| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 47.6 | Very low | 49.6 | Very low | 226 Ų | 226 | 152.5 Ų | 152.5 | 100% | 1.113 | 79% | 0.788 | S | S | * | * | 0 | 108 | 0 | -74.7 | -174.3 | 147 | 0 | 0 | 108.4 | |||||
| 2 | P | 56 | Low | 48.5 | Very low | 124 Ų | 124 | 150 Ų | 150 | 81% | 0.805 | 79% | 0.793 | S | S | * | * | trans | -93.8 | 125.6 | 171 | 31.4 | -23.3 | 0 | 0 | 0 | 110.1 | T4 | P2-T4 PolarHBondContact O-N 3.41Š| ||
| 3 | H | 52.6 | Low | 48.1 | Very low | 172 Ų | 172 | 152.4 Ų | 152.4 | 80% | 0.796 | 79% | 0.793 | S | S | * | * | trans | -76 | 113.9 | 174 | -68.4 | -81.2 | 0 | 0 | 0 | 109.6 | ||||
| 4 | T | 57.4 | Low | 47.1 | Very low | 130 Ų | 130 | 149.8 Ų | 149.8 | 80% | 0.798 | 80% | 0.795 | S | S | * | * | trans | -78.6 | 116.2 | 171.9 | 46.5 | 0 | 0 | 0 | 0 | 109.7 | P2 | P2-T4 PolarHBondContact O-N 3.41Š| ||
| 5 | H | 48.2 | Very low | 46.9 | Very low | 172 Ų | 172 | 148.7 Ų | 148.7 | 80% | 0.796 | 80% | 0.796 | S | S | * | * | trans | -77 | 114.5 | 168.3 | -75.8 | 89.7 | 0 | 0 | 0 | 109.3 | H7 | H5-H7 PolarHBondContact O-N 3.46Š| ||
| 6 | S | 51.4 | Low | 46.2 | Very low | 111 Ų | 111 | 143.6 Ų | 143.6 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | trans | -80.8 | 111.8 | 171.1 | -71.7 | 0 | 0 | 0 | 0 | 110.1 | I8 | S6-I8 PolarHBondContact O-N 3.48Š| ||
| 7 | H | 50.3 | Low | 45.8 | Very low | 183 Ų | 183 | 142 Ų | 142 | 85% | 0.847 | 79% | 0.785 | S | S | * | * | trans | -72.5 | 118.3 | 166.2 | -87.7 | -102.5 | 0 | 0 | 0 | 109.6 | H5 | H5-H7 PolarHBondContact O-N 3.46Š| ||
| 8 | I | 48 | Very low | 45.4 | Very low | 132 Ų | 132 | 143.8 Ų | 143.8 | 68% | 0.677 | 79% | 0.786 | S | S | * | * | trans | -84.4 | 112.3 | 168.1 | -63.7 | 170.4 | 0 | 0 | 0 | 107.1 | S6 Y10 | S6-I8 PolarHBondContact O-N 3.48Å; I8-Y10 HydrophobicContact CG2-CE2 4.15Å | ||
| 9 | S | 46.2 | Very low | 45.1 | Very low | 92 Ų | 92 | 146.7 Ų | 146.7 | 64% | 0.643 | 79% | 0.786 | S | S | * | * | trans | -89.7 | 117 | 174.9 | -156.4 | 0 | 0 | 0 | 0 | 108.9 | H11 | S9-H11 PolarHBondContact O-N 3.48Š| ||
| 10 | Y | 44.2 | Very low | 44.7 | Very low | 197 Ų | 197 | 146.1 Ų | 146.1 | 77% | 0.773 | 78% | 0.782 | S | S | * | * | trans | -80.4 | 116 | 172.5 | -69.8 | -87.6 | 0 | 0 | 0 | 109.2 | I8 | I8-Y10 HydrophobicContact CG2-CE2 4.15Š| ||
| 11 | H | 43.6 | Very low | 44.1 | Very low | 139 Ų | 139 | 144.2 Ų | 144.2 | 64% | 0.644 | 78% | 0.781 | S | S | * | * | trans | -89.8 | 111 | 170.8 | -60.3 | -31.9 | 0 | 0 | 0 | 108.9 | S9 F13 | S9-H11 PolarHBondContact O-N 3.48Å; H11-F13 HydrophobicContact CB-CE2 4.18Å; H11-F13 HydrophobicContact CB-CZ 4.12Å; H11-F13 PolarHBondContact O-N 3.44Å | ||
| 12 | S | 36.3 | Very low | 43.5 | Very low | 122 Ų | 122 | 139.4 Ų | 139.4 | 85% | 0.853 | 76% | 0.764 | S | S | * | * | trans | -80.5 | 111.2 | 170 | -56.9 | 0 | 0 | 0 | 0 | 109 | S14 | S12-S14 PolarHBondContact O-N 3.49Š| ||
| 13 | F | 43.6 | Very low | 42.5 | Very low | 181 Ų | 181 | 139.1 Ų | 139.1 | 79% | 0.794 | 77% | 0.765 | S | S | * | * | trans | -83.9 | 108.7 | 170.9 | -59.8 | -80.2 | 0 | 0 | 0 | 109 | H11 T15 | H11-F13 HydrophobicContact CB-CE2 4.18Å; H11-F13 HydrophobicContact CB-CZ 4.12Å; H11-F13 PolarHBondContact O-N 3.44Å; F13-T15 PolarHBondContact O-N 3.43Å | ||
| 14 | S | 34.5 | Very low | 41.7 | Very low | 116 Ų | 116 | 138.4 Ų | 138.4 | 81% | 0.811 | 77% | 0.765 | S | S | * | * | trans | -79 | 105 | 169.4 | 175.4 | 0 | 0 | 0 | 0 | 108.9 | S12 G16 | S12-S14 PolarHBondContact O-N 3.49Å; S14-G16 PolarHBondContact O-N 3.12Å; S14-G16 VanDerWaalsContact O-N 3.12Å | ||
| 15 | T | 43.6 | Very low | 40.9 | Very low | 133 Ų | 133 | 137 Ų | 137 | 82% | 0.816 | 76% | 0.758 | S | S | * | * | trans | -78.6 | 93.2 | 169.6 | 53.3 | 0 | 0 | 0 | 0 | 108.8 | F13 V17 | F13-T15 PolarHBondContact O-N 3.43Å; T15-V17 PolarHBondContact O-N 3.35Å | ||
| 16 | G | 35.8 | Very low | 40.5 | Very low | 67 Ų | 67 | 134.2 Ų | 134.2 | 69% | 0.691 | 76% | 0.756 | S | S | * | * | trans | -67 | 121.7 | 166.3 | 0 | 0 | 0 | 0 | 0 | 110 | S14 H18 | S14-G16 PolarHBondContact O-N 3.12Å; S14-G16 VanDerWaalsContact O-N 3.12Å; G16-H18 PolarHBondContact O-N 3.44Å | ||
| 17 | V | 39.5 | Very low | 39.7 | Very low | 117 Ų | 117 | 135.2 Ų | 135.2 | 71% | 0.709 | 76% | 0.758 | S | S | * | * | trans | -78.3 | 105.2 | 164.3 | -87.5 | 0 | 0 | 0 | 0 | 108 | T15 Y19 | T15-V17 PolarHBondContact O-N 3.35Å; V17-Y19 HydrophobicContact CB-CE2 4.28Å; V17-Y19 HydrophobicContact CG2-CE2 4.08Å | ||
| 18 | H | 38.6 | Very low | 39.3 | Very low | 174 Ų | 174 | 131.2 Ų | 131.2 | 81% | 0.806 | 75% | 0.746 | S | S | * | * | trans | -82.5 | 108.3 | 170.1 | -155.8 | -101.9 | 0 | 0 | 0 | 107.5 | G16 D20 | G16-H18 PolarHBondContact O-N 3.44Å; H18-D20 PolarHBondContact O-N 3.25Å | ||
| 19 | Y | 40 | Very low | 38.5 | Very low | 200 Ų | 200 | 131.8 Ų | 131.8 | 78% | 0.784 | 75% | 0.751 | S | S | * | * | trans | -81.3 | 94.4 | 171.6 | -70.5 | -84.9 | 0 | 0 | 0 | 108.3 | V17 | V17-Y19 HydrophobicContact CB-CE2 4.28Å; V17-Y19 HydrophobicContact CG2-CE2 4.08Å | ||
| 20 | D | 36.8 | Very low | 38 | Very low | 134 Ų | 134 | 133.8 Ų | 133.8 | 72% | 0.717 | 75% | 0.753 | S | S | * | * | trans | -88.6 | 128.5 | 165.8 | -157.6 | -2.9 | 0 | 0 | 0 | 110.1 | H18 T22 | H18-D20 PolarHBondContact O-N 3.25Å; D20-T22 PolarHBondContact O-N 3.37Å | ||
| 21 | S | 32.5 | Very low | 37.6 | Very low | 107 Ų | 107 | 131.2 Ų | 131.2 | 75% | 0.748 | 75% | 0.751 | S | S | * | * | trans | -96.1 | 74.9 | -164.6 | -63.1 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 22 | T | 35.7 | Very low | 37.3 | Very low | 125 Ų | 125 | 130.8 Ų | 130.8 | 77% | 0.767 | 76% | 0.758 | S | S | * | * | trans | -157.2 | 74.1 | 165.6 | 53.7 | 0 | 0 | 0 | 0 | 112 | D20 | D20-T22 PolarHBondContact O-N 3.37Š| ||
| 23 | S | 32.9 | Very low | 37.1 | Very low | 118 Ų | 118 | 132.2 Ų | 132.2 | 83% | 0.825 | 75% | 0.751 | S | S | * | * | trans | -160.5 | 103.4 | 154.2 | -139.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 24 | I | 37.8 | Very low | 36.6 | Very low | 156 Ų | 156 | 129.2 Ų | 129.2 | 80% | 0.8 | 75% | 0.75 | S | S | * | * | trans | -60 | 124.1 | 170.4 | -62.8 | 164.8 | 0 | 0 | 0 | 106.9 | ||||
| 25 | P | 38.8 | Very low | 36.6 | Very low | 100 Ų | 100 | 130 Ų | 130 | 65% | 0.649 | 75% | 0.75 | S | S | * | * | trans | -64.3 | 136.6 | 172.8 | 27.2 | -32.8 | 0 | 0 | 0 | 108.8 | T27 | P25-T27 PolarHBondContact O-N 3.18Š| ||
| 26 | P | 41 | Very low | 35.9 | Very low | 114 Ų | 114 | 130.9 Ų | 130.9 | 74% | 0.74 | 75% | 0.745 | S | S | * | * | trans | -67.1 | 110.2 | 171.8 | 26.3 | -31 | 0 | 0 | 0 | 109.1 | T28 | P26-T28 PolarHBondContact O-N 3.08Å; P26-T28 VanDerWaalsContact O-N 3.14Å | ||
| 27 | T | 34.4 | Very low | 35.8 | Very low | 133 Ų | 133 | 138.5 Ų | 138.5 | 82% | 0.816 | 75% | 0.754 | S | S | * | * | trans | -66 | 103.1 | 156.1 | -7.7 | 0 | 0 | 0 | 0 | 106.3 | P25 | P25-T27 PolarHBondContact O-N 3.18Š| ||
| 28 | T | 41.2 | Very low | 35.5 | Very low | 98 Ų | 98 | 141.3 Ų | 141.3 | 60% | 0.601 | 76% | 0.76 | S | S | * | * | trans | -110.5 | 96.2 | 168 | -49.3 | 0 | 0 | 0 | 0 | 108.1 | P26 I30 | P26-T28 PolarHBondContact O-N 3.08Å; P26-T28 VanDerWaalsContact O-N 3.14Å; T28-I30 HydrophobicContact CG2-CD1 3.9Å; T28-I30 HydrophobicContact CG2-CG1 3.42Å; T28-I30 VanDerWaalsContact CG2-CG1 3.42Å; T28-I30 PolarHBondContact O-N 3.04Å | ||
| 29 | D | 31.9 | Very low | 35.1 | Very low | 145 Ų | 145 | 142 Ų | 142 | 78% | 0.775 | 76% | 0.763 | S | S | * | * | trans | -59.8 | 106.6 | 156.2 | -75.4 | -46.5 | 0 | 0 | 0 | 107.9 | ||||
| 30 | I | 35.5 | Very low | 34.9 | Very low | 134 Ų | 134 | 138.9 Ų | 138.9 | 69% | 0.687 | 77% | 0.765 | S | S | * | * | trans | -104.6 | 85.6 | 170 | -53.2 | -178.5 | 0 | 0 | 0 | 108.1 | T28 T32 | T28-I30 HydrophobicContact CG2-CD1 3.9Å; T28-I30 HydrophobicContact CG2-CG1 3.42Å; T28-I30 VanDerWaalsContact CG2-CG1 3.42Å; T28-I30 PolarHBondContact O-N 3.04Å; I30-T32 PolarHBondContact O-N 3.41Å | ||
| 31 | I | 35.6 | Very low | 34.5 | Very low | 142 Ų | 142 | 139 Ų | 139 | 73% | 0.728 | 77% | 0.771 | S | S | * | * | trans | -54.6 | 118.6 | 153.5 | -65.4 | 168.5 | 0 | 0 | 0 | 106.9 | Q33 | I31-Q33 HydrophobicContact CG2-CG 4.49Å; I31-Q33 PolarHBondContact O-N 2.85Å; I31-Q33 VanDerWaalsContact O-N 3.16Å | ||
| 32 | T | 36.9 | Very low | 34.5 | Very low | 130 Ų | 130 | 139.5 Ų | 139.5 | 80% | 0.798 | 78% | 0.775 | S | S | * | * | trans | -79 | 97.5 | 171.2 | -47.2 | 0 | 0 | 0 | 0 | 107.6 | I30 | I30-T32 PolarHBondContact O-N 3.41Š| ||
| 33 | Q | 31.7 | Very low | 34.3 | Very low | 153 Ų | 153 | 139.5 Ų | 139.5 | 72% | 0.715 | 77% | 0.774 | S | S | * | * | trans | -72.5 | 143.6 | 168 | -82.2 | -163.2 | 1.3 | 0 | 0 | 110.8 | I31 | I31-Q33 HydrophobicContact CG2-CG 4.49Å; I31-Q33 PolarHBondContact O-N 2.85Å; I31-Q33 VanDerWaalsContact O-N 3.16Å | ||
| 34 | P | 34 | Very low | 34.1 | Very low | 118 Ų | 118 | 138.7 Ų | 138.7 | 77% | 0.766 | 77% | 0.769 | S | S | * | * | trans | -76.8 | 146.9 | 158.9 | 31.9 | -29.6 | 0 | 0 | 0 | 111 | Q36 | P34-Q36 PolarHBondContact O-N 3.32Š| ||
| 35 | T | 34.7 | Very low | 33.8 | Very low | 132 Ų | 132 | 139.4 Ų | 139.4 | 81% | 0.81 | 77% | 0.769 | S | S | * | * | trans | -44.4 | 116.2 | -171.9 | -46 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 36 | Q | 29.3 | Very low | 33.4 | Very low | 152 Ų | 152 | 140.1 Ų | 140.1 | 71% | 0.71 | 77% | 0.774 | S | S | * | * | trans | 28.3 | 109.7 | 139.6 | -61.8 | -74.1 | -23.1 | 0 | 0 | 120 | P34 | P34-Q36 PolarHBondContact O-N 3.32Š| ||
| 37 | Y | 33.6 | Very low | 33.1 | Very low | 227 Ų | 227 | 142.2 Ų | 142.2 | 89% | 0.89 | 78% | 0.777 | S | S | * | * | trans | -143.2 | 112.1 | 142.8 | -82.1 | -78.4 | 0 | 0 | 0 | 111 | ||||
| 38 | Q | 31.8 | Very low | 32.9 | Very low | 175 Ų | 175 | 143 Ų | 143 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | trans | 36.1 | 98.5 | 152.8 | -58.3 | -75.5 | 72.3 | 0 | 0 | 118 | T40 | Q38-T40 PolarHBondContact O-N 3.11Š| ||
| 39 | Q | 30.6 | Very low | 32.6 | Very low | 189 Ų | 189 | 143.3 Ų | 143.3 | 88% | 0.883 | 78% | 0.782 | S | S | * | * | trans | -84.9 | 104.9 | 169.7 | -171.3 | 173.4 | 8.8 | 0 | 0 | 110.3 | ||||
| 40 | T | 36.4 | Very low | 32.4 | Very low | 135 Ų | 135 | 142 Ų | 142 | 83% | 0.828 | 78% | 0.779 | S | S | * | * | trans | -91 | 125.2 | 158 | 42.9 | 0 | 0 | 0 | 0 | 109.4 | Q38 S42 | Q38-T40 PolarHBondContact O-N 3.11Å; T40-S42 PolarHBondContact O-N 3.27Å | ||
| 41 | T | 28.9 | Very low | 32.5 | Very low | 135 Ų | 135 | 141.3 Ų | 141.3 | 83% | 0.828 | 78% | 0.784 | S | S | * | * | trans | -64.4 | 123.2 | -179 | -28.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 42 | S | 31.6 | Very low | 32.3 | Very low | 119 Ų | 119 | 140.8 Ų | 140.8 | 83% | 0.832 | 79% | 0.787 | S | S | * | * | trans | -156.1 | 140 | 151.4 | -137.1 | 0 | 0 | 0 | 0 | 112.1 | T40 | T40-S42 PolarHBondContact O-N 3.27Š| ||
| 43 | T | 32.2 | Very low | 32.3 | Very low | 124 Ų | 124 | 141.5 Ų | 141.5 | 76% | 0.761 | 79% | 0.785 | S | S | * | * | trans | -76.5 | 136.8 | -158.6 | 39.1 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 44 | S | 28.3 | Very low | 32.4 | Very low | 101 Ų | 101 | 139.4 Ų | 139.4 | 71% | 0.706 | 78% | 0.784 | S | S | * | * | trans | 12.4 | 120.9 | 146.8 | -46.1 | 0 | 0 | 0 | 0 | 120 | ||||
| 45 | Q | 32.3 | Very low | 32.3 | Very low | 172 Ų | 172 | 140.4 Ų | 140.4 | 80% | 0.804 | 79% | 0.789 | S | S | * | * | -158.1 | 147.6 | 126.9 | -80.3 | -44.2 | -59.3 | 0 | 0 | 110.3 | |||||
| 46 | P | 29.2 | Very low | 32.5 | Very low | 115 Ų | 115 | 139.7 Ų | 139.7 | 75% | 0.747 | 78% | 0.784 | S | S | * | * | trans | -86 | 131.2 | -174.5 | 33.8 | -29.3 | 0 | 0 | 0 | 110.6 | ||||
| 47 | I | 35.9 | Very low | 32.6 | Very low | 158 Ų | 158 | 140.6 Ų | 140.6 | 81% | 0.81 | 79% | 0.788 | S | S | * | * | trans | -122.1 | 110.4 | 169.1 | -6.3 | 173.1 | 0 | 0 | 0 | 108.8 | S49 | I47-S49 PolarHBondContact O-N 3.27Š| ||
| 48 | D | 29 | Very low | 32.6 | Very low | 150 Ų | 150 | 139.7 Ų | 139.7 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | trans | -53 | 117.8 | 161.3 | 178.8 | 14.7 | 0 | 0 | 0 | 109.5 | ||||
| 49 | S | 34.8 | Very low | 32.7 | Very low | 103 Ų | 103 | 139.6 Ų | 139.6 | 72% | 0.72 | 79% | 0.789 | S | S | * | * | trans | -159.6 | 97.2 | 171.9 | -71.4 | 0 | 0 | 0 | 0 | 110.1 | I47 | I47-S49 PolarHBondContact O-N 3.27Š| ||
| 50 | T | 28.1 | Very low | 32.8 | Very low | 117 Ų | 117 | 136 Ų | 136 | 72% | 0.718 | 78% | 0.784 | S | S | * | * | trans | -38.8 | 128.3 | 163.5 | -50 | 0 | 0 | 0 | 0 | 112 | T52 | T50-T52 PolarHBondContact O-N 3.16Å; T50-T52 VanDerWaalsContact O-N 3.17Å | ||
| 51 | P | 37.2 | Very low | 32.8 | Very low | 120 Ų | 120 | 134.8 Ų | 134.8 | 78% | 0.779 | 78% | 0.782 | S | S | * | * | trans | -76.8 | 107.4 | 177.3 | 28.2 | -29.7 | 0 | 0 | 0 | 110.6 | I53 | P51-I53 PolarHBondContact O-N 3.14Š| ||
| 52 | T | 32.2 | Very low | 32.9 | Very low | 131 Ų | 131 | 137.1 Ų | 137.1 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | -68.7 | 122 | 166.7 | -47.1 | 0 | 0 | 0 | 0 | 109.4 | T50 | T50-T52 PolarHBondContact O-N 3.16Å; T50-T52 VanDerWaalsContact O-N 3.17Å | ||
| 53 | I | 37.4 | Very low | 33.1 | Very low | 145 Ų | 145 | 137.4 Ų | 137.4 | 74% | 0.744 | 79% | 0.785 | S | S | * | * | trans | -68.9 | 126.7 | 175 | -59.5 | 172.2 | 0 | 0 | 0 | 108.9 | P51 T55 | P51-I53 PolarHBondContact O-N 3.14Å; I53-T55 PolarHBondContact O-N 2.94Å | ||
| 54 | P | 33.8 | Very low | 33.3 | Very low | 109 Ų | 109 | 137.1 Ų | 137.1 | 71% | 0.708 | 78% | 0.784 | S | S | * | * | trans | -77.4 | 108 | 168.9 | 28.6 | -28.7 | 0 | 0 | 0 | 109.9 | T56 | P54-T56 PolarHBondContact O-N 3.48Š| ||
| 55 | T | 31.1 | Very low | 33.4 | Very low | 140 Ų | 140 | 138.6 Ų | 138.6 | 86% | 0.859 | 79% | 0.789 | S | S | * | * | trans | -62.4 | 108.8 | 165.2 | -13.4 | 0 | 0 | 0 | 0 | 108.4 | I53 | I53-T55 PolarHBondContact O-N 2.94Š| ||
| 56 | T | 37.9 | Very low | 33.5 | Very low | 116 Ų | 116 | 138.3 Ų | 138.3 | 71% | 0.712 | 79% | 0.792 | S | S | * | * | trans | -106.4 | 115.5 | 168 | -51.6 | 0 | 0 | 0 | 0 | 108 | P54 F58 | P54-T56 PolarHBondContact O-N 3.48Å; T56-F58 PolarHBondContact O-N 3.5Å | ||
| 57 | E | 32.2 | Very low | 33.7 | Very low | 171 Ų | 171 | 142 Ų | 142 | 80% | 0.799 | 80% | 0.799 | S | S | * | * | trans | -58.2 | 118.2 | 177.6 | -67.6 | 175.3 | 139 | 0 | 0 | 110.9 | Q59 | E57-Q59 PolarHBondContact O-N 2.99Š| ||
| 58 | F | 34.7 | Very low | 33.8 | Very low | 208 Ų | 208 | 140.8 Ų | 140.8 | 91% | 0.912 | 80% | 0.799 | S | S | * | * | trans | -80.3 | 101 | 162.2 | -87.6 | -87.6 | 0 | 0 | 0 | 108.4 | T56 S60 | T56-F58 PolarHBondContact O-N 3.5Å; F58-S60 PolarHBondContact O-N 3.24Å | ||
| 59 | Q | 33.4 | Very low | 34.2 | Very low | 173 Ų | 173 | 139 Ų | 139 | 81% | 0.808 | 80% | 0.796 | S | S | * | * | trans | -66.7 | 118.7 | 166.4 | -70.3 | -178 | -37.9 | 0 | 0 | 109.2 | E57 S61 | E57-Q59 PolarHBondContact O-N 2.99Å; Q59-S61 PolarHBondContact O-N 3.28Å | ||
| 60 | S | 31.5 | Very low | 34.1 | Very low | 113 Ų | 113 | 141.5 Ų | 141.5 | 79% | 0.79 | 80% | 0.8 | S | S | * | * | trans | -66.6 | 111.5 | 171.5 | 171.7 | 0 | 0 | 0 | 0 | 109.9 | F58 | F58-S60 PolarHBondContact O-N 3.24Š| ||
| 61 | S | 36.8 | Very low | 34.8 | Very low | 111 Ų | 111 | 142 Ų | 142 | 78% | 0.776 | 80% | 0.804 | S | S | * | * | trans | -91.2 | 112.6 | 165.6 | 41.4 | 0 | 0 | 0 | 0 | 109.8 | Q59 S63 | Q59-S61 PolarHBondContact O-N 3.28Å; S61-S63 PolarHBondContact O-N 3.22Å | ||
| 62 | E | 31.6 | Very low | 34.8 | Very low | 183 Ų | 183 | 141.5 Ų | 141.5 | 86% | 0.855 | 80% | 0.798 | S | S | * | * | trans | -57.6 | 127.6 | 169.3 | -64.9 | 179.2 | 140.3 | 0 | 0 | 109.8 | ||||
| 63 | S | 35.5 | Very low | 35.2 | Very low | 126 Ų | 126 | 140.5 Ų | 140.5 | 88% | 0.881 | 79% | 0.794 | S | S | * | * | trans | -97 | 110.4 | 177.3 | -147.4 | 0 | 0 | 0 | 0 | 110.3 | S61 | S61-S63 PolarHBondContact O-N 3.22Š| ||
| 64 | T | 36.5 | Very low | 35 | Very low | 118 Ų | 118 | 139.8 Ų | 139.8 | 72% | 0.724 | 80% | 0.796 | S | S | * | * | trans | -58.3 | 130.8 | 173.9 | -47.7 | 0 | 0 | 0 | 0 | 111.7 | L66 | T64-L66 PolarHBondContact O-N 3.07Š| ||
| 65 | T | 30.4 | Very low | 35.4 | Very low | 132 Ų | 132 | 143.5 Ų | 143.5 | 81% | 0.81 | 80% | 0.804 | S | S | * | * | trans | -52.2 | 120.5 | 169.7 | 37.4 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 66 | L | 34.1 | Very low | 36 | Very low | 165 Ų | 165 | 142.7 Ų | 142.7 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | trans | -112.4 | 114.1 | 162.9 | -75.4 | 175.5 | 0 | 0 | 0 | 109.8 | T64 | T64-L66 PolarHBondContact O-N 3.07Š| ||
| 67 | Q | 33.6 | Very low | 36.6 | Very low | 192 Ų | 192 | 142.5 Ų | 142.5 | 90% | 0.897 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 131.7 | 173.6 | -70.2 | 175.3 | -19.5 | 0 | 0 | 111.1 | ||
| 68 | T | 37.9 | Very low | 37.4 | Very low | 133 Ų | 133 | 140.3 Ų | 140.3 | 82% | 0.816 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -91.3 | 131.2 | 168.3 | -35.9 | 0 | 0 | 0 | 0 | 109.3 | ||
| 69 | P | 36.8 | Very low | 38 | Very low | 113 Ų | 113 | 137.1 Ų | 137.1 | 73% | 0.734 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 128.7 | 171 | 28 | -29.6 | 0 | 0 | 0 | 110.9 | ||
| 70 | L | 34.2 | Very low | 38.7 | Very low | 155 Ų | 155 | 134.9 Ų | 134.9 | 81% | 0.812 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 122.9 | 174.9 | 178.9 | 67.6 | 0 | 0 | 0 | 111.1 | ||
| 71 | T | 42.5 | Very low | 39.5 | Very low | 129 Ų | 129 | 135.1 Ų | 135.1 | 79% | 0.791 | 80% | 0.795 | S | S | * | * | trans | -128 | 109.9 | 162.4 | 52.4 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 72 | T | 36.9 | Very low | 39.8 | Very low | 108 Ų | 108 | 138.5 Ų | 138.5 | 66% | 0.663 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 130.2 | 175.3 | -52.4 | 0 | 0 | 0 | 0 | 109.9 | ||
| 73 | P | 40.1 | Very low | 40.3 | Very low | 110 Ų | 110 | 139.1 Ų | 139.1 | 71% | 0.714 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -103.1 | 119.4 | 151.6 | 26.7 | -14 | 0 | 0 | 0 | 109.9 | Q75 | P73-Q75 PolarHBondContact O-N 3.19Š|
| 74 | V | 34.4 | Very low | 40.6 | Very low | 131 Ų | 131 | 139.2 Ų | 139.2 | 79% | 0.794 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 122.6 | 170.1 | 171.2 | 0 | 0 | 0 | 0 | 109.4 | ||
| 75 | Q | 40.5 | Very low | 40.5 | Very low | 186 Ų | 186 | 136.9 Ų | 136.9 | 87% | 0.869 | 80% | 0.799 | S | S | * | * | trans | -125.5 | 121.5 | 162.5 | -78.5 | -163.9 | 74.5 | 0 | 0 | 109.7 | P73 | P73-Q75 PolarHBondContact O-N 3.19Š| ||
| 76 | T | 45.5 | Very low | 41 | Very low | 123 Ų | 123 | 137.2 Ų | 137.2 | 76% | 0.755 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 141.6 | 176.9 | 40.3 | 0 | 0 | 0 | 0 | 112.2 | ||
| 77 | P | 49.9 | Very low | 41.1 | Very low | 113 Ų | 113 | 137.7 Ų | 137.7 | 73% | 0.734 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 146.8 | 171.4 | 31.2 | -30.9 | 0 | 0 | 0 | 111.8 | ||
| 78 | P | 47.8 | Very low | 41.4 | Very low | 125 Ų | 125 | 134.4 Ų | 134.4 | 81% | 0.812 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 134 | 172.6 | 30.3 | -30.5 | 0 | 0 | 0 | 110.8 | ||
| 79 | T | 48.2 | Very low | 41.3 | Very low | 140 Ų | 140 | 135.2 Ų | 135.2 | 86% | 0.859 | 80% | 0.795 | S | S | * | * | trans | -84.2 | 115.1 | 174 | 39.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 80 | T | 48.6 | Very low | 41.3 | Very low | 126 Ų | 126 | 135.1 Ų | 135.1 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 130 | 166.7 | -50.9 | 0 | 0 | 0 | 0 | 109.4 | M82 | T80-M82 PolarHBondContact O-N 2.9Š|
| 81 | P | 47.9 | Very low | 41.6 | Very low | 118 Ų | 118 | 133.9 Ų | 133.9 | 77% | 0.766 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 125.4 | 172.5 | 28.8 | -29.5 | 0 | 0 | 0 | 110.5 | Q83 | P81-Q83 PolarHBondContact O-N 3.1Š|
| 82 | M | 42 | Very low | 41.4 | Very low | 183 Ų | 183 | 132.3 Ų | 132.3 | 90% | 0.901 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -66 | 124.9 | 170.3 | -69.3 | -177.3 | 65.2 | 0 | 0 | 110.2 | T80 | T80-M82 PolarHBondContact O-N 2.9Š|
| 83 | Q | 42.8 | Very low | 41.6 | Very low | 195 Ų | 195 | 134.4 Ų | 134.4 | 91% | 0.911 | 80% | 0.797 | S | S | * | * | trans | -104.2 | 113.2 | 166.1 | -155.4 | 177.2 | 11.8 | 0 | 0 | 108.8 | P81 G85 | P81-Q83 PolarHBondContact O-N 3.1Å; Q83-G85 PolarHBondContact O-N 3.49Å | ||
| 84 | T | 41.5 | Very low | 41.5 | Very low | 129 Ų | 129 | 134.4 Ų | 134.4 | 79% | 0.791 | 80% | 0.797 | S | S | * | * | trans | -74.2 | 114.4 | 175.9 | -46 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 85 | G | 34.9 | Very low | 41.8 | Very low | 69 Ų | 69 | 133.8 Ų | 133.8 | 71% | 0.711 | 80% | 0.795 | S | S | * | * | trans | -131 | 101.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | Q83 | Q83-G85 PolarHBondContact O-N 3.49Š| ||
| 86 | V | 41.6 | Very low | 41.4 | Very low | 138 Ų | 138 | 131.3 Ų | 131.3 | 84% | 0.836 | 79% | 0.793 | S | S | * | * | trans | -68.4 | 140.2 | 178.7 | -80 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 87 | H | 34.9 | Very low | 41.2 | Very low | 175 Ų | 175 | 131.2 Ų | 131.2 | 81% | 0.81 | 79% | 0.792 | S | S | * | * | trans | -61.1 | 148.5 | 177.8 | -73.8 | -119 | 0 | 0 | 0 | 112.9 | ||||
| 88 | S | 40.7 | Very low | 40.4 | Very low | 124 Ų | 124 | 133.6 Ų | 133.6 | 87% | 0.867 | 80% | 0.799 | S | S | * | * | trans | -151.1 | 130.8 | 144.3 | -74.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 89 | D | 36.1 | Very low | 40 | Very low | 149 Ų | 149 | 134.4 Ų | 134.4 | 80% | 0.797 | 80% | 0.795 | S | S | * | * | trans | -59.9 | 146.6 | -173.1 | -63 | -59.2 | 0 | 0 | 0 | 114.8 | ||||
| 90 | S | 36.6 | Very low | 39.5 | Very low | 112 Ų | 112 | 135.4 Ų | 135.4 | 78% | 0.783 | 79% | 0.793 | S | S | * | * | trans | -166.6 | 103.3 | 135.6 | -88.4 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 91 | T | 40.2 | Very low | 39.1 | Very low | 129 Ų | 129 | 135.5 Ų | 135.5 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | 48.8 | 115.3 | 129.3 | 46.6 | 0 | 0 | 0 | 0 | 120.3 | |||||
| 92 | S | 37.4 | Very low | 38.4 | Very low | 96 Ų | 96 | 138.2 Ų | 138.2 | 67% | 0.671 | 80% | 0.796 | S | S | * | * | 96.8 | 101.3 | 114.3 | -159.4 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 93 | I | 41.6 | Very low | 38 | Very low | 152 Ų | 152 | 134.8 Ų | 134.8 | 78% | 0.779 | 79% | 0.788 | S | S | * | * | trans | 74.3 | 122.2 | 138.8 | -52.7 | 165.9 | 0 | 0 | 0 | 118.6 | ||||
| 94 | P | 37.9 | Very low | 37.8 | Very low | 110 Ų | 110 | 130.8 Ų | 130.8 | 71% | 0.714 | 78% | 0.777 | S | S | * | * | trans | -96.2 | 166.6 | 168.8 | 40.2 | -32 | 0 | 0 | 0 | 111.7 | ||||
| 95 | P | 40.2 | Very low | 37.5 | Very low | 118 Ų | 118 | 133 Ų | 133 | 77% | 0.766 | 78% | 0.778 | S | S | * | * | -150.2 | 171.9 | 96 | 34.7 | -13.9 | 0 | 0 | 0 | 116.4 | |||||
| 96 | T | 32.8 | Very low | 37.6 | Very low | 133 Ų | 133 | 139 Ų | 139 | 82% | 0.816 | 78% | 0.78 | S | S | * | * | trans | -32.8 | 136.9 | 173.7 | 19 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 97 | T | 40.4 | Very low | 37.4 | Very low | 122 Ų | 122 | 140.1 Ų | 140.1 | 75% | 0.748 | 78% | 0.777 | S | S | * | * | trans | -152.2 | 120.2 | 150.4 | -63.1 | 0 | 0 | 0 | 0 | 109.3 | I99 | T97-I99 HydrophobicContact CG2-CG1 4.19Š| ||
| 98 | D | 34.3 | Very low | 37.3 | Very low | 162 Ų | 162 | 140 Ų | 140 | 87% | 0.866 | 78% | 0.776 | S | S | * | * | trans | -62.6 | 123.6 | 168.2 | -72.2 | -54.5 | 0 | 0 | 0 | 110.6 | ||||
| 99 | I | 39.9 | Very low | 37.3 | Very low | 143 Ų | 143 | 140.4 Ų | 140.4 | 73% | 0.733 | 77% | 0.774 | S | S | * | * | trans | -136.7 | 112.1 | 160.3 | -56.4 | -177.6 | 0 | 0 | 0 | 108.7 | T97 | T97-I99 HydrophobicContact CG2-CG1 4.19Š| ||
| 100 | I | 36.8 | Very low | 37.3 | Very low | 160 Ų | 160 | 138.7 Ų | 138.7 | 82% | 0.821 | 77% | 0.769 | S | S | * | * | trans | -61.8 | 126.3 | 167.3 | -64.4 | 166.5 | 0 | 0 | 0 | 108.7 | ||||
| 101 | T | 39.5 | Very low | 37.3 | Very low | 129 Ų | 129 | 138.6 Ų | 138.6 | 79% | 0.791 | 77% | 0.768 | S | S | * | * | trans | -150.4 | 140.8 | 148.7 | -23.9 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 102 | Q | 34.3 | Very low | 37 | Very low | 175 Ų | 175 | 138.9 Ų | 138.9 | 82% | 0.818 | 77% | 0.77 | S | S | * | * | trans | -53.3 | 170.7 | -166.3 | -90.1 | -172.6 | -5.1 | 0 | 0 | 119.5 | ||||
| 103 | P | 32.8 | Very low | 37.2 | Very low | 110 Ų | 110 | 139.5 Ų | 139.5 | 71% | 0.714 | 78% | 0.775 | S | S | * | * | trans | -91.6 | 145 | -157.5 | 36.3 | -32.4 | 0 | 0 | 0 | 113.6 | ||||
| 104 | T | 40.1 | Very low | 37.1 | Very low | 112 Ų | 112 | 140.3 Ų | 140.3 | 69% | 0.687 | 78% | 0.775 | S | S | * | * | trans | -92.9 | 113.4 | 170.7 | -44.6 | 0 | 0 | 0 | 0 | 110.3 | Y106 | T104-Y106 HydrophobicContact CG2-CD2 3.94Å; T104-Y106 HydrophobicContact CG2-CE2 3.43Å; T104-Y106 VanDerWaalsContact CG2-CE2 3.43Å | ||
| 105 | Q | 34.5 | Very low | 37.2 | Very low | 175 Ų | 175 | 140.9 Ų | 140.9 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | trans | -62.8 | 129.1 | 166.9 | -69.5 | -95.3 | -29.1 | 0 | 0 | 110.4 | ||||
| 106 | Y | 37.9 | Very low | 37.4 | Very low | 194 Ų | 194 | 142.7 Ų | 142.7 | 76% | 0.761 | 78% | 0.78 | S | S | * | * | trans | -132 | 109.9 | 159.7 | -81.9 | -79.4 | 0 | 0 | 0 | 111.3 | T104 | T104-Y106 HydrophobicContact CG2-CD2 3.94Å; T104-Y106 HydrophobicContact CG2-CE2 3.43Å; T104-Y106 VanDerWaalsContact CG2-CE2 3.43Å | ||
| 107 | Q | 37.3 | Very low | 37.6 | Very low | 162 Ų | 162 | 142.8 Ų | 142.8 | 76% | 0.757 | 78% | 0.776 | S | S | * | * | trans | 69.2 | 92.9 | 133.2 | -55.8 | -72.9 | 70.3 | 0 | 0 | 118.6 | T109 | Q107-T109 PolarHBondContact O-N 3.44Š| ||
| 108 | Q | 32.7 | Very low | 37.5 | Very low | 172 Ų | 172 | 141.5 Ų | 141.5 | 80% | 0.804 | 77% | 0.772 | S | S | * | * | trans | -32.4 | 116.8 | 142.7 | -174.7 | 174.9 | 9.4 | 0 | 0 | 114 | ||||
| 109 | T | 40.7 | Very low | 37.6 | Very low | 134 Ų | 134 | 138.8 Ų | 138.8 | 82% | 0.822 | 76% | 0.761 | S | S | * | * | trans | -115.3 | 105.7 | 154.5 | 50.4 | 0 | 0 | 0 | 0 | 108.8 | Q107 S111 | Q107-T109 PolarHBondContact O-N 3.44Å; T109-S111 PolarHBondContact O-N 2.85Å | ||
| 110 | T | 35.3 | Very low | 37.8 | Very low | 113 Ų | 113 | 137.3 Ų | 137.3 | 69% | 0.693 | 76% | 0.761 | S | S | * | * | trans | -73.1 | 105.1 | 172.5 | -44.2 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 111 | S | 37.4 | Very low | 37.9 | Very low | 109 Ų | 109 | 136 Ų | 136 | 76% | 0.762 | 76% | 0.761 | S | S | * | * | trans | -106.7 | 105.3 | 168.3 | -121.7 | 0 | 0 | 0 | 0 | 108.6 | T109 S113 | T109-S111 PolarHBondContact O-N 2.85Å; S111-S113 PolarHBondContact O-N 3.47Å | ||
| 112 | T | 33.9 | Very low | 38.1 | Very low | 135 Ų | 135 | 136.6 Ų | 136.6 | 83% | 0.828 | 76% | 0.757 | S | S | * | * | trans | -70.9 | 100.2 | 170.2 | 42 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 113 | S | 40.1 | Very low | 38.2 | Very low | 110 Ų | 110 | 133.3 Ų | 133.3 | 77% | 0.769 | 75% | 0.752 | S | S | * | * | trans | -104.6 | 117 | 167.6 | -64.3 | 0 | 0 | 0 | 0 | 109.2 | S111 | S111-S113 PolarHBondContact O-N 3.47Š| ||
| 114 | Q | 40.9 | Very low | 38.6 | Very low | 169 Ų | 169 | 134.7 Ų | 134.7 | 79% | 0.79 | 76% | 0.758 | S | S | * | * | trans | -50.8 | 144.4 | 178.9 | -63.8 | -90.8 | -36.4 | 0 | 0 | 112.1 | I116 | Q114-I116 PolarHBondContact O-N 3.38Š| ||
| 115 | P | 40.4 | Very low | 38.8 | Very low | 121 Ų | 121 | 134.6 Ų | 134.6 | 79% | 0.786 | 76% | 0.757 | S | S | * | * | trans | -69.9 | 113.9 | 169.3 | 28.8 | -29.6 | 0 | 0 | 0 | 108.6 | D117 | P115-D117 PolarHBondContact O-N 2.73Å; P115-D117 VanDerWaalsContact O-N 3.11Å | ||
| 116 | I | 44 | Very low | 39 | Very low | 157 Ų | 157 | 134.1 Ų | 134.1 | 81% | 0.805 | 76% | 0.755 | S | S | * | * | trans | -74.2 | 98.7 | 166.8 | -19.9 | 172.9 | 0 | 0 | 0 | 105.6 | Q114 S118 | Q114-I116 PolarHBondContact O-N 3.38Å; I116-S118 PolarHBondContact O-N 3.49Å; I116-S118 VanDerWaalsContact O-N 3.11Å | ||
| 117 | D | 35.6 | Very low | 39.1 | Very low | 134 Ų | 134 | 134.3 Ų | 134.3 | 72% | 0.717 | 76% | 0.76 | S | S | * | * | trans | -64.7 | 106.1 | 166.9 | -175.6 | 2.5 | 0 | 0 | 0 | 107.5 | P115 T119 | P115-D117 PolarHBondContact O-N 2.73Å; P115-D117 VanDerWaalsContact O-N 3.11Å; D117-T119 PolarHBondContact OD1-N 2.94Å; D117-T119 PolarHBondContact OD1-OG1 2.82Å; D117-T119 VanDerWaalsContact OD1-OG1 3.1Å | ||
| 118 | S | 39.3 | Very low | 39 | Very low | 95 Ų | 95 | 134.7 Ų | 134.7 | 66% | 0.664 | 76% | 0.762 | S | S | * | * | trans | -135.6 | 68 | 172.6 | -59.2 | 0 | 0 | 0 | 0 | 106.6 | I116 P120 | I116-S118 PolarHBondContact O-N 3.49Å; I116-S118 VanDerWaalsContact O-N 3.11Å; S118-P120 VanDerWaalsContact O-CD 3.24Å; S118-P120 WeakPolarHBondContact O-CD 3.18Å | ||
| 119 | T | 37.4 | Very low | 39.1 | Very low | 105 Ų | 105 | 132 Ų | 132 | 64% | 0.644 | 76% | 0.763 | S | S | * | * | trans | -62.1 | 116.1 | 166.2 | -59.3 | 0 | 0 | 0 | 0 | 108.2 | D117 T121 | D117-T119 PolarHBondContact OD1-N 2.94Å; D117-T119 PolarHBondContact OD1-OG1 2.82Å; D117-T119 VanDerWaalsContact OD1-OG1 3.1Å; T119-T121 PolarHBondContact O-N 3.28Å; T119-T121 VanDerWaalsContact O-N 3.14Å | ||
| 120 | P | 42.3 | Very low | 39.1 | Very low | 113 Ų | 113 | 131.1 Ų | 131.1 | 73% | 0.734 | 76% | 0.762 | S | S | * | * | trans | -73.9 | 108 | 173.8 | 28.2 | -28.6 | 0 | 0 | 0 | 108.7 | S118 I122 | S118-P120 VanDerWaalsContact O-CD 3.24Å; S118-P120 WeakPolarHBondContact O-CD 3.18Å; P120-I122 PolarHBondContact O-N 3.41Å; P120-I122 VanDerWaalsContact O-N 3.14Å | ||
| 121 | T | 39.7 | Very low | 39.1 | Very low | 132 Ų | 132 | 134.6 Ų | 134.6 | 81% | 0.81 | 77% | 0.77 | S | S | * | * | trans | -66.6 | 106.8 | 170.4 | -50.4 | 0 | 0 | 0 | 0 | 109.1 | T119 | T119-T121 PolarHBondContact O-N 3.28Å; T119-T121 VanDerWaalsContact O-N 3.14Å | ||
| 122 | I | 43.4 | Very low | 39.1 | Very low | 141 Ų | 141 | 134.4 Ų | 134.4 | 72% | 0.723 | 77% | 0.769 | S | S | * | * | trans | -75.1 | 126 | 168.4 | -58.9 | 177.2 | 0 | 0 | 0 | 107.5 | P120 T124 | P120-I122 PolarHBondContact O-N 3.41Å; P120-I122 VanDerWaalsContact O-N 3.14Å; I122-T124 PolarHBondContact O-N 2.91Å | ||
| 123 | P | 36.8 | Very low | 39.2 | Very low | 107 Ų | 107 | 133.6 Ų | 133.6 | 70% | 0.695 | 76% | 0.764 | S | S | * | * | trans | -71 | 113.5 | 174.6 | 27.2 | -30.7 | 0 | 0 | 0 | 109.9 | T125 | P123-T125 PolarHBondContact O-N 2.96Š| ||
| 124 | T | 41.7 | Very low | 39.3 | Very low | 138 Ų | 138 | 134.5 Ų | 134.5 | 85% | 0.847 | 77% | 0.765 | S | S | * | * | trans | -75 | 103.2 | 168.1 | -17.9 | 0 | 0 | 0 | 0 | 108.2 | I122 E126 | I122-T124 PolarHBondContact O-N 2.91Å; T124-E126 PolarHBondContact O-N 3.32Å | ||
| 125 | T | 44.5 | Very low | 39 | Very low | 110 Ų | 110 | 133.5 Ų | 133.5 | 68% | 0.675 | 76% | 0.764 | S | S | * | * | trans | -75.2 | 104.9 | 167.8 | -51.6 | 0 | 0 | 0 | 0 | 108.5 | P123 F127 | P123-T125 PolarHBondContact O-N 2.96Å; T125-F127 PolarHBondContact O-N 2.92Å | ||
| 126 | E | 38.6 | Very low | 38.7 | Very low | 166 Ų | 166 | 136 Ų | 136 | 78% | 0.776 | 77% | 0.765 | S | S | * | * | trans | -59.5 | 110.8 | 166.5 | -99.9 | -178.3 | 153.5 | 0 | 0 | 109.7 | T124 Q128 | T124-E126 PolarHBondContact O-N 3.32Å; E126-Q128 PolarHBondContact O-N 3.48Å | ||
| 127 | F | 38.3 | Very low | 38.6 | Very low | 198 Ų | 198 | 134.7 Ų | 134.7 | 87% | 0.868 | 77% | 0.765 | S | S | * | * | trans | -79.2 | 99.4 | 162.8 | -87.5 | -87.5 | 0 | 0 | 0 | 108.5 | T125 S129 | T125-F127 PolarHBondContact O-N 2.92Å; F127-S129 PolarHBondContact O-N 3.48Å | ||
| 128 | Q | 37.2 | Very low | 38.6 | Very low | 170 Ų | 170 | 134.4 Ų | 134.4 | 79% | 0.794 | 77% | 0.77 | S | S | * | * | trans | -67.2 | 113.3 | 165.3 | -69.7 | -176.4 | -24 | 0 | 0 | 109 | E126 S130 | E126-Q128 PolarHBondContact O-N 3.48Å; Q128-S130 PolarHBondContact O-N 2.76Å | ||
| 129 | S | 33.6 | Very low | 38.8 | Very low | 116 Ų | 116 | 137.2 Ų | 137.2 | 81% | 0.811 | 78% | 0.777 | S | S | * | * | trans | -77.6 | 110 | 168.8 | 174.9 | 0 | 0 | 0 | 0 | 109.1 | F127 | F127-S129 PolarHBondContact O-N 3.48Š| ||
| 130 | S | 40.3 | Very low | 38.9 | Very low | 115 Ų | 115 | 138.6 Ų | 138.6 | 80% | 0.804 | 79% | 0.785 | S | S | * | * | trans | -108.7 | 105 | 164.7 | 44.1 | 0 | 0 | 0 | 0 | 110 | Q128 | Q128-S130 PolarHBondContact O-N 2.76Š| ||
| 131 | E | 35.8 | Very low | 38.9 | Very low | 186 Ų | 186 | 139.2 Ų | 139.2 | 87% | 0.869 | 79% | 0.787 | S | S | * | * | trans | -69.9 | 129.3 | 157.4 | -74.4 | -177.1 | 127.3 | 0 | 0 | 108.7 | ||||
| 132 | S | 38 | Very low | 38.8 | Very low | 105 Ų | 105 | 138 Ų | 138 | 73% | 0.734 | 78% | 0.781 | S | S | * | * | 159.6 | 111.5 | 110.4 | -152.7 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 133 | T | 34.9 | Very low | 38.6 | Very low | 118 Ų | 118 | 138 Ų | 138 | 72% | 0.724 | 79% | 0.788 | S | S | * | * | trans | 39.9 | 108.7 | 131.3 | -30.1 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 134 | T | 42.7 | Very low | 38.8 | Very low | 129 Ų | 129 | 141.5 Ų | 141.5 | 79% | 0.791 | 80% | 0.795 | S | S | * | * | -178.6 | 120.3 | 117.9 | 18.4 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 135 | L | 35.5 | Very low | 38.8 | Very low | 148 Ų | 148 | 140.8 Ų | 140.8 | 78% | 0.775 | 79% | 0.79 | S | S | * | * | trans | 34.3 | 119.2 | 143.4 | -62.1 | 171.3 | 0 | 0 | 0 | 122.7 | ||||
| 136 | Q | 32.8 | Very low | 38.8 | Very low | 173 Ų | 173 | 140.9 Ų | 140.9 | 81% | 0.808 | 79% | 0.793 | S | S | * | * | trans | 67.3 | 114.1 | 136.3 | -64.9 | -177 | 6.8 | 0 | 0 | 120 | ||||
| 137 | T | 41.5 | Very low | 39.1 | Very low | 130 Ų | 130 | 138.6 Ų | 138.6 | 80% | 0.798 | 79% | 0.793 | S | S | * | * | 168.9 | 136 | 112.5 | -56.2 | 0 | 0 | 0 | 0 | 108.2 | L139 | T137-L139 PolarHBondContact O-N 2.9Š| |||
| 138 | P | 37.2 | Very low | 39.1 | Very low | 128 Ų | 128 | 136.1 Ų | 136.1 | 83% | 0.831 | 79% | 0.794 | S | S | * | * | trans | -79.3 | 114.5 | -172.9 | 30.7 | -31.5 | 0 | 0 | 0 | 111.2 | ||||
| 139 | L | 42.3 | Very low | 39.8 | Very low | 154 Ų | 154 | 133.7 Ų | 133.7 | 81% | 0.806 | 79% | 0.791 | S | S | * | * | trans | -100.7 | 114.9 | 169.3 | -167.8 | 63.8 | 0 | 0 | 0 | 109.7 | T137 T141 | T137-L139 PolarHBondContact O-N 2.9Å; L139-T141 PolarHBondContact O-N 2.94Å | ||
| 140 | T | 39.2 | Very low | 40 | Very low | 133 Ų | 133 | 133.2 Ų | 133.2 | 82% | 0.816 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 116.5 | 172.9 | 48.9 | 0 | 0 | 0 | 0 | 110.7 | ||
| 141 | T | 43.6 | Very low | 39.9 | Very low | 126 Ų | 126 | 135.4 Ų | 135.4 | 77% | 0.773 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -103.5 | 133 | 174.4 | -53 | 0 | 0 | 0 | 0 | 108.9 | L139 | L139-T141 PolarHBondContact O-N 2.94Š|
| 142 | P | 37.3 | Very low | 40 | Very low | 106 Ų | 106 | 134.5 Ų | 134.5 | 69% | 0.688 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 144.3 | -174.5 | 29.4 | -34.2 | 0 | 0 | 0 | 111.4 | Q144 | P142-Q144 PolarHBondContact O-N 3.37Å; P142-Q144 VanDerWaalsContact O-N 3.08Å |
| 143 | V | 39.7 | Very low | 40.2 | Very low | 141 Ų | 141 | 136.6 Ų | 136.6 | 86% | 0.855 | 79% | 0.789 | S | S | * | * | trans | -60.6 | 107.5 | 173.1 | 173.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 144 | Q | 39 | Very low | 40.3 | Very low | 182 Ų | 182 | 132.9 Ų | 132.9 | 85% | 0.85 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 116.2 | 163.5 | -80.7 | -169.8 | 63.9 | 0 | 0 | 108.7 | P142 | P142-Q144 PolarHBondContact O-N 3.37Å; P142-Q144 VanDerWaalsContact O-N 3.08Å |
| 145 | T | 42.7 | Very low | 40.3 | Very low | 122 Ų | 122 | 132.4 Ų | 132.4 | 75% | 0.748 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 135.9 | 165.9 | 24.7 | 0 | 0 | 0 | 0 | 109.9 | ||
| 146 | P | 45.4 | Very low | 40.7 | Very low | 113 Ų | 113 | 133.4 Ų | 133.4 | 73% | 0.734 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 144.7 | 176.4 | 28.3 | -32.3 | 0 | 0 | 0 | 110.2 | T148 | P146-T148 PolarHBondContact O-N 2.89Š|
| 147 | P | 44.1 | Very low | 41.5 | Very low | 118 Ų | 118 | 129.3 Ų | 129.3 | 77% | 0.766 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 126.1 | -179.4 | 26.8 | -31.9 | 0 | 0 | 0 | 110.7 | T149 | P147-T149 PolarHBondContact O-N 2.91Š|
| 148 | T | 38.7 | Very low | 41.9 | Very low | 145 Ų | 145 | 130.2 Ų | 130.2 | 89% | 0.89 | 75% | 0.753 | S | S | * | * | trans | -68.9 | 97.1 | 169.7 | 39.4 | 0 | 0 | 0 | 0 | 109.3 | P146 | P146-T148 PolarHBondContact O-N 2.89Š| ||
| 149 | T | 50.4 | Low | 42.3 | Very low | 119 Ų | 119 | 132.8 Ų | 132.8 | 73% | 0.73 | 75% | 0.751 | S | S | * | * | trans | -81.3 | 129.3 | 169 | -55.1 | 0 | 0 | 0 | 0 | 108.2 | P147 M151 | P147-T149 PolarHBondContact O-N 2.91Å; T149-M151 PolarHBondContact O-N 2.92Å | ||
| 150 | P | 39.8 | Very low | 42.9 | Very low | 107 Ų | 107 | 130.3 Ų | 130.3 | 70% | 0.695 | 74% | 0.738 | S | S | * | * | trans | -63.2 | 134.1 | 179.1 | 25.8 | -32.4 | 0 | 0 | 0 | 109.7 | Q152 | P150-Q152 VanDerWaalsContact C-N 3.33Å; P150-Q152 PolarHBondContact O-N 2.68Å | ||
| 151 | M | 36.8 | Very low | 43.1 | Very low | 161 Ų | 161 | 129.8 Ų | 129.8 | 79% | 0.793 | 74% | 0.74 | S | S | * | * | trans | -60.2 | 93.9 | 172.4 | -78 | -160.5 | 68.2 | 0 | 0 | 109.7 | T149 T153 | T149-M151 PolarHBondContact O-N 2.92Å; M151-T153 PolarHBondContact O-N 3.16Å | ||
| 152 | Q | 38.2 | Very low | 43.3 | Very low | 166 Ų | 166 | 129.1 Ų | 129.1 | 78% | 0.776 | 73% | 0.73 | S | S | * | * | trans | -71.1 | 122.3 | 157.6 | -85.5 | -171.2 | 2.2 | 0 | 0 | 107.5 | P150 G154 | P150-Q152 VanDerWaalsContact C-N 3.33Å; P150-Q152 PolarHBondContact O-N 2.68Å; Q152-G154 PolarHBondContact O-N 3.41Å | ||
| 153 | T | 42.6 | Very low | 44 | Very low | 149 Ų | 149 | 135.9 Ų | 135.9 | 91% | 0.914 | 74% | 0.742 | S | S | * | * | trans | -66.3 | 73.7 | 168.4 | 51.3 | 0 | 0 | 0 | 0 | 109.2 | M151 | M151-T153 PolarHBondContact O-N 3.16Š| ||
| 154 | G | 36.7 | Very low | 44.6 | Very low | 41 Ų | 41 | 133.2 Ų | 133.2 | 42% | 0.423 | 72% | 0.723 | S | S | . | * | trans | -107.2 | 124.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | Q152 Y156 | Q152-G154 PolarHBondContact O-N 3.41Å; G154-Y156 WeakPolarHBondContact O-CD2 3.19Å; G154-Y156 PolarHBondContact O-N 3.49Å | ||
| 155 | T | 42.3 | Very low | 45 | Very low | 118 Ų | 118 | 130.8 Ų | 130.8 | 72% | 0.724 | 72% | 0.716 | S | S | * | * | trans | -40.3 | 103.4 | 171.3 | -53.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 156 | Y | 44.8 | Very low | 45.6 | Very low | 169 Ų | 169 | 128.2 Ų | 128.2 | 66% | 0.663 | 70% | 0.7 | S | S | * | * | trans | -72 | 127.9 | 176.9 | -74.2 | -85.9 | 0 | 0 | 0 | 109.3 | G154 I158 | G154-Y156 WeakPolarHBondContact O-CD2 3.19Å; G154-Y156 PolarHBondContact O-N 3.49Å; Y156-I158 PolarHBondContact O-N 2.86Å | ||
| 157 | P | 48.6 | Very low | 45.8 | Very low | 88 Ų | 88 | 129.5 Ų | 129.5 | 57% | 0.571 | 70% | 0.696 | S | S | * | * | trans | -65.4 | 119.7 | 165.3 | 26.6 | -30.9 | 0 | 0 | 0 | 108.6 | F159 | P157-F159 HydrophobicContact CB-CE2 4.14Å; P157-F159 HydrophobicContact CB-CZ 4.18Å; P157-F159 HydrophobicContact CG-CE2 3.77Å; P157-F159 HydrophobicContact CG-CZ 3.98Å; P157-F159 PolarHBondContact O-N 3.25Å | ||
| 158 | I | 49.7 | Very low | 46.2 | Very low | 148 Ų | 148 | 129.5 Ų | 129.5 | 76% | 0.759 | 69% | 0.686 | S | S | * | * | trans | -76.5 | 111.4 | 169.5 | -60.6 | 173.5 | 0 | 0 | 0 | 106.9 | Y156 I160 | Y156-I158 PolarHBondContact O-N 2.86Å; I158-I160 HydrophobicContact CG2-CD1 4.42Å; I158-I160 HydrophobicContact CG2-CG1 3.86Å | ||
| 159 | F | 47.4 | Very low | 46.8 | Very low | 182 Ų | 182 | 130.8 Ų | 130.8 | 80% | 0.798 | 68% | 0.681 | S | S | * | * | trans | -85.8 | 111.6 | 170.8 | -64.7 | -80.3 | 0 | 0 | 0 | 109.1 | P157 | P157-F159 HydrophobicContact CB-CE2 4.14Å; P157-F159 HydrophobicContact CB-CZ 4.18Å; P157-F159 HydrophobicContact CG-CE2 3.77Å; P157-F159 HydrophobicContact CG-CZ 3.98Å; P157-F159 PolarHBondContact O-N 3.25Å | ||
| 160 | I | 53.5 | Low | 46.9 | Very low | 103 Ų | 103 | 131 Ų | 131 | 53% | 0.528 | 68% | 0.682 | S | S | . | * | trans | -99.7 | 111.9 | 172.7 | -55.2 | 177.1 | 0 | 0 | 0 | 107.7 | I158 L162 | I158-I160 HydrophobicContact CG2-CD1 4.42Å; I158-I160 HydrophobicContact CG2-CG1 3.86Å; I160-L162 HydrophobicContact CG2-CD2 4.16Å; I160-L162 HydrophobicContact CG2-CG 4.18Å; I160-L162 PolarHBondContact O-N 3.33Å | ||
| 161 | S | 42.9 | Very low | 47.2 | Very low | 122 Ų | 122 | 131.1 Ų | 131.1 | 85% | 0.853 | 69% | 0.686 | S | S | * | * | trans | -80.1 | 108.7 | 173.5 | -64.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 162 | L | 48.9 | Very low | 47.5 | Very low | 111 Ų | 111 | 132.2 Ų | 132.2 | 58% | 0.581 | 69% | 0.689 | S | S | * | * | trans | -99.7 | 119.6 | 172.7 | -64.9 | 168.2 | 0 | 0 | 0 | 108.9 | I160 L196 | I160-L162 HydrophobicContact CG2-CD2 4.16Å; I160-L162 HydrophobicContact CG2-CG 4.18Å; I160-L162 PolarHBondContact O-N 3.33Å; L162-L196 HydrophobicContact CD1-CD1 4.28Å | ||
| 163 | R | 51.7 | Low | 47.9 | Very low | 249 Ų | 249 | 128.7 Ų | 128.7 | 94% | 0.94 | 68% | 0.679 | S | S | * | * | trans | -94 | 111.3 | 174.3 | -161.3 | 179.1 | -158.6 | -173.2 | 5.6 | 109 | ||||
| 164 | L | 52.9 | Low | 47.8 | Very low | 84 Ų | 84 | 131 Ų | 131 | 44% | 0.44 | 67% | 0.672 | S | S | . | * | trans | -78.7 | 126.7 | 171.3 | -72.1 | 158.8 | 0 | 0 | 0 | 109.1 | I189 | L164-I189 HydrophobicContact CD1-CG2 4.39Š| ||
| 165 | N | 47.2 | Very low | 48.4 | Very low | 132 Ų | 132 | 135 Ų | 135 | 71% | 0.706 | 69% | 0.691 | S | S | * | * | trans | -94.4 | 95.1 | 173.4 | -175.2 | -2.1 | 0 | 0 | 0 | 108.2 | Q167 | N165-Q167 PolarHBondContact OD1-NE2 2.96Š| ||
| 166 | T | 56.1 | Low | 48.8 | Very low | 67 Ų | 67 | 136.7 Ų | 136.7 | 41% | 0.411 | 69% | 0.69 | S | S | . | * | trans | -94.5 | 104.7 | 174.6 | -45 | 0 | 0 | 0 | 0 | 108.7 | H168 | T166-H168 WeakPolarHBondContact CG2-NE2 3.31Å; T166-H168 PolarHBondContact O-N 3.4Å | ||
| 167 | Q | 49.1 | Very low | 49 | Very low | 141 Ų | 141 | 134.2 Ų | 134.2 | 66% | 0.659 | 68% | 0.683 | S | S | * | * | trans | -79.3 | 98.8 | 172 | -69.1 | -70.8 | -19.7 | 0 | 0 | 108.9 | N165 H169 | N165-Q167 PolarHBondContact OD1-NE2 2.96Å; Q167-H169 PolarHBondContact O-N 2.94Å | ||
| 168 | H | 51.7 | Low | 49.1 | Very low | 118 Ų | 118 | 136.3 Ų | 136.3 | 55% | 0.546 | 69% | 0.685 | S | S | . | * | trans | -80.7 | 104.6 | 171.6 | -67.8 | -80.1 | 0 | 0 | 0 | 109.7 | T166 T170 D185 | T166-H168 WeakPolarHBondContact CG2-NE2 3.31Å; T166-H168 PolarHBondContact O-N 3.4Å; H168-T170 PolarHBondContact O-N 3.43Å; H168-T170 VanDerWaalsContact O-N 3.11Å; H168-D185 IonicContact CE1-OD1 3.71Å; H168-D185 IonicContact CE1-OD2 3.24Å; H168-D185 PolarHBondContact CE1-OD2 3.08Å; H168-D185 VanDerWaalsContact CE1-OD2 3.24Å; H168-D185 IonicContact ND1-OD2 3.94Å | ||
| 169 | H | 51.2 | Low | 49.5 | Very low | 172 Ų | 172 | 132.8 Ų | 132.8 | 80% | 0.796 | 67% | 0.673 | S | S | * | * | trans | -71.8 | 97.9 | 165.1 | -72.6 | -88.5 | 0 | 0 | 0 | 109 | Q167 S171 | Q167-H169 PolarHBondContact O-N 2.94Å; H169-S171 PolarHBondContact O-N 3.41Å; H169-S171 VanDerWaalsContact O-N 3.08Å | ||
| 170 | T | 53.8 | Low | 50 | Low | 123 Ų | 123 | 128 Ų | 128 | 76% | 0.755 | 66% | 0.656 | S | S | * | * | trans | -72.1 | 99 | 172.6 | 53.1 | 0 | 0 | 0 | 0 | 109.7 | H168 | H168-T170 PolarHBondContact O-N 3.43Å; H168-T170 VanDerWaalsContact O-N 3.11Å | ||
| 171 | S | 44.3 | Very low | 50.2 | Low | 110 Ų | 110 | 127 Ų | 127 | 77% | 0.769 | 65% | 0.652 | S | S | * | * | trans | -102.7 | 120.6 | 163.3 | -71.8 | 0 | 0 | 0 | 0 | 109.8 | H169 T173 | H169-S171 PolarHBondContact O-N 3.41Å; H169-S171 VanDerWaalsContact O-N 3.08Å; S171-T173 PolarHBondContact O-N 3.34Å | ||
| 172 | H | 44 | Very low | 51.2 | Low | 184 Ų | 184 | 126.7 Ų | 126.7 | 85% | 0.852 | 64% | 0.637 | S | S | * | * | trans | -64.2 | 98.7 | -177.7 | -71.6 | -93.1 | 0 | 0 | 0 | 112.5 | ||||
| 173 | T | 46.9 | Very low | 51.9 | Low | 92 Ų | 92 | 127.1 Ų | 127.1 | 56% | 0.564 | 64% | 0.636 | S | S | * | * | trans | -160 | 112.2 | 163.1 | -39.4 | 0 | 0 | 0 | 0 | 112.2 | S171 F177 | S171-T173 PolarHBondContact O-N 3.34Å; T173-F177 WeakPolarHBondContact O-CD2 3.45Å | ||
| 174 | Y | 40.8 | Very low | 52.5 | Low | 196 Ų | 196 | 120.7 Ų | 120.7 | 77% | 0.769 | 62% | 0.62 | S | S | * | * | trans | 61.5 | 137.6 | 158.7 | -79.4 | -104.9 | 0 | 0 | 0 | 121.2 | H176 F177 | Y174-H176 PolarHBondContact O-N 2.92Å; Y174-F177 PolarHBondContact O-N 2.82Å | ||
| 175 | P | 49.5 | Very low | 53.4 | Low | 127 Ų | 127 | 119 Ų | 119 | 83% | 0.825 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.5 | 13.5 | -172.2 | 29.7 | -35.6 | 0 | 0 | 0 | 116 | ||
| 176 | H | 49.6 | Very low | 54.5 | Low | 152 Ų | 152 | 118.8 Ų | 118.8 | 70% | 0.704 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.8 | -15.6 | 176.1 | -161.7 | 44.6 | 0 | 0 | 0 | 113.6 | Y174 | Y174-H176 PolarHBondContact O-N 2.92Š|
| 177 | F | 49.6 | Very low | 55.3 | Low | 118 Ų | 118 | 118.7 Ų | 118.7 | 52% | 0.518 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -81.9 | -14.5 | -179.6 | -74.5 | -84.1 | 0 | 0 | 0 | 114.6 | T173 Y174 N181 | T173-F177 WeakPolarHBondContact O-CD2 3.45Å; Y174-F177 PolarHBondContact O-N 2.82Å; F177-N181 WeakPolarHBondContact O-CB 3.44Å; F177-N181 PolarHBondContact O-N 3.46Å; F177-N181 VanDerWaalsContact O-N 3.16Å; F177-N181 PolarHBondContact O-ND2 3.42Å |
| 178 | H | 51.3 | Low | 56.5 | Low | 132 Ų | 132 | 117.6 Ų | 117.6 | 61% | 0.611 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -71.5 | -35.3 | -172.3 | -156.4 | 61.8 | 0 | 0 | 0 | 113 | Q182 | H178-Q182 PolarHBondContact NE2-NE2 2.85Å; H178-Q182 WeakPolarHBondContact O-CB 3.47Å; H178-Q182 WeakPolarHBondContact O-CG 3.33Å; H178-Q182 PolarHBondContact O-N 3.26Å |
| 179 | S | 56.6 | Low | 57.7 | Low | 74 Ų | 74 | 115.6 Ų | 115.6 | 52% | 0.517 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -71.2 | -43.2 | 178.7 | -170 | 0 | 0 | 0 | 0 | 112.3 | Q182 Q183 | S179-Q182 PolarHBondContact O-N 2.96Å; S179-Q183 WeakPolarHBondContact O-CB 3.38Å; S179-Q183 WeakPolarHBondContact O-CG 3.48Å; S179-Q183 PolarHBondContact O-N 3.39Å |
| 180 | N | 57.5 | Low | 59 | Low | 81 Ų | 81 | 112 Ų | 112 | 43% | 0.433 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -70.8 | -39.3 | -177 | -69.9 | -21.7 | 0 | 0 | 0 | 111.6 | Q183 L184 | N180-Q183 PolarHBondContact O-N 3.46Å; N180-L184 VanDerWaalsContact O-CB 3.31Å; N180-L184 WeakPolarHBondContact O-CB 3.14Å; N180-L184 WeakPolarHBondContact O-CG 3.2Å; N180-L184 PolarHBondContact O-N 3.47Å |
| 181 | N | 58.2 | Low | 60.1 | Low | 83 Ų | 83 | 109.1 Ų | 109.1 | 44% | 0.444 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -65.4 | -45.2 | 175.8 | -72.8 | -26.6 | 0 | 0 | 0 | 111.3 | F177 Q183 L184 D185 | F177-N181 WeakPolarHBondContact O-CB 3.44Å; F177-N181 PolarHBondContact O-N 3.46Å; F177-N181 VanDerWaalsContact O-N 3.16Å; F177-N181 PolarHBondContact O-ND2 3.42Å; N181-Q183 PolarHBondContact O-N 3.18Å; N181-L184 PolarHBondContact O-N 3.39Å; N181-D185 WeakPolarHBondContact O-CB 3.37Å; N181-D185 PolarHBondContact O-N 2.95Å; N181-D185 VanDerWaalsContact O-OD2 3.08Å |
| 182 | Q | 63.5 | Low | 61.6 | Low | 115 Ų | 115 | 108 Ų | 108 | 54% | 0.537 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.9 | -38.8 | 177.6 | -73.9 | -146 | 56.7 | 0 | 0 | 113.4 | H178 S179 H186 | H178-Q182 PolarHBondContact NE2-NE2 2.85Å; H178-Q182 WeakPolarHBondContact O-CB 3.47Å; H178-Q182 WeakPolarHBondContact O-CG 3.33Å; H178-Q182 PolarHBondContact O-N 3.26Å; S179-Q182 PolarHBondContact O-N 2.96Å; Q182-H186 VanDerWaalsContact O-CB 3.32Å; Q182-H186 WeakPolarHBondContact O-CB 3.27Å; Q182-H186 PolarHBondContact O-N 2.71Å |
| 183 | Q | 64.6 | Low | 63.3 | Low | 120 Ų | 120 | 102.8 Ų | 102.8 | 56% | 0.561 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -67.7 | -40.2 | 175.8 | -78 | -172.8 | -43.2 | 0 | 0 | 112.5 | S179 N180 N181 S187 | S179-Q183 WeakPolarHBondContact O-CB 3.38Å; S179-Q183 WeakPolarHBondContact O-CG 3.48Å; S179-Q183 PolarHBondContact O-N 3.39Å; N180-Q183 PolarHBondContact O-N 3.46Å; N181-Q183 PolarHBondContact O-N 3.18Å; Q183-S187 VanDerWaalsContact O-CB 3.27Å; Q183-S187 WeakPolarHBondContact O-CB 3.28Å; Q183-S187 PolarHBondContact O-N 3.34Å; Q183-S187 PolarHBondContact O-OG 3.17Å |
| 184 | L | 64.4 | Low | 64.9 | Low | 114 Ų | 114 | 104 Ų | 104 | 60% | 0.597 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -66.9 | -43.9 | 176.3 | -73.4 | 170.5 | 0 | 0 | 0 | 111.2 | N180 N181 H186 S187 L188 | N180-L184 VanDerWaalsContact O-CB 3.31Å; N180-L184 WeakPolarHBondContact O-CB 3.14Å; N180-L184 WeakPolarHBondContact O-CG 3.2Å; N180-L184 PolarHBondContact O-N 3.47Å; N181-L184 PolarHBondContact O-N 3.39Å; L184-H186 PolarHBondContact O-N 3.25Å; L184-S187 PolarHBondContact O-N 3.29Å; L184-L188 WeakPolarHBondContact O-CB 3.35Å; L184-L188 PolarHBondContact O-N 3.5Å |
| 185 | D | 71.4 | Confident | 66.7 | Low | 48 Ų | 48 | 98 Ų | 98 | 26% | 0.257 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.3 | -47.7 | 176.6 | -70 | -33 | 0 | 0 | 0 | 110.5 | H168 N181 L188 I189 | H168-D185 IonicContact CE1-OD1 3.71Å; H168-D185 IonicContact CE1-OD2 3.24Å; H168-D185 PolarHBondContact CE1-OD2 3.08Å; H168-D185 VanDerWaalsContact CE1-OD2 3.24Å; H168-D185 IonicContact ND1-OD2 3.94Å; N181-D185 WeakPolarHBondContact O-CB 3.37Å; N181-D185 PolarHBondContact O-N 2.95Å; N181-D185 VanDerWaalsContact O-OD2 3.08Å; D185-L188 PolarHBondContact O-N 2.75Å; D185-I189 VanDerWaalsContact O-CB 3.29Å; D185-I189 WeakPolarHBondContact O-CB 3.48Å; D185-I189 WeakPolarHBondContact O-CD1 3.26Å; D185-I189 WeakPolarHBondContact O-CG1 3.26Å; D185-I189 PolarHBondContact O-N 3.01Å |
| 186 | H | 71 | Confident | 68 | Low | 127 Ų | 127 | 94.7 Ų | 94.7 | 59% | 0.588 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.8 | -44.9 | 178.9 | -165.9 | 73.7 | 0 | 0 | 0 | 112.1 | Q182 L184 Q190 | Q182-H186 VanDerWaalsContact O-CB 3.32Å; Q182-H186 WeakPolarHBondContact O-CB 3.27Å; Q182-H186 PolarHBondContact O-N 2.71Å; L184-H186 PolarHBondContact O-N 3.25Å; H186-Q190 WeakPolarHBondContact O-CB 3.39Å; H186-Q190 PolarHBondContact O-N 2.97Å |
| 187 | S | 73.2 | Confident | 69.6 | Low | 66 Ų | 66 | 93 Ų | 93 | 46% | 0.462 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.9 | -39.4 | -179.5 | -57.2 | 0 | 0 | 0 | 0 | 112 | Q183 L184 S191 | Q183-S187 VanDerWaalsContact O-CB 3.27Å; Q183-S187 WeakPolarHBondContact O-CB 3.28Å; Q183-S187 PolarHBondContact O-N 3.34Å; Q183-S187 PolarHBondContact O-OG 3.17Å; L184-S187 PolarHBondContact O-N 3.29Å; S187-S191 VanDerWaalsContact O-CB 3.26Å; S187-S191 WeakPolarHBondContact O-CB 3.32Å; S187-S191 PolarHBondContact O-N 3.37Å; S187-S191 PolarHBondContact O-OG 2.86Å |
| 188 | L | 73.2 | Confident | 71 | Confident | 118 Ų | 118 | 93 Ų | 93 | 62% | 0.618 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -69.5 | -45.9 | 178.3 | -173.8 | 66.1 | 0 | 0 | 0 | 110.8 | L184 D185 Q190 S191 H192 | L184-L188 WeakPolarHBondContact O-CB 3.35Å; L184-L188 PolarHBondContact O-N 3.5Å; D185-L188 PolarHBondContact O-N 2.75Å; L188-Q190 VanDerWaalsContact C-N 3.32Å; L188-Q190 PolarHBondContact O-N 2.69Å; L188-S191 WeakPolarHBondContact CA-OG 3.36Å; L188-S191 PolarHBondContact O-N 3.5Å; L188-S191 PolarHBondContact O-OG 3.31Å; L188-S191 VanDerWaalsContact O-OG 3.1Å; L188-H192 WeakPolarHBondContact O-CB 3.12Å; L188-H192 PolarHBondContact O-N 2.84Å |
| 189 | I | 78.3 | Confident | 72.3 | Confident | 75 Ų | 75 | 89.8 Ų | 89.8 | 39% | 0.385 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.6 | -44.8 | 176.4 | -69.3 | 165.6 | 0 | 0 | 0 | 110.1 | L164 D185 T193 | L164-I189 HydrophobicContact CD1-CG2 4.39Å; D185-I189 VanDerWaalsContact O-CB 3.29Å; D185-I189 WeakPolarHBondContact O-CB 3.48Å; D185-I189 WeakPolarHBondContact O-CD1 3.26Å; D185-I189 WeakPolarHBondContact O-CG1 3.26Å; D185-I189 PolarHBondContact O-N 3.01Å; I189-T193 VanDerWaalsContact O-CB 3.23Å; I189-T193 WeakPolarHBondContact O-CB 3.29Å; I189-T193 PolarHBondContact O-N 3.21Å; I189-T193 PolarHBondContact O-OG1 3.26Å |
| 190 | Q | 77.1 | Confident | 73.2 | Confident | 97 Ų | 97 | 88.6 Ų | 88.6 | 45% | 0.453 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -65.2 | -50.1 | -179.7 | -173.4 | -179.4 | 22.9 | 0 | 0 | 111.8 | H186 L188 H192 T193 Q194 | H186-Q190 WeakPolarHBondContact O-CB 3.39Å; H186-Q190 PolarHBondContact O-N 2.97Å; L188-Q190 VanDerWaalsContact C-N 3.32Å; L188-Q190 PolarHBondContact O-N 2.69Å; Q190-H192 PolarHBondContact O-N 3.23Å; Q190-T193 PolarHBondContact O-N 3.38Å; Q190-Q194 WeakPolarHBondContact O-CB 3.5Å; Q190-Q194 WeakPolarHBondContact O-CG 3.19Å; Q190-Q194 PolarHBondContact O-N 3.01Å |
| 191 | S | 78 | Confident | 74.2 | Confident | 63 Ų | 63 | 87.6 Ų | 87.6 | 44% | 0.441 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -63.7 | -41.2 | -179.7 | 56.6 | 0 | 0 | 0 | 0 | 112 | S187 L188 Q194 S195 | S187-S191 VanDerWaalsContact O-CB 3.26Å; S187-S191 WeakPolarHBondContact O-CB 3.32Å; S187-S191 PolarHBondContact O-N 3.37Å; S187-S191 PolarHBondContact O-OG 2.86Å; L188-S191 WeakPolarHBondContact CA-OG 3.36Å; L188-S191 PolarHBondContact O-N 3.5Å; L188-S191 PolarHBondContact O-OG 3.31Å; L188-S191 VanDerWaalsContact O-OG 3.1Å; S191-Q194 PolarHBondContact O-N 2.89Å; S191-S195 VanDerWaalsContact O-CB 3.26Å; S191-S195 WeakPolarHBondContact O-CB 3.23Å; S191-S195 PolarHBondContact O-N 2.81Å |
| 192 | H | 75.9 | Confident | 75.1 | Confident | 86 Ų | 86 | 89 Ų | 89 | 40% | 0.398 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -67.6 | -41.8 | 177.6 | -167.7 | -112.5 | 0 | 0 | 0 | 111.8 | L188 Q190 S195 L196 | L188-H192 WeakPolarHBondContact O-CB 3.12Å; L188-H192 PolarHBondContact O-N 2.84Å; Q190-H192 PolarHBondContact O-N 3.23Å; H192-S195 PolarHBondContact O-N 3.25Å; H192-L196 WeakPolarHBondContact CE1-CD1 3.33Å; H192-L196 WeakPolarHBondContact ND1-CD1 3.37Å; H192-L196 WeakPolarHBondContact O-CB 3.35Å; H192-L196 WeakPolarHBondContact O-CG 3.4Å; H192-L196 PolarHBondContact O-N 3.21Å |
| 193 | T | 78.7 | Confident | 75.8 | Confident | 74 Ų | 74 | 86.9 Ų | 86.9 | 45% | 0.454 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -62.1 | -45 | 176.1 | -58.7 | 0 | 0 | 0 | 0 | 111.4 | I189 Q190 L197 | I189-T193 VanDerWaalsContact O-CB 3.23Å; I189-T193 WeakPolarHBondContact O-CB 3.29Å; I189-T193 PolarHBondContact O-N 3.21Å; I189-T193 PolarHBondContact O-OG1 3.26Å; Q190-T193 PolarHBondContact O-N 3.38Å; T193-L197 WeakPolarHBondContact O-CB 3.4Å; T193-L197 PolarHBondContact O-N 3.45Å |
| 194 | Q | 80.4 | Confident | 76.1 | Confident | 119 Ų | 119 | 85.3 Ų | 85.3 | 56% | 0.556 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -64.5 | -45.1 | 177.3 | -74.2 | -177.9 | 24.5 | 0 | 0 | 112 | Q190 S191 L197 Q198 | Q190-Q194 WeakPolarHBondContact O-CB 3.5Å; Q190-Q194 WeakPolarHBondContact O-CG 3.19Å; Q190-Q194 PolarHBondContact O-N 3.01Å; S191-Q194 PolarHBondContact O-N 2.89Å; Q194-L197 PolarHBondContact O-N 3.23Å; Q194-Q198 WeakPolarHBondContact O-CB 3.32Å; Q194-Q198 PolarHBondContact O-N 3.27Å |
| 195 | S | 79.3 | Confident | 76.4 | Confident | 70 Ų | 70 | 85.9 Ų | 85.9 | 49% | 0.49 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -61.3 | -45.4 | 178.7 | -177 | 0 | 0 | 0 | 0 | 111.7 | S191 H192 Q198 S199 | S191-S195 VanDerWaalsContact O-CB 3.26Å; S191-S195 WeakPolarHBondContact O-CB 3.23Å; S191-S195 PolarHBondContact O-N 2.81Å; H192-S195 PolarHBondContact O-N 3.25Å; S195-Q198 PolarHBondContact O-N 3.45Å; S195-S199 WeakPolarHBondContact O-CB 3.42Å; S195-S199 PolarHBondContact O-N 3.47Å |
| 196 | L | 77.3 | Confident | 76.4 | Confident | 57 Ų | 57 | 88.2 Ų | 88.2 | 30% | 0.298 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -62.6 | -46 | 175.9 | -80.6 | 165.2 | 0 | 0 | 0 | 112.2 | L162 H192 Q198 S199 I200 | L162-L196 HydrophobicContact CD1-CD1 4.28Å; H192-L196 WeakPolarHBondContact CE1-CD1 3.33Å; H192-L196 WeakPolarHBondContact ND1-CD1 3.37Å; H192-L196 WeakPolarHBondContact O-CB 3.35Å; H192-L196 WeakPolarHBondContact O-CG 3.4Å; H192-L196 PolarHBondContact O-N 3.21Å; L196-Q198 VanDerWaalsContact C-N 3.31Å; L196-Q198 PolarHBondContact O-N 3.11Å; L196-S199 PolarHBondContact O-N 2.92Å; L196-I200 WeakPolarHBondContact O-CB 3.34Å; L196-I200 VanDerWaalsContact O-CG1 3.28Å; L196-I200 WeakPolarHBondContact O-CG1 3.47Å; L196-I200 PolarHBondContact O-N 3.43Å |
| 197 | L | 81.3 | Confident | 76.7 | Confident | 116 Ų | 116 | 85.1 Ų | 85.1 | 61% | 0.607 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -60.8 | -43.7 | 179 | -175.3 | 67.2 | 0 | 0 | 0 | 111.1 | T193 Q194 T201 | T193-L197 WeakPolarHBondContact O-CB 3.4Å; T193-L197 PolarHBondContact O-N 3.45Å; Q194-L197 PolarHBondContact O-N 3.23Å; L197-T201 VanDerWaalsContact O-CB 3.31Å; L197-T201 WeakPolarHBondContact O-CB 3.41Å; L197-T201 PolarHBondContact O-N 2.87Å; L197-T201 PolarHBondContact O-OG1 3.46Å |
| 198 | Q | 79.3 | Confident | 76.5 | Confident | 118 Ų | 118 | 86.6 Ų | 86.6 | 55% | 0.551 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -63 | -46.6 | 176.1 | -172.4 | 178.4 | 32 | 0 | 0 | 111.2 | Q194 S195 L196 T201 Q202 | Q194-Q198 WeakPolarHBondContact O-CB 3.32Å; Q194-Q198 PolarHBondContact O-N 3.27Å; S195-Q198 PolarHBondContact O-N 3.45Å; L196-Q198 VanDerWaalsContact C-N 3.31Å; L196-Q198 PolarHBondContact O-N 3.11Å; Q198-T201 PolarHBondContact O-N 3.11Å; Q198-Q202 WeakPolarHBondContact O-CG 3.28Å; Q198-Q202 PolarHBondContact O-N 3.1Å |
| 199 | S | 79.2 | Confident | 76.3 | Confident | 65 Ų | 65 | 83.1 Ų | 83.1 | 46% | 0.455 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -59.8 | -50 | 178.8 | -172.7 | 0 | 0 | 0 | 0 | 111.1 | S195 L196 T201 Q202 S203 | S195-S199 WeakPolarHBondContact O-CB 3.42Å; S195-S199 PolarHBondContact O-N 3.47Å; L196-S199 PolarHBondContact O-N 2.92Å; S199-T201 VanDerWaalsContact C-N 3.32Å; S199-T201 PolarHBondContact O-N 3.21Å; S199-Q202 PolarHBondContact O-N 2.93Å; S199-S203 VanDerWaalsContact O-CB 3.32Å; S199-S203 WeakPolarHBondContact O-CB 3.24Å; S199-S203 PolarHBondContact O-N 3.48Å; S199-S203 PolarHBondContact O-OG 3.14Å |
| 200 | I | 76.4 | Confident | 76 | Confident | 49 Ų | 49 | 85.5 Ų | 85.5 | 25% | 0.251 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -61.5 | -42.3 | 179.5 | -69.9 | 166.4 | 0 | 0 | 0 | 110.7 | L196 Q202 I204 Y205 | L196-I200 WeakPolarHBondContact O-CB 3.34Å; L196-I200 VanDerWaalsContact O-CG1 3.28Å; L196-I200 WeakPolarHBondContact O-CG1 3.47Å; L196-I200 PolarHBondContact O-N 3.43Å; I200-Q202 VanDerWaalsContact C-N 3.34Å; I200-Q202 PolarHBondContact O-N 3.06Å; I200-I204 HydrophobicContact CG2-CD1 4.18Å; I200-I204 WeakPolarHBondContact O-CB 3.35Å; I200-I204 PolarHBondContact O-N 2.73Å; I200-Y205 PolarHBondContact O-N 2.86Å |
| 201 | T | 77.3 | Confident | 75.8 | Confident | 60 Ų | 60 | 84.2 Ų | 84.2 | 37% | 0.368 | 45% | 0.454 | S | S | . | . | I | π-helix | trans | -62.2 | -43.7 | 178.6 | -58.1 | 0 | 0 | 0 | 0 | 111.2 | L197 Q198 S199 Y205 Q206 | L197-T201 VanDerWaalsContact O-CB 3.31Å; L197-T201 WeakPolarHBondContact O-CB 3.41Å; L197-T201 PolarHBondContact O-N 2.87Å; L197-T201 PolarHBondContact O-OG1 3.46Å; Q198-T201 PolarHBondContact O-N 3.11Å; S199-T201 VanDerWaalsContact C-N 3.32Å; S199-T201 PolarHBondContact O-N 3.21Å; T201-Y205 WeakPolarHBondContact O-CB 3.3Å; T201-Y205 PolarHBondContact O-N 2.88Å; T201-Q206 PolarHBondContact O-N 3.5Å; T201-Q206 VanDerWaalsContact O-N 3.08Å |
| 202 | Q | 76.3 | Confident | 75.4 | Confident | 112 Ų | 112 | 86.9 Ų | 86.9 | 52% | 0.523 | 46% | 0.463 | S | S | . | . | I | π-helix | trans | -76 | -40.9 | -179 | -70.2 | -177.4 | 10.7 | 0 | 0 | 113 | Q198 S199 I200 P207 | Q198-Q202 WeakPolarHBondContact O-CG 3.28Å; Q198-Q202 PolarHBondContact O-N 3.1Å; S199-Q202 PolarHBondContact O-N 2.93Å; I200-Q202 VanDerWaalsContact C-N 3.34Å; I200-Q202 PolarHBondContact O-N 3.06Å; Q202-P207 WeakPolarHBondContact O-CD 3.34Å |
| 203 | S | 78.2 | Confident | 75 | Confident | 71 Ų | 71 | 86.3 Ų | 86.3 | 50% | 0.497 | 47% | 0.469 | S | S | . | . | I | π-helix | trans | -87.3 | -28.3 | -172 | 71.2 | 0 | 0 | 0 | 0 | 113.6 | S199 P207 | S199-S203 VanDerWaalsContact O-CB 3.32Å; S199-S203 WeakPolarHBondContact O-CB 3.24Å; S199-S203 PolarHBondContact O-N 3.48Å; S199-S203 PolarHBondContact O-OG 3.14Å; S203-P207 WeakPolarHBondContact O-CG 3.2Å |
| 204 | I | 72.3 | Confident | 74.2 | Confident | 86 Ų | 86 | 88.7 Ų | 88.7 | 44% | 0.441 | 47% | 0.474 | S | S | . | . | I | π-helix | trans | -112.2 | -54.7 | -174.8 | -63.9 | 164.4 | 0 | 0 | 0 | 110 | I200 P207 L208 | I200-I204 HydrophobicContact CG2-CD1 4.18Å; I200-I204 WeakPolarHBondContact O-CB 3.35Å; I200-I204 PolarHBondContact O-N 2.73Å; I204-P207 WeakPolarHBondContact O-CD 3.47Å; I204-L208 HydrophobicContact CG2-CD1 3.52Å; I204-L208 VanDerWaalsContact O-CB 3.3Å; I204-L208 WeakPolarHBondContact O-CB 3.36Å; I204-L208 WeakPolarHBondContact O-CD1 3.31Å; I204-L208 VanDerWaalsContact O-CG 3.24Å; I204-L208 WeakPolarHBondContact O-CG 3.34Å; I204-L208 PolarHBondContact O-N 3.39Å |
| 205 | Y | 70.2 | Confident | 73.5 | Confident | 127 Ų | 127 | 86.3 Ų | 86.3 | 50% | 0.498 | 47% | 0.47 | S | S | . | . | I | π-helix | trans | -69 | -45.4 | -171.1 | -169.4 | -94.3 | 0 | 0 | 0 | 112.6 | I200 T201 T209 | I200-Y205 PolarHBondContact O-N 2.86Å; T201-Y205 WeakPolarHBondContact O-CB 3.3Å; T201-Y205 PolarHBondContact O-N 2.88Å; Y205-T209 HydrophobicContact CD1-CG2 4.04Å; Y205-T209 HydrophobicContact CE1-CG2 3.65Å; Y205-T209 HydrophobicContact CE2-CG2 4.25Å; Y205-T209 HydrophobicContact CG-CG2 4.5Å; Y205-T209 WeakPolarHBondContact O-CB 3.23Å; Y205-T209 WeakPolarHBondContact O-CG2 3.31Å; Y205-T209 PolarHBondContact O-N 3.26Å; Y205-T209 PolarHBondContact O-OG1 3.2Å |
| 206 | Q | 71.1 | Confident | 72.5 | Confident | 96 Ų | 96 | 88.7 Ų | 88.7 | 45% | 0.449 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63.9 | -49.7 | 179.2 | -70.7 | -163.8 | 33.4 | 0 | 0 | 113 | T201 L208 T209 H210 | T201-Q206 PolarHBondContact O-N 3.5Å; T201-Q206 VanDerWaalsContact O-N 3.08Å; Q206-L208 VanDerWaalsContact C-N 3.32Å; Q206-L208 PolarHBondContact O-N 2.91Å; Q206-T209 WeakPolarHBondContact CA-OG1 3.4Å; Q206-T209 PolarHBondContact O-N 3.31Å; Q206-T209 PolarHBondContact O-OG1 3.14Å; Q206-H210 PolarHBondContact O-N 3.18Å; Q206-H210 PolarHBondContact O-ND1 2.72Å |
| 207 | P | 76.8 | Confident | 71.8 | Confident | 63 Ų | 63 | 92.4 Ų | 92.4 | 41% | 0.409 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.2 | -36 | -179.1 | -25.8 | 38.1 | 0 | 0 | 0 | 112.7 | Q202 S203 I204 S211 | Q202-P207 WeakPolarHBondContact O-CD 3.34Å; S203-P207 WeakPolarHBondContact O-CG 3.2Å; I204-P207 WeakPolarHBondContact O-CD 3.47Å; P207-S211 WeakPolarHBondContact O-CB 3.17Å; P207-S211 PolarHBondContact O-N 3.43Å; P207-S211 PolarHBondContact O-OG 3.37Å |
| 208 | L | 69.7 | Low | 70.9 | Confident | 96 Ų | 96 | 90.6 Ų | 90.6 | 50% | 0.503 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -66.4 | -45.8 | 177.3 | -76.3 | 168.6 | 0 | 0 | 0 | 111.9 | I204 Q206 S211 L212 | I204-L208 HydrophobicContact CG2-CD1 3.52Å; I204-L208 VanDerWaalsContact O-CB 3.3Å; I204-L208 WeakPolarHBondContact O-CB 3.36Å; I204-L208 WeakPolarHBondContact O-CD1 3.31Å; I204-L208 VanDerWaalsContact O-CG 3.24Å; I204-L208 WeakPolarHBondContact O-CG 3.34Å; I204-L208 PolarHBondContact O-N 3.39Å; Q206-L208 VanDerWaalsContact C-N 3.32Å; Q206-L208 PolarHBondContact O-N 2.91Å; L208-S211 PolarHBondContact O-N 3.25Å; L208-L212 VanDerWaalsContact O-CB 3.31Å; L208-L212 WeakPolarHBondContact O-CB 3.49Å; L208-L212 VanDerWaalsContact O-CG 3.23Å; L208-L212 WeakPolarHBondContact O-CG 3.37Å; L208-L212 PolarHBondContact O-N 3.19Å |
| 209 | T | 70.1 | Confident | 70 | Confident | 46 Ų | 46 | 89 Ų | 89 | 28% | 0.282 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.5 | -44.4 | 177.3 | 47.9 | 0 | 0 | 0 | 0 | 111.4 | Y205 Q206 S211 L212 S213 | Y205-T209 HydrophobicContact CD1-CG2 4.04Å; Y205-T209 HydrophobicContact CE1-CG2 3.65Å; Y205-T209 HydrophobicContact CE2-CG2 4.25Å; Y205-T209 HydrophobicContact CG-CG2 4.5Å; Y205-T209 WeakPolarHBondContact O-CB 3.23Å; Y205-T209 WeakPolarHBondContact O-CG2 3.31Å; Y205-T209 PolarHBondContact O-N 3.26Å; Y205-T209 PolarHBondContact O-OG1 3.2Å; Q206-T209 WeakPolarHBondContact CA-OG1 3.4Å; Q206-T209 PolarHBondContact O-N 3.31Å; Q206-T209 PolarHBondContact O-OG1 3.14Å; T209-S211 PolarHBondContact O-N 2.92Å; T209-L212 PolarHBondContact O-N 3.28Å; T209-S213 WeakPolarHBondContact O-CB 3.29Å; T209-S213 PolarHBondContact O-N 3.48Å; T209-S213 PolarHBondContact O-OG 3.05Å; T209-S213 VanDerWaalsContact O-OG 3.06Å |
| 210 | H | 71.1 | Confident | 69 | Low | 125 Ų | 125 | 90.7 Ų | 90.7 | 58% | 0.579 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -62.9 | -43.4 | 175.1 | -73.6 | 78.6 | 0 | 0 | 0 | 112.2 | Q206 S213 H214 | Q206-H210 PolarHBondContact O-N 3.18Å; Q206-H210 PolarHBondContact O-ND1 2.72Å; H210-S213 PolarHBondContact O-N 3.36Å; H210-H214 VanDerWaalsContact O-CB 3.29Å; H210-H214 WeakPolarHBondContact O-CB 3.36Å; H210-H214 PolarHBondContact O-N 2.96Å |
| 211 | S | 72.6 | Confident | 68.3 | Low | 69 Ų | 69 | 91.1 Ų | 91.1 | 48% | 0.483 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -66.7 | -40.7 | -179.3 | -60.5 | 0 | 0 | 0 | 0 | 111.9 | P207 L208 T209 S215 | P207-S211 WeakPolarHBondContact O-CB 3.17Å; P207-S211 PolarHBondContact O-N 3.43Å; P207-S211 PolarHBondContact O-OG 3.37Å; L208-S211 PolarHBondContact O-N 3.25Å; T209-S211 PolarHBondContact O-N 2.92Å; S211-S215 VanDerWaalsContact O-CB 3.28Å; S211-S215 WeakPolarHBondContact O-CB 3.28Å; S211-S215 PolarHBondContact O-N 2.96Å; S211-S215 PolarHBondContact O-OG 3.42Å |
| 212 | L | 68.9 | Low | 67.3 | Low | 119 Ų | 119 | 93.9 Ų | 93.9 | 62% | 0.623 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -68.5 | -43.5 | 177 | -72.3 | 168.5 | 0 | 0 | 0 | 111.1 | L208 T209 H214 S215 H216 | L208-L212 VanDerWaalsContact O-CB 3.31Å; L208-L212 WeakPolarHBondContact O-CB 3.49Å; L208-L212 VanDerWaalsContact O-CG 3.23Å; L208-L212 WeakPolarHBondContact O-CG 3.37Å; L208-L212 PolarHBondContact O-N 3.19Å; T209-L212 PolarHBondContact O-N 3.28Å; L212-H214 PolarHBondContact O-N 3.34Å; L212-S215 PolarHBondContact O-N 3.2Å; L212-H216 WeakPolarHBondContact O-CB 3.48Å; L212-H216 PolarHBondContact O-N 2.94Å |
| 213 | S | 68.4 | Low | 66.4 | Low | 75 Ų | 75 | 92.5 Ų | 92.5 | 52% | 0.524 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.1 | -42.9 | 174.6 | -66.3 | 0 | 0 | 0 | 0 | 111.8 | T209 H210 H216 M217 | T209-S213 WeakPolarHBondContact O-CB 3.29Å; T209-S213 PolarHBondContact O-N 3.48Å; T209-S213 PolarHBondContact O-OG 3.05Å; T209-S213 VanDerWaalsContact O-OG 3.06Å; H210-S213 PolarHBondContact O-N 3.36Å; S213-H216 PolarHBondContact O-N 3.29Å; S213-M217 WeakPolarHBondContact O-CG 3.36Å; S213-M217 PolarHBondContact O-N 3.28Å |
| 214 | H | 62.9 | Low | 65.4 | Low | 124 Ų | 124 | 93.5 Ų | 93.5 | 57% | 0.574 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -66.8 | -42.4 | 177.8 | -158 | 74.4 | 0 | 0 | 0 | 111.7 | H210 L212 H216 M217 L218 | H210-H214 VanDerWaalsContact O-CB 3.29Å; H210-H214 WeakPolarHBondContact O-CB 3.36Å; H210-H214 PolarHBondContact O-N 2.96Å; L212-H214 PolarHBondContact O-N 3.34Å; H214-H216 VanDerWaalsContact C-N 3.31Å; H214-H216 PolarHBondContact O-N 3.12Å; H214-M217 WeakPolarHBondContact O-CB 3.24Å; H214-M217 PolarHBondContact O-N 3.29Å; H214-L218 WeakPolarHBondContact CD2-CD1 3.47Å; H214-L218 WeakPolarHBondContact O-CD1 3.43Å; H214-L218 PolarHBondContact O-N 2.89Å |
| 215 | S | 64.1 | Low | 64.8 | Low | 68 Ų | 68 | 92.8 Ų | 92.8 | 48% | 0.476 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.4 | -43 | 174.7 | -59.9 | 0 | 0 | 0 | 0 | 111.2 | S211 L212 M217 L218 T219 | S211-S215 VanDerWaalsContact O-CB 3.28Å; S211-S215 WeakPolarHBondContact O-CB 3.28Å; S211-S215 PolarHBondContact O-N 2.96Å; S211-S215 PolarHBondContact O-OG 3.42Å; L212-S215 PolarHBondContact O-N 3.2Å; S215-M217 VanDerWaalsContact C-N 3.35Å; S215-M217 PolarHBondContact O-N 3.08Å; S215-L218 PolarHBondContact O-N 3.03Å; S215-T219 PolarHBondContact O-N 2.9Å; S215-T219 PolarHBondContact O-OG1 3.38Å; S215-T219 VanDerWaalsContact O-OG1 3.05Å |
| 216 | H | 59.6 | Low | 64.2 | Low | 120 Ų | 120 | 92.9 Ų | 92.9 | 56% | 0.556 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.9 | -40.6 | 177 | -156.4 | -102.7 | 0 | 0 | 0 | 111.5 | L212 S213 H214 T219 H220 | L212-H216 WeakPolarHBondContact O-CB 3.48Å; L212-H216 PolarHBondContact O-N 2.94Å; S213-H216 PolarHBondContact O-N 3.29Å; H214-H216 VanDerWaalsContact C-N 3.31Å; H214-H216 PolarHBondContact O-N 3.12Å; H216-T219 PolarHBondContact O-N 3.22Å; H216-H220 AromaticContact CE1-CE1 2.96Å; H216-H220 PolarHBondContact CE1-CE1 3.34Å; H216-H220 AromaticContact CE1-ND1 3.68Å; H216-H220 AromaticContact CE1-NE2 3.72Å; H216-H220 AromaticContact CG-CE1 3.93Å; H216-H220 AromaticContact CG-ND1 3.96Å; H216-H220 AromaticContact ND1-CE1 3.2Å; H216-H220 PolarHBondContact ND1-CE1 2.78Å; H216-H220 AromaticContact ND1-ND1 3.42Å; H216-H220 PolarHBondContact ND1-ND1 3.45Å; H216-H220 AromaticContact NE2-CE1 3.53Å; H216-H220 PolarHBondContact O-N 2.75Å; H216-H220 PolarHBondContact O-ND1 3Å |
| 217 | M | 61.2 | Low | 63.5 | Low | 135 Ų | 135 | 92.9 Ų | 92.9 | 67% | 0.665 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.9 | -42.1 | 173.5 | -75.5 | -162.8 | 71.2 | 0 | 0 | 112.5 | S213 H214 S215 H220 S221 | S213-M217 WeakPolarHBondContact O-CG 3.36Å; S213-M217 PolarHBondContact O-N 3.28Å; H214-M217 WeakPolarHBondContact O-CB 3.24Å; H214-M217 PolarHBondContact O-N 3.29Å; S215-M217 VanDerWaalsContact C-N 3.35Å; S215-M217 PolarHBondContact O-N 3.08Å; M217-H220 PolarHBondContact O-N 2.96Å; M217-S221 WeakPolarHBondContact O-CB 3.34Å; M217-S221 PolarHBondContact O-N 3.49Å; M217-S221 PolarHBondContact O-OG 2.76Å |
| 218 | L | 62.8 | Low | 62.3 | Low | 78 Ų | 78 | 97.3 Ų | 97.3 | 41% | 0.408 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.5 | -47.6 | 174.4 | -91.7 | 89.4 | 0 | 0 | 0 | 111 | H214 S215 H220 S221 H222 | H214-L218 WeakPolarHBondContact CD2-CD1 3.47Å; H214-L218 WeakPolarHBondContact O-CD1 3.43Å; H214-L218 PolarHBondContact O-N 2.89Å; S215-L218 PolarHBondContact O-N 3.03Å; L218-H220 VanDerWaalsContact C-N 3.28Å; L218-H220 PolarHBondContact O-N 2.8Å; L218-S221 WeakPolarHBondContact CA-OG 3.3Å; L218-S221 PolarHBondContact O-N 3.46Å; L218-S221 VanDerWaalsContact O-N 3.12Å; L218-S221 PolarHBondContact O-OG 2.83Å; L218-H222 PolarHBondContact O-CD2 3.05Å; L218-H222 VanDerWaalsContact O-CD2 3.29Å; L218-H222 PolarHBondContact O-N 2.96Å |
| 219 | T | 61.7 | Low | 61.4 | Low | 85 Ų | 85 | 98.8 Ų | 98.8 | 52% | 0.521 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -58.5 | -40 | 178.6 | -53.9 | 0 | 0 | 0 | 0 | 112.1 | S215 H216 T223 | S215-T219 PolarHBondContact O-N 2.9Å; S215-T219 PolarHBondContact O-OG1 3.38Å; S215-T219 VanDerWaalsContact O-OG1 3.05Å; H216-T219 PolarHBondContact O-N 3.22Å; T219-T223 WeakPolarHBondContact O-CB 3.4Å; T219-T223 PolarHBondContact O-N 3.36Å; T219-T223 PolarHBondContact O-OG1 3.01Å |
| 220 | H | 57.7 | Low | 60.3 | Low | 101 Ų | 101 | 102.2 Ų | 102.2 | 47% | 0.468 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -66.4 | -46 | 175.4 | -75.2 | 64.4 | 0 | 0 | 0 | 111.3 | H216 M217 L218 H222 T223 T224 | H216-H220 AromaticContact CE1-CE1 2.96Å; H216-H220 PolarHBondContact CE1-CE1 3.34Å; H216-H220 AromaticContact CE1-ND1 3.68Å; H216-H220 AromaticContact CE1-NE2 3.72Å; H216-H220 AromaticContact CG-CE1 3.93Å; H216-H220 AromaticContact CG-ND1 3.96Å; H216-H220 AromaticContact ND1-CE1 3.2Å; H216-H220 PolarHBondContact ND1-CE1 2.78Å; H216-H220 AromaticContact ND1-ND1 3.42Å; H216-H220 PolarHBondContact ND1-ND1 3.45Å; H216-H220 AromaticContact NE2-CE1 3.53Å; H216-H220 PolarHBondContact O-N 2.75Å; H216-H220 PolarHBondContact O-ND1 3Å; M217-H220 PolarHBondContact O-N 2.96Å; L218-H220 VanDerWaalsContact C-N 3.28Å; L218-H220 PolarHBondContact O-N 2.8Å; H220-H222 VanDerWaalsContact C-N 3.33Å; H220-H222 PolarHBondContact O-N 3.42Å; H220-T223 PolarHBondContact O-N 3.37Å; H220-T224 PolarHBondContact O-N 3.32Å; H220-T224 PolarHBondContact O-OG1 3.03Å |
| 221 | S | 61.1 | Low | 59.4 | Low | 58 Ų | 58 | 100.9 Ų | 100.9 | 41% | 0.406 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.2 | -39.1 | 178.4 | 72.3 | 0 | 0 | 0 | 0 | 112.9 | M217 L218 T225 | M217-S221 WeakPolarHBondContact O-CB 3.34Å; M217-S221 PolarHBondContact O-N 3.49Å; M217-S221 PolarHBondContact O-OG 2.76Å; L218-S221 WeakPolarHBondContact CA-OG 3.3Å; L218-S221 PolarHBondContact O-N 3.46Å; L218-S221 VanDerWaalsContact O-N 3.12Å; L218-S221 PolarHBondContact O-OG 2.83Å; S221-T225 WeakPolarHBondContact O-CB 3.43Å; S221-T225 VanDerWaalsContact O-CG2 3.3Å; S221-T225 WeakPolarHBondContact O-CG2 3.32Å; S221-T225 PolarHBondContact O-N 3.16Å; S221-T225 PolarHBondContact O-OG1 2.91Å |
| 222 | H | 55.9 | Low | 58.5 | Low | 118 Ų | 118 | 102.9 Ų | 102.9 | 55% | 0.546 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -68.7 | -40.9 | 175.7 | -85.2 | -83.3 | 0 | 0 | 0 | 112 | L218 H220 T225 L226 | L218-H222 PolarHBondContact O-CD2 3.05Å; L218-H222 VanDerWaalsContact O-CD2 3.29Å; L218-H222 PolarHBondContact O-N 2.96Å; H220-H222 VanDerWaalsContact C-N 3.33Å; H220-H222 PolarHBondContact O-N 3.42Å; H222-T225 WeakPolarHBondContact CA-OG1 3.22Å; H222-T225 PolarHBondContact O-N 2.98Å; H222-T225 PolarHBondContact O-OG1 3.1Å; H222-L226 WeakPolarHBondContact O-CB 3.43Å; H222-L226 PolarHBondContact O-N 2.7Å |
| 223 | T | 58.4 | Low | 57.6 | Low | 83 Ų | 83 | 106 Ų | 106 | 51% | 0.509 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66.2 | -42.1 | 178 | -53.3 | 0 | 0 | 0 | 0 | 111.2 | T219 H220 L226 T227 | T219-T223 WeakPolarHBondContact O-CB 3.4Å; T219-T223 PolarHBondContact O-N 3.36Å; T219-T223 PolarHBondContact O-OG1 3.01Å; H220-T223 PolarHBondContact O-N 3.37Å; T223-L226 PolarHBondContact O-N 3.02Å; T223-T227 WeakPolarHBondContact O-CB 3.35Å; T223-T227 WeakPolarHBondContact O-CG2 3.43Å; T223-T227 PolarHBondContact O-N 3.08Å; T223-T227 PolarHBondContact O-OG1 3.46Å |
| 224 | T | 56.8 | Low | 56.5 | Low | 91 Ų | 91 | 107.2 Ų | 107.2 | 56% | 0.558 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -67.3 | -40.7 | 177 | -54.5 | 0 | 0 | 0 | 0 | 112.1 | H220 T227 H228 | H220-T224 PolarHBondContact O-N 3.32Å; H220-T224 PolarHBondContact O-OG1 3.03Å; T224-T227 WeakPolarHBondContact CA-OG1 3.23Å; T224-T227 PolarHBondContact O-OG1 2.93Å; T224-T227 VanDerWaalsContact O-OG1 3.1Å; T224-H228 VanDerWaalsContact O-CB 3.23Å; T224-H228 WeakPolarHBondContact O-CB 3.35Å; T224-H228 PolarHBondContact O-N 3.01Å |
| 225 | T | 60.7 | Low | 55.9 | Low | 72 Ų | 72 | 107.9 Ų | 107.9 | 44% | 0.442 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -68.4 | -37.8 | 177 | 48.2 | 0 | 0 | 0 | 0 | 112.2 | S221 H222 N229 | S221-T225 WeakPolarHBondContact O-CB 3.43Å; S221-T225 VanDerWaalsContact O-CG2 3.3Å; S221-T225 WeakPolarHBondContact O-CG2 3.32Å; S221-T225 PolarHBondContact O-N 3.16Å; S221-T225 PolarHBondContact O-OG1 2.91Å; H222-T225 WeakPolarHBondContact CA-OG1 3.22Å; H222-T225 PolarHBondContact O-N 2.98Å; H222-T225 PolarHBondContact O-OG1 3.1Å; T225-N229 VanDerWaalsContact O-CB 3.22Å; T225-N229 WeakPolarHBondContact O-CB 3.45Å; T225-N229 PolarHBondContact O-N 3.45Å; T225-N229 PolarHBondContact O-ND2 3.47Å; T225-N229 VanDerWaalsContact O-ND2 3.16Å |
| 226 | L | 56.5 | Low | 55.1 | Low | 128 Ų | 128 | 109.8 Ų | 109.8 | 67% | 0.67 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -67.8 | -41 | 176.3 | -131 | 106.9 | 0 | 0 | 0 | 112.1 | H222 T223 H230 | H222-L226 WeakPolarHBondContact O-CB 3.43Å; H222-L226 PolarHBondContact O-N 2.7Å; T223-L226 PolarHBondContact O-N 3.02Å; L226-H230 VanDerWaalsContact O-CB 3.31Å; L226-H230 WeakPolarHBondContact O-CB 3.31Å; L226-H230 PolarHBondContact O-N 3.49Å; L226-H230 VanDerWaalsContact O-N 3.08Å |
| 227 | T | 55.8 | Low | 54.4 | Low | 97 Ų | 97 | 111.6 Ų | 111.6 | 60% | 0.595 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -71.6 | -33.2 | 177.9 | 45.2 | 0 | 0 | 0 | 0 | 112.8 | T223 T224 | T223-T227 WeakPolarHBondContact O-CB 3.35Å; T223-T227 WeakPolarHBondContact O-CG2 3.43Å; T223-T227 PolarHBondContact O-N 3.08Å; T223-T227 PolarHBondContact O-OG1 3.46Å; T224-T227 WeakPolarHBondContact CA-OG1 3.23Å; T224-T227 PolarHBondContact O-OG1 2.93Å; T224-T227 VanDerWaalsContact O-OG1 3.1Å |
| 228 | H | 51.2 | Low | 53.6 | Low | 156 Ų | 156 | 113.5 Ų | 113.5 | 72% | 0.722 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -77.1 | -33.1 | 176.5 | -164.8 | 69.6 | 0 | 0 | 0 | 112.9 | T224 | T224-H228 VanDerWaalsContact O-CB 3.23Å; T224-H228 WeakPolarHBondContact O-CB 3.35Å; T224-H228 PolarHBondContact O-N 3.01Å |
| 229 | N | 51.8 | Low | 52.7 | Low | 127 Ų | 127 | 116.7 Ų | 116.7 | 68% | 0.679 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -84.9 | -14 | 179.1 | -68.6 | -25 | 0 | 0 | 0 | 113.7 | T225 P231 | T225-N229 VanDerWaalsContact O-CB 3.22Å; T225-N229 WeakPolarHBondContact O-CB 3.45Å; T225-N229 PolarHBondContact O-N 3.45Å; T225-N229 PolarHBondContact O-ND2 3.47Å; T225-N229 VanDerWaalsContact O-ND2 3.16Å; N229-P231 VanDerWaalsContact C-CD 3.45Å; N229-P231 VanDerWaalsContact O-CD 3.32Å; N229-P231 WeakPolarHBondContact O-CD 3.46Å |
| 230 | H | 47.1 | Very low | 52.2 | Low | 118 Ų | 118 | 124 Ų | 124 | 55% | 0.546 | 69% | 0.689 | S | S | . | * | S | Bend | trans | -115.9 | 77.5 | 174.2 | -166 | -85.6 | 0 | 0 | 0 | 109.2 | L226 T232 | L226-H230 VanDerWaalsContact O-CB 3.31Å; L226-H230 WeakPolarHBondContact O-CB 3.31Å; L226-H230 PolarHBondContact O-N 3.49Å; L226-H230 VanDerWaalsContact O-N 3.08Å; H230-T232 PolarHBondContact O-N 2.95Å |
| 231 | P | 51.4 | Low | 51.9 | Low | 96 Ų | 96 | 125.2 Ų | 125.2 | 62% | 0.623 | 70% | 0.7 | S | S | * | * | trans | -56.4 | 114.5 | 165.2 | 25.1 | -30.7 | 0 | 0 | 0 | 106.2 | N229 F233 | N229-P231 VanDerWaalsContact C-CD 3.45Å; N229-P231 VanDerWaalsContact O-CD 3.32Å; N229-P231 WeakPolarHBondContact O-CD 3.46Å; P231-F233 PolarHBondContact O-N 2.7Å | ||
| 232 | T | 54.5 | Low | 51.4 | Low | 111 Ų | 111 | 128.7 Ų | 128.7 | 68% | 0.681 | 72% | 0.716 | S | S | * | * | trans | -41.8 | 117.6 | 169.1 | 45.7 | 0 | 0 | 0 | 0 | 107.4 | H230 S234 | H230-T232 PolarHBondContact O-N 2.95Å; T232-S234 PolarHBondContact O-N 3.35Å | ||
| 233 | F | 49.6 | Very low | 51.1 | Low | 186 Ų | 186 | 129.3 Ų | 129.3 | 82% | 0.816 | 73% | 0.725 | S | S | * | * | trans | -57.4 | 89.9 | 167.2 | -84.3 | -90.7 | 0 | 0 | 0 | 106.7 | P231 T235 | P231-F233 PolarHBondContact O-N 2.7Å; F233-T235 VanDerWaalsContact C-N 3.34Å; F233-T235 PolarHBondContact O-N 3.41Å | ||
| 234 | S | 45.5 | Very low | 50.7 | Low | 100 Ų | 100 | 132 Ų | 132 | 70% | 0.699 | 74% | 0.738 | S | S | * | * | trans | -62.2 | 105 | 166.8 | -70.4 | 0 | 0 | 0 | 0 | 105.6 | T232 S236 | T232-S234 PolarHBondContact O-N 3.35Å; S234-S236 PolarHBondContact O-N 2.81Å | ||
| 235 | T | 49.5 | Very low | 50.3 | Low | 137 Ų | 137 | 134.6 Ų | 134.6 | 84% | 0.84 | 75% | 0.749 | S | S | * | * | trans | -61.3 | 83.2 | 171.6 | 47.5 | 0 | 0 | 0 | 0 | 109.1 | F233 | F233-T235 VanDerWaalsContact C-N 3.34Å; F233-T235 PolarHBondContact O-N 3.41Å | ||
| 236 | S | 47.3 | Very low | 49.6 | Very low | 109 Ų | 109 | 138.7 Ų | 138.7 | 76% | 0.762 | 77% | 0.769 | S | S | * | * | trans | -99 | 70.2 | 162.7 | 61.5 | 0 | 0 | 0 | 0 | 108.5 | S234 | S234-S236 PolarHBondContact O-N 2.81Š| ||
| 237 | L | 44.9 | Very low | 49.2 | Very low | 158 Ų | 158 | 139.5 Ų | 139.5 | 83% | 0.827 | 78% | 0.776 | S | S | * | * | trans | -135.2 | 87.6 | 169 | -95.6 | 114.3 | 0 | 0 | 0 | 107.3 | ||||
| 238 | L | 46.2 | Very low | 48.6 | Very low | 174 Ų | 174 | 142.8 Ų | 142.8 | 91% | 0.911 | 79% | 0.79 | S | S | * | * | trans | -179 | 66.3 | 157.9 | -98.5 | 143.4 | 0 | 0 | 0 | 110 | ||||
| 239 | T | 42.2 | Very low | 48.4 | Very low | 145 Ų | 145 | 141.7 Ų | 141.7 | 89% | 0.89 | 80% | 0.796 | S | S | * | * | trans | -146.1 | 88.4 | 157.7 | 38.6 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 240 | N | 51.1 | Low | 48.1 | Very low | 239 Ų | 239 | 143 Ų | 143 | 100% | 1.278 | 81% | 0.807 | S | S | * | * | trans | -160.2 | 0 | 146.9 | -138.6 | -1.3 | 0 | 0 | 0 | 108.7 |
Retrieved 240 of 240 residues in 76.7 ms
(Link to these results)