| 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 | 41.6 | Very low | 41.8 | Very low | 233 Ų | 233 | 152.5 Ų | 152.5 | 100% | 1.148 | 83% | 0.831 | S | S | * | * | 0 | 110 | 0 | -74.7 | 174.8 | 67.1 | 0 | 0 | 108.7 | |||||
| 2 | L | 38.4 | Very low | 42.2 | Very low | 180 Ų | 180 | 152.6 Ų | 152.6 | 94% | 0.942 | 83% | 0.83 | S | S | * | * | trans | -139 | 110.4 | 163.1 | -84.7 | 111.6 | 0 | 0 | 0 | 107.4 | ||||
| 3 | R | 41.9 | Very low | 42.5 | Very low | 248 Ų | 248 | 158.8 Ų | 158.8 | 94% | 0.936 | 83% | 0.834 | S | S | * | * | trans | -93.5 | 121.4 | 170.5 | -76.4 | -175.6 | 178.6 | -179.2 | 0.1 | 107.8 | A5 | R3-A5 PolarHBondContact O-N 2.9Š| ||
| 4 | S | 43.1 | Very low | 43 | Very low | 127 Ų | 127 | 157.6 Ų | 157.6 | 89% | 0.888 | 83% | 0.829 | S | S | * | * | trans | -67.5 | 114.4 | 173 | -16.6 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 5 | A | 41.8 | Very low | 43.3 | Very low | 92 Ų | 92 | 155.7 Ų | 155.7 | 76% | 0.76 | 83% | 0.829 | S | S | * | * | trans | -92.4 | 112.7 | 168.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | R3 I7 | R3-A5 PolarHBondContact O-N 2.9Å; A5-I7 PolarHBondContact O-N 2.86Å | ||
| 6 | A | 39.3 | Very low | 43.7 | Very low | 103 Ų | 103 | 152.8 Ų | 152.8 | 85% | 0.851 | 81% | 0.813 | S | S | * | * | trans | -65.3 | 118.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | Y8 | A6-Y8 PolarHBondContact O-N 2.71Š| ||
| 7 | I | 43.2 | Very low | 44.2 | Very low | 153 Ų | 153 | 148.8 Ų | 148.8 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | -76.5 | 108.3 | 170.3 | -61.5 | 173.2 | 0 | 0 | 0 | 106.5 | A5 C9 | A5-I7 PolarHBondContact O-N 2.86Å; I7-C9 PolarHBondContact O-N 2.79Å | ||
| 8 | Y | 38.3 | Very low | 44.6 | Very low | 204 Ų | 204 | 149.6 Ų | 149.6 | 80% | 0.8 | 80% | 0.798 | S | S | * | * | trans | -71.5 | 104.8 | 174.4 | -178.1 | -95.7 | 0 | 0 | 0 | 109.4 | A6 P10 | A6-Y8 PolarHBondContact O-N 2.71Å; Y8-P10 HydrophobicContact CE1-CB 4.27Å | ||
| 9 | C | 39.5 | Very low | 44.9 | Very low | 89 Ų | 89 | 152 Ų | 152 | 60% | 0.601 | 80% | 0.795 | S | S | * | * | trans | -85.9 | 122.2 | 166.5 | -69.2 | 0 | 0 | 0 | 0 | 109.1 | I7 I11 | I7-C9 PolarHBondContact O-N 2.79Å; C9-I11 PolarHBondContact O-N 2.96Å | ||
| 10 | P | 48.1 | Very low | 45.1 | Very low | 113 Ų | 113 | 149.5 Ų | 149.5 | 73% | 0.734 | 78% | 0.779 | S | S | * | * | trans | -79.1 | 92.4 | 169.2 | 30.7 | -27.5 | 0 | 0 | 0 | 108.6 | Y8 | Y8-P10 HydrophobicContact CE1-CB 4.27Š| ||
| 11 | I | 44.4 | Very low | 45.5 | Very low | 136 Ų | 136 | 148.6 Ų | 148.6 | 70% | 0.697 | 77% | 0.771 | S | S | * | * | trans | -74.1 | 130.2 | 166 | -65.6 | 174.9 | 0 | 0 | 0 | 108.4 | C9 | C9-I11 PolarHBondContact O-N 2.96Š| ||
| 12 | N | 46.9 | Very low | 45.9 | Very low | 153 Ų | 153 | 143 Ų | 143 | 82% | 0.818 | 75% | 0.745 | S | S | * | * | trans | 44.1 | 92.1 | 158 | -60.2 | -27.5 | 0 | 0 | 0 | 117.4 | ||||
| 13 | R | 45.7 | Very low | 46.5 | Very low | 233 Ų | 233 | 142.4 Ų | 142.4 | 88% | 0.879 | 73% | 0.73 | S | S | * | * | trans | -106.4 | 123.7 | 147.6 | -89 | -174.2 | 168.4 | 173.7 | -2.8 | 108.3 | ||||
| 14 | D | 50.1 | Low | 46.9 | Very low | 143 Ų | 143 | 134.3 Ų | 134.3 | 77% | 0.765 | 72% | 0.717 | S | S | * | * | trans | -49.7 | 141 | 165.5 | -69.7 | -45.6 | 0 | 0 | 0 | 109.5 | L16 | D14-L16 PolarHBondContact O-N 3.32Š| ||
| 15 | P | 47.7 | Very low | 47.3 | Very low | 128 Ų | 128 | 134.5 Ų | 134.5 | 83% | 0.831 | 71% | 0.706 | S | S | * | * | trans | -65.8 | 102.5 | 178.8 | 26.9 | -32 | 0 | 0 | 0 | 108.4 | S17 | P15-S17 PolarHBondContact O-N 3.18Š| ||
| 16 | L | 49.4 | Very low | 47.3 | Very low | 109 Ų | 109 | 136.7 Ų | 136.7 | 57% | 0.571 | 71% | 0.705 | S | S | * | * | trans | -56.9 | 132.3 | 170.4 | -73.4 | 168.9 | 0 | 0 | 0 | 108.2 | D14 Q18 | D14-L16 PolarHBondContact O-N 3.32Å; L16-Q18 PolarHBondContact O-N 3.35Å | ||
| 17 | S | 52.1 | Low | 47.7 | Very low | 85 Ų | 85 | 142.7 Ų | 142.7 | 59% | 0.594 | 71% | 0.706 | S | S | * | * | trans | -49.8 | 134.4 | 173.5 | 178.7 | 0 | 0 | 0 | 0 | 109.4 | P15 R19 E20 | P15-S17 PolarHBondContact O-N 3.18Å; S17-R19 PolarHBondContact O-N 3.38Å; S17-E20 PolarHBondContact O-N 3.23Å | ||
| 18 | Q | 51.7 | Low | 47.7 | Very low | 164 Ų | 164 | 140 Ų | 140 | 77% | 0.766 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -46.4 | -15.2 | 179.1 | -70 | -179.1 | -13.1 | 0 | 0 | 115.1 | L16 E20 | L16-Q18 PolarHBondContact O-N 3.35Å; Q18-E20 VanDerWaalsContact C-N 3.32Å; Q18-E20 PolarHBondContact O-N 3.38Å |
| 19 | R | 49.3 | Very low | 48.1 | Very low | 195 Ų | 195 | 136.7 Ų | 136.7 | 74% | 0.736 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -68.3 | -23.7 | 174.9 | -162.2 | 173.1 | -172.6 | 176.7 | 1.2 | 114.2 | S17 | S17-R19 PolarHBondContact O-N 3.38Å |
| 20 | E | 50.3 | Low | 47.9 | Very low | 101 Ų | 101 | 138.1 Ų | 138.1 | 47% | 0.472 | 71% | 0.713 | S | S | . | * | H | α-helix | trans | -93.5 | -33.7 | -174.7 | -138.3 | 126.5 | -139.3 | 0 | 0 | 112.6 | S17 Q18 L22 R23 | S17-E20 PolarHBondContact O-N 3.23Å; Q18-E20 VanDerWaalsContact C-N 3.32Å; Q18-E20 PolarHBondContact O-N 3.38Å; E20-L22 VanDerWaalsContact C-N 3.29Å; E20-L22 PolarHBondContact O-N 3.03Å; E20-R23 PolarHBondContact O-N 3.32Å |
| 21 | E | 51.8 | Low | 47.2 | Very low | 132 Ų | 132 | 140.4 Ų | 140.4 | 62% | 0.617 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -62.2 | -34.2 | 174.9 | -75.5 | -168.7 | 151.7 | 0 | 0 | 112.7 | R23 A24 I25 | E21-R23 PolarHBondContact O-N 3.05Å; E21-A24 PolarHBondContact O-N 3.11Å; E21-I25 PolarHBondContact O-N 2.93Å |
| 22 | L | 49.9 | Very low | 47.1 | Very low | 116 Ų | 116 | 140.7 Ų | 140.7 | 61% | 0.607 | 73% | 0.727 | S | S | * | * | H | α-helix | trans | -69.8 | -17.4 | 178.8 | -69.8 | 169 | 0 | 0 | 0 | 114 | E20 N26 | E20-L22 VanDerWaalsContact C-N 3.29Å; E20-L22 PolarHBondContact O-N 3.03Å; L22-N26 PolarHBondContact O-ND2 2.78Å; L22-N26 VanDerWaalsContact O-ND2 3.1Å |
| 23 | R | 51.9 | Low | 46.4 | Very low | 167 Ų | 167 | 136.5 Ų | 136.5 | 63% | 0.63 | 72% | 0.72 | S | S | * | * | H | α-helix | trans | -84 | -29.5 | 172.9 | -77.4 | -173.9 | -164.7 | 158.7 | 4.1 | 112.8 | E20 E21 | E20-R23 PolarHBondContact O-N 3.32Å; E21-R23 PolarHBondContact O-N 3.05Å |
| 24 | A | 49.7 | Very low | 46 | Very low | 78 Ų | 78 | 130 Ų | 130 | 65% | 0.645 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -73.1 | -31.8 | -180 | 0 | 0 | 0 | 0 | 0 | 112 | E21 | E21-A24 PolarHBondContact O-N 3.11Å |
| 25 | I | 51.2 | Low | 45.2 | Very low | 131 Ų | 131 | 133.9 Ų | 133.9 | 67% | 0.672 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | -23.2 | -177.9 | -61.1 | 169.3 | 0 | 0 | 0 | 112.5 | E21 | E21-I25 PolarHBondContact O-N 2.93Š|
| 26 | N | 43.5 | Very low | 44.5 | Very low | 137 Ų | 137 | 137.1 Ų | 137.1 | 73% | 0.733 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | 5.1 | -177.8 | -78.8 | -54.3 | 0 | 0 | 0 | 114.9 | L22 | L22-N26 PolarHBondContact O-ND2 2.78Å; L22-N26 VanDerWaalsContact O-ND2 3.1Å |
| 27 | R | 47.8 | Very low | 43.6 | Very low | 229 Ų | 229 | 138.7 Ų | 138.7 | 86% | 0.864 | 73% | 0.734 | S | S | * | * | trans | -109.4 | 67.4 | 172.4 | -80.4 | -167.7 | -177.1 | -157.1 | 2.1 | 111 | ||||
| 28 | S | 43.1 | Very low | 42.7 | Very low | 97 Ų | 97 | 142 Ų | 142 | 68% | 0.678 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -156.5 | 136.4 | 157.3 | -171.2 | 0 | 0 | 0 | 0 | 109 | ||
| 29 | T | 45.2 | Very low | 41.7 | Very low | 134 Ų | 134 | 141.3 Ų | 141.3 | 82% | 0.822 | 75% | 0.747 | S | S | * | * | trans | 76.8 | 71.4 | 180 | 80 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 30 | S | 35.3 | Very low | 41 | Very low | 119 Ų | 119 | 139.3 Ų | 139.3 | 83% | 0.832 | 75% | 0.751 | S | S | * | * | trans | -132.9 | 80.2 | 141.9 | 66.6 | 0 | 0 | 0 | 0 | 108.4 | T32 | S30-T32 PolarHBondContact O-N 3.24Š| ||
| 31 | N | 34.1 | Very low | 40.2 | Very low | 161 Ų | 161 | 141.1 Ų | 141.1 | 86% | 0.861 | 76% | 0.764 | S | S | * | * | trans | -65.3 | 121.7 | 165.2 | -93.9 | -6.1 | 0 | 0 | 0 | 108.6 | ||||
| 32 | T | 43.5 | Very low | 39.5 | Very low | 143 Ų | 143 | 142 Ų | 142 | 88% | 0.877 | 77% | 0.773 | S | S | * | * | trans | -4.8 | 116.9 | 150.8 | -24.9 | 0 | 0 | 0 | 0 | 116 | S30 | S30-T32 PolarHBondContact O-N 3.24Š| ||
| 33 | G | 32.2 | Very low | 38.7 | Very low | 64 Ų | 64 | 144.3 Ų | 144.3 | 66% | 0.66 | 79% | 0.786 | S | S | * | * | trans | -164.5 | 69.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | Y35 | G33-Y35 PolarHBondContact O-N 3.37Š| ||
| 34 | A | 37.2 | Very low | 38 | Very low | 98 Ų | 98 | 141.4 Ų | 141.4 | 81% | 0.81 | 79% | 0.791 | S | S | * | * | trans | -71.6 | 106 | 172.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 35 | Y | 31.4 | Very low | 37.3 | Very low | 223 Ų | 223 | 147 Ų | 147 | 88% | 0.875 | 80% | 0.8 | S | S | * | * | trans | -122.2 | 101.1 | 158.5 | -77.5 | -79.4 | 0 | 0 | 0 | 108.3 | G33 | G33-Y35 PolarHBondContact O-N 3.37Š| ||
| 36 | H | 34.8 | Very low | 36.4 | Very low | 196 Ų | 196 | 150.4 Ų | 150.4 | 91% | 0.907 | 81% | 0.811 | S | S | * | * | trans | -65.8 | 125.4 | 158.2 | -84.1 | -24.7 | 0 | 0 | 0 | 108.4 | ||||
| 37 | N | 29.7 | Very low | 35.8 | Very low | 143 Ų | 143 | 152.8 Ų | 152.8 | 77% | 0.765 | 82% | 0.818 | S | S | * | * | trans | -130.8 | 92.6 | 157.6 | -160.1 | -1.4 | 0 | 0 | 0 | 108.7 | ||||
| 38 | N | 32.6 | Very low | 34.9 | Very low | 154 Ų | 154 | 145.2 Ų | 145.2 | 82% | 0.824 | 81% | 0.811 | S | S | * | * | trans | -76.8 | 110.5 | 165.1 | -108.4 | -16.5 | 0 | 0 | 0 | 106.8 | ||||
| 39 | N | 31.4 | Very low | 34.4 | Very low | 150 Ų | 150 | 145.8 Ų | 145.8 | 80% | 0.802 | 82% | 0.821 | S | S | * | * | trans | -117.6 | 86.7 | 161.8 | -125.4 | 1.7 | 0 | 0 | 0 | 109.8 | ||||
| 40 | N | 33.5 | Very low | 33.8 | Very low | 152 Ų | 152 | 143 Ų | 143 | 81% | 0.813 | 82% | 0.82 | S | S | * | * | trans | -83.9 | 95.3 | 169.8 | -161.1 | 22.1 | 0 | 0 | 0 | 106.9 | ||||
| 41 | N | 35.3 | Very low | 33.9 | Very low | 140 Ų | 140 | 143.5 Ų | 143.5 | 75% | 0.749 | 82% | 0.818 | S | S | * | * | trans | -173.2 | 110.5 | 157.7 | -116.2 | -10.3 | 0 | 0 | 0 | 110.4 | ||||
| 42 | N | 35.5 | Very low | 34.2 | Very low | 150 Ų | 150 | 140.3 Ų | 140.3 | 80% | 0.802 | 81% | 0.808 | S | S | * | * | 173.5 | 81.7 | 125.5 | -82.1 | -20.2 | 0 | 0 | 0 | 108.7 | S44 | N42-S44 VanDerWaalsContact C-N 3.3Å; N42-S44 PolarHBondContact O-N 3.4Å | |||
| 43 | N | 33.8 | Very low | 33.8 | Very low | 165 Ų | 165 | 143.6 Ų | 143.6 | 88% | 0.882 | 80% | 0.804 | S | S | * | * | trans | -84.2 | 77.2 | 165.2 | -148.6 | 15.4 | 0 | 0 | 0 | 107.5 | ||||
| 44 | S | 38.2 | Very low | 33.9 | Very low | 105 Ų | 105 | 150.5 Ų | 150.5 | 73% | 0.734 | 81% | 0.812 | S | S | * | * | trans | -98.8 | 96.3 | 168.4 | 64 | 0 | 0 | 0 | 0 | 108.9 | N42 F46 | N42-S44 VanDerWaalsContact C-N 3.3Å; N42-S44 PolarHBondContact O-N 3.4Å; S44-F46 PolarHBondContact O-N 3.48Å | ||
| 45 | K | 33.1 | Very low | 33.9 | Very low | 195 Ų | 195 | 152.1 Ų | 152.1 | 85% | 0.848 | 81% | 0.807 | S | S | * | * | trans | -51.6 | 125.1 | 158.4 | -78.8 | 176.9 | 171.8 | -178.2 | 0 | 109.3 | ||||
| 46 | F | 32.4 | Very low | 34.1 | Very low | 204 Ų | 204 | 150 Ų | 150 | 90% | 0.895 | 81% | 0.805 | S | S | * | * | trans | -143.5 | 114.6 | 151.6 | -145 | -93.9 | 0 | 0 | 0 | 108.3 | S44 | S44-F46 PolarHBondContact O-N 3.48Š| ||
| 47 | E | 31.7 | Very low | 34.2 | Very low | 186 Ų | 186 | 148.4 Ų | 148.4 | 87% | 0.869 | 80% | 0.801 | S | S | * | * | trans | -75.4 | 145.3 | 171.6 | -75.8 | -178.4 | 141.2 | 0 | 0 | 110.5 | ||||
| 48 | G | 29.9 | Very low | 34.8 | Very low | 71 Ų | 71 | 147.1 Ų | 147.1 | 73% | 0.732 | 80% | 0.799 | S | S | * | * | trans | 92.4 | 137.8 | 140.6 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 49 | A | 31.8 | Very low | 35.1 | Very low | 108 Ų | 108 | 148.2 Ų | 148.2 | 89% | 0.893 | 80% | 0.799 | S | S | * | * | trans | 82.1 | 112.5 | 164.2 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 50 | G | 32.9 | Very low | 35.5 | Very low | 77 Ų | 77 | 147.3 Ų | 147.3 | 79% | 0.794 | 80% | 0.799 | S | S | * | * | trans | -72.5 | 151.8 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 51 | V | 37 | Very low | 36.2 | Very low | 129 Ų | 129 | 144.2 Ų | 144.2 | 78% | 0.782 | 80% | 0.795 | S | S | * | * | trans | -145.3 | 121.2 | 157.2 | 178.9 | 0 | 0 | 0 | 0 | 108.1 | R53 | V51-R53 PolarHBondContact O-N 2.84Š| ||
| 52 | S | 39.8 | Very low | 36.9 | Very low | 93 Ų | 93 | 144.6 Ų | 144.6 | 65% | 0.65 | 80% | 0.796 | S | S | * | * | trans | -43.1 | 122.7 | 165.2 | -168.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 53 | R | 35.3 | Very low | 37.7 | Very low | 213 Ų | 213 | 146.8 Ų | 146.8 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -123.5 | 87.8 | 164.7 | -75.6 | -162.1 | -89.9 | -168.3 | -5.2 | 109.4 | V51 N55 | V51-R53 PolarHBondContact O-N 2.84Å; R53-N55 PolarHBondContact O-N 3.39Å | ||
| 54 | Y | 35.5 | Very low | 38.1 | Very low | 208 Ų | 208 | 141.8 Ų | 141.8 | 82% | 0.816 | 79% | 0.786 | S | S | * | * | trans | -55.3 | 110.2 | 142.9 | -78.6 | -94.9 | 0 | 0 | 0 | 107 | ||||
| 55 | N | 37.3 | Very low | 38.8 | Very low | 132 Ų | 132 | 143.1 Ų | 143.1 | 71% | 0.706 | 79% | 0.793 | S | S | * | * | trans | -99.3 | 101.2 | 160.9 | -80.3 | -10.4 | 0 | 0 | 0 | 106.9 | R53 I57 | R53-N55 PolarHBondContact O-N 3.39Å; N55-I57 PolarHBondContact O-N 3.31Å | ||
| 56 | E | 34.8 | Very low | 39.4 | Very low | 179 Ų | 179 | 141.2 Ų | 141.2 | 84% | 0.836 | 79% | 0.79 | S | S | * | * | trans | -45.7 | 116.4 | 153.1 | -69.2 | 175.5 | 146 | 0 | 0 | 108.6 | ||||
| 57 | I | 37.9 | Very low | 40 | Very low | 162 Ų | 162 | 135.6 Ų | 135.6 | 83% | 0.831 | 78% | 0.781 | S | S | * | * | trans | -96.4 | 99.5 | 156.2 | -64.4 | 176 | 0 | 0 | 0 | 105.6 | N55 | N55-I57 PolarHBondContact O-N 3.31Š| ||
| 58 | T | 41.1 | Very low | 40.6 | Very low | 117 Ų | 117 | 132.2 Ų | 132.2 | 72% | 0.718 | 77% | 0.773 | S | S | * | * | trans | -35.1 | 130.5 | 163 | -49.6 | 0 | 0 | 0 | 0 | 111.5 | T60 | T58-T60 PolarHBondContact O-N 3.03Š| ||
| 59 | Q | 39.6 | Very low | 41.4 | Very low | 176 Ų | 176 | 140.6 Ų | 140.6 | 82% | 0.822 | 78% | 0.783 | S | S | * | * | trans | -55.2 | 117.1 | 178.6 | -59.3 | 171.9 | 8 | 0 | 0 | 111.2 | ||||
| 60 | T | 39.2 | Very low | 41.9 | Very low | 131 Ų | 131 | 143 Ų | 143 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | trans | -93.9 | 94.7 | 146.4 | 46.5 | 0 | 0 | 0 | 0 | 107 | T58 L62 | T58-T60 PolarHBondContact O-N 3.03Å; T60-L62 PolarHBondContact O-N 3.41Å | ||
| 61 | A | 48.8 | Very low | 42.4 | Very low | 87 Ų | 87 | 144.4 Ų | 144.4 | 72% | 0.719 | 78% | 0.778 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.9 | 61.2 | -178 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 62 | L | 50.2 | Low | 42.9 | Very low | 148 Ų | 148 | 145.8 Ų | 145.8 | 78% | 0.775 | 78% | 0.78 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -143 | -11 | 169.4 | -105.1 | 122.8 | 0 | 0 | 0 | 116.2 | T60 | T60-L62 PolarHBondContact O-N 3.41Š|
| 63 | F | 50.5 | Low | 43.3 | Very low | 196 Ų | 196 | 152.7 Ų | 152.7 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | -145.2 | 76 | 170.8 | -70.7 | -80 | 0 | 0 | 0 | 111.3 | ||||
| 64 | G | 42.7 | Very low | 44.1 | Very low | 61 Ų | 61 | 154.8 Ų | 154.8 | 63% | 0.629 | 80% | 0.799 | S | S | * | * | trans | -70 | 151.5 | 163.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | I66 | G64-I66 PolarHBondContact O-N 3.34Å; G64-I66 VanDerWaalsContact O-N 3.14Å | ||
| 65 | P | 54.5 | Low | 44.3 | Very low | 133 Ų | 133 | 148.4 Ų | 148.4 | 86% | 0.864 | 80% | 0.797 | S | S | * | * | trans | -61.9 | 119.6 | 172.8 | 25.3 | -31.2 | 0 | 0 | 0 | 109 | A67 | P65-A67 PolarHBondContact O-N 3.14Š| ||
| 66 | I | 44.7 | Very low | 44.7 | Very low | 154 Ų | 154 | 148.8 Ų | 148.8 | 79% | 0.79 | 80% | 0.804 | S | S | * | * | trans | -59.2 | 109.7 | 172.4 | -63.3 | 170.5 | 0 | 0 | 0 | 107 | G64 T68 | G64-I66 PolarHBondContact O-N 3.34Å; G64-I66 VanDerWaalsContact O-N 3.14Å; I66-T68 VanDerWaalsContact C-N 3.28Å; I66-T68 PolarHBondContact O-N 3.26Å | ||
| 67 | A | 44.4 | Very low | 44.8 | Very low | 87 Ų | 87 | 148.7 Ų | 148.7 | 72% | 0.719 | 81% | 0.806 | S | S | * | * | trans | -62 | 95.5 | 166.5 | 0 | 0 | 0 | 0 | 0 | 107.4 | P65 R69 | P65-A67 PolarHBondContact O-N 3.14Å; A67-R69 PolarHBondContact O-N 3.38Å | ||
| 68 | T | 44.5 | Very low | 45 | Very low | 114 Ų | 114 | 152.5 Ų | 152.5 | 70% | 0.699 | 81% | 0.81 | S | S | * | * | trans | -59.6 | 132.8 | 166.4 | 51.8 | 0 | 0 | 0 | 0 | 107.5 | I66 N70 | I66-T68 VanDerWaalsContact C-N 3.28Å; I66-T68 PolarHBondContact O-N 3.26Å; T68-N70 VanDerWaalsContact C-N 3.25Å; T68-N70 PolarHBondContact O-N 3.35Å | ||
| 69 | R | 46.8 | Very low | 45 | Very low | 248 Ų | 248 | 150.1 Ų | 150.1 | 94% | 0.936 | 81% | 0.809 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.7 | 79.8 | -176.7 | -173 | -174.7 | -175.4 | -150.8 | 3.9 | 111.4 | A67 | A67-R69 PolarHBondContact O-N 3.38Š|
| 70 | N | 42.8 | Very low | 45 | Very low | 159 Ų | 159 | 148.9 Ų | 148.9 | 85% | 0.85 | 81% | 0.813 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -161.4 | 13.6 | 161.9 | -109.4 | 0.4 | 0 | 0 | 0 | 114.4 | T68 I72 | T68-N70 VanDerWaalsContact C-N 3.25Å; T68-N70 PolarHBondContact O-N 3.35Å; N70-I72 PolarHBondContact O-N 3.45Å |
| 71 | S | 42.5 | Very low | 45.3 | Very low | 105 Ų | 105 | 146.2 Ų | 146.2 | 73% | 0.734 | 81% | 0.812 | S | S | * | * | trans | -92.6 | 31.7 | -179.3 | -175.5 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 72 | I | 48.3 | Very low | 45 | Very low | 158 Ų | 158 | 150 Ų | 150 | 81% | 0.81 | 82% | 0.819 | S | S | * | * | trans | -123.7 | 84.6 | 170.8 | -55 | 174 | 0 | 0 | 0 | 107.9 | N70 | N70-I72 PolarHBondContact O-N 3.45Š| ||
| 73 | R | 48.6 | Very low | 44.7 | Very low | 239 Ų | 239 | 148.8 Ų | 148.8 | 90% | 0.902 | 82% | 0.82 | S | S | * | * | S | Bend | trans | 179.9 | 67.3 | 149.9 | -103.2 | -179.8 | -92.3 | -116 | 7.2 | 109.9 | ||
| 74 | R | 51.6 | Low | 44.1 | Very low | 256 Ų | 256 | 144.6 Ų | 144.6 | 97% | 0.966 | 82% | 0.815 | S | S | * | * | trans | -158.6 | 94.3 | 155.6 | -110.8 | -176.2 | -89 | -121.4 | 5.2 | 107.3 | ||||
| 75 | G | 39.2 | Very low | 44.2 | Very low | 74 Ų | 74 | 147.5 Ų | 147.5 | 76% | 0.763 | 82% | 0.823 | S | S | * | * | trans | 174.7 | 88.9 | -177.4 | 0 | 0 | 0 | 0 | 0 | 109 | M77 | G75-M77 PolarHBondContact O-N 3.37Š| ||
| 76 | T | 46.3 | Very low | 43.7 | Very low | 141 Ų | 141 | 146.9 Ų | 146.9 | 87% | 0.865 | 82% | 0.819 | S | S | * | * | trans | -51.7 | 123.2 | 175.5 | 44.4 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 77 | M | 35.7 | Very low | 43.2 | Very low | 177 Ų | 177 | 145.1 Ų | 145.1 | 87% | 0.872 | 82% | 0.82 | S | S | * | * | trans | -144.7 | 133 | 153.1 | -88.5 | -62.2 | -64.4 | 0 | 0 | 109.5 | G75 | G75-M77 PolarHBondContact O-N 3.37Š| ||
| 78 | R | 42.2 | Very low | 42.8 | Very low | 242 Ų | 242 | 147.1 Ų | 147.1 | 91% | 0.913 | 82% | 0.823 | S | S | * | * | trans | -49 | 148.6 | -179.7 | -77.7 | 168.5 | 158.3 | -139.8 | -1.7 | 114 | ||||
| 79 | G | 43 | Very low | 42.4 | Very low | 67 Ų | 67 | 152.8 Ų | 152.8 | 69% | 0.691 | 83% | 0.832 | S | S | * | * | trans | 87.7 | 102.3 | 143.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 80 | T | 38.5 | Very low | 41.9 | Very low | 149 Ų | 149 | 147.2 Ų | 147.2 | 91% | 0.914 | 83% | 0.825 | S | S | * | * | 171.3 | 116.3 | 129 | 37.3 | 0 | 0 | 0 | 0 | 106.5 | |||||
| 81 | G | 45.3 | Very low | 41.4 | Very low | 75 Ų | 75 | 144.4 Ų | 144.4 | 77% | 0.773 | 82% | 0.818 | S | S | * | * | trans | -74.9 | 136.3 | -176.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 82 | L | 43 | Very low | 41 | Very low | 166 Ų | 166 | 146.1 Ų | 146.1 | 87% | 0.869 | 82% | 0.824 | S | S | * | * | trans | -150.8 | 141.8 | 145.7 | -74.2 | -176 | 0 | 0 | 0 | 108.6 | ||||
| 83 | P | 44 | Very low | 40.2 | Very low | 124 Ų | 124 | 147.6 Ų | 147.6 | 81% | 0.805 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 138.3 | -172.9 | 29 | -33.4 | 0 | 0 | 0 | 112.4 | ||
| 84 | S | 38.2 | Very low | 39.4 | Very low | 108 Ų | 108 | 143.1 Ų | 143.1 | 76% | 0.755 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 143.8 | 169.8 | -58.3 | 0 | 0 | 0 | 0 | 110.8 | ||
| 85 | P | 45.1 | Very low | 38.5 | Very low | 121 Ų | 121 | 138.8 Ų | 138.8 | 79% | 0.786 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 146 | 176.8 | 27.3 | -31.8 | 0 | 0 | 0 | 111.5 | ||
| 86 | P | 42.4 | Very low | 38.3 | Very low | 121 Ų | 121 | 143.3 Ų | 143.3 | 79% | 0.786 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 131.6 | -166.4 | 27 | -33.7 | 0 | 0 | 0 | 113.3 | V88 | P86-V88 PolarHBondContact O-N 3.1Š|
| 87 | S | 35.4 | Very low | 37.7 | Very low | 117 Ų | 117 | 143.7 Ų | 143.7 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 118.6 | 161.1 | -87 | 0 | 0 | 0 | 0 | 109.8 | R89 | S87-R89 PolarHBondContact O-N 3.14Š|
| 88 | V | 36 | Very low | 37.8 | Very low | 129 Ų | 129 | 143.6 Ų | 143.6 | 78% | 0.782 | 81% | 0.807 | S | S | * | * | trans | -68.7 | 100.2 | 168.3 | 179.9 | 0 | 0 | 0 | 0 | 108.3 | P86 V90 | P86-V88 PolarHBondContact O-N 3.1Å; V88-V90 HydrophobicContact CG1-CG2 3.87Å | ||
| 89 | R | 35.8 | Very low | 37.6 | Very low | 233 Ų | 233 | 140.8 Ų | 140.8 | 88% | 0.879 | 81% | 0.805 | S | S | * | * | trans | -73.2 | 115.5 | 157.3 | -79.9 | -179.1 | 179.9 | 167.7 | 0.1 | 107.3 | S87 | S87-R89 PolarHBondContact O-N 3.14Š| ||
| 90 | V | 35.9 | Very low | 37.4 | Very low | 131 Ų | 131 | 149 Ų | 149 | 79% | 0.794 | 82% | 0.815 | S | S | * | * | trans | -93.9 | 105.3 | 159.4 | -176 | 0 | 0 | 0 | 0 | 107.1 | V88 | V88-V90 HydrophobicContact CG1-CG2 3.87Š| ||
| 91 | S | 31.6 | Very low | 37.2 | Very low | 99 Ų | 99 | 148 Ų | 148 | 69% | 0.692 | 81% | 0.809 | S | S | * | * | trans | -61 | 136.9 | 168.5 | -74.9 | 0 | 0 | 0 | 0 | 110.6 | Q93 | S91-Q93 PolarHBondContact O-N 3.12Š| ||
| 92 | T | 34.5 | Very low | 36.7 | Very low | 142 Ų | 142 | 150.4 Ų | 150.4 | 87% | 0.871 | 81% | 0.814 | S | S | * | * | trans | -59.5 | 117.5 | 157.6 | 44.4 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 93 | Q | 32.5 | Very low | 36.2 | Very low | 188 Ų | 188 | 147.1 Ų | 147.1 | 88% | 0.879 | 80% | 0.804 | S | S | * | * | trans | -150.2 | 123.3 | 151 | -133 | 172.8 | -5.8 | 0 | 0 | 110.2 | S91 | S91-Q93 PolarHBondContact O-N 3.12Š| ||
| 94 | N | 31.5 | Very low | 35.8 | Very low | 146 Ų | 146 | 148.7 Ų | 148.7 | 78% | 0.781 | 80% | 0.799 | S | S | * | * | trans | -41.9 | 136.7 | 165.8 | -89.2 | -41.5 | 0 | 0 | 0 | 111.6 | ||||
| 95 | H | 32.6 | Very low | 35.9 | Very low | 165 Ų | 165 | 151.4 Ų | 151.4 | 76% | 0.764 | 81% | 0.805 | S | S | * | * | -175.4 | 117.7 | 120.5 | -90 | -60.3 | 0 | 0 | 0 | 110.9 | |||||
| 96 | Q | 34.2 | Very low | 35.4 | Very low | 168 Ų | 168 | 152.2 Ų | 152.2 | 79% | 0.785 | 80% | 0.798 | S | S | * | * | trans | 49.3 | 128.8 | 135.2 | -60.4 | -174.2 | -7.7 | 0 | 0 | 121.4 | ||||
| 97 | N | 33.9 | Very low | 35 | Very low | 149 Ų | 149 | 152.2 Ų | 152.2 | 80% | 0.797 | 80% | 0.801 | S | S | * | * | trans | 55.2 | 102.5 | 144.4 | -101.3 | -20.8 | 0 | 0 | 0 | 117.7 | ||||
| 98 | Q | 38.9 | Very low | 35.1 | Very low | 176 Ų | 176 | 151.6 Ų | 151.6 | 82% | 0.822 | 80% | 0.797 | S | S | * | * | -173.9 | 117.4 | 98.4 | -92.6 | -167.1 | 93.9 | 0 | 0 | 110.2 | |||||
| 99 | Q | 38.1 | Very low | 35.4 | Very low | 183 Ų | 183 | 151 Ų | 151 | 86% | 0.855 | 80% | 0.799 | S | S | * | * | trans | -65.8 | 123.6 | 157.8 | -69.9 | 169.4 | -47.5 | 0 | 0 | 108 | ||||
| 100 | R | 37.4 | Very low | 35.4 | Very low | 238 Ų | 238 | 143.8 Ų | 143.8 | 90% | 0.898 | 80% | 0.796 | S | S | * | * | trans | -146.8 | 109.4 | 145.7 | -102.4 | -177.7 | -174 | -140.4 | 0.2 | 108.8 | ||||
| 101 | T | 35.8 | Very low | 35.5 | Very low | 129 Ų | 129 | 141.2 Ų | 141.2 | 79% | 0.791 | 80% | 0.796 | S | S | * | * | trans | -65.7 | 121.5 | 166.3 | 49.2 | 0 | 0 | 0 | 0 | 108.4 | S103 | T101-S103 PolarHBondContact O-N 3.36Å; T101-S103 VanDerWaalsContact O-N 3.16Å | ||
| 102 | S | 33.4 | Very low | 36.1 | Very low | 126 Ų | 126 | 145.3 Ų | 145.3 | 88% | 0.881 | 81% | 0.805 | S | S | * | * | trans | -77.9 | 99.5 | 168.8 | 58.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 103 | S | 33.8 | Very low | 36.5 | Very low | 96 Ų | 96 | 147.9 Ų | 147.9 | 67% | 0.671 | 81% | 0.807 | S | S | * | * | trans | -67.3 | 139.1 | 165.9 | 48.8 | 0 | 0 | 0 | 0 | 111.2 | T101 | T101-S103 PolarHBondContact O-N 3.36Å; T101-S103 VanDerWaalsContact O-N 3.16Å | ||
| 104 | F | 35.7 | Very low | 36.9 | Very low | 157 Ų | 157 | 143.1 Ų | 143.1 | 69% | 0.689 | 81% | 0.808 | S | S | * | * | trans | 21 | 114.8 | 130.5 | -161 | -102 | 0 | 0 | 0 | 117.4 | E106 | F104-E106 HydrophobicContact CD1-CB 4.1Å; F104-E106 HydrophobicContact CE1-CB 3.35Å; F104-E106 HydrophobicContact CE1-CG 4.27Å; F104-E106 WeakPolarHBondContact CE1-OE2 3.4Å; F104-E106 HydrophobicContact CZ-CB 3.64Å; F104-E106 HydrophobicContact CZ-CG 4.27Å; F104-E106 WeakPolarHBondContact CZ-OE2 3.34Å | ||
| 105 | D | 39.6 | Very low | 37 | Very low | 165 Ų | 165 | 139.5 Ų | 139.5 | 88% | 0.882 | 81% | 0.805 | S | S | * | * | trans | -122.1 | 109.7 | 151.8 | -87.4 | -45.8 | 0 | 0 | 0 | 108.4 | ||||
| 106 | E | 34.8 | Very low | 37.3 | Very low | 138 Ų | 138 | 137.4 Ų | 137.4 | 65% | 0.645 | 81% | 0.809 | S | S | * | * | trans | -84.7 | 103.4 | 168.4 | 174.3 | 171.3 | -177.7 | 0 | 0 | 107.3 | F104 S108 | F104-E106 HydrophobicContact CD1-CB 4.1Å; F104-E106 HydrophobicContact CE1-CB 3.35Å; F104-E106 HydrophobicContact CE1-CG 4.27Å; F104-E106 WeakPolarHBondContact CE1-OE2 3.4Å; F104-E106 HydrophobicContact CZ-CB 3.64Å; F104-E106 HydrophobicContact CZ-CG 4.27Å; F104-E106 WeakPolarHBondContact CZ-OE2 3.34Å; E106-S108 PolarHBondContact O-N 2.99Å | ||
| 107 | S | 33.2 | Very low | 37.5 | Very low | 121 Ų | 121 | 137.3 Ų | 137.3 | 85% | 0.846 | 81% | 0.812 | S | S | * | * | trans | -93.6 | 87.9 | 163.3 | -70.5 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 108 | S | 37.1 | Very low | 37.8 | Very low | 105 Ų | 105 | 135.4 Ų | 135.4 | 73% | 0.734 | 81% | 0.811 | S | S | * | * | trans | -80.4 | 116.3 | 157.4 | -164.4 | 0 | 0 | 0 | 0 | 107.7 | E106 | E106-S108 PolarHBondContact O-N 2.99Š| ||
| 109 | S | 42.3 | Very low | 38.2 | Very low | 116 Ų | 116 | 132.8 Ų | 132.8 | 81% | 0.811 | 81% | 0.809 | S | S | * | * | trans | -136.1 | 103.4 | 156.1 | 74.7 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 110 | G | 37.3 | Very low | 38.1 | Very low | 81 Ų | 81 | 132.1 Ų | 132.1 | 84% | 0.835 | 81% | 0.811 | S | S | * | * | trans | -63.3 | 141.7 | 165 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 111 | G | 37.8 | Very low | 38.1 | Very low | 77 Ų | 77 | 128.8 Ų | 128.8 | 79% | 0.794 | 81% | 0.81 | S | S | * | * | trans | -156.6 | 93.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 112 | E | 44.5 | Very low | 37.9 | Very low | 186 Ų | 186 | 125.1 Ų | 125.1 | 87% | 0.869 | 80% | 0.798 | S | S | * | * | trans | -66.5 | 133.9 | 167.6 | 58.2 | -152.3 | 130.7 | 0 | 0 | 111.1 | ||||
| 113 | E | 41.8 | Very low | 38.1 | Very low | 196 Ų | 196 | 128.8 Ų | 128.8 | 92% | 0.916 | 80% | 0.801 | S | S | * | * | trans | 165 | 115.8 | 152.8 | -96.9 | 179 | 174.9 | 0 | 0 | 105.6 | ||||
| 114 | G | 41.1 | Very low | 38.6 | Very low | 87 Ų | 87 | 133.1 Ų | 133.1 | 90% | 0.897 | 81% | 0.807 | S | S | * | * | 85.1 | 64.1 | 57.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 115 | G | 34.2 | Very low | 38.9 | Very low | 70 Ų | 70 | 132.1 Ų | 132.1 | 72% | 0.722 | 81% | 0.81 | S | S | * | * | trans | -155.5 | 65.9 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | I117 | G115-I117 PolarHBondContact O-N 2.91Š| ||
| 116 | S | 37.5 | Very low | 39.1 | Very low | 121 Ų | 121 | 134.4 Ų | 134.4 | 85% | 0.846 | 81% | 0.812 | S | S | * | * | trans | -65.8 | 117.9 | 162.2 | 45.7 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 117 | I | 39.5 | Very low | 39.3 | Very low | 167 Ų | 167 | 136.6 Ų | 136.6 | 86% | 0.856 | 82% | 0.822 | S | S | * | * | trans | -118 | 109.1 | 162.1 | 48.7 | 166.3 | 0 | 0 | 0 | 109.2 | G115 | G115-I117 PolarHBondContact O-N 2.91Š| ||
| 118 | S | 40.2 | Very low | 39.6 | Very low | 109 Ų | 109 | 135.9 Ų | 135.9 | 76% | 0.762 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 155.2 | 170.6 | -64.4 | 0 | 0 | 0 | 0 | 111.8 | D120 | S118-D120 PolarHBondContact O-N 2.95Š|
| 119 | P | 48 | Very low | 40.3 | Very low | 120 Ų | 120 | 136.7 Ų | 136.7 | 78% | 0.779 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -71 | 129.5 | 167.9 | 30.4 | -30.9 | 0 | 0 | 0 | 109.3 | L121 | P119-L121 PolarHBondContact O-N 3.38Š|
| 120 | D | 35 | Very low | 40.5 | Very low | 169 Ų | 169 | 138.7 Ų | 138.7 | 90% | 0.904 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 131.3 | 177.8 | -161.9 | 7.2 | 0 | 0 | 0 | 110.5 | S118 | S118-D120 PolarHBondContact O-N 2.95Š|
| 121 | L | 37.8 | Very low | 40.9 | Very low | 169 Ų | 169 | 141 Ų | 141 | 89% | 0.885 | 82% | 0.821 | S | S | * | * | trans | -113 | 100 | -175 | -171.1 | 84.1 | 0 | 0 | 0 | 106.6 | P119 | P119-L121 PolarHBondContact O-N 3.38Š| ||
| 122 | G | 31.1 | Very low | 40.8 | Very low | 52 Ų | 52 | 142.8 Ų | 142.8 | 54% | 0.536 | 82% | 0.821 | S | S | . | * | trans | 163.1 | 90.2 | 164.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 123 | H | 37.6 | Very low | 40.6 | Very low | 203 Ų | 203 | 138.4 Ų | 138.4 | 94% | 0.94 | 81% | 0.811 | S | S | * | * | -140.2 | 121.8 | 127.8 | -79.2 | -62.4 | 0 | 0 | 0 | 109.4 | |||||
| 124 | K | 45.3 | Very low | 40.6 | Very low | 186 Ų | 186 | 135.6 Ų | 135.6 | 81% | 0.809 | 81% | 0.808 | S | S | * | * | trans | -74.5 | 155.9 | -179.8 | -59.9 | -178.8 | 176.8 | -177 | 0 | 110.5 | ||||
| 125 | N | 40.7 | Very low | 40.3 | Very low | 137 Ų | 137 | 140 Ų | 140 | 73% | 0.733 | 81% | 0.805 | S | S | * | * | trans | 78.8 | 102.3 | 160.4 | -43.6 | -46 | 0 | 0 | 0 | 115.4 | ||||
| 126 | F | 43.8 | Very low | 40.7 | Very low | 212 Ų | 212 | 144.2 Ų | 144.2 | 93% | 0.93 | 81% | 0.811 | S | S | * | * | -167.5 | 136.6 | 92 | -99.6 | -80.2 | 0 | 0 | 0 | 109.8 | |||||
| 127 | E | 38.7 | Very low | 40.7 | Very low | 184 Ų | 184 | 144.1 Ų | 144.1 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -64.9 | 143 | -174.9 | -160 | 155.4 | 163.6 | 0 | 0 | 111.7 | ||||
| 128 | S | 40.4 | Very low | 40.5 | Very low | 106 Ų | 106 | 144.8 Ų | 144.8 | 74% | 0.741 | 80% | 0.804 | S | S | * | * | trans | -52.3 | 159.8 | 170 | -46.8 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 129 | P | 52.3 | Low | 40.9 | Very low | 122 Ų | 122 | 145.1 Ų | 145.1 | 79% | 0.792 | 80% | 0.804 | S | S | * | * | trans | -125 | 122.2 | 134.6 | 31.6 | -20.4 | 0 | 0 | 0 | 111.6 | ||||
| 130 | L | 45.3 | Very low | 40.3 | Very low | 158 Ų | 158 | 143.2 Ų | 143.2 | 83% | 0.827 | 80% | 0.798 | S | S | * | * | trans | -57.7 | 140.9 | 154.2 | -65.5 | 155.2 | 0 | 0 | 0 | 108.9 | S132 | L130-S132 PolarHBondContact O-N 2.95Š| ||
| 131 | P | 46 | Very low | 40.5 | Very low | 129 Ų | 129 | 140.4 Ų | 140.4 | 84% | 0.838 | 79% | 0.792 | S | S | * | * | trans | -85.1 | 100.1 | 155.4 | 29.5 | -27.5 | 0 | 0 | 0 | 109.1 | ||||
| 132 | S | 35.7 | Very low | 40.3 | Very low | 115 Ų | 115 | 140.6 Ų | 140.6 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | trans | -75.1 | 140.3 | 163.1 | -174.5 | 0 | 0 | 0 | 0 | 109.9 | L130 | L130-S132 PolarHBondContact O-N 2.95Š| ||
| 133 | S | 39.8 | Very low | 40.6 | Very low | 95 Ų | 95 | 143.6 Ų | 143.6 | 66% | 0.664 | 81% | 0.806 | S | S | * | * | trans | -60.3 | 150.8 | -178.3 | -41 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 134 | T | 41.6 | Very low | 41 | Very low | 137 Ų | 137 | 139.7 Ų | 139.7 | 84% | 0.84 | 80% | 0.799 | S | S | * | * | 154.4 | 124.9 | 112.7 | 50.8 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 135 | E | 35.9 | Very low | 41 | Very low | 178 Ų | 178 | 135.9 Ų | 135.9 | 83% | 0.832 | 79% | 0.794 | S | S | * | * | -163.9 | 112.4 | 125.4 | -161.4 | 161.4 | -176.5 | 0 | 0 | 110 | |||||
| 136 | N | 41.5 | Very low | 40.7 | Very low | 159 Ų | 159 | 138.4 Ų | 138.4 | 85% | 0.85 | 80% | 0.803 | S | S | * | * | trans | -75.3 | 124.4 | 167.2 | -88.3 | -13.3 | 0 | 0 | 0 | 108.9 | ||||
| 137 | V | 37.5 | Very low | 40.7 | Very low | 120 Ų | 120 | 136.9 Ų | 136.9 | 73% | 0.727 | 80% | 0.796 | S | S | * | * | trans | -143.8 | 100.1 | 147.4 | -172.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 138 | H | 36.4 | Very low | 40.6 | Very low | 180 Ų | 180 | 136.2 Ų | 136.2 | 83% | 0.833 | 79% | 0.793 | S | S | * | * | trans | -91 | 147.6 | 152.5 | -81.5 | -72.1 | 0 | 0 | 0 | 108.1 | ||||
| 139 | P | 48.3 | Very low | 40.4 | Very low | 116 Ų | 116 | 137.8 Ų | 137.8 | 75% | 0.753 | 79% | 0.792 | S | S | * | * | -137.1 | 134.8 | 113.6 | 28.9 | -12.6 | 0 | 0 | 0 | 114.5 | |||||
| 140 | A | 34.7 | Very low | 39.7 | Very low | 81 Ų | 81 | 141.3 Ų | 141.3 | 67% | 0.669 | 80% | 0.798 | S | S | * | * | trans | 32.5 | 117.4 | 138.1 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 141 | S | 40.4 | Very low | 39.2 | Very low | 109 Ų | 109 | 137.4 Ų | 137.4 | 76% | 0.762 | 80% | 0.796 | S | S | * | * | 31.6 | 114.4 | 129.7 | 55.5 | 0 | 0 | 0 | 0 | 120.2 | |||||
| 142 | N | 33.1 | Very low | 38.8 | Very low | 173 Ų | 173 | 141.2 Ų | 141.2 | 93% | 0.925 | 80% | 0.8 | S | S | * | * | trans | -138.2 | 118.7 | 146.9 | -88 | -31.2 | 0 | 0 | 0 | 109.7 | ||||
| 143 | S | 38.1 | Very low | 38.7 | Very low | 115 Ų | 115 | 142 Ų | 142 | 80% | 0.804 | 79% | 0.791 | S | S | * | * | trans | -114.6 | 147 | 162.4 | 57.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 144 | P | 46.4 | Very low | 38.5 | Very low | 122 Ų | 122 | 146.7 Ų | 146.7 | 79% | 0.792 | 80% | 0.799 | S | S | * | * | trans | -127.5 | 167.8 | 141.6 | 33.1 | -18.5 | 0 | 0 | 0 | 112.3 | ||||
| 145 | P | 45 | Very low | 38.7 | Very low | 106 Ų | 106 | 148.1 Ų | 148.1 | 69% | 0.688 | 79% | 0.794 | S | S | * | * | trans | -115.2 | 154.5 | -131.5 | 35.2 | -23.2 | 0 | 0 | 0 | 114.4 | ||||
| 146 | M | 34.6 | Very low | 39.1 | Very low | 190 Ų | 190 | 145 Ų | 145 | 94% | 0.936 | 79% | 0.787 | S | S | * | * | trans | -108.2 | 103.3 | 155.4 | -91.8 | -70.8 | 159.6 | 0 | 0 | 109 | ||||
| 147 | K | 42.7 | Very low | 39.1 | Very low | 180 Ų | 180 | 143 Ų | 143 | 78% | 0.783 | 78% | 0.783 | S | S | * | * | trans | -72 | 131.1 | 158.8 | -67.2 | -179.2 | 176.8 | -178.6 | 0 | 106.7 | ||||
| 148 | Q | 36 | Very low | 39.6 | Very low | 170 Ų | 170 | 144.9 Ų | 144.9 | 79% | 0.794 | 80% | 0.795 | S | S | * | * | -176.9 | 128.1 | 114.8 | -98.9 | -173.4 | -0.6 | 0 | 0 | 113 | |||||
| 149 | I | 38.2 | Very low | 40.3 | Very low | 139 Ų | 139 | 147.2 Ų | 147.2 | 71% | 0.713 | 80% | 0.796 | S | S | * | * | trans | 83.6 | 92 | 142.8 | -56.8 | 159.6 | 0 | 0 | 0 | 117.3 | ||||
| 150 | E | 37.2 | Very low | 40.1 | Very low | 195 Ų | 195 | 145.8 Ų | 145.8 | 91% | 0.911 | 79% | 0.794 | S | S | * | * | 28.7 | 116.7 | 124.6 | -108.5 | 170.8 | 178.1 | 0 | 0 | 119 | |||||
| 151 | G | 33.8 | Very low | 40.7 | Very low | 77 Ų | 77 | 154.2 Ų | 154.2 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | 172 | 77.9 | 166.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 152 | F | 38.5 | Very low | 40.9 | Very low | 208 Ų | 208 | 154.7 Ų | 154.7 | 91% | 0.912 | 81% | 0.812 | S | S | * | * | trans | 51.8 | 111.3 | 151.7 | -126 | -100.2 | 0 | 0 | 0 | 120.2 | ||||
| 153 | E | 32.5 | Very low | 41.5 | Very low | 133 Ų | 133 | 150.6 Ų | 150.6 | 62% | 0.621 | 80% | 0.802 | S | S | * | * | trans | -76.2 | 127.3 | 175.9 | -171.2 | 178.5 | -161.4 | 0 | 0 | 111.8 | K155 | E153-K155 HydrophobicContact CG-CG 4.09Å; E153-K155 WeakPolarHBondContact OE1-CD 3.49Å; E153-K155 WeakPolarHBondContact OE1-CE 3.41Å; E153-K155 IonicContact OE1-NZ 3.24Å; E153-K155 PolarHBondContact OE1-NZ 3.3Å; E153-K155 IonicContact OE2-NZ 3.57Å | ||
| 154 | F | 36.9 | Very low | 42 | Very low | 192 Ų | 192 | 153.1 Ų | 153.1 | 84% | 0.842 | 81% | 0.806 | S | S | * | * | trans | -128.5 | 97.7 | 153.3 | -139.1 | -90.8 | 0 | 0 | 0 | 109.1 | T156 | F154-T156 PolarHBondContact O-N 3.33Š| ||
| 155 | K | 45.4 | Very low | 41.8 | Very low | 168 Ų | 168 | 153.1 Ų | 153.1 | 73% | 0.73 | 81% | 0.809 | S | S | * | * | trans | -63.8 | 113.5 | 174.2 | -80 | 171.9 | 164.6 | 125.5 | 0 | 110.2 | E153 | E153-K155 HydrophobicContact CG-CG 4.09Å; E153-K155 WeakPolarHBondContact OE1-CD 3.49Å; E153-K155 WeakPolarHBondContact OE1-CE 3.41Å; E153-K155 IonicContact OE1-NZ 3.24Å; E153-K155 PolarHBondContact OE1-NZ 3.3Å; E153-K155 IonicContact OE2-NZ 3.57Å | ||
| 156 | T | 44.3 | Very low | 41.7 | Very low | 113 Ų | 113 | 151.9 Ų | 151.9 | 69% | 0.693 | 80% | 0.803 | S | S | * | * | trans | -137.5 | 143.6 | 152.2 | 51.7 | 0 | 0 | 0 | 0 | 109.9 | F154 | F154-T156 PolarHBondContact O-N 3.33Š| ||
| 157 | P | 41.2 | Very low | 42.3 | Very low | 115 Ų | 115 | 148.1 Ų | 148.1 | 75% | 0.747 | 79% | 0.792 | S | S | * | * | trans | -77.5 | 140.8 | -153.6 | 30 | -33.9 | 0 | 0 | 0 | 112.9 | R159 | P157-R159 PolarHBondContact O-N 2.92Š| ||
| 158 | T | 48.7 | Very low | 42.3 | Very low | 160 Ų | 160 | 146.5 Ų | 146.5 | 98% | 0.982 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -64.3 | 73 | 170.7 | -27.4 | 0 | 0 | 0 | 0 | 110.8 | ||
| 159 | R | 49.9 | Very low | 42.6 | Very low | 230 Ų | 230 | 143.2 Ų | 143.2 | 87% | 0.868 | 79% | 0.785 | S | S | * | * | trans | -148.8 | 79.7 | 172.1 | -166.7 | -179.6 | -166 | -175.7 | 4.5 | 109.4 | P157 | P157-R159 PolarHBondContact O-N 2.92Š| ||
| 160 | A | 45 | Very low | 43 | Very low | 86 Ų | 86 | 143.5 Ų | 143.5 | 71% | 0.711 | 79% | 0.788 | S | S | * | * | trans | 150.8 | 73.4 | 152.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 161 | R | 47.1 | Very low | 43.6 | Very low | 257 Ų | 257 | 142.3 Ų | 142.3 | 97% | 0.97 | 78% | 0.78 | S | S | * | * | trans | -133.1 | 61.7 | 158.9 | -74.8 | -168.7 | 168 | -172.4 | -2.7 | 109.9 | ||||
| 162 | S | 45.2 | Very low | 44.2 | Very low | 119 Ų | 119 | 146.6 Ų | 146.6 | 83% | 0.832 | 78% | 0.782 | S | S | * | * | trans | -146.6 | 35.1 | 168.6 | 50 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 163 | A | 44.4 | Very low | 44.4 | Very low | 88 Ų | 88 | 144.2 Ų | 144.2 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -120.1 | 12.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 164 | L | 48.2 | Very low | 45.3 | Very low | 167 Ų | 167 | 142 Ų | 142 | 87% | 0.874 | 79% | 0.791 | S | S | * | * | trans | -128.7 | 11.4 | 179.1 | -65.8 | 176 | 0 | 0 | 0 | 114.9 | S166 | L164-S166 VanDerWaalsContact C-N 3.34Å; L164-S166 PolarHBondContact O-N 3.16Å; L164-S166 VanDerWaalsContact O-N 3.11Å | ||
| 165 | S | 43.6 | Very low | 45.5 | Very low | 122 Ų | 122 | 135.1 Ų | 135.1 | 85% | 0.853 | 78% | 0.775 | S | S | * | * | trans | -81.6 | 88.7 | 163.6 | -178 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 166 | S | 43.1 | Very low | 45.6 | Very low | 81 Ų | 81 | 134.9 Ų | 134.9 | 57% | 0.566 | 78% | 0.782 | S | S | * | * | trans | -58.7 | 137 | 171.9 | -62.6 | 0 | 0 | 0 | 0 | 109.9 | L164 M168 | L164-S166 VanDerWaalsContact C-N 3.34Å; L164-S166 PolarHBondContact O-N 3.16Å; L164-S166 VanDerWaalsContact O-N 3.11Å; S166-M168 PolarHBondContact O-N 3.16Å | ||
| 167 | P | 46.1 | Very low | 45.7 | Very low | 110 Ų | 110 | 136.3 Ų | 136.3 | 71% | 0.714 | 79% | 0.785 | S | S | * | * | G | 310 helix | trans | -73.2 | 8.6 | -179.6 | 33 | -34.9 | 0 | 0 | 0 | 113 | S169 | P167-S169 VanDerWaalsContact C-N 3.3Å; P167-S169 PolarHBondContact O-N 3.37Å |
| 168 | M | 42.2 | Very low | 45.8 | Very low | 146 Ų | 146 | 138.8 Ų | 138.8 | 72% | 0.719 | 79% | 0.792 | S | S | * | * | G | 310 helix | trans | -85.8 | 7.6 | -168.8 | -132.3 | 98.2 | 83.8 | 0 | 0 | 114.3 | S166 | S166-M168 PolarHBondContact O-N 3.16Š|
| 169 | S | 42.8 | Very low | 45.3 | Very low | 102 Ų | 102 | 135.2 Ų | 135.2 | 71% | 0.713 | 77% | 0.773 | S | S | * | * | G | 310 helix | trans | -84.3 | -12.8 | 179.2 | -170.3 | 0 | 0 | 0 | 0 | 113.6 | P167 | P167-S169 VanDerWaalsContact C-N 3.3Å; P167-S169 PolarHBondContact O-N 3.37Å |
| 170 | N | 46.7 | Very low | 45.2 | Very low | 144 Ų | 144 | 130.7 Ų | 130.7 | 77% | 0.77 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -97.1 | 1.2 | -172.1 | -67.4 | -15.6 | 0 | 0 | 0 | 114.3 | ||
| 171 | F | 50.9 | Low | 45.3 | Very low | 170 Ų | 170 | 134.2 Ų | 134.2 | 75% | 0.746 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -100.8 | -0.4 | -178 | -73.2 | -77.6 | 0 | 0 | 0 | 114.4 | ||
| 172 | M | 46.2 | Very low | 45.3 | Very low | 167 Ų | 167 | 127 Ų | 127 | 82% | 0.823 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -114.8 | 13.2 | -174.1 | -73.8 | -66.9 | 159.9 | 0 | 0 | 114.8 | ||
| 173 | N | 43.1 | Very low | 45.8 | Very low | 158 Ų | 158 | 132.2 Ų | 132.2 | 85% | 0.845 | 77% | 0.769 | S | S | * | * | trans | -104.9 | 95.5 | 163.1 | -93.9 | -2.8 | 0 | 0 | 0 | 109 | G175 | N173-G175 PolarHBondContact O-N 3.4Å; N173-G175 VanDerWaalsContact O-N 3.15Å | ||
| 174 | G | 49.9 | Very low | 46.3 | Very low | 86 Ų | 86 | 134.1 Ų | 134.1 | 89% | 0.887 | 77% | 0.774 | S | S | * | * | trans | -59.7 | 108.6 | 154.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 175 | G | 40.8 | Very low | 46.8 | Very low | 49 Ų | 49 | 128.7 Ų | 128.7 | 51% | 0.505 | 75% | 0.754 | S | S | . | * | trans | -140.4 | 102.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 107.7 | N173 N177 | N173-G175 PolarHBondContact O-N 3.4Å; N173-G175 VanDerWaalsContact O-N 3.15Å; G175-N177 PolarHBondContact O-N 3.38Å; G175-N177 VanDerWaalsContact O-N 3.11Å; G175-N177 PolarHBondContact O-ND2 3.24Å; G175-N177 VanDerWaalsContact O-ND2 3.16Å | ||
| 176 | D | 49.4 | Very low | 48.1 | Very low | 162 Ų | 162 | 126.3 Ų | 126.3 | 87% | 0.866 | 74% | 0.737 | S | S | * | * | trans | -38.6 | 111.5 | 170.5 | -55 | -52.8 | 0 | 0 | 0 | 110.4 | ||||
| 177 | N | 44.4 | Very low | 49.6 | Very low | 143 Ų | 143 | 132.3 Ų | 132.3 | 77% | 0.765 | 75% | 0.747 | S | S | * | * | trans | -147.5 | 91.5 | 170.2 | -77.3 | -76.9 | 0 | 0 | 0 | 108.3 | G175 S179 | G175-N177 PolarHBondContact O-N 3.38Å; G175-N177 VanDerWaalsContact O-N 3.11Å; G175-N177 PolarHBondContact O-ND2 3.24Å; G175-N177 VanDerWaalsContact O-ND2 3.16Å; N177-S179 VanDerWaalsContact C-N 3.27Å; N177-S179 PolarHBondContact O-N 2.72Å | ||
| 178 | D | 44.3 | Very low | 50.9 | Low | 167 Ų | 167 | 132.5 Ų | 132.5 | 89% | 0.893 | 74% | 0.741 | S | S | * | * | trans | -61.8 | 86.3 | 163.2 | -68.9 | -49.6 | 0 | 0 | 0 | 109.4 | ||||
| 179 | S | 38.8 | Very low | 52.3 | Low | 85 Ų | 85 | 127.9 Ų | 127.9 | 59% | 0.594 | 72% | 0.719 | S | S | * | * | trans | -172.3 | 119.1 | 159.8 | -86 | 0 | 0 | 0 | 0 | 111 | N177 I181 | N177-S179 VanDerWaalsContact C-N 3.27Å; N177-S179 PolarHBondContact O-N 2.72Å; S179-I181 PolarHBondContact O-N 3.13Å | ||
| 180 | P | 46 | Very low | 53.7 | Low | 135 Ų | 135 | 127.8 Ų | 127.8 | 88% | 0.877 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.6 | 1.8 | -178.6 | 29.7 | -32 | 0 | 0 | 0 | 114.1 | ||
| 181 | I | 49.1 | Very low | 55.1 | Low | 161 Ų | 161 | 129 Ų | 129 | 83% | 0.826 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.6 | -14.7 | -164.7 | -63.5 | 165.9 | 0 | 0 | 0 | 113.6 | S179 | S179-I181 PolarHBondContact O-N 3.13Š|
| 182 | S | 46.3 | Very low | 56.1 | Low | 104 Ų | 104 | 123.9 Ų | 123.9 | 73% | 0.727 | 68% | 0.681 | S | S | * | * | trans | -133.9 | 62.4 | -170.3 | 176.8 | 0 | 0 | 0 | 0 | 113 | ||||
| 183 | R | 56 | Low | 57.4 | Low | 230 Ų | 230 | 119.2 Ų | 119.2 | 87% | 0.868 | 66% | 0.657 | S | S | * | * | trans | -101.8 | 130.2 | 157.1 | -71 | -172.3 | 179.4 | -146.9 | -0.9 | 108.7 | A185 | R183-A185 PolarHBondContact O-N 3.07Š| ||
| 184 | P | 53.7 | Low | 58.7 | Low | 127 Ų | 127 | 118.7 Ų | 118.7 | 83% | 0.825 | 65% | 0.649 | S | S | * | * | trans | -61.1 | 115.9 | 171.6 | 23.6 | -29.8 | 0 | 0 | 0 | 108.1 | S186 | P184-S186 PolarHBondContact O-N 3.39Š| ||
| 185 | A | 59.9 | Low | 59.9 | Low | 54 Ų | 54 | 122.8 Ų | 122.8 | 45% | 0.446 | 64% | 0.643 | S | S | . | * | trans | -55.5 | 125.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | R183 R187 M189 | R183-A185 PolarHBondContact O-N 3.07Å; A185-R187 PolarHBondContact O-N 2.93Å; A185-M189 HydrophobicContact CB-CB 4.05Å | ||
| 186 | S | 70.4 | Confident | 61 | Low | 71 Ų | 71 | 123.3 Ų | 123.3 | 50% | 0.497 | 65% | 0.649 | S | S | . | * | trans | -48.8 | 144 | 172.7 | 166.6 | 0 | 0 | 0 | 0 | 109.7 | P184 L188 M189 Q190 | P184-S186 PolarHBondContact O-N 3.39Å; S186-L188 CarbonylContact O-C 3.54Å; S186-L188 PolarHBondContact O-N 2.89Å; S186-L188 PolarHBondContact OG-N 3.02Å; S186-M189 WeakPolarHBondContact O-CA 3.28Å; S186-M189 WeakPolarHBondContact O-CB 3.49Å; S186-M189 PolarHBondContact O-N 3.34Å; S186-Q190 PolarHBondContact O-N 3.21Å | ||
| 187 | R | 74.3 | Confident | 61.5 | Low | 208 Ų | 208 | 120 Ų | 120 | 79% | 0.785 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -50.3 | -28.6 | 175.8 | -83 | -177.2 | 176.3 | 166.7 | -0.7 | 112.7 | A185 R191 | A185-R187 PolarHBondContact O-N 2.93Å; R187-R191 WeakPolarHBondContact O-CG 3.43Å; R187-R191 PolarHBondContact O-N 3.37Å; R187-R191 VanDerWaalsContact O-N 3.14Å |
| 188 | L | 72.7 | Confident | 62.2 | Low | 113 Ų | 113 | 115.1 Ų | 115.1 | 59% | 0.592 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -67 | -49.5 | 172.7 | -177.5 | 66.6 | 0 | 0 | 0 | 111.7 | S186 Q190 R191 L192 | S186-L188 CarbonylContact O-C 3.54Å; S186-L188 PolarHBondContact O-N 2.89Å; S186-L188 PolarHBondContact OG-N 3.02Å; L188-Q190 VanDerWaalsContact C-N 3.33Å; L188-Q190 PolarHBondContact O-N 3.41Å; L188-R191 PolarHBondContact O-N 3.19Å; L188-L192 HydrophobicContact CD1-CD1 4.48Å; L188-L192 HydrophobicContact CG-CD1 4.08Å; L188-L192 VanDerWaalsContact O-CG 3.29Å; L188-L192 WeakPolarHBondContact O-CG 3.41Å; L188-L192 PolarHBondContact O-N 2.83Å |
| 189 | M | 71.8 | Confident | 63.2 | Low | 49 Ų | 49 | 115.4 Ų | 115.4 | 24% | 0.241 | 60% | 0.596 | C | S | . | * | H | α-helix | trans | -58.4 | -45.2 | 175.8 | -72.8 | -68.6 | -64.7 | 0 | 0 | 111.2 | A185 S186 R191 L192 E193 I198 | A185-M189 HydrophobicContact CB-CB 4.05Å; S186-M189 WeakPolarHBondContact O-CA 3.28Å; S186-M189 WeakPolarHBondContact O-CB 3.49Å; S186-M189 PolarHBondContact O-N 3.34Å; M189-R191 VanDerWaalsContact C-N 3.3Å; M189-R191 PolarHBondContact O-N 3.4Å; M189-L192 PolarHBondContact O-N 3.04Å; M189-L192 VanDerWaalsContact O-N 3.08Å; M189-E193 WeakPolarHBondContact O-CG 3.37Å; M189-E193 PolarHBondContact O-N 3.47Å; M189-I198 HydrophobicContact CE-CD1 3.96Å; M189-I198 HydrophobicContact SD-CD1 4.41Å |
| 190 | Q | 73.7 | Confident | 64.3 | Low | 100 Ų | 100 | 119.9 Ų | 119.9 | 47% | 0.467 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -61.4 | -38.5 | 177.6 | -167 | 176.6 | 30.9 | 0 | 0 | 112.2 | S186 L188 Q194 | S186-Q190 PolarHBondContact O-N 3.21Å; L188-Q190 VanDerWaalsContact C-N 3.33Å; L188-Q190 PolarHBondContact O-N 3.41Å; Q190-Q194 WeakPolarHBondContact O-CB 3.5Å; Q190-Q194 WeakPolarHBondContact O-CG 3.42Å; Q190-Q194 PolarHBondContact O-N 2.9Å |
| 191 | R | 75.8 | Confident | 64.9 | Low | 170 Ų | 170 | 118.7 Ų | 118.7 | 64% | 0.642 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -67.8 | -38.8 | 173.6 | -79.3 | -180 | 180 | 163.9 | -0.1 | 112.3 | R187 L188 M189 Q194 K195 | R187-R191 WeakPolarHBondContact O-CG 3.43Å; R187-R191 PolarHBondContact O-N 3.37Å; R187-R191 VanDerWaalsContact O-N 3.14Å; L188-R191 PolarHBondContact O-N 3.19Å; M189-R191 VanDerWaalsContact C-N 3.3Å; M189-R191 PolarHBondContact O-N 3.4Å; R191-Q194 PolarHBondContact O-N 3.27Å; R191-K195 WeakPolarHBondContact O-CB 3.36Å; R191-K195 WeakPolarHBondContact O-CG 3.45Å; R191-K195 PolarHBondContact O-N 3.08Å |
| 192 | L | 71.9 | Confident | 65.3 | Low | 63 Ų | 63 | 114.2 Ų | 114.2 | 33% | 0.33 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -68.3 | -39 | 178.7 | -69.2 | 171 | 0 | 0 | 0 | 111.5 | L188 M189 K195 G196 T197 I198 | L188-L192 HydrophobicContact CD1-CD1 4.48Å; L188-L192 HydrophobicContact CG-CD1 4.08Å; L188-L192 VanDerWaalsContact O-CG 3.29Å; L188-L192 WeakPolarHBondContact O-CG 3.41Å; L188-L192 PolarHBondContact O-N 2.83Å; M189-L192 PolarHBondContact O-N 3.04Å; M189-L192 VanDerWaalsContact O-N 3.08Å; L192-K195 PolarHBondContact O-N 3.4Å; L192-G196 PolarHBondContact O-N 2.96Å; L192-T197 VanDerWaalsContact CA-OG1 3.27Å; L192-T197 WeakPolarHBondContact CA-OG1 3.48Å; L192-T197 WeakPolarHBondContact CB-OG1 3.48Å; L192-T197 VanDerWaalsContact CD2-OG1 3.31Å; L192-T197 WeakPolarHBondContact CD2-OG1 3.45Å; L192-T197 PolarHBondContact O-N 2.84Å; L192-T197 PolarHBondContact O-OG1 2.96Å; L192-I198 HydrophobicContact CB-CG2 3.72Å |
| 193 | E | 72.8 | Confident | 66 | Low | 69 Ų | 69 | 113.2 Ų | 113.2 | 32% | 0.322 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64.5 | -47.1 | 172.6 | -72.8 | 177.5 | -171.2 | 0 | 0 | 111 | M189 K195 G196 I198 | M189-E193 WeakPolarHBondContact O-CG 3.37Å; M189-E193 PolarHBondContact O-N 3.47Å; E193-K195 PolarHBondContact O-N 3.45Å; E193-G196 PolarHBondContact O-N 2.7Å; E193-I198 HydrophobicContact CG-CG2 3.8Å |
| 194 | Q | 70.8 | Confident | 66.3 | Low | 146 Ų | 146 | 108.2 Ų | 108.2 | 68% | 0.682 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.8 | -28 | 176 | -76.5 | 175.2 | -1.1 | 0 | 0 | 113.2 | Q190 R191 G196 | Q190-Q194 WeakPolarHBondContact O-CB 3.5Å; Q190-Q194 WeakPolarHBondContact O-CG 3.42Å; Q190-Q194 PolarHBondContact O-N 2.9Å; R191-Q194 PolarHBondContact O-N 3.27Å; Q194-G196 VanDerWaalsContact C-N 3.29Å |
| 195 | K | 74.4 | Confident | 66.7 | Low | 172 Ų | 172 | 106.9 Ų | 106.9 | 75% | 0.748 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.6 | 0.8 | 175 | -68.4 | -68.8 | -180 | -172 | 0 | 113.1 | R191 L192 E193 T197 | R191-K195 WeakPolarHBondContact O-CB 3.36Å; R191-K195 WeakPolarHBondContact O-CG 3.45Å; R191-K195 PolarHBondContact O-N 3.08Å; L192-K195 PolarHBondContact O-N 3.4Å; E193-K195 PolarHBondContact O-N 3.45Å; K195-T197 HydrophobicContact CB-CG2 4.01Å; K195-T197 PolarHBondContact O-N 3.36Å |
| 196 | G | 64.8 | Low | 67.3 | Low | 61 Ų | 61 | 107 Ų | 107 | 63% | 0.629 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.6 | 15.9 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | L192 E193 Q194 | L192-G196 PolarHBondContact O-N 2.96Å; E193-G196 PolarHBondContact O-N 2.7Å; Q194-G196 VanDerWaalsContact C-N 3.29Å |
| 197 | T | 60.4 | Low | 67.2 | Low | 91 Ų | 91 | 108.8 Ų | 108.8 | 56% | 0.558 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -85.2 | -12.9 | -175.7 | 56.6 | 0 | 0 | 0 | 0 | 113.4 | L192 K195 | L192-T197 VanDerWaalsContact CA-OG1 3.27Å; L192-T197 WeakPolarHBondContact CA-OG1 3.48Å; L192-T197 WeakPolarHBondContact CB-OG1 3.48Å; L192-T197 VanDerWaalsContact CD2-OG1 3.31Å; L192-T197 WeakPolarHBondContact CD2-OG1 3.45Å; L192-T197 PolarHBondContact O-N 2.84Å; L192-T197 PolarHBondContact O-OG1 2.96Å; K195-T197 HydrophobicContact CB-CG2 4.01Å; K195-T197 PolarHBondContact O-N 3.36Å |
| 198 | I | 59 | Low | 66.9 | Low | 41 Ų | 41 | 103.2 Ų | 103.2 | 21% | 0.21 | 50% | 0.503 | C | S | . | . | trans | -144 | 123.8 | 176.9 | -169.6 | 164 | 0 | 0 | 0 | 108.4 | M189 L192 E193 | M189-I198 HydrophobicContact CE-CD1 3.96Å; M189-I198 HydrophobicContact SD-CD1 4.41Å; L192-I198 HydrophobicContact CB-CG2 3.72Å; E193-I198 HydrophobicContact CG-CG2 3.8Å | ||
| 199 | R | 65.4 | Low | 66.9 | Low | 174 Ų | 174 | 103 Ų | 103 | 66% | 0.657 | 50% | 0.501 | S | S | * | . | trans | -100.4 | 148 | 166.1 | -58.8 | -171.7 | 69.2 | 139.3 | 2 | 107.7 | D201 D202 | R199-D201 PolarHBondContact O-N 3.27Å; R199-D202 PolarHBondContact N-OD2 2.99Å; R199-D202 VanDerWaalsContact O-CB 3.31Å; R199-D202 WeakPolarHBondContact O-CB 3.2Å; R199-D202 PolarHBondContact O-N 3.24Å | ||
| 200 | R | 60.1 | Low | 66.9 | Low | 179 Ų | 179 | 108.5 Ų | 108.5 | 68% | 0.675 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -57.9 | -24.8 | 179.7 | -62.8 | -166.2 | -159.9 | 103.4 | 3.5 | 112.8 | D202 E203 | R200-D202 VanDerWaalsContact C-N 3.29Å; R200-D202 PolarHBondContact O-N 3.45Å; R200-E203 WeakPolarHBondContact O-CB 3.48Å; R200-E203 PolarHBondContact O-N 3.23Å |
| 201 | D | 59.7 | Low | 66.9 | Low | 110 Ų | 110 | 109.8 Ų | 109.8 | 59% | 0.588 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -68.3 | -27.4 | 175.5 | -49.6 | -45.6 | 0 | 0 | 0 | 112.5 | R199 E203 | R199-D201 PolarHBondContact O-N 3.27Å; D201-E203 PolarHBondContact O-N 2.63Å |
| 202 | D | 58.3 | Low | 66.5 | Low | 67 Ų | 67 | 104.9 Ų | 104.9 | 36% | 0.358 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -75 | -14.9 | 175.1 | -57.2 | -44 | 0 | 0 | 0 | 112.2 | R199 R200 I205 S206 | R199-D202 PolarHBondContact N-OD2 2.99Å; R199-D202 VanDerWaalsContact O-CB 3.31Å; R199-D202 WeakPolarHBondContact O-CB 3.2Å; R199-D202 PolarHBondContact O-N 3.24Å; R200-D202 VanDerWaalsContact C-N 3.29Å; R200-D202 PolarHBondContact O-N 3.45Å; D202-I205 PolarHBondContact O-N 2.87Å; D202-S206 VanDerWaalsContact O-CB 3.22Å; D202-S206 WeakPolarHBondContact O-CB 3.32Å; D202-S206 PolarHBondContact O-N 3.35Å; D202-S206 PolarHBondContact O-OG 3.27Å |
| 203 | E | 61 | Low | 66.3 | Low | 83 Ų | 83 | 104.4 Ų | 104.4 | 39% | 0.388 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -72.5 | -34.3 | -179.4 | -152.8 | 164.5 | -148.8 | 0 | 0 | 110.9 | R200 D201 S206 Q207 | R200-E203 WeakPolarHBondContact O-CB 3.48Å; R200-E203 PolarHBondContact O-N 3.23Å; D201-E203 PolarHBondContact O-N 2.63Å; E203-S206 PolarHBondContact O-N 2.88Å; E203-Q207 WeakPolarHBondContact O-CB 3.39Å; E203-Q207 VanDerWaalsContact O-CG 3.32Å; E203-Q207 WeakPolarHBondContact O-CG 3.31Å; E203-Q207 PolarHBondContact O-N 3.22Å |
| 204 | I | 61.5 | Low | 65.9 | Low | 124 Ų | 124 | 106.7 Ų | 106.7 | 64% | 0.636 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -68.1 | -45 | 174 | -56.3 | 174.3 | 0 | 0 | 0 | 110 | S206 Q207 E208 | I204-S206 VanDerWaalsContact C-N 3.31Å; I204-S206 PolarHBondContact O-N 3.4Å; I204-Q207 PolarHBondContact O-N 2.89Å; I204-E208 PolarHBondContact O-N 2.71Å |
| 205 | I | 62.6 | Low | 65.5 | Low | 99 Ų | 99 | 102.7 Ų | 102.7 | 51% | 0.508 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.8 | -41.4 | 176.1 | -62.7 | 169.7 | 0 | 0 | 0 | 110 | D202 Q207 E208 I209 | D202-I205 PolarHBondContact O-N 2.87Å; I205-Q207 PolarHBondContact O-N 3.43Å; I205-E208 PolarHBondContact O-N 2.96Å; I205-I209 HydrophobicContact CG2-CD1 3.72Å; I205-I209 HydrophobicContact CG2-CG1 4.41Å; I205-I209 WeakPolarHBondContact O-CB 3.28Å; I205-I209 WeakPolarHBondContact O-CD1 3.49Å; I205-I209 WeakPolarHBondContact O-CG1 3.39Å; I205-I209 PolarHBondContact O-N 3.02Å |
| 206 | S | 71.1 | Confident | 64.6 | Low | 56 Ų | 56 | 99.3 Ų | 99.3 | 39% | 0.392 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.3 | -35.9 | 177.6 | -63.6 | 0 | 0 | 0 | 0 | 112.9 | D202 E203 I204 R210 | D202-S206 VanDerWaalsContact O-CB 3.22Å; D202-S206 WeakPolarHBondContact O-CB 3.32Å; D202-S206 PolarHBondContact O-N 3.35Å; D202-S206 PolarHBondContact O-OG 3.27Å; E203-S206 PolarHBondContact O-N 2.88Å; I204-S206 VanDerWaalsContact C-N 3.31Å; I204-S206 PolarHBondContact O-N 3.4Å; S206-R210 VanDerWaalsContact O-CB 3.26Å; S206-R210 WeakPolarHBondContact O-CB 3.41Å; S206-R210 PolarHBondContact O-N 2.93Å |
| 207 | Q | 69.9 | Low | 64.2 | Low | 110 Ų | 110 | 102.6 Ų | 102.6 | 51% | 0.514 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -69.7 | -40.5 | 174.2 | -77.1 | -179.5 | 32.9 | 0 | 0 | 112 | E203 I204 I205 R210 R211 | E203-Q207 WeakPolarHBondContact O-CB 3.39Å; E203-Q207 VanDerWaalsContact O-CG 3.32Å; E203-Q207 WeakPolarHBondContact O-CG 3.31Å; E203-Q207 PolarHBondContact O-N 3.22Å; I204-Q207 PolarHBondContact O-N 2.89Å; I205-Q207 PolarHBondContact O-N 3.43Å; Q207-R210 PolarHBondContact O-N 3.41Å; Q207-R211 WeakPolarHBondContact O-CB 3.37Å; Q207-R211 PolarHBondContact O-N 3.07Å |
| 208 | E | 67.8 | Low | 64 | Low | 91 Ų | 91 | 102.7 Ų | 102.7 | 43% | 0.425 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.6 | -47.4 | 174.3 | -172 | 59.7 | -136.8 | 0 | 0 | 110.7 | I204 I205 R210 R211 V212 | I204-E208 PolarHBondContact O-N 2.71Å; I205-E208 PolarHBondContact O-N 2.96Å; E208-R210 VanDerWaalsContact C-N 3.3Å; E208-R210 PolarHBondContact O-N 3.03Å; E208-R211 PolarHBondContact O-N 3.24Å; E208-R211 IonicContact OE1-NH1 3.96Å; E208-R211 IonicContact OE2-CZ 2.62Å; E208-R211 IonicContact OE2-NH1 2.66Å; E208-R211 PolarHBondContact OE2-NH1 3.35Å; E208-R211 IonicContact OE2-NH2 3.7Å; E208-V212 WeakPolarHBondContact O-CB 3.45Å; E208-V212 VanDerWaalsContact O-CG2 3.28Å; E208-V212 WeakPolarHBondContact O-CG2 3.02Å; E208-V212 PolarHBondContact O-N 3.43Å |
| 209 | I | 71.3 | Confident | 63.9 | Low | 109 Ų | 109 | 110.9 Ų | 110.9 | 56% | 0.559 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -60 | -41.3 | 176 | -67.6 | 166.5 | 0 | 0 | 0 | 110.9 | I205 V212 A213 | I205-I209 HydrophobicContact CG2-CD1 3.72Å; I205-I209 HydrophobicContact CG2-CG1 4.41Å; I205-I209 WeakPolarHBondContact O-CB 3.28Å; I205-I209 WeakPolarHBondContact O-CD1 3.49Å; I205-I209 WeakPolarHBondContact O-CG1 3.39Å; I205-I209 PolarHBondContact O-N 3.02Å; I209-V212 PolarHBondContact O-N 3.41Å; I209-A213 WeakPolarHBondContact O-CB 3.06Å; I209-A213 PolarHBondContact O-N 3.14Å |
| 210 | R | 72.5 | Confident | 63.4 | Low | 163 Ų | 163 | 105.8 Ų | 105.8 | 62% | 0.615 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64 | -45.4 | 176.2 | -172.5 | -177.7 | -60.4 | -174.8 | 2.4 | 111.6 | S206 Q207 E208 V212 A213 E214 | S206-R210 VanDerWaalsContact O-CB 3.26Å; S206-R210 WeakPolarHBondContact O-CB 3.41Å; S206-R210 PolarHBondContact O-N 2.93Å; Q207-R210 PolarHBondContact O-N 3.41Å; E208-R210 VanDerWaalsContact C-N 3.3Å; E208-R210 PolarHBondContact O-N 3.03Å; R210-V212 VanDerWaalsContact C-N 3.34Å; R210-V212 PolarHBondContact O-N 3.08Å; R210-A213 PolarHBondContact O-N 2.84Å; R210-E214 HydrophobicContact CG-CG 4.44Å; R210-E214 VanDerWaalsContact CG-OE1 3.31Å; R210-E214 WeakPolarHBondContact CG-OE1 3.34Å; R210-E214 WeakPolarHBondContact O-CB 3.36Å; R210-E214 VanDerWaalsContact O-CG 3.31Å; R210-E214 WeakPolarHBondContact O-CG 3.4Å; R210-E214 PolarHBondContact O-N 3.15Å |
| 211 | R | 72.8 | Confident | 63.3 | Low | 127 Ų | 127 | 101.7 Ų | 101.7 | 48% | 0.479 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.8 | -41 | 177 | -162 | -171.9 | -54.6 | 129.1 | 6.9 | 111.3 | Q207 E208 E214 T215 | Q207-R211 WeakPolarHBondContact O-CB 3.37Å; Q207-R211 PolarHBondContact O-N 3.07Å; E208-R211 PolarHBondContact O-N 3.24Å; E208-R211 IonicContact OE1-NH1 3.96Å; E208-R211 IonicContact OE2-CZ 2.62Å; E208-R211 IonicContact OE2-NH1 2.66Å; E208-R211 PolarHBondContact OE2-NH1 3.35Å; E208-R211 IonicContact OE2-NH2 3.7Å; R211-E214 PolarHBondContact O-N 2.88Å; R211-T215 WeakPolarHBondContact O-CB 3.4Å; R211-T215 WeakPolarHBondContact O-CG2 3.37Å; R211-T215 PolarHBondContact O-N 2.84Å; R211-T215 PolarHBondContact O-OG1 3.34Å |
| 212 | V | 68.7 | Low | 63.2 | Low | 68 Ų | 68 | 99.7 Ų | 99.7 | 41% | 0.412 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.9 | -42.4 | 173.8 | 173.5 | 0 | 0 | 0 | 0 | 110.7 | E208 I209 R210 T215 N216 | E208-V212 WeakPolarHBondContact O-CB 3.45Å; E208-V212 VanDerWaalsContact O-CG2 3.28Å; E208-V212 WeakPolarHBondContact O-CG2 3.02Å; E208-V212 PolarHBondContact O-N 3.43Å; I209-V212 PolarHBondContact O-N 3.41Å; R210-V212 VanDerWaalsContact C-N 3.34Å; R210-V212 PolarHBondContact O-N 3.08Å; V212-T215 WeakPolarHBondContact CA-OG1 3.32Å; V212-T215 PolarHBondContact O-OG1 3.12Å; V212-N216 WeakPolarHBondContact O-CB 3.4Å; V212-N216 PolarHBondContact O-N 3.42Å; V212-N216 PolarHBondContact O-ND2 3.3Å |
| 213 | A | 66.4 | Low | 63.3 | Low | 53 Ų | 53 | 103.7 Ų | 103.7 | 44% | 0.438 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.8 | -43.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | I209 R210 N216 L217 | I209-A213 WeakPolarHBondContact O-CB 3.06Å; I209-A213 PolarHBondContact O-N 3.14Å; R210-A213 PolarHBondContact O-N 2.84Å; A213-N216 PolarHBondContact O-N 2.88Å; A213-L217 PolarHBondContact O-N 3.5Å |
| 214 | E | 65.5 | Low | 63.1 | Low | 116 Ų | 116 | 103.4 Ų | 103.4 | 54% | 0.542 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -67.4 | -37.8 | 178 | -73 | 172.6 | -171.7 | 0 | 0 | 112.6 | R210 R211 N216 L217 S218 | R210-E214 HydrophobicContact CG-CG 4.44Å; R210-E214 VanDerWaalsContact CG-OE1 3.31Å; R210-E214 WeakPolarHBondContact CG-OE1 3.34Å; R210-E214 WeakPolarHBondContact O-CB 3.36Å; R210-E214 VanDerWaalsContact O-CG 3.31Å; R210-E214 WeakPolarHBondContact O-CG 3.4Å; R210-E214 PolarHBondContact O-N 3.15Å; R211-E214 PolarHBondContact O-N 2.88Å; E214-N216 VanDerWaalsContact C-N 3.29Å; E214-N216 PolarHBondContact O-N 2.99Å; E214-L217 PolarHBondContact O-N 3.05Å; E214-S218 WeakPolarHBondContact O-CB 3.35Å; E214-S218 PolarHBondContact O-N 3.45Å; E214-S218 PolarHBondContact O-OG 3.03Å |
| 215 | T | 61.8 | Low | 62.9 | Low | 63 Ų | 63 | 100.9 Ų | 100.9 | 39% | 0.387 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -67.8 | -29.8 | 173.4 | 54.4 | 0 | 0 | 0 | 0 | 112.2 | R211 V212 S218 R219 | R211-T215 WeakPolarHBondContact O-CB 3.4Å; R211-T215 WeakPolarHBondContact O-CG2 3.37Å; R211-T215 PolarHBondContact O-N 2.84Å; R211-T215 PolarHBondContact O-OG1 3.34Å; V212-T215 WeakPolarHBondContact CA-OG1 3.32Å; V212-T215 PolarHBondContact O-OG1 3.12Å; T215-S218 VanDerWaalsContact CA-OG 3.3Å; T215-S218 WeakPolarHBondContact CA-OG 3.39Å; T215-S218 PolarHBondContact O-OG 3.17Å; T215-R219 WeakPolarHBondContact O-CG 3.35Å; T215-R219 PolarHBondContact O-N 3.31Å |
| 216 | N | 55.2 | Low | 62.6 | Low | 100 Ų | 100 | 100.1 Ų | 100.1 | 54% | 0.535 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -77.7 | -33.9 | 173.7 | -78.6 | -68 | 0 | 0 | 0 | 112.5 | V212 A213 E214 | V212-N216 WeakPolarHBondContact O-CB 3.4Å; V212-N216 PolarHBondContact O-N 3.42Å; V212-N216 PolarHBondContact O-ND2 3.3Å; A213-N216 PolarHBondContact O-N 2.88Å; E214-N216 VanDerWaalsContact C-N 3.29Å; E214-N216 PolarHBondContact O-N 2.99Å |
| 217 | L | 57.9 | Low | 62.1 | Low | 130 Ų | 130 | 107.1 Ų | 107.1 | 68% | 0.681 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -70.6 | -40.1 | 172.5 | -106.5 | 73.3 | 0 | 0 | 0 | 112.4 | A213 E214 R219 S220 | A213-L217 PolarHBondContact O-N 3.5Å; E214-L217 PolarHBondContact O-N 3.05Å; L217-R219 PolarHBondContact O-N 3.43Å; L217-S220 WeakPolarHBondContact O-CB 3.5Å; L217-S220 PolarHBondContact O-N 3.15Å; L217-S220 PolarHBondContact O-OG 3.25Å |
| 218 | S | 55.1 | Low | 61.5 | Low | 93 Ų | 93 | 103.3 Ų | 103.3 | 65% | 0.65 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -70.5 | -16.6 | 179.8 | 52.7 | 0 | 0 | 0 | 0 | 113.9 | E214 T215 | E214-S218 WeakPolarHBondContact O-CB 3.35Å; E214-S218 PolarHBondContact O-N 3.45Å; E214-S218 PolarHBondContact O-OG 3.03Å; T215-S218 VanDerWaalsContact CA-OG 3.3Å; T215-S218 WeakPolarHBondContact CA-OG 3.39Å; T215-S218 PolarHBondContact O-OG 3.17Å |
| 219 | R | 57.3 | Low | 61 | Low | 214 Ų | 214 | 101.7 Ų | 101.7 | 81% | 0.808 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.4 | -9.5 | 169.7 | -73.5 | 177.4 | -178.2 | -161.3 | 1.9 | 113.7 | T215 L217 | T215-R219 WeakPolarHBondContact O-CG 3.35Å; T215-R219 PolarHBondContact O-N 3.31Å; L217-R219 PolarHBondContact O-N 3.43Å |
| 220 | S | 55.9 | Low | 60.2 | Low | 67 Ų | 67 | 102.3 Ų | 102.3 | 47% | 0.469 | 55% | 0.549 | S | S | . | . | S | Bend | trans | -78.2 | 135.2 | 170.3 | 74.4 | 0 | 0 | 0 | 0 | 109.5 | L217 S222 | L217-S220 WeakPolarHBondContact O-CB 3.5Å; L217-S220 PolarHBondContact O-N 3.15Å; L217-S220 PolarHBondContact O-OG 3.25Å; S220-S222 PolarHBondContact O-N 2.83Å; S220-S222 VanDerWaalsContact O-N 3.15Å |
| 221 | P | 57.2 | Low | 59.5 | Low | 93 Ų | 93 | 97.3 Ų | 97.3 | 60% | 0.604 | 54% | 0.539 | S | S | * | . | P | Polyproline II helix | trans | -59.6 | 123.1 | 177 | 23.4 | -30.9 | 0 | 0 | 0 | 108.9 | ||
| 222 | S | 57.3 | Low | 58.8 | Low | 68 Ų | 68 | 96.7 Ų | 96.7 | 48% | 0.476 | 55% | 0.545 | S | S | . | . | P | Polyproline II helix | trans | -58.1 | 150.1 | -179.8 | 70 | 0 | 0 | 0 | 0 | 110.8 | S220 A224 S225 L226 | S220-S222 PolarHBondContact O-N 2.83Å; S220-S222 VanDerWaalsContact O-N 3.15Å; S222-A224 PolarHBondContact O-N 3.31Å; S222-S225 WeakPolarHBondContact O-CA 3.22Å; S222-S225 VanDerWaalsContact O-CB 3.28Å; S222-S225 WeakPolarHBondContact O-CB 3.35Å; S222-S225 PolarHBondContact O-N 3.04Å; S222-S225 PolarHBondContact OG-N 3.44Å; S222-L226 PolarHBondContact O-N 2.83Å |
| 223 | L | 59.8 | Low | 58.1 | Low | 150 Ų | 150 | 99.5 Ų | 99.5 | 79% | 0.785 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -54 | -27.8 | 175.1 | -79.2 | 169.8 | 0 | 0 | 0 | 112.6 | L226 R227 | L223-L226 PolarHBondContact O-N 3.34Å; L223-R227 WeakPolarHBondContact O-CB 3.41Å; L223-R227 PolarHBondContact O-N 3.5Å |
| 224 | A | 57 | Low | 57.5 | Low | 77 Ų | 77 | 100.2 Ų | 100.2 | 64% | 0.636 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -67.2 | -40.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | S222 L226 R227 G228 | S222-A224 PolarHBondContact O-N 3.31Å; A224-L226 VanDerWaalsContact C-N 3.34Å; A224-R227 PolarHBondContact O-N 3.36Å; A224-G228 PolarHBondContact O-N 2.85Å; A224-G228 VanDerWaalsContact O-N 3.08Å |
| 225 | S | 57.4 | Low | 56.9 | Low | 72 Ų | 72 | 102.9 Ų | 102.9 | 50% | 0.503 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -66.2 | -37.2 | 173.3 | -150.9 | 0 | 0 | 0 | 0 | 111.6 | S222 S229 | S222-S225 WeakPolarHBondContact O-CA 3.22Å; S222-S225 VanDerWaalsContact O-CB 3.28Å; S222-S225 WeakPolarHBondContact O-CB 3.35Å; S222-S225 PolarHBondContact O-N 3.04Å; S222-S225 PolarHBondContact OG-N 3.44Å; S225-S229 PolarHBondContact O-N 2.89Å; S225-S229 PolarHBondContact O-OG 3.21Å |
| 226 | L | 56.9 | Low | 56.5 | Low | 83 Ų | 83 | 109.3 Ų | 109.3 | 44% | 0.435 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -65.7 | -45 | 174.4 | -142.7 | 88.1 | 0 | 0 | 0 | 111.9 | S222 L223 A224 G228 S229 M230 | S222-L226 PolarHBondContact O-N 2.83Å; L223-L226 PolarHBondContact O-N 3.34Å; A224-L226 VanDerWaalsContact C-N 3.34Å; L226-G228 VanDerWaalsContact C-N 3.34Å; L226-G228 PolarHBondContact O-N 2.71Å; L226-S229 WeakPolarHBondContact CA-OG 3.25Å; L226-S229 PolarHBondContact O-N 3.13Å; L226-S229 PolarHBondContact O-OG 2.83Å; L226-M230 WeakPolarHBondContact O-CG 3.26Å; L226-M230 PolarHBondContact O-N 2.87Å |
| 227 | R | 60.6 | Low | 56.2 | Low | 202 Ų | 202 | 108 Ų | 108 | 76% | 0.762 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -64.2 | -38.5 | 179.4 | -164.8 | 178.5 | -173.2 | -133.5 | 2.4 | 112.1 | L223 A224 S231 | L223-R227 WeakPolarHBondContact O-CB 3.41Å; L223-R227 PolarHBondContact O-N 3.5Å; A224-R227 PolarHBondContact O-N 3.36Å; R227-S231 PolarHBondContact O-N 3.41Å; R227-S231 PolarHBondContact O-OG 2.82Å; R227-S231 VanDerWaalsContact O-OG 3.12Å |
| 228 | G | 58 | Low | 55.8 | Low | 31 Ų | 31 | 105.9 Ų | 105.9 | 32% | 0.32 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -72.2 | -28.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | A224 L226 S231 N232 | A224-G228 PolarHBondContact O-N 2.85Å; A224-G228 VanDerWaalsContact O-N 3.08Å; L226-G228 VanDerWaalsContact C-N 3.34Å; L226-G228 PolarHBondContact O-N 2.71Å; G228-S231 WeakPolarHBondContact CA-OG 3.25Å; G228-S231 PolarHBondContact O-OG 3.46Å; G228-S231 VanDerWaalsContact O-OG 3.08Å; G228-N232 PolarHBondContact O-N 2.89Å; G228-N232 PolarHBondContact O-ND2 2.71Å |
| 229 | S | 56.2 | Low | 55.6 | Low | 56 Ų | 56 | 108.9 Ų | 108.9 | 39% | 0.392 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -78.8 | -34.1 | 176 | 39 | 0 | 0 | 0 | 0 | 112.3 | S225 L226 N232 L233 | S225-S229 PolarHBondContact O-N 2.89Å; S225-S229 PolarHBondContact O-OG 3.21Å; L226-S229 WeakPolarHBondContact CA-OG 3.25Å; L226-S229 PolarHBondContact O-N 3.13Å; L226-S229 PolarHBondContact O-OG 2.83Å; S229-N232 PolarHBondContact O-N 3.34Å; S229-L233 PolarHBondContact O-N 3.37Å |
| 230 | M | 54.4 | Low | 55.1 | Low | 122 Ų | 122 | 104.2 Ų | 104.2 | 60% | 0.601 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -67.7 | -39.2 | 174.6 | -67.3 | -154.6 | -46.6 | 0 | 0 | 113.4 | L226 N232 L233 A234 | L226-M230 WeakPolarHBondContact O-CG 3.26Å; L226-M230 PolarHBondContact O-N 2.87Å; M230-N232 VanDerWaalsContact C-N 3.31Å; M230-N232 PolarHBondContact O-N 3.41Å; M230-L233 WeakPolarHBondContact O-CB 3.16Å; M230-L233 PolarHBondContact O-N 2.92Å; M230-A234 PolarHBondContact O-N 3.35Å |
| 231 | S | 58.7 | Low | 54.8 | Low | 59 Ų | 59 | 108.7 Ų | 108.7 | 41% | 0.413 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -65.4 | -35.6 | 175.7 | 45 | 0 | 0 | 0 | 0 | 112.1 | R227 G228 A234 F235 | R227-S231 PolarHBondContact O-N 3.41Å; R227-S231 PolarHBondContact O-OG 2.82Å; R227-S231 VanDerWaalsContact O-OG 3.12Å; G228-S231 WeakPolarHBondContact CA-OG 3.25Å; G228-S231 PolarHBondContact O-OG 3.46Å; G228-S231 VanDerWaalsContact O-OG 3.08Å; S231-A234 PolarHBondContact O-N 3.19Å; S231-F235 WeakPolarHBondContact O-CD2 3.48Å; S231-F235 PolarHBondContact O-N 3.5Å |
| 232 | N | 56.5 | Low | 54.5 | Low | 113 Ų | 113 | 109.8 Ų | 109.8 | 60% | 0.604 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -70.3 | -29.7 | 173 | -77.7 | -45.5 | 0 | 0 | 0 | 113.4 | G228 S229 M230 R236 | G228-N232 PolarHBondContact O-N 2.89Å; G228-N232 PolarHBondContact O-ND2 2.71Å; S229-N232 PolarHBondContact O-N 3.34Å; M230-N232 VanDerWaalsContact C-N 3.31Å; M230-N232 PolarHBondContact O-N 3.41Å; N232-R236 PolarHBondContact O-N 2.9Å |
| 233 | L | 54.2 | Low | 53.9 | Low | 127 Ų | 127 | 110.9 Ų | 110.9 | 67% | 0.665 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -69.4 | -42.3 | 171.3 | -113.5 | 72.6 | 0 | 0 | 0 | 111.6 | S229 M230 F235 R236 A237 | S229-L233 PolarHBondContact O-N 3.37Å; M230-L233 WeakPolarHBondContact O-CB 3.16Å; M230-L233 PolarHBondContact O-N 2.92Å; L233-F235 VanDerWaalsContact C-N 3.3Å; L233-F235 PolarHBondContact O-N 3.23Å; L233-R236 PolarHBondContact O-N 3.1Å; L233-R236 VanDerWaalsContact O-N 3.16Å; L233-A237 WeakPolarHBondContact O-CB 3.37Å; L233-A237 PolarHBondContact O-N 3.35Å |
| 234 | A | 54.7 | Low | 53 | Low | 69 Ų | 69 | 106.8 Ų | 106.8 | 57% | 0.57 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -62 | -36 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | M230 S231 | M230-A234 PolarHBondContact O-N 3.35Å; S231-A234 PolarHBondContact O-N 3.19Å |
| 235 | F | 53.3 | Low | 52.6 | Low | 171 Ų | 171 | 110.8 Ų | 110.8 | 75% | 0.75 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -78.7 | -21 | 175.8 | -88.6 | -82.6 | 0 | 0 | 0 | 114.5 | S231 L233 S238 | S231-F235 WeakPolarHBondContact O-CD2 3.48Å; S231-F235 PolarHBondContact O-N 3.5Å; L233-F235 VanDerWaalsContact C-N 3.3Å; L233-F235 PolarHBondContact O-N 3.23Å; F235-S238 PolarHBondContact O-OG 3.28Å |
| 236 | R | 53.4 | Low | 52.1 | Low | 198 Ų | 198 | 111.5 Ų | 111.5 | 75% | 0.747 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -93.1 | -22.4 | 176.3 | -85.3 | -172.8 | 176.9 | -144.3 | -0.2 | 114.2 | N232 L233 S238 Q239 | N232-R236 PolarHBondContact O-N 2.9Å; L233-R236 PolarHBondContact O-N 3.1Å; L233-R236 VanDerWaalsContact O-N 3.16Å; R236-S238 PolarHBondContact O-N 2.73Å; R236-Q239 PolarHBondContact O-N 3.06Å |
| 237 | A | 48.1 | Very low | 52 | Low | 72 Ų | 72 | 112.2 Ų | 112.2 | 60% | 0.595 | 66% | 0.659 | S | S | * | * | G | 310 helix | trans | -67 | -22.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | L233 Q239 | L233-A237 WeakPolarHBondContact O-CB 3.37Å; L233-A237 PolarHBondContact O-N 3.35Å; A237-Q239 VanDerWaalsContact C-N 3.29Å; A237-Q239 PolarHBondContact O-N 3.24Å |
| 238 | S | 49.6 | Very low | 51.4 | Low | 86 Ų | 86 | 110.9 Ų | 110.9 | 60% | 0.601 | 66% | 0.662 | S | S | * | * | G | 310 helix | trans | -77.6 | -7.3 | 178.1 | 55.9 | 0 | 0 | 0 | 0 | 114.8 | F235 R236 | F235-S238 PolarHBondContact O-OG 3.28Å; R236-S238 PolarHBondContact O-N 2.73Å |
| 239 | Q | 50.1 | Low | 51.3 | Low | 156 Ų | 156 | 114.7 Ų | 114.7 | 73% | 0.729 | 67% | 0.674 | S | S | * | * | G | 310 helix | trans | -119.9 | 13.5 | -176.9 | -64 | -68.5 | -6.8 | 0 | 0 | 113.5 | R236 A237 | R236-Q239 PolarHBondContact O-N 3.06Å; A237-Q239 VanDerWaalsContact C-N 3.29Å; A237-Q239 PolarHBondContact O-N 3.24Å |
| 240 | L | 47.5 | Very low | 51.3 | Low | 116 Ų | 116 | 115.2 Ų | 115.2 | 61% | 0.607 | 68% | 0.677 | S | S | * | * | trans | -102 | 60.4 | 178.2 | -93.2 | 151.5 | 0 | 0 | 0 | 111.2 | L242 | L240-L242 VanDerWaalsContact C-N 3.28Å; L240-L242 HydrophobicContact CD2-CB 4.01Å; L240-L242 HydrophobicContact CD2-CD1 4.12Å; L240-L242 HydrophobicContact CD2-CD2 4.39Å; L240-L242 HydrophobicContact CD2-CG 4.4Å; L240-L242 PolarHBondContact O-N 3.47Å | ||
| 241 | N | 49.9 | Very low | 51.6 | Low | 162 Ų | 162 | 114.4 Ų | 114.4 | 87% | 0.866 | 68% | 0.68 | S | S | * | * | trans | -85.4 | 77.7 | 153 | -77.6 | -45.4 | 0 | 0 | 0 | 107.6 | ||||
| 242 | L | 50.1 | Low | 51.5 | Low | 115 Ų | 115 | 117.4 Ų | 117.4 | 60% | 0.602 | 69% | 0.692 | S | S | * | * | trans | -112.7 | 31.8 | -177.3 | -114.6 | 87.2 | 0 | 0 | 0 | 113.7 | L240 | L240-L242 VanDerWaalsContact C-N 3.28Å; L240-L242 HydrophobicContact CD2-CB 4.01Å; L240-L242 HydrophobicContact CD2-CD1 4.12Å; L240-L242 HydrophobicContact CD2-CD2 4.39Å; L240-L242 HydrophobicContact CD2-CG 4.4Å; L240-L242 PolarHBondContact O-N 3.47Å | ||
| 243 | A | 44.4 | Very low | 51.4 | Low | 91 Ų | 91 | 115.7 Ų | 115.7 | 75% | 0.752 | 68% | 0.682 | S | S | * | * | trans | -139.7 | 77.2 | 171.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 244 | G | 41.3 | Very low | 51.6 | Low | 65 Ų | 65 | 113.9 Ų | 113.9 | 67% | 0.67 | 68% | 0.677 | S | S | * | * | trans | -62.3 | 140.6 | 149.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | S246 | G244-S246 PolarHBondContact O-N 3.17Š| ||
| 245 | T | 48.5 | Very low | 51.7 | Low | 161 Ų | 161 | 119 Ų | 119 | 99% | 0.988 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -66.2 | 21.3 | -168.7 | 47.9 | 0 | 0 | 0 | 0 | 116 | ||
| 246 | S | 47.5 | Very low | 51.7 | Low | 86 Ų | 86 | 118.9 Ų | 118.9 | 60% | 0.601 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -138.2 | 114.2 | 174.1 | 56.1 | 0 | 0 | 0 | 0 | 106.9 | G244 E248 | G244-S246 PolarHBondContact O-N 3.17Å; S246-E248 PolarHBondContact O-N 2.88Å |
| 247 | G | 54.8 | Low | 51.8 | Low | 98 Ų | 98 | 112.6 Ų | 112.6 | 100% | 1.01 | 68% | 0.676 | S | S | * | * | trans | -64.3 | 34.5 | -173.1 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 248 | E | 48.3 | Very low | 51.8 | Low | 174 Ų | 174 | 112.2 Ų | 112.2 | 81% | 0.813 | 67% | 0.669 | S | S | * | * | trans | -100.5 | 114 | 169 | -110.9 | -175.4 | 162.1 | 0 | 0 | 109.8 | S246 | S246-E248 PolarHBondContact O-N 2.88Š| ||
| 249 | L | 54.8 | Low | 52.2 | Low | 111 Ų | 111 | 114.3 Ų | 114.3 | 58% | 0.581 | 68% | 0.678 | S | S | * | * | trans | -67.1 | 135.6 | 167.4 | -78 | 161.7 | 0 | 0 | 0 | 108.6 | ||||
| 250 | P | 58 | Low | 52.3 | Low | 68 Ų | 68 | 112.3 Ų | 112.3 | 44% | 0.442 | 67% | 0.672 | S | S | . | * | trans | -50.3 | 136.9 | 172.9 | -24.2 | 28.2 | 0 | 0 | 0 | 110.9 | N252 L253 | P250-N252 PolarHBondContact O-N 2.65Å; P250-L253 HydrophobicContact CB-CD1 4.34Å; P250-L253 HydrophobicContact CG-CD1 3.97Å; P250-L253 PolarHBondContact O-N 2.87Å | ||
| 251 | P | 59.5 | Low | 52.5 | Low | 105 Ų | 105 | 109.2 Ų | 109.2 | 68% | 0.682 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.5 | -15.6 | -176.1 | 20.3 | -31.5 | 0 | 0 | 0 | 113.9 | ||
| 252 | N | 55.9 | Low | 52.7 | Low | 121 Ų | 121 | 106.3 Ų | 106.3 | 65% | 0.647 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | -9.3 | 175.7 | -70.7 | -44.3 | 0 | 0 | 0 | 114.4 | P250 | P250-N252 PolarHBondContact O-N 2.65Š|
| 253 | L | 55.6 | Low | 52.9 | Low | 78 Ų | 78 | 104.2 Ų | 104.2 | 41% | 0.408 | 65% | 0.649 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -103.5 | -13.8 | 179.8 | -68.3 | 173.3 | 0 | 0 | 0 | 113.4 | P250 K255 F256 A257 | P250-L253 HydrophobicContact CB-CD1 4.34Å; P250-L253 HydrophobicContact CG-CD1 3.97Å; P250-L253 PolarHBondContact O-N 2.87Å; L253-K255 PolarHBondContact O-N 2.92Å; L253-F256 HydrophobicContact CD2-CD2 4.34Å; L253-F256 PolarHBondContact O-N 3.36Å; L253-A257 PolarHBondContact O-N 2.9Å |
| 254 | T | 57.9 | Low | 53.3 | Low | 89 Ų | 89 | 108.6 Ų | 108.6 | 55% | 0.546 | 65% | 0.646 | S | S | . | * | G | 310 helix | trans | -59.3 | -29.2 | 176.2 | -43.1 | 0 | 0 | 0 | 0 | 112.3 | F256 A257 | T254-F256 PolarHBondContact O-N 2.86Å; T254-A257 WeakPolarHBondContact O-CB 3.3Å; T254-A257 PolarHBondContact O-N 2.82Å |
| 255 | K | 57 | Low | 53.9 | Low | 175 Ų | 175 | 111 Ų | 111 | 76% | 0.761 | 64% | 0.64 | S | S | * | * | G | 310 helix | trans | -72.1 | -17.2 | 177.5 | -50.6 | -178.6 | -169.7 | -179.6 | 0 | 113.1 | L253 | L253-K255 PolarHBondContact O-N 2.92Š|
| 256 | F | 53.8 | Low | 54.1 | Low | 169 Ų | 169 | 106.5 Ų | 106.5 | 74% | 0.741 | 62% | 0.615 | S | S | * | * | G | 310 helix | trans | -103.9 | 1.6 | 175.2 | -62.6 | -73.8 | 0 | 0 | 0 | 112.9 | L253 T254 S258 | L253-F256 HydrophobicContact CD2-CD2 4.34Å; L253-F256 PolarHBondContact O-N 3.36Å; T254-F256 PolarHBondContact O-N 2.86Å; F256-S258 PolarHBondContact O-N 2.62Å |
| 257 | A | 54.5 | Low | 54.4 | Low | 67 Ų | 67 | 107.6 Ų | 107.6 | 55% | 0.554 | 61% | 0.614 | S | S | * | * | trans | -68.3 | 83.6 | 168.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | L253 T254 V259 | L253-A257 PolarHBondContact O-N 2.9Å; T254-A257 WeakPolarHBondContact O-CB 3.3Å; T254-A257 PolarHBondContact O-N 2.82Å; A257-V259 PolarHBondContact O-N 2.91Å; A257-V259 VanDerWaalsContact O-N 3.11Å | ||
| 258 | S | 48.7 | Very low | 54.4 | Low | 64 Ų | 64 | 106 Ų | 106 | 45% | 0.448 | 59% | 0.587 | S | S | . | * | trans | -53.5 | 118.5 | 178.5 | 177.9 | 0 | 0 | 0 | 0 | 109.5 | F256 N260 S261 | F256-S258 PolarHBondContact O-N 2.62Å; S258-N260 PolarHBondContact O-N 3.31Å; S258-N260 VanDerWaalsContact OG-C 3.31Å; S258-N260 WeakPolarHBondContact OG-CA 3.43Å; S258-N260 PolarHBondContact OG-N 2.86Å; S258-N260 VanDerWaalsContact OG-N 3.14Å; S258-S261 WeakPolarHBondContact O-CB 3.36Å; S258-S261 PolarHBondContact O-N 3.32Å | ||
| 259 | V | 57.1 | Low | 54.7 | Low | 129 Ų | 129 | 100.5 Ų | 100.5 | 78% | 0.782 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.5 | -14.2 | 167.1 | -84.5 | 0 | 0 | 0 | 0 | 112.3 | A257 | A257-V259 PolarHBondContact O-N 2.91Å; A257-V259 VanDerWaalsContact O-N 3.11Å |
| 260 | N | 53.8 | Low | 54.8 | Low | 115 Ų | 115 | 100.4 Ų | 100.4 | 62% | 0.615 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108 | 34.7 | 171.9 | -77.3 | -20 | 0 | 0 | 0 | 112.8 | S258 | S258-N260 PolarHBondContact O-N 3.31Å; S258-N260 VanDerWaalsContact OG-C 3.31Å; S258-N260 WeakPolarHBondContact OG-CA 3.43Å; S258-N260 PolarHBondContact OG-N 2.86Å; S258-N260 VanDerWaalsContact OG-N 3.14Å |
| 261 | S | 50.2 | Low | 54.9 | Low | 50 Ų | 50 | 104 Ų | 104 | 35% | 0.35 | 57% | 0.574 | S | S | . | * | trans | -62.2 | 132.4 | 173 | -133.4 | 0 | 0 | 0 | 0 | 110 | S258 A263 R264 Q265 | S258-S261 WeakPolarHBondContact O-CB 3.36Å; S258-S261 PolarHBondContact O-N 3.32Å; S261-A263 PolarHBondContact O-N 3.37Å; S261-R264 PolarHBondContact O-N 3.45Å; S261-Q265 PolarHBondContact O-N 3.45Å | ||
| 262 | P | 55.4 | Low | 55.1 | Low | 101 Ų | 101 | 105.8 Ų | 105.8 | 66% | 0.656 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -52.5 | -30.5 | 179.2 | -28.3 | 34.7 | 0 | 0 | 0 | 113.7 | R264 Q265 S266 | P262-R264 VanDerWaalsContact C-N 3.31Å; P262-R264 PolarHBondContact O-N 3.44Å; P262-Q265 PolarHBondContact O-N 2.85Å; P262-S266 WeakPolarHBondContact O-CB 3.28Å; P262-S266 PolarHBondContact O-N 3.18Å |
| 263 | A | 53.7 | Low | 55.3 | Low | 71 Ų | 71 | 103.5 Ų | 103.5 | 59% | 0.587 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -61.3 | -34 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | S261 | S261-A263 PolarHBondContact O-N 3.37Å |
| 264 | R | 52.4 | Low | 56.1 | Low | 183 Ų | 183 | 103.4 Ų | 103.4 | 69% | 0.691 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -81.3 | -31.7 | 176.1 | -76.9 | -176.6 | 154.6 | -111.7 | -3.2 | 112.6 | S261 P262 S266 | S261-R264 PolarHBondContact O-N 3.45Å; P262-R264 VanDerWaalsContact C-N 3.31Å; P262-R264 PolarHBondContact O-N 3.44Å; R264-S266 VanDerWaalsContact C-N 3.33Å |
| 265 | Q | 54.2 | Low | 56.9 | Low | 115 Ų | 115 | 103.6 Ų | 103.6 | 54% | 0.537 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -68.1 | -34.1 | 172.4 | -67.6 | -173.4 | 0 | 0 | 0 | 112.1 | S261 P262 L267 S268 S269 | S261-Q265 PolarHBondContact O-N 3.45Å; P262-Q265 PolarHBondContact O-N 2.85Å; Q265-L267 VanDerWaalsContact C-N 3.29Å; Q265-L267 PolarHBondContact O-N 3.37Å; Q265-S268 PolarHBondContact O-N 3.21Å; Q265-S268 VanDerWaalsContact O-N 3.14Å; Q265-S269 PolarHBondContact O-N 3.48Å; Q265-S269 PolarHBondContact O-OG 2.86Å |
| 266 | S | 52.3 | Low | 57.9 | Low | 67 Ų | 67 | 104.6 Ų | 104.6 | 47% | 0.469 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -58.6 | -37 | 176.1 | -171.8 | 0 | 0 | 0 | 0 | 113.2 | P262 R264 S269 M270 | P262-S266 WeakPolarHBondContact O-CB 3.28Å; P262-S266 PolarHBondContact O-N 3.18Å; R264-S266 VanDerWaalsContact C-N 3.33Å; S266-S269 WeakPolarHBondContact CA-OG 3.07Å; S266-S269 PolarHBondContact O-OG 3.42Å; S266-M270 VanDerWaalsContact O-CB 3.28Å; S266-M270 WeakPolarHBondContact O-CB 3.48Å; S266-M270 PolarHBondContact O-N 2.62Å |
| 267 | L | 54.2 | Low | 59.5 | Low | 109 Ų | 109 | 102.3 Ų | 102.3 | 57% | 0.571 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -71.5 | -34.2 | 177.1 | -62 | 175.1 | 0 | 0 | 0 | 112.2 | Q265 M270 K271 | Q265-L267 VanDerWaalsContact C-N 3.29Å; Q265-L267 PolarHBondContact O-N 3.37Å; L267-M270 HydrophobicContact CD2-CE 3.93Å; L267-K271 PolarHBondContact O-N 2.83Å; L267-K271 VanDerWaalsContact O-N 3.12Å |
| 268 | S | 56.1 | Low | 60.9 | Low | 64 Ų | 64 | 101.8 Ų | 101.8 | 45% | 0.448 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -72.2 | -39.4 | 176.3 | -173 | 0 | 0 | 0 | 0 | 112 | Q265 K271 K272 | Q265-S268 PolarHBondContact O-N 3.21Å; Q265-S268 VanDerWaalsContact O-N 3.14Å; S268-K271 PolarHBondContact O-N 3.47Å; S268-K272 WeakPolarHBondContact O-CG 3.39Å; S268-K272 PolarHBondContact O-N 2.85Å; S268-K272 VanDerWaalsContact O-N 3.1Å |
| 269 | S | 53.9 | Low | 62.6 | Low | 60 Ų | 60 | 101.3 Ų | 101.3 | 42% | 0.42 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -66.9 | -39.5 | 174.2 | 60 | 0 | 0 | 0 | 0 | 111.7 | Q265 S266 K271 K272 T273 | Q265-S269 PolarHBondContact O-N 3.48Å; Q265-S269 PolarHBondContact O-OG 2.86Å; S266-S269 WeakPolarHBondContact CA-OG 3.07Å; S266-S269 PolarHBondContact O-OG 3.42Å; S269-K271 VanDerWaalsContact C-N 3.29Å; S269-K271 PolarHBondContact O-N 2.91Å; S269-K272 PolarHBondContact O-N 3.34Å; S269-T273 WeakPolarHBondContact O-CG2 3.32Å; S269-T273 PolarHBondContact O-N 3.34Å; S269-T273 PolarHBondContact O-OG1 3.28Å |
| 270 | M | 56 | Low | 64.3 | Low | 109 Ų | 109 | 99 Ų | 99 | 54% | 0.537 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.5 | -36.6 | 174.4 | -170.5 | 175.2 | 69.3 | 0 | 0 | 112.4 | S266 L267 T273 T274 | S266-M270 VanDerWaalsContact O-CB 3.28Å; S266-M270 WeakPolarHBondContact O-CB 3.48Å; S266-M270 PolarHBondContact O-N 2.62Å; L267-M270 HydrophobicContact CD2-CE 3.93Å; M270-T273 WeakPolarHBondContact CA-OG1 3.31Å; M270-T273 PolarHBondContact O-OG1 2.92Å; M270-T274 WeakPolarHBondContact O-CB 3.43Å; M270-T274 PolarHBondContact O-N 2.92Å; M270-T274 VanDerWaalsContact O-N 3.07Å; M270-T274 PolarHBondContact O-OG1 3.45Å |
| 271 | K | 61.8 | Low | 66.1 | Low | 142 Ų | 142 | 99.3 Ų | 99.3 | 62% | 0.617 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65.7 | -45.9 | 173.3 | -164.8 | 172.8 | -179.5 | -178.4 | 0 | 111.4 | L267 S268 S269 T273 T274 D275 | L267-K271 PolarHBondContact O-N 2.83Å; L267-K271 VanDerWaalsContact O-N 3.12Å; S268-K271 PolarHBondContact O-N 3.47Å; S269-K271 VanDerWaalsContact C-N 3.29Å; S269-K271 PolarHBondContact O-N 2.91Å; K271-T273 PolarHBondContact O-N 3.48Å; K271-T274 WeakPolarHBondContact O-CB 3.31Å; K271-T274 PolarHBondContact O-N 3.46Å; K271-T274 VanDerWaalsContact O-N 3.13Å; K271-D275 VanDerWaalsContact O-CG 3.28Å; K271-D275 PolarHBondContact O-N 3.41Å |
| 272 | K | 61.8 | Low | 68.1 | Low | 144 Ų | 144 | 101.9 Ų | 101.9 | 63% | 0.626 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -62.5 | -36.8 | 176.4 | -68.6 | 175.3 | -176.9 | -176.6 | 0 | 113.4 | S268 S269 T274 R276 | S268-K272 WeakPolarHBondContact O-CG 3.39Å; S268-K272 PolarHBondContact O-N 2.85Å; S268-K272 VanDerWaalsContact O-N 3.1Å; S269-K272 PolarHBondContact O-N 3.34Å; K272-T274 VanDerWaalsContact C-N 3.35Å; K272-R276 WeakPolarHBondContact O-CB 3.37Å; K272-R276 PolarHBondContact O-N 2.98Å |
| 273 | T | 62.1 | Low | 69.9 | Low | 73 Ų | 73 | 106.6 Ų | 106.6 | 45% | 0.448 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -68.1 | -37.5 | 174.8 | 53.3 | 0 | 0 | 0 | 0 | 111.4 | S269 M270 K271 R276 Q277 | S269-T273 WeakPolarHBondContact O-CG2 3.32Å; S269-T273 PolarHBondContact O-N 3.34Å; S269-T273 PolarHBondContact O-OG1 3.28Å; M270-T273 WeakPolarHBondContact CA-OG1 3.31Å; M270-T273 PolarHBondContact O-OG1 2.92Å; K271-T273 PolarHBondContact O-N 3.48Å; T273-R276 PolarHBondContact O-N 2.71Å; T273-Q277 WeakPolarHBondContact O-CB 3.5Å; T273-Q277 WeakPolarHBondContact O-CG 3.46Å; T273-Q277 PolarHBondContact O-N 3.44Å |
| 274 | T | 72.3 | Confident | 71.8 | Confident | 75 Ų | 75 | 107.8 Ų | 107.8 | 46% | 0.46 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63.7 | -45.1 | 174.8 | -52.7 | 0 | 0 | 0 | 0 | 111.2 | M270 K271 K272 R276 Q277 A278 | M270-T274 WeakPolarHBondContact O-CB 3.43Å; M270-T274 PolarHBondContact O-N 2.92Å; M270-T274 VanDerWaalsContact O-N 3.07Å; M270-T274 PolarHBondContact O-OG1 3.45Å; K271-T274 WeakPolarHBondContact O-CB 3.31Å; K271-T274 PolarHBondContact O-N 3.46Å; K271-T274 VanDerWaalsContact O-N 3.13Å; K272-T274 VanDerWaalsContact C-N 3.35Å; T274-R276 VanDerWaalsContact C-N 3.34Å; T274-R276 PolarHBondContact O-N 2.88Å; T274-Q277 WeakPolarHBondContact O-CB 3.21Å; T274-Q277 PolarHBondContact O-N 2.83Å; T274-A278 PolarHBondContact O-N 2.94Å |
| 275 | D | 73.2 | Confident | 73.5 | Confident | 94 Ų | 94 | 100.3 Ų | 100.3 | 50% | 0.503 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.5 | -40.2 | 177.5 | -62.2 | -25.3 | 0 | 0 | 0 | 111.5 | K271 A278 A279 | K271-D275 VanDerWaalsContact O-CG 3.28Å; K271-D275 PolarHBondContact O-N 3.41Å; D275-A278 PolarHBondContact O-N 3.16Å; D275-A279 PolarHBondContact O-N 3.21Å |
| 276 | R | 79.3 | Confident | 75.2 | Confident | 196 Ų | 196 | 102.3 Ų | 102.3 | 74% | 0.74 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.3 | -39.3 | 175.4 | -166.1 | 176.8 | -165.7 | -134.7 | 3.1 | 112.1 | K272 T273 T274 A279 V280 | K272-R276 WeakPolarHBondContact O-CB 3.37Å; K272-R276 PolarHBondContact O-N 2.98Å; T273-R276 PolarHBondContact O-N 2.71Å; T274-R276 VanDerWaalsContact C-N 3.34Å; T274-R276 PolarHBondContact O-N 2.88Å; R276-A279 PolarHBondContact O-N 3Å; R276-V280 VanDerWaalsContact O-CG2 3.31Å; R276-V280 WeakPolarHBondContact O-CG2 3.35Å; R276-V280 PolarHBondContact O-N 3.06Å |
| 277 | Q | 85.8 | Confident | 77 | Confident | 121 Ų | 121 | 103.5 Ų | 103.5 | 57% | 0.565 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.9 | -42.3 | 174.5 | -76.1 | 168.6 | -11.7 | 0 | 0 | 111.1 | T273 T274 V280 L281 | T273-Q277 WeakPolarHBondContact O-CB 3.5Å; T273-Q277 WeakPolarHBondContact O-CG 3.46Å; T273-Q277 PolarHBondContact O-N 3.44Å; T274-Q277 WeakPolarHBondContact O-CB 3.21Å; T274-Q277 PolarHBondContact O-N 2.83Å; Q277-V280 PolarHBondContact O-N 3.18Å; Q277-L281 WeakPolarHBondContact O-CG 3.32Å; Q277-L281 PolarHBondContact O-N 3.19Å |
| 278 | A | 85.4 | Confident | 78.6 | Confident | 55 Ų | 55 | 104 Ų | 104 | 46% | 0.455 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.8 | -45.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | T274 D275 V280 L281 E282 | T274-A278 PolarHBondContact O-N 2.94Å; D275-A278 PolarHBondContact O-N 3.16Å; A278-V280 VanDerWaalsContact C-N 3.32Å; A278-V280 PolarHBondContact O-N 3.11Å; A278-L281 PolarHBondContact O-N 3.15Å; A278-E282 WeakPolarHBondContact O-CB 3.49Å; A278-E282 PolarHBondContact O-N 3.04Å |
| 279 | A | 84.3 | Confident | 79.8 | Confident | 54 Ų | 54 | 106.8 Ų | 106.8 | 45% | 0.446 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63 | -36.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113 | D275 R276 R283 | D275-A279 PolarHBondContact O-N 3.21Å; R276-A279 PolarHBondContact O-N 3Å; A279-R283 WeakPolarHBondContact O-CB 3.18Å; A279-R283 PolarHBondContact O-N 2.75Å |
| 280 | V | 92 | Very high | 81.1 | Confident | 80 Ų | 80 | 108 Ų | 108 | 49% | 0.485 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -67.3 | -44.4 | 174.5 | 170 | 0 | 0 | 0 | 0 | 110.9 | R276 Q277 A278 E282 R283 L284 | R276-V280 VanDerWaalsContact O-CG2 3.31Å; R276-V280 WeakPolarHBondContact O-CG2 3.35Å; R276-V280 PolarHBondContact O-N 3.06Å; Q277-V280 PolarHBondContact O-N 3.18Å; A278-V280 VanDerWaalsContact C-N 3.32Å; A278-V280 PolarHBondContact O-N 3.11Å; V280-E282 VanDerWaalsContact C-N 3.34Å; V280-E282 PolarHBondContact O-N 3.29Å; V280-R283 PolarHBondContact O-N 2.97Å; V280-L284 HydrophobicContact CG1-CD1 3.99Å; V280-L284 HydrophobicContact CG1-CG 4.43Å; V280-L284 WeakPolarHBondContact O-CB 3.26Å; V280-L284 VanDerWaalsContact O-CG 3.32Å; V280-L284 WeakPolarHBondContact O-CG 3.22Å; V280-L284 PolarHBondContact O-N 3.24Å |
| 281 | L | 92.8 | Very high | 82.3 | Confident | 122 Ų | 122 | 107.3 Ų | 107.3 | 64% | 0.639 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.6 | -41.2 | 176.9 | -72.8 | 172 | 0 | 0 | 0 | 111.8 | Q277 A278 L284 G285 | Q277-L281 WeakPolarHBondContact O-CG 3.32Å; Q277-L281 PolarHBondContact O-N 3.19Å; A278-L281 PolarHBondContact O-N 3.15Å; L281-L284 PolarHBondContact O-N 3.44Å; L281-G285 PolarHBondContact O-N 2.84Å |
| 282 | E | 91.6 | Very high | 82.6 | Confident | 105 Ų | 105 | 103.3 Ų | 103.3 | 49% | 0.491 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.6 | -45.6 | 175.1 | -168.5 | -168.8 | 167.9 | 0 | 0 | 111.2 | A278 V280 L284 G285 R286 | A278-E282 WeakPolarHBondContact O-CB 3.49Å; A278-E282 PolarHBondContact O-N 3.04Å; V280-E282 VanDerWaalsContact C-N 3.34Å; V280-E282 PolarHBondContact O-N 3.29Å; E282-L284 VanDerWaalsContact C-N 3.31Å; E282-L284 PolarHBondContact O-N 3.36Å; E282-G285 PolarHBondContact O-N 3.45Å; E282-G285 VanDerWaalsContact O-N 3.17Å; E282-R286 WeakPolarHBondContact O-CG 3.27Å; E282-R286 PolarHBondContact O-N 3.08Å; E282-R286 IonicContact OE1-CZ 3.26Å; E282-R286 VanDerWaalsContact OE1-CZ 3.26Å; E282-R286 IonicContact OE1-NE 3.97Å; E282-R286 PolarHBondContact OE1-NE 3.33Å; E282-R286 IonicContact OE1-NH2 2.63Å; E282-R286 PolarHBondContact OE1-NH2 3.34Å |
| 283 | R | 91.9 | Very high | 82.8 | Confident | 199 Ų | 199 | 100.8 Ų | 100.8 | 75% | 0.751 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.5 | -37.5 | 177.1 | -168.7 | 175.1 | -176 | -165.3 | 1 | 112.1 | A279 V280 L287 | A279-R283 WeakPolarHBondContact O-CB 3.18Å; A279-R283 PolarHBondContact O-N 2.75Å; V280-R283 PolarHBondContact O-N 2.97Å; R283-L287 VanDerWaalsContact O-CB 3.26Å; R283-L287 WeakPolarHBondContact O-CB 3.31Å; R283-L287 PolarHBondContact O-N 2.79Å |
| 284 | L | 93.8 | Very high | 82.7 | Confident | 97 Ų | 97 | 100.8 Ų | 100.8 | 51% | 0.508 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -67.8 | -38 | 173.5 | -74.4 | 171.7 | 0 | 0 | 0 | 111.9 | V280 L281 E282 L287 R288 | V280-L284 HydrophobicContact CG1-CD1 3.99Å; V280-L284 HydrophobicContact CG1-CG 4.43Å; V280-L284 WeakPolarHBondContact O-CB 3.26Å; V280-L284 VanDerWaalsContact O-CG 3.32Å; V280-L284 WeakPolarHBondContact O-CG 3.22Å; V280-L284 PolarHBondContact O-N 3.24Å; L281-L284 PolarHBondContact O-N 3.44Å; E282-L284 VanDerWaalsContact C-N 3.31Å; E282-L284 PolarHBondContact O-N 3.36Å; L284-L287 PolarHBondContact O-N 3.24Å; L284-R288 VanDerWaalsContact O-CB 3.25Å; L284-R288 WeakPolarHBondContact O-CB 3.39Å; L284-R288 PolarHBondContact O-N 3.18Å |
| 285 | G | 89.9 | Confident | 82.2 | Confident | 25 Ų | 25 | 103.6 Ų | 103.6 | 26% | 0.258 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.6 | -50.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | L281 E282 L287 R288 E289 | L281-G285 PolarHBondContact O-N 2.84Å; E282-G285 PolarHBondContact O-N 3.45Å; E282-G285 VanDerWaalsContact O-N 3.17Å; G285-L287 VanDerWaalsContact C-N 3.33Å; G285-L287 PolarHBondContact O-N 2.96Å; G285-R288 WeakPolarHBondContact O-CB 3.31Å; G285-R288 PolarHBondContact O-N 3.21Å; G285-E289 WeakPolarHBondContact O-CB 3.38Å; G285-E289 WeakPolarHBondContact O-CG 3.13Å; G285-E289 PolarHBondContact O-N 2.95Å |
| 286 | R | 88.6 | Confident | 81.3 | Confident | 158 Ų | 158 | 107.7 Ų | 107.7 | 60% | 0.596 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -61.6 | -38.9 | 175.6 | -67.3 | 178.6 | -174.4 | -155.7 | 2 | 112.5 | E282 E289 S290 | E282-R286 WeakPolarHBondContact O-CG 3.27Å; E282-R286 PolarHBondContact O-N 3.08Å; E282-R286 IonicContact OE1-CZ 3.26Å; E282-R286 VanDerWaalsContact OE1-CZ 3.26Å; E282-R286 IonicContact OE1-NE 3.97Å; E282-R286 PolarHBondContact OE1-NE 3.33Å; E282-R286 IonicContact OE1-NH2 2.63Å; E282-R286 PolarHBondContact OE1-NH2 3.34Å; R286-E289 PolarHBondContact O-N 3.49Å; R286-S290 VanDerWaalsContact O-CB 3.25Å; R286-S290 WeakPolarHBondContact O-CB 3.32Å; R286-S290 PolarHBondContact O-N 2.97Å |
| 287 | L | 90.3 | Very high | 80.1 | Confident | 92 Ų | 92 | 104.8 Ų | 104.8 | 48% | 0.482 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -65.8 | -44.2 | 175.6 | 178.4 | 62.5 | 0 | 0 | 0 | 111.1 | R283 L284 G285 S290 L291 | R283-L287 VanDerWaalsContact O-CB 3.26Å; R283-L287 WeakPolarHBondContact O-CB 3.31Å; R283-L287 PolarHBondContact O-N 2.79Å; L284-L287 PolarHBondContact O-N 3.24Å; G285-L287 VanDerWaalsContact C-N 3.33Å; G285-L287 PolarHBondContact O-N 2.96Å; L287-S290 PolarHBondContact O-N 2.95Å; L287-L291 HydrophobicContact CD1-CD1 4.16Å; L287-L291 HydrophobicContact CD1-CG 4.18Å; L287-L291 HydrophobicContact CG-CD1 4.03Å; L287-L291 HydrophobicContact CG-CG 4.46Å; L287-L291 WeakPolarHBondContact O-CB 3.35Å; L287-L291 WeakPolarHBondContact O-CG 3.29Å; L287-L291 PolarHBondContact O-N 2.92Å |
| 288 | R | 87 | Confident | 78.8 | Confident | 118 Ų | 118 | 104.7 Ų | 104.7 | 45% | 0.445 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -57.6 | -50.5 | 174.1 | 173.6 | 175.8 | -177 | -82.8 | -2.9 | 110 | L284 G285 S290 L291 H292 | L284-R288 VanDerWaalsContact O-CB 3.25Å; L284-R288 WeakPolarHBondContact O-CB 3.39Å; L284-R288 PolarHBondContact O-N 3.18Å; G285-R288 WeakPolarHBondContact O-CB 3.31Å; G285-R288 PolarHBondContact O-N 3.21Å; R288-S290 PolarHBondContact O-N 3.27Å; R288-L291 PolarHBondContact O-N 3.5Å; R288-H292 VanDerWaalsContact CG-CD2 3.4Å; R288-H292 WeakPolarHBondContact CG-CD2 3.33Å; R288-H292 WeakPolarHBondContact O-CB 3.33Å; R288-H292 PolarHBondContact O-CD2 3.14Å; R288-H292 PolarHBondContact O-N 3.34Å |
| 289 | E | 83 | Confident | 77.2 | Confident | 124 Ų | 124 | 105.1 Ų | 105.1 | 58% | 0.579 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -61 | -43.5 | 177.6 | -72.2 | 168.3 | -170.1 | 0 | 0 | 112.4 | G285 R286 H292 A293 | G285-E289 WeakPolarHBondContact O-CB 3.38Å; G285-E289 WeakPolarHBondContact O-CG 3.13Å; G285-E289 PolarHBondContact O-N 2.95Å; R286-E289 PolarHBondContact O-N 3.49Å; E289-H292 CarbonylContact O-C 3.42Å; E289-H292 PolarHBondContact O-N 3.04Å; E289-H292 VanDerWaalsContact O-N 3.13Å; E289-A293 WeakPolarHBondContact O-CB 3.41Å; E289-A293 PolarHBondContact O-N 3.38Å |
| 290 | S | 81.3 | Confident | 75.6 | Confident | 84 Ų | 84 | 107.5 Ų | 107.5 | 59% | 0.587 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -63.5 | -41.7 | 176.5 | 176.9 | 0 | 0 | 0 | 0 | 112.3 | R286 L287 R288 H292 A293 | R286-S290 VanDerWaalsContact O-CB 3.25Å; R286-S290 WeakPolarHBondContact O-CB 3.32Å; R286-S290 PolarHBondContact O-N 2.97Å; L287-S290 PolarHBondContact O-N 2.95Å; R288-S290 PolarHBondContact O-N 3.27Å; S290-H292 VanDerWaalsContact C-N 3.28Å; S290-H292 PolarHBondContact O-N 3.47Å; S290-A293 PolarHBondContact O-N 3.38Å |
| 291 | L | 79.6 | Confident | 73.7 | Confident | 95 Ų | 95 | 114.9 Ų | 114.9 | 50% | 0.497 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -66.4 | -31.6 | 173.6 | -70.8 | 172.7 | 0 | 0 | 0 | 111.8 | L287 R288 K295 | L287-L291 HydrophobicContact CD1-CD1 4.16Å; L287-L291 HydrophobicContact CD1-CG 4.18Å; L287-L291 HydrophobicContact CG-CD1 4.03Å; L287-L291 HydrophobicContact CG-CG 4.46Å; L287-L291 WeakPolarHBondContact O-CB 3.35Å; L287-L291 WeakPolarHBondContact O-CG 3.29Å; L287-L291 PolarHBondContact O-N 2.92Å; R288-L291 PolarHBondContact O-N 3.5Å; L291-K295 WeakPolarHBondContact O-CE 3.2Å; L291-K295 WeakPolarHBondContact O-CG 2.95Å |
| 292 | H | 68.8 | Low | 71.7 | Confident | 59 Ų | 59 | 116.5 Ų | 116.5 | 27% | 0.273 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -86.2 | -18.3 | 176.3 | -70.4 | -64.2 | 0 | 0 | 0 | 113.6 | R288 E289 S290 G294 K295 Y297 | R288-H292 VanDerWaalsContact CG-CD2 3.4Å; R288-H292 WeakPolarHBondContact CG-CD2 3.33Å; R288-H292 WeakPolarHBondContact O-CB 3.33Å; R288-H292 PolarHBondContact O-CD2 3.14Å; R288-H292 PolarHBondContact O-N 3.34Å; E289-H292 CarbonylContact O-C 3.42Å; E289-H292 PolarHBondContact O-N 3.04Å; E289-H292 VanDerWaalsContact O-N 3.13Å; S290-H292 VanDerWaalsContact C-N 3.28Å; S290-H292 PolarHBondContact O-N 3.47Å; H292-G294 PolarHBondContact O-N 2.96Å; H292-K295 PolarHBondContact O-N 2.93Å; H292-Y297 AromaticContact CE1-CD1 3.7Å; H292-Y297 AromaticContact ND1-CD1 3.72Å |
| 293 | A | 65.4 | Low | 69.3 | Low | 90 Ų | 90 | 114.9 Ų | 114.9 | 74% | 0.744 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -68.7 | -22.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | E289 S290 | E289-A293 WeakPolarHBondContact O-CB 3.41Å; E289-A293 PolarHBondContact O-N 3.38Å; S290-A293 PolarHBondContact O-N 3.38Å |
| 294 | G | 59.7 | Low | 67.4 | Low | 74 Ų | 74 | 112.7 Ų | 112.7 | 76% | 0.763 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.3 | -1.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | H292 | H292-G294 PolarHBondContact O-N 2.96Š|
| 295 | K | 62.2 | Low | 65.3 | Low | 133 Ų | 133 | 113.1 Ų | 113.1 | 58% | 0.578 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.5 | 124.4 | -177.8 | -12.8 | 179.5 | -177.6 | -175.1 | 0 | 107.2 | L291 H292 Y297 | L291-K295 WeakPolarHBondContact O-CE 3.2Å; L291-K295 WeakPolarHBondContact O-CG 2.95Å; H292-K295 PolarHBondContact O-N 2.93Å; K295-Y297 PolarHBondContact O-N 3.11Å |
| 296 | N | 54 | Low | 63.1 | Low | 181 Ų | 181 | 118 Ų | 118 | 97% | 0.968 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.7 | 62 | 178 | -64.8 | -58.6 | 0 | 0 | 0 | 113.1 | ||
| 297 | Y | 55.4 | Low | 60.9 | Low | 135 Ų | 135 | 116.5 Ų | 116.5 | 53% | 0.529 | 67% | 0.667 | S | S | . | * | trans | -107.3 | 99.9 | 177.9 | -173.4 | -94 | 0 | 0 | 0 | 107.8 | H292 K295 P299 | H292-Y297 AromaticContact CE1-CD1 3.7Å; H292-Y297 AromaticContact ND1-CD1 3.72Å; K295-Y297 PolarHBondContact O-N 3.11Å; Y297-P299 WeakPolarHBondContact O-CD 3.45Å | ||
| 298 | T | 57 | Low | 58.8 | Low | 119 Ų | 119 | 117.4 Ų | 117.4 | 73% | 0.73 | 68% | 0.681 | S | S | * | * | trans | -65.6 | 118.6 | 169.4 | -37.1 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 299 | P | 53.6 | Low | 56.7 | Low | 63 Ų | 63 | 123.6 Ų | 123.6 | 41% | 0.409 | 71% | 0.705 | S | S | . | * | trans | -58.3 | 144.7 | 169.9 | -14.9 | 27.7 | 0 | 0 | 0 | 108.5 | Y297 R301 | Y297-P299 WeakPolarHBondContact O-CD 3.45Å; P299-R301 PolarHBondContact O-N 3.48Å | ||
| 300 | P | 51 | Low | 54.8 | Low | 105 Ų | 105 | 125 Ų | 125 | 68% | 0.682 | 71% | 0.714 | S | S | * | * | trans | -58.3 | 107.4 | 168.8 | 24.4 | -30.6 | 0 | 0 | 0 | 107.8 | N302 | P300-N302 PolarHBondContact O-N 2.76Å; P300-N302 VanDerWaalsContact O-N 3.15Å | ||
| 301 | R | 51.9 | Low | 52.9 | Low | 235 Ų | 235 | 127 Ų | 127 | 89% | 0.887 | 72% | 0.723 | S | S | * | * | trans | -57.7 | 113.5 | 174.9 | 179.9 | 178.6 | 174.4 | -177.1 | -2 | 107.8 | P299 | P299-R301 PolarHBondContact O-N 3.48Š| ||
| 302 | N | 50.8 | Low | 51.2 | Low | 155 Ų | 155 | 129.2 Ų | 129.2 | 83% | 0.829 | 74% | 0.741 | S | S | * | * | trans | 40.1 | 79.7 | 161.6 | -67.3 | 8.5 | 0 | 0 | 0 | 116.4 | P300 | P300-N302 PolarHBondContact O-N 2.76Å; P300-N302 VanDerWaalsContact O-N 3.15Å | ||
| 303 | G | 40.4 | Very low | 49.9 | Very low | 71 Ų | 71 | 132 Ų | 132 | 73% | 0.732 | 76% | 0.764 | S | S | * | * | trans | -94.9 | 83.8 | 152 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 304 | I | 52.2 | Low | 49 | Very low | 154 Ų | 154 | 132.7 Ų | 132.7 | 79% | 0.79 | 77% | 0.77 | S | S | * | * | S | Bend | trans | 29.8 | 121.1 | 147.9 | -7.6 | 174.3 | 0 | 0 | 0 | 117.7 | ||
| 305 | S | 48.5 | Very low | 48.1 | Very low | 105 Ų | 105 | 137.8 Ų | 137.8 | 73% | 0.734 | 77% | 0.774 | S | S | * | * | trans | 88.5 | 92.6 | 156.9 | -44 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 306 | S | 43.7 | Very low | 47.3 | Very low | 127 Ų | 127 | 137.3 Ų | 137.3 | 89% | 0.888 | 78% | 0.783 | S | S | * | * | S | Bend | trans | 179.6 | 30 | 139.2 | 36.9 | 0 | 0 | 0 | 0 | 114.5 | ||
| 307 | S | 43.9 | Very low | 47.2 | Very low | 127 Ų | 127 | 134 Ų | 134 | 89% | 0.888 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -123.8 | 36.1 | 171.6 | -157 | 0 | 0 | 0 | 0 | 112.9 | ||
| 308 | S | 44.8 | Very low | 46.9 | Very low | 111 Ų | 111 | 133.7 Ų | 133.7 | 78% | 0.776 | 79% | 0.785 | S | S | * | * | trans | -153.6 | 50.1 | 176.7 | 61.6 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 309 | R | 42.8 | Very low | 46.6 | Very low | 249 Ų | 249 | 135.8 Ų | 135.8 | 94% | 0.94 | 79% | 0.79 | S | S | * | * | trans | -135 | 54.1 | 171.1 | -142.3 | -177.7 | -154 | -152.6 | 6.6 | 111.9 | ||||
| 310 | I | 44 | Very low | 46.3 | Very low | 152 Ų | 152 | 137.3 Ų | 137.3 | 78% | 0.779 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -121 | 126.9 | 153.8 | -63.3 | 179.1 | 0 | 0 | 0 | 105.7 | ||
| 311 | T | 41.8 | Very low | 46.7 | Very low | 126 Ų | 126 | 137.8 Ų | 137.8 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | trans | 68.3 | 98.4 | 163.6 | 54.3 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 312 | T | 42.5 | Very low | 46.6 | Very low | 142 Ų | 142 | 137.5 Ų | 137.5 | 87% | 0.871 | 81% | 0.805 | S | S | * | * | -168.1 | 145 | 125.2 | 29.1 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 313 | P | 41.4 | Very low | 46.9 | Very low | 117 Ų | 117 | 136 Ų | 136 | 76% | 0.76 | 80% | 0.804 | S | S | * | * | trans | -84.2 | 148.5 | 179.9 | 34.7 | -31.3 | 0 | 0 | 0 | 111.6 | ||||
| 314 | A | 48.5 | Very low | 47.3 | Very low | 105 Ų | 105 | 138.9 Ų | 138.9 | 87% | 0.868 | 81% | 0.807 | S | S | * | * | trans | 39.7 | 92.6 | 156.3 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 315 | Q | 39.2 | Very low | 46.7 | Very low | 182 Ų | 182 | 143.6 Ų | 143.6 | 85% | 0.85 | 83% | 0.829 | S | S | * | * | trans | -139.6 | 107.5 | 157 | -142.5 | 161.8 | 7 | 0 | 0 | 109.7 | ||||
| 316 | T | 46.3 | Very low | 46.6 | Very low | 123 Ų | 123 | 145.6 Ų | 145.6 | 76% | 0.755 | 83% | 0.833 | S | S | * | * | trans | 21 | 127.6 | 152.4 | 2.3 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 317 | P | 51.2 | Low | 46.8 | Very low | 111 Ų | 111 | 146.5 Ų | 146.5 | 72% | 0.721 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 147.8 | 169.8 | 29.5 | -32.9 | 0 | 0 | 0 | 110.8 | I319 | P317-I319 PolarHBondContact O-N 3.4Š|
| 318 | P | 48.5 | Very low | 46.9 | Very low | 128 Ų | 128 | 147.6 Ų | 147.6 | 83% | 0.831 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 131.8 | 179.4 | 26.9 | -32.6 | 0 | 0 | 0 | 110.9 | S320 | P318-S320 PolarHBondContact O-N 3.26Š|
| 319 | I | 50.8 | Low | 47.1 | Very low | 163 Ų | 163 | 149.8 Ų | 149.8 | 84% | 0.836 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 123.7 | 173.4 | -71.9 | 166.5 | 0 | 0 | 0 | 108.9 | P317 | P317-I319 PolarHBondContact O-N 3.4Š|
| 320 | S | 48.5 | Very low | 47.3 | Very low | 96 Ų | 96 | 143.6 Ų | 143.6 | 67% | 0.671 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 128.8 | 166.7 | 162.5 | 0 | 0 | 0 | 0 | 110 | P318 R322 | P318-S320 PolarHBondContact O-N 3.26Å; S320-R322 PolarHBondContact O-N 2.66Å |
| 321 | P | 58.7 | Low | 47.6 | Very low | 115 Ų | 115 | 143 Ų | 143 | 75% | 0.747 | 83% | 0.826 | S | S | * | * | trans | -75.6 | 116 | 167.5 | 29.5 | -27.8 | 0 | 0 | 0 | 108.8 | ||||
| 322 | R | 50.8 | Low | 48 | Very low | 228 Ų | 228 | 144.2 Ų | 144.2 | 86% | 0.86 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 130.7 | 161.9 | -84 | -175.9 | 174.8 | -151.2 | -1 | 108.7 | S320 | S320-R322 PolarHBondContact O-N 2.66Š|
| 323 | P | 55.9 | Low | 48.4 | Very low | 125 Ų | 125 | 144.4 Ų | 144.4 | 81% | 0.812 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 130.5 | 159.1 | 27.7 | -28.1 | 0 | 0 | 0 | 108.9 | ||
| 324 | V | 49.4 | Very low | 49 | Very low | 130 Ų | 130 | 146.7 Ų | 146.7 | 79% | 0.788 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -93.2 | 135 | 167.2 | -178.9 | 0 | 0 | 0 | 0 | 106.5 | ||
| 325 | M | 40 | Very low | 49 | Very low | 254 Ų | 254 | 150.5 Ų | 150.5 | 100% | 1.251 | 83% | 0.829 | S | S | * | * | trans | 86.3 | 0 | -179.8 | -49.3 | -145.7 | 77.9 | 0 | 0 | 115.9 |
Retrieved 325 of 325 residues in 88.5 ms
(Link to these results)