| 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 | Very low | 42.9 | Very low | 232 Ų | 232 | 141 Ų | 141 | 100% | 1.143 | 81% | 0.807 | S | S | * | * | 0 | 49.5 | 0 | -71.2 | 168.4 | 163.4 | 0 | 0 | 109.5 | |||||
| 2 | D | 42.1 | Very low | 42.9 | Very low | 137 Ų | 137 | 141.9 Ų | 141.9 | 73% | 0.733 | 80% | 0.799 | S | S | * | * | 16.2 | 149.1 | 112.7 | -47.5 | -81 | 0 | 0 | 0 | 119.9 | |||||
| 3 | H | 45.5 | Very low | 42.7 | Very low | 170 Ų | 170 | 143.1 Ų | 143.1 | 79% | 0.787 | 79% | 0.794 | S | S | * | * | trans | 99.1 | 100.9 | 167.4 | -59.9 | -69.6 | 0 | 0 | 0 | 115.3 | ||||
| 4 | I | 46.5 | Very low | 42.5 | Very low | 149 Ų | 149 | 146.3 Ų | 146.3 | 76% | 0.764 | 80% | 0.8 | S | S | * | * | 67.1 | 123.2 | 61.9 | -58.6 | -172 | 0 | 0 | 0 | 113.8 | I6 | I4-I6 HydrophobicContact CG2-CD1 3.86Å; I4-I6 HydrophobicContact CG2-CG1 4.11Å | |||
| 5 | G | 39.4 | Very low | 42.4 | Very low | 68 Ų | 68 | 142.2 Ų | 142.2 | 70% | 0.701 | 79% | 0.793 | S | S | * | * | trans | 154.2 | 83 | 160.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 6 | I | 42 | Very low | 42.4 | Very low | 140 Ų | 140 | 142.9 Ų | 142.9 | 72% | 0.718 | 79% | 0.788 | S | S | * | * | 73.8 | 129.3 | 75.2 | -56.1 | 178.9 | 0 | 0 | 0 | 113.6 | I4 | I4-I6 HydrophobicContact CG2-CD1 3.86Å; I4-I6 HydrophobicContact CG2-CG1 4.11Å | |||
| 7 | L | 42.2 | Very low | 42.5 | Very low | 171 Ų | 171 | 141.6 Ų | 141.6 | 90% | 0.895 | 79% | 0.785 | S | S | * | * | trans | 95.4 | 114 | 160.6 | -52.5 | -177.9 | 0 | 0 | 0 | 119.1 | ||||
| 8 | G | 37.3 | Very low | 42.8 | Very low | 75 Ų | 75 | 141.3 Ų | 141.3 | 77% | 0.773 | 78% | 0.776 | S | S | * | * | trans | 174.6 | 56.6 | 163.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | H10 | G8-H10 PolarHBondContact O-N 3.17Å; G8-H10 VanDerWaalsContact O-N 3.17Å | ||
| 9 | A | 45.2 | Very low | 43.5 | Very low | 107 Ų | 107 | 139.4 Ų | 139.4 | 88% | 0.884 | 77% | 0.772 | S | S | * | * | trans | -63.1 | 110.1 | 171 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 10 | H | 42 | Very low | 43.8 | Very low | 165 Ų | 165 | 139.7 Ų | 139.7 | 76% | 0.764 | 77% | 0.77 | S | S | * | * | trans | -100.1 | 99.1 | 165.6 | -165.4 | 53.8 | 0 | 0 | 0 | 109.4 | G8 Q12 | G8-H10 PolarHBondContact O-N 3.17Å; G8-H10 VanDerWaalsContact O-N 3.17Å; H10-Q12 PolarHBondContact O-N 3.17Å; H10-Q12 VanDerWaalsContact O-N 3.16Å | ||
| 11 | L | 42.7 | Very low | 43.9 | Very low | 137 Ų | 137 | 137.3 Ų | 137.3 | 72% | 0.717 | 76% | 0.763 | S | S | * | * | trans | -63.7 | 98.8 | 171.9 | -175.3 | 71.2 | 0 | 0 | 0 | 109.4 | Q13 | L11-Q13 HydrophobicContact CD2-CG 4.16Å; L11-Q13 HydrophobicContact CG-CG 4.21Å; L11-Q13 PolarHBondContact O-N 3.1Å | ||
| 12 | Q | 42.4 | Very low | 44 | Very low | 152 Ų | 152 | 134.2 Ų | 134.2 | 71% | 0.71 | 74% | 0.744 | S | S | * | * | trans | -74.9 | 92.2 | 166.9 | -168.3 | 71 | 35.8 | 0 | 0 | 108 | H10 H14 | H10-Q12 PolarHBondContact O-N 3.17Å; H10-Q12 VanDerWaalsContact O-N 3.16Å; Q12-H14 PolarHBondContact O-N 3.16Å; Q12-H14 VanDerWaalsContact O-N 3.17Å | ||
| 13 | Q | 40.5 | Very low | 44.3 | Very low | 157 Ų | 157 | 130.2 Ų | 130.2 | 73% | 0.734 | 74% | 0.735 | S | S | * | * | trans | -61.4 | 114.9 | 171.1 | -79.7 | -179.5 | -39.6 | 0 | 0 | 109.8 | L11 A15 | L11-Q13 HydrophobicContact CD2-CG 4.16Å; L11-Q13 HydrophobicContact CG-CG 4.21Å; L11-Q13 PolarHBondContact O-N 3.1Å; Q13-A15 PolarHBondContact O-N 3.05Å; Q13-A15 VanDerWaalsContact O-N 3.1Å | ||
| 14 | H | 40.4 | Very low | 44.7 | Very low | 188 Ų | 188 | 127.8 Ų | 127.8 | 87% | 0.87 | 73% | 0.727 | S | S | * | * | trans | -67.4 | 97.7 | 161.2 | -93.4 | -90.5 | 0 | 0 | 0 | 108.5 | Q12 H16 | Q12-H14 PolarHBondContact O-N 3.16Å; Q12-H14 VanDerWaalsContact O-N 3.17Å; H14-H16 PolarHBondContact O-N 3.38Å | ||
| 15 | A | 40.6 | Very low | 44.9 | Very low | 85 Ų | 85 | 126.7 Ų | 126.7 | 70% | 0.702 | 72% | 0.723 | S | S | * | * | trans | -82.2 | 99.8 | 160.8 | 0 | 0 | 0 | 0 | 0 | 107.8 | Q13 V17 | Q13-A15 PolarHBondContact O-N 3.05Å; Q13-A15 VanDerWaalsContact O-N 3.1Å; A15-V17 PolarHBondContact O-N 3.41Å | ||
| 16 | H | 42.4 | Very low | 45.5 | Very low | 153 Ų | 153 | 130.7 Ų | 130.7 | 71% | 0.708 | 72% | 0.723 | S | S | * | * | trans | -71 | 92.2 | 168.6 | -173.9 | -104.7 | 0 | 0 | 0 | 108.5 | H14 E18 | H14-H16 PolarHBondContact O-N 3.38Å; H16-E18 IonicContact CE1-OE1 2.94Å; H16-E18 PolarHBondContact CE1-OE1 3.02Å; H16-E18 IonicContact ND1-OE1 3.22Å; H16-E18 IonicContact NE2-OE1 2.65Å; H16-E18 PolarHBondContact O-N 3.34Å | ||
| 17 | V | 45.1 | Very low | 46 | Very low | 122 Ų | 122 | 129.3 Ų | 129.3 | 74% | 0.739 | 72% | 0.716 | S | S | * | * | trans | -89.3 | 99 | 168 | -177.7 | 0 | 0 | 0 | 0 | 106.7 | A15 P19 | A15-V17 PolarHBondContact O-N 3.41Å; V17-P19 WeakPolarHBondContact O-CD 3.36Å | ||
| 18 | E | 47.4 | Very low | 46.2 | Very low | 135 Ų | 135 | 127.4 Ų | 127.4 | 63% | 0.631 | 71% | 0.706 | S | S | * | * | trans | -55.5 | 120.1 | 163 | -81.4 | -77.3 | 142.2 | 0 | 0 | 108.2 | H16 I20 | H16-E18 IonicContact CE1-OE1 2.94Å; H16-E18 PolarHBondContact CE1-OE1 3.02Å; H16-E18 IonicContact ND1-OE1 3.22Å; H16-E18 IonicContact NE2-OE1 2.65Å; H16-E18 PolarHBondContact O-N 3.34Å; E18-I20 PolarHBondContact O-N 3.49Å | ||
| 19 | P | 56.5 | Low | 46.8 | Very low | 106 Ų | 106 | 127.3 Ų | 127.3 | 69% | 0.688 | 69% | 0.694 | S | S | * | * | trans | -65.7 | 121.3 | 165.7 | 27.3 | -29.6 | 0 | 0 | 0 | 107.4 | V17 S21 | V17-P19 WeakPolarHBondContact O-CD 3.36Å; P19-S21 PolarHBondContact O-N 3.31Å | ||
| 20 | I | 48.8 | Very low | 46.6 | Very low | 144 Ų | 144 | 127.4 Ų | 127.4 | 74% | 0.738 | 68% | 0.679 | S | S | * | * | trans | -52.3 | 103.7 | 173.4 | -64.2 | 168 | 0 | 0 | 0 | 107.9 | E18 F22 | E18-I20 PolarHBondContact O-N 3.49Å; I20-F22 HydrophobicContact CG2-CD2 4.04Å; I20-F22 HydrophobicContact CG2-CE2 3.74Å; I20-F22 HydrophobicContact CG2-CZ 4.25Å; I20-F22 PolarHBondContact O-N 3.37Å; I20-F22 VanDerWaalsContact O-N 3.13Å | ||
| 21 | S | 46 | Very low | 47 | Very low | 90 Ų | 90 | 124.5 Ų | 124.5 | 63% | 0.629 | 67% | 0.673 | S | S | * | * | trans | -74.1 | 101.8 | 175.9 | -173 | 0 | 0 | 0 | 0 | 107.7 | P19 G23 | P19-S21 PolarHBondContact O-N 3.31Å; S21-G23 PolarHBondContact O-N 2.92Å | ||
| 22 | F | 48.8 | Very low | 47.1 | Very low | 167 Ų | 167 | 125.9 Ų | 125.9 | 73% | 0.732 | 68% | 0.675 | S | S | * | * | trans | -72.7 | 111.5 | 162.4 | -78.4 | -85 | 0 | 0 | 0 | 106.7 | I20 I24 | I20-F22 HydrophobicContact CG2-CD2 4.04Å; I20-F22 HydrophobicContact CG2-CE2 3.74Å; I20-F22 HydrophobicContact CG2-CZ 4.25Å; I20-F22 PolarHBondContact O-N 3.37Å; I20-F22 VanDerWaalsContact O-N 3.13Å; F22-I24 VanDerWaalsContact C-N 3.3Å; F22-I24 PolarHBondContact O-N 3.47Å | ||
| 23 | G | 49.1 | Very low | 47.1 | Very low | 54 Ų | 54 | 126.1 Ų | 126.1 | 56% | 0.557 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.4 | 77.7 | -166.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | S21 | S21-G23 PolarHBondContact O-N 2.92Š|
| 24 | I | 53.2 | Low | 47.1 | Very low | 118 Ų | 118 | 123.2 Ų | 123.2 | 61% | 0.605 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.6 | -34.5 | 168.8 | -58 | 174.7 | 0 | 0 | 0 | 109.4 | F22 Q26 I27 | F22-I24 VanDerWaalsContact C-N 3.3Å; F22-I24 PolarHBondContact O-N 3.47Å; I24-Q26 PolarHBondContact O-N 3.37Å; I24-I27 PolarHBondContact O-N 3Å |
| 25 | D | 51 | Low | 47.2 | Very low | 126 Ų | 126 | 118.9 Ų | 118.9 | 67% | 0.674 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.7 | -15.5 | -178.8 | -64.7 | -66.2 | 0 | 0 | 0 | 114.2 | ||
| 26 | Q | 51.2 | Low | 47.4 | Very low | 152 Ų | 152 | 122.8 Ų | 122.8 | 71% | 0.71 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.8 | -10.2 | 178.4 | -154.8 | 159.5 | 20.7 | 0 | 0 | 113.9 | I24 S29 | I24-Q26 PolarHBondContact O-N 3.37Å; Q26-S29 PolarHBondContact O-OG 3.45Å |
| 27 | I | 52.4 | Low | 47.7 | Very low | 111 Ų | 111 | 123.2 Ų | 123.2 | 57% | 0.569 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | -32.9 | -179.4 | -59.9 | 174.2 | 0 | 0 | 0 | 110.8 | I24 | I24-I27 PolarHBondContact O-N 3Š|
| 28 | L | 46.4 | Very low | 47.7 | Very low | 131 Ų | 131 | 121 Ų | 121 | 69% | 0.686 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.6 | -22.4 | -176.6 | -66.9 | 174.5 | 0 | 0 | 0 | 113.6 | ||
| 29 | S | 49.8 | Very low | 47.3 | Very low | 74 Ų | 74 | 120.3 Ų | 120.3 | 52% | 0.517 | 69% | 0.688 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81.7 | -20.7 | 178.5 | 45.5 | 0 | 0 | 0 | 0 | 113.9 | Q26 | Q26-S29 PolarHBondContact O-OG 3.45Š|
| 30 | N | 42.7 | Very low | 46.6 | Very low | 109 Ų | 109 | 127 Ų | 127 | 58% | 0.583 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.4 | -16.6 | -178.1 | -102.4 | 5.7 | 0 | 0 | 0 | 114.8 | ||
| 31 | V | 50.6 | Low | 46.4 | Very low | 103 Ų | 103 | 128.6 Ų | 128.6 | 62% | 0.624 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -72.1 | -29.3 | -180 | 157.6 | 0 | 0 | 0 | 0 | 112.6 | Q33 | V31-Q33 VanDerWaalsContact C-N 3.32Å; V31-Q33 PolarHBondContact O-N 2.95Å |
| 32 | E | 44.8 | Very low | 46.4 | Very low | 166 Ų | 166 | 130.1 Ų | 130.1 | 78% | 0.776 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -76.7 | -15 | -177.9 | -67.1 | -161.3 | 123.9 | 0 | 0 | 114.1 | ||
| 33 | Q | 41.3 | Very low | 45.9 | Very low | 158 Ų | 158 | 130.2 Ų | 130.2 | 74% | 0.738 | 72% | 0.717 | S | S | * | * | G | 310 helix | trans | -88.8 | -17 | 176.8 | -81.9 | 176.2 | 7.3 | 0 | 0 | 114.1 | V31 | V31-Q33 VanDerWaalsContact C-N 3.32Å; V31-Q33 PolarHBondContact O-N 2.95Å |
| 34 | S | 40.1 | Very low | 46 | Very low | 96 Ų | 96 | 133 Ų | 133 | 67% | 0.671 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -91.9 | -9.1 | -172.5 | -71.5 | 0 | 0 | 0 | 0 | 115.3 | M36 | S34-M36 VanDerWaalsContact C-N 3.27Å; S34-M36 PolarHBondContact O-N 3.06Å |
| 35 | C | 43.7 | Very low | 45.1 | Very low | 97 Ų | 97 | 134.1 Ų | 134.1 | 66% | 0.655 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -80.6 | 1.3 | -176.5 | 60.7 | 0 | 0 | 0 | 0 | 115.1 | ||
| 36 | M | 44.6 | Very low | 44.8 | Very low | 166 Ų | 166 | 139.2 Ų | 139.2 | 82% | 0.818 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -104.4 | 1.4 | -176.8 | -63.2 | -71.5 | -178.7 | 0 | 0 | 114.8 | S34 | S34-M36 VanDerWaalsContact C-N 3.27Å; S34-M36 PolarHBondContact O-N 3.06Å |
| 37 | L | 47.8 | Very low | 44 | Very low | 163 Ų | 163 | 134.5 Ų | 134.5 | 85% | 0.853 | 74% | 0.736 | S | S | * | * | trans | -100.3 | 96.9 | 175.2 | -127.3 | 77.5 | 0 | 0 | 0 | 111.2 | S39 | L37-S39 PolarHBondContact O-N 3.08Š| ||
| 38 | G | 46.1 | Very low | 43.3 | Very low | 76 Ų | 76 | 137.9 Ų | 137.9 | 78% | 0.784 | 75% | 0.749 | S | S | * | * | trans | -60.3 | 129.2 | 172 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 39 | S | 39.3 | Very low | 43.7 | Very low | 120 Ų | 120 | 137.5 Ų | 137.5 | 84% | 0.839 | 75% | 0.754 | S | S | * | * | trans | -101 | 98.4 | 162.6 | -67.4 | 0 | 0 | 0 | 0 | 108.3 | L37 M41 | L37-S39 PolarHBondContact O-N 3.08Å; S39-M41 PolarHBondContact O-N 3.45Å | ||
| 40 | R | 40.1 | Very low | 43.1 | Very low | 246 Ų | 246 | 138.1 Ų | 138.1 | 93% | 0.928 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 119.6 | 158.8 | -84 | 175.2 | 166.3 | 165.1 | -5.3 | 107.5 | ||
| 41 | M | 45.5 | Very low | 42.8 | Very low | 177 Ų | 177 | 143.6 Ų | 143.6 | 87% | 0.872 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 134.2 | 162 | -75.7 | -69.8 | -171.4 | 0 | 0 | 108.7 | S39 | S39-M41 PolarHBondContact O-N 3.45Š|
| 42 | P | 46.3 | Very low | 42.2 | Very low | 122 Ų | 122 | 146.5 Ų | 146.5 | 79% | 0.792 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -81.1 | 124.9 | 166.4 | 30.7 | -26.2 | 0 | 0 | 0 | 109.4 | ||
| 43 | E | 38.4 | Very low | 41.5 | Very low | 170 Ų | 170 | 141.8 Ų | 141.8 | 79% | 0.794 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 139.7 | 168.4 | -163.6 | -144.1 | 161.3 | 0 | 0 | 109.7 | D45 | E43-D45 PolarHBondContact O-N 3.39Š|
| 44 | P | 51 | Low | 41 | Very low | 111 Ų | 111 | 138 Ų | 138 | 72% | 0.721 | 79% | 0.789 | S | S | * | * | trans | -83 | 114.1 | 169.3 | 31 | -28.7 | 0 | 0 | 0 | 110.5 | Y46 | P44-Y46 PolarHBondContact O-N 3.1Š| ||
| 45 | D | 34.8 | Very low | 40.7 | Very low | 143 Ų | 143 | 138.6 Ų | 138.6 | 77% | 0.765 | 80% | 0.8 | S | S | * | * | trans | -55 | 122.7 | 170.1 | -164.9 | -86.6 | 0 | 0 | 0 | 111.3 | E43 | E43-D45 PolarHBondContact O-N 3.39Š| ||
| 46 | Y | 43.5 | Very low | 40.1 | Very low | 232 Ų | 232 | 138.2 Ų | 138.2 | 91% | 0.91 | 81% | 0.812 | S | S | * | * | trans | -128.1 | 106.9 | 156.5 | -118.1 | -88.5 | 0 | 0 | 0 | 107.8 | P44 | P44-Y46 PolarHBondContact O-N 3.1Š| ||
| 47 | G | 34.7 | Very low | 39.6 | Very low | 54 Ų | 54 | 134.3 Ų | 134.3 | 56% | 0.557 | 81% | 0.814 | S | S | * | * | trans | -69.2 | 142.6 | -173.2 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 48 | H | 38.8 | Very low | 39.2 | Very low | 182 Ų | 182 | 133.9 Ų | 133.9 | 84% | 0.843 | 82% | 0.818 | S | S | * | * | trans | 53.6 | 158.3 | 132.8 | -95.3 | -32.5 | 0 | 0 | 0 | 121.7 | ||||
| 49 | P | 53.1 | Low | 38.6 | Very low | 122 Ų | 122 | 134.3 Ų | 134.3 | 79% | 0.792 | 82% | 0.822 | S | S | * | * | cis | -133.5 | 178.3 | 21.5 | 32 | -7.9 | 0 | 0 | 0 | 117.6 | ||||
| 50 | A | 38.4 | Very low | 38.3 | Very low | 88 Ų | 88 | 131.6 Ų | 131.6 | 73% | 0.727 | 81% | 0.814 | S | S | * | * | trans | -58.1 | 147.9 | -175.3 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 51 | Y | 35.5 | Very low | 37.9 | Very low | 223 Ų | 223 | 130 Ų | 130 | 88% | 0.875 | 81% | 0.814 | S | S | * | * | trans | -135.7 | 132.1 | 136.7 | 69.6 | -89.2 | 0 | 0 | 0 | 109.6 | ||||
| 52 | N | 37.7 | Very low | 37.3 | Very low | 165 Ų | 165 | 126 Ų | 126 | 88% | 0.882 | 81% | 0.809 | S | S | * | * | trans | -91.8 | 143.3 | 176.2 | -177.4 | 24.6 | 0 | 0 | 0 | 108.4 | ||||
| 53 | G | 30.9 | Very low | 36.8 | Very low | 67 Ų | 67 | 126.4 Ų | 126.4 | 69% | 0.691 | 81% | 0.813 | S | S | * | * | trans | 158.1 | 107.4 | 163.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 54 | G | 30.2 | Very low | 36.6 | Very low | 77 Ų | 77 | 122 Ų | 122 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | 101.4 | 91.4 | 128 | 0 | 0 | 0 | 0 | 0 | 119.1 | |||||
| 55 | A | 33.6 | Very low | 35.6 | Very low | 110 Ų | 110 | 120.9 Ų | 120.9 | 91% | 0.909 | 82% | 0.822 | S | S | * | * | 27.1 | 132.7 | 127.5 | 0 | 0 | 0 | 0 | 0 | 121.8 | |||||
| 56 | G | 32.5 | Very low | 35.5 | Very low | 88 Ų | 88 | 118.1 Ų | 118.1 | 91% | 0.907 | 83% | 0.828 | S | S | * | * | trans | 115.3 | 128.5 | 133.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 57 | G | 33.9 | Very low | 34.9 | Very low | 84 Ų | 84 | 111 Ų | 111 | 87% | 0.866 | 83% | 0.825 | S | S | * | * | trans | 149.8 | 76.2 | 161 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 58 | V | 39.1 | Very low | 34.7 | Very low | 155 Ų | 155 | 112.6 Ų | 112.6 | 94% | 0.939 | 84% | 0.841 | S | S | * | * | trans | -82 | 148.2 | 161.3 | -76.3 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 59 | G | 34.1 | Very low | 34.2 | Very low | 84 Ų | 84 | 106.9 Ų | 106.9 | 87% | 0.866 | 83% | 0.831 | S | S | * | * | trans | 137.7 | 126.8 | 169.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 60 | G | 32.6 | Very low | 33.3 | Very low | 64 Ų | 64 | 112 Ų | 112 | 66% | 0.66 | 84% | 0.836 | S | S | * | * | cis | 137.1 | 129.1 | 22.7 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 61 | F | 31.3 | Very low | 33.1 | Very low | 212 Ų | 212 | 114.1 Ų | 114.1 | 93% | 0.93 | 84% | 0.836 | S | S | * | * | trans | 3 | 142.5 | 158.1 | -45.2 | -90.2 | 0 | 0 | 0 | 117.7 | ||||
| 62 | A | 32.1 | Very low | 33 | Very low | 94 Ų | 94 | 109.8 Ų | 109.8 | 78% | 0.777 | 84% | 0.838 | S | S | * | * | 176.1 | 175.9 | 54.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 63 | C | 37.2 | Very low | 32.9 | Very low | 130 Ų | 130 | 107.8 Ų | 107.8 | 88% | 0.878 | 83% | 0.831 | S | S | * | * | trans | -60 | 159.5 | 176.7 | 53.2 | 0 | 0 | 0 | 0 | 119 | ||||
| 64 | G | 32.7 | Very low | 33.1 | Very low | 77 Ų | 77 | 109.8 Ų | 109.8 | 79% | 0.794 | 84% | 0.841 | S | S | * | * | trans | 157.8 | 128.6 | 157.6 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 65 | G | 31.9 | Very low | 33.3 | Very low | 87 Ų | 87 | 110.1 Ų | 110.1 | 90% | 0.897 | 85% | 0.845 | S | S | * | * | cis | 107.2 | 102.3 | 21.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 66 | G | 31.6 | Very low | 33.4 | Very low | 86 Ų | 86 | 110.8 Ų | 110.8 | 89% | 0.887 | 84% | 0.843 | S | S | * | * | trans | 120.8 | 132.4 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 67 | G | 31.8 | Very low | 33.2 | Very low | 83 Ų | 83 | 112.7 Ų | 112.7 | 86% | 0.856 | 84% | 0.841 | S | S | * | * | cis | 119.7 | 106.8 | 13.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 68 | G | 29 | Very low | 33.1 | Very low | 87 Ų | 87 | 112.4 Ų | 112.4 | 90% | 0.897 | 84% | 0.838 | S | S | * | * | trans | 79.8 | 146.5 | 170.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 69 | G | 29 | Very low | 33.1 | Very low | 61 Ų | 61 | 113.5 Ų | 113.5 | 63% | 0.629 | 84% | 0.835 | S | S | * | * | cis | 151 | 149.7 | 9.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 70 | Y | 34.7 | Very low | 33.2 | Very low | 229 Ų | 229 | 114.2 Ų | 114.2 | 90% | 0.898 | 83% | 0.833 | S | S | * | * | trans | 73.3 | 113.5 | 166.1 | 83.1 | -95.8 | 0 | 0 | 0 | 122.6 | ||||
| 71 | N | 33.6 | Very low | 33.6 | Very low | 134 Ų | 134 | 116.1 Ų | 116.1 | 72% | 0.717 | 84% | 0.836 | S | S | * | * | 64.4 | 118.2 | 122.3 | -132.4 | 12.5 | 0 | 0 | 0 | 121.5 | |||||
| 72 | S | 33 | Very low | 33.8 | Very low | 131 Ų | 131 | 114.7 Ų | 114.7 | 92% | 0.916 | 84% | 0.837 | S | S | * | * | trans | -149.8 | 98.5 | 151.6 | -75.9 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 73 | T | 36.9 | Very low | 33.8 | Very low | 123 Ų | 123 | 114.3 Ų | 114.3 | 76% | 0.755 | 84% | 0.842 | S | S | * | * | trans | -88 | 124.7 | 157.2 | 29.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 74 | A | 34.5 | Very low | 33.5 | Very low | 109 Ų | 109 | 111.8 Ų | 111.8 | 90% | 0.901 | 84% | 0.838 | S | S | * | * | trans | 156.9 | 121.7 | 136.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 75 | G | 33.8 | Very low | 33.5 | Very low | 85 Ų | 85 | 112.4 Ų | 112.4 | 88% | 0.876 | 84% | 0.836 | S | S | * | * | trans | 175.1 | 75.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 76 | S | 35.3 | Very low | 33.8 | Very low | 123 Ų | 123 | 118 Ų | 118 | 86% | 0.86 | 83% | 0.831 | S | S | * | * | trans | -102.8 | 125.2 | 174 | -179.7 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 77 | C | 29.8 | Very low | 34.2 | Very low | 129 Ų | 129 | 122.2 Ų | 122.2 | 87% | 0.872 | 83% | 0.827 | S | S | * | * | trans | -174.2 | 142.3 | 151.2 | 55.9 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 78 | G | 31.1 | Very low | 34.5 | Very low | 77 Ų | 77 | 126.7 Ų | 126.7 | 79% | 0.794 | 83% | 0.828 | S | S | * | * | cis | -167.9 | 155.8 | -2.4 | 0 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 79 | M | 39 | Very low | 35.1 | Very low | 179 Ų | 179 | 128.4 Ų | 128.4 | 88% | 0.882 | 82% | 0.817 | S | S | * | * | trans | -68.6 | 142.4 | -177.6 | -165.9 | -162.2 | -178.7 | 0 | 0 | 112.4 | ||||
| 80 | A | 35.9 | Very low | 35.5 | Very low | 98 Ų | 98 | 134.1 Ų | 134.1 | 81% | 0.81 | 83% | 0.829 | S | S | * | * | trans | -163.3 | 108.1 | 146.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 81 | S | 41.1 | Very low | 35.7 | Very low | 105 Ų | 105 | 127.9 Ų | 127.9 | 73% | 0.734 | 82% | 0.819 | S | S | * | * | trans | -81.7 | 127 | 158.9 | -83.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 82 | L | 37 | Very low | 36.1 | Very low | 182 Ų | 182 | 128.4 Ų | 128.4 | 95% | 0.953 | 83% | 0.827 | S | S | * | * | trans | -144 | 128.5 | 150.9 | -80.5 | 172.3 | 0 | 0 | 0 | 107.6 | ||||
| 83 | G | 31.6 | Very low | 36.5 | Very low | 85 Ų | 85 | 129.1 Ų | 129.1 | 88% | 0.876 | 82% | 0.821 | S | S | * | * | trans | -98.4 | -173.4 | -163.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 84 | G | 29.4 | Very low | 36.7 | Very low | 78 Ų | 78 | 131.8 Ų | 131.8 | 80% | 0.804 | 83% | 0.827 | S | S | * | * | trans | 107.4 | 95.5 | 153 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 85 | A | 33.8 | Very low | 36.9 | Very low | 89 Ų | 89 | 133.6 Ų | 133.6 | 74% | 0.736 | 82% | 0.821 | S | S | * | * | trans | -153.6 | 112.6 | 142.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 86 | Y | 38.6 | Very low | 36.9 | Very low | 206 Ų | 206 | 132.2 Ų | 132.2 | 81% | 0.808 | 81% | 0.806 | S | S | * | * | trans | -46 | 131.5 | 169.4 | 28.9 | -89.9 | 0 | 0 | 0 | 114.2 | ||||
| 87 | H | 38.8 | Very low | 37.1 | Very low | 173 Ų | 173 | 132.2 Ų | 132.2 | 80% | 0.801 | 80% | 0.802 | S | S | * | * | trans | -119.3 | 106.8 | 158.5 | -175.5 | -98.1 | 0 | 0 | 0 | 107.9 | ||||
| 88 | M | 39.1 | Very low | 37.4 | Very low | 178 Ų | 178 | 132.5 Ų | 132.5 | 88% | 0.877 | 79% | 0.794 | S | S | * | * | trans | -85.2 | 108.4 | 174.2 | -69.5 | -89 | -162 | 0 | 0 | 108.5 | ||||
| 89 | N | 41.6 | Very low | 37.8 | Very low | 123 Ų | 123 | 136.2 Ų | 136.2 | 66% | 0.658 | 79% | 0.793 | S | S | * | * | trans | -98.8 | 108.1 | 162.2 | -175.8 | -13.6 | 0 | 0 | 0 | 107.6 | S91 | N89-S91 PolarHBondContact O-N 3.27Å; N89-S91 PolarHBondContact OD1-OG 3.39Å | ||
| 90 | M | 36.3 | Very low | 37.8 | Very low | 181 Ų | 181 | 134.4 Ų | 134.4 | 89% | 0.892 | 79% | 0.787 | S | S | * | * | trans | -78.9 | 105 | 167.9 | -91 | -162.3 | 171 | 0 | 0 | 109.3 | ||||
| 91 | S | 39.5 | Very low | 37.7 | Very low | 98 Ų | 98 | 134.1 Ų | 134.1 | 69% | 0.685 | 78% | 0.779 | S | S | * | * | trans | -118.7 | 104.4 | 156.4 | -59.4 | 0 | 0 | 0 | 0 | 107.3 | N89 N93 | N89-S91 PolarHBondContact O-N 3.27Å; N89-S91 PolarHBondContact OD1-OG 3.39Å; S91-N93 PolarHBondContact O-N 2.92Å | ||
| 92 | V | 43 | Very low | 37.6 | Very low | 145 Ų | 145 | 135 Ų | 135 | 88% | 0.879 | 79% | 0.786 | S | S | * | * | trans | -69.1 | 111.8 | 170.2 | -79.3 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 93 | N | 40.9 | Very low | 37.8 | Very low | 146 Ų | 146 | 129.9 Ų | 129.9 | 78% | 0.781 | 78% | 0.776 | S | S | * | * | trans | -105.3 | 121.8 | 168.2 | -177.5 | 29.6 | 0 | 0 | 0 | 107.9 | S91 | S91-N93 PolarHBondContact O-N 2.92Š| ||
| 94 | M | 39.6 | Very low | 38.8 | Very low | 179 Ų | 179 | 132.4 Ų | 132.4 | 88% | 0.882 | 78% | 0.775 | S | S | * | * | trans | -100.2 | 105.7 | 166.1 | -85.3 | -76.4 | 171.4 | 0 | 0 | 109 | ||||
| 95 | N | 39.1 | Very low | 39.5 | Very low | 147 Ų | 147 | 136.4 Ų | 136.4 | 79% | 0.786 | 78% | 0.776 | S | S | * | * | trans | -22.7 | 146.7 | 145.4 | -164.9 | 35.1 | 0 | 0 | 0 | 113.9 | ||||
| 96 | G | 34.7 | Very low | 40.1 | Very low | 55 Ų | 55 | 143.1 Ų | 143.1 | 57% | 0.567 | 78% | 0.782 | S | S | * | * | cis | -174.8 | 168.6 | 9.8 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 97 | T | 38.5 | Very low | 40.5 | Very low | 124 Ų | 124 | 139.6 Ų | 139.6 | 76% | 0.761 | 78% | 0.782 | S | S | * | * | -177.4 | 150.5 | 60.4 | 40.3 | 0 | 0 | 0 | 0 | 110 | |||||
| 98 | N | 37.1 | Very low | 40.7 | Very low | 134 Ų | 134 | 135.8 Ų | 135.8 | 72% | 0.717 | 77% | 0.772 | S | S | * | * | trans | 63.7 | 133.2 | 151 | -79.7 | -8.4 | 0 | 0 | 0 | 120.7 | ||||
| 99 | M | 39.3 | Very low | 40.6 | Very low | 155 Ų | 155 | 132.1 Ų | 132.1 | 76% | 0.764 | 77% | 0.77 | S | S | * | * | cis | -163.1 | 138.3 | 0.9 | -97.4 | -75.9 | 156.1 | 0 | 0 | 108.4 | ||||
| 100 | N | 38.6 | Very low | 40.5 | Very low | 141 Ų | 141 | 134.6 Ų | 134.6 | 75% | 0.754 | 78% | 0.777 | S | S | * | * | trans | 61.8 | 113.3 | 146.2 | -125.9 | -7 | 0 | 0 | 0 | 124 | ||||
| 101 | S | 34 | Very low | 41 | Very low | 93 Ų | 93 | 137 Ų | 137 | 65% | 0.65 | 78% | 0.777 | S | S | * | * | trans | 75 | 114.5 | 132.9 | -75.7 | 0 | 0 | 0 | 0 | 123 | ||||
| 102 | S | 39 | Very low | 41.4 | Very low | 124 Ų | 124 | 137.4 Ų | 137.4 | 87% | 0.867 | 78% | 0.777 | S | S | * | * | 66.5 | 123.6 | 129.4 | -58.3 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 103 | G | 42.3 | Very low | 41.7 | Very low | 74 Ų | 74 | 136.6 Ų | 136.6 | 76% | 0.763 | 78% | 0.775 | S | S | * | * | trans | 119.6 | 99 | 143.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | I105 | G103-I105 PolarHBondContact O-N 3.46Š| ||
| 104 | V | 51.1 | Low | 41.8 | Very low | 138 Ų | 138 | 137.2 Ų | 137.2 | 84% | 0.836 | 78% | 0.777 | S | S | * | * | trans | -58.1 | 128.8 | 159.5 | 179.8 | 0 | 0 | 0 | 0 | 109 | R106 | V104-R106 PolarHBondContact O-N 3.47Š| ||
| 105 | I | 44.1 | Very low | 41.6 | Very low | 161 Ų | 161 | 133.7 Ų | 133.7 | 83% | 0.826 | 77% | 0.77 | S | S | * | * | trans | -48.6 | 114 | 179.1 | -64.1 | 160.9 | 0 | 0 | 0 | 110.6 | G103 | G103-I105 PolarHBondContact O-N 3.46Š| ||
| 106 | R | 47.3 | Very low | 41.5 | Very low | 230 Ų | 230 | 130.9 Ų | 130.9 | 87% | 0.868 | 78% | 0.776 | S | S | * | * | trans | -104.2 | 122.7 | 164.1 | -60.9 | -169.4 | -175.4 | -171.8 | 2.7 | 108 | V104 | V104-R106 PolarHBondContact O-N 3.47Š| ||
| 107 | V | 47.7 | Very low | 41.6 | Very low | 133 Ų | 133 | 132 Ų | 132 | 81% | 0.806 | 79% | 0.787 | S | S | * | * | trans | -68.5 | 129.6 | 173.5 | 179 | 0 | 0 | 0 | 0 | 109.4 | A109 | V107-A109 PolarHBondContact O-N 2.91Š| ||
| 108 | P | 41.2 | Very low | 41.7 | Very low | 92 Ų | 92 | 131.4 Ų | 131.4 | 60% | 0.597 | 79% | 0.788 | S | S | * | * | trans | -71 | 114.2 | 174.6 | -19.6 | 33.1 | 0 | 0 | 0 | 111.8 | H110 | P108-H110 PolarHBondContact O-N 3.45Š| ||
| 109 | A | 38.7 | Very low | 41.8 | Very low | 101 Ų | 101 | 129.9 Ų | 129.9 | 84% | 0.835 | 79% | 0.794 | S | S | * | * | trans | -88.8 | 87.3 | 159.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | V107 R111 | V107-A109 PolarHBondContact O-N 2.91Å; A109-R111 PolarHBondContact O-N 3.5Å | ||
| 110 | H | 38.2 | Very low | 42.2 | Very low | 175 Ų | 175 | 128.3 Ų | 128.3 | 81% | 0.81 | 79% | 0.793 | S | S | * | * | trans | -65.7 | 110.5 | 165.2 | -64.8 | -78.4 | 0 | 0 | 0 | 108.7 | P108 | P108-H110 PolarHBondContact O-N 3.45Š| ||
| 111 | R | 46.6 | Very low | 43 | Very low | 232 Ų | 232 | 126.7 Ų | 126.7 | 88% | 0.875 | 79% | 0.79 | S | S | * | * | trans | -124 | 119.9 | 160.9 | -154.4 | 176.1 | -167.1 | 171.9 | 3.5 | 107.2 | A109 | A109-R111 PolarHBondContact O-N 3.5Š| ||
| 112 | P | 48.7 | Very low | 44.3 | Very low | 106 Ų | 106 | 127.8 Ų | 127.8 | 69% | 0.688 | 80% | 0.795 | S | S | * | * | trans | -73.1 | 146.3 | -175.2 | 29 | -32.4 | 0 | 0 | 0 | 110.8 | ||||
| 113 | P | 48.8 | Very low | 44.7 | Very low | 129 Ų | 129 | 127.3 Ų | 127.3 | 84% | 0.838 | 79% | 0.789 | S | S | * | * | trans | -84.9 | 118.4 | 168 | 32.3 | -26.5 | 0 | 0 | 0 | 109.2 | ||||
| 114 | L | 42.5 | Very low | 45.1 | Very low | 158 Ų | 158 | 129 Ų | 129 | 83% | 0.827 | 80% | 0.796 | S | S | * | * | trans | -92.3 | 115.3 | 164.2 | -94.9 | 138.4 | 0 | 0 | 0 | 109 | ||||
| 115 | S | 36.8 | Very low | 44.8 | Very low | 105 Ų | 105 | 127.3 Ų | 127.3 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | trans | 43 | 119 | 142.3 | 67.7 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 116 | G | 37.4 | Very low | 44.9 | Very low | 88 Ų | 88 | 123.8 Ų | 123.8 | 91% | 0.907 | 79% | 0.793 | S | S | * | * | 81.5 | 97.1 | 124 | 0 | 0 | 0 | 0 | 0 | 117.5 | |||||
| 117 | G | 36.6 | Very low | 44.7 | Very low | 78 Ų | 78 | 116 Ų | 116 | 80% | 0.804 | 79% | 0.785 | S | S | * | * | trans | -173.8 | 115.3 | 162.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 118 | S | 39.6 | Very low | 44.7 | Very low | 113 Ų | 113 | 117.2 Ų | 117.2 | 79% | 0.79 | 79% | 0.792 | S | S | * | * | trans | -45.3 | 133.3 | -173.6 | -69.1 | 0 | 0 | 0 | 0 | 115.1 | V120 | S118-V120 PolarHBondContact O-N 3.01Š| ||
| 119 | A | 38.9 | Very low | 45.3 | Very low | 101 Ų | 101 | 116.8 Ų | 116.8 | 84% | 0.835 | 80% | 0.804 | S | S | * | * | trans | -64.3 | 116.6 | 158.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 120 | V | 48.7 | Very low | 46 | Very low | 123 Ų | 123 | 117.7 Ų | 117.7 | 75% | 0.745 | 80% | 0.795 | S | S | * | * | trans | -124.2 | 110.9 | 160.5 | -170.6 | 0 | 0 | 0 | 0 | 106.6 | S118 | S118-V120 PolarHBondContact O-N 3.01Š| ||
| 121 | P | 55.3 | Low | 47 | Very low | 107 Ų | 107 | 116.6 Ų | 116.6 | 70% | 0.695 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 136.8 | 171.4 | 29 | -31 | 0 | 0 | 0 | 109.1 | ||
| 122 | P | 60.8 | Low | 47.6 | Very low | 116 Ų | 116 | 108.6 Ų | 108.6 | 75% | 0.753 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 143.1 | 171.1 | 27.7 | -31.9 | 0 | 0 | 0 | 109.6 | A124 | P122-A124 PolarHBondContact O-N 3.47Š|
| 123 | P | 48.5 | Very low | 48 | Very low | 113 Ų | 113 | 107.9 Ų | 107.9 | 73% | 0.734 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 133.1 | 179.9 | 27.8 | -32.3 | 0 | 0 | 0 | 109.8 | S125 | P123-S125 PolarHBondContact O-N 3.49Š|
| 124 | A | 49.8 | Very low | 49.1 | Very low | 109 Ų | 109 | 107.7 Ų | 107.7 | 90% | 0.901 | 77% | 0.769 | S | S | * | * | trans | -63.8 | 97.1 | 164.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | P122 | P122-A124 PolarHBondContact O-N 3.47Š| ||
| 125 | S | 45 | Very low | 50.4 | Low | 104 Ų | 104 | 103 Ų | 103 | 73% | 0.727 | 75% | 0.747 | S | S | * | * | trans | -94.1 | 110.2 | 165 | -57.7 | 0 | 0 | 0 | 0 | 108.1 | P123 | P123-S125 PolarHBondContact O-N 3.49Š| ||
| 126 | G | 46.3 | Very low | 52.2 | Low | 86 Ų | 86 | 103.9 Ų | 103.9 | 89% | 0.887 | 74% | 0.737 | S | S | * | * | trans | -55.9 | 135.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 127 | G | 42 | Very low | 53.7 | Low | 68 Ų | 68 | 104.8 Ų | 104.8 | 70% | 0.701 | 73% | 0.727 | S | S | * | * | trans | -162.6 | 90.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 107.4 | G129 | G127-G129 PolarHBondContact O-N 2.89Š| ||
| 128 | V | 48.8 | Very low | 55.6 | Low | 158 Ų | 158 | 109.8 Ų | 109.8 | 96% | 0.958 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -59.1 | 128.6 | 172.8 | -75.1 | 0 | 0 | 0 | 0 | 109.4 | ||
| 129 | G | 53.6 | Low | 57.2 | Low | 82 Ų | 82 | 108.7 Ų | 108.7 | 85% | 0.845 | 71% | 0.705 | S | S | * | * | trans | 107 | 68.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | G127 | G127-G129 PolarHBondContact O-N 2.89Š| ||
| 130 | N | 54.1 | Low | 58.4 | Low | 121 Ų | 121 | 105.7 Ų | 105.7 | 65% | 0.647 | 67% | 0.674 | S | S | * | * | trans | -133.3 | 100.4 | 165.5 | -151.1 | -13.9 | 0 | 0 | 0 | 111.5 | S132 | N130-S132 PolarHBondContact ND2-OG 3.32Å; N130-S132 VanDerWaalsContact ND2-OG 3.07Å; N130-S132 PolarHBondContact O-N 3.48Å; N130-S132 WeakPolarHBondContact OD1-CB 3.32Å; N130-S132 PolarHBondContact OD1-N 2.88Å; N130-S132 PolarHBondContact OD1-OG 2.98Å | ||
| 131 | L | 57.9 | Low | 58.8 | Low | 151 Ų | 151 | 104.5 Ų | 104.5 | 79% | 0.791 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -67 | 4.9 | 170.4 | -69.5 | 166.7 | 0 | 0 | 0 | 112.9 | A133 L134 | L131-A133 PolarHBondContact O-N 3.08Å; L131-L134 PolarHBondContact O-N 3.07Å |
| 132 | S | 58.6 | Low | 58.6 | Low | 64 Ų | 64 | 106.6 Ų | 106.6 | 45% | 0.448 | 68% | 0.677 | S | S | . | * | G | 310 helix | trans | -63.8 | -18.8 | 175 | 57.9 | 0 | 0 | 0 | 0 | 113.8 | N130 L134 T135 | N130-S132 PolarHBondContact ND2-OG 3.32Å; N130-S132 VanDerWaalsContact ND2-OG 3.07Å; N130-S132 PolarHBondContact O-N 3.48Å; N130-S132 WeakPolarHBondContact OD1-CB 3.32Å; N130-S132 PolarHBondContact OD1-N 2.88Å; N130-S132 PolarHBondContact OD1-OG 2.98Å; S132-L134 PolarHBondContact O-N 3.28Å; S132-T135 PolarHBondContact O-N 2.85Å |
| 133 | A | 58.8 | Low | 58.2 | Low | 92 Ų | 92 | 110.6 Ų | 110.6 | 76% | 0.76 | 68% | 0.677 | S | S | * | * | G | 310 helix | trans | -67.6 | -14.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | L131 | L131-A133 PolarHBondContact O-N 3.08Š|
| 134 | L | 70.8 | Confident | 58.4 | Low | 125 Ų | 125 | 113.8 Ų | 113.8 | 65% | 0.654 | 67% | 0.674 | S | S | * | * | G | 310 helix | trans | -103.5 | 5.9 | 176.8 | -60.4 | 178.6 | 0 | 0 | 0 | 113.3 | L131 S132 F136 M139 | L131-L134 PolarHBondContact O-N 3.07Å; S132-L134 PolarHBondContact O-N 3.28Å; L134-F136 PolarHBondContact O-N 3.04Å; L134-M139 WeakPolarHBondContact O-CE 3.39Å |
| 135 | T | 69.9 | Low | 58.3 | Low | 59 Ų | 59 | 118.6 Ų | 118.6 | 36% | 0.362 | 67% | 0.67 | S | S | . | * | trans | -90.2 | 97.9 | -177.6 | -54.7 | 0 | 0 | 0 | 0 | 110.1 | S132 M139 E140 | S132-T135 PolarHBondContact O-N 2.85Å; T135-M139 HydrophobicContact CG2-CB 3.82Å; T135-E140 HydrophobicContact CG2-CB 4.42Å; T135-E140 WeakPolarHBondContact CG2-OE2 3.47Å | ||
| 136 | F | 75.5 | Confident | 58.4 | Low | 123 Ų | 123 | 119.3 Ų | 119.3 | 54% | 0.539 | 67% | 0.671 | S | S | . | * | trans | -62.6 | 150.1 | 175.8 | -67.2 | -80.1 | 0 | 0 | 0 | 111.5 | L134 W138 M139 | L134-F136 PolarHBondContact O-N 3.04Å; F136-W138 VanDerWaalsContact CB-CD1 3.44Å; F136-W138 HydrophobicContact CB-CG 4.26Å; F136-W138 AromaticContact CG-NE1 3.74Å; F136-W138 PolarHBondContact O-N 3.2Å; F136-M139 HydrophobicContact CB-CE 4.25Å; F136-M139 HydrophobicContact CD2-CE 3.49Å; F136-M139 VanDerWaalsContact CD2-CE 3.49Å; F136-M139 HydrophobicContact CE2-CE 4.35Å; F136-M139 HydrophobicContact CG-CE 4.35Å; F136-M139 WeakPolarHBondContact O-CA 3.49Å; F136-M139 WeakPolarHBondContact O-CB 3.46Å; F136-M139 PolarHBondContact O-N 2.92Å | ||
| 137 | P | 68.5 | Low | 58.5 | Low | 107 Ų | 107 | 124.1 Ų | 124.1 | 70% | 0.695 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.1 | -24.7 | -176.7 | -29.3 | 35.7 | 0 | 0 | 0 | 115.4 | ||
| 138 | W | 75.5 | Confident | 58.6 | Low | 184 Ų | 184 | 128 Ų | 128 | 70% | 0.697 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | -26.9 | 175.2 | 64.6 | -97.5 | 0 | 0 | 0 | 113.5 | F136 E140 S141 | F136-W138 VanDerWaalsContact CB-CD1 3.44Å; F136-W138 HydrophobicContact CB-CG 4.26Å; F136-W138 AromaticContact CG-NE1 3.74Å; F136-W138 PolarHBondContact O-N 3.2Å; W138-E140 VanDerWaalsContact C-N 3.34Å; W138-S141 PolarHBondContact O-OG 3.37Å; W138-S141 VanDerWaalsContact O-OG 3.14Å |
| 139 | M | 74.2 | Confident | 59.1 | Low | 89 Ų | 89 | 131.8 Ų | 131.8 | 44% | 0.438 | 67% | 0.669 | S | S | . | * | G | 310 helix | trans | -75.8 | -18.6 | 176.4 | -82.7 | -161.7 | -93.7 | 0 | 0 | 113.5 | L134 T135 F136 S141 | L134-M139 WeakPolarHBondContact O-CE 3.39Å; T135-M139 HydrophobicContact CG2-CB 3.82Å; F136-M139 HydrophobicContact CB-CE 4.25Å; F136-M139 HydrophobicContact CD2-CE 3.49Å; F136-M139 VanDerWaalsContact CD2-CE 3.49Å; F136-M139 HydrophobicContact CE2-CE 4.35Å; F136-M139 HydrophobicContact CG-CE 4.35Å; F136-M139 WeakPolarHBondContact O-CA 3.49Å; F136-M139 WeakPolarHBondContact O-CB 3.46Å; F136-M139 PolarHBondContact O-N 2.92Å; M139-S141 PolarHBondContact O-N 2.98Å |
| 140 | E | 64.9 | Low | 58.6 | Low | 38 Ų | 38 | 137 Ų | 137 | 18% | 0.178 | 67% | 0.668 | C | S | . | * | G | 310 helix | trans | -84.2 | 7.8 | -172.1 | -164.1 | 54.7 | -162.6 | 0 | 0 | 114.2 | T135 W138 N142 R143 R144 | T135-E140 HydrophobicContact CG2-CB 4.42Å; T135-E140 WeakPolarHBondContact CG2-OE2 3.47Å; W138-E140 VanDerWaalsContact C-N 3.34Å; E140-N142 PolarHBondContact O-N 3.42Å; E140-R143 PolarHBondContact O-N 3.36Å; E140-R143 WeakPolarHBondContact OE1-CB 3.49Å; E140-R143 WeakPolarHBondContact OE1-CD 3.29Å; E140-R144 HydrophobicContact CG-CG 4.05Å; E140-R144 VanDerWaalsContact CG-NH2 3.28Å |
| 141 | S | 55.5 | Low | 58.1 | Low | 99 Ų | 99 | 136.2 Ų | 136.2 | 69% | 0.692 | 67% | 0.669 | S | S | * | * | G | 310 helix | trans | -63.3 | -13.1 | -174.6 | -58.6 | 0 | 0 | 0 | 0 | 114.7 | W138 M139 | W138-S141 PolarHBondContact O-OG 3.37Å; W138-S141 VanDerWaalsContact O-OG 3.14Å; M139-S141 PolarHBondContact O-N 2.98Å |
| 142 | N | 52.7 | Low | 57.5 | Low | 150 Ų | 150 | 131.9 Ų | 131.9 | 80% | 0.802 | 66% | 0.66 | S | S | * | * | G | 310 helix | trans | -98.8 | -11.8 | 179.7 | -96.4 | 10.8 | 0 | 0 | 0 | 115.1 | E140 | E140-N142 PolarHBondContact O-N 3.42Š|
| 143 | R | 52.3 | Low | 57 | Low | 201 Ų | 201 | 136.7 Ų | 136.7 | 76% | 0.758 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.9 | -8.7 | -171.6 | -84.1 | -175.2 | -151.9 | -98.6 | 1.3 | 115.5 | E140 Y145 | E140-R143 PolarHBondContact O-N 3.36Å; E140-R143 WeakPolarHBondContact OE1-CB 3.49Å; E140-R143 WeakPolarHBondContact OE1-CD 3.29Å; R143-Y145 VanDerWaalsContact C-N 3.35Å; R143-Y145 PolarHBondContact O-N 2.83Å; R143-Y145 VanDerWaalsContact O-N 3.08Å |
| 144 | R | 51 | Low | 56.7 | Low | 179 Ų | 179 | 137.2 Ų | 137.2 | 68% | 0.675 | 67% | 0.671 | S | S | * | * | trans | -89.5 | 56.5 | -172.8 | -52.8 | -155 | -169.7 | -91.4 | 8.6 | 114.3 | E140 | E140-R144 HydrophobicContact CG-CG 4.05Å; E140-R144 VanDerWaalsContact CG-NH2 3.28Å | ||
| 145 | Y | 48.1 | Very low | 55.8 | Low | 210 Ų | 210 | 140.4 Ų | 140.4 | 82% | 0.824 | 68% | 0.676 | S | S | * | * | trans | -87.7 | -4.8 | 170.1 | -89.9 | -75.7 | 0 | 0 | 0 | 114.3 | R143 | R143-Y145 VanDerWaalsContact C-N 3.35Å; R143-Y145 PolarHBondContact O-N 2.83Å; R143-Y145 VanDerWaalsContact O-N 3.08Å | ||
| 146 | T | 47.5 | Very low | 55.2 | Low | 120 Ų | 120 | 146.1 Ų | 146.1 | 74% | 0.736 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -132.5 | 115.4 | -176.8 | 56.8 | 0 | 0 | 0 | 0 | 111.9 | ||
| 147 | K | 48.5 | Very low | 54.1 | Low | 187 Ų | 187 | 145.5 Ų | 145.5 | 81% | 0.813 | 70% | 0.701 | S | S | * | * | S | Bend | trans | 80.6 | 132.7 | 150 | -144.6 | 99.9 | 175.7 | -174.5 | 0 | 117.6 | ||
| 148 | D | 43.8 | Very low | 53.8 | Low | 148 Ų | 148 | 149 Ų | 149 | 79% | 0.791 | 70% | 0.7 | S | S | * | * | trans | 84.4 | 102.2 | 164.4 | -53 | -51.6 | 0 | 0 | 0 | 119.3 | ||||
| 149 | R | 58.5 | Low | 53.4 | Low | 238 Ų | 238 | 145.6 Ų | 145.6 | 90% | 0.898 | 70% | 0.7 | S | S | * | * | trans | -97.8 | 122.7 | 170.4 | -70.9 | 176.1 | -178.5 | 160.2 | 1.6 | 108.8 | ||||
| 150 | F | 43.5 | Very low | 52.8 | Low | 191 Ų | 191 | 145.9 Ų | 145.9 | 84% | 0.838 | 71% | 0.708 | S | S | * | * | trans | -147.7 | 113.9 | 156 | -164.1 | -110 | 0 | 0 | 0 | 111.3 | ||||
| 151 | T | 45.1 | Very low | 52.9 | Low | 106 Ų | 106 | 149.4 Ų | 149.4 | 65% | 0.65 | 73% | 0.734 | S | S | * | * | trans | 49.1 | 128.4 | 152.5 | 56.7 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 152 | G | 44.1 | Very low | 53.2 | Low | 60 Ų | 60 | 154.3 Ų | 154.3 | 62% | 0.619 | 74% | 0.743 | S | S | * | * | trans | 116.7 | 54.3 | 137.5 | 0 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 153 | H | 47.8 | Very low | 53.6 | Low | 165 Ų | 165 | 156 Ų | 156 | 76% | 0.764 | 74% | 0.743 | S | S | * | * | trans | 60.5 | 166.8 | 163 | -87.2 | -80.5 | 0 | 0 | 0 | 119.3 | N157 | H153-N157 PolarHBondContact N-ND2 3.22Š| ||
| 154 | P | 53.8 | Low | 54.2 | Low | 102 Ų | 102 | 155.8 Ų | 155.8 | 66% | 0.662 | 75% | 0.748 | S | S | * | * | S | Bend | cis | -101 | 163.1 | -45.6 | 34.9 | -19.7 | 0 | 0 | 0 | 110.7 | Q156 | P154-Q156 PolarHBondContact O-N 3.33Š|
| 155 | Y | 51.2 | Low | 55.1 | Low | 193 Ų | 193 | 155.7 Ų | 155.7 | 76% | 0.757 | 75% | 0.753 | S | S | * | * | S | Bend | trans | 68.9 | -38.8 | -176.6 | -137.5 | -90.9 | 0 | 0 | 0 | 117.4 | N157 R158 | Y155-N157 PolarHBondContact O-N 3.49Å; Y155-R158 PolarHBondContact O-N 3.29Å |
| 156 | Q | 57.2 | Low | 56.5 | Low | 179 Ų | 179 | 151.1 Ų | 151.1 | 84% | 0.836 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | -22.4 | 179.8 | -65.7 | -159.7 | -29.1 | 0 | 0 | 114.4 | P154 R158 | P154-Q156 PolarHBondContact O-N 3.33Å; Q156-R158 VanDerWaalsContact C-N 3.3Å; Q156-R158 PolarHBondContact O-N 2.92Å |
| 157 | N | 52.3 | Low | 58 | Low | 110 Ų | 110 | 157.6 Ų | 157.6 | 59% | 0.588 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | 0.4 | 176.6 | -65.1 | -12.1 | 0 | 0 | 0 | 113.7 | H153 Y155 T159 | H153-N157 PolarHBondContact N-ND2 3.22Å; Y155-N157 PolarHBondContact O-N 3.49Å; N157-T159 PolarHBondContact O-N 3.24Å |
| 158 | R | 61.8 | Low | 59.7 | Low | 179 Ų | 179 | 153.2 Ų | 153.2 | 68% | 0.675 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -77.5 | 120.7 | 171.8 | -66.9 | -174.7 | 177.5 | -146.7 | -1 | 106.8 | Y155 Q156 P160 | Y155-R158 PolarHBondContact O-N 3.29Å; Q156-R158 VanDerWaalsContact C-N 3.3Å; Q156-R158 PolarHBondContact O-N 2.92Å; R158-P160 VanDerWaalsContact O-CD 3.3Å; R158-P160 WeakPolarHBondContact O-CD 3.26Å |
| 159 | T | 68 | Low | 62 | Low | 114 Ų | 114 | 151.8 Ų | 151.8 | 70% | 0.699 | 75% | 0.75 | S | S | * | * | trans | -44.9 | 117.2 | 169.1 | 29.7 | 0 | 0 | 0 | 0 | 108.1 | N157 | N157-T159 PolarHBondContact O-N 3.24Š| ||
| 160 | P | 62.2 | Low | 63.8 | Low | 95 Ų | 95 | 143.2 Ų | 143.2 | 62% | 0.617 | 72% | 0.719 | S | S | * | * | trans | -52.7 | 128.5 | -178 | -28.2 | 34.4 | 0 | 0 | 0 | 108.4 | R158 K162 | R158-P160 VanDerWaalsContact O-CD 3.3Å; R158-P160 WeakPolarHBondContact O-CD 3.26Å; P160-K162 PolarHBondContact O-N 3.1Å | ||
| 161 | P | 66.6 | Low | 66.3 | Low | 112 Ų | 112 | 137.1 Ų | 137.1 | 73% | 0.727 | 70% | 0.701 | S | S | * | * | trans | -54 | 108.3 | -179.3 | -27 | 34.1 | 0 | 0 | 0 | 109.6 | K163 | P161-K163 PolarHBondContact O-N 3.44Š| ||
| 162 | K | 60.2 | Low | 68.8 | Low | 201 Ų | 201 | 140.9 Ų | 140.9 | 87% | 0.874 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -62.8 | 104.7 | 175.9 | -73.7 | -171.4 | 175.6 | -177.8 | 0 | 106.5 | P160 | P160-K162 PolarHBondContact O-N 3.1Š|
| 163 | K | 61.3 | Low | 71.3 | Confident | 186 Ų | 186 | 144.5 Ų | 144.5 | 81% | 0.809 | 71% | 0.708 | S | S | * | * | S | Bend | trans | 76.2 | 108.2 | -175.7 | -48.9 | -175.5 | 177.7 | -175.6 | 0 | 113.8 | P161 K165 | P161-K163 PolarHBondContact O-N 3.44Å; K163-K165 PolarHBondContact O-N 3.31Å; K163-K165 VanDerWaalsContact O-N 3.13Å |
| 164 | K | 64.8 | Low | 73.7 | Confident | 196 Ų | 196 | 138.5 Ų | 138.5 | 85% | 0.852 | 68% | 0.68 | S | S | * | * | trans | -63.1 | 110.6 | 165.3 | -71.3 | 178 | -179.6 | 172.2 | 0 | 107.2 | ||||
| 165 | K | 70.3 | Confident | 75.8 | Confident | 178 Ų | 178 | 135.8 Ų | 135.8 | 77% | 0.774 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 139.6 | 167.4 | -78.2 | 90 | 174.4 | -178.1 | 0 | 107.8 | K163 R167 | K163-K165 PolarHBondContact O-N 3.31Å; K163-K165 VanDerWaalsContact O-N 3.13Å; K165-R167 PolarHBondContact O-N 3.02Å |
| 166 | P | 77.4 | Confident | 78.1 | Confident | 114 Ų | 114 | 129.1 Ų | 129.1 | 74% | 0.74 | 64% | 0.64 | S | S | * | * | P | Polyproline II helix | trans | -48.5 | 136.4 | 171.8 | -25.5 | 33 | 0 | 0 | 0 | 110.2 | T168 | P166-T168 PolarHBondContact O-N 3.41Š|
| 167 | R | 79.9 | Confident | 80 | Confident | 255 Ų | 255 | 124 Ų | 124 | 96% | 0.962 | 62% | 0.616 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 119.9 | 173.6 | -78.3 | -174.7 | 171.2 | 119.4 | -3.3 | 107.8 | K165 | K165-R167 PolarHBondContact O-N 3.02Š|
| 168 | T | 84.3 | Confident | 82.2 | Confident | 95 Ų | 95 | 118.8 Ų | 118.8 | 58% | 0.583 | 59% | 0.588 | S | S | * | * | P | Polyproline II helix | trans | -88 | 131.4 | 172.4 | 48.4 | 0 | 0 | 0 | 0 | 108.8 | P166 | P166-T168 PolarHBondContact O-N 3.41Š|
| 169 | S | 91.9 | Very high | 84 | Confident | 118 Ų | 118 | 114.2 Ų | 114.2 | 83% | 0.825 | 58% | 0.575 | S | S | * | * | P | Polyproline II helix | trans | -88.5 | 142.9 | 168.9 | 52.9 | 0 | 0 | 0 | 0 | 109.5 | ||
| 170 | F | 95.3 | Very high | 85.4 | Confident | 58 Ų | 58 | 113.9 Ų | 113.9 | 25% | 0.254 | 56% | 0.563 | S | S | . | * | P | Polyproline II helix | trans | -85.9 | 143.2 | 172.8 | -56.8 | -51 | 0 | 0 | 0 | 109.7 | Q174 I175 M202 Q206 W210 | F170-Q174 HydrophobicContact CB-CB 4.34Å; F170-I175 HydrophobicContact CB-CD1 4.32Å; F170-I175 HydrophobicContact CB-CG1 3.89Å; F170-M202 HydrophobicContact CD1-CE 3.46Å; F170-M202 VanDerWaalsContact CD1-CE 3.46Å; F170-M202 HydrophobicContact CD1-SD 4.31Å; F170-M202 HydrophobicContact CE1-CE 3.22Å; F170-M202 HydrophobicContact CE2-CE 4.38Å; F170-M202 HydrophobicContact CG-CE 4.17Å; F170-M202 HydrophobicContact CZ-CE 3.72Å; F170-Q206 HydrophobicContact CE1-CB 4.38Å; F170-Q206 HydrophobicContact CE1-CG 4.39Å; F170-Q206 HydrophobicContact CZ-CB 4.37Å; F170-W210 AromaticContact CD2-CD1 3.75Å; F170-W210 AromaticContact CE2-CD1 3.61Å; F170-W210 HydrophobicContact CE2-CG 4.5Å |
| 171 | S | 97.4 | Very high | 87.1 | Confident | 64 Ų | 64 | 112.7 Ų | 112.7 | 45% | 0.448 | 55% | 0.547 | S | S | . | . | P | Polyproline II helix | trans | -63.4 | 154.8 | 172.5 | 171.2 | 0 | 0 | 0 | 0 | 111 | L173 Q174 I175 | S171-L173 VanDerWaalsContact C-N 3.28Å; S171-L173 PolarHBondContact O-N 2.86Å; S171-Q174 WeakPolarHBondContact O-CB 3.44Å; S171-Q174 PolarHBondContact O-N 3.41Å; S171-Q174 VanDerWaalsContact O-N 3.1Å; S171-I175 WeakPolarHBondContact O-CG1 3.39Å; S171-I175 PolarHBondContact O-N 3.29Å |
| 172 | R | 97 | Very high | 88.6 | Confident | 184 Ų | 184 | 107.7 Ų | 107.7 | 69% | 0.694 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -54.8 | -44 | 176.9 | -174.7 | 61.8 | 175.7 | -171.9 | 1.1 | 112 | Q174 I175 C176 | R172-Q174 VanDerWaalsContact C-N 3.33Å; R172-Q174 PolarHBondContact O-N 3.03Å; R172-I175 PolarHBondContact O-N 3.33Å; R172-C176 PolarHBondContact O-N 2.85Å; R172-C176 PolarHBondContact O-SG 3.33Å; R172-C176 VanDerWaalsContact O-SG 3.33Å |
| 173 | L | 97.3 | Very high | 90.4 | Very high | 137 Ų | 137 | 105.3 Ų | 105.3 | 72% | 0.717 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.9 | -40.6 | 178.1 | -67.8 | 175.6 | 0 | 0 | 0 | 112.1 | S171 C176 E177 | S171-L173 VanDerWaalsContact C-N 3.28Å; S171-L173 PolarHBondContact O-N 2.86Å; L173-C176 PolarHBondContact O-N 2.8Å; L173-E177 PolarHBondContact O-N 3Å; L173-E177 VanDerWaalsContact O-N 3.08Å |
| 174 | Q | 97.8 | Very high | 92.2 | Very high | 39 Ų | 39 | 103.7 Ų | 103.7 | 18% | 0.182 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -63.2 | -44.4 | 176.6 | -67.5 | 175 | -42.3 | 0 | 0 | 110.9 | F170 S171 R172 L178 L200 M202 | F170-Q174 HydrophobicContact CB-CB 4.34Å; S171-Q174 WeakPolarHBondContact O-CB 3.44Å; S171-Q174 PolarHBondContact O-N 3.41Å; S171-Q174 VanDerWaalsContact O-N 3.1Å; R172-Q174 VanDerWaalsContact C-N 3.33Å; R172-Q174 PolarHBondContact O-N 3.03Å; Q174-L178 WeakPolarHBondContact O-CB 3.44Å; Q174-L178 WeakPolarHBondContact O-CD1 3.44Å; Q174-L178 WeakPolarHBondContact O-CG 3.43Å; Q174-L178 PolarHBondContact O-N 3.26Å; Q174-L200 PolarHBondContact NE2-O 3.32Å; Q174-M202 HydrophobicContact CB-SD 4.17Å; Q174-M202 HydrophobicContact CG-SD 4.26Å |
| 175 | I | 97.9 | Very high | 93.7 | Very high | 45 Ų | 45 | 97.2 Ų | 97.2 | 23% | 0.231 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -61.9 | -46.9 | 177.5 | -63.4 | 167 | 0 | 0 | 0 | 110.4 | F170 S171 R172 E177 L178 E179 | F170-I175 HydrophobicContact CB-CD1 4.32Å; F170-I175 HydrophobicContact CB-CG1 3.89Å; S171-I175 WeakPolarHBondContact O-CG1 3.39Å; S171-I175 PolarHBondContact O-N 3.29Å; R172-I175 PolarHBondContact O-N 3.33Å; I175-E177 PolarHBondContact O-N 3.2Å; I175-L178 PolarHBondContact O-N 3.42Å; I175-E179 HydrophobicContact CG2-CG 4.25Å; I175-E179 WeakPolarHBondContact O-CB 3.35Å; I175-E179 WeakPolarHBondContact O-CG 3.35Å; I175-E179 PolarHBondContact O-N 3.2Å |
| 176 | C | 98.2 | Very high | 95.1 | Very high | 52 Ų | 52 | 91.6 Ų | 91.6 | 35% | 0.351 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -58.9 | -46.9 | -179.9 | -72.4 | 0 | 0 | 0 | 0 | 112.4 | R172 L173 E179 K180 | R172-C176 PolarHBondContact O-N 2.85Å; R172-C176 PolarHBondContact O-SG 3.33Å; R172-C176 VanDerWaalsContact O-SG 3.33Å; L173-C176 PolarHBondContact O-N 2.8Å; C176-E179 PolarHBondContact O-N 2.87Å; C176-K180 WeakPolarHBondContact O-CB 3.14Å; C176-K180 PolarHBondContact O-N 3.12Å |
| 177 | E | 98.3 | Very high | 96 | Very high | 73 Ų | 73 | 92.5 Ų | 92.5 | 34% | 0.341 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -69 | -36 | 178.8 | -78.4 | -61.1 | 136 | 0 | 0 | 112.8 | L173 I175 K180 R181 L200 | L173-E177 PolarHBondContact O-N 3Å; L173-E177 VanDerWaalsContact O-N 3.08Å; I175-E177 PolarHBondContact O-N 3.2Å; E177-K180 PolarHBondContact O-N 2.83Å; E177-K180 IonicContact OE1-NZ 3.41Å; E177-K180 PolarHBondContact OE1-NZ 3.07Å; E177-R181 WeakPolarHBondContact O-CB 3.36Å; E177-R181 PolarHBondContact O-N 3.47Å; E177-L200 HydrophobicContact CB-CD1 4.21Å; E177-L200 HydrophobicContact CB-CD2 3.65Å; E177-L200 HydrophobicContact CG-CD2 4.1Å |
| 178 | L | 98.5 | Very high | 96.9 | Very high | 0 Ų | 0 | 81.3 Ų | 81.3 | 0% | 0 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -62.2 | -43.7 | 172.3 | -72.2 | 166 | 0 | 0 | 0 | 111.4 | Q174 I175 R181 F182 L196 L200 M202 V207 W210 F211 | Q174-L178 WeakPolarHBondContact O-CB 3.44Å; Q174-L178 WeakPolarHBondContact O-CD1 3.44Å; Q174-L178 WeakPolarHBondContact O-CG 3.43Å; Q174-L178 PolarHBondContact O-N 3.26Å; I175-L178 PolarHBondContact O-N 3.42Å; L178-R181 PolarHBondContact O-N 3.45Å; L178-F182 VanDerWaalsContact O-CB 3.26Å; L178-F182 WeakPolarHBondContact O-CB 3.26Å; L178-F182 PolarHBondContact O-N 3.27Å; L178-L196 HydrophobicContact CD2-CD2 3.94Å; L178-L200 HydrophobicContact CD2-CD1 3.87Å; L178-L200 HydrophobicContact CG-CD1 3.73Å; L178-M202 HydrophobicContact CD1-CE 4.18Å; L178-M202 HydrophobicContact CD1-SD 4.12Å; L178-V207 HydrophobicContact CD2-CG1 4.23Å; L178-W210 HydrophobicContact CB-CD2 3.97Å; L178-W210 HydrophobicContact CB-CE3 3.9Å; L178-W210 HydrophobicContact CB-CH2 3.59Å; L178-W210 HydrophobicContact CB-CZ2 3.63Å; L178-W210 HydrophobicContact CB-CZ3 3.73Å; L178-W210 HydrophobicContact CD1-CD2 3.82Å; L178-W210 HydrophobicContact CD1-CE3 4.44Å; L178-W210 HydrophobicContact CD1-CG 3.84Å; L178-W210 HydrophobicContact CD1-CZ2 4.45Å; L178-W210 HydrophobicContact CD2-CD2 4.36Å; L178-W210 HydrophobicContact CD2-CE3 4.22Å; L178-W210 HydrophobicContact CG-CD2 4.27Å; L178-W210 HydrophobicContact CG-CE3 4.42Å; L178-F211 HydrophobicContact CD2-CD2 4.5Å; L178-F211 HydrophobicContact CD2-CE2 3.93Å |
| 179 | E | 98.4 | Very high | 97.5 | Very high | 82 Ų | 82 | 79.4 Ų | 79.4 | 38% | 0.383 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.8 | -43.9 | 176.5 | -74.3 | -176.8 | 162.9 | 0 | 0 | 112 | I175 C176 R181 F182 H183 W210 | I175-E179 HydrophobicContact CG2-CG 4.25Å; I175-E179 WeakPolarHBondContact O-CB 3.35Å; I175-E179 WeakPolarHBondContact O-CG 3.35Å; I175-E179 PolarHBondContact O-N 3.2Å; C176-E179 PolarHBondContact O-N 2.87Å; E179-R181 PolarHBondContact O-N 2.93Å; E179-F182 CarbonylContact O-C 3.58Å; E179-F182 PolarHBondContact O-N 2.87Å; E179-H183 PolarHBondContact O-N 3.45Å; E179-W210 HydrophobicContact CG-CH2 3.84Å; E179-W210 HydrophobicContact CG-CZ2 3.89Å |
| 180 | K | 98.3 | Very high | 97.8 | Very high | 107 Ų | 107 | 77.7 Ų | 77.7 | 47% | 0.465 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -59.6 | -43.9 | 175 | -179.4 | -178.8 | 175.7 | -176.3 | 0 | 111.9 | C176 E177 R184 | C176-K180 WeakPolarHBondContact O-CB 3.14Å; C176-K180 PolarHBondContact O-N 3.12Å; E177-K180 PolarHBondContact O-N 2.83Å; E177-K180 IonicContact OE1-NZ 3.41Å; E177-K180 PolarHBondContact OE1-NZ 3.07Å; K180-R184 PolarHBondContact O-N 3.19Å |
| 181 | R | 98.1 | Very high | 97.9 | Very high | 71 Ų | 71 | 78.7 Ų | 78.7 | 27% | 0.268 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -67.5 | -41.5 | 175 | -166.3 | 71.1 | 178 | 179.6 | 2.2 | 111.2 | E177 L178 E179 H183 R184 Q185 L188 E192 L196 F211 | E177-R181 WeakPolarHBondContact O-CB 3.36Å; E177-R181 PolarHBondContact O-N 3.47Å; L178-R181 PolarHBondContact O-N 3.45Å; E179-R181 PolarHBondContact O-N 2.93Å; R181-H183 VanDerWaalsContact C-N 3.31Å; R181-H183 PolarHBondContact O-N 3.07Å; R181-R184 PolarHBondContact O-N 3.45Å; R181-Q185 PolarHBondContact O-N 3.37Å; R181-L188 HydrophobicContact CG-CD1 4.46Å; R181-L188 HydrophobicContact CG-CD2 4.01Å; R181-E192 IonicContact NH2-OE1 2.92Å; R181-E192 PolarHBondContact NH2-OE1 3.49Å; R181-L196 HydrophobicContact CB-CD2 4.24Å; R181-L196 HydrophobicContact CG-CD2 4.09Å; R181-F211 HydrophobicContact CB-CZ 4.36Å; R181-F211 HydrophobicContact CG-CZ 4.34Å |
| 182 | F | 98.5 | Very high | 98 | Very high | 7 Ų | 7 | 78.4 Ų | 78.4 | 3% | 0.031 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -63.7 | -34.4 | 177.2 | -175.8 | -99.1 | 0 | 0 | 0 | 113.1 | L178 E179 R184 Q185 K186 W210 F211 R214 R215 W218 | L178-F182 VanDerWaalsContact O-CB 3.26Å; L178-F182 WeakPolarHBondContact O-CB 3.26Å; L178-F182 PolarHBondContact O-N 3.27Å; E179-F182 CarbonylContact O-C 3.58Å; E179-F182 PolarHBondContact O-N 2.87Å; F182-R184 VanDerWaalsContact C-N 3.32Å; F182-R184 PolarHBondContact O-N 3.23Å; F182-Q185 WeakPolarHBondContact CA-O 3.49Å; F182-Q185 CarbonylContact O-C 3.54Å; F182-Q185 PolarHBondContact O-N 2.78Å; F182-K186 HydrophobicContact CD1-CD 4.13Å; F182-K186 HydrophobicContact CD2-CD 4.35Å; F182-K186 HydrophobicContact CE1-CD 3.64Å; F182-K186 HydrophobicContact CE2-CB 4.11Å; F182-K186 HydrophobicContact CE2-CD 3.88Å; F182-K186 HydrophobicContact CG-CD 4.47Å; F182-K186 HydrophobicContact CZ-CB 4.4Å; F182-K186 HydrophobicContact CZ-CD 3.5Å; F182-K186 VanDerWaalsContact CZ-CD 3.5Å; F182-K186 HydrophobicContact CZ-CG 4.49Å; F182-K186 WeakPolarHBondContact O-CD 3.46Å; F182-K186 PolarHBondContact O-NZ 2.84Å; F182-W210 HydrophobicContact CB-CH2 4.37Å; F182-W210 HydrophobicContact CB-CZ3 4.08Å; F182-W210 HydrophobicContact CG-CZ3 4.46Å; F182-F211 HydrophobicContact CB-CE1 4.17Å; F182-F211 HydrophobicContact CB-CZ 4.32Å; F182-F211 AromaticContact CD2-CD1 3.88Å; F182-F211 HydrophobicContact CD2-CD1 3.88Å; F182-F211 AromaticContact CD2-CE1 3.81Å; F182-F211 HydrophobicContact CD2-CE1 3.81Å; F182-R214 HydrophobicContact CD1-CG 3.65Å; F182-R214 HydrophobicContact CD2-CB 4.33Å; F182-R214 HydrophobicContact CD2-CG 3.8Å; F182-R214 HydrophobicContact CE1-CG 3.66Å; F182-R214 HydrophobicContact CE2-CB 4.26Å; F182-R214 HydrophobicContact CE2-CG 3.83Å; F182-R214 HydrophobicContact CG-CG 3.72Å; F182-R214 HydrophobicContact CZ-CB 4.5Å; F182-R214 HydrophobicContact CZ-CG 3.75Å; F182-R215 HydrophobicContact CE2-CG 3.74Å; F182-R215 HydrophobicContact CZ-CG 4.2Å; F182-W218 HydrophobicContact CE1-CB 4.28Å; F182-W218 HydrophobicContact CE1-CG 4.44Å; F182-W218 HydrophobicContact CZ-CB 4.08Å; F182-W218 HydrophobicContact CZ-CG 4.32Å |
| 183 | H | 98.1 | Very high | 98 | Very high | 151 Ų | 151 | 71.9 Ų | 71.9 | 70% | 0.699 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -58.9 | -48.1 | 176 | -171.5 | 83.5 | 0 | 0 | 0 | 110.3 | E179 R181 K186 | E179-H183 PolarHBondContact O-N 3.45Å; R181-H183 VanDerWaalsContact C-N 3.31Å; R181-H183 PolarHBondContact O-N 3.07Å; H183-K186 PolarHBondContact O-NZ 3.13Å; H183-K186 VanDerWaalsContact O-NZ 3.07Å |
| 184 | R | 97.8 | Very high | 98 | Very high | 152 Ų | 152 | 67.2 Ų | 67.2 | 57% | 0.574 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -69.3 | -37.7 | 177.8 | -65.2 | -176.4 | -70.5 | -166.8 | 0.7 | 113.9 | K180 R181 F182 | K180-R184 PolarHBondContact O-N 3.19Å; R181-R184 PolarHBondContact O-N 3.45Å; F182-R184 VanDerWaalsContact C-N 3.32Å; F182-R184 PolarHBondContact O-N 3.23Å |
| 185 | Q | 97.9 | Very high | 98.1 | Very high | 59 Ų | 59 | 68.2 Ų | 68.2 | 28% | 0.276 | 36% | 0.355 | S | S | . | . | trans | -149.2 | 115.7 | -171.8 | -166.5 | -175.2 | -1.8 | 0 | 0 | 111.2 | R181 F182 Y187 L188 E192 | R181-Q185 PolarHBondContact O-N 3.37Å; F182-Q185 WeakPolarHBondContact CA-O 3.49Å; F182-Q185 CarbonylContact O-C 3.54Å; F182-Q185 PolarHBondContact O-N 2.78Å; Q185-Y187 VanDerWaalsContact C-N 3.34Å; Q185-Y187 VanDerWaalsContact CG-O 3.26Å; Q185-Y187 WeakPolarHBondContact CG-O 3.22Å; Q185-Y187 PolarHBondContact NE2-O 2.83Å; Q185-Y187 PolarHBondContact O-N 3.29Å; Q185-L188 HydrophobicContact CB-CD2 4.33Å; Q185-L188 HydrophobicContact CG-CD2 4.27Å; Q185-E192 PolarHBondContact NE2-OE2 3.2Å; Q185-E192 PolarHBondContact OE1-OE1 3.05Å | ||
| 186 | K | 97.8 | Very high | 98 | Very high | 61 Ų | 61 | 67 Ų | 67 | 27% | 0.265 | 35% | 0.349 | S | S | . | . | S | Bend | trans | -75.5 | -22.1 | -175.9 | -49.7 | -61.1 | 166.6 | -154.8 | 0 | 113.3 | F182 H183 R215 | F182-K186 HydrophobicContact CD1-CD 4.13Å; F182-K186 HydrophobicContact CD2-CD 4.35Å; F182-K186 HydrophobicContact CE1-CD 3.64Å; F182-K186 HydrophobicContact CE2-CB 4.11Å; F182-K186 HydrophobicContact CE2-CD 3.88Å; F182-K186 HydrophobicContact CG-CD 4.47Å; F182-K186 HydrophobicContact CZ-CB 4.4Å; F182-K186 HydrophobicContact CZ-CD 3.5Å; F182-K186 VanDerWaalsContact CZ-CD 3.5Å; F182-K186 HydrophobicContact CZ-CG 4.49Å; F182-K186 WeakPolarHBondContact O-CD 3.46Å; F182-K186 PolarHBondContact O-NZ 2.84Å; H183-K186 PolarHBondContact O-NZ 3.13Å; H183-K186 VanDerWaalsContact O-NZ 3.07Å; K186-R215 WeakPolarHBondContact O-CD 3.42Å |
| 187 | Y | 98.1 | Very high | 98 | Very high | 132 Ų | 132 | 64.8 Ų | 64.8 | 52% | 0.518 | 34% | 0.335 | S | S | . | . | S | Bend | trans | -132.2 | 119.6 | -176.9 | -63.2 | -108.6 | 0 | 0 | 0 | 109.2 | Q185 | Q185-Y187 VanDerWaalsContact C-N 3.34Å; Q185-Y187 VanDerWaalsContact CG-O 3.26Å; Q185-Y187 WeakPolarHBondContact CG-O 3.22Å; Q185-Y187 PolarHBondContact NE2-O 2.83Å; Q185-Y187 PolarHBondContact O-N 3.29Å |
| 188 | L | 97.6 | Very high | 98 | Very high | 20 Ų | 20 | 69.5 Ų | 69.5 | 11% | 0.105 | 35% | 0.354 | C | S | . | . | trans | -95.9 | 137.4 | 178.1 | -62.6 | -178.6 | 0 | 0 | 0 | 111.6 | R181 Q185 R193 L196 V207 F211 | R181-L188 HydrophobicContact CG-CD1 4.46Å; R181-L188 HydrophobicContact CG-CD2 4.01Å; Q185-L188 HydrophobicContact CB-CD2 4.33Å; Q185-L188 HydrophobicContact CG-CD2 4.27Å; L188-R193 HydrophobicContact CB-CB 4.43Å; L188-L196 HydrophobicContact CD1-CD2 3.78Å; L188-V207 HydrophobicContact CD1-CG1 4.43Å; L188-F211 HydrophobicContact CD1-CD1 4.26Å; L188-F211 HydrophobicContact CD1-CD2 4.07Å; L188-F211 HydrophobicContact CD1-CE1 3.72Å; L188-F211 HydrophobicContact CD1-CE2 3.52Å; L188-F211 HydrophobicContact CD1-CG 4.43Å; L188-F211 HydrophobicContact CD1-CZ 3.33Å; L188-F211 HydrophobicContact CD2-CE1 4.22Å; L188-F211 HydrophobicContact CD2-CZ 4.33Å; L188-F211 HydrophobicContact CG-CD1 4.06Å; L188-F211 HydrophobicContact CG-CE1 3.58Å; L188-F211 HydrophobicContact CG-CE2 4.32Å; L188-F211 HydrophobicContact CG-CZ 3.75Å | ||
| 189 | A | 98 | Very high | 98 | Very high | 55 Ų | 55 | 73.1 Ų | 73.1 | 46% | 0.455 | 38% | 0.384 | S | S | . | . | trans | -67.3 | 164.1 | 167.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | A191 E192 R193 | A189-A191 PolarHBondContact O-N 3.29Å; A189-E192 HydrophobicContact CB-CG 4.2Å; A189-E192 PolarHBondContact N-OE2 3.31Å; A189-E192 PolarHBondContact O-N 3.24Å; A189-R193 WeakPolarHBondContact O-CB 3.47Å; A189-R193 PolarHBondContact O-N 2.96Å | ||
| 190 | S | 97.9 | Very high | 97.9 | Very high | 83 Ų | 83 | 70.3 Ų | 70.3 | 58% | 0.58 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -59.6 | -46.2 | -175.7 | -157.4 | 0 | 0 | 0 | 0 | 112.6 | R193 A194 | S190-R193 PolarHBondContact O-N 3.45Å; S190-A194 PolarHBondContact O-N 2.9Å; S190-A194 VanDerWaalsContact O-N 3.07Å |
| 191 | A | 97.8 | Very high | 97.8 | Very high | 79 Ų | 79 | 74.5 Ų | 74.5 | 65% | 0.653 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -63.9 | -43.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | A189 R193 A194 A195 | A189-A191 PolarHBondContact O-N 3.29Å; A191-R193 VanDerWaalsContact C-N 3.32Å; A191-R193 PolarHBondContact O-N 3.47Å; A191-A194 PolarHBondContact O-N 2.91Å; A191-A195 PolarHBondContact O-N 3.44Å |
| 192 | E | 97.9 | Very high | 97.8 | Very high | 58 Ų | 58 | 72 Ų | 72 | 27% | 0.271 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -64.3 | -38.9 | 178.2 | -58.4 | -175.8 | 102 | 0 | 0 | 112 | R181 Q185 A189 A195 L196 | R181-E192 IonicContact NH2-OE1 2.92Å; R181-E192 PolarHBondContact NH2-OE1 3.49Å; Q185-E192 PolarHBondContact NE2-OE2 3.2Å; Q185-E192 PolarHBondContact OE1-OE1 3.05Å; A189-E192 HydrophobicContact CB-CG 4.2Å; A189-E192 PolarHBondContact N-OE2 3.31Å; A189-E192 PolarHBondContact O-N 3.24Å; E192-A195 PolarHBondContact O-N 2.76Å; E192-L196 WeakPolarHBondContact O-CB 3.27Å; E192-L196 PolarHBondContact O-N 3.19Å |
| 193 | R | 98.3 | Very high | 97.7 | Very high | 47 Ų | 47 | 75.3 Ų | 75.3 | 18% | 0.177 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -62.5 | -45.2 | 175.7 | -162.8 | -172.8 | -41.2 | 107.7 | 10.1 | 111.2 | L188 A189 S190 A191 A195 L196 A197 D204 V207 | L188-R193 HydrophobicContact CB-CB 4.43Å; A189-R193 WeakPolarHBondContact O-CB 3.47Å; A189-R193 PolarHBondContact O-N 2.96Å; S190-R193 PolarHBondContact O-N 3.45Å; A191-R193 VanDerWaalsContact C-N 3.32Å; A191-R193 PolarHBondContact O-N 3.47Å; R193-A195 VanDerWaalsContact C-N 3.33Å; R193-A195 PolarHBondContact O-N 2.92Å; R193-L196 PolarHBondContact O-N 3.39Å; R193-A197 VanDerWaalsContact O-CB 3.29Å; R193-A197 WeakPolarHBondContact O-CB 3.34Å; R193-A197 PolarHBondContact O-N 3.46Å; R193-D204 WeakPolarHBondContact CB-OD2 3.44Å; R193-D204 WeakPolarHBondContact CD-OD2 3.22Å; R193-D204 VanDerWaalsContact CG-OD2 3.27Å; R193-D204 WeakPolarHBondContact CG-OD2 3.39Å; R193-D204 IonicContact NH1-OD1 2.65Å; R193-D204 PolarHBondContact NH1-OD1 3.46Å; R193-D204 IonicContact NH1-OD2 2.82Å; R193-V207 HydrophobicContact CG-CB 3.9Å; R193-V207 HydrophobicContact CG-CG1 3.59Å |
| 194 | A | 98.1 | Very high | 97.7 | Very high | 38 Ų | 38 | 70.9 Ų | 70.9 | 31% | 0.314 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -62.7 | -39.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | S190 A191 A197 K198 | S190-A194 PolarHBondContact O-N 2.9Å; S190-A194 VanDerWaalsContact O-N 3.07Å; A191-A194 PolarHBondContact O-N 2.91Å; A194-A197 PolarHBondContact O-N 2.93Å; A194-K198 WeakPolarHBondContact O-CG 3.47Å; A194-K198 PolarHBondContact O-N 3.28Å; A194-K198 VanDerWaalsContact O-N 3.08Å |
| 195 | A | 97.9 | Very high | 97.6 | Very high | 61 Ų | 61 | 66.5 Ų | 66.5 | 50% | 0.504 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -63.8 | -45.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | A191 E192 R193 A197 K198 A199 | A191-A195 PolarHBondContact O-N 3.44Å; E192-A195 PolarHBondContact O-N 2.76Å; R193-A195 VanDerWaalsContact C-N 3.33Å; R193-A195 PolarHBondContact O-N 2.92Å; A195-A197 PolarHBondContact O-N 3.3Å; A195-K198 PolarHBondContact O-N 2.72Å; A195-A199 PolarHBondContact O-N 3.42Å |
| 196 | L | 97.8 | Very high | 97.6 | Very high | 19 Ų | 19 | 66.4 Ų | 66.4 | 10% | 0.099 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -64.8 | -40 | 177.6 | -173.3 | 63.2 | 0 | 0 | 0 | 112.2 | L178 R181 L188 E192 R193 K198 A199 L200 V207 F211 | L178-L196 HydrophobicContact CD2-CD2 3.94Å; R181-L196 HydrophobicContact CB-CD2 4.24Å; R181-L196 HydrophobicContact CG-CD2 4.09Å; L188-L196 HydrophobicContact CD1-CD2 3.78Å; E192-L196 WeakPolarHBondContact O-CB 3.27Å; E192-L196 PolarHBondContact O-N 3.19Å; R193-L196 PolarHBondContact O-N 3.39Å; L196-K198 VanDerWaalsContact C-N 3.35Å; L196-K198 PolarHBondContact O-N 3.13Å; L196-A199 PolarHBondContact O-N 3.12Å; L196-L200 HydrophobicContact CD1-CD1 3.86Å; L196-L200 HydrophobicContact CD1-CG 4.16Å; L196-L200 HydrophobicContact CG-CD1 4.02Å; L196-L200 WeakPolarHBondContact O-CG 3.32Å; L196-L200 PolarHBondContact O-N 2.92Å; L196-V207 HydrophobicContact CD2-CG1 3.99Å; L196-F211 HydrophobicContact CD2-CE2 3.93Å; L196-F211 HydrophobicContact CD2-CZ 4.32Å |
| 197 | A | 98.1 | Very high | 97.6 | Very high | 6 Ų | 6 | 63.5 Ų | 63.5 | 5% | 0.05 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -59.2 | -45.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | R193 A194 A195 L200 K201 M202 V207 | R193-A197 VanDerWaalsContact O-CB 3.29Å; R193-A197 WeakPolarHBondContact O-CB 3.34Å; R193-A197 PolarHBondContact O-N 3.46Å; A194-A197 PolarHBondContact O-N 2.93Å; A195-A197 PolarHBondContact O-N 3.3Å; A197-L200 PolarHBondContact O-N 3.44Å; A197-K201 PolarHBondContact O-N 3.36Å; A197-K201 VanDerWaalsContact O-N 3.1Å; A197-M202 CarbonylContact C-O 3.43Å; A197-M202 WeakPolarHBondContact CB-O 3.33Å; A197-M202 PolarHBondContact O-N 2.86Å; A197-M202 VanDerWaalsContact O-O 3.08Å; A197-V207 HydrophobicContact CB-CG2 3.87Å |
| 198 | K | 97.8 | Very high | 97.6 | Very high | 171 Ų | 171 | 63.2 Ų | 63.2 | 74% | 0.743 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -60.8 | -47.9 | 174.6 | -71.7 | 175 | -179 | -178.1 | 0 | 111.9 | A194 A195 L196 L200 K201 | A194-K198 WeakPolarHBondContact O-CG 3.47Å; A194-K198 PolarHBondContact O-N 3.28Å; A194-K198 VanDerWaalsContact O-N 3.08Å; A195-K198 PolarHBondContact O-N 2.72Å; L196-K198 VanDerWaalsContact C-N 3.35Å; L196-K198 PolarHBondContact O-N 3.13Å; K198-L200 VanDerWaalsContact C-N 3.32Å; K198-L200 PolarHBondContact O-N 3.47Å; K198-K201 PolarHBondContact O-N 3.48Å |
| 199 | A | 97.4 | Very high | 97.6 | Very high | 77 Ų | 77 | 66 Ų | 66 | 64% | 0.636 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -60.7 | -38.9 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | A195 L196 | A195-A199 PolarHBondContact O-N 3.42Å; L196-A199 PolarHBondContact O-N 3.12Å |
| 200 | L | 96.8 | Very high | 97.6 | Very high | 23 Ų | 23 | 64.8 Ų | 64.8 | 12% | 0.12 | 37% | 0.37 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.8 | 3.3 | -177.7 | -60 | -178.7 | 0 | 0 | 0 | 114.2 | Q174 E177 L178 L196 A197 K198 M202 | Q174-L200 PolarHBondContact NE2-O 3.32Å; E177-L200 HydrophobicContact CB-CD1 4.21Å; E177-L200 HydrophobicContact CB-CD2 3.65Å; E177-L200 HydrophobicContact CG-CD2 4.1Å; L178-L200 HydrophobicContact CD2-CD1 3.87Å; L178-L200 HydrophobicContact CG-CD1 3.73Å; L196-L200 HydrophobicContact CD1-CD1 3.86Å; L196-L200 HydrophobicContact CD1-CG 4.16Å; L196-L200 HydrophobicContact CG-CD1 4.02Å; L196-L200 WeakPolarHBondContact O-CG 3.32Å; L196-L200 PolarHBondContact O-N 2.92Å; A197-L200 PolarHBondContact O-N 3.44Å; K198-L200 VanDerWaalsContact C-N 3.32Å; K198-L200 PolarHBondContact O-N 3.47Å; L200-M202 VanDerWaalsContact C-N 3.27Å; L200-M202 HydrophobicContact CB-CG 4.06Å; L200-M202 HydrophobicContact CB-SD 3.97Å; L200-M202 HydrophobicContact CD1-SD 4.35Å; L200-M202 WeakPolarHBondContact O-CG 3.3Å; L200-M202 PolarHBondContact O-N 2.97Å |
| 201 | K | 97.6 | Very high | 97.6 | Very high | 195 Ų | 195 | 61.3 Ų | 61.3 | 85% | 0.848 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.7 | 44.7 | -173.7 | -57.1 | -178.6 | 179.8 | 178.8 | 0 | 112.1 | A197 K198 | A197-K201 PolarHBondContact O-N 3.36Å; A197-K201 VanDerWaalsContact O-N 3.1Å; K198-K201 PolarHBondContact O-N 3.48Å |
| 202 | M | 96.5 | Very high | 97.6 | Very high | 17 Ų | 17 | 61.6 Ų | 61.6 | 8% | 0.084 | 33% | 0.332 | C | S | . | . | trans | -118.6 | 162.8 | 178.4 | -64 | 177.3 | 63.2 | 0 | 0 | 110.2 | F170 Q174 L178 A197 L200 Q206 V207 | F170-M202 HydrophobicContact CD1-CE 3.46Å; F170-M202 VanDerWaalsContact CD1-CE 3.46Å; F170-M202 HydrophobicContact CD1-SD 4.31Å; F170-M202 HydrophobicContact CE1-CE 3.22Å; F170-M202 HydrophobicContact CE2-CE 4.38Å; F170-M202 HydrophobicContact CG-CE 4.17Å; F170-M202 HydrophobicContact CZ-CE 3.72Å; Q174-M202 HydrophobicContact CB-SD 4.17Å; Q174-M202 HydrophobicContact CG-SD 4.26Å; L178-M202 HydrophobicContact CD1-CE 4.18Å; L178-M202 HydrophobicContact CD1-SD 4.12Å; A197-M202 CarbonylContact C-O 3.43Å; A197-M202 WeakPolarHBondContact CB-O 3.33Å; A197-M202 PolarHBondContact O-N 2.86Å; A197-M202 VanDerWaalsContact O-O 3.08Å; L200-M202 VanDerWaalsContact C-N 3.27Å; L200-M202 HydrophobicContact CB-CG 4.06Å; L200-M202 HydrophobicContact CB-SD 3.97Å; L200-M202 HydrophobicContact CD1-SD 4.35Å; L200-M202 WeakPolarHBondContact O-CG 3.3Å; L200-M202 PolarHBondContact O-N 2.97Å; M202-Q206 HydrophobicContact CE-CB 3.86Å; M202-V207 HydrophobicContact CB-CG2 4.23Å | ||
| 203 | T | 97.4 | Very high | 97.6 | Very high | 77 Ų | 77 | 63.7 Ų | 63.7 | 47% | 0.472 | 35% | 0.345 | S | S | . | . | trans | -81.4 | 150.9 | 172.3 | 62.6 | 0 | 0 | 0 | 0 | 111.3 | A205 Q206 V207 | T203-A205 PolarHBondContact O-N 3.33Å; T203-Q206 WeakPolarHBondContact O-CB 3.33Å; T203-Q206 PolarHBondContact O-N 3.07Å; T203-Q206 WeakPolarHBondContact OG1-CB 3.35Å; T203-Q206 VanDerWaalsContact OG1-CG 3.22Å; T203-Q206 WeakPolarHBondContact OG1-CG 3.32Å; T203-Q206 PolarHBondContact OG1-N 3.38Å; T203-Q206 PolarHBondContact OG1-OE1 3.28Å; T203-V207 PolarHBondContact O-N 3.33Å; T203-V207 VanDerWaalsContact O-N 3.12Å | ||
| 204 | D | 97.1 | Very high | 97.6 | Very high | 59 Ų | 59 | 64 Ų | 64 | 32% | 0.316 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -54 | -39.4 | 175.3 | -173.1 | -96.7 | 0 | 0 | 0 | 111.7 | R193 Q206 V207 K208 | R193-D204 WeakPolarHBondContact CB-OD2 3.44Å; R193-D204 WeakPolarHBondContact CD-OD2 3.22Å; R193-D204 VanDerWaalsContact CG-OD2 3.27Å; R193-D204 WeakPolarHBondContact CG-OD2 3.39Å; R193-D204 IonicContact NH1-OD1 2.65Å; R193-D204 PolarHBondContact NH1-OD1 3.46Å; R193-D204 IonicContact NH1-OD2 2.82Å; D204-Q206 PolarHBondContact O-N 3.2Å; D204-V207 PolarHBondContact O-N 2.95Å; D204-K208 VanDerWaalsContact O-CB 3.3Å; D204-K208 WeakPolarHBondContact O-CB 3.43Å; D204-K208 PolarHBondContact O-N 3.28Å |
| 205 | A | 96.6 | Very high | 97.6 | Very high | 59 Ų | 59 | 64.1 Ų | 64.1 | 49% | 0.488 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63.4 | -37.9 | 177 | 0 | 0 | 0 | 0 | 0 | 113.1 | T203 T209 | T203-A205 PolarHBondContact O-N 3.33Å; A205-T209 WeakPolarHBondContact O-CB 3.38Å; A205-T209 PolarHBondContact O-N 2.91Å; A205-T209 PolarHBondContact O-OG1 3.16Å |
| 206 | Q | 96.8 | Very high | 97.6 | Very high | 57 Ų | 57 | 64.5 Ų | 64.5 | 27% | 0.266 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -66.6 | -46.3 | 175 | -77.5 | 165.8 | -51.9 | 0 | 0 | 111.1 | F170 M202 T203 D204 K208 T209 W210 | F170-Q206 HydrophobicContact CE1-CB 4.38Å; F170-Q206 HydrophobicContact CE1-CG 4.39Å; F170-Q206 HydrophobicContact CZ-CB 4.37Å; M202-Q206 HydrophobicContact CE-CB 3.86Å; T203-Q206 WeakPolarHBondContact O-CB 3.33Å; T203-Q206 PolarHBondContact O-N 3.07Å; T203-Q206 WeakPolarHBondContact OG1-CB 3.35Å; T203-Q206 VanDerWaalsContact OG1-CG 3.22Å; T203-Q206 WeakPolarHBondContact OG1-CG 3.32Å; T203-Q206 PolarHBondContact OG1-N 3.38Å; T203-Q206 PolarHBondContact OG1-OE1 3.28Å; D204-Q206 PolarHBondContact O-N 3.2Å; Q206-K208 VanDerWaalsContact C-N 3.34Å; Q206-K208 PolarHBondContact O-N 3.46Å; Q206-T209 PolarHBondContact O-N 2.96Å; Q206-W210 WeakPolarHBondContact O-CB 3.5Å; Q206-W210 PolarHBondContact O-N 3.03Å |
| 207 | V | 97.9 | Very high | 97.6 | Very high | 0 Ų | 0 | 68.5 Ų | 68.5 | 0% | 0 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -61.5 | -44.5 | 176.7 | -178.9 | 0 | 0 | 0 | 0 | 110.5 | L178 L188 R193 L196 A197 M202 T203 D204 T209 W210 F211 | L178-V207 HydrophobicContact CD2-CG1 4.23Å; L188-V207 HydrophobicContact CD1-CG1 4.43Å; R193-V207 HydrophobicContact CG-CB 3.9Å; R193-V207 HydrophobicContact CG-CG1 3.59Å; L196-V207 HydrophobicContact CD2-CG1 3.99Å; A197-V207 HydrophobicContact CB-CG2 3.87Å; M202-V207 HydrophobicContact CB-CG2 4.23Å; T203-V207 PolarHBondContact O-N 3.33Å; T203-V207 VanDerWaalsContact O-N 3.12Å; D204-V207 PolarHBondContact O-N 2.95Å; V207-T209 PolarHBondContact O-N 3.18Å; V207-W210 PolarHBondContact O-N 3Å; V207-F211 HydrophobicContact CG1-CD2 3.83Å; V207-F211 HydrophobicContact CG1-CE2 3.98Å; V207-F211 WeakPolarHBondContact O-CD2 3.31Å; V207-F211 PolarHBondContact O-N 3.39Å |
| 208 | K | 97.8 | Very high | 97.5 | Very high | 127 Ų | 127 | 72.7 Ų | 72.7 | 55% | 0.552 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -56.9 | -49.1 | 175.4 | 177.3 | 180 | 166.7 | 179.5 | 0 | 111.7 | D204 Q206 F211 Q212 | D204-K208 VanDerWaalsContact O-CB 3.3Å; D204-K208 WeakPolarHBondContact O-CB 3.43Å; D204-K208 PolarHBondContact O-N 3.28Å; Q206-K208 VanDerWaalsContact C-N 3.34Å; Q206-K208 PolarHBondContact O-N 3.46Å; K208-F211 PolarHBondContact O-N 2.83Å; K208-Q212 WeakPolarHBondContact O-CB 3.47Å; K208-Q212 PolarHBondContact O-N 3.25Å |
| 209 | T | 97.7 | Very high | 97.4 | Very high | 78 Ų | 78 | 70 Ų | 70 | 48% | 0.479 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -65.3 | -41 | -179.8 | -57.2 | 0 | 0 | 0 | 0 | 111.1 | A205 Q206 V207 Q212 N213 | A205-T209 WeakPolarHBondContact O-CB 3.38Å; A205-T209 PolarHBondContact O-N 2.91Å; A205-T209 PolarHBondContact O-OG1 3.16Å; Q206-T209 PolarHBondContact O-N 2.96Å; V207-T209 PolarHBondContact O-N 3.18Å; T209-Q212 PolarHBondContact O-N 3.48Å; T209-N213 WeakPolarHBondContact O-CB 3.11Å; T209-N213 VanDerWaalsContact O-CG 3.27Å; T209-N213 PolarHBondContact O-N 3.45Å; T209-N213 PolarHBondContact O-ND2 3.31Å |
| 210 | W | 97.8 | Very high | 97.3 | Very high | 30 Ų | 30 | 73.1 Ų | 73.1 | 11% | 0.114 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -62.2 | -48.2 | 176.7 | -169.4 | 100.2 | 0 | 0 | 0 | 111.4 | F170 L178 E179 F182 Q206 V207 Q212 N213 R214 | F170-W210 AromaticContact CD2-CD1 3.75Å; F170-W210 AromaticContact CE2-CD1 3.61Å; F170-W210 HydrophobicContact CE2-CG 4.5Å; L178-W210 HydrophobicContact CB-CD2 3.97Å; L178-W210 HydrophobicContact CB-CE3 3.9Å; L178-W210 HydrophobicContact CB-CH2 3.59Å; L178-W210 HydrophobicContact CB-CZ2 3.63Å; L178-W210 HydrophobicContact CB-CZ3 3.73Å; L178-W210 HydrophobicContact CD1-CD2 3.82Å; L178-W210 HydrophobicContact CD1-CE3 4.44Å; L178-W210 HydrophobicContact CD1-CG 3.84Å; L178-W210 HydrophobicContact CD1-CZ2 4.45Å; L178-W210 HydrophobicContact CD2-CD2 4.36Å; L178-W210 HydrophobicContact CD2-CE3 4.22Å; L178-W210 HydrophobicContact CG-CD2 4.27Å; L178-W210 HydrophobicContact CG-CE3 4.42Å; E179-W210 HydrophobicContact CG-CH2 3.84Å; E179-W210 HydrophobicContact CG-CZ2 3.89Å; F182-W210 HydrophobicContact CB-CH2 4.37Å; F182-W210 HydrophobicContact CB-CZ3 4.08Å; F182-W210 HydrophobicContact CG-CZ3 4.46Å; Q206-W210 WeakPolarHBondContact O-CB 3.5Å; Q206-W210 PolarHBondContact O-N 3.03Å; V207-W210 PolarHBondContact O-N 3Å; W210-Q212 VanDerWaalsContact C-N 3.3Å; W210-Q212 PolarHBondContact O-N 3.47Å; W210-N213 PolarHBondContact O-N 2.92Å; W210-R214 HydrophobicContact CD2-CB 4.49Å; W210-R214 HydrophobicContact CE3-CB 3.94Å; W210-R214 HydrophobicContact CE3-CG 4.49Å; W210-R214 HydrophobicContact CH2-CB 4.05Å; W210-R214 HydrophobicContact CH2-CG 3.75Å; W210-R214 HydrophobicContact CZ3-CB 3.69Å; W210-R214 HydrophobicContact CZ3-CG 3.75Å; W210-R214 VanDerWaalsContact O-CB 3.32Å; W210-R214 WeakPolarHBondContact O-CB 3.41Å; W210-R214 PolarHBondContact O-N 3.05Å |
| 211 | F | 98.5 | Very high | 97.2 | Very high | 10 Ų | 10 | 75.6 Ų | 75.6 | 4% | 0.044 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -64.4 | -33.1 | 176.7 | -91.5 | -101.7 | 0 | 0 | 0 | 112.7 | L178 R181 F182 L188 L196 V207 K208 R215 | L178-F211 HydrophobicContact CD2-CD2 4.5Å; L178-F211 HydrophobicContact CD2-CE2 3.93Å; R181-F211 HydrophobicContact CB-CZ 4.36Å; R181-F211 HydrophobicContact CG-CZ 4.34Å; F182-F211 HydrophobicContact CB-CE1 4.17Å; F182-F211 HydrophobicContact CB-CZ 4.32Å; F182-F211 AromaticContact CD2-CD1 3.88Å; F182-F211 HydrophobicContact CD2-CD1 3.88Å; F182-F211 AromaticContact CD2-CE1 3.81Å; F182-F211 HydrophobicContact CD2-CE1 3.81Å; L188-F211 HydrophobicContact CD1-CD1 4.26Å; L188-F211 HydrophobicContact CD1-CD2 4.07Å; L188-F211 HydrophobicContact CD1-CE1 3.72Å; L188-F211 HydrophobicContact CD1-CE2 3.52Å; L188-F211 HydrophobicContact CD1-CG 4.43Å; L188-F211 HydrophobicContact CD1-CZ 3.33Å; L188-F211 HydrophobicContact CD2-CE1 4.22Å; L188-F211 HydrophobicContact CD2-CZ 4.33Å; L188-F211 HydrophobicContact CG-CD1 4.06Å; L188-F211 HydrophobicContact CG-CE1 3.58Å; L188-F211 HydrophobicContact CG-CE2 4.32Å; L188-F211 HydrophobicContact CG-CZ 3.75Å; L196-F211 HydrophobicContact CD2-CE2 3.93Å; L196-F211 HydrophobicContact CD2-CZ 4.32Å; V207-F211 HydrophobicContact CG1-CD2 3.83Å; V207-F211 HydrophobicContact CG1-CE2 3.98Å; V207-F211 WeakPolarHBondContact O-CD2 3.31Å; V207-F211 PolarHBondContact O-N 3.39Å; K208-F211 PolarHBondContact O-N 2.83Å; F211-R215 WeakPolarHBondContact O-CB 3.45Å; F211-R215 VanDerWaalsContact O-CG 3.32Å; F211-R215 WeakPolarHBondContact O-CG 3.45Å; F211-R215 PolarHBondContact O-N 2.94Å; F211-R215 PolarHBondContact O-NE 2.85Å |
| 212 | Q | 98.2 | Very high | 96.9 | Very high | 85 Ų | 85 | 68.5 Ų | 68.5 | 40% | 0.397 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -64.8 | -50.3 | 172.5 | -174.2 | 61.4 | 53.5 | 0 | 0 | 111.3 | K208 T209 W210 R214 R215 T216 | K208-Q212 WeakPolarHBondContact O-CB 3.47Å; K208-Q212 PolarHBondContact O-N 3.25Å; T209-Q212 PolarHBondContact O-N 3.48Å; W210-Q212 VanDerWaalsContact C-N 3.3Å; W210-Q212 PolarHBondContact O-N 3.47Å; Q212-R214 VanDerWaalsContact C-N 3.33Å; Q212-R214 PolarHBondContact O-N 3.45Å; Q212-R215 PolarHBondContact O-N 2.65Å; Q212-T216 PolarHBondContact O-N 3.26Å; Q212-T216 VanDerWaalsContact O-N 3.07Å; Q212-T216 PolarHBondContact O-OG1 3.13Å |
| 213 | N | 97.9 | Very high | 96.6 | Very high | 102 Ų | 102 | 70.2 Ų | 70.2 | 55% | 0.545 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62.9 | -41.1 | 178.5 | -69.7 | -15.4 | 0 | 0 | 0 | 111.4 | T209 W210 T216 K217 | T209-N213 WeakPolarHBondContact O-CB 3.11Å; T209-N213 VanDerWaalsContact O-CG 3.27Å; T209-N213 PolarHBondContact O-N 3.45Å; T209-N213 PolarHBondContact O-ND2 3.31Å; W210-N213 PolarHBondContact O-N 2.92Å; N213-T216 PolarHBondContact O-N 2.87Å; N213-K217 PolarHBondContact O-N 3.32Å |
| 214 | R | 98.2 | Very high | 96.3 | Very high | 53 Ų | 53 | 71 Ų | 71 | 20% | 0.2 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -64.4 | -42.3 | 179.2 | -172.5 | 65.8 | -171 | 115.7 | -8.7 | 111.9 | F182 W210 Q212 K217 W218 | F182-R214 HydrophobicContact CD1-CG 3.65Å; F182-R214 HydrophobicContact CD2-CB 4.33Å; F182-R214 HydrophobicContact CD2-CG 3.8Å; F182-R214 HydrophobicContact CE1-CG 3.66Å; F182-R214 HydrophobicContact CE2-CB 4.26Å; F182-R214 HydrophobicContact CE2-CG 3.83Å; F182-R214 HydrophobicContact CG-CG 3.72Å; F182-R214 HydrophobicContact CZ-CB 4.5Å; F182-R214 HydrophobicContact CZ-CG 3.75Å; W210-R214 HydrophobicContact CD2-CB 4.49Å; W210-R214 HydrophobicContact CE3-CB 3.94Å; W210-R214 HydrophobicContact CE3-CG 4.49Å; W210-R214 HydrophobicContact CH2-CB 4.05Å; W210-R214 HydrophobicContact CH2-CG 3.75Å; W210-R214 HydrophobicContact CZ3-CB 3.69Å; W210-R214 HydrophobicContact CZ3-CG 3.75Å; W210-R214 VanDerWaalsContact O-CB 3.32Å; W210-R214 WeakPolarHBondContact O-CB 3.41Å; W210-R214 PolarHBondContact O-N 3.05Å; Q212-R214 VanDerWaalsContact C-N 3.33Å; Q212-R214 PolarHBondContact O-N 3.45Å; R214-K217 PolarHBondContact O-N 3.42Å; R214-W218 WeakPolarHBondContact O-CB 3.48Å; R214-W218 PolarHBondContact O-N 3Å |
| 215 | R | 98.3 | Very high | 96.1 | Very high | 41 Ų | 41 | 74 Ų | 74 | 16% | 0.155 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -63 | -40.6 | 173.7 | -76.9 | -178.6 | -70.4 | 158.2 | 3 | 112.5 | F182 K186 F211 Q212 W218 R219 | F182-R215 HydrophobicContact CE2-CG 3.74Å; F182-R215 HydrophobicContact CZ-CG 4.2Å; K186-R215 WeakPolarHBondContact O-CD 3.42Å; F211-R215 WeakPolarHBondContact O-CB 3.45Å; F211-R215 VanDerWaalsContact O-CG 3.32Å; F211-R215 WeakPolarHBondContact O-CG 3.45Å; F211-R215 PolarHBondContact O-N 2.94Å; F211-R215 PolarHBondContact O-NE 2.85Å; Q212-R215 PolarHBondContact O-N 2.65Å; R215-W218 PolarHBondContact O-N 3.5Å; R215-R219 WeakPolarHBondContact O-CG 3.48Å; R215-R219 PolarHBondContact O-N 3.06Å |
| 216 | T | 97.8 | Very high | 95.9 | Very high | 68 Ų | 68 | 78.4 Ų | 78.4 | 42% | 0.417 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -62.2 | -45.8 | 174.9 | -60.1 | 0 | 0 | 0 | 0 | 111.3 | Q212 N213 W218 R219 R220 | Q212-T216 PolarHBondContact O-N 3.26Å; Q212-T216 VanDerWaalsContact O-N 3.07Å; Q212-T216 PolarHBondContact O-OG1 3.13Å; N213-T216 PolarHBondContact O-N 2.87Å; T216-W218 PolarHBondContact O-N 3.42Å; T216-R219 PolarHBondContact O-N 3.48Å; T216-R219 PolarHBondContact OG1-NH2 3.03Å; T216-R220 PolarHBondContact O-N 3.36Å |
| 217 | K | 97.1 | Very high | 95.6 | Very high | 103 Ų | 103 | 78.6 Ų | 78.6 | 45% | 0.448 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -60.2 | -45.2 | 175 | -176.3 | 177 | 176.8 | -176.9 | 0 | 111.5 | N213 R214 R220 Q221 | N213-K217 PolarHBondContact O-N 3.32Å; R214-K217 PolarHBondContact O-N 3.42Å; K217-R220 PolarHBondContact O-N 2.91Å; K217-Q221 HydrophobicContact CG-CG 4.42Å; K217-Q221 VanDerWaalsContact O-CG 3.31Å; K217-Q221 WeakPolarHBondContact O-CG 3.35Å; K217-Q221 PolarHBondContact O-N 2.87Å |
| 218 | W | 96.5 | Very high | 95.3 | Very high | 95 Ų | 95 | 81 Ų | 81 | 36% | 0.36 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -59.4 | -49.8 | 178.2 | 170.9 | 64.4 | 0 | 0 | 0 | 112.1 | F182 R214 R215 T216 R220 Q221 T222 | F182-W218 HydrophobicContact CE1-CB 4.28Å; F182-W218 HydrophobicContact CE1-CG 4.44Å; F182-W218 HydrophobicContact CZ-CB 4.08Å; F182-W218 HydrophobicContact CZ-CG 4.32Å; R214-W218 WeakPolarHBondContact O-CB 3.48Å; R214-W218 PolarHBondContact O-N 3Å; R215-W218 PolarHBondContact O-N 3.5Å; T216-W218 PolarHBondContact O-N 3.42Å; W218-R220 VanDerWaalsContact C-N 3.28Å; W218-R220 PolarHBondContact O-N 3.39Å; W218-Q221 PolarHBondContact O-N 3.26Å; W218-T222 PolarHBondContact O-N 3.49Å; W218-T222 PolarHBondContact O-OG1 2.99Å; W218-T222 VanDerWaalsContact O-OG1 3.12Å |
| 219 | R | 96.5 | Very high | 95.1 | Very high | 113 Ų | 113 | 80.4 Ų | 80.4 | 43% | 0.426 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -59.2 | -39.5 | 176.5 | -73.4 | -165.6 | -57.4 | -81.9 | -5.1 | 112.7 | R215 T216 A223 | R215-R219 WeakPolarHBondContact O-CG 3.48Å; R215-R219 PolarHBondContact O-N 3.06Å; T216-R219 PolarHBondContact O-N 3.48Å; T216-R219 PolarHBondContact OG1-NH2 3.03Å; R219-A223 WeakPolarHBondContact O-CB 3.33Å; R219-A223 PolarHBondContact O-N 3.46Å |
| 220 | R | 94.9 | Very high | 94.9 | Very high | 143 Ų | 143 | 84.2 Ų | 84.2 | 54% | 0.54 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.2 | -47 | 176.5 | -176.9 | 171.9 | 73 | 94.8 | -1.5 | 111.3 | T216 K217 W218 T222 A223 E224 | T216-R220 PolarHBondContact O-N 3.36Å; K217-R220 PolarHBondContact O-N 2.91Å; W218-R220 VanDerWaalsContact C-N 3.28Å; W218-R220 PolarHBondContact O-N 3.39Å; R220-T222 PolarHBondContact O-N 3.38Å; R220-A223 PolarHBondContact O-N 2.87Å; R220-A223 VanDerWaalsContact O-N 3.16Å; R220-E224 WeakPolarHBondContact CD-OE1 3.49Å; R220-E224 HydrophobicContact CG-CG 4.33Å; R220-E224 WeakPolarHBondContact CG-OE1 3.5Å; R220-E224 IonicContact CZ-OE1 3.57Å; R220-E224 IonicContact NE-OE1 2.95Å; R220-E224 IonicContact NH1-OE1 3.73Å; R220-E224 PolarHBondContact NH1-OE1 3.21Å; R220-E224 IonicContact NH1-OE2 3.89Å; R220-E224 PolarHBondContact NH1-OE2 3.27Å; R220-E224 WeakPolarHBondContact O-CB 3.49Å; R220-E224 WeakPolarHBondContact O-CG 3.42Å; R220-E224 PolarHBondContact O-N 2.94Å |
| 221 | Q | 93.6 | Very high | 94.7 | Very high | 76 Ų | 76 | 87 Ų | 87 | 36% | 0.355 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -59.7 | -46.3 | 178 | -71.5 | 176.8 | -49.6 | 0 | 0 | 111.6 | K217 W218 A223 E224 E225 | K217-Q221 HydrophobicContact CG-CG 4.42Å; K217-Q221 VanDerWaalsContact O-CG 3.31Å; K217-Q221 WeakPolarHBondContact O-CG 3.35Å; K217-Q221 PolarHBondContact O-N 2.87Å; W218-Q221 PolarHBondContact O-N 3.26Å; Q221-A223 VanDerWaalsContact C-N 3.26Å; Q221-A223 PolarHBondContact O-N 3.42Å; Q221-E224 PolarHBondContact O-N 2.99Å; Q221-E225 WeakPolarHBondContact O-CB 3.3Å; Q221-E225 PolarHBondContact O-N 3.08Å |
| 222 | T | 91.4 | Very high | 94.4 | Very high | 46 Ų | 46 | 92.2 Ų | 92.2 | 28% | 0.282 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -67.3 | -24.6 | 177.6 | -53.5 | 0 | 0 | 0 | 0 | 113.5 | W218 R220 R226 | W218-T222 PolarHBondContact O-N 3.49Å; W218-T222 PolarHBondContact O-OG1 2.99Å; W218-T222 VanDerWaalsContact O-OG1 3.12Å; R220-T222 PolarHBondContact O-N 3.38Å; T222-R226 PolarHBondContact O-NH1 3.17Å |
| 223 | A | 90.7 | Very high | 94.2 | Very high | 52 Ų | 52 | 91 Ų | 91 | 43% | 0.43 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -77.9 | -43.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | R219 R220 Q221 R226 E227 | R219-A223 WeakPolarHBondContact O-CB 3.33Å; R219-A223 PolarHBondContact O-N 3.46Å; R220-A223 PolarHBondContact O-N 2.87Å; R220-A223 VanDerWaalsContact O-N 3.16Å; Q221-A223 VanDerWaalsContact C-N 3.26Å; Q221-A223 PolarHBondContact O-N 3.42Å; A223-R226 PolarHBondContact O-N 2.82Å; A223-E227 WeakPolarHBondContact O-CB 3.48Å; A223-E227 PolarHBondContact O-N 2.65Å |
| 224 | E | 92.2 | Very high | 94 | Very high | 93 Ų | 93 | 91 Ų | 91 | 44% | 0.435 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -63.5 | -39.9 | 178.2 | -73.6 | 167.3 | -179.1 | 0 | 0 | 112 | R220 Q221 E227 A228 | R220-E224 WeakPolarHBondContact CD-OE1 3.49Å; R220-E224 HydrophobicContact CG-CG 4.33Å; R220-E224 WeakPolarHBondContact CG-OE1 3.5Å; R220-E224 IonicContact CZ-OE1 3.57Å; R220-E224 IonicContact NE-OE1 2.95Å; R220-E224 IonicContact NH1-OE1 3.73Å; R220-E224 PolarHBondContact NH1-OE1 3.21Å; R220-E224 IonicContact NH1-OE2 3.89Å; R220-E224 PolarHBondContact NH1-OE2 3.27Å; R220-E224 WeakPolarHBondContact O-CB 3.49Å; R220-E224 WeakPolarHBondContact O-CG 3.42Å; R220-E224 PolarHBondContact O-N 2.94Å; Q221-E224 PolarHBondContact O-N 2.99Å; E224-E227 PolarHBondContact O-N 3.38Å; E224-A228 WeakPolarHBondContact O-CB 3.4Å; E224-A228 PolarHBondContact O-N 3.26Å |
| 225 | E | 91.7 | Very high | 93.8 | Very high | 123 Ų | 123 | 95.8 Ų | 95.8 | 58% | 0.575 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -61.1 | -50.1 | 175.9 | -175.6 | 172 | -156.6 | 0 | 0 | 111.9 | Q221 E227 A228 E229 | Q221-E225 WeakPolarHBondContact O-CB 3.3Å; Q221-E225 PolarHBondContact O-N 3.08Å; E225-E227 VanDerWaalsContact C-N 3.27Å; E225-E227 PolarHBondContact O-N 2.94Å; E225-A228 WeakPolarHBondContact O-CB 3.31Å; E225-A228 PolarHBondContact O-N 3.23Å; E225-A228 VanDerWaalsContact O-N 3.13Å; E225-E229 WeakPolarHBondContact O-CG 3.43Å; E225-E229 PolarHBondContact O-N 3.38Å |
| 226 | R | 91.9 | Very high | 93.6 | Very high | 152 Ų | 152 | 98.3 Ų | 98.3 | 57% | 0.574 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -61.1 | -36.7 | 175.8 | -172.2 | -169.6 | -68.6 | 86.5 | 3.9 | 112.5 | T222 A223 R230 | T222-R226 PolarHBondContact O-NH1 3.17Å; A223-R226 PolarHBondContact O-N 2.82Å; R226-R230 WeakPolarHBondContact O-CB 3.46Å; R226-R230 PolarHBondContact O-N 3.39Å |
| 227 | E | 91.9 | Very high | 93.4 | Very high | 61 Ų | 61 | 100.3 Ų | 100.3 | 29% | 0.285 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -67.7 | -41.3 | 176.2 | -176.7 | 61.3 | -142.4 | 0 | 0 | 111.2 | A223 E224 E225 R230 Q231 | A223-E227 WeakPolarHBondContact O-CB 3.48Å; A223-E227 PolarHBondContact O-N 2.65Å; E224-E227 PolarHBondContact O-N 3.38Å; E225-E227 VanDerWaalsContact C-N 3.27Å; E225-E227 PolarHBondContact O-N 2.94Å; E227-R230 VanDerWaalsContact CD-CZ 3.43Å; E227-R230 PolarHBondContact O-N 3.14Å; E227-R230 IonicContact OE1-CZ 3.56Å; E227-R230 VanDerWaalsContact OE1-CZ 3.22Å; E227-R230 IonicContact OE1-NE 3.45Å; E227-R230 IonicContact OE1-NH1 3.85Å; E227-R230 IonicContact OE1-NH2 3.52Å; E227-R230 PolarHBondContact OE1-NH2 2.83Å; E227-R230 IonicContact OE2-CZ 3.96Å; E227-R230 IonicContact OE2-NE 3.79Å; E227-R230 IonicContact OE2-NH1 2.72Å; E227-R230 PolarHBondContact OE2-NH1 2.91Å; E227-R230 IonicContact OE2-NH2 3.07Å; E227-R230 PolarHBondContact OE2-NH2 2.94Å; E227-Q231 VanDerWaalsContact O-CG 3.31Å; E227-Q231 WeakPolarHBondContact O-CG 3.44Å; E227-Q231 PolarHBondContact O-N 2.72Å; E227-Q231 PolarHBondContact OE1-NE2 3.06Å |
| 228 | A | 91.6 | Very high | 93.2 | Very high | 49 Ų | 49 | 100.2 Ų | 100.2 | 41% | 0.405 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63.1 | -43.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | E224 E225 R230 Q231 Q232 | E224-A228 WeakPolarHBondContact O-CB 3.4Å; E224-A228 PolarHBondContact O-N 3.26Å; E225-A228 WeakPolarHBondContact O-CB 3.31Å; E225-A228 PolarHBondContact O-N 3.23Å; E225-A228 VanDerWaalsContact O-N 3.13Å; A228-R230 VanDerWaalsContact C-N 3.35Å; A228-R230 PolarHBondContact O-N 2.85Å; A228-Q231 PolarHBondContact O-N 3.45Å; A228-Q232 WeakPolarHBondContact O-CB 3.36Å; A228-Q232 PolarHBondContact O-N 3.35Å |
| 229 | E | 92.3 | Very high | 93 | Very high | 116 Ų | 116 | 100.7 Ų | 100.7 | 54% | 0.542 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -58.7 | -45.5 | 172.8 | -72.4 | 175.3 | 169.9 | 0 | 0 | 111.4 | E225 Q231 Q232 A233 | E225-E229 WeakPolarHBondContact O-CG 3.43Å; E225-E229 PolarHBondContact O-N 3.38Å; E229-Q231 VanDerWaalsContact C-N 3.33Å; E229-Q231 PolarHBondContact O-N 3.07Å; E229-Q232 PolarHBondContact O-N 3.33Å; E229-A233 WeakPolarHBondContact O-CB 3.49Å; E229-A233 PolarHBondContact O-N 3.14Å |
| 230 | R | 93.4 | Very high | 92.8 | Very high | 157 Ų | 157 | 100.7 Ų | 100.7 | 59% | 0.592 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61 | -42.4 | 176.8 | -166.6 | 179.2 | 78.7 | -141.5 | 5.8 | 111.8 | R226 E227 A228 A233 N234 | R226-R230 WeakPolarHBondContact O-CB 3.46Å; R226-R230 PolarHBondContact O-N 3.39Å; E227-R230 VanDerWaalsContact CD-CZ 3.43Å; E227-R230 PolarHBondContact O-N 3.14Å; E227-R230 IonicContact OE1-CZ 3.56Å; E227-R230 VanDerWaalsContact OE1-CZ 3.22Å; E227-R230 IonicContact OE1-NE 3.45Å; E227-R230 IonicContact OE1-NH1 3.85Å; E227-R230 IonicContact OE1-NH2 3.52Å; E227-R230 PolarHBondContact OE1-NH2 2.83Å; E227-R230 IonicContact OE2-CZ 3.96Å; E227-R230 IonicContact OE2-NE 3.79Å; E227-R230 IonicContact OE2-NH1 2.72Å; E227-R230 PolarHBondContact OE2-NH1 2.91Å; E227-R230 IonicContact OE2-NH2 3.07Å; E227-R230 PolarHBondContact OE2-NH2 2.94Å; A228-R230 VanDerWaalsContact C-N 3.35Å; A228-R230 PolarHBondContact O-N 2.85Å; R230-A233 PolarHBondContact O-N 3.01Å; R230-N234 WeakPolarHBondContact O-CB 3.16Å; R230-N234 PolarHBondContact O-N 3.23Å |
| 231 | Q | 93.3 | Very high | 92.6 | Very high | 90 Ų | 90 | 100.6 Ų | 100.6 | 42% | 0.421 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -67.3 | -36.1 | 176.9 | -71.6 | 175.6 | 14.9 | 0 | 0 | 112.2 | E227 A228 E229 R235 | E227-Q231 VanDerWaalsContact O-CG 3.31Å; E227-Q231 WeakPolarHBondContact O-CG 3.44Å; E227-Q231 PolarHBondContact O-N 2.72Å; E227-Q231 PolarHBondContact OE1-NE2 3.06Å; A228-Q231 PolarHBondContact O-N 3.45Å; E229-Q231 VanDerWaalsContact C-N 3.33Å; E229-Q231 PolarHBondContact O-N 3.07Å; Q231-R235 WeakPolarHBondContact O-CG 3.47Å; Q231-R235 PolarHBondContact O-N 2.94Å; Q231-R235 PolarHBondContact O-NE 2.93Å |
| 232 | Q | 93.6 | Very high | 92.2 | Very high | 118 Ų | 118 | 102.5 Ų | 102.5 | 55% | 0.551 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.5 | -47.6 | 173.6 | -176.9 | 177.8 | -5.7 | 0 | 0 | 111.3 | A228 E229 N234 R235 I236 | A228-Q232 WeakPolarHBondContact O-CB 3.36Å; A228-Q232 PolarHBondContact O-N 3.35Å; E229-Q232 PolarHBondContact O-N 3.33Å; Q232-N234 VanDerWaalsContact C-N 3.29Å; Q232-N234 PolarHBondContact O-N 2.96Å; Q232-R235 WeakPolarHBondContact O-CB 3.3Å; Q232-R235 PolarHBondContact O-N 2.93Å; Q232-I236 HydrophobicContact CG-CD1 4.18Å; Q232-I236 WeakPolarHBondContact O-CG1 3.41Å; Q232-I236 PolarHBondContact O-N 3.35Å |
| 233 | A | 93.4 | Very high | 91.8 | Very high | 59 Ų | 59 | 103.8 Ų | 103.8 | 49% | 0.488 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.1 | -41.2 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | E229 R230 I236 L237 | E229-A233 WeakPolarHBondContact O-CB 3.49Å; E229-A233 PolarHBondContact O-N 3.14Å; R230-A233 PolarHBondContact O-N 3.01Å; A233-I236 PolarHBondContact O-N 3.43Å; A233-L237 WeakPolarHBondContact O-CB 3.49Å; A233-L237 PolarHBondContact O-N 2.83Å |
| 234 | N | 94.3 | Very high | 91.3 | Very high | 102 Ų | 102 | 103.8 Ų | 103.8 | 55% | 0.545 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.9 | -40.2 | 176.3 | -173 | -97.2 | 0 | 0 | 0 | 112.6 | R230 Q232 L237 M238 | R230-N234 WeakPolarHBondContact O-CB 3.16Å; R230-N234 PolarHBondContact O-N 3.23Å; Q232-N234 VanDerWaalsContact C-N 3.29Å; Q232-N234 PolarHBondContact O-N 2.96Å; N234-L237 PolarHBondContact O-N 2.97Å; N234-M238 WeakPolarHBondContact O-CB 3.49Å; N234-M238 PolarHBondContact O-N 3.44Å |
| 235 | R | 93.9 | Very high | 90.8 | Very high | 155 Ų | 155 | 106 Ų | 106 | 59% | 0.585 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.8 | -45.7 | 173.8 | -81 | -175.6 | -88.3 | -134.9 | -1.3 | 112.2 | Q231 Q232 M238 Q239 | Q231-R235 WeakPolarHBondContact O-CG 3.47Å; Q231-R235 PolarHBondContact O-N 2.94Å; Q231-R235 PolarHBondContact O-NE 2.93Å; Q232-R235 WeakPolarHBondContact O-CB 3.3Å; Q232-R235 PolarHBondContact O-N 2.93Å; R235-M238 PolarHBondContact O-N 2.83Å; R235-Q239 WeakPolarHBondContact O-CB 3.31Å; R235-Q239 PolarHBondContact O-N 3Å |
| 236 | I | 93.9 | Very high | 90 | Very high | 94 Ų | 94 | 106.4 Ų | 106.4 | 48% | 0.482 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.3 | -44.9 | 177.3 | -66.9 | 168 | 0 | 0 | 0 | 110.5 | Q232 A233 M238 Q239 L240 | Q232-I236 HydrophobicContact CG-CD1 4.18Å; Q232-I236 WeakPolarHBondContact O-CG1 3.41Å; Q232-I236 PolarHBondContact O-N 3.35Å; A233-I236 PolarHBondContact O-N 3.43Å; I236-M238 VanDerWaalsContact C-N 3.33Å; I236-M238 PolarHBondContact O-N 2.98Å; I236-Q239 PolarHBondContact O-N 3.21Å; I236-L240 WeakPolarHBondContact O-CB 3.48Å; I236-L240 PolarHBondContact O-N 3.43Å |
| 237 | L | 93.6 | Very high | 89 | Confident | 109 Ų | 109 | 105.6 Ų | 105.6 | 57% | 0.571 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -59.8 | -43.7 | 177.7 | -178.1 | 64 | 0 | 0 | 0 | 111.8 | A233 N234 L240 Q241 | A233-L237 WeakPolarHBondContact O-CB 3.49Å; A233-L237 PolarHBondContact O-N 2.83Å; N234-L237 PolarHBondContact O-N 2.97Å; L237-L240 PolarHBondContact O-N 2.93Å; L237-Q241 PolarHBondContact O-N 3.25Å |
| 238 | M | 92.3 | Very high | 87.7 | Confident | 102 Ų | 102 | 108 Ų | 108 | 50% | 0.502 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.9 | -41.6 | 177.7 | -165.5 | -175.2 | 81.3 | 0 | 0 | 111.7 | N234 R235 I236 Q241 Q242 | N234-M238 WeakPolarHBondContact O-CB 3.49Å; N234-M238 PolarHBondContact O-N 3.44Å; R235-M238 PolarHBondContact O-N 2.83Å; I236-M238 VanDerWaalsContact C-N 3.33Å; I236-M238 PolarHBondContact O-N 2.98Å; M238-Q241 PolarHBondContact O-N 3.34Å; M238-Q242 WeakPolarHBondContact O-CG 3.02Å; M238-Q242 PolarHBondContact O-N 3.28Å |
| 239 | Q | 91.9 | Very high | 86.3 | Confident | 105 Ų | 105 | 111 Ų | 111 | 49% | 0.491 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63.4 | -44.3 | 175.8 | -176.6 | 178.5 | -5.6 | 0 | 0 | 111.4 | R235 I236 Q241 Q242 E243 | R235-Q239 WeakPolarHBondContact O-CB 3.31Å; R235-Q239 PolarHBondContact O-N 3Å; I236-Q239 PolarHBondContact O-N 3.21Å; Q239-Q241 VanDerWaalsContact C-N 3.28Å; Q239-Q241 PolarHBondContact O-N 3.07Å; Q239-Q242 WeakPolarHBondContact O-CB 3.46Å; Q239-Q242 PolarHBondContact O-N 3.47Å; Q239-Q242 VanDerWaalsContact O-N 3.14Å; Q239-E243 HydrophobicContact CG-CG 4.45Å; Q239-E243 PolarHBondContact NE2-OE1 2.8Å; Q239-E243 WeakPolarHBondContact O-CG 3.29Å; Q239-E243 PolarHBondContact O-N 3.47Å |
| 240 | L | 93.3 | Very high | 84.8 | Confident | 112 Ų | 112 | 110.9 Ų | 110.9 | 59% | 0.586 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -61.7 | -38.5 | 178.8 | -153.5 | 86.5 | 0 | 0 | 0 | 111.6 | I236 L237 E243 A244 | I236-L240 WeakPolarHBondContact O-CB 3.48Å; I236-L240 PolarHBondContact O-N 3.43Å; L237-L240 PolarHBondContact O-N 2.93Å; L240-E243 PolarHBondContact O-N 3.22Å; L240-A244 VanDerWaalsContact O-CB 3.3Å; L240-A244 WeakPolarHBondContact O-CB 3.39Å; L240-A244 PolarHBondContact O-N 3.29Å |
| 241 | Q | 89.6 | Confident | 82.8 | Confident | 141 Ų | 141 | 109.8 Ų | 109.8 | 66% | 0.659 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -65.3 | -41.3 | 175.3 | -173.6 | 174.6 | -1.3 | 0 | 0 | 111.8 | L237 M238 Q239 A244 F245 | L237-Q241 PolarHBondContact O-N 3.25Å; M238-Q241 PolarHBondContact O-N 3.34Å; Q239-Q241 VanDerWaalsContact C-N 3.28Å; Q239-Q241 PolarHBondContact O-N 3.07Å; Q241-A244 PolarHBondContact O-N 3.25Å; Q241-F245 WeakPolarHBondContact O-CB 3.45Å; Q241-F245 PolarHBondContact O-N 3.19Å |
| 242 | Q | 85.6 | Confident | 81 | Confident | 116 Ų | 116 | 110.9 Ų | 110.9 | 54% | 0.542 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.1 | -45.8 | 174.2 | -71.9 | 174.5 | 1.4 | 0 | 0 | 111.6 | M238 Q239 A244 F245 Q246 | M238-Q242 WeakPolarHBondContact O-CG 3.02Å; M238-Q242 PolarHBondContact O-N 3.28Å; Q239-Q242 WeakPolarHBondContact O-CB 3.46Å; Q239-Q242 PolarHBondContact O-N 3.47Å; Q239-Q242 VanDerWaalsContact O-N 3.14Å; Q242-A244 VanDerWaalsContact C-N 3.34Å; Q242-A244 PolarHBondContact O-N 2.81Å; Q242-F245 PolarHBondContact O-N 2.82Å; Q242-Q246 VanDerWaalsContact O-CB 3.29Å; Q242-Q246 WeakPolarHBondContact O-CB 3.41Å; Q242-Q246 PolarHBondContact O-N 3.02Å |
| 243 | E | 82.9 | Confident | 79.4 | Confident | 74 Ų | 74 | 110.7 Ų | 110.7 | 35% | 0.346 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -62.5 | -40.6 | 176.7 | -75.3 | -178.3 | -160.3 | 0 | 0 | 111.9 | Q239 L240 Q246 K247 | Q239-E243 HydrophobicContact CG-CG 4.45Å; Q239-E243 PolarHBondContact NE2-OE1 2.8Å; Q239-E243 WeakPolarHBondContact O-CG 3.29Å; Q239-E243 PolarHBondContact O-N 3.47Å; L240-E243 PolarHBondContact O-N 3.22Å; E243-Q246 PolarHBondContact O-N 3.25Å; E243-K247 VanDerWaalsContact O-CB 3.24Å; E243-K247 WeakPolarHBondContact O-CB 3.4Å; E243-K247 WeakPolarHBondContact O-CG 3.2Å; E243-K247 PolarHBondContact O-N 3.34Å; E243-K247 IonicContact OE2-NZ 3.87Å |
| 244 | A | 81.5 | Confident | 77.8 | Confident | 52 Ų | 52 | 111.8 Ų | 111.8 | 43% | 0.43 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -61.8 | -46.3 | 175 | 0 | 0 | 0 | 0 | 0 | 111.1 | L240 Q241 Q242 K247 T248 | L240-A244 VanDerWaalsContact O-CB 3.3Å; L240-A244 WeakPolarHBondContact O-CB 3.39Å; L240-A244 PolarHBondContact O-N 3.29Å; Q241-A244 PolarHBondContact O-N 3.25Å; Q242-A244 VanDerWaalsContact C-N 3.34Å; Q242-A244 PolarHBondContact O-N 2.81Å; A244-K247 PolarHBondContact O-N 2.81Å; A244-T248 PolarHBondContact O-N 3.21Å; A244-T248 PolarHBondContact O-OG1 3.07Å |
| 245 | F | 81 | Confident | 76.2 | Confident | 140 Ų | 140 | 109.9 Ų | 109.9 | 61% | 0.614 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -64 | -42.6 | 177.4 | -171.3 | -101.4 | 0 | 0 | 0 | 112.3 | Q241 Q242 T248 I249 | Q241-F245 WeakPolarHBondContact O-CB 3.45Å; Q241-F245 PolarHBondContact O-N 3.19Å; Q242-F245 PolarHBondContact O-N 2.82Å; F245-T248 WeakPolarHBondContact O-CB 3.24Å; F245-T248 PolarHBondContact O-N 3.32Å; F245-I249 HydrophobicContact CD1-CD1 3.95Å; F245-I249 HydrophobicContact CE1-CD1 3.35Å; F245-I249 HydrophobicContact CE1-CG1 4.28Å; F245-I249 HydrophobicContact CZ-CD1 3.82Å; F245-I249 PolarHBondContact O-N 3.38Å |
| 246 | Q | 75.7 | Confident | 74.7 | Confident | 131 Ų | 131 | 106.7 Ų | 106.7 | 61% | 0.612 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -71.4 | -32.4 | -179.7 | -163.3 | 145.2 | 84.2 | 0 | 0 | 112.4 | Q242 E243 I249 N250 | Q242-Q246 VanDerWaalsContact O-CB 3.29Å; Q242-Q246 WeakPolarHBondContact O-CB 3.41Å; Q242-Q246 PolarHBondContact O-N 3.02Å; E243-Q246 PolarHBondContact O-N 3.25Å; Q246-I249 PolarHBondContact O-N 3.04Å; Q246-N250 WeakPolarHBondContact CG-ND2 3.39Å; Q246-N250 WeakPolarHBondContact O-CB 3.46Å; Q246-N250 PolarHBondContact O-N 2.94Å; Q246-N250 PolarHBondContact O-ND2 3.13Å |
| 247 | K | 69 | Low | 73.4 | Confident | 135 Ų | 135 | 106.9 Ų | 106.9 | 59% | 0.587 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -65.9 | -39 | 168.9 | -76 | 170.1 | -175.7 | 169.1 | 0 | 111.3 | E243 A244 I249 Q251 | E243-K247 VanDerWaalsContact O-CB 3.24Å; E243-K247 WeakPolarHBondContact O-CB 3.4Å; E243-K247 WeakPolarHBondContact O-CG 3.2Å; E243-K247 PolarHBondContact O-N 3.34Å; E243-K247 IonicContact OE2-NZ 3.87Å; A244-K247 PolarHBondContact O-N 2.81Å; K247-I249 VanDerWaalsContact C-N 3.29Å; K247-I249 PolarHBondContact O-N 2.95Å; K247-Q251 WeakPolarHBondContact O-CB 3.12Å; K247-Q251 PolarHBondContact O-N 3.19Å |
| 248 | T | 64.7 | Low | 71.8 | Confident | 110 Ų | 110 | 107.2 Ų | 107.2 | 68% | 0.675 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -63.8 | -34.4 | 173.5 | -55.5 | 0 | 0 | 0 | 0 | 112.2 | A244 F245 | A244-T248 PolarHBondContact O-N 3.21Å; A244-T248 PolarHBondContact O-OG1 3.07Å; F245-T248 WeakPolarHBondContact O-CB 3.24Å; F245-T248 PolarHBondContact O-N 3.32Å |
| 249 | I | 64.1 | Low | 70.4 | Confident | 112 Ų | 112 | 103.2 Ų | 103.2 | 57% | 0.574 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -78.3 | -37.8 | 177.9 | -70.4 | -174 | 0 | 0 | 0 | 113.1 | F245 Q246 K247 | F245-I249 HydrophobicContact CD1-CD1 3.95Å; F245-I249 HydrophobicContact CE1-CD1 3.35Å; F245-I249 HydrophobicContact CE1-CG1 4.28Å; F245-I249 HydrophobicContact CZ-CD1 3.82Å; F245-I249 PolarHBondContact O-N 3.38Å; Q246-I249 PolarHBondContact O-N 3.04Å; K247-I249 VanDerWaalsContact C-N 3.29Å; K247-I249 PolarHBondContact O-N 2.95Å |
| 250 | N | 59.1 | Low | 69.2 | Low | 115 Ų | 115 | 102.9 Ų | 102.9 | 62% | 0.615 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -98 | -2 | -175.1 | -67.6 | -74.5 | 0 | 0 | 0 | 114.4 | Q246 P252 | Q246-N250 WeakPolarHBondContact CG-ND2 3.39Å; Q246-N250 WeakPolarHBondContact O-CB 3.46Å; Q246-N250 PolarHBondContact O-N 2.94Å; Q246-N250 PolarHBondContact O-ND2 3.13Å; N250-P252 VanDerWaalsContact O-CD 3.31Å; N250-P252 WeakPolarHBondContact O-CD 3.37Å |
| 251 | Q | 52.2 | Low | 68.2 | Low | 134 Ų | 134 | 105.7 Ų | 105.7 | 63% | 0.626 | 57% | 0.568 | S | S | * | * | S | Bend | trans | -68.9 | 120 | 172.1 | -170.9 | -172.7 | 102.5 | 0 | 0 | 107.9 | K247 V253 | K247-Q251 WeakPolarHBondContact O-CB 3.12Å; K247-Q251 PolarHBondContact O-N 3.19Å; Q251-V253 PolarHBondContact O-N 3.42Å |
| 252 | P | 55.3 | Low | 67.6 | Low | 112 Ų | 112 | 102.4 Ų | 102.4 | 73% | 0.727 | 56% | 0.555 | S | S | * | * | trans | -60.4 | 116.7 | 166 | 25.4 | -30 | 0 | 0 | 0 | 106 | N250 A254 | N250-P252 VanDerWaalsContact O-CD 3.31Å; N250-P252 WeakPolarHBondContact O-CD 3.37Å; P252-A254 PolarHBondContact O-N 3.17Å | ||
| 253 | V | 59.8 | Low | 67 | Low | 115 Ų | 115 | 101.5 Ų | 101.5 | 70% | 0.697 | 56% | 0.561 | S | S | * | * | trans | -52.1 | 106.8 | 171.7 | 174.4 | 0 | 0 | 0 | 0 | 105.9 | Q251 P255 | Q251-V253 PolarHBondContact O-N 3.42Å; V253-P255 WeakPolarHBondContact O-CD 3.45Å | ||
| 254 | A | 60.6 | Low | 66.7 | Low | 81 Ų | 81 | 101.7 Ų | 101.7 | 67% | 0.669 | 57% | 0.571 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 118.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 105.5 | P252 D256 | P252-A254 PolarHBondContact O-N 3.17Å; A254-D256 PolarHBondContact O-N 3.43Å |
| 255 | P | 59.8 | Low | 66.2 | Low | 62 Ų | 62 | 103.3 Ų | 103.3 | 40% | 0.403 | 57% | 0.572 | S | S | . | * | P | Polyproline II helix | trans | -63.4 | 128.2 | -174.3 | 28 | -35.2 | 0 | 0 | 0 | 107.6 | V253 L260 | V253-P255 WeakPolarHBondContact O-CD 3.45Å; P255-L260 HydrophobicContact CB-CD1 3.32Å; P255-L260 HydrophobicContact CG-CD1 3.35Å |
| 256 | D | 63.9 | Low | 65.7 | Low | 89 Ų | 89 | 102.1 Ų | 102.1 | 48% | 0.476 | 56% | 0.564 | S | S | . | * | P | Polyproline II helix | trans | -48.8 | 129.3 | 178.2 | -170.2 | -33.5 | 0 | 0 | 0 | 108.8 | A254 L258 C259 L260 | A254-D256 PolarHBondContact O-N 3.43Å; D256-L258 PolarHBondContact O-N 3.42Å; D256-L258 PolarHBondContact OD1-N 2.97Å; D256-L258 VanDerWaalsContact OD1-N 3.13Å; D256-C259 HydrophobicContact CB-CB 4.37Å; D256-C259 PolarHBondContact N-SG 3.2Å; D256-C259 PolarHBondContact O-N 3.4Å; D256-C259 PolarHBondContact O-SG 3.04Å; D256-L260 PolarHBondContact O-N 3.35Å |
| 257 | P | 65.9 | Low | 65.5 | Low | 98 Ų | 98 | 98.4 Ų | 98.4 | 64% | 0.636 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -52.7 | -25.9 | -179.8 | 19.8 | -33.4 | 0 | 0 | 0 | 113.1 | ||
| 258 | L | 60.1 | Low | 65.5 | Low | 116 Ų | 116 | 97.2 Ų | 97.2 | 61% | 0.607 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -74.3 | -29.4 | 174.7 | -61.7 | -179.6 | 0 | 0 | 0 | 113.8 | D256 N262 | D256-L258 PolarHBondContact O-N 3.42Å; D256-L258 PolarHBondContact OD1-N 2.97Å; D256-L258 VanDerWaalsContact OD1-N 3.13Å; L258-N262 PolarHBondContact O-N 3.27Å |
| 259 | C | 63.1 | Low | 65.5 | Low | 17 Ų | 17 | 95.1 Ų | 95.1 | 12% | 0.115 | 54% | 0.538 | C | S | . | . | H | α-helix | trans | -80.1 | -19.6 | 177.8 | 72.3 | 0 | 0 | 0 | 0 | 112.8 | D256 L265 Y266 Q269 | D256-C259 HydrophobicContact CB-CB 4.37Å; D256-C259 PolarHBondContact N-SG 3.2Å; D256-C259 PolarHBondContact O-N 3.4Å; D256-C259 PolarHBondContact O-SG 3.04Å; C259-L265 HydrophobicContact CB-CB 4.17Å; C259-Y266 WeakPolarHBondContact O-CB 3.49Å; C259-Y266 PolarHBondContact O-N 3.45Å; C259-Q269 PolarHBondContact SG-OE1 3.26Å |
| 260 | L | 65.7 | Low | 65.4 | Low | 98 Ų | 98 | 94.9 Ų | 94.9 | 51% | 0.513 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -73.6 | -35.2 | 170 | -103.1 | 71 | 0 | 0 | 0 | 113.3 | P255 D256 | P255-L260 HydrophobicContact CB-CD1 3.32Å; P255-L260 HydrophobicContact CG-CD1 3.35Å; D256-L260 PolarHBondContact O-N 3.35Å |
| 261 | Q | 72.8 | Confident | 65.6 | Low | 172 Ų | 172 | 95.4 Ų | 95.4 | 80% | 0.804 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -83.5 | -16.5 | -177.9 | -91.7 | 177.9 | -21.3 | 0 | 0 | 113.8 | ||
| 262 | N | 76.3 | Confident | 65.7 | Low | 71 Ų | 71 | 94.3 Ų | 94.3 | 38% | 0.38 | 54% | 0.535 | S | S | . | . | trans | -105.5 | 108.7 | 179.7 | -172.2 | -72.3 | 0 | 0 | 0 | 110.6 | L258 S264 L265 Y266 | L258-N262 PolarHBondContact O-N 3.27Å; N262-S264 PolarHBondContact O-N 3.12Å; N262-S264 WeakPolarHBondContact OD1-CB 3.31Å; N262-S264 PolarHBondContact OD1-N 3.47Å; N262-L265 HydrophobicContact CB-CB 4.08Å; N262-L265 HydrophobicContact CB-CD1 3.98Å; N262-L265 HydrophobicContact CB-CG 4.09Å; N262-L265 PolarHBondContact O-N 3.22Å; N262-L265 VanDerWaalsContact O-N 3.12Å; N262-L265 PolarHBondContact OD1-N 3.18Å; N262-Y266 WeakPolarHBondContact O-CB 3.39Å; N262-Y266 PolarHBondContact O-N 2.91Å | ||
| 263 | S | 74.1 | Confident | 65.6 | Low | 97 Ų | 97 | 93.8 Ų | 93.8 | 68% | 0.678 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -56 | -34.5 | -177.2 | 53.2 | 0 | 0 | 0 | 0 | 113.8 | A267 | S263-A267 WeakPolarHBondContact O-CB 3.49Å; S263-A267 PolarHBondContact O-N 3.39Å; S263-A267 VanDerWaalsContact O-N 3.12Å |
| 264 | S | 76 | Confident | 65.2 | Low | 78 Ų | 78 | 99.1 Ų | 99.1 | 55% | 0.545 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -71.4 | -43.2 | 177.7 | -52.6 | 0 | 0 | 0 | 0 | 112 | N262 A267 L268 | N262-S264 PolarHBondContact O-N 3.12Å; N262-S264 WeakPolarHBondContact OD1-CB 3.31Å; N262-S264 PolarHBondContact OD1-N 3.47Å; S264-A267 PolarHBondContact O-N 3.39Å; S264-L268 WeakPolarHBondContact O-CG 3.44Å; S264-L268 PolarHBondContact O-N 3.42Å |
| 265 | L | 70.3 | Confident | 64.8 | Low | 86 Ų | 86 | 99.1 Ų | 99.1 | 45% | 0.45 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -69.1 | -35.7 | 176.5 | -65.6 | 179 | 0 | 0 | 0 | 112 | C259 N262 L268 Q269 | C259-L265 HydrophobicContact CB-CB 4.17Å; N262-L265 HydrophobicContact CB-CB 4.08Å; N262-L265 HydrophobicContact CB-CD1 3.98Å; N262-L265 HydrophobicContact CB-CG 4.09Å; N262-L265 PolarHBondContact O-N 3.22Å; N262-L265 VanDerWaalsContact O-N 3.12Å; N262-L265 PolarHBondContact OD1-N 3.18Å; L265-L268 HydrophobicContact CD2-CD1 4.47Å; L265-L268 PolarHBondContact O-N 3.33Å; L265-Q269 PolarHBondContact O-N 3.46Å; L265-Q269 VanDerWaalsContact O-N 3.12Å |
| 266 | Y | 72.3 | Confident | 64.3 | Low | 115 Ų | 115 | 104.1 Ų | 104.1 | 45% | 0.451 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.9 | -41.6 | 175 | -170 | -101.9 | 0 | 0 | 0 | 112.4 | C259 N262 L268 Q269 N270 | C259-Y266 WeakPolarHBondContact O-CB 3.49Å; C259-Y266 PolarHBondContact O-N 3.45Å; N262-Y266 WeakPolarHBondContact O-CB 3.39Å; N262-Y266 PolarHBondContact O-N 2.91Å; Y266-L268 VanDerWaalsContact C-N 3.33Å; Y266-L268 PolarHBondContact O-N 3.12Å; Y266-Q269 PolarHBondContact O-N 3.34Å; Y266-N270 PolarHBondContact O-ND2 3Å |
| 267 | A | 71.3 | Confident | 63.5 | Low | 53 Ų | 53 | 105.7 Ų | 105.7 | 44% | 0.438 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -63.2 | -39.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | S263 S264 N270 | S263-A267 WeakPolarHBondContact O-CB 3.49Å; S263-A267 PolarHBondContact O-N 3.39Å; S263-A267 VanDerWaalsContact O-N 3.12Å; S264-A267 PolarHBondContact O-N 3.39Å; A267-N270 PolarHBondContact O-N 2.97Å |
| 268 | L | 68.7 | Low | 62.6 | Low | 111 Ų | 111 | 108 Ų | 108 | 58% | 0.581 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -67.5 | -33.2 | 177.3 | -70 | 170.4 | 0 | 0 | 0 | 112.9 | S264 L265 Y266 N270 L271 | S264-L268 WeakPolarHBondContact O-CG 3.44Å; S264-L268 PolarHBondContact O-N 3.42Å; L265-L268 HydrophobicContact CD2-CD1 4.47Å; L265-L268 PolarHBondContact O-N 3.33Å; Y266-L268 VanDerWaalsContact C-N 3.33Å; Y266-L268 PolarHBondContact O-N 3.12Å; L268-N270 VanDerWaalsContact C-N 3.28Å; L268-N270 PolarHBondContact O-N 3.18Å; L268-L271 PolarHBondContact O-N 3.12Å |
| 269 | Q | 64.3 | Low | 62 | Low | 65 Ų | 65 | 106.4 Ų | 106.4 | 30% | 0.304 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -66.6 | -28.9 | 178.5 | -168.8 | 167.7 | 20 | 0 | 0 | 113.1 | C259 L265 Y266 | C259-Q269 PolarHBondContact SG-OE1 3.26Å; L265-Q269 PolarHBondContact O-N 3.46Å; L265-Q269 VanDerWaalsContact O-N 3.12Å; Y266-Q269 PolarHBondContact O-N 3.34Å |
| 270 | N | 62.8 | Low | 61 | Low | 108 Ų | 108 | 114 Ų | 114 | 58% | 0.578 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -83.2 | -15.6 | 178.1 | -67.9 | -53.7 | 0 | 0 | 0 | 113.4 | Y266 A267 L268 Q272 | Y266-N270 PolarHBondContact O-ND2 3Å; A267-N270 PolarHBondContact O-N 2.97Å; L268-N270 VanDerWaalsContact C-N 3.28Å; L268-N270 PolarHBondContact O-N 3.18Å; N270-Q272 VanDerWaalsContact C-N 3.3Å; N270-Q272 PolarHBondContact O-N 3.19Å |
| 271 | L | 63.4 | Low | 60 | Low | 126 Ų | 126 | 117.3 Ų | 117.3 | 66% | 0.66 | 62% | 0.624 | S | S | * | * | trans | -89 | 71 | 172 | -63.4 | 169.2 | 0 | 0 | 0 | 108 | L268 P273 | L268-L271 PolarHBondContact O-N 3.12Å; L271-P273 WeakPolarHBondContact O-CD 3.4Å | ||
| 272 | Q | 54.3 | Low | 58.7 | Low | 111 Ų | 111 | 114.4 Ų | 114.4 | 52% | 0.519 | 62% | 0.623 | S | S | . | * | trans | -87.8 | 100.9 | 168.8 | -81.7 | -79.5 | -80.4 | 0 | 0 | 109 | N270 W274 S275 | N270-Q272 VanDerWaalsContact C-N 3.3Å; N270-Q272 PolarHBondContact O-N 3.19Å; Q272-W274 PolarHBondContact O-N 3.41Å; Q272-S275 VanDerWaalsContact CB-OG 3.31Å; Q272-S275 WeakPolarHBondContact CB-OG 3.04Å; Q272-S275 PolarHBondContact O-N 3.32Å; Q272-S275 PolarHBondContact O-OG 3.07Å | ||
| 273 | P | 51.3 | Low | 57.3 | Low | 100 Ų | 100 | 116.1 Ų | 116.1 | 65% | 0.649 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.2 | 1.5 | 177.5 | 25.9 | -32.3 | 0 | 0 | 0 | 114.1 | L271 | L271-P273 WeakPolarHBondContact O-CD 3.4Š|
| 274 | W | 52.1 | Low | 55.8 | Low | 227 Ų | 227 | 118.9 Ų | 118.9 | 86% | 0.86 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.3 | -4.7 | -178.3 | -41.1 | 75.4 | 0 | 0 | 0 | 112.7 | Q272 E276 | Q272-W274 PolarHBondContact O-N 3.41Å; W274-E276 PolarHBondContact O-N 3.34Å |
| 275 | S | 52.1 | Low | 54.2 | Low | 81 Ų | 81 | 121.4 Ų | 121.4 | 57% | 0.566 | 67% | 0.671 | S | S | * | * | trans | -97.5 | 45.7 | -179.2 | 66.2 | 0 | 0 | 0 | 0 | 112.2 | Q272 | Q272-S275 VanDerWaalsContact CB-OG 3.31Å; Q272-S275 WeakPolarHBondContact CB-OG 3.04Å; Q272-S275 PolarHBondContact O-N 3.32Å; Q272-S275 PolarHBondContact O-OG 3.07Å | ||
| 276 | E | 49.3 | Very low | 52.8 | Low | 168 Ų | 168 | 121.4 Ų | 121.4 | 79% | 0.785 | 68% | 0.683 | S | S | * | * | trans | -99.7 | 90.8 | 174.3 | -69.6 | -166.8 | 158.8 | 0 | 0 | 111.5 | W274 T278 | W274-E276 PolarHBondContact O-N 3.34Å; E276-T278 PolarHBondContact O-N 3.34Å | ||
| 277 | N | 48.5 | Very low | 51.1 | Low | 121 Ų | 121 | 121.8 Ų | 121.8 | 65% | 0.647 | 70% | 0.701 | S | S | * | * | 25.1 | 88.2 | 123.2 | -103.9 | -25.7 | 0 | 0 | 0 | 117.4 | A279 | N277-A279 PolarHBondContact O-N 3.25Š| |||
| 278 | T | 46.5 | Very low | 49.3 | Very low | 146 Ų | 146 | 131.7 Ų | 131.7 | 90% | 0.896 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | 0.7 | 165.2 | -65.2 | 0 | 0 | 0 | 0 | 114.3 | E276 | E276-T278 PolarHBondContact O-N 3.34Š|
| 279 | A | 46 | Very low | 48.4 | Very low | 84 Ų | 84 | 132.7 Ų | 132.7 | 69% | 0.694 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.2 | -1.3 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | N277 | N277-A279 PolarHBondContact O-N 3.25Š|
| 280 | K | 42.8 | Very low | 47.5 | Very low | 177 Ų | 177 | 136.3 Ų | 136.3 | 77% | 0.77 | 77% | 0.769 | S | S | * | * | trans | -138.3 | 60.2 | -176.5 | -59.7 | -168.1 | -175.8 | -174.5 | 0 | 113.4 | ||||
| 281 | I | 45.3 | Very low | 46.7 | Very low | 167 Ų | 167 | 137.8 Ų | 137.8 | 86% | 0.856 | 78% | 0.78 | S | S | * | * | trans | -129.6 | 63.4 | 160.3 | -34.9 | 174.1 | 0 | 0 | 0 | 108.2 | ||||
| 282 | S | 46 | Very low | 45.7 | Very low | 111 Ų | 111 | 138.5 Ų | 138.5 | 78% | 0.776 | 79% | 0.787 | S | S | * | * | trans | -122.2 | 140.2 | 157.6 | -161 | 0 | 0 | 0 | 0 | 106 | ||||
| 283 | S | 46.3 | Very low | 45.2 | Very low | 107 Ų | 107 | 140.3 Ų | 140.3 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | trans | 72.4 | 82.8 | -176 | 80.8 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 284 | V | 41.5 | Very low | 44.8 | Very low | 155 Ų | 155 | 142.9 Ų | 142.9 | 94% | 0.939 | 81% | 0.814 | S | S | * | * | -158.4 | 86.1 | 124.3 | -99.1 | 0 | 0 | 0 | 0 | 108.3 | |||||
| 285 | S | 43.2 | Very low | 44.2 | Very low | 131 Ų | 131 | 136.9 Ų | 136.9 | 92% | 0.916 | 81% | 0.811 | S | S | * | * | trans | -141.7 | 82.9 | 154.5 | -162.8 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 286 | A | 41.6 | Very low | 43.6 | Very low | 86 Ų | 86 | 141.2 Ų | 141.2 | 71% | 0.711 | 83% | 0.829 | S | S | * | * | trans | -158.8 | 141.1 | 165.4 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 287 | C | 37 | Very low | 43.2 | Very low | 122 Ų | 122 | 139 Ų | 139 | 82% | 0.824 | 83% | 0.833 | S | S | * | * | trans | 81.1 | 125.8 | -179.9 | -43.6 | 0 | 0 | 0 | 0 | 114 | ||||
| 288 | E | 33.5 | Very low | 42.7 | Very low | 261 Ų | 261 | 140.6 Ų | 140.6 | 100% | 1.22 | 85% | 0.85 | S | S | * | * | cis | -163.1 | 0 | -2.1 | -140.7 | 172.8 | 127.3 | 0 | 0 | 106.7 |
Retrieved 288 of 288 residues in 101.6 ms
(Link to these results)