| 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 | 45.3 | Very low | 51 | Low | 239 Ų | 239 | 142.8 Ų | 142.8 | 100% | 1.177 | 81% | 0.812 | S | S | * | * | 0 | 119.6 | 0 | -72.9 | 162.6 | 161 | 0 | 0 | 107.5 | |||||
| 2 | F | 43.8 | Very low | 52.4 | Low | 206 Ų | 206 | 135.4 Ų | 135.4 | 90% | 0.904 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -97.2 | 133.2 | 175.1 | -72.2 | -79.6 | 0 | 0 | 0 | 109.6 | ||
| 3 | P | 55.3 | Low | 53 | Low | 123 Ų | 123 | 133.2 Ų | 133.2 | 80% | 0.799 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 135.3 | 174.9 | 28.9 | -32.8 | 0 | 0 | 0 | 110.2 | ||
| 4 | S | 40.8 | Very low | 53.7 | Low | 111 Ų | 111 | 134.6 Ų | 134.6 | 78% | 0.776 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -74 | 140.4 | 174.2 | -67.3 | 0 | 0 | 0 | 0 | 110.7 | V6 | S4-V6 PolarHBondContact O-N 3.23Š|
| 5 | P | 51 | Low | 54.4 | Low | 125 Ų | 125 | 131.3 Ų | 131.3 | 81% | 0.812 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 132 | 175.9 | 27.3 | -33.5 | 0 | 0 | 0 | 110.8 | T7 | P5-T7 PolarHBondContact O-N 3.47Š|
| 6 | V | 53.8 | Low | 55.1 | Low | 131 Ų | 131 | 130.3 Ų | 130.3 | 79% | 0.794 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 123.5 | 172.4 | -85.3 | 0 | 0 | 0 | 0 | 110.2 | S4 T8 | S4-V6 PolarHBondContact O-N 3.23Å; V6-T8 PolarHBondContact O-N 3.29Å |
| 7 | T | 47.3 | Very low | 55.5 | Low | 128 Ų | 128 | 129.9 Ų | 129.9 | 79% | 0.785 | 72% | 0.724 | S | S | * | * | trans | -78 | 103 | 175.7 | -163.9 | 0 | 0 | 0 | 0 | 109.3 | P5 T9 | P5-T7 PolarHBondContact O-N 3.47Å; T7-T9 PolarHBondContact O-N 2.92Å | ||
| 8 | T | 52.5 | Low | 55.3 | Low | 123 Ų | 123 | 128.4 Ų | 128.4 | 76% | 0.755 | 71% | 0.714 | S | S | * | * | trans | -73.8 | 91.8 | 176.3 | 44 | 0 | 0 | 0 | 0 | 109.2 | V6 P10 | V6-T8 PolarHBondContact O-N 3.29Å; T8-P10 WeakPolarHBondContact O-CD 3Å | ||
| 9 | T | 57.4 | Low | 55 | Low | 102 Ų | 102 | 129.2 Ų | 129.2 | 63% | 0.626 | 72% | 0.716 | S | S | * | * | trans | -63.8 | 122.7 | 173.7 | 50.2 | 0 | 0 | 0 | 0 | 109.4 | T7 F11 | T7-T9 PolarHBondContact O-N 2.92Å; T9-F11 PolarHBondContact O-N 2.98Å | ||
| 10 | P | 65.5 | Low | 54.7 | Low | 124 Ų | 124 | 131.4 Ų | 131.4 | 81% | 0.805 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -79.1 | 29.4 | -172.6 | 34.8 | -39.2 | 0 | 0 | 0 | 113.4 | T8 | T8-P10 WeakPolarHBondContact O-CD 3Š|
| 11 | F | 47.7 | Very low | 54.5 | Low | 159 Ų | 159 | 131.9 Ų | 131.9 | 70% | 0.697 | 72% | 0.718 | S | S | * | * | trans | -138.8 | 112.9 | 174.4 | -92.8 | -89.4 | 0 | 0 | 0 | 107 | T9 | T9-F11 PolarHBondContact O-N 2.98Š| ||
| 12 | S | 68.1 | Low | 54.5 | Low | 54 Ų | 54 | 129.6 Ų | 129.6 | 38% | 0.378 | 70% | 0.704 | S | S | . | * | trans | -86.4 | 143.7 | 169.2 | -171.5 | 0 | 0 | 0 | 0 | 108.9 | K14 D15 | S12-K14 PolarHBondContact O-N 3.1Å; S12-K14 VanDerWaalsContact O-N 3.13Å; S12-K14 PolarHBondContact OG-N 2.92Å; S12-D15 WeakPolarHBondContact CA-OD2 3.44Å; S12-D15 VanDerWaalsContact CB-OD2 3.28Å; S12-D15 WeakPolarHBondContact CB-OD2 3.35Å; S12-D15 PolarHBondContact N-OD2 3.19Å; S12-D15 WeakPolarHBondContact O-CB 2.98Å; S12-D15 PolarHBondContact O-N 3.24Å | ||
| 13 | V | 61 | Low | 54.6 | Low | 106 Ų | 106 | 128.8 Ų | 128.8 | 64% | 0.642 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -58.9 | -26 | 172.1 | -178.9 | 0 | 0 | 0 | 0 | 110.9 | D15 I16 L17 | V13-D15 VanDerWaalsContact C-N 3.27Å; V13-D15 PolarHBondContact O-N 3.46Å; V13-I16 PolarHBondContact O-N 3.17Å; V13-L17 PolarHBondContact O-N 3.1Å |
| 14 | K | 62.1 | Low | 53.8 | Low | 153 Ų | 153 | 127.9 Ų | 127.9 | 67% | 0.665 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -61.6 | -31.9 | 174 | -58.7 | -176.4 | 179.5 | -174.9 | 0 | 113.1 | S12 I16 L17 N18 | S12-K14 PolarHBondContact O-N 3.1Å; S12-K14 VanDerWaalsContact O-N 3.13Å; S12-K14 PolarHBondContact OG-N 2.92Å; K14-I16 PolarHBondContact O-N 3.35Å; K14-L17 PolarHBondContact O-N 3.44Å; K14-N18 WeakPolarHBondContact O-CB 3.43Å; K14-N18 PolarHBondContact O-N 3.14Å |
| 15 | D | 64 | Low | 53.6 | Low | 85 Ų | 85 | 126 Ų | 126 | 46% | 0.455 | 70% | 0.699 | S | S | . | * | H | α-helix | trans | -71.3 | -24.2 | -178.4 | -50.8 | -33.7 | 0 | 0 | 0 | 111.9 | S12 V13 | S12-D15 WeakPolarHBondContact CA-OD2 3.44Å; S12-D15 VanDerWaalsContact CB-OD2 3.28Å; S12-D15 WeakPolarHBondContact CB-OD2 3.35Å; S12-D15 PolarHBondContact N-OD2 3.19Å; S12-D15 WeakPolarHBondContact O-CB 2.98Å; S12-D15 PolarHBondContact O-N 3.24Å; V13-D15 VanDerWaalsContact C-N 3.27Å; V13-D15 PolarHBondContact O-N 3.46Å |
| 16 | I | 66.6 | Low | 52.9 | Low | 115 Ų | 115 | 128.6 Ų | 128.6 | 59% | 0.59 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -79.1 | -44.9 | 176.8 | -56.7 | 172.3 | 0 | 0 | 0 | 109.9 | V13 K14 L19 | V13-I16 PolarHBondContact O-N 3.17Å; K14-I16 PolarHBondContact O-N 3.35Å; I16-L19 PolarHBondContact O-N 3.49Å |
| 17 | L | 60.9 | Low | 52.1 | Low | 124 Ų | 124 | 127.1 Ų | 127.1 | 65% | 0.649 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -72.2 | -35 | -177.2 | -63 | 173.9 | 0 | 0 | 0 | 112.8 | V13 K14 L19 | V13-L17 PolarHBondContact O-N 3.1Å; K14-L17 PolarHBondContact O-N 3.44Å; L17-L19 VanDerWaalsContact C-N 3.29Å; L17-L19 PolarHBondContact O-N 3.44Å |
| 18 | N | 51.7 | Low | 52.1 | Low | 103 Ų | 103 | 127 Ų | 127 | 55% | 0.551 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.1 | -17.4 | 178.3 | -76.3 | -11.9 | 0 | 0 | 0 | 113.8 | K14 E20 | K14-N18 WeakPolarHBondContact O-CB 3.43Å; K14-N18 PolarHBondContact O-N 3.14Å; N18-E20 VanDerWaalsContact C-N 3.31Å; N18-E20 PolarHBondContact O-N 3.49Å |
| 19 | L | 49.7 | Very low | 51.6 | Low | 144 Ų | 144 | 130.2 Ų | 130.2 | 75% | 0.754 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | -21.8 | -177.5 | -168.7 | 59.7 | 0 | 0 | 0 | 112.9 | I16 L17 | I16-L19 PolarHBondContact O-N 3.49Å; L17-L19 VanDerWaalsContact C-N 3.29Å; L17-L19 PolarHBondContact O-N 3.44Å |
| 20 | E | 49.6 | Very low | 50.8 | Low | 172 Ų | 172 | 132.8 Ų | 132.8 | 80% | 0.804 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -82.7 | -21 | -179.9 | -159 | 153.3 | 94.1 | 0 | 0 | 112.7 | N18 H22 | N18-E20 VanDerWaalsContact C-N 3.31Å; N18-E20 PolarHBondContact O-N 3.49Å; E20-H22 VanDerWaalsContact C-N 3.33Å; E20-H22 PolarHBondContact O-N 3.38Å |
| 21 | Q | 50.5 | Low | 49.4 | Very low | 143 Ų | 143 | 133.7 Ų | 133.7 | 67% | 0.668 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | -5.5 | -171.5 | -160.7 | 163 | 10.1 | 0 | 0 | 115 | ||
| 22 | H | 45.1 | Very low | 48.8 | Very low | 191 Ų | 191 | 130.9 Ų | 130.9 | 88% | 0.884 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.9 | 15.5 | 176.7 | -98.7 | -65.6 | 0 | 0 | 0 | 114.6 | E20 | E20-H22 VanDerWaalsContact C-N 3.33Å; E20-H22 PolarHBondContact O-N 3.38Å |
| 23 | Q | 45.8 | Very low | 47.6 | Very low | 188 Ų | 188 | 132.9 Ų | 132.9 | 88% | 0.879 | 74% | 0.738 | S | S | * | * | trans | -123.5 | 40.1 | 173.6 | -152.9 | 172.9 | 117.4 | 0 | 0 | 113.3 | ||||
| 24 | S | 38.1 | Very low | 46.4 | Very low | 105 Ų | 105 | 136.2 Ų | 136.2 | 73% | 0.734 | 75% | 0.751 | S | S | * | * | trans | -123.7 | 90.7 | 172.3 | 48.9 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 25 | G | 36.3 | Very low | 45.1 | Very low | 72 Ų | 72 | 133.8 Ų | 133.8 | 74% | 0.742 | 75% | 0.754 | S | S | * | * | trans | -139.7 | 11.3 | -171.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 26 | L | 36.4 | Very low | 44.4 | Very low | 179 Ų | 179 | 135.5 Ų | 135.5 | 94% | 0.937 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -143.8 | 133 | 164 | -73.2 | -179.4 | 0 | 0 | 0 | 109.3 | ||
| 27 | A | 37.7 | Very low | 43.7 | Very low | 99 Ų | 99 | 135.2 Ų | 135.2 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | trans | -90.5 | 168.8 | -174.7 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 28 | P | 47.2 | Very low | 43 | Very low | 127 Ų | 127 | 135.2 Ų | 135.2 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | trans | -98 | 164.8 | -155.5 | 38.1 | -36.2 | 0 | 0 | 0 | 114.6 | ||||
| 29 | M | 43.1 | Very low | 42.5 | Very low | 190 Ų | 190 | 136.2 Ų | 136.2 | 94% | 0.936 | 80% | 0.802 | S | S | * | * | trans | -132.3 | 114.1 | 153.9 | -162.4 | 170.3 | -172.1 | 0 | 0 | 110.1 | ||||
| 30 | E | 39.3 | Very low | 42.4 | Very low | 155 Ų | 155 | 137.2 Ų | 137.2 | 72% | 0.724 | 81% | 0.805 | S | S | * | * | trans | -64.1 | 140.9 | 167.2 | -92.2 | -83.9 | 141.9 | 0 | 0 | 110.9 | ||||
| 31 | L | 36.2 | Very low | 42.2 | Very low | 144 Ų | 144 | 136.9 Ų | 136.9 | 75% | 0.754 | 81% | 0.807 | S | S | * | * | 173.1 | 146.9 | 97.7 | -105.5 | 119.9 | 0 | 0 | 0 | 112.9 | |||||
| 32 | S | 36.1 | Very low | 41.6 | Very low | 100 Ų | 100 | 135.6 Ų | 135.6 | 70% | 0.699 | 81% | 0.814 | S | S | * | * | trans | 68.3 | 103.8 | 149.8 | -61.7 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 33 | A | 41.3 | Very low | 41.3 | Very low | 95 Ų | 95 | 132.5 Ų | 132.5 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | trans | -63.2 | 154.2 | 149.3 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 34 | L | 36.2 | Very low | 40.8 | Very low | 177 Ų | 177 | 131.5 Ų | 131.5 | 93% | 0.927 | 80% | 0.802 | S | S | * | * | trans | -174 | 153.5 | 134.6 | -102.5 | 169.4 | 0 | 0 | 0 | 112 | ||||
| 35 | S | 36 | Very low | 41 | Very low | 102 Ų | 102 | 136.1 Ų | 136.1 | 71% | 0.713 | 81% | 0.809 | S | S | * | * | trans | 70 | 89.9 | 160.1 | -153 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 36 | S | 49.2 | Very low | 41 | Very low | 120 Ų | 120 | 138.8 Ų | 138.8 | 84% | 0.839 | 80% | 0.802 | S | S | * | * | trans | -73.8 | 136.1 | 138.1 | -59.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 37 | P | 51.2 | Low | 40.7 | Very low | 110 Ų | 110 | 139.2 Ų | 139.2 | 71% | 0.714 | 80% | 0.799 | S | S | * | * | trans | -103.9 | 109.7 | 158.2 | 32.5 | -24.4 | 0 | 0 | 0 | 110.7 | ||||
| 38 | S | 47.2 | Very low | 40.5 | Very low | 123 Ų | 123 | 139.4 Ų | 139.4 | 86% | 0.86 | 79% | 0.791 | S | S | * | * | trans | -61.2 | 133.6 | 149.6 | -70.2 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 39 | C | 40.8 | Very low | 39.7 | Very low | 124 Ų | 124 | 144.2 Ų | 144.2 | 84% | 0.838 | 79% | 0.794 | S | S | * | * | trans | -131.7 | 140.5 | 158.5 | 55.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 40 | M | 47.4 | Very low | 39.3 | Very low | 166 Ų | 166 | 139.8 Ų | 139.8 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | trans | -95.7 | 155.1 | -167.4 | -66 | -112 | -71.5 | 0 | 0 | 111.5 | ||||
| 41 | L | 45.9 | Very low | 39 | Very low | 164 Ų | 164 | 137.2 Ų | 137.2 | 86% | 0.859 | 79% | 0.787 | S | S | * | * | trans | 36.3 | 115.6 | 140 | -158.8 | 74.7 | 0 | 0 | 0 | 118.3 | ||||
| 42 | S | 38.1 | Very low | 39 | Very low | 117 Ų | 117 | 138.9 Ų | 138.9 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | -129.3 | 97.7 | 167.2 | -57.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 43 | T | 36.8 | Very low | 40.2 | Very low | 125 Ų | 125 | 138.7 Ų | 138.7 | 77% | 0.767 | 79% | 0.787 | S | S | * | * | trans | 4.9 | 113.5 | 155.2 | 55.9 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 44 | F | 37.3 | Very low | 40.5 | Very low | 168 Ų | 168 | 140.4 Ų | 140.4 | 74% | 0.737 | 79% | 0.79 | S | S | * | * | 15.3 | 115.2 | 119.5 | -152.7 | -96.9 | 0 | 0 | 0 | 117.2 | Q46 | F44-Q46 HydrophobicContact CD1-CB 4.26Å; F44-Q46 HydrophobicContact CE1-CB 3.59Å; F44-Q46 HydrophobicContact CZ-CB 3.89Å | |||
| 45 | K | 41.7 | Very low | 40.2 | Very low | 202 Ų | 202 | 135.8 Ų | 135.8 | 88% | 0.878 | 79% | 0.786 | S | S | * | * | trans | -135.4 | 109.3 | 148.7 | -123.4 | -170.5 | 179.8 | -163.6 | 0 | 109.6 | ||||
| 46 | Q | 35.3 | Very low | 40.5 | Very low | 128 Ų | 128 | 137.9 Ų | 137.9 | 60% | 0.598 | 79% | 0.788 | S | S | * | * | trans | -102.8 | 120.8 | 173.8 | 178.3 | -175.1 | 15 | 0 | 0 | 106.4 | F44 | F44-Q46 HydrophobicContact CD1-CB 4.26Å; F44-Q46 HydrophobicContact CE1-CB 3.59Å; F44-Q46 HydrophobicContact CZ-CB 3.89Å | ||
| 47 | E | 30.6 | Very low | 40.4 | Very low | 187 Ų | 187 | 138 Ų | 138 | 87% | 0.874 | 79% | 0.785 | S | S | * | * | trans | -111.9 | 129 | 160.7 | -88.9 | -172 | 115.6 | 0 | 0 | 109 | ||||
| 48 | T | 33.8 | Very low | 39.7 | Very low | 104 Ų | 104 | 140.1 Ų | 140.1 | 64% | 0.638 | 79% | 0.786 | S | S | * | * | trans | -134.5 | 111.2 | -179 | -28.3 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 49 | Y | 30.8 | Very low | 39.3 | Very low | 227 Ų | 227 | 140 Ų | 140 | 89% | 0.89 | 78% | 0.775 | S | S | * | * | trans | -148.8 | 111.3 | 159.5 | -139.7 | -93.3 | 0 | 0 | 0 | 113 | ||||
| 50 | S | 33.3 | Very low | 39.2 | Very low | 98 Ų | 98 | 144 Ų | 144 | 69% | 0.685 | 77% | 0.773 | S | S | * | * | trans | -7 | 151 | 157.7 | -48.9 | 0 | 0 | 0 | 0 | 123 | ||||
| 51 | A | 34.4 | Very low | 38.8 | Very low | 101 Ų | 101 | 142.7 Ų | 142.7 | 84% | 0.835 | 77% | 0.769 | S | S | * | * | trans | 109.6 | 100.4 | 131.5 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 52 | E | 35.1 | Very low | 38.2 | Very low | 179 Ų | 179 | 143.1 Ų | 143.1 | 84% | 0.836 | 77% | 0.766 | S | S | * | * | trans | -82 | 176.5 | 145.4 | -91.5 | -106.1 | 114.3 | 0 | 0 | 110.4 | ||||
| 53 | P | 61.6 | Low | 38.2 | Very low | 96 Ų | 96 | 144.9 Ų | 144.9 | 62% | 0.623 | 77% | 0.766 | S | S | * | * | cis | -129.5 | -167.5 | -37.3 | 37.9 | -20 | 0 | 0 | 0 | 110.9 | ||||
| 54 | P | 48.3 | Very low | 38.8 | Very low | 131 Ų | 131 | 144 Ų | 144 | 85% | 0.851 | 76% | 0.762 | S | S | * | * | -155 | 168.6 | 86.2 | 40 | -20.9 | 0 | 0 | 0 | 117 | |||||
| 55 | G | 30.2 | Very low | 38.6 | Very low | 80 Ų | 80 | 144.1 Ų | 144.1 | 83% | 0.825 | 77% | 0.765 | S | S | * | * | trans | 126.7 | 98.5 | 142.9 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 56 | L | 41.1 | Very low | 38.2 | Very low | 146 Ų | 146 | 137.4 Ų | 137.4 | 76% | 0.764 | 75% | 0.748 | S | S | * | * | trans | -74.9 | 161.2 | 161.6 | -101.9 | 167.4 | 0 | 0 | 0 | 111.7 | E58 | L56-E58 HydrophobicContact CD2-CB 4.35Š| ||
| 57 | P | 46.6 | Very low | 38.7 | Very low | 121 Ų | 121 | 140.1 Ų | 140.1 | 79% | 0.786 | 76% | 0.76 | S | S | * | * | -137.9 | 154.6 | 72.1 | 31.8 | -12.2 | 0 | 0 | 0 | 114.2 | |||||
| 58 | E | 37.4 | Very low | 39.5 | Very low | 155 Ų | 155 | 136.6 Ų | 136.6 | 72% | 0.724 | 75% | 0.753 | S | S | * | * | cis | 87.2 | 125.4 | 36.6 | -166.2 | 168.6 | 155.4 | 0 | 0 | 115.7 | L56 | L56-E58 HydrophobicContact CD2-CB 4.35Š| ||
| 59 | L | 38.9 | Very low | 39.7 | Very low | 122 Ų | 122 | 136.8 Ų | 136.8 | 64% | 0.639 | 77% | 0.765 | S | S | * | * | trans | 141 | 103.9 | 159.9 | -77.4 | 166.4 | 0 | 0 | 0 | 109.9 | ||||
| 60 | R | 38.6 | Very low | 39.9 | Very low | 208 Ų | 208 | 135.7 Ų | 135.7 | 79% | 0.785 | 77% | 0.765 | S | S | * | * | 64 | 144.5 | 85.7 | 104.3 | 173.7 | 177.6 | -133.4 | -7 | 113.8 | |||||
| 61 | D | 38.2 | Very low | 40.1 | Very low | 138 Ų | 138 | 136.4 Ų | 136.4 | 74% | 0.738 | 77% | 0.77 | S | S | * | * | cis | -168.5 | 166.6 | -10.4 | -129.4 | -33.9 | 0 | 0 | 0 | 110.4 | ||||
| 62 | E | 34.2 | Very low | 40.2 | Very low | 172 Ų | 172 | 136.1 Ų | 136.1 | 80% | 0.804 | 77% | 0.768 | S | S | * | * | trans | 75.9 | 151.3 | 151.4 | -68.6 | -79.5 | 63.9 | 0 | 0 | 125.3 | ||||
| 63 | L | 37.6 | Very low | 40.7 | Very low | 155 Ų | 155 | 137.4 Ų | 137.4 | 81% | 0.812 | 77% | 0.771 | S | S | * | * | trans | -79.7 | -176.4 | -172.2 | -142 | 41.5 | 0 | 0 | 0 | 112.3 | ||||
| 64 | P | 50 | Low | 40 | Very low | 106 Ų | 106 | 138.9 Ų | 138.9 | 69% | 0.688 | 78% | 0.78 | S | S | * | * | cis | -141 | -154.2 | 12.1 | 42 | -16.9 | 0 | 0 | 0 | 115.1 | ||||
| 65 | E | 32.5 | Very low | 39.2 | Very low | 171 Ų | 171 | 138.3 Ų | 138.3 | 80% | 0.799 | 78% | 0.779 | S | S | * | * | cis | -158.7 | 168.1 | 7.4 | -145.9 | -164.1 | 127.3 | 0 | 0 | 114.1 | ||||
| 66 | A | 33.5 | Very low | 39.6 | Very low | 61 Ų | 61 | 139.6 Ų | 139.6 | 50% | 0.504 | 78% | 0.776 | S | S | . | * | trans | 47.2 | 118.5 | 141.1 | 0 | 0 | 0 | 0 | 0 | 126.3 | ||||
| 67 | H | 46.1 | Very low | 39.7 | Very low | 184 Ų | 184 | 142.1 Ų | 142.1 | 85% | 0.852 | 78% | 0.777 | S | S | * | * | 90.1 | 152.6 | 127.6 | -72.3 | -38.3 | 0 | 0 | 0 | 123.1 | |||||
| 68 | P | 47.5 | Very low | 39.4 | Very low | 114 Ų | 114 | 145.6 Ų | 145.6 | 74% | 0.74 | 78% | 0.776 | S | S | * | * | trans | -121.8 | 161.6 | -144.2 | 41.8 | -29.5 | 0 | 0 | 0 | 116.2 | ||||
| 69 | A | 36.9 | Very low | 39.3 | Very low | 107 Ų | 107 | 143.9 Ų | 143.9 | 88% | 0.884 | 78% | 0.775 | S | S | * | * | trans | -124.4 | 140.8 | 168.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 70 | K | 35.9 | Very low | 39.1 | Very low | 204 Ų | 204 | 147.4 Ų | 147.4 | 89% | 0.887 | 79% | 0.786 | S | S | * | * | trans | -106.9 | 138 | -176.6 | -54.6 | 164.5 | -178 | 170.8 | 0 | 110.2 | ||||
| 71 | S | 36.6 | Very low | 38.8 | Very low | 114 Ų | 114 | 142.3 Ų | 142.3 | 80% | 0.797 | 78% | 0.782 | S | S | * | * | trans | 176.1 | 113.6 | 144.6 | 47.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 72 | A | 38 | Very low | 38.6 | Very low | 95 Ų | 95 | 145.8 Ų | 145.8 | 79% | 0.785 | 79% | 0.786 | S | S | * | * | 89.7 | 80.8 | 65.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 73 | F | 45.8 | Very low | 39.3 | Very low | 205 Ų | 205 | 144.2 Ų | 144.2 | 90% | 0.899 | 79% | 0.788 | S | S | * | * | trans | -93.5 | 133.5 | 134.2 | -62.7 | -82.9 | 0 | 0 | 0 | 105.5 | ||||
| 74 | P | 46 | Very low | 39.4 | Very low | 127 Ų | 127 | 144.8 Ų | 144.8 | 83% | 0.825 | 79% | 0.786 | S | S | * | * | -145.1 | 156.7 | 66 | 38.4 | -20.6 | 0 | 0 | 0 | 116.2 | |||||
| 75 | S | 32.4 | Very low | 39.5 | Very low | 119 Ų | 119 | 148.2 Ų | 148.2 | 83% | 0.832 | 80% | 0.795 | S | S | * | * | trans | -159.6 | 137.1 | 168.6 | -171.3 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 76 | S | 38.2 | Very low | 39.8 | Very low | 108 Ų | 108 | 146.4 Ų | 146.4 | 76% | 0.755 | 79% | 0.791 | S | S | * | * | cis | -142.8 | 170.2 | -4.3 | 63.3 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 77 | Y | 41.9 | Very low | 39.9 | Very low | 198 Ų | 198 | 148.8 Ų | 148.8 | 78% | 0.776 | 80% | 0.804 | S | S | * | * | trans | -120.4 | 132.5 | 173 | 45.1 | -87.9 | 0 | 0 | 0 | 108.4 | ||||
| 78 | Y | 41.4 | Very low | 39.9 | Very low | 195 Ų | 195 | 144.4 Ų | 144.4 | 77% | 0.765 | 80% | 0.8 | S | S | * | * | trans | 166.1 | 117.7 | 150.8 | -113.3 | -97.3 | 0 | 0 | 0 | 106.3 | ||||
| 79 | V | 35.2 | Very low | 39.6 | Very low | 118 Ų | 118 | 148.7 Ų | 148.7 | 72% | 0.715 | 81% | 0.807 | S | S | * | * | 70 | 93.4 | 55.3 | -177.1 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 80 | K | 34.2 | Very low | 40 | Very low | 197 Ų | 197 | 150.3 Ų | 150.3 | 86% | 0.857 | 80% | 0.801 | S | S | * | * | trans | 172 | 152.1 | 149.5 | -100.6 | 165.5 | -179 | 178.1 | 0 | 107.6 | ||||
| 81 | S | 32.7 | Very low | 40.6 | Very low | 101 Ų | 101 | 146.1 Ų | 146.1 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | cis | -146.2 | 158.6 | -1.2 | -177 | 0 | 0 | 0 | 0 | 109.6 | V83 | S81-V83 PolarHBondContact O-N 3.49Š| ||
| 82 | Y | 34.3 | Very low | 40.9 | Very low | 211 Ų | 211 | 149.9 Ų | 149.9 | 83% | 0.827 | 80% | 0.799 | S | S | * | * | trans | -47.6 | 134.3 | 153.9 | -113.3 | -119.6 | 0 | 0 | 0 | 110.4 | ||||
| 83 | V | 48.1 | Very low | 41.4 | Very low | 139 Ų | 139 | 147.6 Ų | 147.6 | 84% | 0.842 | 78% | 0.78 | S | S | * | * | trans | -134.2 | 124.3 | 142 | -81.1 | 0 | 0 | 0 | 0 | 108.7 | S81 | S81-V83 PolarHBondContact O-N 3.49Š| ||
| 84 | E | 39.7 | Very low | 41.7 | Very low | 166 Ų | 166 | 143 Ų | 143 | 78% | 0.776 | 77% | 0.765 | S | S | * | * | trans | -70.2 | 135.1 | 174.9 | -174.2 | 173 | 162.1 | 0 | 0 | 109.5 | ||||
| 85 | M | 51.8 | Low | 42 | Very low | 178 Ų | 178 | 146.3 Ų | 146.3 | 88% | 0.877 | 77% | 0.766 | S | S | * | * | trans | -134.6 | 99 | 170.4 | -98 | -75.7 | 169.9 | 0 | 0 | 107.8 | ||||
| 86 | D | 39.4 | Very low | 42.9 | Very low | 133 Ų | 133 | 147.4 Ų | 147.4 | 71% | 0.711 | 76% | 0.756 | S | S | * | * | trans | -72 | 138.6 | 174.5 | -159.4 | -13 | 0 | 0 | 0 | 109.8 | ||||
| 87 | S | 36.6 | Very low | 43.6 | Very low | 112 Ų | 112 | 147.6 Ų | 147.6 | 78% | 0.783 | 75% | 0.745 | S | S | * | * | trans | -163.1 | 72.7 | 175.9 | -84.7 | 0 | 0 | 0 | 0 | 111.1 | K89 | S87-K89 PolarHBondContact O-N 3.21Š| ||
| 88 | A | 45.6 | Very low | 44.2 | Very low | 92 Ų | 92 | 144.3 Ų | 144.3 | 76% | 0.76 | 74% | 0.74 | S | S | * | * | trans | -63.4 | 112.5 | 159.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 89 | K | 41.4 | Very low | 44.6 | Very low | 203 Ų | 203 | 139.5 Ų | 139.5 | 88% | 0.883 | 73% | 0.734 | S | S | * | * | trans | -154.6 | 124.4 | 136.2 | -122.5 | 167.7 | -174.2 | 172.1 | 0 | 114 | S87 | S87-K89 PolarHBondContact O-N 3.21Š| ||
| 90 | D | 44.6 | Very low | 45.6 | Very low | 142 Ų | 142 | 137.3 Ų | 137.3 | 76% | 0.759 | 72% | 0.724 | S | S | * | * | trans | -66.7 | 141.6 | 175 | -151 | -36.4 | 0 | 0 | 0 | 111.4 | ||||
| 91 | S | 49.5 | Very low | 46.6 | Very low | 116 Ų | 116 | 132.8 Ų | 132.8 | 81% | 0.811 | 71% | 0.709 | S | S | * | * | trans | -178.2 | 50.1 | 169.4 | -79.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 92 | K | 42.3 | Very low | 47.8 | Very low | 193 Ų | 193 | 134.6 Ų | 134.6 | 84% | 0.839 | 71% | 0.706 | S | S | * | * | trans | -118.1 | 36.1 | -177 | -147.7 | 173.5 | -174.3 | 174.6 | 0 | 114.3 | ||||
| 93 | A | 48.4 | Very low | 48.8 | Very low | 46 Ų | 46 | 131.5 Ų | 131.5 | 38% | 0.38 | 70% | 0.697 | S | S | . | * | S | Bend | trans | -109.8 | -44.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | K95 K96 | A93-K95 PolarHBondContact O-N 2.83Å; A93-K96 WeakPolarHBondContact O-CE 3.46Å; A93-K96 WeakPolarHBondContact O-CG 3.4Å |
| 94 | D | 52.5 | Low | 48.9 | Very low | 110 Ų | 110 | 128.6 Ų | 128.6 | 59% | 0.588 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -94.5 | -1.2 | -151 | -52.9 | -74.5 | 0 | 0 | 0 | 117.8 | ||
| 95 | K | 51.8 | Low | 49.4 | Very low | 195 Ų | 195 | 126.9 Ų | 126.9 | 85% | 0.848 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -82.2 | -11.6 | 175.5 | -73.8 | -176 | 177.4 | 176.6 | 0 | 114.5 | A93 | A93-K95 PolarHBondContact O-N 2.83Å |
| 96 | K | 51.5 | Low | 49.3 | Very low | 142 Ų | 142 | 124.7 Ų | 124.7 | 62% | 0.617 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -90 | -35.3 | 177.3 | 38 | 177.6 | 174.8 | 174 | 0 | 112.1 | A93 S100 | A93-K96 WeakPolarHBondContact O-CE 3.46Å; A93-K96 WeakPolarHBondContact O-CG 3.4Å; K96-S100 PolarHBondContact O-N 3.33Å |
| 97 | E | 52.2 | Low | 49.6 | Very low | 112 Ų | 112 | 124.2 Ų | 124.2 | 52% | 0.523 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -64 | -48.5 | 176.1 | -72.6 | -59 | 130.6 | 0 | 0 | 112.5 | C99 S100 L101 | E97-C99 VanDerWaalsContact C-N 3.33Å; E97-C99 PolarHBondContact O-N 3.49Å; E97-S100 WeakPolarHBondContact O-CA 3.43Å; E97-S100 WeakPolarHBondContact O-CB 3.28Å; E97-S100 PolarHBondContact O-N 3.4Å; E97-L101 PolarHBondContact O-N 2.89Å |
| 98 | L | 55.1 | Low | 50 | Low | 129 Ų | 129 | 125.8 Ų | 125.8 | 68% | 0.675 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -59.3 | -38.1 | -179.7 | -83.6 | 163.7 | 0 | 0 | 0 | 113.6 | S100 H102 | L98-S100 VanDerWaalsContact C-N 3.34Å; L98-H102 PolarHBondContact O-N 3.47Å |
| 99 | C | 50.5 | Low | 50.1 | Low | 95 Ų | 95 | 130.3 Ų | 130.3 | 64% | 0.642 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -73.5 | -24.5 | 173.3 | -74.9 | 0 | 0 | 0 | 0 | 113.3 | E97 K103 | E97-C99 VanDerWaalsContact C-N 3.33Å; E97-C99 PolarHBondContact O-N 3.49Å; C99-K103 WeakPolarHBondContact O-CB 3.45Å; C99-K103 PolarHBondContact O-N 2.88Å |
| 100 | S | 55.4 | Low | 50.4 | Low | 72 Ų | 72 | 129.2 Ų | 129.2 | 50% | 0.503 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -75.2 | -45.1 | 176.2 | -151.2 | 0 | 0 | 0 | 0 | 111.1 | K96 E97 L98 K103 S104 | K96-S100 PolarHBondContact O-N 3.33Å; E97-S100 WeakPolarHBondContact O-CA 3.43Å; E97-S100 WeakPolarHBondContact O-CB 3.28Å; E97-S100 PolarHBondContact O-N 3.4Å; L98-S100 VanDerWaalsContact C-N 3.34Å; S100-K103 WeakPolarHBondContact O-CB 3.44Å; S100-K103 PolarHBondContact O-N 2.81Å; S100-K103 VanDerWaalsContact O-N 3.1Å; S100-S104 PolarHBondContact O-N 3.12Å |
| 101 | L | 54.7 | Low | 50.6 | Low | 101 Ų | 101 | 129.5 Ų | 129.5 | 53% | 0.529 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -60.9 | -46.1 | 176.1 | -92.1 | 157.4 | 0 | 0 | 0 | 112.8 | E97 K103 S104 L105 | E97-L101 PolarHBondContact O-N 2.89Å; L101-K103 PolarHBondContact O-N 3.01Å; L101-S104 PolarHBondContact O-N 3.41Å; L101-S104 VanDerWaalsContact O-N 3.14Å; L101-L105 PolarHBondContact O-N 3.04Å; L101-L105 VanDerWaalsContact O-N 3.17Å |
| 102 | H | 58.3 | Low | 51.1 | Low | 139 Ų | 139 | 131.7 Ų | 131.7 | 64% | 0.644 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -65.2 | -20 | 176.8 | -155.8 | -75.2 | 0 | 0 | 0 | 112.9 | L98 E106 | L98-H102 PolarHBondContact O-N 3.47Å; H102-E106 WeakPolarHBondContact O-CG 3.37Å |
| 103 | K | 55.1 | Low | 51.4 | Low | 146 Ų | 146 | 131.5 Ų | 131.5 | 64% | 0.635 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -86.6 | -30.3 | 174 | -166.5 | -174.2 | 175.2 | -160.4 | 0 | 113 | C99 S100 L101 Q107 | C99-K103 WeakPolarHBondContact O-CB 3.45Å; C99-K103 PolarHBondContact O-N 2.88Å; S100-K103 WeakPolarHBondContact O-CB 3.44Å; S100-K103 PolarHBondContact O-N 2.81Å; S100-K103 VanDerWaalsContact O-N 3.1Å; L101-K103 PolarHBondContact O-N 3.01Å; K103-Q107 PolarHBondContact O-N 2.97Å |
| 104 | S | 51.4 | Low | 51.7 | Low | 79 Ų | 79 | 134 Ų | 134 | 55% | 0.552 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -72.8 | -41.3 | 178.2 | -152.4 | 0 | 0 | 0 | 0 | 112 | S100 L101 E106 Q107 D108 | S100-S104 PolarHBondContact O-N 3.12Å; L101-S104 PolarHBondContact O-N 3.41Å; L101-S104 VanDerWaalsContact O-N 3.14Å; S104-E106 VanDerWaalsContact C-N 3.34Å; S104-E106 PolarHBondContact O-N 3.43Å; S104-Q107 PolarHBondContact O-N 3.38Å; S104-Q107 VanDerWaalsContact O-N 3.1Å; S104-D108 PolarHBondContact O-N 3.27Å |
| 105 | L | 50.2 | Low | 51.8 | Low | 130 Ų | 130 | 135.4 Ų | 135.4 | 68% | 0.681 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -66.9 | -31.7 | 178 | -77.8 | 165.2 | 0 | 0 | 0 | 113.4 | L101 Q107 | L101-L105 PolarHBondContact O-N 3.04Å; L101-L105 VanDerWaalsContact O-N 3.17Å; L105-Q107 VanDerWaalsContact C-N 3.28Å; L105-Q107 PolarHBondContact O-N 2.79Å |
| 106 | E | 48.1 | Very low | 51.7 | Low | 131 Ų | 131 | 134.2 Ų | 134.2 | 61% | 0.612 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -76.7 | -11.9 | 173.2 | -73.6 | -68.4 | 126.1 | 0 | 0 | 113.6 | H102 S104 | H102-E106 WeakPolarHBondContact O-CG 3.37Å; S104-E106 VanDerWaalsContact C-N 3.34Å; S104-E106 PolarHBondContact O-N 3.43Å |
| 107 | Q | 46.6 | Very low | 52 | Low | 124 Ų | 124 | 137.1 Ų | 137.1 | 58% | 0.579 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -92.5 | -34.1 | -179.5 | -169.1 | 160 | -44 | 0 | 0 | 112.7 | K103 S104 L105 K109 | K103-Q107 PolarHBondContact O-N 2.97Å; S104-Q107 PolarHBondContact O-N 3.38Å; S104-Q107 VanDerWaalsContact O-N 3.1Å; L105-Q107 VanDerWaalsContact C-N 3.28Å; L105-Q107 PolarHBondContact O-N 2.79Å; Q107-K109 PolarHBondContact O-N 2.97Å |
| 108 | D | 45.4 | Very low | 52.2 | Low | 144 Ų | 144 | 137.1 Ų | 137.1 | 77% | 0.77 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -78.7 | -15.6 | -175.4 | -150.6 | 12.8 | 0 | 0 | 0 | 113.8 | S104 R110 | S104-D108 PolarHBondContact O-N 3.27Å; D108-R110 PolarHBondContact O-N 3.37Å |
| 109 | K | 47.3 | Very low | 52.5 | Low | 187 Ų | 187 | 142.6 Ų | 142.6 | 81% | 0.813 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.8 | 21.5 | -176.1 | -144.1 | -174.5 | -176.5 | -174.4 | 0 | 114.9 | Q107 | Q107-K109 PolarHBondContact O-N 2.97Š|
| 110 | R | 47.9 | Very low | 53 | Low | 181 Ų | 181 | 146.9 Ų | 146.9 | 68% | 0.683 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.2 | 6.3 | -171.7 | -66.7 | -165.9 | -63.9 | 109 | 7.3 | 116.5 | D108 | D108-R110 PolarHBondContact O-N 3.37Š|
| 111 | D | 48.7 | Very low | 53.4 | Low | 148 Ų | 148 | 154.8 Ų | 154.8 | 79% | 0.791 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -108.5 | 13.6 | -178.9 | -80.6 | -52.9 | 0 | 0 | 0 | 114.6 | ||
| 112 | L | 59.3 | Low | 54 | Low | 162 Ų | 162 | 159.9 Ų | 159.9 | 85% | 0.848 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -133 | 117.2 | 168.2 | -72 | 169.9 | 0 | 0 | 0 | 110.3 | ||
| 113 | E | 48.7 | Very low | 54.9 | Low | 189 Ų | 189 | 165 Ų | 165 | 88% | 0.883 | 77% | 0.766 | S | S | * | * | S | Bend | trans | 123.5 | 127.5 | 166.5 | -67 | -79.7 | 113.4 | 0 | 0 | 114.5 | ||
| 114 | D | 54.4 | Low | 56.1 | Low | 99 Ų | 99 | 169.4 Ų | 169.4 | 53% | 0.529 | 78% | 0.778 | S | S | . | * | trans | 65.3 | 103.7 | 166.9 | -168.7 | 12.7 | 0 | 0 | 0 | 120 | E116 | D114-E116 PolarHBondContact OD1-N 3.13Š| ||
| 115 | P | 54.8 | Low | 57.4 | Low | 139 Ų | 139 | 174.9 Ų | 174.9 | 90% | 0.903 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -80.6 | -2.6 | 172.2 | 33.8 | -34.4 | 0 | 0 | 0 | 115.6 | ||
| 116 | E | 49.5 | Very low | 59 | Low | 170 Ų | 170 | 174.1 Ų | 174.1 | 79% | 0.794 | 80% | 0.795 | S | S | * | * | trans | -107.1 | 33.9 | -168.6 | -146.1 | -173.4 | 179.5 | 0 | 0 | 115.9 | D114 | D114-E116 PolarHBondContact OD1-N 3.13Š| ||
| 117 | R | 57.6 | Low | 61 | Low | 203 Ų | 203 | 179.3 Ų | 179.3 | 77% | 0.766 | 81% | 0.809 | S | S | * | * | trans | -104.8 | 112.4 | 170.2 | -158.4 | 163.3 | -74 | -157.1 | -2.3 | 112.6 | R119 | R117-R119 PolarHBondContact O-N 3.46Å; R117-R119 VanDerWaalsContact O-N 3.12Å | ||
| 118 | P | 57.3 | Low | 63.1 | Low | 111 Ų | 111 | 179.4 Ų | 179.4 | 72% | 0.721 | 82% | 0.818 | S | S | * | * | trans | -56.1 | 119.7 | 179 | -26.4 | 34.4 | 0 | 0 | 0 | 111.6 | Q120 | P118-Q120 PolarHBondContact O-N 2.87Š| ||
| 119 | R | 60.8 | Low | 65.5 | Low | 245 Ų | 245 | 179.8 Ų | 179.8 | 93% | 0.925 | 82% | 0.819 | S | S | * | * | trans | -57.1 | 99.8 | -177.9 | -63.8 | -174.7 | -175.2 | -152.4 | -0.8 | 110 | R117 R121 | R117-R119 PolarHBondContact O-N 3.46Å; R117-R119 VanDerWaalsContact O-N 3.12Å; R119-R121 PolarHBondContact O-N 3.2Å | ||
| 120 | Q | 61.7 | Low | 67.9 | Low | 185 Ų | 185 | 173.8 Ų | 173.8 | 86% | 0.864 | 79% | 0.793 | S | S | * | * | trans | -55.5 | 111.9 | -177.5 | -73.6 | -176.7 | -10.9 | 0 | 0 | 109.6 | P118 K122 | P118-Q120 PolarHBondContact O-N 2.87Å; Q120-K122 PolarHBondContact O-N 3.09Å | ||
| 121 | R | 63.4 | Low | 70.3 | Confident | 238 Ų | 238 | 167.9 Ų | 167.9 | 90% | 0.898 | 78% | 0.78 | S | S | * | * | trans | -57.5 | 113.9 | -179.6 | -69.6 | -179.7 | 175.9 | 179.6 | -1.1 | 108.3 | R119 R123 | R119-R121 PolarHBondContact O-N 3.2Å; R121-R123 PolarHBondContact O-N 3.45Å | ||
| 122 | K | 67.9 | Low | 72.7 | Confident | 208 Ų | 208 | 168.3 Ų | 168.3 | 90% | 0.904 | 78% | 0.777 | S | S | * | * | trans | -45.3 | 105.3 | -176.6 | -64.8 | 179.7 | -179.7 | 179 | 0 | 109.9 | Q120 R124 | Q120-K122 PolarHBondContact O-N 3.09Å; K122-R124 PolarHBondContact O-N 3.46Å | ||
| 123 | R | 76 | Confident | 74.5 | Confident | 245 Ų | 245 | 164 Ų | 164 | 93% | 0.925 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 131.4 | -176.8 | -83.5 | -178.3 | 160.3 | -166.9 | -5.4 | 109.1 | R121 | R121-R123 PolarHBondContact O-N 3.45Š|
| 124 | R | 81.8 | Confident | 76.9 | Confident | 239 Ų | 239 | 156.8 Ų | 156.8 | 90% | 0.902 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 141.3 | 175.9 | -73.4 | -179.1 | 166.5 | -172.5 | -5 | 108.8 | K122 | K122-R124 PolarHBondContact O-N 3.46Š|
| 125 | K | 78.1 | Confident | 79 | Confident | 194 Ų | 194 | 153.6 Ų | 153.6 | 84% | 0.843 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 135.6 | 176.1 | -80.3 | 92 | 172.8 | -168.7 | 0 | 109.5 | ||
| 126 | P | 84.1 | Confident | 81.1 | Confident | 115 Ų | 115 | 153.9 Ų | 153.9 | 75% | 0.747 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 147.8 | 175.5 | 25.9 | -33.6 | 0 | 0 | 0 | 110.5 | V128 | P126-V128 PolarHBondContact O-N 3.2Š|
| 127 | R | 90.4 | Very high | 83.4 | Confident | 240 Ų | 240 | 147.7 Ų | 147.7 | 91% | 0.906 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 124.7 | 174.8 | -70.4 | 179.7 | 174.9 | 168.9 | -2.6 | 108.8 | ||
| 128 | V | 90.8 | Very high | 85.3 | Confident | 125 Ų | 125 | 138 Ų | 138 | 76% | 0.758 | 63% | 0.634 | S | S | * | * | P | Polyproline II helix | trans | -84.4 | 131.5 | 171.9 | -178 | 0 | 0 | 0 | 0 | 108.8 | P126 | P126-V128 PolarHBondContact O-N 3.2Š|
| 129 | L | 94.9 | Very high | 87.3 | Confident | 153 Ų | 153 | 135.6 Ų | 135.6 | 80% | 0.801 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -97.8 | 151.2 | 172.7 | -61.9 | 178.7 | 0 | 0 | 0 | 109.8 | ||
| 130 | F | 97.8 | Very high | 89.1 | Confident | 60 Ų | 60 | 129.4 Ų | 129.4 | 26% | 0.263 | 59% | 0.589 | S | S | . | * | P | Polyproline II helix | trans | -80.3 | 148.1 | 171.3 | -56.8 | -42 | 0 | 0 | 0 | 110.4 | Q134 V135 L138 L162 Q166 W170 | F130-Q134 HydrophobicContact CB-CB 4.24Å; F130-V135 HydrophobicContact CB-CG2 4Å; F130-L138 HydrophobicContact CD2-CD1 4.44Å; F130-L162 HydrophobicContact CD1-CD1 4.28Å; F130-L162 HydrophobicContact CD1-CD2 3.72Å; F130-L162 HydrophobicContact CE1-CD1 4.25Å; F130-L162 HydrophobicContact CE1-CD2 3.68Å; F130-Q166 HydrophobicContact CE1-CB 4.26Å; F130-Q166 HydrophobicContact CE1-CG 4.23Å; F130-Q166 HydrophobicContact CZ-CB 3.91Å; F130-Q166 HydrophobicContact CZ-CG 4.12Å; F130-W170 AromaticContact CD2-CD1 3.8Å; F130-W170 HydrophobicContact CE2-CB 4.28Å; F130-W170 AromaticContact CE2-CD1 3.74Å; F130-W170 HydrophobicContact CE2-CG 4.36Å |
| 131 | S | 98.3 | Very high | 90.9 | Very high | 58 Ų | 58 | 125.4 Ų | 125.4 | 41% | 0.406 | 57% | 0.567 | S | S | . | * | P | Polyproline II helix | trans | -70 | 158 | 175.1 | 73 | 0 | 0 | 0 | 0 | 111.4 | A133 Q134 V135 | S131-A133 VanDerWaalsContact C-N 3.25Å; S131-A133 PolarHBondContact O-N 3.03Å; S131-Q134 WeakPolarHBondContact O-CB 3.34Å; S131-Q134 PolarHBondContact O-N 3.09Å; S131-Q134 VanDerWaalsContact O-N 3.09Å; S131-Q134 WeakPolarHBondContact OG-CG 3.46Å; S131-Q134 PolarHBondContact OG-N 3.37Å; S131-Q134 PolarHBondContact OG-OE1 3.05Å; S131-V135 WeakPolarHBondContact O-CG2 3.45Å; S131-V135 PolarHBondContact O-N 3.41Å |
| 132 | Q | 98.2 | Very high | 92.5 | Very high | 156 Ų | 156 | 114.8 Ų | 114.8 | 73% | 0.729 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -60.3 | -35.6 | -179.3 | -171.9 | 62.5 | 8.4 | 0 | 0 | 112.5 | V135 Y136 | Q132-V135 PolarHBondContact O-N 3.27Å; Q132-Y136 WeakPolarHBondContact O-CB 3.5Å; Q132-Y136 PolarHBondContact O-N 3.01Å |
| 133 | A | 98.1 | Very high | 94 | Very high | 72 Ų | 72 | 112.2 Ų | 112.2 | 60% | 0.595 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.9 | -41.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | S131 Y136 E137 | S131-A133 VanDerWaalsContact C-N 3.25Å; S131-A133 PolarHBondContact O-N 3.03Å; A133-Y136 PolarHBondContact O-N 3.37Å; A133-E137 PolarHBondContact O-N 3.45Å; A133-E137 VanDerWaalsContact O-N 3.17Å |
| 134 | Q | 98.6 | Very high | 95 | Very high | 38 Ų | 38 | 106.1 Ų | 106.1 | 18% | 0.178 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -63.2 | -44.8 | 173.8 | -71.8 | 169.2 | -32.3 | 0 | 0 | 111.1 | F130 S131 Y136 L138 L160 | F130-Q134 HydrophobicContact CB-CB 4.24Å; S131-Q134 WeakPolarHBondContact O-CB 3.34Å; S131-Q134 PolarHBondContact O-N 3.09Å; S131-Q134 VanDerWaalsContact O-N 3.09Å; S131-Q134 WeakPolarHBondContact OG-CG 3.46Å; S131-Q134 PolarHBondContact OG-N 3.37Å; S131-Q134 PolarHBondContact OG-OE1 3.05Å; Q134-Y136 PolarHBondContact O-N 3.17Å; Q134-L138 WeakPolarHBondContact O-CB 3.34Å; Q134-L138 WeakPolarHBondContact O-CD1 3.48Å; Q134-L138 WeakPolarHBondContact O-CG 3.39Å; Q134-L138 PolarHBondContact O-N 2.86Å; Q134-L160 HydrophobicContact CG-CB 4.42Å; Q134-L160 PolarHBondContact NE2-O 2.94Å |
| 135 | V | 98.5 | Very high | 95.8 | Very high | 32 Ų | 32 | 98.6 Ų | 98.6 | 19% | 0.194 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -62.3 | -42.5 | 177.1 | 176.5 | 0 | 0 | 0 | 0 | 111.3 | F130 S131 Q132 L138 E139 | F130-V135 HydrophobicContact CB-CG2 4Å; S131-V135 WeakPolarHBondContact O-CG2 3.45Å; S131-V135 PolarHBondContact O-N 3.41Å; Q132-V135 PolarHBondContact O-N 3.27Å; V135-L138 PolarHBondContact O-N 2.79Å; V135-E139 HydrophobicContact CG1-CG 4.39Å; V135-E139 WeakPolarHBondContact O-CB 3.46Å; V135-E139 WeakPolarHBondContact O-CG 3.48Å; V135-E139 PolarHBondContact O-N 3.34Å |
| 136 | Y | 98.5 | Very high | 96.7 | Very high | 144 Ų | 144 | 93.7 Ų | 93.7 | 57% | 0.565 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -58.5 | -50.5 | 178.1 | 173.9 | -91.7 | 0 | 0 | 0 | 112.4 | Q132 A133 Q134 E139 R140 | Q132-Y136 WeakPolarHBondContact O-CB 3.5Å; Q132-Y136 PolarHBondContact O-N 3.01Å; A133-Y136 PolarHBondContact O-N 3.37Å; Q134-Y136 PolarHBondContact O-N 3.17Å; Y136-E139 PolarHBondContact O-N 2.96Å; Y136-R140 WeakPolarHBondContact O-CB 3.19Å; Y136-R140 PolarHBondContact O-N 3.4Å |
| 137 | E | 98.6 | Very high | 97.4 | Very high | 40 Ų | 40 | 95.6 Ų | 95.6 | 19% | 0.187 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -68.8 | -35.6 | 179.4 | -82.9 | -61.1 | 136.6 | 0 | 0 | 112.8 | A133 E139 R140 R141 L160 | A133-E137 PolarHBondContact O-N 3.45Å; A133-E137 VanDerWaalsContact O-N 3.17Å; E137-E139 VanDerWaalsContact C-N 3.34Å; E137-E139 PolarHBondContact O-N 3.48Å; E137-R140 PolarHBondContact O-N 3.44Å; E137-R140 WeakPolarHBondContact OE1-CD 3.39Å; E137-R140 IonicContact OE1-CZ 3.69Å; E137-R140 IonicContact OE1-NE 3.87Å; E137-R140 IonicContact OE1-NH1 2.74Å; E137-R140 PolarHBondContact OE1-NH1 3.24Å; E137-R140 WeakPolarHBondContact OE2-CD 3.17Å; E137-R140 IonicContact OE2-NH1 3.51Å; E137-R141 WeakPolarHBondContact O-CB 3.39Å; E137-R141 WeakPolarHBondContact O-CG 3.38Å; E137-R141 PolarHBondContact O-N 3.39Å; E137-L160 HydrophobicContact CB-CD1 4.22Å; E137-L160 HydrophobicContact CB-CD2 3.62Å; E137-L160 HydrophobicContact CG-CD2 4.12Å |
| 138 | L | 98.7 | Very high | 97.8 | Very high | 0 Ų | 0 | 85.5 Ų | 85.5 | 0% | 0 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -60.1 | -43.5 | 170.7 | -72.3 | 166.3 | 0 | 0 | 0 | 111.3 | F130 Q134 V135 F142 L156 L160 L162 V167 W170 F171 | F130-L138 HydrophobicContact CD2-CD1 4.44Å; Q134-L138 WeakPolarHBondContact O-CB 3.34Å; Q134-L138 WeakPolarHBondContact O-CD1 3.48Å; Q134-L138 WeakPolarHBondContact O-CG 3.39Å; Q134-L138 PolarHBondContact O-N 2.86Å; V135-L138 PolarHBondContact O-N 2.79Å; L138-F142 VanDerWaalsContact O-CB 3.23Å; L138-F142 WeakPolarHBondContact O-CB 3.38Å; L138-F142 PolarHBondContact O-N 3Å; L138-L156 HydrophobicContact CD2-CD2 4.11Å; L138-L160 HydrophobicContact CD1-CD1 4.49Å; L138-L160 HydrophobicContact CD2-CD1 3.85Å; L138-L160 HydrophobicContact CG-CD1 3.69Å; L138-L162 HydrophobicContact CD1-CD1 4.18Å; L138-V167 HydrophobicContact CD2-CG1 4.33Å; L138-V167 HydrophobicContact CD2-CG2 4.48Å; L138-W170 HydrophobicContact CB-CD2 3.9Å; L138-W170 HydrophobicContact CB-CE3 3.86Å; L138-W170 HydrophobicContact CB-CH2 3.72Å; L138-W170 HydrophobicContact CB-CZ2 3.71Å; L138-W170 HydrophobicContact CB-CZ3 3.79Å; L138-W170 HydrophobicContact CD1-CD2 3.9Å; L138-W170 HydrophobicContact CD1-CG 3.86Å; L138-W170 HydrophobicContact CD2-CD2 4.38Å; L138-W170 HydrophobicContact CD2-CE3 4.24Å; L138-W170 HydrophobicContact CG-CD2 4.28Å; L138-W170 HydrophobicContact CG-CE3 4.43Å; L138-F171 HydrophobicContact CD2-CD2 4.44Å; L138-F171 HydrophobicContact CD2-CE2 3.93Å |
| 139 | E | 98.5 | Very high | 98.1 | Very high | 60 Ų | 60 | 81.7 Ų | 81.7 | 28% | 0.28 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -68.5 | -39.6 | 175.2 | -73.4 | -161.1 | 156.4 | 0 | 0 | 112.9 | V135 Y136 E137 F142 K143 W170 R174 | V135-E139 HydrophobicContact CG1-CG 4.39Å; V135-E139 WeakPolarHBondContact O-CB 3.46Å; V135-E139 WeakPolarHBondContact O-CG 3.48Å; V135-E139 PolarHBondContact O-N 3.34Å; Y136-E139 PolarHBondContact O-N 2.96Å; E137-E139 VanDerWaalsContact C-N 3.34Å; E137-E139 PolarHBondContact O-N 3.48Å; E139-F142 PolarHBondContact O-N 3.33Å; E139-K143 WeakPolarHBondContact O-CG 3.49Å; E139-K143 PolarHBondContact O-N 3.02Å; E139-W170 HydrophobicContact CB-CH2 4.43Å; E139-W170 HydrophobicContact CG-CH2 3.75Å; E139-W170 HydrophobicContact CG-CZ2 3.74Å; E139-R174 IonicContact OE1-CZ 3.27Å; E139-R174 VanDerWaalsContact OE1-CZ 3.27Å; E139-R174 IonicContact OE1-NH1 2.61Å; E139-R174 PolarHBondContact OE1-NH1 3.18Å; E139-R174 IonicContact OE1-NH2 3.45Å; E139-R174 PolarHBondContact OE1-NH2 3.33Å |
| 140 | R | 98.6 | Very high | 98.3 | Very high | 115 Ų | 115 | 76.8 Ų | 76.8 | 43% | 0.434 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -58.7 | -49.2 | 175.3 | -175.8 | -174 | 178.8 | -166.3 | 1.2 | 110.9 | Y136 E137 K143 Q144 | Y136-R140 WeakPolarHBondContact O-CB 3.19Å; Y136-R140 PolarHBondContact O-N 3.4Å; E137-R140 PolarHBondContact O-N 3.44Å; E137-R140 WeakPolarHBondContact OE1-CD 3.39Å; E137-R140 IonicContact OE1-CZ 3.69Å; E137-R140 IonicContact OE1-NE 3.87Å; E137-R140 IonicContact OE1-NH1 2.74Å; E137-R140 PolarHBondContact OE1-NH1 3.24Å; E137-R140 WeakPolarHBondContact OE2-CD 3.17Å; E137-R140 IonicContact OE2-NH1 3.51Å; R140-K143 WeakPolarHBondContact O-CB 3.39Å; R140-K143 PolarHBondContact O-N 2.74Å; R140-Q144 PolarHBondContact O-N 2.81Å |
| 141 | R | 98.4 | Very high | 98.3 | Very high | 102 Ų | 102 | 78.2 Ų | 78.2 | 39% | 0.385 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -67 | -39.1 | 175.8 | -69.6 | -71.7 | 158.9 | -174.5 | 9.1 | 112.1 | E137 K143 Q144 Q145 L156 F171 | E137-R141 WeakPolarHBondContact O-CB 3.39Å; E137-R141 WeakPolarHBondContact O-CG 3.38Å; E137-R141 PolarHBondContact O-N 3.39Å; R141-K143 VanDerWaalsContact C-N 3.29Å; R141-K143 PolarHBondContact O-N 3.44Å; R141-Q144 WeakPolarHBondContact O-CB 3.49Å; R141-Q144 PolarHBondContact O-N 2.84Å; R141-Q145 PolarHBondContact O-N 2.92Å; R141-L156 HydrophobicContact CB-CD2 4.13Å; R141-L156 HydrophobicContact CG-CD1 4.02Å; R141-L156 HydrophobicContact CG-CD2 4.18Å; R141-F171 HydrophobicContact CB-CZ 4.28Å |
| 142 | F | 98.6 | Very high | 98.3 | Very high | 14 Ų | 14 | 78.8 Ų | 78.8 | 6% | 0.061 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -64 | -30.4 | 174.3 | -174.8 | -97.6 | 0 | 0 | 0 | 113.6 | L138 E139 Q145 K146 W170 F171 R174 R175 | L138-F142 VanDerWaalsContact O-CB 3.23Å; L138-F142 WeakPolarHBondContact O-CB 3.38Å; L138-F142 PolarHBondContact O-N 3Å; E139-F142 PolarHBondContact O-N 3.33Å; F142-Q145 WeakPolarHBondContact CA-O 3.1Å; F142-K146 HydrophobicContact CD1-CD 4.23Å; F142-K146 HydrophobicContact CD2-CD 4.38Å; F142-K146 HydrophobicContact CE1-CD 3.73Å; F142-K146 HydrophobicContact CE2-CB 4.18Å; F142-K146 HydrophobicContact CE2-CD 3.9Å; F142-K146 HydrophobicContact CZ-CB 4.49Å; F142-K146 HydrophobicContact CZ-CD 3.55Å; F142-K146 WeakPolarHBondContact O-CD 3.43Å; F142-K146 PolarHBondContact O-NZ 3.04Å; F142-W170 HydrophobicContact CB-CH2 4.22Å; F142-W170 HydrophobicContact CB-CZ3 3.96Å; F142-W170 HydrophobicContact CD2-CZ3 4.48Å; F142-W170 HydrophobicContact CG-CZ3 4.34Å; F142-F171 HydrophobicContact CB-CE1 4.12Å; F142-F171 HydrophobicContact CB-CZ 4.25Å; F142-F171 AromaticContact CD2-CD1 3.82Å; F142-F171 HydrophobicContact CD2-CD1 3.82Å; F142-F171 AromaticContact CD2-CE1 3.83Å; F142-F171 HydrophobicContact CD2-CE1 3.83Å; F142-F171 HydrophobicContact CG-CE1 4.5Å; F142-R174 HydrophobicContact CD1-CG 3.56Å; F142-R174 HydrophobicContact CD2-CB 4.25Å; F142-R174 HydrophobicContact CD2-CG 3.8Å; F142-R174 HydrophobicContact CE1-CG 3.49Å; F142-R174 VanDerWaalsContact CE1-CG 3.49Å; F142-R174 HydrophobicContact CE2-CB 4.1Å; F142-R174 HydrophobicContact CE2-CG 3.73Å; F142-R174 HydrophobicContact CG-CG 3.71Å; F142-R174 HydrophobicContact CZ-CB 4.29Å; F142-R174 HydrophobicContact CZ-CG 3.57Å; F142-R175 HydrophobicContact CE2-CG 3.82Å; F142-R175 HydrophobicContact CZ-CG 4.19Å |
| 143 | K | 98 | Very high | 98.3 | Very high | 154 Ų | 154 | 74.4 Ų | 74.4 | 67% | 0.67 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -61.7 | -45.7 | 173.1 | -77.1 | 172.5 | -176.6 | 179.9 | 0 | 110.6 | E139 R140 R141 K146 | E139-K143 WeakPolarHBondContact O-CG 3.49Å; E139-K143 PolarHBondContact O-N 3.02Å; R140-K143 WeakPolarHBondContact O-CB 3.39Å; R140-K143 PolarHBondContact O-N 2.74Å; R141-K143 VanDerWaalsContact C-N 3.29Å; R141-K143 PolarHBondContact O-N 3.44Å; K143-K146 PolarHBondContact O-NZ 3.4Å; K143-K146 VanDerWaalsContact O-NZ 3.09Å |
| 144 | Q | 98 | Very high | 98.4 | Very high | 117 Ų | 117 | 74.2 Ų | 74.2 | 55% | 0.547 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -68 | -47.9 | 178.2 | -62.5 | 168.4 | -13.8 | 0 | 0 | 112.6 | R140 R141 | R140-Q144 PolarHBondContact O-N 2.81Å; R141-Q144 WeakPolarHBondContact O-CB 3.49Å; R141-Q144 PolarHBondContact O-N 2.84Å |
| 145 | Q | 97.9 | Very high | 98.4 | Very high | 82 Ų | 82 | 78.6 Ų | 78.6 | 38% | 0.383 | 37% | 0.367 | S | S | . | . | trans | -143 | 122.1 | -171.1 | -168.2 | 179.7 | -19.5 | 0 | 0 | 111 | R141 F142 Y147 L148 E152 | R141-Q145 PolarHBondContact O-N 2.92Å; F142-Q145 WeakPolarHBondContact CA-O 3.1Å; Q145-Y147 WeakPolarHBondContact CG-O 3.3Å; Q145-Y147 PolarHBondContact NE2-O 3.39Å; Q145-L148 HydrophobicContact CB-CD2 4.24Å; Q145-L148 HydrophobicContact CG-CD2 4.23Å; Q145-E152 PolarHBondContact NE2-OE2 2.54Å | ||
| 146 | K | 97.8 | Very high | 98.4 | Very high | 91 Ų | 91 | 77.6 Ų | 77.6 | 40% | 0.396 | 36% | 0.36 | S | S | . | . | S | Bend | trans | -79.4 | -20.3 | -175.2 | -51 | -60.3 | 167 | -150.9 | 0 | 113.8 | F142 K143 R175 | F142-K146 HydrophobicContact CD1-CD 4.23Å; F142-K146 HydrophobicContact CD2-CD 4.38Å; F142-K146 HydrophobicContact CE1-CD 3.73Å; F142-K146 HydrophobicContact CE2-CB 4.18Å; F142-K146 HydrophobicContact CE2-CD 3.9Å; F142-K146 HydrophobicContact CZ-CB 4.49Å; F142-K146 HydrophobicContact CZ-CD 3.55Å; F142-K146 WeakPolarHBondContact O-CD 3.43Å; F142-K146 PolarHBondContact O-NZ 3.04Å; K143-K146 PolarHBondContact O-NZ 3.4Å; K143-K146 VanDerWaalsContact O-NZ 3.09Å; K146-R175 WeakPolarHBondContact O-CD 3.14Å |
| 147 | Y | 98.3 | Very high | 98.4 | Very high | 154 Ų | 154 | 70.9 Ų | 70.9 | 60% | 0.604 | 33% | 0.334 | S | S | * | . | S | Bend | trans | -136.4 | 114.6 | -175.3 | -64 | -97 | 0 | 0 | 0 | 108.6 | Q145 R175 | Q145-Y147 WeakPolarHBondContact CG-O 3.3Å; Q145-Y147 PolarHBondContact NE2-O 3.39Å; Y147-R175 VanDerWaalsContact CE1-CD 3.44Å; Y147-R175 VanDerWaalsContact CZ-CD 3.44Å |
| 148 | L | 98.3 | Very high | 98.4 | Very high | 29 Ų | 29 | 74.4 Ų | 74.4 | 15% | 0.152 | 35% | 0.354 | C | S | . | . | trans | -92.6 | 142.8 | 176.8 | -61.4 | -179.4 | 0 | 0 | 0 | 111.2 | Q145 E152 R153 L156 V167 F171 | Q145-L148 HydrophobicContact CB-CD2 4.24Å; Q145-L148 HydrophobicContact CG-CD2 4.23Å; L148-E152 VanDerWaalsContact CA-OE2 3.27Å; L148-E152 WeakPolarHBondContact CA-OE2 3.5Å; L148-E152 HydrophobicContact CB-CB 4.11Å; L148-E152 HydrophobicContact CD2-CB 4.3Å; L148-R153 HydrophobicContact CB-CG 3.53Å; L148-R153 HydrophobicContact CD1-CG 4Å; L148-R153 HydrophobicContact CG-CG 4.42Å; L148-L156 HydrophobicContact CD1-CD2 3.75Å; L148-V167 HydrophobicContact CD1-CG1 4.28Å; L148-F171 HydrophobicContact CD1-CD1 4.34Å; L148-F171 HydrophobicContact CD1-CD2 4.23Å; L148-F171 HydrophobicContact CD1-CE1 3.79Å; L148-F171 HydrophobicContact CD1-CE2 3.68Å; L148-F171 HydrophobicContact CD1-CZ 3.44Å; L148-F171 VanDerWaalsContact CD1-CZ 3.44Å; L148-F171 HydrophobicContact CD2-CE1 4.26Å; L148-F171 HydrophobicContact CD2-CZ 4.43Å; L148-F171 HydrophobicContact CG-CD1 4.1Å; L148-F171 HydrophobicContact CG-CE1 3.64Å; L148-F171 HydrophobicContact CG-CE2 4.43Å; L148-F171 HydrophobicContact CG-CZ 3.84Å | ||
| 149 | S | 98.4 | Very high | 98.3 | Very high | 44 Ų | 44 | 78.4 Ų | 78.4 | 31% | 0.308 | 38% | 0.379 | S | S | . | . | trans | -68.9 | 177.5 | 170.1 | 75.4 | 0 | 0 | 0 | 0 | 111.8 | P151 E152 R153 | S149-P151 WeakPolarHBondContact OG-CD 3.5Å; S149-E152 VanDerWaalsContact CB-OE1 3.26Å; S149-E152 WeakPolarHBondContact CB-OE1 3.47Å; S149-E152 PolarHBondContact N-OE2 3.19Å; S149-E152 WeakPolarHBondContact OG-CG 3.42Å; S149-E152 PolarHBondContact OG-OE1 2.97Å; S149-E152 PolarHBondContact OG-OE2 3.5Å; S149-R153 VanDerWaalsContact O-CG 3.29Å; S149-R153 WeakPolarHBondContact O-CG 3.48Å; S149-R153 PolarHBondContact O-N 3.11Å; S149-R153 PolarHBondContact O-NE 3.19Å; S149-R153 VanDerWaalsContact O-NE 3.12Å | ||
| 150 | A | 98.3 | Very high | 98.3 | Very high | 50 Ų | 50 | 76.3 Ų | 76.3 | 41% | 0.413 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -59.1 | -60.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | E152 R153 D154 | A150-E152 VanDerWaalsContact C-N 3.31Å; A150-E152 PolarHBondContact O-N 3.37Å; A150-R153 PolarHBondContact O-N 3.05Å; A150-R153 VanDerWaalsContact O-N 3.1Å; A150-D154 PolarHBondContact O-N 2.94Å |
| 151 | P | 98.3 | Very high | 98.3 | Very high | 90 Ų | 90 | 79.1 Ų | 79.1 | 58% | 0.584 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -62.4 | -33.7 | -176.5 | 24.7 | -35.6 | 0 | 0 | 0 | 113.7 | S149 R153 D154 H155 | S149-P151 WeakPolarHBondContact OG-CD 3.5Å; P151-R153 VanDerWaalsContact C-N 3.35Å; P151-R153 PolarHBondContact O-N 2.88Å; P151-D154 PolarHBondContact O-N 2.88Å; P151-H155 WeakPolarHBondContact O-CB 3.44Å; P151-H155 PolarHBondContact O-N 3.46Å |
| 152 | E | 98.4 | Very high | 98.3 | Very high | 71 Ų | 71 | 75.4 Ų | 75.4 | 33% | 0.332 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -62.1 | -39.7 | 175.3 | -74.3 | 152.9 | -135.6 | 0 | 0 | 112.8 | Q145 L148 S149 A150 L156 | Q145-E152 PolarHBondContact NE2-OE2 2.54Å; L148-E152 VanDerWaalsContact CA-OE2 3.27Å; L148-E152 WeakPolarHBondContact CA-OE2 3.5Å; L148-E152 HydrophobicContact CB-CB 4.11Å; L148-E152 HydrophobicContact CD2-CB 4.3Å; S149-E152 VanDerWaalsContact CB-OE1 3.26Å; S149-E152 WeakPolarHBondContact CB-OE1 3.47Å; S149-E152 PolarHBondContact N-OE2 3.19Å; S149-E152 WeakPolarHBondContact OG-CG 3.42Å; S149-E152 PolarHBondContact OG-OE1 2.97Å; S149-E152 PolarHBondContact OG-OE2 3.5Å; A150-E152 VanDerWaalsContact C-N 3.31Å; A150-E152 PolarHBondContact O-N 3.37Å; E152-L156 WeakPolarHBondContact O-CB 3.35Å; E152-L156 PolarHBondContact O-N 3.3Å |
| 153 | R | 98.6 | Very high | 98.3 | Very high | 64 Ų | 64 | 78.3 Ų | 78.3 | 24% | 0.242 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -68.9 | -39.1 | 176.5 | -68.5 | 174.4 | -54.6 | 172.1 | 13.4 | 111.4 | L148 S149 A150 P151 L156 A157 V167 | L148-R153 HydrophobicContact CB-CG 3.53Å; L148-R153 HydrophobicContact CD1-CG 4Å; L148-R153 HydrophobicContact CG-CG 4.42Å; S149-R153 VanDerWaalsContact O-CG 3.29Å; S149-R153 WeakPolarHBondContact O-CG 3.48Å; S149-R153 PolarHBondContact O-N 3.11Å; S149-R153 PolarHBondContact O-NE 3.19Å; S149-R153 VanDerWaalsContact O-NE 3.12Å; A150-R153 PolarHBondContact O-N 3.05Å; A150-R153 VanDerWaalsContact O-N 3.1Å; P151-R153 VanDerWaalsContact C-N 3.35Å; P151-R153 PolarHBondContact O-N 2.88Å; R153-L156 PolarHBondContact O-N 3.34Å; R153-A157 WeakPolarHBondContact O-CB 3.23Å; R153-A157 PolarHBondContact O-N 2.86Å; R153-V167 HydrophobicContact CB-CG1 4.31Å; R153-V167 HydrophobicContact CG-CG1 4.18Å |
| 154 | D | 98.6 | Very high | 98.3 | Very high | 68 Ų | 68 | 72.7 Ų | 72.7 | 36% | 0.364 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -66.4 | -42.1 | 179.3 | -59.6 | -33.3 | 0 | 0 | 0 | 110.6 | A150 P151 A157 N158 S164 | A150-D154 PolarHBondContact O-N 2.94Å; P151-D154 PolarHBondContact O-N 2.88Å; D154-A157 PolarHBondContact O-N 3.3Å; D154-N158 VanDerWaalsContact O-CG 3.22Å; D154-N158 PolarHBondContact O-N 3.34Å; D154-N158 PolarHBondContact O-ND2 2.9Å; D154-S164 WeakPolarHBondContact OD1-CB 3.37Å; D154-S164 PolarHBondContact OD1-OG 2.92Å |
| 155 | H | 98.6 | Very high | 98.3 | Very high | 129 Ų | 129 | 71.4 Ų | 71.4 | 60% | 0.597 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -60 | -50.2 | 171.3 | -179.5 | 79.7 | 0 | 0 | 0 | 112.2 | P151 A157 N158 V159 | P151-H155 WeakPolarHBondContact O-CB 3.44Å; P151-H155 PolarHBondContact O-N 3.46Å; H155-A157 VanDerWaalsContact C-N 3.31Å; H155-A157 PolarHBondContact O-N 3.28Å; H155-N158 PolarHBondContact O-N 3.1Å; H155-V159 WeakPolarHBondContact O-CG2 3.39Å; H155-V159 PolarHBondContact O-N 3.49Å; H155-V159 VanDerWaalsContact O-N 3.09Å |
| 156 | L | 98.4 | Very high | 98.3 | Very high | 12 Ų | 12 | 70.6 Ų | 70.6 | 6% | 0.063 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -64.3 | -35.8 | -179.8 | -173.3 | 57.7 | 0 | 0 | 0 | 112.6 | L138 R141 L148 E152 R153 V159 L160 V167 F171 | L138-L156 HydrophobicContact CD2-CD2 4.11Å; R141-L156 HydrophobicContact CB-CD2 4.13Å; R141-L156 HydrophobicContact CG-CD1 4.02Å; R141-L156 HydrophobicContact CG-CD2 4.18Å; L148-L156 HydrophobicContact CD1-CD2 3.75Å; E152-L156 WeakPolarHBondContact O-CB 3.35Å; E152-L156 PolarHBondContact O-N 3.3Å; R153-L156 PolarHBondContact O-N 3.34Å; L156-V159 PolarHBondContact O-N 3.45Å; L156-L160 HydrophobicContact CD1-CD1 3.76Å; L156-L160 HydrophobicContact CD1-CG 4.01Å; L156-L160 HydrophobicContact CG-CD1 4.01Å; L156-L160 HydrophobicContact CG-CG 4.49Å; L156-L160 WeakPolarHBondContact O-CB 3.36Å; L156-L160 WeakPolarHBondContact O-CG 3.39Å; L156-L160 PolarHBondContact O-N 3.44Å; L156-V167 HydrophobicContact CD2-CG1 4.09Å; L156-F171 HydrophobicContact CD2-CE2 3.96Å; L156-F171 HydrophobicContact CD2-CZ 4.27Å |
| 157 | A | 98.6 | Very high | 98.3 | Very high | 2 Ų | 2 | 66.2 Ų | 66.2 | 2% | 0.017 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -60.8 | -46.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | R153 D154 H155 V159 L160 K161 L162 V167 | R153-A157 WeakPolarHBondContact O-CB 3.23Å; R153-A157 PolarHBondContact O-N 2.86Å; D154-A157 PolarHBondContact O-N 3.3Å; H155-A157 VanDerWaalsContact C-N 3.31Å; H155-A157 PolarHBondContact O-N 3.28Å; A157-V159 PolarHBondContact O-N 2.61Å; A157-L160 PolarHBondContact O-N 3.31Å; A157-K161 WeakPolarHBondContact O-CA 3.29Å; A157-K161 PolarHBondContact O-N 3.3Å; A157-L162 CarbonylContact C-O 3.5Å; A157-L162 WeakPolarHBondContact CB-O 3.31Å; A157-L162 PolarHBondContact O-N 3.45Å; A157-V167 HydrophobicContact CB-CG2 4.04Å |
| 158 | N | 98.4 | Very high | 98.3 | Very high | 114 Ų | 114 | 64 Ų | 64 | 61% | 0.61 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -63.8 | -36.9 | 178.2 | -71.9 | -25.8 | 0 | 0 | 0 | 113.6 | D154 H155 K161 | D154-N158 VanDerWaalsContact O-CG 3.22Å; D154-N158 PolarHBondContact O-N 3.34Å; D154-N158 PolarHBondContact O-ND2 2.9Å; H155-N158 PolarHBondContact O-N 3.1Å; N158-K161 PolarHBondContact O-NZ 3.48Å |
| 159 | V | 98 | Very high | 98.3 | Very high | 84 Ų | 84 | 66.6 Ų | 66.6 | 51% | 0.509 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -68.7 | -47.7 | 175.5 | 173.9 | 0 | 0 | 0 | 0 | 110.9 | H155 L156 A157 K161 | H155-V159 WeakPolarHBondContact O-CG2 3.39Å; H155-V159 PolarHBondContact O-N 3.49Å; H155-V159 VanDerWaalsContact O-N 3.09Å; L156-V159 PolarHBondContact O-N 3.45Å; A157-V159 PolarHBondContact O-N 2.61Å; V159-K161 VanDerWaalsContact C-N 3.34Å; V159-K161 PolarHBondContact O-N 3.12Å |
| 160 | L | 97.9 | Very high | 98.3 | Very high | 17 Ų | 17 | 66.1 Ų | 66.1 | 9% | 0.089 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -86.5 | -0 | -174 | -59.3 | -176.6 | 0 | 0 | 0 | 115 | Q134 E137 L138 L156 A157 L162 | Q134-L160 HydrophobicContact CG-CB 4.42Å; Q134-L160 PolarHBondContact NE2-O 2.94Å; E137-L160 HydrophobicContact CB-CD1 4.22Å; E137-L160 HydrophobicContact CB-CD2 3.62Å; E137-L160 HydrophobicContact CG-CD2 4.12Å; L138-L160 HydrophobicContact CD1-CD1 4.49Å; L138-L160 HydrophobicContact CD2-CD1 3.85Å; L138-L160 HydrophobicContact CG-CD1 3.69Å; L156-L160 HydrophobicContact CD1-CD1 3.76Å; L156-L160 HydrophobicContact CD1-CG 4.01Å; L156-L160 HydrophobicContact CG-CD1 4.01Å; L156-L160 HydrophobicContact CG-CG 4.49Å; L156-L160 WeakPolarHBondContact O-CB 3.36Å; L156-L160 WeakPolarHBondContact O-CG 3.39Å; L156-L160 PolarHBondContact O-N 3.44Å; A157-L160 PolarHBondContact O-N 3.31Å; L160-L162 VanDerWaalsContact C-N 3.26Å; L160-L162 HydrophobicContact CB-CD1 4.18Å; L160-L162 HydrophobicContact CB-CG 4.15Å; L160-L162 PolarHBondContact O-N 2.84Å |
| 161 | K | 98.3 | Very high | 98.4 | Very high | 174 Ų | 174 | 64 Ų | 64 | 76% | 0.757 | 33% | 0.329 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.9 | 43.5 | -173.3 | -50 | -55.1 | 174.5 | -160.2 | 0 | 112.2 | A157 N158 V159 | A157-K161 WeakPolarHBondContact O-CA 3.29Å; A157-K161 PolarHBondContact O-N 3.3Å; N158-K161 PolarHBondContact O-NZ 3.48Å; V159-K161 VanDerWaalsContact C-N 3.34Å; V159-K161 PolarHBondContact O-N 3.12Å |
| 162 | L | 97.9 | Very high | 98.4 | Very high | 23 Ų | 23 | 62.8 Ų | 62.8 | 12% | 0.12 | 32% | 0.315 | C | S | . | . | trans | -114.5 | 170.7 | 173.7 | -64.5 | 179.7 | 0 | 0 | 0 | 109.6 | F130 L138 A157 L160 Q166 V167 | F130-L162 HydrophobicContact CD1-CD1 4.28Å; F130-L162 HydrophobicContact CD1-CD2 3.72Å; F130-L162 HydrophobicContact CE1-CD1 4.25Å; F130-L162 HydrophobicContact CE1-CD2 3.68Å; L138-L162 HydrophobicContact CD1-CD1 4.18Å; A157-L162 CarbonylContact C-O 3.5Å; A157-L162 WeakPolarHBondContact CB-O 3.31Å; A157-L162 PolarHBondContact O-N 3.45Å; L160-L162 VanDerWaalsContact C-N 3.26Å; L160-L162 HydrophobicContact CB-CD1 4.18Å; L160-L162 HydrophobicContact CB-CG 4.15Å; L160-L162 PolarHBondContact O-N 2.84Å; L162-Q166 HydrophobicContact CB-CB 4.43Å; L162-V167 HydrophobicContact CB-CG2 4.33Å | ||
| 163 | T | 98.4 | Very high | 98.4 | Very high | 75 Ų | 75 | 64 Ų | 64 | 46% | 0.46 | 32% | 0.324 | S | S | . | . | trans | -88 | 150.1 | 167.5 | 60.9 | 0 | 0 | 0 | 0 | 111 | T165 Q166 V167 | T163-T165 PolarHBondContact O-N 3.4Å; T163-T165 VanDerWaalsContact O-N 3.11Å; T163-Q166 WeakPolarHBondContact O-CB 3.49Å; T163-Q166 PolarHBondContact O-N 2.86Å; T163-Q166 WeakPolarHBondContact OG1-CB 3.33Å; T163-Q166 VanDerWaalsContact OG1-CG 3.3Å; T163-Q166 WeakPolarHBondContact OG1-CG 3.29Å; T163-Q166 PolarHBondContact OG1-N 3.38Å; T163-Q166 PolarHBondContact OG1-OE1 2.97Å; T163-V167 PolarHBondContact O-N 3.35Å | ||
| 164 | S | 98.1 | Very high | 98.3 | Very high | 37 Ų | 37 | 64.4 Ų | 64.4 | 26% | 0.259 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -56.6 | -29.3 | 175 | -41.2 | 0 | 0 | 0 | 0 | 112.7 | D154 K168 | D154-S164 WeakPolarHBondContact OD1-CB 3.37Å; D154-S164 PolarHBondContact OD1-OG 2.92Å; S164-K168 VanDerWaalsContact O-CB 3.31Å; S164-K168 WeakPolarHBondContact O-CB 3.42Å; S164-K168 PolarHBondContact O-N 3.3Å |
| 165 | T | 98.4 | Very high | 98.3 | Very high | 89 Ų | 89 | 65 Ų | 65 | 55% | 0.546 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -68.8 | -41.8 | 172.9 | -59.9 | 0 | 0 | 0 | 0 | 112.5 | T163 K168 I169 | T163-T165 PolarHBondContact O-N 3.4Å; T163-T165 VanDerWaalsContact O-N 3.11Å; T165-K168 WeakPolarHBondContact O-CB 3.49Å; T165-K168 PolarHBondContact O-N 2.9Å; T165-I169 HydrophobicContact CG2-CD1 3.9Å; T165-I169 WeakPolarHBondContact O-CB 3.27Å; T165-I169 VanDerWaalsContact O-CG1 3.29Å; T165-I169 WeakPolarHBondContact O-CG1 3.49Å; T165-I169 PolarHBondContact O-N 3.36Å |
| 166 | Q | 98.2 | Very high | 98.3 | Very high | 65 Ų | 65 | 64.8 Ų | 64.8 | 30% | 0.304 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.8 | -42.8 | 173 | -78.3 | 161.5 | -47.9 | 0 | 0 | 111.3 | F130 L162 T163 I169 W170 | F130-Q166 HydrophobicContact CE1-CB 4.26Å; F130-Q166 HydrophobicContact CE1-CG 4.23Å; F130-Q166 HydrophobicContact CZ-CB 3.91Å; F130-Q166 HydrophobicContact CZ-CG 4.12Å; L162-Q166 HydrophobicContact CB-CB 4.43Å; T163-Q166 WeakPolarHBondContact O-CB 3.49Å; T163-Q166 PolarHBondContact O-N 2.86Å; T163-Q166 WeakPolarHBondContact OG1-CB 3.33Å; T163-Q166 VanDerWaalsContact OG1-CG 3.3Å; T163-Q166 WeakPolarHBondContact OG1-CG 3.29Å; T163-Q166 PolarHBondContact OG1-N 3.38Å; T163-Q166 PolarHBondContact OG1-OE1 2.97Å; Q166-I169 PolarHBondContact O-N 3.09Å; Q166-W170 WeakPolarHBondContact O-CB 3.48Å; Q166-W170 PolarHBondContact O-N 2.91Å |
| 167 | V | 98.6 | Very high | 98.2 | Very high | 0 Ų | 0 | 70.6 Ų | 70.6 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -61.1 | -47 | 174.2 | 179.7 | 0 | 0 | 0 | 0 | 110.6 | L138 L148 R153 L156 A157 L162 T163 I169 W170 F171 | L138-V167 HydrophobicContact CD2-CG1 4.33Å; L138-V167 HydrophobicContact CD2-CG2 4.48Å; L148-V167 HydrophobicContact CD1-CG1 4.28Å; R153-V167 HydrophobicContact CB-CG1 4.31Å; R153-V167 HydrophobicContact CG-CG1 4.18Å; L156-V167 HydrophobicContact CD2-CG1 4.09Å; A157-V167 HydrophobicContact CB-CG2 4.04Å; L162-V167 HydrophobicContact CB-CG2 4.33Å; T163-V167 PolarHBondContact O-N 3.35Å; V167-I169 PolarHBondContact O-N 2.89Å; V167-W170 PolarHBondContact O-N 2.86Å; V167-F171 HydrophobicContact CG1-CD2 3.86Å; V167-F171 HydrophobicContact CG1-CE2 4Å; V167-F171 WeakPolarHBondContact O-CD2 3.41Å; V167-F171 PolarHBondContact O-N 3.29Å |
| 168 | K | 98.4 | Very high | 97.9 | Very high | 108 Ų | 108 | 73.1 Ų | 73.1 | 47% | 0.47 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -54.8 | -50.2 | 175.2 | 178.6 | -173.1 | 177.6 | -176.1 | 0 | 112 | S164 T165 F171 Q172 | S164-K168 VanDerWaalsContact O-CB 3.31Å; S164-K168 WeakPolarHBondContact O-CB 3.42Å; S164-K168 PolarHBondContact O-N 3.3Å; T165-K168 WeakPolarHBondContact O-CB 3.49Å; T165-K168 PolarHBondContact O-N 2.9Å; K168-F171 PolarHBondContact O-N 3.07Å; K168-Q172 WeakPolarHBondContact O-CB 3.26Å; K168-Q172 PolarHBondContact O-N 3.18Å |
| 169 | I | 98.4 | Very high | 97.7 | Very high | 82 Ų | 82 | 72.7 Ų | 72.7 | 42% | 0.421 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -64.6 | -43.7 | -179.5 | -69.7 | 167.1 | 0 | 0 | 0 | 110.6 | T165 Q166 V167 Q172 N173 | T165-I169 HydrophobicContact CG2-CD1 3.9Å; T165-I169 WeakPolarHBondContact O-CB 3.27Å; T165-I169 VanDerWaalsContact O-CG1 3.29Å; T165-I169 WeakPolarHBondContact O-CG1 3.49Å; T165-I169 PolarHBondContact O-N 3.36Å; Q166-I169 PolarHBondContact O-N 3.09Å; V167-I169 PolarHBondContact O-N 2.89Å; I169-Q172 PolarHBondContact O-N 2.62Å; I169-N173 WeakPolarHBondContact O-CB 3.34Å; I169-N173 VanDerWaalsContact O-CG 3.24Å; I169-N173 PolarHBondContact O-N 3.47Å |
| 170 | W | 98.4 | Very high | 97.5 | Very high | 34 Ų | 34 | 76.2 Ų | 76.2 | 13% | 0.129 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -62.5 | -46.3 | 178.4 | -171.7 | 99.7 | 0 | 0 | 0 | 111.6 | F130 L138 E139 F142 Q166 V167 Q172 N173 R174 | F130-W170 AromaticContact CD2-CD1 3.8Å; F130-W170 HydrophobicContact CE2-CB 4.28Å; F130-W170 AromaticContact CE2-CD1 3.74Å; F130-W170 HydrophobicContact CE2-CG 4.36Å; L138-W170 HydrophobicContact CB-CD2 3.9Å; L138-W170 HydrophobicContact CB-CE3 3.86Å; L138-W170 HydrophobicContact CB-CH2 3.72Å; L138-W170 HydrophobicContact CB-CZ2 3.71Å; L138-W170 HydrophobicContact CB-CZ3 3.79Å; L138-W170 HydrophobicContact CD1-CD2 3.9Å; L138-W170 HydrophobicContact CD1-CG 3.86Å; L138-W170 HydrophobicContact CD2-CD2 4.38Å; L138-W170 HydrophobicContact CD2-CE3 4.24Å; L138-W170 HydrophobicContact CG-CD2 4.28Å; L138-W170 HydrophobicContact CG-CE3 4.43Å; E139-W170 HydrophobicContact CB-CH2 4.43Å; E139-W170 HydrophobicContact CG-CH2 3.75Å; E139-W170 HydrophobicContact CG-CZ2 3.74Å; F142-W170 HydrophobicContact CB-CH2 4.22Å; F142-W170 HydrophobicContact CB-CZ3 3.96Å; F142-W170 HydrophobicContact CD2-CZ3 4.48Å; F142-W170 HydrophobicContact CG-CZ3 4.34Å; Q166-W170 WeakPolarHBondContact O-CB 3.48Å; Q166-W170 PolarHBondContact O-N 2.91Å; V167-W170 PolarHBondContact O-N 2.86Å; W170-Q172 VanDerWaalsContact C-N 3.31Å; W170-Q172 PolarHBondContact O-N 2.84Å; W170-N173 PolarHBondContact O-N 2.74Å; W170-R174 HydrophobicContact CE3-CB 4.14Å; W170-R174 HydrophobicContact CH2-CB 4.15Å; W170-R174 HydrophobicContact CH2-CG 3.88Å; W170-R174 HydrophobicContact CZ3-CB 3.85Å; W170-R174 HydrophobicContact CZ3-CG 3.94Å; W170-R174 WeakPolarHBondContact O-CB 3.37Å; W170-R174 PolarHBondContact O-N 2.8Å |
| 171 | F | 98.7 | Very high | 97.1 | Very high | 7 Ų | 7 | 80.5 Ų | 80.5 | 3% | 0.031 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -63.6 | -35.9 | 176.6 | -91.6 | -104.4 | 0 | 0 | 0 | 112.5 | L138 R141 F142 L148 L156 V167 K168 R175 | L138-F171 HydrophobicContact CD2-CD2 4.44Å; L138-F171 HydrophobicContact CD2-CE2 3.93Å; R141-F171 HydrophobicContact CB-CZ 4.28Å; F142-F171 HydrophobicContact CB-CE1 4.12Å; F142-F171 HydrophobicContact CB-CZ 4.25Å; F142-F171 AromaticContact CD2-CD1 3.82Å; F142-F171 HydrophobicContact CD2-CD1 3.82Å; F142-F171 AromaticContact CD2-CE1 3.83Å; F142-F171 HydrophobicContact CD2-CE1 3.83Å; F142-F171 HydrophobicContact CG-CE1 4.5Å; L148-F171 HydrophobicContact CD1-CD1 4.34Å; L148-F171 HydrophobicContact CD1-CD2 4.23Å; L148-F171 HydrophobicContact CD1-CE1 3.79Å; L148-F171 HydrophobicContact CD1-CE2 3.68Å; L148-F171 HydrophobicContact CD1-CZ 3.44Å; L148-F171 VanDerWaalsContact CD1-CZ 3.44Å; L148-F171 HydrophobicContact CD2-CE1 4.26Å; L148-F171 HydrophobicContact CD2-CZ 4.43Å; L148-F171 HydrophobicContact CG-CD1 4.1Å; L148-F171 HydrophobicContact CG-CE1 3.64Å; L148-F171 HydrophobicContact CG-CE2 4.43Å; L148-F171 HydrophobicContact CG-CZ 3.84Å; L156-F171 HydrophobicContact CD2-CE2 3.96Å; L156-F171 HydrophobicContact CD2-CZ 4.27Å; V167-F171 HydrophobicContact CG1-CD2 3.86Å; V167-F171 HydrophobicContact CG1-CE2 4Å; V167-F171 WeakPolarHBondContact O-CD2 3.41Å; V167-F171 PolarHBondContact O-N 3.29Å; K168-F171 PolarHBondContact O-N 3.07Å; F171-R175 WeakPolarHBondContact O-CG 3.35Å; F171-R175 PolarHBondContact O-N 3.35Å; F171-R175 VanDerWaalsContact O-N 3.07Å; F171-R175 PolarHBondContact O-NE 3.26Å |
| 172 | Q | 98.5 | Very high | 96.4 | Very high | 64 Ų | 64 | 80 Ų | 80 | 30% | 0.299 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -65.2 | -50 | 173.7 | 178.8 | 167.5 | 12.7 | 0 | 0 | 111.4 | K168 I169 W170 R174 R175 Y176 | K168-Q172 WeakPolarHBondContact O-CB 3.26Å; K168-Q172 PolarHBondContact O-N 3.18Å; I169-Q172 PolarHBondContact O-N 2.62Å; W170-Q172 VanDerWaalsContact C-N 3.31Å; W170-Q172 PolarHBondContact O-N 2.84Å; Q172-R174 VanDerWaalsContact C-N 3.3Å; Q172-R174 PolarHBondContact O-N 2.96Å; Q172-R175 PolarHBondContact O-N 3.44Å; Q172-Y176 HydrophobicContact CG-CD2 3.8Å; Q172-Y176 HydrophobicContact CG-CE2 3.33Å; Q172-Y176 PolarHBondContact NE2-OH 3.48Å; Q172-Y176 VanDerWaalsContact O-CD2 3.24Å; Q172-Y176 WeakPolarHBondContact O-CD2 3.24Å; Q172-Y176 PolarHBondContact O-N 3.37Å |
| 173 | N | 98.1 | Very high | 95.7 | Very high | 96 Ų | 96 | 84 Ų | 84 | 51% | 0.513 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -59.5 | -40 | 175.9 | -70.2 | -12.8 | 0 | 0 | 0 | 112 | I169 W170 Y176 K177 | I169-N173 WeakPolarHBondContact O-CB 3.34Å; I169-N173 VanDerWaalsContact O-CG 3.24Å; I169-N173 PolarHBondContact O-N 3.47Å; W170-N173 PolarHBondContact O-N 2.74Å; N173-Y176 PolarHBondContact O-N 3.13Å; N173-K177 PolarHBondContact O-N 3.45Å |
| 174 | R | 98.1 | Very high | 94.8 | Very high | 73 Ų | 73 | 83.2 Ų | 83.2 | 28% | 0.275 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -64.9 | -42.3 | 177.9 | -170.9 | 68.3 | -167.9 | -164.5 | -3.8 | 112.3 | E139 F142 W170 Q172 K177 C178 | E139-R174 IonicContact OE1-CZ 3.27Å; E139-R174 VanDerWaalsContact OE1-CZ 3.27Å; E139-R174 IonicContact OE1-NH1 2.61Å; E139-R174 PolarHBondContact OE1-NH1 3.18Å; E139-R174 IonicContact OE1-NH2 3.45Å; E139-R174 PolarHBondContact OE1-NH2 3.33Å; F142-R174 HydrophobicContact CD1-CG 3.56Å; F142-R174 HydrophobicContact CD2-CB 4.25Å; F142-R174 HydrophobicContact CD2-CG 3.8Å; F142-R174 HydrophobicContact CE1-CG 3.49Å; F142-R174 VanDerWaalsContact CE1-CG 3.49Å; F142-R174 HydrophobicContact CE2-CB 4.1Å; F142-R174 HydrophobicContact CE2-CG 3.73Å; F142-R174 HydrophobicContact CG-CG 3.71Å; F142-R174 HydrophobicContact CZ-CB 4.29Å; F142-R174 HydrophobicContact CZ-CG 3.57Å; W170-R174 HydrophobicContact CE3-CB 4.14Å; W170-R174 HydrophobicContact CH2-CB 4.15Å; W170-R174 HydrophobicContact CH2-CG 3.88Å; W170-R174 HydrophobicContact CZ3-CB 3.85Å; W170-R174 HydrophobicContact CZ3-CG 3.94Å; W170-R174 WeakPolarHBondContact O-CB 3.37Å; W170-R174 PolarHBondContact O-N 2.8Å; Q172-R174 VanDerWaalsContact C-N 3.3Å; Q172-R174 PolarHBondContact O-N 2.96Å; R174-K177 PolarHBondContact O-N 2.9Å; R174-C178 PolarHBondContact O-N 3.31Å; R174-C178 VanDerWaalsContact O-N 3.13Å |
| 175 | R | 98.1 | Very high | 93.7 | Very high | 81 Ų | 81 | 86.6 Ų | 86.6 | 31% | 0.306 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -63.2 | -43.3 | 172.6 | -74.1 | -175.5 | -71.7 | 124 | -2.6 | 111.9 | F142 K146 Y147 F171 Q172 C178 K179 | F142-R175 HydrophobicContact CE2-CG 3.82Å; F142-R175 HydrophobicContact CZ-CG 4.19Å; K146-R175 WeakPolarHBondContact O-CD 3.14Å; Y147-R175 VanDerWaalsContact CE1-CD 3.44Å; Y147-R175 VanDerWaalsContact CZ-CD 3.44Å; F171-R175 WeakPolarHBondContact O-CG 3.35Å; F171-R175 PolarHBondContact O-N 3.35Å; F171-R175 VanDerWaalsContact O-N 3.07Å; F171-R175 PolarHBondContact O-NE 3.26Å; Q172-R175 PolarHBondContact O-N 3.44Å; R175-C178 PolarHBondContact O-N 2.89Å; R175-K179 PolarHBondContact O-N 3.49Å |
| 176 | Y | 97.8 | Very high | 92.5 | Very high | 123 Ų | 123 | 86.4 Ų | 86.4 | 48% | 0.482 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -61.7 | -43.8 | 175.7 | -73.8 | -54.1 | 0 | 0 | 0 | 112.6 | Q172 N173 C178 K179 R180 | Q172-Y176 HydrophobicContact CG-CD2 3.8Å; Q172-Y176 HydrophobicContact CG-CE2 3.33Å; Q172-Y176 PolarHBondContact NE2-OH 3.48Å; Q172-Y176 VanDerWaalsContact O-CD2 3.24Å; Q172-Y176 WeakPolarHBondContact O-CD2 3.24Å; Q172-Y176 PolarHBondContact O-N 3.37Å; N173-Y176 PolarHBondContact O-N 3.13Å; Y176-C178 VanDerWaalsContact C-N 3.35Å; Y176-C178 PolarHBondContact O-N 2.95Å; Y176-K179 PolarHBondContact O-N 3.35Å; Y176-R180 WeakPolarHBondContact O-CB 3.35Å; Y176-R180 PolarHBondContact O-N 3.33Å |
| 177 | K | 96 | Very high | 90.9 | Very high | 134 Ų | 134 | 87.5 Ų | 87.5 | 58% | 0.583 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -58.3 | -45.6 | 176.1 | -173.7 | 176.6 | 178.7 | -179.6 | 0 | 111.6 | N173 R174 R180 Q181 | N173-K177 PolarHBondContact O-N 3.45Å; R174-K177 PolarHBondContact O-N 2.9Å; K177-R180 PolarHBondContact O-N 3.25Å; K177-Q181 WeakPolarHBondContact O-CB 3.37Å; K177-Q181 PolarHBondContact O-N 2.75Å |
| 178 | C | 93 | Very high | 89.1 | Confident | 55 Ų | 55 | 95.2 Ų | 95.2 | 37% | 0.372 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -67 | -36.3 | 178 | -179.8 | 0 | 0 | 0 | 0 | 113.3 | R174 R175 Y176 | R174-C178 PolarHBondContact O-N 3.31Å; R174-C178 VanDerWaalsContact O-N 3.13Å; R175-C178 PolarHBondContact O-N 2.89Å; Y176-C178 VanDerWaalsContact C-N 3.35Å; Y176-C178 PolarHBondContact O-N 2.95Å |
| 179 | K | 94.1 | Very high | 87.3 | Confident | 106 Ų | 106 | 98.1 Ų | 98.1 | 46% | 0.461 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -64.4 | -48.2 | 172.2 | -171.5 | -175 | 72.1 | 165.2 | 0 | 110.8 | R175 Y176 R182 Q183 | R175-K179 PolarHBondContact O-N 3.49Å; Y176-K179 PolarHBondContact O-N 3.35Å; K179-R182 PolarHBondContact O-N 3.36Å; K179-Q183 PolarHBondContact O-N 3.26Å |
| 180 | R | 93.6 | Very high | 85.6 | Confident | 158 Ų | 158 | 98.9 Ų | 98.9 | 60% | 0.596 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -66 | -42.6 | -176.3 | -178.7 | 163.3 | -176.1 | -150.2 | -3 | 112.2 | Y176 K177 R182 Q183 D184 | Y176-R180 WeakPolarHBondContact O-CB 3.35Å; Y176-R180 PolarHBondContact O-N 3.33Å; K177-R180 PolarHBondContact O-N 3.25Å; R180-R182 PolarHBondContact O-N 2.9Å; R180-Q183 PolarHBondContact O-N 3.32Å; R180-D184 VanDerWaalsContact CG-OD2 3.27Å; R180-D184 WeakPolarHBondContact CG-OD2 3.35Å; R180-D184 IonicContact CZ-OD2 3.88Å; R180-D184 IonicContact NE-OD1 3.45Å; R180-D184 PolarHBondContact NE-OD1 3.1Å; R180-D184 IonicContact NE-OD2 3.32Å; R180-D184 PolarHBondContact NE-OD2 3.38Å; R180-D184 IonicContact NH2-OD1 3.91Å; R180-D184 IonicContact NH2-OD2 3.96Å; R180-D184 PolarHBondContact O-N 2.81Å |
| 181 | Q | 90.3 | Very high | 83.6 | Confident | 107 Ų | 107 | 100.1 Ų | 100.1 | 50% | 0.5 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -55.6 | -37.7 | 176.2 | -175.1 | 173.7 | 3.8 | 0 | 0 | 112.8 | K177 Q185 | K177-Q181 WeakPolarHBondContact O-CB 3.37Å; K177-Q181 PolarHBondContact O-N 2.75Å; Q181-Q185 WeakPolarHBondContact O-CB 3.27Å; Q181-Q185 WeakPolarHBondContact O-CG 3.28Å; Q181-Q185 PolarHBondContact O-N 3.43Å |
| 182 | R | 82.6 | Confident | 81.8 | Confident | 163 Ų | 163 | 104.5 Ų | 104.5 | 62% | 0.615 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -68.6 | -39 | 174.2 | -76.5 | -171.2 | -77.6 | 169.5 | -6 | 112.9 | K179 R180 T186 | K179-R182 PolarHBondContact O-N 3.36Å; R180-R182 PolarHBondContact O-N 2.9Å; R182-T186 PolarHBondContact O-N 2.86Å; R182-T186 PolarHBondContact O-OG1 3.2Å; R182-T186 VanDerWaalsContact O-OG1 3.05Å |
| 183 | Q | 83.4 | Confident | 79.9 | Confident | 106 Ų | 106 | 105.1 Ų | 105.1 | 50% | 0.495 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -68.7 | -44.2 | 178 | -67.6 | 178.7 | -28.5 | 0 | 0 | 111.8 | K179 R180 Q185 T186 L187 | K179-Q183 PolarHBondContact O-N 3.26Å; R180-Q183 PolarHBondContact O-N 3.32Å; Q183-Q185 VanDerWaalsContact C-N 3.35Å; Q183-Q185 PolarHBondContact O-N 3.12Å; Q183-T186 PolarHBondContact O-N 3.01Å; Q183-L187 WeakPolarHBondContact O-CG 3.22Å; Q183-L187 PolarHBondContact O-N 2.91Å |
| 184 | D | 80 | Confident | 78.2 | Confident | 60 Ų | 60 | 105.6 Ų | 105.6 | 32% | 0.321 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63 | -41.3 | 177.1 | -61.7 | -19.9 | 0 | 0 | 0 | 110.2 | R180 T186 L187 E188 | R180-D184 VanDerWaalsContact CG-OD2 3.27Å; R180-D184 WeakPolarHBondContact CG-OD2 3.35Å; R180-D184 IonicContact CZ-OD2 3.88Å; R180-D184 IonicContact NE-OD1 3.45Å; R180-D184 PolarHBondContact NE-OD1 3.1Å; R180-D184 IonicContact NE-OD2 3.32Å; R180-D184 PolarHBondContact NE-OD2 3.38Å; R180-D184 IonicContact NH2-OD1 3.91Å; R180-D184 IonicContact NH2-OD2 3.96Å; R180-D184 PolarHBondContact O-N 2.81Å; D184-T186 PolarHBondContact O-N 2.85Å; D184-L187 PolarHBondContact O-N 3.39Å; D184-E188 PolarHBondContact O-N 3.02Å |
| 185 | Q | 76.4 | Confident | 76.7 | Confident | 107 Ų | 107 | 108.2 Ų | 108.2 | 50% | 0.5 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -61.7 | -38.8 | 172.6 | -78.7 | 174.3 | -18.8 | 0 | 0 | 113.7 | Q181 Q183 L187 M189 | Q181-Q185 WeakPolarHBondContact O-CB 3.27Å; Q181-Q185 WeakPolarHBondContact O-CG 3.28Å; Q181-Q185 PolarHBondContact O-N 3.43Å; Q183-Q185 VanDerWaalsContact C-N 3.35Å; Q183-Q185 PolarHBondContact O-N 3.12Å; Q185-L187 VanDerWaalsContact C-N 3.34Å; Q185-M189 WeakPolarHBondContact O-CB 3.47Å; Q185-M189 PolarHBondContact O-N 3.49Å; Q185-M189 VanDerWaalsContact O-N 3.16Å |
| 186 | T | 72.5 | Confident | 75.2 | Confident | 86 Ų | 86 | 114.5 Ų | 114.5 | 53% | 0.528 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -64.3 | -39 | 173.5 | -58.6 | 0 | 0 | 0 | 0 | 111.4 | R182 Q183 D184 M189 V190 | R182-T186 PolarHBondContact O-N 2.86Å; R182-T186 PolarHBondContact O-OG1 3.2Å; R182-T186 VanDerWaalsContact O-OG1 3.05Å; Q183-T186 PolarHBondContact O-N 3.01Å; D184-T186 PolarHBondContact O-N 2.85Å; T186-M189 PolarHBondContact O-N 3.29Å; T186-V190 HydrophobicContact CG2-CG2 4.4Å; T186-V190 VanDerWaalsContact O-CG2 3.27Å; T186-V190 WeakPolarHBondContact O-CG2 3.18Å; T186-V190 PolarHBondContact O-N 3.17Å; T186-V190 VanDerWaalsContact O-N 3.08Å |
| 187 | L | 64.1 | Low | 73.4 | Confident | 87 Ų | 87 | 120.3 Ų | 120.3 | 46% | 0.455 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -67.9 | -41.1 | 179.4 | -70.9 | 170.5 | 0 | 0 | 0 | 112.7 | Q183 D184 Q185 M189 V190 G191 I192 | Q183-L187 WeakPolarHBondContact O-CG 3.22Å; Q183-L187 PolarHBondContact O-N 2.91Å; D184-L187 PolarHBondContact O-N 3.39Å; Q185-L187 VanDerWaalsContact C-N 3.34Å; L187-M189 VanDerWaalsContact C-N 3.35Å; L187-V190 PolarHBondContact O-N 2.86Å; L187-G191 PolarHBondContact O-N 3.15Å; L187-I192 HydrophobicContact CD2-CD1 4.23Å; L187-I192 PolarHBondContact O-N 3.22Å |
| 188 | E | 61.8 | Low | 72 | Confident | 162 Ų | 162 | 121 Ų | 121 | 76% | 0.757 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -63.2 | -40.6 | 174.6 | -71.5 | -174.2 | 165.8 | 0 | 0 | 111.7 | D184 V190 G191 | D184-E188 PolarHBondContact O-N 3.02Å; E188-V190 PolarHBondContact O-N 3.33Å; E188-G191 PolarHBondContact O-N 3.06Å; E188-G191 VanDerWaalsContact O-N 3.13Å |
| 189 | M | 59.7 | Low | 70.4 | Confident | 169 Ų | 169 | 122.6 Ų | 122.6 | 83% | 0.833 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -76.3 | -19.7 | -178.6 | -164.7 | 141.5 | 59.1 | 0 | 0 | 114.3 | Q185 T186 L187 G191 | Q185-M189 WeakPolarHBondContact O-CB 3.47Å; Q185-M189 PolarHBondContact O-N 3.49Å; Q185-M189 VanDerWaalsContact O-N 3.16Å; T186-M189 PolarHBondContact O-N 3.29Å; L187-M189 VanDerWaalsContact C-N 3.35Å; M189-G191 VanDerWaalsContact C-N 3.29Å |
| 190 | V | 63 | Low | 69 | Low | 99 Ų | 99 | 123.3 Ų | 123.3 | 60% | 0.6 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.9 | 0.7 | 170.3 | -176.3 | 0 | 0 | 0 | 0 | 111.3 | T186 L187 E188 I192 | T186-V190 HydrophobicContact CG2-CG2 4.4Å; T186-V190 VanDerWaalsContact O-CG2 3.27Å; T186-V190 WeakPolarHBondContact O-CG2 3.18Å; T186-V190 PolarHBondContact O-N 3.17Å; T186-V190 VanDerWaalsContact O-N 3.08Å; L187-V190 PolarHBondContact O-N 2.86Å; E188-V190 PolarHBondContact O-N 3.33Å; V190-I192 HydrophobicContact CB-CD1 4.42Å; V190-I192 HydrophobicContact CB-CG1 4.28Å; V190-I192 HydrophobicContact CG1-CD1 3.91Å; V190-I192 HydrophobicContact CG1-CG1 3.88Å; V190-I192 PolarHBondContact O-N 3.45Å; V190-I192 VanDerWaalsContact O-N 3.11Å |
| 191 | G | 56.5 | Low | 67.5 | Low | 60 Ų | 60 | 120.7 Ų | 120.7 | 62% | 0.619 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 64.5 | 15.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | L187 E188 M189 P193 | L187-G191 PolarHBondContact O-N 3.15Å; E188-G191 PolarHBondContact O-N 3.06Å; E188-G191 VanDerWaalsContact O-N 3.13Å; M189-G191 VanDerWaalsContact C-N 3.29Å; G191-P193 VanDerWaalsContact O-CD 3.28Å; G191-P193 WeakPolarHBondContact O-CD 3.46Å |
| 192 | I | 61.1 | Low | 66.4 | Low | 99 Ų | 99 | 121.7 Ų | 121.7 | 51% | 0.508 | 65% | 0.65 | S | S | . | * | trans | -71.9 | 114 | 178 | -59.2 | 177.4 | 0 | 0 | 0 | 106.6 | L187 V190 | L187-I192 HydrophobicContact CD2-CD1 4.23Å; L187-I192 PolarHBondContact O-N 3.22Å; V190-I192 HydrophobicContact CB-CD1 4.42Å; V190-I192 HydrophobicContact CB-CG1 4.28Å; V190-I192 HydrophobicContact CG1-CD1 3.91Å; V190-I192 HydrophobicContact CG1-CG1 3.88Å; V190-I192 PolarHBondContact O-N 3.45Å; V190-I192 VanDerWaalsContact O-N 3.11Å | ||
| 193 | P | 57.5 | Low | 65.5 | Low | 76 Ų | 76 | 121.9 Ų | 121.9 | 49% | 0.494 | 66% | 0.662 | S | S | . | * | trans | -60.6 | 137.5 | -177.7 | 24.9 | -33.5 | 0 | 0 | 0 | 109 | G191 | G191-P193 VanDerWaalsContact O-CD 3.28Å; G191-P193 WeakPolarHBondContact O-CD 3.46Å | ||
| 194 | P | 63.7 | Low | 64.5 | Low | 107 Ų | 107 | 120.2 Ų | 120.2 | 70% | 0.695 | 66% | 0.659 | S | S | * | * | trans | -52.8 | 138.1 | 178.9 | 22.1 | -33.2 | 0 | 0 | 0 | 109 | R196 | P194-R196 PolarHBondContact O-N 2.98Š| ||
| 195 | P | 65.3 | Low | 62.9 | Low | 127 Ų | 127 | 128 Ų | 128 | 83% | 0.825 | 68% | 0.684 | S | S | * | * | trans | -53 | 109 | -169.3 | 19.1 | -32.1 | 0 | 0 | 0 | 109.4 | R197 | P195-R197 PolarHBondContact O-N 2.85Å; P195-R197 VanDerWaalsContact O-N 3.16Å | ||
| 196 | R | 66.4 | Low | 61.9 | Low | 213 Ų | 213 | 129.8 Ų | 129.8 | 80% | 0.804 | 70% | 0.697 | S | S | * | * | trans | -56.5 | 125.7 | -170.1 | -58.1 | -176.7 | -144.3 | 175.3 | 7 | 106.9 | P194 I198 | P194-R196 PolarHBondContact O-N 2.98Å; R196-I198 PolarHBondContact O-N 3.17Å | ||
| 197 | R | 60.6 | Low | 61.1 | Low | 245 Ų | 245 | 128.9 Ų | 128.9 | 93% | 0.925 | 71% | 0.705 | S | S | * | * | trans | -56.6 | 106.6 | 175.9 | -79.5 | -178.8 | 163.6 | -176.4 | -5.1 | 107.5 | P195 A199 | P195-R197 PolarHBondContact O-N 2.85Å; P195-R197 VanDerWaalsContact O-N 3.16Å; R197-A199 PolarHBondContact O-N 3.05Å | ||
| 198 | I | 66.8 | Low | 60.8 | Low | 148 Ų | 148 | 133 Ų | 133 | 76% | 0.759 | 72% | 0.719 | S | S | * | * | trans | -59.6 | 114.3 | 170.7 | -60.1 | 174.1 | 0 | 0 | 0 | 105 | R196 V200 | R196-I198 PolarHBondContact O-N 3.17Å; I198-V200 VanDerWaalsContact C-N 3.33Å; I198-V200 PolarHBondContact O-N 2.84Å | ||
| 199 | A | 58.5 | Low | 60.2 | Low | 90 Ų | 90 | 130.1 Ų | 130.1 | 74% | 0.744 | 72% | 0.715 | S | S | * | * | trans | -63.1 | 102.3 | 169.6 | 0 | 0 | 0 | 0 | 0 | 106.2 | R197 P201 | R197-A199 PolarHBondContact O-N 3.05Å; A199-P201 WeakPolarHBondContact O-CD 3.27Å; A199-P201 VanDerWaalsContact O-N 3.12Å | ||
| 200 | V | 66.1 | Low | 59.6 | Low | 120 Ų | 120 | 128.1 Ų | 128.1 | 73% | 0.727 | 72% | 0.716 | S | S | * | * | trans | -63.7 | 113.4 | 173.6 | 176.4 | 0 | 0 | 0 | 0 | 105.5 | I198 V202 | I198-V200 VanDerWaalsContact C-N 3.33Å; I198-V200 PolarHBondContact O-N 2.84Å; V200-V202 PolarHBondContact O-N 2.85Å; V200-V202 VanDerWaalsContact O-N 3.1Å | ||
| 201 | P | 62.3 | Low | 59.2 | Low | 103 Ų | 103 | 130.6 Ų | 130.6 | 67% | 0.669 | 73% | 0.725 | S | S | * | * | trans | -60.8 | 122.2 | 174.7 | 26.1 | -32.1 | 0 | 0 | 0 | 106.7 | A199 L203 | A199-P201 WeakPolarHBondContact O-CD 3.27Å; A199-P201 VanDerWaalsContact O-N 3.12Å; P201-L203 PolarHBondContact O-N 3.16Å | ||
| 202 | V | 66.3 | Low | 58.7 | Low | 128 Ų | 128 | 131.4 Ų | 131.4 | 78% | 0.776 | 73% | 0.733 | S | S | * | * | trans | -55.5 | 117 | 174.6 | 175.7 | 0 | 0 | 0 | 0 | 106.5 | V200 V204 | V200-V202 PolarHBondContact O-N 2.85Å; V200-V202 VanDerWaalsContact O-N 3.1Å; V202-V204 PolarHBondContact O-N 3.09Å | ||
| 203 | L | 64.1 | Low | 58 | Low | 168 Ų | 168 | 136 Ų | 136 | 88% | 0.88 | 75% | 0.753 | S | S | * | * | trans | -62.2 | 103.1 | 176.9 | -73.7 | 173.9 | 0 | 0 | 0 | 107.6 | P201 R205 | P201-L203 PolarHBondContact O-N 3.16Å; L203-R205 PolarHBondContact O-N 3.03Å | ||
| 204 | V | 61.5 | Low | 57.6 | Low | 71 Ų | 71 | 138 Ų | 138 | 43% | 0.43 | 77% | 0.769 | S | S | . | * | trans | -59.3 | 121.6 | -175.4 | 179.7 | 0 | 0 | 0 | 0 | 108.7 | V202 K208 | V202-V204 PolarHBondContact O-N 3.09Å; V204-K208 VanDerWaalsContact CG1-O 3.28Å; V204-K208 WeakPolarHBondContact CG1-O 3.28Å | ||
| 205 | R | 48 | Very low | 56.6 | Low | 223 Ų | 223 | 137.8 Ų | 137.8 | 84% | 0.842 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.6 | 127.7 | 161.5 | -161.8 | 164.1 | -179.3 | 118.7 | -1.1 | 107.2 | L203 | L203-R205 PolarHBondContact O-N 3.03Š|
| 206 | D | 54.3 | Low | 55.7 | Low | 145 Ų | 145 | 138.4 Ų | 138.4 | 78% | 0.775 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 72.1 | 29.7 | 178.3 | -43.7 | -39.2 | 0 | 0 | 0 | 116.3 | K208 | D206-K208 PolarHBondContact O-N 3.44Å; D206-K208 VanDerWaalsContact O-N 3.15Å |
| 207 | G | 56 | Low | 54.3 | Low | 67 Ų | 67 | 137.4 Ų | 137.4 | 69% | 0.691 | 77% | 0.771 | S | S | * | * | S | Bend | trans | 74.7 | 7.5 | 146.6 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||
| 208 | K | 57.5 | Low | 53.7 | Low | 173 Ų | 173 | 131 Ų | 131 | 75% | 0.752 | 76% | 0.764 | S | S | * | * | trans | -119.1 | 117.3 | 173.8 | -64.5 | -166.5 | 179.9 | -173.4 | 0 | 112.9 | V204 D206 C210 | V204-K208 VanDerWaalsContact CG1-O 3.28Å; V204-K208 WeakPolarHBondContact CG1-O 3.28Å; D206-K208 PolarHBondContact O-N 3.44Å; D206-K208 VanDerWaalsContact O-N 3.15Å; K208-C210 PolarHBondContact O-N 3.18Å | ||
| 209 | P | 48.6 | Very low | 52.3 | Low | 102 Ų | 102 | 127 Ų | 127 | 66% | 0.662 | 75% | 0.749 | S | S | * | * | trans | -67.4 | 115.6 | 170.1 | 28 | -31.3 | 0 | 0 | 0 | 109 | L211 | P209-L211 PolarHBondContact O-N 2.97Š| ||
| 210 | C | 48.6 | Very low | 51.8 | Low | 126 Ų | 126 | 128.5 Ų | 128.5 | 85% | 0.851 | 75% | 0.751 | S | S | * | * | trans | -74.8 | 69.4 | 173.6 | 52.5 | 0 | 0 | 0 | 0 | 110.8 | K208 G212 | K208-C210 PolarHBondContact O-N 3.18Å; C210-G212 PolarHBondContact O-N 2.99Å | ||
| 211 | L | 53.9 | Low | 50.4 | Low | 151 Ų | 151 | 132 Ų | 132 | 79% | 0.791 | 75% | 0.753 | S | S | * | * | trans | -69.6 | 113.1 | 153.9 | -66.6 | 179.2 | 0 | 0 | 0 | 106.6 | P209 E213 | P209-L211 PolarHBondContact O-N 2.97Å; L211-E213 PolarHBondContact O-N 3.25Å | ||
| 212 | G | 46.1 | Very low | 49.7 | Very low | 78 Ų | 78 | 134 Ų | 134 | 80% | 0.804 | 76% | 0.758 | S | S | * | * | trans | -66.9 | 113.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | C210 S214 | C210-G212 PolarHBondContact O-N 2.99Å; G212-S214 PolarHBondContact O-N 3.12Å; G212-S214 VanDerWaalsContact O-N 3.12Å | ||
| 213 | E | 46.5 | Very low | 48.7 | Very low | 196 Ų | 196 | 133.4 Ų | 133.4 | 92% | 0.916 | 75% | 0.754 | S | S | * | * | trans | -69.5 | 102.2 | 171.9 | -68.9 | 173.3 | 123.6 | 0 | 0 | 109.7 | L211 | L211-E213 PolarHBondContact O-N 3.25Š| ||
| 214 | S | 48.1 | Very low | 47.8 | Very low | 118 Ų | 118 | 129.8 Ų | 129.8 | 83% | 0.825 | 74% | 0.743 | S | S | * | * | trans | 172.2 | 78.6 | 147.2 | 38.5 | 0 | 0 | 0 | 0 | 113.3 | G212 | G212-S214 PolarHBondContact O-N 3.12Å; G212-S214 VanDerWaalsContact O-N 3.12Å | ||
| 215 | S | 42.7 | Very low | 46.8 | Very low | 102 Ų | 102 | 133.3 Ų | 133.3 | 71% | 0.713 | 76% | 0.758 | S | S | * | * | trans | -165.1 | 119.6 | 143.5 | -167.1 | 0 | 0 | 0 | 0 | 111.9 | Y217 | S215-Y217 PolarHBondContact O-N 3.05Å; S215-Y217 VanDerWaalsContact O-N 3.09Å | ||
| 216 | P | 47.7 | Very low | 46.3 | Very low | 139 Ų | 139 | 129.4 Ų | 129.4 | 90% | 0.903 | 75% | 0.753 | S | S | * | * | trans | -83.7 | 66.2 | 170.3 | 35.7 | -33.7 | 0 | 0 | 0 | 110.3 | ||||
| 217 | Y | 37 | Very low | 45.9 | Very low | 192 Ų | 192 | 127.5 Ų | 127.5 | 75% | 0.753 | 75% | 0.749 | S | S | * | * | trans | -112.1 | 99.3 | 168.2 | -159.6 | -96.4 | 0 | 0 | 0 | 110.6 | S215 S219 | S215-Y217 PolarHBondContact O-N 3.05Å; S215-Y217 VanDerWaalsContact O-N 3.09Å; Y217-S219 PolarHBondContact O-N 3.06Å; Y217-S219 VanDerWaalsContact O-N 3.17Å | ||
| 218 | S | 47.4 | Very low | 45.2 | Very low | 111 Ų | 111 | 134.5 Ų | 134.5 | 78% | 0.776 | 76% | 0.756 | S | S | * | * | trans | -63.7 | 111.7 | 171.5 | -175.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 219 | S | 37.3 | Very low | 44.3 | Very low | 65 Ų | 65 | 132 Ų | 132 | 46% | 0.455 | 76% | 0.76 | S | S | . | * | trans | -109.8 | 118.6 | 172.6 | -167.3 | 0 | 0 | 0 | 0 | 109.5 | Y217 Y221 | Y217-S219 PolarHBondContact O-N 3.06Å; Y217-S219 VanDerWaalsContact O-N 3.17Å; S219-Y221 PolarHBondContact O-N 3.16Å; S219-Y221 VanDerWaalsContact OG-CE2 3.25Å; S219-Y221 WeakPolarHBondContact OG-CE2 3.25Å | ||
| 220 | P | 47.9 | Very low | 43.9 | Very low | 120 Ų | 120 | 136.4 Ų | 136.4 | 78% | 0.779 | 77% | 0.765 | S | S | * | * | trans | -83.5 | 84.6 | -169.8 | 33.4 | -35.2 | 0 | 0 | 0 | 111.5 | ||||
| 221 | Y | 36.9 | Very low | 43.8 | Very low | 195 Ų | 195 | 136.3 Ų | 136.3 | 77% | 0.765 | 76% | 0.756 | S | S | * | * | trans | -107.9 | 87.4 | 165.6 | -67.1 | -68.2 | 0 | 0 | 0 | 110.4 | S219 V223 | S219-Y221 PolarHBondContact O-N 3.16Å; S219-Y221 VanDerWaalsContact OG-CE2 3.25Å; S219-Y221 WeakPolarHBondContact OG-CE2 3.25Å; Y221-V223 VanDerWaalsContact C-N 3.31Å; Y221-V223 PolarHBondContact O-N 3.47Å | ||
| 222 | N | 48 | Very low | 43 | Very low | 144 Ų | 144 | 133.8 Ų | 133.8 | 77% | 0.77 | 76% | 0.757 | S | S | * | * | trans | -70.3 | 89 | 170 | -163.4 | -56 | 0 | 0 | 0 | 108.9 | S224 | N222-S224 PolarHBondContact O-N 3.42Å; N222-S224 PolarHBondContact OD1-OG 3.22Å | ||
| 223 | V | 44.6 | Very low | 42.7 | Very low | 116 Ų | 116 | 140.3 Ų | 140.3 | 70% | 0.703 | 76% | 0.759 | S | S | * | * | trans | -83.5 | 93 | 169.9 | -179.8 | 0 | 0 | 0 | 0 | 107.5 | Y221 I225 | Y221-V223 VanDerWaalsContact C-N 3.31Å; Y221-V223 PolarHBondContact O-N 3.47Å; V223-I225 PolarHBondContact O-N 3.04Å | ||
| 224 | S | 45.6 | Very low | 42.8 | Very low | 91 Ų | 91 | 136 Ų | 136 | 64% | 0.636 | 75% | 0.748 | S | S | * | * | trans | -64.1 | 103.6 | 173.4 | -44.9 | 0 | 0 | 0 | 0 | 109.7 | N222 N226 | N222-S224 PolarHBondContact O-N 3.42Å; N222-S224 PolarHBondContact OD1-OG 3.22Å; S224-N226 PolarHBondContact O-N 3.45Å; S224-N226 VanDerWaalsContact O-N 3.16Å | ||
| 225 | I | 39.7 | Very low | 42.3 | Very low | 146 Ų | 146 | 134.6 Ų | 134.6 | 75% | 0.749 | 74% | 0.744 | S | S | * | * | trans | -73.9 | 101.1 | 174.3 | -70.5 | 164.1 | 0 | 0 | 0 | 108 | V223 | V223-I225 PolarHBondContact O-N 3.04Š| ||
| 226 | N | 37.9 | Very low | 42 | Very low | 141 Ų | 141 | 141 Ų | 141 | 75% | 0.754 | 75% | 0.754 | S | S | * | * | trans | -101.8 | 109.3 | 163 | -82.2 | -10.9 | 0 | 0 | 0 | 108.8 | S224 | S224-N226 PolarHBondContact O-N 3.45Å; S224-N226 VanDerWaalsContact O-N 3.16Å | ||
| 227 | P | 45.2 | Very low | 41.6 | Very low | 105 Ų | 105 | 139.4 Ų | 139.4 | 68% | 0.682 | 74% | 0.742 | S | S | * | * | trans | -76.3 | 128.7 | 172.7 | 30.7 | -31.4 | 0 | 0 | 0 | 110.2 | ||||
| 228 | Y | 41.4 | Very low | 42.2 | Very low | 214 Ų | 214 | 137.4 Ų | 137.4 | 84% | 0.839 | 74% | 0.744 | S | S | * | * | trans | 58.5 | 101.4 | 172.1 | -78.4 | -92.6 | 0 | 0 | 0 | 117.7 | ||||
| 229 | S | 38.4 | Very low | 41.8 | Very low | 120 Ų | 120 | 141.7 Ų | 141.7 | 84% | 0.839 | 75% | 0.745 | S | S | * | * | trans | -124.6 | 92.9 | 149.2 | -57.9 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 230 | Y | 40.5 | Very low | 42.4 | Very low | 195 Ų | 195 | 146 Ų | 146 | 77% | 0.765 | 76% | 0.762 | S | S | * | * | trans | -85.9 | 137.4 | 173.7 | -163 | -100.1 | 0 | 0 | 0 | 108.4 | ||||
| 231 | N | 47.2 | Very low | 41.9 | Very low | 123 Ų | 123 | 144.9 Ų | 144.9 | 66% | 0.658 | 76% | 0.758 | S | S | * | * | trans | 79 | 89.9 | -172.4 | -51.8 | -57.2 | 0 | 0 | 0 | 116.9 | ||||
| 232 | A | 37 | Very low | 42.5 | Very low | 99 Ų | 99 | 141.5 Ų | 141.5 | 82% | 0.818 | 76% | 0.76 | S | S | * | * | trans | -137.4 | 84.2 | 147.2 | 0 | 0 | 0 | 0 | 0 | 108.2 | P234 | A232-P234 WeakPolarHBondContact O-CD 3.45Š| ||
| 233 | Y | 38.6 | Very low | 42.2 | Very low | 215 Ų | 215 | 138.9 Ų | 138.9 | 84% | 0.843 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 123.3 | 168.6 | -90.1 | -89 | 0 | 0 | 0 | 108.5 | A235 | Y233-A235 PolarHBondContact O-N 3.46Š|
| 234 | P | 48.9 | Very low | 41.8 | Very low | 104 Ų | 104 | 139.2 Ų | 139.2 | 68% | 0.675 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 125 | 165.8 | 29.1 | -31.4 | 0 | 0 | 0 | 108.3 | A232 Y236 | A232-P234 WeakPolarHBondContact O-CD 3.45Å; P234-Y236 PolarHBondContact O-N 3.36Å |
| 235 | A | 39.3 | Very low | 41.4 | Very low | 90 Ų | 90 | 142.1 Ų | 142.1 | 74% | 0.744 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 126 | 170.4 | 0 | 0 | 0 | 0 | 0 | 109 | Y233 T237 | Y233-A235 PolarHBondContact O-N 3.46Å; A235-T237 VanDerWaalsContact C-N 3.34Å; A235-T237 PolarHBondContact O-N 3.08Å |
| 236 | Y | 35.8 | Very low | 41.2 | Very low | 235 Ų | 235 | 138.9 Ų | 138.9 | 92% | 0.922 | 77% | 0.767 | S | S | * | * | trans | -70.3 | 92.6 | 171.6 | -85.5 | -89.2 | 0 | 0 | 0 | 109.3 | P234 | P234-Y236 PolarHBondContact O-N 3.36Š| ||
| 237 | T | 39.8 | Very low | 41.4 | Very low | 106 Ų | 106 | 138.5 Ų | 138.5 | 65% | 0.65 | 77% | 0.765 | S | S | * | * | trans | -69.5 | 136.3 | 163.3 | 37.1 | 0 | 0 | 0 | 0 | 109.8 | A235 Y239 | A235-T237 VanDerWaalsContact C-N 3.34Å; A235-T237 PolarHBondContact O-N 3.08Å; T237-Y239 PolarHBondContact O-N 3.13Å | ||
| 238 | N | 47.8 | Very low | 41.1 | Very low | 150 Ų | 150 | 143.6 Ų | 143.6 | 80% | 0.802 | 77% | 0.772 | S | S | * | * | trans | -59.6 | 116.6 | -177.5 | -175.7 | -27.2 | 0 | 0 | 0 | 110.9 | ||||
| 239 | Y | 39.8 | Very low | 41 | Very low | 201 Ų | 201 | 140.1 Ų | 140.1 | 79% | 0.788 | 77% | 0.768 | S | S | * | * | trans | -124.3 | 97.9 | 166.9 | -88.1 | -78.2 | 0 | 0 | 0 | 110.8 | T237 S241 | T237-Y239 PolarHBondContact O-N 3.13Å; Y239-S241 PolarHBondContact O-N 3.48Å | ||
| 240 | N | 49.9 | Very low | 40.9 | Very low | 155 Ų | 155 | 144.3 Ų | 144.3 | 83% | 0.829 | 77% | 0.767 | S | S | * | * | trans | -61.2 | 120.3 | 157.5 | -171.8 | 32.2 | 0 | 0 | 0 | 108.7 | ||||
| 241 | S | 37.5 | Very low | 41.1 | Very low | 98 Ų | 98 | 140.2 Ų | 140.2 | 69% | 0.685 | 77% | 0.765 | S | S | * | * | trans | -141.4 | 135.8 | 178 | -166.7 | 0 | 0 | 0 | 0 | 108.9 | Y239 A243 | Y239-S241 PolarHBondContact O-N 3.48Å; S241-A243 PolarHBondContact O-N 3.02Å | ||
| 242 | P | 48.9 | Very low | 40.8 | Very low | 124 Ų | 124 | 139.9 Ų | 139.9 | 81% | 0.805 | 77% | 0.772 | S | S | * | * | trans | -69.7 | 123.2 | -161.4 | 25.9 | -34.1 | 0 | 0 | 0 | 112 | ||||
| 243 | A | 41.5 | Very low | 41 | Very low | 88 Ų | 88 | 143 Ų | 143 | 73% | 0.727 | 77% | 0.771 | S | S | * | * | trans | -58.2 | 150.8 | 161.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | S241 N245 | S241-A243 PolarHBondContact O-N 3.02Å; A243-N245 PolarHBondContact O-N 3.17Å; A243-N245 VanDerWaalsContact O-N 3.12Å | ||
| 244 | C | 36.4 | Very low | 41 | Very low | 124 Ų | 124 | 141.7 Ų | 141.7 | 84% | 0.838 | 77% | 0.773 | S | S | * | * | trans | -45.7 | 119.8 | 169.8 | 45.2 | 0 | 0 | 0 | 0 | 111.2 | A246 | C244-A246 PolarHBondContact O-N 3.42Š| ||
| 245 | N | 39 | Very low | 40.6 | Very low | 152 Ų | 152 | 143.3 Ų | 143.3 | 81% | 0.813 | 78% | 0.782 | S | S | * | * | trans | -63.8 | 105.4 | -177.5 | -177.4 | -3.1 | 0 | 0 | 0 | 110.3 | A243 N247 | A243-N245 PolarHBondContact O-N 3.17Å; A243-N245 VanDerWaalsContact O-N 3.12Å; N245-N247 PolarHBondContact OD1-N 3.26Å | ||
| 246 | A | 34 | Very low | 40.6 | Very low | 77 Ų | 77 | 148 Ų | 148 | 64% | 0.636 | 79% | 0.79 | S | S | * | * | trans | -121.3 | 85.2 | 163.7 | 0 | 0 | 0 | 0 | 0 | 107 | C244 Y248 | C244-A246 PolarHBondContact O-N 3.42Å; A246-Y248 PolarHBondContact O-N 3.11Å | ||
| 247 | N | 42.6 | Very low | 40.8 | Very low | 133 Ų | 133 | 145.7 Ų | 145.7 | 71% | 0.711 | 79% | 0.788 | S | S | * | * | trans | -59.8 | 101.6 | -177.9 | -173.9 | 17.3 | 0 | 0 | 0 | 111.5 | N245 | N245-N247 PolarHBondContact OD1-N 3.26Š| ||
| 248 | Y | 38.5 | Very low | 41.1 | Very low | 212 Ų | 212 | 146.4 Ų | 146.4 | 83% | 0.831 | 79% | 0.794 | S | S | * | * | trans | -131.3 | 102 | 164.2 | -80.6 | -78.9 | 0 | 0 | 0 | 108.5 | A246 | A246-Y248 PolarHBondContact O-N 3.11Š| ||
| 249 | N | 39.3 | Very low | 40.5 | Very low | 141 Ų | 141 | 145.1 Ų | 145.1 | 75% | 0.754 | 80% | 0.797 | S | S | * | * | trans | -74.4 | 123.9 | 178.5 | -177.1 | 22.3 | 0 | 0 | 0 | 110.6 | ||||
| 250 | Y | 36.3 | Very low | 40.3 | Very low | 208 Ų | 208 | 140.5 Ų | 140.5 | 82% | 0.816 | 80% | 0.8 | S | S | * | * | trans | -137.5 | 131.5 | 161.9 | -99.7 | -86.1 | 0 | 0 | 0 | 108.1 | S252 | Y250-S252 PolarHBondContact O-N 2.94Š| ||
| 251 | P | 46.1 | Very low | 39.8 | Very low | 110 Ų | 110 | 137.9 Ų | 137.9 | 71% | 0.714 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 123.6 | -178.3 | 29.1 | -33.4 | 0 | 0 | 0 | 111.2 | ||
| 252 | S | 40.8 | Very low | 39.7 | Very low | 116 Ų | 116 | 136.8 Ų | 136.8 | 81% | 0.811 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -80.3 | 125.5 | 171.2 | -176 | 0 | 0 | 0 | 0 | 110.4 | Y250 | Y250-S252 PolarHBondContact O-N 2.94Š|
| 253 | M | 41.4 | Very low | 39.4 | Very low | 163 Ų | 163 | 138.1 Ų | 138.1 | 80% | 0.803 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 146 | 168.6 | -77.3 | -78.6 | 109.7 | 0 | 0 | 111.2 | ||
| 254 | Q | 38.3 | Very low | 39.3 | Very low | 188 Ų | 188 | 142 Ų | 142 | 88% | 0.879 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 128.6 | 175.9 | -70.1 | 163.1 | -55.3 | 0 | 0 | 110.6 | ||
| 255 | T | 38.9 | Very low | 39.3 | Very low | 139 Ų | 139 | 145.2 Ų | 145.2 | 85% | 0.853 | 81% | 0.814 | S | S | * | * | trans | -94.8 | 110.6 | 169.6 | 54.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 256 | M | 40.1 | Very low | 39.7 | Very low | 188 Ų | 188 | 146.6 Ų | 146.6 | 93% | 0.926 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 145 | 173 | -77 | -148.8 | 161.9 | 0 | 0 | 112.3 | ||
| 257 | Q | 39.8 | Very low | 39.9 | Very low | 186 Ų | 186 | 149.2 Ų | 149.2 | 87% | 0.869 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -99.9 | 121 | -174.5 | 176.2 | -178.3 | -23.9 | 0 | 0 | 109.8 | ||
| 258 | P | 46 | Very low | 39.7 | Very low | 122 Ų | 122 | 152.3 Ų | 152.3 | 79% | 0.792 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -78 | 131.1 | 173.1 | -11.4 | 27.9 | 0 | 0 | 0 | 110.9 | ||
| 259 | S | 34.6 | Very low | 39.8 | Very low | 122 Ų | 122 | 145.2 Ų | 145.2 | 85% | 0.853 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 134.2 | 169.6 | -168.9 | 0 | 0 | 0 | 0 | 109.9 | ||
| 260 | A | 36.9 | Very low | 39.6 | Very low | 104 Ų | 104 | 145.9 Ų | 145.9 | 86% | 0.86 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -102 | 121.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 261 | A | 38.6 | Very low | 39.6 | Very low | 101 Ų | 101 | 139.3 Ų | 139.3 | 84% | 0.835 | 82% | 0.824 | S | S | * | * | trans | -150 | 143.1 | 169.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 262 | G | 35 | Very low | 39.3 | Very low | 75 Ų | 75 | 141.6 Ų | 141.6 | 77% | 0.773 | 83% | 0.83 | S | S | * | * | trans | 91.8 | 94.4 | 160.4 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 263 | N | 44.2 | Very low | 39.3 | Very low | 151 Ų | 151 | 143.7 Ų | 143.7 | 81% | 0.807 | 83% | 0.831 | S | S | * | * | trans | -6.4 | 136.1 | 150 | -54 | -38.9 | 0 | 0 | 0 | 118.4 | ||||
| 264 | N | 38.2 | Very low | 39 | Very low | 169 Ų | 169 | 142.8 Ų | 142.8 | 90% | 0.904 | 83% | 0.829 | S | S | * | * | -160 | 135 | 126.7 | -97 | -45 | 0 | 0 | 0 | 111.6 | |||||
| 265 | F | 37.8 | Very low | 39 | Very low | 193 Ų | 193 | 139.1 Ų | 139.1 | 85% | 0.846 | 83% | 0.825 | S | S | * | * | trans | -81.7 | 141.7 | 174.3 | -90.5 | -112.3 | 0 | 0 | 0 | 110.7 | ||||
| 266 | M | 46.8 | Very low | 38.9 | Very low | 180 Ų | 180 | 139 Ų | 139 | 89% | 0.887 | 82% | 0.823 | S | S | * | * | trans | -144.5 | 132.2 | 133 | -78.2 | -154 | 175.9 | 0 | 0 | 110.3 | ||||
| 267 | N | 37.8 | Very low | 38.7 | Very low | 133 Ų | 133 | 138.2 Ų | 138.2 | 71% | 0.711 | 82% | 0.818 | S | S | * | * | trans | -108.1 | 130.1 | -179 | 165.9 | 35.6 | 0 | 0 | 0 | 108.8 | ||||
| 268 | F | 38.7 | Very low | 38.7 | Very low | 198 Ų | 198 | 135.7 Ų | 135.7 | 87% | 0.868 | 82% | 0.815 | S | S | * | * | trans | -142.7 | 119.4 | 158.8 | -79 | -75 | 0 | 0 | 0 | 110.1 | ||||
| 269 | G | 40.1 | Very low | 38.7 | Very low | 62 Ų | 62 | 135.6 Ų | 135.6 | 64% | 0.639 | 81% | 0.814 | S | S | * | * | trans | -142.5 | 127.7 | 169.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 270 | V | 36.3 | Very low | 39.2 | Very low | 156 Ų | 156 | 137.4 Ų | 137.4 | 95% | 0.945 | 81% | 0.813 | S | S | * | * | trans | -172.9 | 142 | 161.6 | -94.5 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 271 | G | 36 | Very low | 39.8 | Very low | 70 Ų | 70 | 138.1 Ų | 138.1 | 72% | 0.722 | 81% | 0.809 | S | S | * | * | cis | -166.3 | 179.2 | -2.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 272 | D | 38.4 | Very low | 40 | Very low | 158 Ų | 158 | 143 Ų | 143 | 85% | 0.845 | 81% | 0.814 | S | S | * | * | trans | -57.4 | 157.2 | -172.6 | -63.5 | -98.6 | 0 | 0 | 0 | 117.3 | ||||
| 273 | L | 41.9 | Very low | 39.9 | Very low | 159 Ų | 159 | 142.9 Ų | 142.9 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | -169 | 137.5 | 117.2 | -100.1 | 161.5 | 0 | 0 | 0 | 113.4 | |||||
| 274 | N | 35.6 | Very low | 39.6 | Very low | 144 Ų | 144 | 143.7 Ų | 143.7 | 77% | 0.77 | 82% | 0.817 | S | S | * | * | trans | -4.9 | 155.6 | 151.5 | -76.5 | -61 | 0 | 0 | 0 | 120.1 | ||||
| 275 | S | 36.5 | Very low | 40.2 | Very low | 112 Ų | 112 | 140.9 Ų | 140.9 | 78% | 0.783 | 82% | 0.818 | S | S | * | * | cis | -161.4 | 164.4 | 17.3 | 22.2 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 276 | V | 38.4 | Very low | 40.2 | Very low | 135 Ų | 135 | 134.9 Ų | 134.9 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | trans | -76.5 | 148.3 | 169.7 | 173.3 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 277 | Q | 34.8 | Very low | 40.2 | Very low | 173 Ų | 173 | 134 Ų | 134 | 81% | 0.808 | 81% | 0.808 | S | S | * | * | 142.6 | 109 | 130 | -166.5 | 149.8 | 21.1 | 0 | 0 | 115.8 | |||||
| 278 | T | 39.5 | Very low | 40.5 | Very low | 132 Ų | 132 | 133.3 Ų | 133.3 | 81% | 0.81 | 81% | 0.813 | S | S | * | * | trans | -143.6 | 132.2 | 154.2 | 47.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 279 | P | 46.8 | Very low | 40.9 | Very low | 121 Ų | 121 | 128.6 Ų | 128.6 | 79% | 0.786 | 80% | 0.8 | S | S | * | * | trans | -92.7 | 143.7 | 179.9 | 34.4 | -32.5 | 0 | 0 | 0 | 112.8 | ||||
| 280 | I | 44 | Very low | 41.5 | Very low | 159 Ų | 159 | 134.1 Ų | 134.1 | 82% | 0.815 | 81% | 0.814 | S | S | * | * | trans | -121.1 | 131.8 | 168.3 | -63.9 | 177.6 | 0 | 0 | 0 | 107.7 | ||||
| 281 | P | 49.6 | Very low | 42.1 | Very low | 120 Ų | 120 | 134.8 Ų | 134.8 | 78% | 0.779 | 81% | 0.807 | S | S | * | * | trans | -76.9 | 153.7 | -172.1 | 30.4 | -35.6 | 0 | 0 | 0 | 113.9 | ||||
| 282 | Q | 43.7 | Very low | 42.5 | Very low | 204 Ų | 204 | 134.6 Ų | 134.6 | 95% | 0.953 | 81% | 0.805 | S | S | * | * | trans | -68.1 | 146.5 | 173.9 | -66.8 | 173.1 | -42.8 | 0 | 0 | 112 | ||||
| 283 | G | 33.5 | Very low | 42.9 | Very low | 72 Ų | 72 | 135.4 Ų | 135.4 | 74% | 0.742 | 81% | 0.807 | S | S | * | * | trans | -158.8 | 92.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 284 | N | 38.2 | Very low | 43.5 | Very low | 168 Ų | 168 | 138.3 Ų | 138.3 | 90% | 0.898 | 81% | 0.807 | S | S | * | * | trans | 53.1 | 127 | 160.4 | -73.6 | 12.1 | 0 | 0 | 0 | 121.9 | G286 | N284-G286 PolarHBondContact O-N 3.26Š| ||
| 285 | A | 48.9 | Very low | 43.9 | Very low | 110 Ų | 110 | 136 Ų | 136 | 91% | 0.909 | 81% | 0.808 | S | S | * | * | trans | -61.9 | 125.8 | 161.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 286 | G | 39.7 | Very low | 44.8 | Very low | 67 Ų | 67 | 146 Ų | 146 | 69% | 0.691 | 83% | 0.829 | S | S | * | * | trans | -111.7 | 121.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | N284 S288 | N284-G286 PolarHBondContact O-N 3.26Å; G286-S288 PolarHBondContact O-N 3.39Å | ||
| 287 | I | 46.7 | Very low | 45.1 | Very low | 162 Ų | 162 | 146.6 Ų | 146.6 | 83% | 0.831 | 83% | 0.829 | S | S | * | * | trans | -67.7 | 110.9 | -176.2 | -57.9 | 160.9 | 0 | 0 | 0 | 109.8 | T289 | I287-T289 PolarHBondContact O-N 3.26Š| ||
| 288 | S | 42.7 | Very low | 45.6 | Very low | 117 Ų | 117 | 145.2 Ų | 145.2 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | trans | -70.7 | 98 | 175.6 | -81.4 | 0 | 0 | 0 | 0 | 111.4 | G286 L290 | G286-S288 PolarHBondContact O-N 3.39Å; S288-L290 PolarHBondContact O-N 3.16Å | ||
| 289 | T | 47.8 | Very low | 46 | Very low | 100 Ų | 100 | 145.9 Ų | 145.9 | 61% | 0.613 | 83% | 0.832 | S | S | * | * | trans | -76.5 | 114 | 169.4 | 56.2 | 0 | 0 | 0 | 0 | 110.1 | I287 H291 | I287-T289 PolarHBondContact O-N 3.26Å; T289-H291 PolarHBondContact O-N 3Å; T289-H291 PolarHBondContact OG1-ND1 3.23Å | ||
| 290 | L | 51.7 | Low | 45.9 | Very low | 178 Ų | 178 | 147.4 Ų | 147.4 | 93% | 0.932 | 83% | 0.834 | S | S | * | * | trans | -69.1 | 77.5 | 174.7 | -83.9 | 164.9 | 0 | 0 | 0 | 111.3 | S288 G292 | S288-L290 PolarHBondContact O-N 3.16Å; L290-G292 PolarHBondContact O-N 2.93Å | ||
| 291 | H | 50.7 | Low | 46 | Very low | 170 Ų | 170 | 146.7 Ų | 146.7 | 79% | 0.787 | 84% | 0.836 | S | S | * | * | trans | -81.2 | 114.4 | 172.5 | -91.2 | 92 | 0 | 0 | 0 | 111.7 | T289 | T289-H291 PolarHBondContact O-N 3Å; T289-H291 PolarHBondContact OG1-ND1 3.23Å | ||
| 292 | G | 42.8 | Very low | 45.8 | Very low | 66 Ų | 66 | 148.5 Ų | 148.5 | 68% | 0.68 | 84% | 0.839 | S | S | * | * | trans | 91.8 | 57.1 | 144.5 | 0 | 0 | 0 | 0 | 0 | 118.2 | L290 R294 | L290-G292 PolarHBondContact O-N 2.93Å; G292-R294 PolarHBondContact O-N 3.34Å | ||
| 293 | I | 48.2 | Very low | 46 | Very low | 174 Ų | 174 | 144.5 Ų | 144.5 | 89% | 0.892 | 83% | 0.831 | S | S | * | * | trans | -68.3 | 89 | 154 | -59.1 | 170.1 | 0 | 0 | 0 | 108.2 | A295 | I293-A295 PolarHBondContact O-N 3.36Š| ||
| 294 | R | 54.3 | Low | 46.9 | Very low | 221 Ų | 221 | 150.1 Ų | 150.1 | 83% | 0.834 | 84% | 0.838 | S | S | * | * | trans | -81.8 | 105.7 | 162.7 | -87.6 | -178.1 | 175.4 | -101.2 | -0.4 | 108.7 | G292 | G292-R294 PolarHBondContact O-N 3.34Š| ||
| 295 | A | 44.1 | Very low | 47.6 | Very low | 95 Ų | 95 | 148.6 Ų | 148.6 | 79% | 0.785 | 83% | 0.833 | S | S | * | * | trans | -58.1 | 139.6 | 161.8 | 0 | 0 | 0 | 0 | 0 | 110 | I293 | I293-A295 PolarHBondContact O-N 3.36Š| ||
| 296 | W | 54.2 | Low | 47.5 | Very low | 323 Ų | 323 | 152.1 Ų | 152.1 | 100% | 1.223 | 83% | 0.826 | S | S | * | * | trans | -96.9 | 0 | 176.5 | -75.3 | 75.5 | 0 | 0 | 0 | 110.8 |
Retrieved 296 of 296 residues in 205.6 ms
(Link to these results)