 39.8 | Very low | 146 Ų | 146 | 160.8 Ų | 160.8 | 78% | 0.781 | 81% | 0.808 | S | S | * | * | trans | 77.9 | 112 | 160.4 | -58.2 | -33.7 | 0 | 0 | 0 | 119 | ||||
| 209 | K | 49.8 | Very low | 39.7 | Very low | 204 Ų | 204 | 163.5 Ų | 163.5 | 89% | 0.887 | 81% | 0.813 | S | S | * | * | trans | 8.3 | 114.6 | 152.8 | -63.7 | 177.4 | 175.6 | 175.7 | 0 | 116.7 | ||||
| 210 | K | 37.5 | Very low | 39.6 | Very low | 205 Ų | 205 | 165.5 Ų | 165.5 | 89% | 0.891 | 82% | 0.816 | S | S | * | * | trans | -141.5 | 145.7 | 147.3 | -97.9 | 117.7 | -176.7 | -175.6 | 0 | 111 | ||||
| 211 | S | 42.5 | Very low | 39.4 | Very low | 101 Ų | 101 | 165.7 Ų | 165.7 | 71% | 0.706 | 82% | 0.815 | S | S | * | * | trans | -72.7 | 138.6 | 174.7 | -173.6 | 0 | 0 | 0 | 0 | 110.2 | H213 | S211-H213 PolarHBondContact O-N 3.24Å; S211-H213 VanDerWaalsContact O-N 3.1Å | ||
| 212 | L | 39.8 | Very low | 39.3 | Very low | 154 Ų | 154 | 166.4 Ų | 166.4 | 81% | 0.806 | 82% | 0.821 | S | S | * | * | trans | -76.8 | 93 | 167.6 | -86.8 | 165.4 | 0 | 0 | 0 | 109 | F214 | L212-F214 PolarHBondContact O-N 2.84Š| ||
| 213 | H | 36.6 | Very low | 39 | Very low | 165 Ų | 165 | 163.8 Ų | 163.8 | 76% | 0.764 | 82% | 0.815 | S | S | * | * | trans | -71.7 | 115.9 | 173.4 | -120.4 | -81.3 | 0 | 0 | 0 | 109.9 | S211 I215 | S211-H213 PolarHBondContact O-N 3.24Å; S211-H213 VanDerWaalsContact O-N 3.1Å; H213-I215 PolarHBondContact O-N 2.79Å | ||
| 214 | F | 38.1 | Very low | 39.1 | Very low | 198 Ų | 198 | 164.7 Ų | 164.7 | 87% | 0.868 | 82% | 0.819 | S | S | * | * | trans | -70.2 | 115 | 173 | -65.2 | -88.3 | 0 | 0 | 0 | 110 | L212 | L212-F214 PolarHBondContact O-N 2.84Š| ||
| 215 | I | 38.6 | Very low | 39.1 | Very low | 146 Ų | 146 | 165.7 Ų | 165.7 | 75% | 0.749 | 82% | 0.819 | S | S | * | * | trans | -96.2 | 95.1 | 171.3 | -59.5 | -179.6 | 0 | 0 | 0 | 108.3 | H213 R217 | H213-I215 PolarHBondContact O-N 2.79Å; I215-R217 HydrophobicContact CG2-CG 4.29Å; I215-R217 PolarHBondContact O-N 3Å | ||
| 216 | H | 32.1 | Very low | 38.9 | Very low | 162 Ų | 162 | 166.9 Ų | 166.9 | 75% | 0.75 | 82% | 0.821 | S | S | * | * | trans | -78.4 | 94.1 | 170.5 | -171.4 | -67.9 | 0 | 0 | 0 | 109.4 | V218 | H216-V218 PolarHBondContact O-N 2.85Š| ||
| 217 | R | 35.5 | Very low | 38.9 | Very low | 227 Ų | 227 | 169.3 Ų | 169.3 | 86% | 0.857 | 83% | 0.828 | S | S | * | * | trans | -74.1 | 119.5 | 165.8 | -82.7 | -174.1 | 172.3 | 159.8 | -0.8 | 109.2 | I215 | I215-R217 HydrophobicContact CG2-CG 4.29Å; I215-R217 PolarHBondContact O-N 3Å | ||
| 218 | V | 34.9 | Very low | 38.6 | Very low | 195 Ų | 195 | 173 Ų | 173 | 100% | 1.182 | 84% | 0.84 | S | S | * | * | trans | -79.5 | 0 | 165.2 | -174.8 | 0 | 0 | 0 | 0 | 108.6 | H216 | H216-V218 PolarHBondContact O-N 2.85Š|
Retrieved 218 of 218 residues in 164.1 ms
(Link to these results)