| 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 | 48.9 | Very low | 41.6 | Very low | 240 Ų | 240 | 153.7 Ų | 153.7 | 100% | 1.182 | 82% | 0.822 | S | S | * | * | 0 | 111.9 | 0 | -66.3 | -71.4 | -175.2 | 0 | 0 | 106.8 | |||||
| 2 | H | 41 | Very low | 41.4 | Very low | 196 Ų | 196 | 154.6 Ų | 154.6 | 91% | 0.907 | 82% | 0.817 | S | S | * | * | trans | -82.3 | 141 | -149.3 | -118.5 | -96.1 | 0 | 0 | 0 | 115.2 | ||||
| 3 | F | 32.2 | Very low | 41.3 | Very low | 190 Ų | 190 | 159.5 Ų | 159.5 | 83% | 0.833 | 82% | 0.82 | S | S | * | * | trans | -70.1 | 150.6 | 158.1 | -75.4 | -96.5 | 0 | 0 | 0 | 111.4 | ||||
| 4 | S | 40.8 | Very low | 41.6 | Very low | 104 Ų | 104 | 162 Ų | 162 | 73% | 0.727 | 82% | 0.822 | S | S | * | * | trans | 160.8 | 115 | 142 | -77.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 5 | K | 43.6 | Very low | 41.4 | Very low | 191 Ų | 191 | 163.3 Ų | 163.3 | 83% | 0.83 | 83% | 0.827 | S | S | * | * | 86.5 | 117.1 | 83 | -84.3 | 178.9 | 173.2 | 174.8 | 0 | 114.4 | |||||
| 6 | V | 43.8 | Very low | 41.8 | Very low | 120 Ų | 120 | 160.8 Ų | 160.8 | 73% | 0.727 | 83% | 0.825 | S | S | * | * | 48.7 | 122.7 | 127.4 | -164.9 | 0 | 0 | 0 | 0 | 118.1 | |||||
| 7 | N | 37.7 | Very low | 41.8 | Very low | 148 Ų | 148 | 156.5 Ų | 156.5 | 79% | 0.791 | 82% | 0.82 | S | S | * | * | -173.1 | 121.5 | 122.8 | -87.4 | -17.3 | 0 | 0 | 0 | 110.7 | |||||
| 8 | G | 35.3 | Very low | 41.7 | Very low | 72 Ų | 72 | 159.2 Ų | 159.2 | 74% | 0.742 | 82% | 0.823 | S | S | * | * | trans | -88.4 | 141.3 | 167.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 9 | N | 43.2 | Very low | 41.6 | Very low | 151 Ų | 151 | 156.9 Ų | 156.9 | 81% | 0.807 | 82% | 0.822 | S | S | * | * | trans | -133.1 | 105.3 | 173.9 | -70.9 | -19.8 | 0 | 0 | 0 | 108.7 | ||||
| 10 | E | 38 | Very low | 41.5 | Very low | 173 Ų | 173 | 155.7 Ų | 155.7 | 81% | 0.808 | 82% | 0.822 | S | S | * | * | trans | -76 | 147.1 | 155.4 | -106.4 | -160.6 | 137.4 | 0 | 0 | 109.4 | ||||
| 11 | P | 53.3 | Low | 41.2 | Very low | 106 Ų | 106 | 157.7 Ų | 157.7 | 69% | 0.688 | 82% | 0.824 | S | S | * | * | trans | -115.4 | 110 | 154.3 | 31.1 | -16.9 | 0 | 0 | 0 | 110.9 | Y13 | P11-Y13 PolarHBondContact O-N 3.47Š| ||
| 12 | H | 39.5 | Very low | 41.2 | Very low | 164 Ų | 164 | 152.2 Ų | 152.2 | 76% | 0.759 | 81% | 0.807 | S | S | * | * | trans | -57.5 | 121.6 | 159.6 | -114.4 | -86.9 | 0 | 0 | 0 | 110.2 | ||||
| 13 | Y | 39.9 | Very low | 41 | Very low | 219 Ų | 219 | 150.2 Ų | 150.2 | 86% | 0.859 | 80% | 0.802 | S | S | * | * | trans | -122.8 | 115.5 | 160.5 | -93.7 | -85.8 | 0 | 0 | 0 | 110.9 | P11 | P11-Y13 PolarHBondContact O-N 3.47Š| ||
| 14 | K | 45.9 | Very low | 41.6 | Very low | 194 Ų | 194 | 149.1 Ų | 149.1 | 84% | 0.843 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 138.9 | 178.9 | -79.3 | 169.1 | 168.8 | 174.3 | 0 | 111.8 | ||
| 15 | M | 37.9 | Very low | 41.5 | Very low | 181 Ų | 181 | 150.3 Ų | 150.3 | 89% | 0.892 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -72 | 142.1 | 159.8 | -64.4 | -105 | 92.6 | 0 | 0 | 110.5 | ||
| 16 | P | 48 | Very low | 41.3 | Very low | 124 Ų | 124 | 147.3 Ų | 147.3 | 81% | 0.805 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -97.7 | 136.9 | 163.5 | 33.3 | -25.9 | 0 | 0 | 0 | 111.6 | ||
| 17 | A | 42.3 | Very low | 41.2 | Very low | 88 Ų | 88 | 148.3 Ų | 148.3 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -94.1 | 149.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 18 | K | 38.8 | Very low | 41.2 | Very low | 205 Ų | 205 | 150.5 Ų | 150.5 | 89% | 0.891 | 80% | 0.804 | S | S | * | * | trans | 50.1 | 112.5 | 146.9 | -67.9 | 174.5 | 177.7 | 177.9 | 0 | 119.4 | ||||
| 19 | S | 40 | Very low | 41.2 | Very low | 115 Ų | 115 | 150 Ų | 150 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -143.4 | 106.2 | 143.7 | 51.8 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 20 | T | 40.9 | Very low | 41 | Very low | 132 Ų | 132 | 148.5 Ų | 148.5 | 81% | 0.81 | 80% | 0.8 | S | S | * | * | 69.5 | 102.4 | 89.4 | -50.4 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 21 | F | 35 | Very low | 41.2 | Very low | 198 Ų | 198 | 144.9 Ų | 144.9 | 87% | 0.868 | 79% | 0.794 | S | S | * | * | trans | -63.8 | 151 | 169.5 | -65.5 | -91.8 | 0 | 0 | 0 | 112.4 | ||||
| 22 | P | 49 | Very low | 40.6 | Very low | 126 Ų | 126 | 145.4 Ų | 145.4 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -108.4 | 118.4 | 150.2 | 31 | -17.5 | 0 | 0 | 0 | 110.6 | ||||
| 23 | N | 36 | Very low | 40.6 | Very low | 153 Ų | 153 | 145.8 Ų | 145.8 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | -75.8 | 132.4 | 156 | -82.2 | -56.3 | 0 | 0 | 0 | 107.8 | ||||
| 24 | H | 45 | Very low | 40.8 | Very low | 168 Ų | 168 | 142.2 Ų | 142.2 | 78% | 0.778 | 80% | 0.804 | S | S | * | * | trans | -153.3 | 127 | 150.8 | -116.7 | -87.7 | 0 | 0 | 0 | 111 | ||||
| 25 | D | 39.4 | Very low | 40.9 | Very low | 129 Ų | 129 | 137 Ų | 137 | 69% | 0.69 | 80% | 0.797 | S | S | * | * | trans | 73.9 | 98.6 | 147.9 | -56.8 | -17.3 | 0 | 0 | 0 | 123 | ||||
| 26 | V | 39.6 | Very low | 41.3 | Very low | 128 Ų | 128 | 133.2 Ų | 133.2 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | -51.3 | 121.3 | 144.3 | 172 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 27 | V | 41.6 | Very low | 41 | Very low | 140 Ų | 140 | 133.8 Ų | 133.8 | 85% | 0.848 | 78% | 0.781 | S | S | * | * | trans | -135 | 127.2 | 150.7 | 179.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 28 | K | 37.4 | Very low | 41.2 | Very low | 195 Ų | 195 | 136.9 Ų | 136.9 | 85% | 0.848 | 78% | 0.781 | S | S | * | * | trans | -83.5 | 145.7 | -179.3 | -69.3 | 170.2 | 173.7 | 173.3 | 0 | 111.3 | ||||
| 29 | G | 35.3 | Very low | 41.3 | Very low | 62 Ų | 62 | 134.7 Ų | 134.7 | 64% | 0.639 | 77% | 0.773 | S | S | * | * | trans | 166.4 | 97.5 | 160.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 30 | S | 37.6 | Very low | 41.4 | Very low | 119 Ų | 119 | 135.2 Ų | 135.2 | 83% | 0.832 | 77% | 0.766 | S | S | * | * | 53.9 | 130.5 | 97.7 | 67.9 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 31 | S | 42.1 | Very low | 41.2 | Very low | 97 Ų | 97 | 136 Ų | 136 | 68% | 0.678 | 76% | 0.758 | S | S | * | * | cis | -174 | 148.6 | 0.7 | 52.3 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 32 | T | 42.3 | Very low | 41.7 | Very low | 117 Ų | 117 | 131.7 Ų | 131.7 | 72% | 0.718 | 75% | 0.748 | S | S | * | * | trans | 58 | 99.7 | 153.5 | 60.3 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 33 | D | 37.8 | Very low | 41.4 | Very low | 171 Ų | 171 | 130.6 Ų | 130.6 | 91% | 0.914 | 74% | 0.739 | S | S | * | * | trans | -150.6 | 88.7 | 134.1 | -92.3 | -28.5 | 0 | 0 | 0 | 108.7 | ||||
| 34 | V | 45.3 | Very low | 41.8 | Very low | 145 Ų | 145 | 131.1 Ų | 131.1 | 88% | 0.879 | 73% | 0.734 | S | S | * | * | trans | -94.8 | 94.1 | 171.8 | 178.2 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 35 | A | 47.2 | Very low | 41.7 | Very low | 84 Ų | 84 | 130.7 Ų | 130.7 | 69% | 0.694 | 73% | 0.731 | S | S | * | * | trans | -81.3 | 133.4 | 168.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | L37 | A35-L37 PolarHBondContact O-N 3.21Š| ||
| 36 | P | 45.9 | Very low | 42 | Very low | 102 Ų | 102 | 128.5 Ų | 128.5 | 66% | 0.662 | 73% | 0.726 | S | S | * | * | trans | -67.5 | 125.5 | -176.8 | -16.3 | 29.1 | 0 | 0 | 0 | 112.4 | E38 | P36-E38 PolarHBondContact O-N 3.4Š| ||
| 37 | L | 43.5 | Very low | 42.3 | Very low | 135 Ų | 135 | 130.1 Ų | 130.1 | 71% | 0.707 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | 20.4 | 176.8 | -103.7 | 147.2 | 0 | 0 | 0 | 114.6 | A35 | A35-L37 PolarHBondContact O-N 3.21Š|
| 38 | E | 44.7 | Very low | 42.6 | Very low | 154 Ų | 154 | 129 Ų | 129 | 72% | 0.72 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94 | -11.7 | -172.3 | -64.2 | -168.6 | 160.7 | 0 | 0 | 114.4 | P36 | P36-E38 PolarHBondContact O-N 3.4Š|
| 39 | H | 42.3 | Very low | 43.2 | Very low | 159 Ų | 159 | 123.3 Ų | 123.3 | 74% | 0.736 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -97.4 | -1 | -178.5 | -83 | -77.8 | 0 | 0 | 0 | 115.9 | ||
| 40 | L | 42.4 | Very low | 43.9 | Very low | 125 Ų | 125 | 125.9 Ų | 125.9 | 65% | 0.654 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -93.3 | -14.7 | 177.8 | -75.6 | 168.5 | 0 | 0 | 0 | 114.2 | ||
| 41 | F | 36 | Very low | 44.3 | Very low | 148 Ų | 148 | 126 Ų | 126 | 65% | 0.649 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -86.5 | -23.3 | 177.7 | -84 | -87.5 | 0 | 0 | 0 | 113.8 | ||
| 42 | V | 44.7 | Very low | 44.9 | Very low | 108 Ų | 108 | 125.9 Ų | 125.9 | 66% | 0.655 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -87.9 | -12.5 | -173.6 | -177.9 | 0 | 0 | 0 | 0 | 113.3 | ||
| 43 | T | 43.6 | Very low | 45.5 | Very low | 103 Ų | 103 | 126 Ų | 126 | 63% | 0.632 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -104.3 | -5.7 | -178.7 | 45 | 0 | 0 | 0 | 0 | 114.3 | ||
| 44 | K | 44.4 | Very low | 46.1 | Very low | 164 Ų | 164 | 124 Ų | 124 | 71% | 0.713 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -101.1 | -8.8 | -175.8 | -122.9 | 176.9 | -177.8 | 179.7 | 0 | 115.5 | ||
| 45 | F | 43.6 | Very low | 46.7 | Very low | 160 Ų | 160 | 125.2 Ų | 125.2 | 70% | 0.702 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -118.2 | 0.9 | 179.7 | -71.9 | -79.4 | 0 | 0 | 0 | 114.7 | K47 | F45-K47 PolarHBondContact O-N 3.46Š|
| 46 | S | 45.1 | Very low | 46.9 | Very low | 83 Ų | 83 | 128.5 Ų | 128.5 | 58% | 0.58 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | 17 | -168.2 | 44.8 | 0 | 0 | 0 | 0 | 116.3 | ||
| 47 | K | 46 | Very low | 47.3 | Very low | 161 Ų | 161 | 128.5 Ų | 128.5 | 70% | 0.7 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -141.3 | 12.7 | -178.9 | -71.2 | -170.8 | -179.7 | 178.9 | 0 | 116.5 | F45 T49 | F45-K47 PolarHBondContact O-N 3.46Å; K47-T49 PolarHBondContact O-N 2.85Å; K47-T49 VanDerWaalsContact O-N 3.14Å |
| 48 | L | 47.3 | Very low | 47.9 | Very low | 118 Ų | 118 | 127.5 Ų | 127.5 | 62% | 0.618 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -75.7 | 101.3 | 158.6 | -83.1 | 159.9 | 0 | 0 | 0 | 105.9 | I50 | L48-I50 PolarHBondContact O-N 3.48Š|
| 49 | T | 49.1 | Very low | 48.2 | Very low | 74 Ų | 74 | 123 Ų | 123 | 45% | 0.454 | 61% | 0.614 | S | S | . | * | trans | -53.9 | 125 | 179.4 | 31.8 | 0 | 0 | 0 | 0 | 108.9 | K47 D51 D52 | K47-T49 PolarHBondContact O-N 2.85Å; K47-T49 VanDerWaalsContact O-N 3.14Å; T49-D51 PolarHBondContact O-N 3.37Å; T49-D52 PolarHBondContact O-N 2.85Å; T49-D52 PolarHBondContact OG1-OD2 3.06Å | ||
| 50 | I | 50.3 | Low | 48.5 | Very low | 117 Ų | 117 | 123 Ų | 123 | 60% | 0.6 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -47.5 | -24.2 | 176.2 | -67.3 | 162.9 | 0 | 0 | 0 | 111.4 | L48 D52 Y54 | L48-I50 PolarHBondContact O-N 3.48Å; I50-D52 PolarHBondContact O-N 3.06Å; I50-Y54 HydrophobicContact CG2-CD2 3.94Å; I50-Y54 HydrophobicContact CG2-CE2 4.07Å; I50-Y54 WeakPolarHBondContact O-CD2 3.34Å; I50-Y54 PolarHBondContact O-N 2.86Å |
| 51 | D | 45.9 | Very low | 48.9 | Very low | 121 Ų | 121 | 122 Ų | 122 | 65% | 0.647 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -65.1 | -31.9 | 175.8 | -56.7 | -42.2 | 0 | 0 | 0 | 114.7 | T49 K55 | T49-D51 PolarHBondContact O-N 3.37Å; D51-K55 PolarHBondContact O-N 3.47Å |
| 52 | D | 55.2 | Low | 49.6 | Very low | 95 Ų | 95 | 118.8 Ų | 118.8 | 51% | 0.508 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -81.8 | -28.3 | -178.2 | -70.9 | -34.1 | 0 | 0 | 0 | 112.2 | T49 I50 | T49-D52 PolarHBondContact O-N 2.85Å; T49-D52 PolarHBondContact OG1-OD2 3.06Å; I50-D52 PolarHBondContact O-N 3.06Å |
| 53 | E | 55.1 | Low | 49.9 | Very low | 119 Ų | 119 | 118.4 Ų | 118.4 | 56% | 0.556 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -76.3 | -31 | 172.7 | -67 | -171.8 | 163.8 | 0 | 0 | 112 | N57 | E53-N57 PolarHBondContact O-N 3.46Å; E53-N57 PolarHBondContact O-ND2 3.42Å |
| 54 | Y | 49.7 | Very low | 50 | Low | 130 Ų | 130 | 119.5 Ų | 119.5 | 51% | 0.51 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -69.9 | -36.2 | 175.1 | -101.7 | -92.2 | 0 | 0 | 0 | 112.8 | I50 Y56 L58 F289 | I50-Y54 HydrophobicContact CG2-CD2 3.94Å; I50-Y54 HydrophobicContact CG2-CE2 4.07Å; I50-Y54 WeakPolarHBondContact O-CD2 3.34Å; I50-Y54 PolarHBondContact O-N 2.86Å; Y54-Y56 VanDerWaalsContact C-N 3.34Å; Y54-L58 WeakPolarHBondContact O-CB 3.25Å; Y54-L58 PolarHBondContact O-N 3.4Å; Y54-F289 HydrophobicContact CE2-CZ 4.3Å; Y54-F289 WeakPolarHBondContact OH-CZ 3.31Å |
| 55 | K | 58.3 | Low | 50.1 | Low | 169 Ų | 169 | 117.7 Ų | 117.7 | 74% | 0.735 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -72.2 | -28.4 | 179.2 | -157.8 | 173 | -177.5 | -179.8 | 0 | 112.8 | D51 | D51-K55 PolarHBondContact O-N 3.47Å |
| 56 | Y | 51.9 | Low | 49.9 | Very low | 153 Ų | 153 | 115 Ų | 115 | 60% | 0.6 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -81.3 | -36.7 | 178.9 | -138.3 | -91.6 | 0 | 0 | 0 | 112.8 | Y54 V363 | Y54-Y56 VanDerWaalsContact C-N 3.34Å; Y56-V363 HydrophobicContact CE1-CG2 4.48Å; Y56-V363 WeakPolarHBondContact OH-CG2 3.38Å |
| 57 | N | 54.3 | Low | 49.5 | Very low | 103 Ų | 103 | 115 Ų | 115 | 55% | 0.551 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -80.6 | -27.5 | 179.5 | -72.1 | -35.6 | 0 | 0 | 0 | 113.6 | E53 L61 | E53-N57 PolarHBondContact O-N 3.46Å; E53-N57 PolarHBondContact O-ND2 3.42Å; N57-L61 PolarHBondContact O-N 2.86Å |
| 58 | L | 55.4 | Low | 49.4 | Very low | 114 Ų | 114 | 112.7 Ų | 112.7 | 60% | 0.597 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -73.2 | -31.9 | 173.9 | -147.5 | 80.1 | 0 | 0 | 0 | 112.1 | Y54 Y60 V62 | Y54-L58 WeakPolarHBondContact O-CB 3.25Å; Y54-L58 PolarHBondContact O-N 3.4Å; L58-Y60 VanDerWaalsContact C-N 3.31Å; L58-Y60 PolarHBondContact O-N 3.18Å; L58-V62 HydrophobicContact CG-CG2 4.47Å; L58-V62 WeakPolarHBondContact O-CB 3.49Å; L58-V62 WeakPolarHBondContact O-CG2 3.4Å; L58-V62 PolarHBondContact O-N 3.48Å; L58-V62 VanDerWaalsContact O-N 3.14Å |
| 59 | A | 51.6 | Low | 49.1 | Very low | 60 Ų | 60 | 112.6 Ų | 112.6 | 50% | 0.496 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -66.6 | -32.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | T63 | A59-T63 WeakPolarHBondContact O-CG2 3.06Å; A59-T63 PolarHBondContact O-OG1 3.28Å |
| 60 | Y | 48.3 | Very low | 48.5 | Very low | 159 Ų | 159 | 115.1 Ų | 115.1 | 62% | 0.624 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -81.6 | -33.3 | -180 | -153.4 | -96.8 | 0 | 0 | 0 | 112.8 | L58 T63 E64 | L58-Y60 VanDerWaalsContact C-N 3.31Å; L58-Y60 PolarHBondContact O-N 3.18Å; Y60-T63 PolarHBondContact O-OG1 2.96Å; Y60-E64 WeakPolarHBondContact CE1-OE1 2.94Å |
| 61 | L | 50.6 | Low | 47.9 | Very low | 102 Ų | 102 | 115.2 Ų | 115.2 | 53% | 0.534 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -81.9 | -19.4 | 178.3 | -72.6 | 167.3 | 0 | 0 | 0 | 114.1 | N57 N65 | N57-L61 PolarHBondContact O-N 2.86Å; L61-N65 PolarHBondContact O-ND2 2.87Å; L61-N65 VanDerWaalsContact O-ND2 3.14Å |
| 62 | V | 51.1 | Low | 47.5 | Very low | 81 Ų | 81 | 115.5 Ų | 115.5 | 49% | 0.491 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -83 | -18.4 | 173.3 | 174 | 0 | 0 | 0 | 0 | 111.9 | L58 N66 | L58-V62 HydrophobicContact CG-CG2 4.47Å; L58-V62 WeakPolarHBondContact O-CB 3.49Å; L58-V62 WeakPolarHBondContact O-CG2 3.4Å; L58-V62 PolarHBondContact O-N 3.48Å; L58-V62 VanDerWaalsContact O-N 3.14Å; V62-N66 PolarHBondContact O-ND2 2.92Å; V62-N66 VanDerWaalsContact O-ND2 3.1Å |
| 63 | T | 50.5 | Low | 46.6 | Very low | 100 Ų | 100 | 120.5 Ų | 120.5 | 61% | 0.613 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -87.4 | -19.1 | 176.6 | 46.8 | 0 | 0 | 0 | 0 | 114.6 | A59 Y60 | A59-T63 WeakPolarHBondContact O-CG2 3.06Å; A59-T63 PolarHBondContact O-OG1 3.28Å; Y60-T63 PolarHBondContact O-OG1 2.96Å |
| 64 | E | 47.1 | Very low | 45.7 | Very low | 126 Ų | 126 | 119.5 Ų | 119.5 | 59% | 0.589 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -97 | -12.4 | -178.9 | -66.2 | -170.3 | 160.5 | 0 | 0 | 114 | Y60 | Y60-E64 WeakPolarHBondContact CE1-OE1 2.94Å |
| 65 | N | 46.5 | Very low | 44.8 | Very low | 126 Ų | 126 | 119 Ų | 119 | 67% | 0.674 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -108.9 | 3.2 | -178.9 | -68.5 | -51.8 | 0 | 0 | 0 | 114.8 | L61 | L61-N65 PolarHBondContact O-ND2 2.87Å; L61-N65 VanDerWaalsContact O-ND2 3.14Å |
| 66 | N | 38.5 | Very low | 44 | Very low | 103 Ų | 103 | 119.7 Ų | 119.7 | 55% | 0.551 | 67% | 0.674 | S | S | * | * | trans | -114.5 | 73.9 | 174.6 | -68.6 | -39.8 | 0 | 0 | 0 | 110.1 | V62 T68 | V62-N66 PolarHBondContact O-ND2 2.92Å; V62-N66 VanDerWaalsContact O-ND2 3.1Å; N66-T68 PolarHBondContact O-N 3.4Å | ||
| 67 | G | 36.8 | Very low | 43.1 | Very low | 83 Ų | 83 | 119 Ų | 119 | 86% | 0.856 | 69% | 0.686 | S | S | * | * | trans | -65 | 74.4 | 162.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 68 | T | 44.7 | Very low | 42.3 | Very low | 113 Ų | 113 | 122.5 Ų | 122.5 | 69% | 0.693 | 70% | 0.699 | S | S | * | * | trans | -139.3 | 106.4 | 172.5 | 29.9 | 0 | 0 | 0 | 0 | 108.7 | N66 | N66-T68 PolarHBondContact O-N 3.4Š| ||
| 69 | T | 40.6 | Very low | 41.5 | Very low | 117 Ų | 117 | 125.1 Ų | 125.1 | 72% | 0.718 | 71% | 0.705 | S | S | * | * | trans | -43 | 134.7 | 170.2 | 49.4 | 0 | 0 | 0 | 0 | 111.9 | V71 | T69-V71 PolarHBondContact O-N 3.03Š| ||
| 70 | P | 36.6 | Very low | 40.8 | Very low | 127 Ų | 127 | 129.8 Ų | 129.8 | 83% | 0.825 | 72% | 0.717 | S | S | * | * | trans | -71 | 102.5 | 168.2 | 29.1 | -29.9 | 0 | 0 | 0 | 108.3 | V72 | P70-V72 PolarHBondContact O-N 2.95Š| ||
| 71 | V | 38.1 | Very low | 40.1 | Very low | 118 Ų | 118 | 132.8 Ų | 132.8 | 72% | 0.715 | 73% | 0.727 | S | S | * | * | trans | -64.2 | 114.3 | 167 | 173.5 | 0 | 0 | 0 | 0 | 107.8 | T69 K73 | T69-V71 PolarHBondContact O-N 3.03Å; V71-K73 PolarHBondContact O-N 3.01Å; V71-K73 VanDerWaalsContact O-N 3.12Å | ||
| 72 | V | 37.8 | Very low | 39.3 | Very low | 128 Ų | 128 | 132.7 Ų | 132.7 | 78% | 0.776 | 74% | 0.735 | S | S | * | * | trans | -53.8 | 109.9 | 169 | 176.3 | 0 | 0 | 0 | 0 | 108.4 | P70 S74 | P70-V72 PolarHBondContact O-N 2.95Å; V72-S74 PolarHBondContact O-N 3.2Å | ||
| 73 | K | 35.1 | Very low | 38.5 | Very low | 199 Ų | 199 | 135 Ų | 135 | 87% | 0.865 | 75% | 0.749 | S | S | * | * | trans | -85.8 | 93.2 | 167.9 | -76.2 | -176.2 | 178.6 | 178.6 | 0 | 108.6 | V71 | V71-K73 PolarHBondContact O-N 3.01Å; V71-K73 VanDerWaalsContact O-N 3.12Å | ||
| 74 | S | 36 | Very low | 38 | Very low | 99 Ų | 99 | 136.9 Ų | 136.9 | 69% | 0.692 | 76% | 0.76 | S | S | * | * | trans | -60.8 | 126.7 | 158 | 46.4 | 0 | 0 | 0 | 0 | 109.5 | V72 Q76 | V72-S74 PolarHBondContact O-N 3.2Å; S74-Q76 PolarHBondContact O-N 2.78Å | ||
| 75 | S | 30.7 | Very low | 37.3 | Very low | 119 Ų | 119 | 135.4 Ų | 135.4 | 83% | 0.832 | 76% | 0.764 | S | S | * | * | trans | -62.9 | 109.5 | 172.6 | 48.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 76 | Q | 42.8 | Very low | 36.8 | Very low | 184 Ų | 184 | 136.1 Ų | 136.1 | 86% | 0.86 | 77% | 0.768 | S | S | * | * | trans | -132 | 114.9 | 156.5 | -76.6 | -173.7 | -12.9 | 0 | 0 | 109.2 | S74 | S74-Q76 PolarHBondContact O-N 2.78Š| ||
| 77 | T | 33 | Very low | 37 | Very low | 138 Ų | 138 | 137.3 Ų | 137.3 | 85% | 0.847 | 78% | 0.779 | S | S | * | * | trans | -54.3 | 122.9 | 165.2 | 44 | 0 | 0 | 0 | 0 | 111 | ||||
| 78 | E | 35.8 | Very low | 37.4 | Very low | 176 Ų | 176 | 142 Ų | 142 | 82% | 0.822 | 78% | 0.776 | S | S | * | * | trans | -164.8 | 122 | 136.6 | -147.6 | 135.2 | -159 | 0 | 0 | 114 | ||||
| 79 | K | 38.8 | Very low | 37.1 | Very low | 169 Ų | 169 | 143 Ų | 143 | 74% | 0.735 | 78% | 0.784 | S | S | * | * | trans | 8.1 | 123.7 | 152 | -69.8 | 166.8 | 179.4 | 168.7 | 0 | 121.2 | ||||
| 80 | Q | 37.4 | Very low | 37 | Very low | 159 Ų | 159 | 144.3 Ų | 144.3 | 74% | 0.743 | 79% | 0.786 | S | S | * | * | 71.4 | 121.3 | 122 | -69.2 | -172.5 | -1.3 | 0 | 0 | 121 | |||||
| 81 | R | 33.1 | Very low | 37.2 | Very low | 221 Ų | 221 | 145 Ų | 145 | 83% | 0.834 | 78% | 0.783 | S | S | * | * | 112.7 | 122.5 | 129.6 | -86.7 | 173.3 | 178.7 | -172.6 | -0.1 | 118.7 | |||||
| 82 | S | 34.7 | Very low | 37.1 | Very low | 100 Ų | 100 | 150.6 Ų | 150.6 | 70% | 0.699 | 79% | 0.791 | S | S | * | * | trans | 61.5 | 108.1 | 144.1 | 52.6 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 83 | V | 34.7 | Very low | 37.3 | Very low | 130 Ų | 130 | 151.3 Ų | 151.3 | 79% | 0.788 | 79% | 0.789 | S | S | * | * | 61.9 | 103.3 | 85.8 | 179.3 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 84 | T | 39.1 | Very low | 37.4 | Very low | 139 Ų | 139 | 148.4 Ų | 148.4 | 85% | 0.853 | 78% | 0.778 | S | S | * | * | -177.4 | 138.7 | 120.3 | 30.5 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 85 | S | 33.6 | Very low | 37.7 | Very low | 95 Ų | 95 | 149.6 Ų | 149.6 | 66% | 0.664 | 78% | 0.781 | S | S | * | * | trans | -84.3 | 168.1 | 179 | 45 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 86 | N | 34.4 | Very low | 37.9 | Very low | 141 Ų | 141 | 149.7 Ų | 149.7 | 75% | 0.754 | 77% | 0.772 | S | S | * | * | trans | 87.5 | 106.9 | 161 | -52 | -29.8 | 0 | 0 | 0 | 116.2 | ||||
| 87 | T | 43.1 | Very low | 37.6 | Very low | 129 Ų | 129 | 146 Ų | 146 | 79% | 0.791 | 77% | 0.767 | S | S | * | * | -178.3 | 122 | 109.4 | 29.4 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 88 | K | 46.4 | Very low | 38 | Very low | 181 Ų | 181 | 147.1 Ų | 147.1 | 79% | 0.787 | 77% | 0.766 | S | S | * | * | trans | 57 | 123.1 | 147.6 | -64.4 | 174.2 | 178.7 | 174.6 | 0 | 120.7 | ||||
| 89 | P | 36.7 | Very low | 38.3 | Very low | 133 Ų | 133 | 145.4 Ų | 145.4 | 86% | 0.864 | 76% | 0.758 | S | S | * | * | trans | -100.5 | 122.8 | 146.3 | 33.2 | -21.1 | 0 | 0 | 0 | 110.4 | ||||
| 90 | L | 39.9 | Very low | 38.2 | Very low | 145 Ų | 145 | 146.7 Ų | 146.7 | 76% | 0.759 | 76% | 0.758 | S | S | * | * | trans | -112.7 | 114.4 | 164.8 | -84.5 | 169.9 | 0 | 0 | 0 | 108.2 | ||||
| 91 | N | 39.8 | Very low | 38.3 | Very low | 141 Ų | 141 | 148.2 Ų | 148.2 | 75% | 0.754 | 76% | 0.762 | S | S | * | * | 169.3 | 101.8 | 120.1 | -85.4 | -23.5 | 0 | 0 | 0 | 110.4 | |||||
| 92 | R | 36.6 | Very low | 38.4 | Very low | 237 Ų | 237 | 143.1 Ų | 143.1 | 89% | 0.894 | 76% | 0.76 | S | S | * | * | trans | -87.2 | 108.7 | 162.7 | -173.2 | 177.7 | -174.9 | 145.7 | -0.4 | 106.1 | ||||
| 93 | I | 41.3 | Very low | 38.5 | Very low | 142 Ų | 142 | 147.2 Ų | 147.2 | 73% | 0.728 | 77% | 0.769 | S | S | * | * | trans | -110.4 | 109.4 | 166.6 | -63.6 | 175.4 | 0 | 0 | 0 | 106.5 | V95 | I93-V95 HydrophobicContact CG2-CG2 3.83Š| ||
| 94 | H | 38.3 | Very low | 38.8 | Very low | 138 Ų | 138 | 147 Ų | 147 | 64% | 0.639 | 77% | 0.77 | S | S | * | * | trans | -95 | 120 | 169.4 | -167 | -75.4 | 0 | 0 | 0 | 106.7 | D96 | H94-D96 IonicContact CE1-OD2 2.74Å; H94-D96 PolarHBondContact CE1-OD2 2.87Å; H94-D96 IonicContact NE2-OD2 3.48Å | ||
| 95 | V | 41.9 | Very low | 38.8 | Very low | 125 Ų | 125 | 146.1 Ų | 146.1 | 76% | 0.758 | 76% | 0.764 | S | S | * | * | trans | -131.4 | 97.6 | 167.7 | -179.5 | 0 | 0 | 0 | 0 | 106.9 | I93 | I93-V95 HydrophobicContact CG2-CG2 3.83Š| ||
| 96 | D | 34.7 | Very low | 38.7 | Very low | 120 Ų | 120 | 148.9 Ų | 148.9 | 64% | 0.642 | 77% | 0.77 | S | S | * | * | trans | -95.9 | 147.1 | 159.3 | -93.6 | -31.4 | 0 | 0 | 0 | 108.5 | H94 | H94-D96 IonicContact CE1-OD2 2.74Å; H94-D96 PolarHBondContact CE1-OD2 2.87Å; H94-D96 IonicContact NE2-OD2 3.48Å | ||
| 97 | S | 36.4 | Very low | 38.7 | Very low | 107 Ų | 107 | 149.5 Ų | 149.5 | 75% | 0.748 | 77% | 0.768 | S | S | * | * | trans | 78.3 | 77.7 | 156.5 | -54.3 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 98 | I | 40.4 | Very low | 38.5 | Very low | 162 Ų | 162 | 148.8 Ų | 148.8 | 83% | 0.831 | 76% | 0.763 | S | S | * | * | trans | -144.3 | 91.7 | 137.9 | -53.9 | -176.7 | 0 | 0 | 0 | 110.8 | ||||
| 99 | Q | 42.1 | Very low | 37.9 | Very low | 140 Ų | 140 | 146.7 Ų | 146.7 | 65% | 0.654 | 76% | 0.761 | S | S | * | * | 42.4 | 123.3 | 125.7 | -76.7 | -178 | 11.4 | 0 | 0 | 121.5 | |||||
| 100 | R | 36.9 | Very low | 37.9 | Very low | 196 Ų | 196 | 149.4 Ų | 149.4 | 74% | 0.74 | 76% | 0.762 | S | S | * | * | trans | 80 | 104.3 | 131.7 | -66.4 | 178.4 | -140.3 | -126 | 7.9 | 118.4 | ||||
| 101 | K | 39.5 | Very low | 37.8 | Very low | 190 Ų | 190 | 154 Ų | 154 | 83% | 0.826 | 77% | 0.769 | S | S | * | * | 166.8 | 125.1 | 95.4 | -98.9 | 158.8 | -177 | -175 | 0 | 113.1 | |||||
| 102 | S | 36.8 | Very low | 37.6 | Very low | 114 Ų | 114 | 150.2 Ų | 150.2 | 80% | 0.797 | 76% | 0.764 | S | S | * | * | trans | 65.5 | 96.5 | 143.2 | 61 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 103 | E | 35.5 | Very low | 37.5 | Very low | 186 Ų | 186 | 148 Ų | 148 | 87% | 0.869 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -101 | 142.4 | 140.5 | -84.2 | -177 | 147 | 0 | 0 | 109.5 | ||
| 104 | P | 42.1 | Very low | 37.2 | Very low | 125 Ų | 125 | 150.4 Ų | 150.4 | 81% | 0.812 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 124.8 | 174.1 | 31.2 | -29.3 | 0 | 0 | 0 | 111.4 | ||
| 105 | V | 37.6 | Very low | 37.2 | Very low | 122 Ų | 122 | 153.8 Ų | 153.8 | 74% | 0.739 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 127.3 | 170.3 | 174.6 | 0 | 0 | 0 | 0 | 109.8 | ||
| 106 | I | 33.4 | Very low | 36.8 | Very low | 153 Ų | 153 | 152.3 Ų | 152.3 | 79% | 0.785 | 77% | 0.771 | S | S | * | * | trans | -104 | 105 | 160.8 | -59.8 | 177.8 | 0 | 0 | 0 | 107.4 | T108 | I106-T108 HydrophobicContact CG2-CG2 4.44Š| ||
| 107 | H | 33.2 | Very low | 36.7 | Very low | 153 Ų | 153 | 153.4 Ų | 153.4 | 71% | 0.708 | 79% | 0.786 | S | S | * | * | trans | -68.1 | 129.2 | 163.8 | -109.9 | -97.2 | 0 | 0 | 0 | 108.6 | ||||
| 108 | T | 39.3 | Very low | 36.8 | Very low | 114 Ų | 114 | 159.4 Ų | 159.4 | 70% | 0.699 | 79% | 0.793 | S | S | * | * | trans | -128.4 | 127.4 | 153.6 | 46 | 0 | 0 | 0 | 0 | 109.2 | I106 | I106-T108 HydrophobicContact CG2-CG2 4.44Š| ||
| 109 | D | 33.9 | Very low | 36.5 | Very low | 138 Ų | 138 | 161.3 Ų | 161.3 | 74% | 0.738 | 79% | 0.791 | S | S | * | * | trans | -74.2 | 126.4 | -169.2 | -63.7 | -49.2 | 0 | 0 | 0 | 111.7 | R111 | D109-R111 PolarHBondContact O-N 3.46Š| ||
| 110 | H | 36.6 | Very low | 36.3 | Very low | 190 Ų | 190 | 164.8 Ų | 164.8 | 88% | 0.88 | 80% | 0.798 | S | S | * | * | trans | -83.3 | 82.1 | 163.1 | -69.1 | -64.1 | 0 | 0 | 0 | 109.7 | ||||
| 111 | R | 38.6 | Very low | 36.2 | Very low | 240 Ų | 240 | 166.1 Ų | 166.1 | 91% | 0.906 | 80% | 0.803 | S | S | * | * | trans | -144.8 | 114.7 | 161.6 | -78.8 | -166.2 | 179.3 | -171.6 | 0.8 | 111.7 | D109 | D109-R111 PolarHBondContact O-N 3.46Š| ||
| 112 | G | 33.8 | Very low | 36.2 | Very low | 63 Ų | 63 | 166.6 Ų | 166.6 | 65% | 0.649 | 81% | 0.808 | S | S | * | * | trans | 94.7 | 90.3 | 144.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 113 | F | 35.2 | Very low | 36.5 | Very low | 191 Ų | 191 | 170.2 Ų | 170.2 | 84% | 0.838 | 81% | 0.809 | S | S | * | * | trans | -146.4 | 83.4 | 137.2 | -92.7 | -76 | 0 | 0 | 0 | 109.1 | ||||
| 114 | H | 35.3 | Very low | 36.7 | Very low | 192 Ų | 192 | 167.2 Ų | 167.2 | 89% | 0.889 | 81% | 0.806 | S | S | * | * | trans | -98.8 | 104.3 | 159.3 | -127.7 | -80.3 | 0 | 0 | 0 | 106.2 | ||||
| 115 | R | 37.3 | Very low | 36.7 | Very low | 209 Ų | 209 | 170 Ų | 170 | 79% | 0.789 | 81% | 0.813 | S | S | * | * | trans | -132.1 | 90.7 | 165.6 | -76.4 | -170.8 | 179.7 | -159.9 | 1.3 | 106.3 | ||||
| 116 | S | 34.3 | Very low | 36.7 | Very low | 93 Ų | 93 | 175.6 Ų | 175.6 | 65% | 0.65 | 82% | 0.821 | S | S | * | * | 74.6 | 91.5 | 96.7 | 69.7 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 117 | C | 31.9 | Very low | 37.2 | Very low | 143 Ų | 143 | 172.1 Ų | 172.1 | 97% | 0.966 | 82% | 0.823 | S | S | * | * | trans | -119.1 | 98.7 | 143 | -99.2 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 118 | R | 38.8 | Very low | 37.6 | Very low | 233 Ų | 233 | 173.9 Ų | 173.9 | 88% | 0.879 | 83% | 0.829 | S | S | * | * | trans | -84.3 | 128.9 | 164.2 | -70.9 | 178.2 | 175.2 | 174.5 | -1 | 106.5 | ||||
| 119 | Y | 34.5 | Very low | 37.7 | Very low | 203 Ų | 203 | 175.2 Ų | 175.2 | 80% | 0.796 | 84% | 0.836 | S | S | * | * | trans | -155.1 | 123.5 | 133 | -126.7 | -92.6 | 0 | 0 | 0 | 112.1 | ||||
| 120 | R | 37.5 | Very low | 38 | Very low | 213 Ų | 213 | 173.2 Ų | 173.2 | 80% | 0.804 | 84% | 0.839 | S | S | * | * | trans | 51.5 | 103 | 159.4 | -81.6 | -178.9 | 177.7 | 171.3 | -1.1 | 121.8 | ||||
| 121 | R | 34.8 | Very low | 38 | Very low | 224 Ų | 224 | 168.1 Ų | 168.1 | 85% | 0.845 | 83% | 0.83 | S | S | * | * | trans | -60.1 | 142.9 | 147.7 | -66.9 | 172.3 | 167 | 167.8 | -5.8 | 112.3 | ||||
| 122 | Q | 40.8 | Very low | 38 | Very low | 199 Ų | 199 | 168.4 Ų | 168.4 | 93% | 0.93 | 83% | 0.831 | S | S | * | * | trans | -132.9 | 142.5 | 134.5 | -73.1 | -168.5 | 10.6 | 0 | 0 | 109 | ||||
| 123 | K | 43.4 | Very low | 38.1 | Very low | 190 Ų | 190 | 174 Ų | 174 | 83% | 0.826 | 84% | 0.84 | S | S | * | * | trans | -89.1 | 157.1 | -160.9 | -71.7 | 171.9 | 173.8 | 177.3 | 0 | 113 | ||||
| 124 | P | 38.7 | Very low | 38.2 | Very low | 124 Ų | 124 | 170.4 Ų | 170.4 | 81% | 0.805 | 84% | 0.838 | S | S | * | * | trans | -95.4 | 159.6 | 177.7 | 37.5 | -31.9 | 0 | 0 | 0 | 113.3 | ||||
| 125 | L | 41.7 | Very low | 38 | Very low | 182 Ų | 182 | 166.7 Ų | 166.7 | 95% | 0.953 | 83% | 0.834 | S | S | * | * | trans | -115.5 | 135.3 | 165.2 | -77.4 | 172.4 | 0 | 0 | 0 | 110.7 | ||||
| 126 | R | 38.8 | Very low | 38.3 | Very low | 240 Ų | 240 | 162.5 Ų | 162.5 | 91% | 0.906 | 83% | 0.834 | S | S | * | * | trans | -69 | 148 | -176.4 | -84 | 171.6 | 159 | -179 | -3.9 | 113.1 | ||||
| 127 | G | 42.4 | Very low | 38.7 | Very low | 80 Ų | 80 | 164 Ų | 164 | 83% | 0.825 | 84% | 0.839 | S | S | * | * | trans | -159.9 | 109.1 | 152.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 128 | K | 41.7 | Very low | 38.6 | Very low | 190 Ų | 190 | 167.6 Ų | 167.6 | 83% | 0.826 | 83% | 0.834 | S | S | * | * | trans | -74 | 153.4 | 170.6 | -67.8 | 171.3 | 174 | 179.1 | 0 | 108.8 | ||||
| 129 | V | 42.3 | Very low | 38.5 | Very low | 142 Ų | 142 | 163.7 Ų | 163.7 | 86% | 0.861 | 83% | 0.829 | S | S | * | * | -179.2 | 127.6 | 128.9 | 155.1 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 130 | A | 39.5 | Very low | 38.3 | Very low | 96 Ų | 96 | 158.7 Ų | 158.7 | 79% | 0.793 | 82% | 0.823 | S | S | * | * | trans | 31.9 | 134.6 | 150.8 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 131 | A | 37.5 | Very low | 38.1 | Very low | 84 Ų | 84 | 154 Ų | 154 | 69% | 0.694 | 82% | 0.824 | S | S | * | * | trans | -48.5 | 151 | 162.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 132 | R | 37.9 | Very low | 38.4 | Very low | 246 Ų | 246 | 148.6 Ų | 148.6 | 93% | 0.928 | 82% | 0.817 | S | S | * | * | trans | -160.1 | 135 | 138.8 | -102.4 | 158.6 | -165.2 | -133.8 | 3.8 | 110.2 | ||||
| 133 | H | 36.9 | Very low | 38.1 | Very low | 180 Ų | 180 | 147.5 Ų | 147.5 | 83% | 0.833 | 81% | 0.812 | S | S | * | * | trans | -68.7 | 141.8 | 176.5 | -54.1 | -94.4 | 0 | 0 | 0 | 111 | ||||
| 134 | S | 35.7 | Very low | 37.8 | Very low | 115 Ų | 115 | 144.3 Ų | 144.3 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | trans | 177.7 | 118.1 | 143.2 | 49.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 135 | S | 32.2 | Very low | 37.7 | Very low | 114 Ų | 114 | 147.9 Ų | 147.9 | 80% | 0.797 | 81% | 0.812 | S | S | * | * | trans | -67.2 | 148.1 | 162 | -49.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 136 | P | 43.8 | Very low | 37.5 | Very low | 122 Ų | 122 | 146 Ų | 146 | 79% | 0.792 | 80% | 0.799 | S | S | * | * | trans | -106.1 | 111 | 156.5 | 29.9 | -17.2 | 0 | 0 | 0 | 108.7 | ||||
| 137 | V | 41.3 | Very low | 37.5 | Very low | 124 Ų | 124 | 142.3 Ų | 142.3 | 75% | 0.752 | 79% | 0.791 | S | S | * | * | 49.9 | 107.6 | 83.6 | -172.7 | 0 | 0 | 0 | 0 | 113.7 | I139 | V137-I139 HydrophobicContact CG1-CG1 4.38Š| |||
| 138 | Y | 30 | Very low | 37.3 | Very low | 219 Ų | 219 | 147.7 Ų | 147.7 | 86% | 0.859 | 80% | 0.797 | S | S | * | * | trans | -62.5 | 130.1 | 164.4 | -123.5 | -100.8 | 0 | 0 | 0 | 109.9 | ||||
| 139 | I | 37.3 | Very low | 36.9 | Very low | 151 Ų | 151 | 143.1 Ų | 143.1 | 77% | 0.774 | 79% | 0.789 | S | S | * | * | trans | -129.1 | 112.4 | 161.6 | -62.7 | 178.3 | 0 | 0 | 0 | 107.5 | V137 | V137-I139 HydrophobicContact CG1-CG1 4.38Š| ||
| 140 | S | 30.3 | Very low | 36.8 | Very low | 97 Ų | 97 | 141.7 Ų | 141.7 | 68% | 0.678 | 79% | 0.786 | S | S | * | * | trans | -77.9 | 135.1 | 163 | -40.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 141 | S | 33.9 | Very low | 36.8 | Very low | 116 Ų | 116 | 143.9 Ų | 143.9 | 81% | 0.811 | 78% | 0.784 | S | S | * | * | trans | -159 | 148 | 144.7 | -85.9 | 0 | 0 | 0 | 0 | 111 | ||||
| 142 | P | 41.1 | Very low | 36.9 | Very low | 109 Ų | 109 | 150 Ų | 150 | 71% | 0.708 | 80% | 0.795 | S | S | * | * | trans | -109.6 | -174.5 | -161.3 | 31 | -11 | 0 | 0 | 0 | 112.3 | ||||
| 143 | E | 34.1 | Very low | 36.9 | Very low | 177 Ų | 177 | 146.1 Ų | 146.1 | 83% | 0.827 | 79% | 0.793 | S | S | * | * | trans | 103.9 | 134.4 | 154.6 | -64.5 | 179.6 | 163 | 0 | 0 | 120 | ||||
| 144 | S | 37.7 | Very low | 37.1 | Very low | 122 Ų | 122 | 144.5 Ų | 144.5 | 85% | 0.853 | 79% | 0.79 | S | S | * | * | trans | 83.8 | 138 | 162.6 | 76.6 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 145 | Y | 36.2 | Very low | 37.2 | Very low | 199 Ų | 199 | 149.3 Ų | 149.3 | 78% | 0.78 | 79% | 0.791 | S | S | * | * | cis | -174.8 | 154.5 | -21.7 | -168.6 | -134 | 0 | 0 | 0 | 104.5 | ||||
| 146 | E | 37.6 | Very low | 37.3 | Very low | 144 Ų | 144 | 155.4 Ų | 155.4 | 67% | 0.673 | 80% | 0.796 | S | S | * | * | trans | 86.8 | 97.1 | 161 | -46.5 | -146.3 | 137.7 | 0 | 0 | 122 | ||||
| 147 | H | 38.4 | Very low | 36.9 | Very low | 161 Ų | 161 | 157.8 Ų | 157.8 | 75% | 0.745 | 80% | 0.797 | S | S | * | * | 30.6 | 118.1 | 120.4 | -86.8 | -50.3 | 0 | 0 | 0 | 121.2 | |||||
| 148 | M | 37.4 | Very low | 36.7 | Very low | 194 Ų | 194 | 161.3 Ų | 161.3 | 96% | 0.956 | 80% | 0.803 | S | S | * | * | -135.5 | 113.6 | 129.7 | -70.2 | -163.2 | 76 | 0 | 0 | 109.4 | |||||
| 149 | S | 34 | Very low | 36.9 | Very low | 94 Ų | 94 | 156.8 Ų | 156.8 | 66% | 0.657 | 79% | 0.793 | S | S | * | * | trans | -88.9 | 139.5 | 172.4 | -56.9 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 150 | S | 40.2 | Very low | 36.9 | Very low | 112 Ų | 112 | 158.2 Ų | 158.2 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | trans | -153.7 | 94.4 | 152.9 | 64 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 151 | D | 39 | Very low | 36.9 | Very low | 142 Ų | 142 | 158.9 Ų | 158.9 | 76% | 0.759 | 80% | 0.801 | S | S | * | * | trans | 20 | 121.7 | 135.5 | -50.8 | -34.9 | 0 | 0 | 0 | 118.9 | ||||
| 152 | F | 40.1 | Very low | 37.1 | Very low | 212 Ų | 212 | 157.8 Ų | 157.8 | 93% | 0.93 | 79% | 0.793 | S | S | * | * | trans | -174.3 | 93.8 | 132.2 | -97.4 | -69.3 | 0 | 0 | 0 | 108.9 | ||||
| 153 | D | 36.8 | Very low | 36.8 | Very low | 165 Ų | 165 | 162.4 Ų | 162.4 | 88% | 0.882 | 80% | 0.803 | S | S | * | * | trans | -121.3 | 123.2 | 164.1 | -91.8 | -41.1 | 0 | 0 | 0 | 108.5 | ||||
| 154 | D | 41.5 | Very low | 36.8 | Very low | 145 Ų | 145 | 158.3 Ų | 158.3 | 78% | 0.775 | 80% | 0.799 | S | S | * | * | trans | -143.2 | 97.6 | 164.9 | -121.2 | -21.5 | 0 | 0 | 0 | 111.2 | ||||
| 155 | R | 39.1 | Very low | 36.7 | Very low | 217 Ų | 217 | 161.5 Ų | 161.5 | 82% | 0.819 | 80% | 0.798 | S | S | * | * | trans | 37.5 | 115.6 | 137.7 | -69.7 | 176.3 | 161.6 | 157 | -3.1 | 119.9 | ||||
| 156 | R | 34.4 | Very low | 36.7 | Very low | 241 Ų | 241 | 160 Ų | 160 | 91% | 0.909 | 80% | 0.798 | S | S | * | * | -176.9 | 114 | 101.2 | -106.5 | 176.7 | -88.4 | -161.3 | -6 | 112.9 | |||||
| 157 | E | 33.8 | Very low | 36.5 | Very low | 173 Ų | 173 | 160.6 Ų | 160.6 | 81% | 0.808 | 80% | 0.804 | S | S | * | * | trans | -69.9 | 143.4 | 157.2 | -78.6 | 166.3 | 141.1 | 0 | 0 | 110.6 | ||||
| 158 | F | 38.7 | Very low | 36.1 | Very low | 198 Ų | 198 | 158.1 Ų | 158.1 | 87% | 0.868 | 81% | 0.805 | S | S | * | * | trans | -145.1 | 113.3 | 149.9 | -128 | -89 | 0 | 0 | 0 | 108.5 | ||||
| 159 | D | 34.1 | Very low | 36 | Very low | 124 Ų | 124 | 158.3 Ų | 158.3 | 66% | 0.663 | 80% | 0.801 | S | S | * | * | trans | -61.5 | 145.7 | 176.8 | -64.2 | -55.8 | 0 | 0 | 0 | 112.3 | ||||
| 160 | H | 37 | Very low | 36 | Very low | 180 Ų | 180 | 160 Ų | 160 | 83% | 0.833 | 81% | 0.807 | S | S | * | * | trans | -160.7 | 85.1 | 140.3 | -86.6 | -54.5 | 0 | 0 | 0 | 110.2 | ||||
| 161 | S | 30.7 | Very low | 35.7 | Very low | 112 Ų | 112 | 162 Ų | 162 | 78% | 0.783 | 80% | 0.804 | S | S | * | * | trans | -108.4 | 96 | 161.2 | 61.9 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 162 | S | 36.7 | Very low | 35.4 | Very low | 92 Ų | 92 | 161 Ų | 161 | 64% | 0.643 | 80% | 0.798 | S | S | * | * | trans | 179.2 | 120 | 157.7 | 47.1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 163 | F | 35 | Very low | 35.3 | Very low | 206 Ų | 206 | 158.5 Ų | 158.5 | 90% | 0.904 | 79% | 0.794 | S | S | * | * | trans | 149.7 | 67.5 | 146.6 | -87.1 | -75.6 | 0 | 0 | 0 | 110.2 | ||||
| 164 | A | 33.4 | Very low | 35 | Very low | 91 Ų | 91 | 158.4 Ų | 158.4 | 75% | 0.752 | 79% | 0.794 | S | S | * | * | trans | -97.1 | 146 | 149.1 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 165 | K | 36.6 | Very low | 34.4 | Very low | 190 Ų | 190 | 154.6 Ų | 154.6 | 83% | 0.826 | 79% | 0.789 | S | S | * | * | trans | 97.6 | 98.3 | 177.9 | -57.4 | 168.8 | -178.9 | 176.7 | 0 | 114.3 | ||||
| 166 | H | 36.8 | Very low | 34.2 | Very low | 168 Ų | 168 | 152.7 Ų | 152.7 | 78% | 0.778 | 79% | 0.793 | S | S | * | * | -173.7 | 136.3 | 105.5 | -116.9 | -83.1 | 0 | 0 | 0 | 112.7 | |||||
| 167 | L | 33.4 | Very low | 34 | Very low | 155 Ų | 155 | 148 Ų | 148 | 81% | 0.812 | 79% | 0.786 | S | S | * | * | trans | 89.5 | 91.8 | 153.1 | -54.8 | 172 | 0 | 0 | 0 | 120.1 | ||||
| 168 | S | 29.4 | Very low | 33.9 | Very low | 109 Ų | 109 | 147.9 Ų | 147.9 | 76% | 0.762 | 79% | 0.785 | S | S | * | * | trans | -88.8 | 162 | 139.8 | -60.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 169 | K | 34.6 | Very low | 33.4 | Very low | 199 Ų | 199 | 143.1 Ų | 143.1 | 87% | 0.865 | 78% | 0.777 | S | S | * | * | trans | 89.2 | 126.4 | -177.2 | -80.8 | 108 | 172 | -178.4 | 0 | 112.2 | ||||
| 170 | V | 35.5 | Very low | 33.3 | Very low | 130 Ų | 130 | 144.9 Ų | 144.9 | 79% | 0.788 | 78% | 0.781 | S | S | * | * | -162.4 | 141.2 | 52.4 | 167.6 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 171 | H | 32.5 | Very low | 32.8 | Very low | 154 Ų | 154 | 143.4 Ų | 143.4 | 71% | 0.713 | 77% | 0.772 | S | S | * | * | trans | 29 | 128.4 | 151.5 | -91.2 | -94.2 | 0 | 0 | 0 | 123.6 | ||||
| 172 | D | 32.8 | Very low | 32.9 | Very low | 119 Ų | 119 | 145.1 Ų | 145.1 | 64% | 0.636 | 77% | 0.766 | S | S | * | * | 23.8 | 125.2 | 119.4 | -49.2 | -33.9 | 0 | 0 | 0 | 118.5 | |||||
| 173 | N | 37.9 | Very low | 32.7 | Very low | 161 Ų | 161 | 147.6 Ų | 147.6 | 86% | 0.861 | 77% | 0.767 | S | S | * | * | -173.7 | 139.5 | 111.2 | -88.3 | -41.4 | 0 | 0 | 0 | 112.7 | |||||
| 174 | N | 31 | Very low | 32.9 | Very low | 163 Ų | 163 | 143.8 Ų | 143.8 | 87% | 0.872 | 75% | 0.752 | S | S | * | * | trans | -59 | 145.4 | 179.4 | -79.5 | -45.1 | 0 | 0 | 0 | 114.5 | ||||
| 175 | G | 29.8 | Very low | 33.2 | Very low | 65 Ų | 65 | 146.7 Ų | 146.7 | 67% | 0.67 | 75% | 0.747 | S | S | * | * | 71 | 122.6 | 129.1 | 0 | 0 | 0 | 0 | 0 | 117.9 | |||||
| 176 | I | 34.9 | Very low | 33.1 | Very low | 177 Ų | 177 | 146.2 Ų | 146.2 | 91% | 0.908 | 75% | 0.745 | S | S | * | * | -170.4 | 137.5 | 124 | -90.6 | 146.9 | 0 | 0 | 0 | 108.5 | |||||
| 177 | N | 28.5 | Very low | 32.9 | Very low | 141 Ų | 141 | 142.1 Ų | 142.1 | 75% | 0.754 | 74% | 0.741 | S | S | * | * | trans | -74 | 171.8 | -177 | -66.5 | -55.8 | 0 | 0 | 0 | 113.6 | ||||
| 178 | Q | 31.9 | Very low | 33.1 | Very low | 172 Ų | 172 | 142.9 Ų | 142.9 | 80% | 0.804 | 75% | 0.745 | S | S | * | * | trans | 95.5 | 111 | 139.1 | -87.7 | 166.9 | 24 | 0 | 0 | 119.7 | ||||
| 179 | S | 28.8 | Very low | 33.4 | Very low | 98 Ų | 98 | 142.8 Ų | 142.8 | 69% | 0.685 | 74% | 0.739 | S | S | * | * | 93.7 | 149.7 | 116.2 | 75.6 | 0 | 0 | 0 | 0 | 119.5 | |||||
| 180 | H | 31.2 | Very low | 33.5 | Very low | 161 Ų | 161 | 140 Ų | 140 | 75% | 0.745 | 73% | 0.733 | S | S | * | * | trans | 82.2 | 140.2 | 165.7 | -98.1 | -108.1 | 0 | 0 | 0 | 117.5 | ||||
| 181 | F | 27.6 | Very low | 33.5 | Very low | 149 Ų | 149 | 139.7 Ų | 139.7 | 65% | 0.654 | 73% | 0.727 | S | S | * | * | cis | 165.5 | 161.5 | -20.1 | -137.8 | -83.2 | 0 | 0 | 0 | 104.9 | ||||
| 182 | F | 33.1 | Very low | 33.5 | Very low | 147 Ų | 147 | 139.7 Ų | 139.7 | 65% | 0.645 | 73% | 0.732 | S | S | * | * | trans | 77 | 102.8 | 163.8 | -74.7 | -75.7 | 0 | 0 | 0 | 117.5 | ||||
| 183 | E | 32.7 | Very low | 33.5 | Very low | 144 Ų | 144 | 138.6 Ų | 138.6 | 67% | 0.673 | 74% | 0.74 | S | S | * | * | 83.7 | 121.1 | 85.3 | -91.2 | -156.4 | 143.3 | 0 | 0 | 113.7 | |||||
| 184 | H | 39.2 | Very low | 33.5 | Very low | 126 Ų | 126 | 136.3 Ų | 136.3 | 58% | 0.583 | 73% | 0.734 | S | S | * | * | 173.7 | 135.8 | 101 | -111.5 | -37.2 | 0 | 0 | 0 | 114 | |||||
| 185 | K | 39.5 | Very low | 33.5 | Very low | 152 Ų | 152 | 135.7 Ų | 135.7 | 66% | 0.661 | 73% | 0.73 | S | S | * | * | trans | 68 | 139.3 | 140.8 | -70.6 | 159.4 | 175.1 | 150.9 | 0 | 117.8 | ||||
| 186 | K | 34.6 | Very low | 33.5 | Very low | 180 Ų | 180 | 138.9 Ų | 138.9 | 78% | 0.783 | 73% | 0.731 | S | S | * | * | cis | -167.9 | 125.7 | 6.8 | -116.6 | 167.2 | 176.6 | -175.2 | 0 | 105.5 | ||||
| 187 | A | 33.1 | Very low | 33.2 | Very low | 82 Ų | 82 | 135.7 Ų | 135.7 | 68% | 0.678 | 72% | 0.72 | S | S | * | * | 71.8 | 112.5 | 101.6 | 0 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 188 | L | 36.6 | Very low | 33.4 | Very low | 172 Ų | 172 | 134.9 Ų | 134.9 | 90% | 0.901 | 72% | 0.72 | S | S | * | * | trans | 173.3 | 91 | 135.9 | -90.4 | 167.1 | 0 | 0 | 0 | 106.6 | ||||
| 189 | V | 36.3 | Very low | 33.3 | Very low | 107 Ų | 107 | 131.5 Ų | 131.5 | 65% | 0.648 | 72% | 0.716 | S | S | * | * | 85.2 | 114.9 | 67.2 | 172 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 190 | L | 36.8 | Very low | 33.6 | Very low | 140 Ų | 140 | 131.8 Ų | 131.8 | 73% | 0.733 | 72% | 0.718 | S | S | * | * | trans | 75.9 | 132.3 | 160.9 | -56.3 | 156.4 | 0 | 0 | 0 | 115.8 | ||||
| 191 | N | 34.2 | Very low | 33.8 | Very low | 123 Ų | 123 | 133 Ų | 133 | 66% | 0.658 | 72% | 0.721 | S | S | * | * | cis | -172.2 | 138.4 | 10.3 | -116.3 | -15.5 | 0 | 0 | 0 | 109.7 | ||||
| 192 | N | 33.1 | Very low | 34 | Very low | 155 Ų | 155 | 132.7 Ų | 132.7 | 83% | 0.829 | 73% | 0.725 | S | S | * | * | trans | 141.3 | 105.6 | 133.9 | -69 | -25.9 | 0 | 0 | 0 | 112.6 | ||||
| 193 | A | 32.8 | Very low | 34.1 | Very low | 96 Ų | 96 | 133.2 Ų | 133.2 | 79% | 0.793 | 74% | 0.735 | S | S | * | * | trans | -90.1 | 167.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 194 | P | 36.8 | Very low | 34 | Very low | 113 Ų | 113 | 132.2 Ų | 132.2 | 73% | 0.734 | 74% | 0.742 | S | S | * | * | trans | -100.1 | -158.2 | -167.2 | 40.2 | -30.4 | 0 | 0 | 0 | 112.1 | ||||
| 195 | L | 32.7 | Very low | 33.8 | Very low | 150 Ų | 150 | 131.7 Ų | 131.7 | 79% | 0.785 | 75% | 0.752 | S | S | * | * | trans | 104.9 | 139.5 | -179.5 | -55.9 | 158.3 | 0 | 0 | 0 | 111.1 | ||||
| 196 | D | 29.1 | Very low | 33.7 | Very low | 132 Ų | 132 | 130.6 Ų | 130.6 | 71% | 0.706 | 76% | 0.758 | S | S | * | * | cis | -163.5 | 166.6 | -2.9 | -111.2 | -21.6 | 0 | 0 | 0 | 109.4 | ||||
| 197 | T | 29.3 | Very low | 34 | Very low | 109 Ų | 109 | 129 Ų | 129 | 67% | 0.669 | 76% | 0.757 | S | S | * | * | trans | -35.9 | 153.8 | 171.8 | 47.4 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 198 | T | 31.5 | Very low | 34.2 | Very low | 124 Ų | 124 | 134.6 Ų | 134.6 | 76% | 0.761 | 77% | 0.766 | S | S | * | * | trans | 104.9 | 113 | 146.7 | 71.8 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 199 | S | 30.9 | Very low | 33.8 | Very low | 102 Ų | 102 | 132.3 Ų | 132.3 | 71% | 0.713 | 76% | 0.763 | S | S | * | * | trans | 61 | 127.8 | 135.8 | 64.2 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 200 | S | 34.3 | Very low | 33.8 | Very low | 103 Ų | 103 | 132.8 Ų | 132.8 | 72% | 0.72 | 77% | 0.769 | S | S | * | * | trans | 85.5 | 107.8 | 140.1 | 67.1 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 201 | K | 34.7 | Very low | 33.9 | Very low | 188 Ų | 188 | 132.2 Ų | 132.2 | 82% | 0.817 | 77% | 0.771 | S | S | * | * | trans | 61.9 | 118.5 | 130.3 | -72.6 | -178.8 | 178.1 | -179.4 | 0 | 119.2 | ||||
| 202 | L | 32.8 | Very low | 34 | Very low | 142 Ų | 142 | 131.3 Ų | 131.3 | 74% | 0.743 | 77% | 0.774 | S | S | * | * | trans | 74.4 | 105.6 | 135.7 | -62.7 | 170.4 | 0 | 0 | 0 | 117.3 | ||||
| 203 | N | 36.1 | Very low | 34.2 | Very low | 157 Ų | 157 | 131.7 Ų | 131.7 | 84% | 0.84 | 78% | 0.775 | S | S | * | * | 168 | 134.8 | 95.9 | -87.2 | -29.7 | 0 | 0 | 0 | 111.9 | |||||
| 204 | C | 30 | Very low | 34.1 | Very low | 123 Ų | 123 | 133.5 Ų | 133.5 | 83% | 0.831 | 77% | 0.772 | S | S | * | * | trans | -96.1 | 133.9 | 174.3 | -178.1 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 205 | C | 34 | Very low | 34.1 | Very low | 116 Ų | 116 | 136.5 Ų | 136.5 | 78% | 0.784 | 78% | 0.78 | S | S | * | * | trans | -170.7 | 111.6 | 151.2 | -104 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 206 | T | 38.6 | Very low | 34.2 | Very low | 128 Ų | 128 | 135.7 Ų | 135.7 | 79% | 0.785 | 78% | 0.776 | S | S | * | * | 168.7 | 137.4 | 122.1 | 42 | 0 | 0 | 0 | 0 | 111 | |||||
| 207 | L | 40.7 | Very low | 34.4 | Very low | 148 Ų | 148 | 134.5 Ų | 134.5 | 78% | 0.775 | 78% | 0.778 | S | S | * | * | trans | 102.1 | 85.8 | 159.3 | -48.3 | -175.3 | 0 | 0 | 0 | 118.8 | ||||
| 208 | K | 36.7 | Very low | 34.8 | Very low | 198 Ų | 198 | 135.1 Ų | 135.1 | 86% | 0.861 | 78% | 0.784 | S | S | * | * | 73.3 | 101.4 | 125.3 | -80.6 | 166.7 | 171.9 | 173.9 | 0 | 119.8 | |||||
| 209 | C | 28.1 | Very low | 34.7 | Very low | 125 Ų | 125 | 136.8 Ų | 136.8 | 85% | 0.845 | 79% | 0.788 | S | S | * | * | trans | -97.3 | 166.7 | 152.4 | -64.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 210 | P | 36.3 | Very low | 34.5 | Very low | 117 Ų | 117 | 137 Ų | 137 | 76% | 0.76 | 79% | 0.788 | S | S | * | * | trans | -119.7 | 116.2 | 133.7 | 28.4 | -15.4 | 0 | 0 | 0 | 111.5 | ||||
| 211 | T | 38.3 | Very low | 34.5 | Very low | 128 Ų | 128 | 141 Ų | 141 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | 29.5 | 127.9 | 129.5 | 16.6 | 0 | 0 | 0 | 0 | 117.8 | |||||
| 212 | S | 38 | Very low | 34.6 | Very low | 103 Ų | 103 | 140 Ų | 140 | 72% | 0.72 | 80% | 0.798 | S | S | * | * | 179.5 | 156.4 | 51.3 | 41.7 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 213 | L | 36.5 | Very low | 34.6 | Very low | 163 Ų | 163 | 142.1 Ų | 142.1 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | trans | 123.2 | 79.2 | 160 | -64 | 171.8 | 0 | 0 | 0 | 115.3 | ||||
| 214 | N | 31.4 | Very low | 34.4 | Very low | 135 Ų | 135 | 140.7 Ų | 140.7 | 72% | 0.722 | 79% | 0.794 | S | S | * | * | trans | -24.2 | 137.9 | 154 | -54.5 | -29 | 0 | 0 | 0 | 116.7 | ||||
| 215 | I | 36.3 | Very low | 34.6 | Very low | 176 Ų | 176 | 142.1 Ų | 142.1 | 90% | 0.903 | 79% | 0.793 | S | S | * | * | -157 | 132.9 | 114.2 | -83.7 | 144.7 | 0 | 0 | 0 | 106.9 | |||||
| 216 | D | 34.3 | Very low | 34.8 | Very low | 132 Ų | 132 | 144.1 Ų | 144.1 | 71% | 0.706 | 80% | 0.795 | S | S | * | * | trans | -87 | 145.2 | -156.5 | -67.6 | -66.6 | 0 | 0 | 0 | 116.9 | ||||
| 217 | S | 34.4 | Very low | 34.6 | Very low | 108 Ų | 108 | 146.8 Ų | 146.8 | 76% | 0.755 | 80% | 0.795 | S | S | * | * | trans | 78.5 | 151.3 | 132.8 | -71.5 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 218 | P | 36.7 | Very low | 34.1 | Very low | 122 Ų | 122 | 146.2 Ų | 146.2 | 79% | 0.792 | 80% | 0.798 | S | S | * | * | -136.6 | 170.9 | -58.2 | 32.1 | -11.1 | 0 | 0 | 0 | 114.3 | |||||
| 219 | L | 29.4 | Very low | 34 | Very low | 159 Ų | 159 | 145.5 Ų | 145.5 | 83% | 0.832 | 80% | 0.798 | S | S | * | * | trans | -50.9 | 151.3 | 178.7 | -80.5 | 163.4 | 0 | 0 | 0 | 118.9 | ||||
| 220 | C | 27.3 | Very low | 34.1 | Very low | 105 Ų | 105 | 149 Ų | 149 | 71% | 0.709 | 80% | 0.798 | S | S | * | * | trans | 7.6 | 127.2 | 147.5 | 64.6 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 221 | E | 33.1 | Very low | 34.2 | Very low | 187 Ų | 187 | 149.5 Ų | 149.5 | 87% | 0.874 | 80% | 0.802 | S | S | * | * | trans | -156.9 | 158.1 | 145.4 | -110.4 | 173.3 | -158.8 | 0 | 0 | 110.1 | ||||
| 222 | L | 38.1 | Very low | 33.9 | Very low | 167 Ų | 167 | 150.9 Ų | 150.9 | 87% | 0.874 | 80% | 0.804 | S | S | * | * | trans | 95.8 | 72.9 | -179.5 | -68.5 | 124.4 | 0 | 0 | 0 | 118.4 | ||||
| 223 | K | 31.9 | Very low | 33.7 | Very low | 188 Ų | 188 | 150.8 Ų | 150.8 | 82% | 0.817 | 80% | 0.801 | S | S | * | * | trans | -80.7 | 144.2 | 136 | -99.4 | 176.2 | 176.6 | 175.4 | 0 | 109.6 | ||||
| 224 | N | 32.8 | Very low | 33.8 | Very low | 127 Ų | 127 | 149.9 Ų | 149.9 | 68% | 0.679 | 80% | 0.798 | S | S | * | * | trans | 72.9 | 105.8 | 161.2 | -54.3 | -17 | 0 | 0 | 0 | 116.4 | ||||
| 225 | N | 33.8 | Very low | 34.4 | Very low | 153 Ų | 153 | 150.3 Ų | 150.3 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | -176.6 | 155.6 | 117 | -91.4 | -46.5 | 0 | 0 | 0 | 110.9 | |||||
| 226 | L | 38.5 | Very low | 34.5 | Very low | 158 Ų | 158 | 150.1 Ų | 150.1 | 83% | 0.827 | 80% | 0.798 | S | S | * | * | trans | 92.2 | 80.6 | 163.6 | -64.9 | 131.5 | 0 | 0 | 0 | 118.5 | ||||
| 227 | K | 34.6 | Very low | 34.7 | Very low | 183 Ų | 183 | 151.3 Ų | 151.3 | 80% | 0.796 | 80% | 0.804 | S | S | * | * | 45.9 | 105.5 | 115.1 | -82.5 | 171.6 | 173.9 | 174.2 | 0 | 117.7 | Q229 | K227-Q229 PolarHBondContact O-N 2.97Š| |||
| 228 | V | 29.6 | Very low | 35 | Very low | 137 Ų | 137 | 153.5 Ų | 153.5 | 83% | 0.83 | 81% | 0.806 | S | S | * | * | -10.1 | 108.2 | 127.3 | -177.4 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 229 | Q | 35.2 | Very low | 35.3 | Very low | 182 Ų | 182 | 153.9 Ų | 153.9 | 85% | 0.85 | 81% | 0.806 | S | S | * | * | trans | -139.2 | 123.5 | 146 | -78 | -169.7 | 8.6 | 0 | 0 | 108.7 | K227 | K227-Q229 PolarHBondContact O-N 2.97Š| ||
| 230 | K | 29.2 | Very low | 35.7 | Very low | 198 Ų | 198 | 148.6 Ų | 148.6 | 86% | 0.861 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 135.9 | 171.9 | -69.5 | 172.3 | 174.6 | 175.6 | 0 | 109.2 | ||
| 231 | P | 38 | Very low | 36.5 | Very low | 129 Ų | 129 | 154.5 Ų | 154.5 | 84% | 0.838 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -91.6 | 132.7 | 163.1 | 15.8 | 0.7 | 0 | 0 | 0 | 111.2 | ||
| 232 | N | 33.9 | Very low | 37.1 | Very low | 156 Ų | 156 | 155.2 Ų | 155.2 | 83% | 0.834 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 145.5 | 179.1 | -148.7 | -1.4 | 0 | 0 | 0 | 112.5 | ||
| 233 | P | 33.4 | Very low | 37.6 | Very low | 101 Ų | 101 | 153.5 Ų | 153.5 | 66% | 0.656 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 120.3 | 176.8 | 31.9 | -20.9 | 0 | 0 | 0 | 109.2 | ||
| 234 | N | 38.7 | Very low | 38.6 | Very low | 145 Ų | 145 | 148.5 Ų | 148.5 | 78% | 0.775 | 76% | 0.757 | S | S | * | * | trans | 167.1 | 93.7 | 148.9 | -90.3 | -32.5 | 0 | 0 | 0 | 110.3 | ||||
| 235 | T | 44 | Very low | 39.5 | Very low | 144 Ų | 144 | 145.2 Ų | 145.2 | 88% | 0.883 | 74% | 0.744 | S | S | * | * | trans | -157.8 | 110.4 | 139.3 | -5.2 | 0 | 0 | 0 | 0 | 108.6 | N237 | T235-N237 PolarHBondContact O-N 3.25Š| ||
| 236 | K | 37.2 | Very low | 40.6 | Very low | 171 Ų | 171 | 146.2 Ų | 146.2 | 74% | 0.743 | 74% | 0.736 | S | S | * | * | trans | -72.3 | 110.8 | 176.7 | -64.2 | 167.7 | 180 | 172.7 | 0 | 107.4 | ||||
| 237 | N | 40.2 | Very low | 41.9 | Very low | 158 Ų | 158 | 142.8 Ų | 142.8 | 85% | 0.845 | 72% | 0.722 | S | S | * | * | trans | -120.5 | 97.1 | 152.8 | -90.1 | -29.3 | 0 | 0 | 0 | 108 | T235 V239 | T235-N237 PolarHBondContact O-N 3.25Å; N237-V239 PolarHBondContact O-N 2.81Å | ||
| 238 | I | 39 | Very low | 43.2 | Very low | 154 Ų | 154 | 138.9 Ų | 138.9 | 79% | 0.79 | 71% | 0.709 | S | S | * | * | trans | -80.7 | 91.6 | 176.6 | -65.3 | 165.3 | 0 | 0 | 0 | 105.5 | ||||
| 239 | V | 43.7 | Very low | 44.8 | Very low | 130 Ų | 130 | 137.3 Ų | 137.3 | 79% | 0.788 | 69% | 0.692 | S | S | * | * | trans | -133.8 | 111 | 163.2 | -176.4 | 0 | 0 | 0 | 0 | 108.4 | N237 | N237-V239 PolarHBondContact O-N 2.81Š| ||
| 240 | S | 38.3 | Very low | 46.4 | Very low | 47 Ų | 47 | 136.2 Ų | 136.2 | 33% | 0.329 | 68% | 0.684 | S | S | . | * | trans | 49.4 | 58.7 | 162 | -145.2 | 0 | 0 | 0 | 0 | 119.4 | R242 E243 | S240-R242 PolarHBondContact O-N 2.83Å; S240-E243 WeakPolarHBondContact CB-OE2 3.08Å; S240-E243 PolarHBondContact O-N 3.47Å; S240-E243 VanDerWaalsContact O-N 3.11Å; S240-E243 VanDerWaalsContact OG-CD 3.23Å; S240-E243 WeakPolarHBondContact OG-CG 3.37Å; S240-E243 PolarHBondContact OG-OE2 3.27Å | ||
| 241 | R | 43 | Very low | 48.2 | Very low | 229 Ų | 229 | 130.8 Ų | 130.8 | 86% | 0.864 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -59.2 | -7.9 | 163.5 | -163.3 | 173.8 | -174.9 | 174.2 | 2.2 | 113.8 | S245 | R241-S245 PolarHBondContact O-OG 2.76Å |
| 242 | R | 46.4 | Very low | 49.4 | Very low | 203 Ų | 203 | 129.4 Ų | 129.4 | 77% | 0.766 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -88 | -19.8 | 175.5 | -85.9 | -178.2 | 177.1 | 155.1 | -0.5 | 113.8 | S240 S245 R246 | S240-R242 PolarHBondContact O-N 2.83Å; R242-S245 PolarHBondContact O-OG 3.44Å; R242-R246 WeakPolarHBondContact O-CG 3.48Å |
| 243 | E | 48.8 | Very low | 50.6 | Low | 131 Ų | 131 | 129.6 Ų | 129.6 | 61% | 0.612 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -87.6 | -37 | 178.3 | -80.6 | 166.9 | 154.8 | 0 | 0 | 111.7 | S240 S245 R246 T247 | S240-E243 WeakPolarHBondContact CB-OE2 3.08Å; S240-E243 PolarHBondContact O-N 3.47Å; S240-E243 VanDerWaalsContact O-N 3.11Å; S240-E243 VanDerWaalsContact OG-CD 3.23Å; S240-E243 WeakPolarHBondContact OG-CG 3.37Å; S240-E243 PolarHBondContact OG-OE2 3.27Å; E243-S245 PolarHBondContact O-N 3.39Å; E243-R246 PolarHBondContact O-N 3.4Å; E243-T247 PolarHBondContact O-N 3.01Å; E243-T247 PolarHBondContact O-OG1 3.46Å |
| 244 | T | 52.9 | Low | 52.1 | Low | 83 Ų | 83 | 130.2 Ų | 130.2 | 51% | 0.509 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -69.3 | -31.6 | 177.2 | 53.6 | 0 | 0 | 0 | 0 | 113.4 | T247 I248 | T244-T247 PolarHBondContact O-OG1 3.03Å; T244-I248 WeakPolarHBondContact O-CD1 3.18Å; T244-I248 VanDerWaalsContact O-CG1 3.31Å; T244-I248 WeakPolarHBondContact O-CG1 3.48Å; T244-I248 PolarHBondContact O-N 3.06Å |
| 245 | S | 51.5 | Low | 52.9 | Low | 57 Ų | 57 | 125.6 Ų | 125.6 | 40% | 0.399 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -69.6 | -34.4 | 175 | 56.2 | 0 | 0 | 0 | 0 | 112.7 | R241 R242 E243 I248 E249 | R241-S245 PolarHBondContact O-OG 2.76Å; R242-S245 PolarHBondContact O-OG 3.44Å; E243-S245 PolarHBondContact O-N 3.39Å; S245-I248 PolarHBondContact O-N 3.29Å; S245-E249 PolarHBondContact O-N 3.15Å |
| 246 | R | 56.8 | Low | 53.2 | Low | 174 Ų | 174 | 123.7 Ų | 123.7 | 66% | 0.657 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -72.1 | -32.1 | 177.4 | -72.8 | 178 | 175.5 | 176.2 | -1.1 | 112.7 | R242 E243 K250 | R242-R246 WeakPolarHBondContact O-CG 3.48Å; E243-R246 PolarHBondContact O-N 3.4Å; R246-K250 PolarHBondContact O-N 2.89Å; R246-K250 VanDerWaalsContact O-N 3.15Å |
| 247 | T | 65.2 | Low | 54.1 | Low | 87 Ų | 87 | 120.8 Ų | 120.8 | 53% | 0.534 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -70.2 | -40 | 173.2 | 0.6 | 0 | 0 | 0 | 0 | 111.7 | E243 T244 K250 T251 | E243-T247 PolarHBondContact O-N 3.01Å; E243-T247 PolarHBondContact O-OG1 3.46Å; T244-T247 PolarHBondContact O-OG1 3.03Å; T247-K250 PolarHBondContact O-N 3.43Å; T247-T251 PolarHBondContact O-N 3.01Å; T247-T251 PolarHBondContact O-OG1 3.05Å |
| 248 | I | 63.2 | Low | 54.5 | Low | 101 Ų | 101 | 120.9 Ų | 120.9 | 52% | 0.518 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -66.7 | -39.6 | 176.5 | -66.9 | 162.2 | 0 | 0 | 0 | 111.6 | T244 S245 T251 L252 | T244-I248 WeakPolarHBondContact O-CD1 3.18Å; T244-I248 VanDerWaalsContact O-CG1 3.31Å; T244-I248 WeakPolarHBondContact O-CG1 3.48Å; T244-I248 PolarHBondContact O-N 3.06Å; S245-I248 PolarHBondContact O-N 3.29Å; I248-T251 WeakPolarHBondContact CA-OG1 3.43Å; I248-T251 PolarHBondContact O-N 2.99Å; I248-T251 PolarHBondContact O-OG1 3.46Å; I248-L252 HydrophobicContact CG2-CD1 3.92Å; I248-L252 WeakPolarHBondContact O-CB 3.48Å; I248-L252 WeakPolarHBondContact O-CG 3.47Å; I248-L252 PolarHBondContact O-N 3.03Å |
| 249 | E | 62.6 | Low | 55 | Low | 103 Ų | 103 | 118.7 Ų | 118.7 | 48% | 0.481 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -68.7 | -35.9 | 176.5 | -119.3 | -168.1 | 126.4 | 0 | 0 | 112.7 | S245 R253 | S245-E249 PolarHBondContact O-N 3.15Å; E249-R253 WeakPolarHBondContact O-CG 3.17Å; E249-R253 PolarHBondContact O-N 3.47Å; E249-R253 IonicContact OE1-CZ 3.87Å; E249-R253 IonicContact OE1-NE 3.86Å; E249-R253 IonicContact OE1-NH2 2.98Å; E249-R253 PolarHBondContact OE1-NH2 3.29Å |
| 250 | K | 68 | Low | 55.1 | Low | 159 Ų | 159 | 120.5 Ų | 120.5 | 69% | 0.691 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -67.6 | -39.7 | 174.5 | -83.2 | -177.2 | 177.2 | -178.9 | 0 | 112 | R246 T247 Q254 | R246-K250 PolarHBondContact O-N 2.89Å; R246-K250 VanDerWaalsContact O-N 3.15Å; T247-K250 PolarHBondContact O-N 3.43Å; K250-Q254 WeakPolarHBondContact O-CB 3.48Å; K250-Q254 PolarHBondContact O-N 3.32Å |
| 251 | T | 67.3 | Low | 55.6 | Low | 85 Ų | 85 | 122.4 Ų | 122.4 | 52% | 0.521 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -70.2 | -35.4 | 176.2 | 46.4 | 0 | 0 | 0 | 0 | 112.5 | T247 I248 Q254 A255 | T247-T251 PolarHBondContact O-N 3.01Å; T247-T251 PolarHBondContact O-OG1 3.05Å; I248-T251 WeakPolarHBondContact CA-OG1 3.43Å; I248-T251 PolarHBondContact O-N 2.99Å; I248-T251 PolarHBondContact O-OG1 3.46Å; T251-Q254 PolarHBondContact O-N 3.44Å; T251-A255 WeakPolarHBondContact O-CB 3.39Å; T251-A255 PolarHBondContact O-N 2.97Å |
| 252 | L | 64.3 | Low | 55.5 | Low | 99 Ų | 99 | 117.8 Ų | 117.8 | 52% | 0.518 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -66.8 | -40.5 | 173 | -82.3 | 162.1 | 0 | 0 | 0 | 112.9 | I248 A255 N256 | I248-L252 HydrophobicContact CG2-CD1 3.92Å; I248-L252 WeakPolarHBondContact O-CB 3.48Å; I248-L252 WeakPolarHBondContact O-CG 3.47Å; I248-L252 PolarHBondContact O-N 3.03Å; L252-A255 PolarHBondContact O-N 3.39Å; L252-N256 PolarHBondContact O-N 3.42Å |
| 253 | R | 57.9 | Low | 55.1 | Low | 160 Ų | 160 | 117.7 Ų | 117.7 | 60% | 0.604 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -68.4 | -36.4 | 174.8 | -70.6 | 179.1 | -165.1 | -125.6 | 3.7 | 112.3 | E249 A255 N256 N257 | E249-R253 WeakPolarHBondContact O-CG 3.17Å; E249-R253 PolarHBondContact O-N 3.47Å; E249-R253 IonicContact OE1-CZ 3.87Å; E249-R253 IonicContact OE1-NE 3.86Å; E249-R253 IonicContact OE1-NH2 2.98Å; E249-R253 PolarHBondContact OE1-NH2 3.29Å; R253-A255 VanDerWaalsContact C-N 3.33Å; R253-N256 PolarHBondContact O-N 3.44Å; R253-N257 PolarHBondContact O-N 3.48Å |
| 254 | Q | 65 | Low | 54.5 | Low | 115 Ų | 115 | 117.4 Ų | 117.4 | 54% | 0.537 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -72.4 | -26.5 | 176.4 | -161.9 | 167.8 | 16 | 0 | 0 | 112.8 | K250 T251 R258 | K250-Q254 WeakPolarHBondContact O-CB 3.48Å; K250-Q254 PolarHBondContact O-N 3.32Å; T251-Q254 PolarHBondContact O-N 3.44Å; Q254-R258 WeakPolarHBondContact O-CG 3.36Å; Q254-R258 PolarHBondContact O-N 3.01Å |
| 255 | A | 56.3 | Low | 53.6 | Low | 48 Ų | 48 | 122.4 Ų | 122.4 | 40% | 0.397 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -72.4 | -44.7 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | T251 L252 R253 N257 R258 V259 | T251-A255 WeakPolarHBondContact O-CB 3.39Å; T251-A255 PolarHBondContact O-N 2.97Å; L252-A255 PolarHBondContact O-N 3.39Å; R253-A255 VanDerWaalsContact C-N 3.33Å; A255-N257 PolarHBondContact O-N 3.21Å; A255-R258 PolarHBondContact O-N 3.41Å; A255-R258 VanDerWaalsContact O-N 3.12Å; A255-V259 WeakPolarHBondContact O-CG2 3.4Å; A255-V259 PolarHBondContact O-N 3.06Å |
| 256 | N | 50.5 | Low | 53 | Low | 104 Ų | 104 | 125.6 Ų | 125.6 | 56% | 0.556 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -65.6 | -38.1 | 178.6 | -71.7 | -14.4 | 0 | 0 | 0 | 112.6 | L252 R253 R258 V259 E260 | L252-N256 PolarHBondContact O-N 3.42Å; R253-N256 PolarHBondContact O-N 3.44Å; N256-R258 PolarHBondContact O-N 3.21Å; N256-V259 PolarHBondContact O-N 3.12Å; N256-E260 PolarHBondContact O-N 2.89Å |
| 257 | N | 55.1 | Low | 52.1 | Low | 109 Ų | 109 | 124.9 Ų | 124.9 | 58% | 0.583 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -69.2 | -20.2 | 174.5 | -69.9 | 0 | 0 | 0 | 0 | 113.3 | R253 A255 S261 | R253-N257 PolarHBondContact O-N 3.48Å; A255-N257 PolarHBondContact O-N 3.21Å; N257-S261 PolarHBondContact O-OG 3.08Å |
| 258 | R | 49.2 | Very low | 51 | Low | 161 Ų | 161 | 125 Ų | 125 | 61% | 0.608 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -81.4 | -30.7 | 174.7 | -85.9 | -179.9 | 168.6 | 138 | -3.5 | 112.6 | Q254 A255 N256 E260 S261 | Q254-R258 WeakPolarHBondContact O-CG 3.36Å; Q254-R258 PolarHBondContact O-N 3.01Å; A255-R258 PolarHBondContact O-N 3.41Å; A255-R258 VanDerWaalsContact O-N 3.12Å; N256-R258 PolarHBondContact O-N 3.21Å; R258-E260 VanDerWaalsContact C-N 3.29Å; R258-E260 PolarHBondContact O-N 2.84Å; R258-S261 WeakPolarHBondContact CA-OG 3.48Å; R258-S261 PolarHBondContact O-N 3.45Å; R258-S261 PolarHBondContact O-OG 3.4Å |
| 259 | V | 49.3 | Very low | 49.8 | Very low | 108 Ų | 108 | 126.1 Ų | 126.1 | 66% | 0.655 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -67.2 | -31.6 | 174.8 | 179.5 | 0 | 0 | 0 | 0 | 111.3 | A255 N256 S261 | A255-V259 WeakPolarHBondContact O-CG2 3.4Å; A255-V259 PolarHBondContact O-N 3.06Å; N256-V259 PolarHBondContact O-N 3.12Å; V259-S261 VanDerWaalsContact C-N 3.29Å; V259-S261 PolarHBondContact O-N 2.84Å |
| 260 | E | 46 | Very low | 48.6 | Very low | 167 Ų | 167 | 127.5 Ų | 127.5 | 78% | 0.78 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.6 | -13.8 | 173.8 | -75.2 | -177 | 155.9 | 0 | 0 | 114.3 | N256 R258 | N256-E260 PolarHBondContact O-N 2.89Å; R258-E260 VanDerWaalsContact C-N 3.29Å; R258-E260 PolarHBondContact O-N 2.84Å |
| 261 | S | 48.3 | Very low | 47.3 | Very low | 87 Ų | 87 | 125.7 Ų | 125.7 | 61% | 0.608 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101 | -3.4 | -178.5 | 55.3 | 0 | 0 | 0 | 0 | 115.3 | N257 R258 V259 K263 | N257-S261 PolarHBondContact O-OG 3.08Å; R258-S261 WeakPolarHBondContact CA-OG 3.48Å; R258-S261 PolarHBondContact O-N 3.45Å; R258-S261 PolarHBondContact O-OG 3.4Å; V259-S261 VanDerWaalsContact C-N 3.29Å; V259-S261 PolarHBondContact O-N 2.84Å; S261-K263 PolarHBondContact O-N 3.03Å |
| 262 | M | 41.4 | Very low | 46.2 | Very low | 133 Ų | 133 | 129.2 Ų | 129.2 | 66% | 0.655 | 68% | 0.684 | S | S | * | * | trans | -92.2 | 78.3 | 173.4 | -73.5 | -178.6 | 52.3 | 0 | 0 | 110.6 | I264 | M262-I264 HydrophobicContact CE-CD1 4.05Å; M262-I264 HydrophobicContact CE-CG1 4.31Å; M262-I264 PolarHBondContact O-N 3.33Å | ||
| 263 | K | 37.4 | Very low | 45.1 | Very low | 201 Ų | 201 | 131.5 Ų | 131.5 | 87% | 0.874 | 69% | 0.694 | S | S | * | * | trans | -67.4 | 90.4 | 157.9 | -78.4 | 179.2 | 178.1 | -179.6 | 0 | 107.8 | S261 E265 | S261-K263 PolarHBondContact O-N 3.03Å; K263-E265 PolarHBondContact O-N 2.83Å | ||
| 264 | I | 36.3 | Very low | 44.1 | Very low | 125 Ų | 125 | 135 Ų | 135 | 64% | 0.641 | 71% | 0.707 | S | S | * | * | trans | -74.6 | 114.3 | 162.8 | -60.4 | 178 | 0 | 0 | 0 | 105.5 | M262 V266 | M262-I264 HydrophobicContact CE-CD1 4.05Å; M262-I264 HydrophobicContact CE-CG1 4.31Å; M262-I264 PolarHBondContact O-N 3.33Å; I264-V266 VanDerWaalsContact C-N 3.34Å; I264-V266 PolarHBondContact O-N 3.03Å | ||
| 265 | E | 34.3 | Very low | 42.9 | Very low | 187 Ų | 187 | 135.9 Ų | 135.9 | 87% | 0.874 | 72% | 0.716 | S | S | * | * | trans | -61.6 | 96.8 | 170 | -70.1 | -179.1 | 163.4 | 0 | 0 | 108.4 | K263 | K263-E265 PolarHBondContact O-N 2.83Š| ||
| 266 | V | 38.1 | Very low | 42.2 | Very low | 125 Ų | 125 | 140.9 Ų | 140.9 | 76% | 0.758 | 74% | 0.735 | S | S | * | * | trans | -79.5 | 116.8 | 164.6 | -178.1 | 0 | 0 | 0 | 0 | 105.4 | I264 A268 | I264-V266 VanDerWaalsContact C-N 3.34Å; I264-V266 PolarHBondContact O-N 3.03Å; V266-A268 PolarHBondContact O-N 2.92Å | ||
| 267 | N | 38.5 | Very low | 41.8 | Very low | 159 Ų | 159 | 144.7 Ų | 144.7 | 85% | 0.85 | 75% | 0.747 | S | S | * | * | trans | -44.1 | 117.1 | 173.4 | -76.5 | -34.9 | 0 | 0 | 0 | 109.3 | ||||
| 268 | A | 41.1 | Very low | 41.2 | Very low | 90 Ų | 90 | 144 Ų | 144 | 74% | 0.744 | 75% | 0.751 | S | S | * | * | trans | -57.3 | 138 | -179.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | V266 | V266-A268 PolarHBondContact O-N 2.92Š| ||
| 269 | P | 39.4 | Very low | 41.4 | Very low | 123 Ų | 123 | 142.4 Ų | 142.4 | 80% | 0.799 | 76% | 0.764 | S | S | * | * | trans | -66.7 | 143.6 | 172 | 29 | -30.9 | 0 | 0 | 0 | 109.4 | ||||
| 270 | D | 36.9 | Very low | 41.5 | Very low | 133 Ų | 133 | 144.4 Ų | 144.4 | 71% | 0.711 | 77% | 0.766 | S | S | * | * | trans | -44 | 131.5 | -178.5 | -116.3 | -34.8 | 0 | 0 | 0 | 112.9 | L272 | D270-L272 PolarHBondContact O-N 2.67Š| ||
| 271 | P | 40.4 | Very low | 42.1 | Very low | 121 Ų | 121 | 139.7 Ų | 139.7 | 79% | 0.786 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.8 | 21.4 | -173.8 | 29.4 | -33 | 0 | 0 | 0 | 114.8 | ||
| 272 | L | 45.1 | Very low | 42.9 | Very low | 158 Ų | 158 | 140.3 Ų | 140.3 | 83% | 0.827 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.4 | 2.4 | -179.6 | -65.7 | -179.7 | 0 | 0 | 0 | 114.6 | D270 | D270-L272 PolarHBondContact O-N 2.67Š|
| 273 | M | 41 | Very low | 44.3 | Very low | 147 Ų | 147 | 137.3 Ų | 137.3 | 72% | 0.724 | 74% | 0.742 | S | S | * | * | trans | -100.5 | 94.9 | 170.1 | -71.9 | -82.9 | -75.5 | 0 | 0 | 109.4 | D275 | M273-D275 PolarHBondContact O-N 3.11Å; M273-D275 VanDerWaalsContact O-N 3.14Å | ||
| 274 | R | 37.5 | Very low | 45.9 | Very low | 234 Ų | 234 | 130.6 Ų | 130.6 | 88% | 0.883 | 72% | 0.72 | S | S | * | * | trans | -73.3 | 100.5 | 169.2 | -65.3 | -175.4 | -171 | -124.9 | 1.5 | 108 | D276 | R274-D276 PolarHBondContact O-N 3.26Š| ||
| 275 | D | 38.8 | Very low | 47.7 | Very low | 134 Ų | 134 | 131.6 Ų | 131.6 | 72% | 0.717 | 72% | 0.716 | S | S | * | * | trans | -69 | 104.7 | 169.7 | -71.2 | -42.9 | 0 | 0 | 0 | 109.9 | M273 F277 | M273-D275 PolarHBondContact O-N 3.11Å; M273-D275 VanDerWaalsContact O-N 3.14Å; D275-F277 PolarHBondContact O-N 3Å; D275-F277 VanDerWaalsContact O-N 3.07Å | ||
| 276 | D | 41.6 | Very low | 49.8 | Very low | 152 Ų | 152 | 127.1 Ų | 127.1 | 81% | 0.813 | 70% | 0.701 | S | S | * | * | trans | -75.1 | 27.2 | 169.3 | -80.5 | -27 | 0 | 0 | 0 | 112.9 | R274 | R274-D276 PolarHBondContact O-N 3.26Š| ||
| 277 | F | 42.4 | Very low | 51.6 | Low | 184 Ų | 184 | 128.9 Ų | 128.9 | 81% | 0.807 | 70% | 0.699 | S | S | * | * | trans | -120.4 | 80 | 175.1 | -71.3 | -78.8 | 0 | 0 | 0 | 110.3 | D275 S279 | D275-F277 PolarHBondContact O-N 3Å; D275-F277 VanDerWaalsContact O-N 3.07Å; F277-S279 PolarHBondContact O-N 2.98Å; F277-S279 VanDerWaalsContact O-N 3.13Å | ||
| 278 | C | 41.7 | Very low | 53.4 | Low | 96 Ų | 96 | 123.9 Ų | 123.9 | 65% | 0.649 | 68% | 0.679 | S | S | * | * | trans | -63.2 | 114.1 | 165.2 | -162.4 | 0 | 0 | 0 | 0 | 108.2 | H280 | C278-H280 PolarHBondContact O-N 3.35Å; C278-H280 WeakPolarHBondContact SG-CB 3.47Å | ||
| 279 | S | 53 | Low | 55 | Low | 126 Ų | 126 | 124.1 Ų | 124.1 | 88% | 0.881 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | 8.2 | 174.6 | 56.8 | 0 | 0 | 0 | 0 | 114.1 | F277 | F277-S279 PolarHBondContact O-N 2.98Å; F277-S279 VanDerWaalsContact O-N 3.13Å |
| 280 | H | 52.9 | Low | 56.9 | Low | 151 Ų | 151 | 125.8 Ų | 125.8 | 70% | 0.699 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.5 | 5.1 | -173.4 | -154.6 | -75 | 0 | 0 | 0 | 114.1 | C278 | C278-H280 PolarHBondContact O-N 3.35Å; C278-H280 WeakPolarHBondContact SG-CB 3.47Å |
| 281 | D | 57.7 | Low | 58.7 | Low | 67 Ų | 67 | 122.4 Ų | 122.4 | 36% | 0.358 | 65% | 0.649 | S | S | . | * | S | Bend | trans | -119.2 | -14.4 | -162 | -162 | 32 | 0 | 0 | 0 | 116 | S284 R285 | D281-S284 PolarHBondContact O-N 3.46Å; D281-R285 VanDerWaalsContact CG-NE 3.34Å; D281-R285 WeakPolarHBondContact O-CB 3.34Å; D281-R285 WeakPolarHBondContact O-CG 3.34Å; D281-R285 PolarHBondContact O-N 3.2Å; D281-R285 IonicContact OD1-NE 3.18Å; D281-R285 IonicContact OD2-CZ 3.9Å; D281-R285 IonicContact OD2-NE 3.8Å; D281-R285 PolarHBondContact OD2-NE 3.01Å; D281-R285 IonicContact OD2-NH2 2.79Å; D281-R285 PolarHBondContact OD2-NH2 3.07Å |
| 282 | V | 65 | Low | 60.6 | Low | 101 Ų | 101 | 122.1 Ų | 122.1 | 61% | 0.612 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -66.9 | -44.4 | 178.9 | -173.9 | 0 | 0 | 0 | 0 | 111.2 | S284 R285 V286 | V282-S284 VanDerWaalsContact C-N 3.34Å; V282-S284 PolarHBondContact O-N 3.49Å; V282-R285 PolarHBondContact O-N 2.99Å; V282-V286 VanDerWaalsContact O-CG2 3.29Å; V282-V286 WeakPolarHBondContact O-CG2 3.18Å; V282-V286 PolarHBondContact O-N 3.36Å |
| 283 | A | 71.6 | Confident | 62.2 | Low | 69 Ų | 69 | 119.9 Ų | 119.9 | 57% | 0.57 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -68 | -34 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | K287 | A283-K287 WeakPolarHBondContact O-CB 3.31Å; A283-K287 WeakPolarHBondContact O-CG 3.42Å; A283-K287 PolarHBondContact O-N 3.2Å |
| 284 | S | 71.6 | Confident | 63.8 | Low | 60 Ų | 60 | 120.1 Ų | 120.1 | 42% | 0.42 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -67.7 | -44.8 | 174.8 | -65.3 | 0 | 0 | 0 | 0 | 111.3 | D281 V282 K287 A288 | D281-S284 PolarHBondContact O-N 3.46Å; V282-S284 VanDerWaalsContact C-N 3.34Å; V282-S284 PolarHBondContact O-N 3.49Å; S284-K287 PolarHBondContact O-N 3.22Å; S284-A288 WeakPolarHBondContact O-CB 3.47Å; S284-A288 PolarHBondContact O-N 2.77Å |
| 285 | R | 73.2 | Confident | 64.8 | Low | 146 Ų | 146 | 112.1 Ų | 112.1 | 55% | 0.551 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -61.9 | -44 | 174.7 | -76.9 | -176.2 | -115.3 | 168 | -4.1 | 112.4 | D281 V282 K287 A288 F289 | D281-R285 VanDerWaalsContact CG-NE 3.34Å; D281-R285 WeakPolarHBondContact O-CB 3.34Å; D281-R285 WeakPolarHBondContact O-CG 3.34Å; D281-R285 PolarHBondContact O-N 3.2Å; D281-R285 IonicContact OD1-NE 3.18Å; D281-R285 IonicContact OD2-CZ 3.9Å; D281-R285 IonicContact OD2-NE 3.8Å; D281-R285 PolarHBondContact OD2-NE 3.01Å; D281-R285 IonicContact OD2-NH2 2.79Å; D281-R285 PolarHBondContact OD2-NH2 3.07Å; V282-R285 PolarHBondContact O-N 2.99Å; R285-K287 VanDerWaalsContact C-N 3.34Å; R285-K287 PolarHBondContact O-N 3.14Å; R285-A288 PolarHBondContact O-N 2.9Å; R285-F289 WeakPolarHBondContact O-CB 3.38Å; R285-F289 PolarHBondContact O-N 2.9Å |
| 286 | V | 77.7 | Confident | 65.7 | Low | 94 Ų | 94 | 113.1 Ų | 113.1 | 57% | 0.57 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -64 | -38.4 | 176.7 | 173.1 | 0 | 0 | 0 | 0 | 111.5 | V282 K290 | V282-V286 VanDerWaalsContact O-CG2 3.29Å; V282-V286 WeakPolarHBondContact O-CG2 3.18Å; V282-V286 PolarHBondContact O-N 3.36Å; V286-K290 WeakPolarHBondContact O-CB 3.38Å; V286-K290 PolarHBondContact O-N 3.07Å |
| 287 | K | 76.2 | Confident | 66.2 | Low | 162 Ų | 162 | 113.5 Ų | 113.5 | 70% | 0.704 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -67.1 | -43 | 174.6 | -83.8 | 179.8 | 178.9 | 176.2 | 0 | 112.5 | A283 S284 R285 F289 K290 A291 | A283-K287 WeakPolarHBondContact O-CB 3.31Å; A283-K287 WeakPolarHBondContact O-CG 3.42Å; A283-K287 PolarHBondContact O-N 3.2Å; S284-K287 PolarHBondContact O-N 3.22Å; R285-K287 VanDerWaalsContact C-N 3.34Å; R285-K287 PolarHBondContact O-N 3.14Å; K287-F289 VanDerWaalsContact C-N 3.34Å; K287-K290 PolarHBondContact O-N 3.1Å; K287-A291 WeakPolarHBondContact O-CB 3.45Å; K287-A291 PolarHBondContact O-N 3.2Å |
| 288 | A | 76.1 | Confident | 66.6 | Low | 53 Ų | 53 | 111.9 Ų | 111.9 | 44% | 0.438 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -62.4 | -43.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111 | S284 R285 K290 A291 L292 | S284-A288 WeakPolarHBondContact O-CB 3.47Å; S284-A288 PolarHBondContact O-N 2.77Å; R285-A288 PolarHBondContact O-N 2.9Å; A288-K290 PolarHBondContact O-N 2.81Å; A288-A291 WeakPolarHBondContact O-CB 3.5Å; A288-A291 PolarHBondContact O-N 3.08Å; A288-L292 WeakPolarHBondContact O-CG 3.05Å; A288-L292 PolarHBondContact O-N 3.47Å |
| 289 | F | 75 | Confident | 66.8 | Low | 95 Ų | 95 | 116.1 Ų | 116.1 | 42% | 0.417 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -64.5 | -41.5 | 177.3 | -155.4 | -91.6 | 0 | 0 | 0 | 112.1 | Y54 R285 K287 A291 L292 M293 | Y54-F289 HydrophobicContact CE2-CZ 4.3Å; Y54-F289 WeakPolarHBondContact OH-CZ 3.31Å; R285-F289 WeakPolarHBondContact O-CB 3.38Å; R285-F289 PolarHBondContact O-N 2.9Å; K287-F289 VanDerWaalsContact C-N 3.34Å; F289-A291 VanDerWaalsContact C-N 3.29Å; F289-A291 PolarHBondContact O-N 2.86Å; F289-L292 PolarHBondContact O-N 2.77Å; F289-M293 HydrophobicContact CD1-CG 4.09Å; F289-M293 HydrophobicContact CE1-CG 3.98Å; F289-M293 HydrophobicContact CE1-SD 4.26Å; F289-M293 WeakPolarHBondContact O-CG 3.22Å; F289-M293 PolarHBondContact O-N 3.35Å |
| 290 | K | 79 | Confident | 66.2 | Low | 159 Ų | 159 | 114.5 Ų | 114.5 | 69% | 0.691 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -66.1 | -29.7 | 174.6 | -168.6 | 169.3 | -174.1 | 169.4 | 0 | 112.9 | V286 K287 A288 K294 | V286-K290 WeakPolarHBondContact O-CB 3.38Å; V286-K290 PolarHBondContact O-N 3.07Å; K287-K290 PolarHBondContact O-N 3.1Å; A288-K290 PolarHBondContact O-N 2.81Å; K290-K294 WeakPolarHBondContact O-CB 3.3Å; K290-K294 PolarHBondContact O-N 3.28Å |
| 291 | A | 76.5 | Confident | 65.7 | Low | 61 Ų | 61 | 114.8 Ų | 114.8 | 50% | 0.504 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -72.1 | -41.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | K287 A288 F289 K294 S295 | K287-A291 WeakPolarHBondContact O-CB 3.45Å; K287-A291 PolarHBondContact O-N 3.2Å; A288-A291 WeakPolarHBondContact O-CB 3.5Å; A288-A291 PolarHBondContact O-N 3.08Å; F289-A291 VanDerWaalsContact C-N 3.29Å; F289-A291 PolarHBondContact O-N 2.86Å; A291-K294 PolarHBondContact O-N 3.39Å; A291-S295 PolarHBondContact O-N 2.85Å; A291-S295 PolarHBondContact O-OG 2.93Å |
| 292 | L | 78.4 | Confident | 64.7 | Low | 115 Ų | 115 | 118.9 Ų | 118.9 | 60% | 0.602 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -66.6 | -41.2 | 178.6 | -68.9 | 172.1 | 0 | 0 | 0 | 112.7 | A288 F289 K294 S295 | A288-L292 WeakPolarHBondContact O-CG 3.05Å; A288-L292 PolarHBondContact O-N 3.47Å; F289-L292 PolarHBondContact O-N 2.77Å; L292-K294 PolarHBondContact O-N 3.35Å; L292-S295 PolarHBondContact O-N 3.13Å; L292-S295 PolarHBondContact O-OG 2.98Å |
| 293 | M | 79 | Confident | 63.8 | Low | 112 Ų | 112 | 123.2 Ų | 123.2 | 55% | 0.552 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -67.6 | -21.4 | 174.9 | -65 | -62.8 | -64.9 | 0 | 0 | 113 | F289 | F289-M293 HydrophobicContact CD1-CG 4.09Å; F289-M293 HydrophobicContact CE1-CG 3.98Å; F289-M293 HydrophobicContact CE1-SD 4.26Å; F289-M293 WeakPolarHBondContact O-CG 3.22Å; F289-M293 PolarHBondContact O-N 3.35Å |
| 294 | K | 74.5 | Confident | 62.2 | Low | 152 Ų | 152 | 128 Ų | 128 | 66% | 0.661 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -89.7 | -17.4 | 179.8 | -158.3 | 171.5 | -174.2 | -177.6 | 0 | 112.9 | K290 A291 L292 | K290-K294 WeakPolarHBondContact O-CB 3.3Å; K290-K294 PolarHBondContact O-N 3.28Å; A291-K294 PolarHBondContact O-N 3.39Å; L292-K294 PolarHBondContact O-N 3.35Å |
| 295 | S | 60 | Low | 60.7 | Low | 66 Ų | 66 | 130.2 Ų | 130.2 | 46% | 0.462 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -80.3 | -22.1 | 175.1 | 41.8 | 0 | 0 | 0 | 0 | 113.9 | A291 L292 E297 | A291-S295 PolarHBondContact O-N 2.85Å; A291-S295 PolarHBondContact O-OG 2.93Å; L292-S295 PolarHBondContact O-N 3.13Å; L292-S295 PolarHBondContact O-OG 2.98Å; S295-E297 VanDerWaalsContact C-N 3.32Å; S295-E297 PolarHBondContact O-N 3.03Å |
| 296 | E | 56.9 | Low | 59.2 | Low | 155 Ų | 155 | 132 Ų | 132 | 72% | 0.724 | 69% | 0.685 | S | S | * | * | G | 310 helix | trans | -76.7 | -11 | 178.8 | -84 | -178.7 | 156.2 | 0 | 0 | 114.5 | ||
| 297 | E | 52.8 | Low | 57.4 | Low | 159 Ų | 159 | 133.7 Ų | 133.7 | 74% | 0.743 | 70% | 0.696 | S | S | * | * | G | 310 helix | trans | -85.1 | 0 | 177.8 | -79.7 | -176.7 | 155.3 | 0 | 0 | 114.6 | S295 | S295-E297 VanDerWaalsContact C-N 3.32Å; S295-E297 PolarHBondContact O-N 3.03Å |
| 298 | L | 49.5 | Very low | 56 | Low | 151 Ų | 151 | 136.1 Ų | 136.1 | 79% | 0.791 | 71% | 0.707 | S | S | * | * | G | 310 helix | trans | -121.9 | 13.1 | -173.4 | -75.6 | 170.7 | 0 | 0 | 0 | 116 | ||
| 299 | E | 47.1 | Very low | 54.6 | Low | 184 Ų | 184 | 138 Ų | 138 | 86% | 0.86 | 72% | 0.717 | S | S | * | * | trans | -100.8 | 16.3 | 177.5 | -71.1 | -168.1 | 166.1 | 0 | 0 | 115.4 | ||||
| 300 | S | 39.3 | Very low | 53.2 | Low | 92 Ų | 92 | 141.5 Ų | 141.5 | 64% | 0.643 | 74% | 0.738 | S | S | * | * | trans | -103.9 | 124.2 | 162.4 | 66.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 301 | I | 42.3 | Very low | 51.5 | Low | 157 Ų | 157 | 142.6 Ų | 142.6 | 81% | 0.805 | 74% | 0.743 | S | S | * | * | trans | 120 | 90.4 | 177.4 | -61.6 | 152.5 | 0 | 0 | 0 | 109.3 | ||||
| 302 | D | 37.3 | Very low | 50 | Low | 153 Ų | 153 | 148.7 Ų | 148.7 | 82% | 0.818 | 76% | 0.758 | S | S | * | * | trans | 175.2 | 70.3 | 140.5 | -86.4 | -15.8 | 0 | 0 | 0 | 110.1 | ||||
| 303 | Q | 46 | Very low | 48.2 | Very low | 193 Ų | 193 | 149.7 Ų | 149.7 | 90% | 0.902 | 77% | 0.768 | S | S | * | * | trans | -139.3 | 71.8 | 159.9 | -71 | -170.7 | 0.1 | 0 | 0 | 108.4 | ||||
| 304 | N | 38.5 | Very low | 46.5 | Very low | 170 Ų | 170 | 150.3 Ų | 150.3 | 91% | 0.909 | 78% | 0.779 | S | S | * | * | trans | -139.8 | 73 | 174.2 | -93.4 | -19.3 | 0 | 0 | 0 | 109.8 | ||||
| 305 | S | 39.9 | Very low | 44.9 | Very low | 106 Ų | 106 | 150.2 Ų | 150.2 | 74% | 0.741 | 79% | 0.786 | S | S | * | * | trans | -165.3 | 132.7 | 155.9 | 54 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 306 | E | 41.6 | Very low | 44.1 | Very low | 182 Ų | 182 | 153.6 Ų | 153.6 | 85% | 0.85 | 79% | 0.794 | S | S | * | * | S | Bend | trans | 82.9 | 83.8 | -176.7 | -49.8 | 174.8 | -179.2 | 0 | 0 | 111.9 | ||
| 307 | T | 39.6 | Very low | 43.7 | Very low | 131 Ų | 131 | 156.4 Ų | 156.4 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | -165 | 104.2 | 80.4 | 31.3 | 0 | 0 | 0 | 0 | 109.9 | S309 | T307-S309 PolarHBondContact O-N 2.79Š| |||
| 308 | K | 46.1 | Very low | 43.4 | Very low | 213 Ų | 213 | 158.2 Ų | 158.2 | 93% | 0.926 | 80% | 0.803 | S | S | * | * | trans | -76.3 | 93.4 | 165.6 | -83.5 | 174.9 | 175.1 | 169.3 | 0 | 109.2 | ||||
| 309 | S | 47.5 | Very low | 43.4 | Very low | 93 Ų | 93 | 159.2 Ų | 159.2 | 65% | 0.65 | 81% | 0.808 | S | S | * | * | trans | 161.2 | 102.5 | 154.8 | 46.7 | 0 | 0 | 0 | 0 | 105.6 | T307 | T307-S309 PolarHBondContact O-N 2.79Š| ||
| 310 | I | 45.4 | Very low | 43.4 | Very low | 168 Ų | 168 | 155 Ų | 155 | 86% | 0.862 | 80% | 0.796 | S | S | * | * | -156.2 | 116.5 | 95.2 | -80.2 | 139.1 | 0 | 0 | 0 | 106.5 | |||||
| 311 | K | 44.2 | Very low | 43.3 | Very low | 182 Ų | 182 | 158.9 Ų | 158.9 | 79% | 0.791 | 81% | 0.81 | S | S | * | * | trans | -84.3 | 153.8 | 174.1 | -65.6 | 173.8 | 172.1 | 171.4 | 0 | 109.2 | ||||
| 312 | K | 44 | Very low | 43.6 | Very low | 189 Ų | 189 | 157.4 Ų | 157.4 | 82% | 0.822 | 81% | 0.808 | S | S | * | * | trans | 78.2 | 127.1 | 163.5 | -49.8 | 172.2 | 177.3 | -179.2 | 0 | 111.3 | ||||
| 313 | V | 41.7 | Very low | 43.8 | Very low | 135 Ų | 135 | 155.5 Ų | 155.5 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | cis | -154.4 | 135.9 | 38.3 | 168.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 314 | T | 42.7 | Very low | 43.3 | Very low | 125 Ų | 125 | 155.6 Ų | 155.6 | 77% | 0.767 | 80% | 0.797 | S | S | * | * | trans | -65.5 | 128.7 | 164 | 42.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 315 | D | 40.3 | Very low | 43.6 | Very low | 151 Ų | 151 | 155.7 Ų | 155.7 | 81% | 0.807 | 79% | 0.792 | S | S | * | * | trans | -171.7 | 109.9 | 132.8 | -114.2 | -23.3 | 0 | 0 | 0 | 111.8 | ||||
| 316 | E | 44.2 | Very low | 43.9 | Very low | 136 Ų | 136 | 156 Ų | 156 | 64% | 0.636 | 78% | 0.782 | S | S | * | * | trans | 31.6 | 120.3 | 130.2 | -68.4 | -92 | 128 | 0 | 0 | 120.1 | ||||
| 317 | R | 48.6 | Very low | 44 | Very low | 214 Ų | 214 | 154.1 Ų | 154.1 | 81% | 0.808 | 78% | 0.778 | S | S | * | * | trans | 86.7 | 94.8 | 146.3 | -56 | 165.5 | -148.3 | 168.1 | 10.6 | 118.9 | ||||
| 318 | K | 45.9 | Very low | 44.4 | Very low | 197 Ų | 197 | 154.8 Ų | 154.8 | 86% | 0.857 | 77% | 0.771 | S | S | * | * | 163.5 | 100.2 | 117.5 | -93.5 | 174.9 | 178.1 | -178.6 | 0 | 108 | P320 | K318-P320 WeakPolarHBondContact O-CD 3.35Š| |||
| 319 | I | 48.6 | Very low | 44.5 | Very low | 172 Ų | 172 | 152 Ų | 152 | 88% | 0.882 | 77% | 0.765 | S | S | * | * | trans | -81.3 | 117 | 167.3 | -59.7 | 172.2 | 0 | 0 | 0 | 106.4 | ||||
| 320 | P | 47.7 | Very low | 44.1 | Very low | 95 Ų | 95 | 150.6 Ų | 150.6 | 62% | 0.617 | 77% | 0.765 | S | S | * | * | trans | -78.3 | 149.4 | 169.4 | 2 | 17.3 | 0 | 0 | 0 | 109.6 | K318 V322 | K318-P320 WeakPolarHBondContact O-CD 3.35Å; P320-V322 PolarHBondContact O-N 2.84Å | ||
| 321 | D | 38 | Very low | 44.2 | Very low | 175 Ų | 175 | 150.6 Ų | 150.6 | 94% | 0.936 | 77% | 0.766 | S | S | * | * | trans | -55.1 | 114.1 | 173.3 | -63.6 | -52.4 | 0 | 0 | 0 | 111.1 | ||||
| 322 | V | 47 | Very low | 44.1 | Very low | 125 Ų | 125 | 153 Ų | 153 | 76% | 0.758 | 77% | 0.77 | S | S | * | * | trans | -119.3 | 131.1 | 172.3 | -176.9 | 0 | 0 | 0 | 0 | 108.9 | P320 | P320-V322 PolarHBondContact O-N 2.84Š| ||
| 323 | P | 41.5 | Very low | 44.1 | Very low | 114 Ų | 114 | 155.5 Ų | 155.5 | 74% | 0.74 | 77% | 0.774 | S | S | * | * | trans | -74.1 | 148.5 | -165.2 | -8.3 | 25.5 | 0 | 0 | 0 | 112.5 | Q325 | P323-Q325 PolarHBondContact O-N 2.84Š| ||
| 324 | Y | 36.4 | Very low | 44.3 | Very low | 195 Ų | 195 | 154.4 Ų | 154.4 | 77% | 0.765 | 77% | 0.773 | S | S | * | * | trans | -46 | 105.1 | 171 | -178.5 | -100.8 | 0 | 0 | 0 | 111.8 | E326 | Y324-E326 HydrophobicContact CD1-CB 4.23Å; Y324-E326 HydrophobicContact CE1-CB 3.81Å; Y324-E326 HydrophobicContact CE1-CG 3.73Å; Y324-E326 PolarHBondContact O-N 2.98Å | ||
| 325 | Q | 45.5 | Very low | 45 | Very low | 171 Ų | 171 | 157.9 Ų | 157.9 | 80% | 0.799 | 78% | 0.777 | S | S | * | * | trans | -85.7 | 106.3 | 165 | -81.8 | -176.5 | -29.1 | 0 | 0 | 108.4 | P323 N327 | P323-Q325 PolarHBondContact O-N 2.84Å; Q325-N327 PolarHBondContact O-N 3.45Å; Q325-N327 VanDerWaalsContact O-N 3.11Å | ||
| 326 | E | 44.7 | Very low | 45.3 | Very low | 114 Ų | 114 | 157 Ų | 157 | 53% | 0.533 | 78% | 0.778 | S | S | . | * | trans | -67.7 | 102.3 | 172.6 | -152.6 | 167.4 | -140 | 0 | 0 | 108.2 | Y324 H328 | Y324-E326 HydrophobicContact CD1-CB 4.23Å; Y324-E326 HydrophobicContact CE1-CB 3.81Å; Y324-E326 HydrophobicContact CE1-CG 3.73Å; Y324-E326 PolarHBondContact O-N 2.98Å; E326-H328 VanDerWaalsContact CD-NE2 3.28Å; E326-H328 WeakPolarHBondContact CG-NE2 3.5Å; E326-H328 PolarHBondContact O-CD2 3.06Å; E326-H328 PolarHBondContact O-N 3.44Å; E326-H328 IonicContact OE2-CD2 2.81Å; E326-H328 IonicContact OE2-CE1 2.74Å; E326-H328 PolarHBondContact OE2-CE1 3.42Å; E326-H328 IonicContact OE2-NE2 3.18Å; E326-H328 PolarHBondContact OE2-NE2 2.77Å | ||
| 327 | N | 44.5 | Very low | 45.5 | Very low | 142 Ų | 142 | 155.1 Ų | 155.1 | 76% | 0.759 | 77% | 0.767 | S | S | * | * | trans | -68.4 | 80.6 | 171.8 | -72.1 | -30.8 | 0 | 0 | 0 | 109.1 | Q325 I329 | Q325-N327 PolarHBondContact O-N 3.45Å; Q325-N327 VanDerWaalsContact O-N 3.11Å; N327-I329 PolarHBondContact O-N 3.3Å | ||
| 328 | H | 48.8 | Very low | 45.6 | Very low | 144 Ų | 144 | 147 Ų | 147 | 67% | 0.667 | 74% | 0.744 | S | S | * | * | trans | -67.5 | 85.2 | 162.9 | -70.8 | -72.7 | 0 | 0 | 0 | 107.8 | E326 G330 | E326-H328 VanDerWaalsContact CD-NE2 3.28Å; E326-H328 WeakPolarHBondContact CG-NE2 3.5Å; E326-H328 PolarHBondContact O-CD2 3.06Å; E326-H328 PolarHBondContact O-N 3.44Å; E326-H328 IonicContact OE2-CD2 2.81Å; E326-H328 IonicContact OE2-CE1 2.74Å; E326-H328 PolarHBondContact OE2-CE1 3.42Å; E326-H328 IonicContact OE2-NE2 3.18Å; E326-H328 PolarHBondContact OE2-NE2 2.77Å; H328-G330 VanDerWaalsContact C-N 3.32Å; H328-G330 PolarHBondContact O-N 3.42Å | ||
| 329 | I | 47.8 | Very low | 46.3 | Very low | 156 Ų | 156 | 140.4 Ų | 140.4 | 80% | 0.8 | 73% | 0.732 | S | S | * | * | trans | -57 | 105.7 | 161.8 | -63.9 | 167.8 | 0 | 0 | 0 | 105.2 | N327 L331 | N327-I329 PolarHBondContact O-N 3.3Å; I329-L331 VanDerWaalsContact C-N 3.35Å; I329-L331 PolarHBondContact O-N 3.46Å | ||
| 330 | G | 38.1 | Very low | 46.9 | Very low | 63 Ų | 63 | 139.5 Ų | 139.5 | 65% | 0.649 | 72% | 0.724 | S | S | * | * | trans | -62.1 | 90.4 | -169.2 | 0 | 0 | 0 | 0 | 0 | 112 | H328 R332 | H328-G330 VanDerWaalsContact C-N 3.32Å; H328-G330 PolarHBondContact O-N 3.42Å; G330-R332 PolarHBondContact O-N 2.74Å | ||
| 331 | L | 48.5 | Very low | 47.5 | Very low | 167 Ų | 167 | 139.7 Ų | 139.7 | 87% | 0.874 | 72% | 0.716 | S | S | * | * | trans | -63.3 | 88.6 | 150.8 | -119 | 77.5 | 0 | 0 | 0 | 105.9 | I329 R333 | I329-L331 VanDerWaalsContact C-N 3.35Å; I329-L331 PolarHBondContact O-N 3.46Å; L331-R333 VanDerWaalsContact C-N 3.29Å; L331-R333 PolarHBondContact O-N 2.81Å | ||
| 332 | R | 41.4 | Very low | 48.3 | Very low | 233 Ų | 233 | 137.6 Ų | 137.6 | 88% | 0.879 | 70% | 0.702 | S | S | * | * | trans | -55.1 | 101.4 | 166 | -84.6 | -163 | 177.8 | -136.8 | 2.6 | 106.6 | G330 S334 | G330-R332 PolarHBondContact O-N 2.74Å; R332-S334 VanDerWaalsContact C-N 3.3Å; R332-S334 PolarHBondContact O-N 3.3Å | ||
| 333 | R | 44.1 | Very low | 49.1 | Very low | 241 Ų | 241 | 134.3 Ų | 134.3 | 91% | 0.909 | 69% | 0.685 | S | S | * | * | trans | -47.9 | 100.1 | 162.3 | -86.1 | 175.2 | 157.5 | 149.3 | -5.4 | 106.7 | L331 K335 | L331-R333 VanDerWaalsContact C-N 3.29Å; L331-R333 PolarHBondContact O-N 2.81Å; R333-K335 PolarHBondContact O-N 3.47Å; R333-K335 VanDerWaalsContact O-N 3.11Å | ||
| 334 | S | 47.1 | Very low | 50 | Low | 113 Ų | 113 | 137.9 Ų | 137.9 | 79% | 0.79 | 68% | 0.684 | S | S | * | * | trans | -58.8 | 120.1 | 173.6 | -70.7 | 0 | 0 | 0 | 0 | 106.6 | R332 T336 | R332-S334 VanDerWaalsContact C-N 3.3Å; R332-S334 PolarHBondContact O-N 3.3Å; S334-T336 PolarHBondContact O-N 2.93Å | ||
| 335 | K | 56.4 | Low | 51.2 | Low | 198 Ų | 198 | 136 Ų | 136 | 86% | 0.861 | 68% | 0.675 | S | S | * | * | trans | -46.4 | 113.6 | -179.6 | -67.7 | 172.6 | 177.1 | 179.2 | 0 | 109.3 | R333 F337 | R333-K335 PolarHBondContact O-N 3.47Å; R333-K335 VanDerWaalsContact O-N 3.11Å; K335-F337 PolarHBondContact O-N 3.32Å | ||
| 336 | T | 46.6 | Very low | 51.8 | Low | 132 Ų | 132 | 134.3 Ų | 134.3 | 81% | 0.81 | 66% | 0.663 | S | S | * | * | trans | 21.1 | 92.4 | 157.9 | 56.8 | 0 | 0 | 0 | 0 | 115.6 | S334 S338 | S334-T336 PolarHBondContact O-N 2.93Å; T336-S338 PolarHBondContact O-N 3.42Å | ||
| 337 | F | 48.6 | Very low | 52.5 | Low | 96 Ų | 96 | 134 Ų | 134 | 42% | 0.421 | 66% | 0.661 | S | S | . | * | trans | -59.9 | 108 | 150.8 | -169.2 | -102 | 0 | 0 | 0 | 105.8 | K335 G339 Q341 | K335-F337 PolarHBondContact O-N 3.32Å; F337-G339 PolarHBondContact O-N 2.86Å; F337-Q341 HydrophobicContact CD1-CB 4.49Å; F337-Q341 HydrophobicContact CE1-CB 3.76Å; F337-Q341 HydrophobicContact CZ-CB 4Å | ||
| 338 | S | 51 | Low | 53.1 | Low | 44 Ų | 44 | 135 Ų | 135 | 31% | 0.308 | 66% | 0.661 | S | S | . | * | trans | -43.3 | 121.5 | -173.4 | 52.2 | 0 | 0 | 0 | 0 | 110.9 | T336 E340 Q341 | T336-S338 PolarHBondContact O-N 3.42Å; S338-E340 PolarHBondContact O-N 3.25Å; S338-Q341 PolarHBondContact O-N 3.31Å; S338-Q341 WeakPolarHBondContact OG-CG 3.3Å | ||
| 339 | G | 59.6 | Low | 53.7 | Low | 59 Ų | 59 | 135.9 Ų | 135.9 | 61% | 0.608 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -54.6 | -20.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | F337 M342 S343 | F337-G339 PolarHBondContact O-N 2.86Å; G339-M342 PolarHBondContact O-N 3.47Å; G339-S343 PolarHBondContact O-N 2.98Å; G339-S343 VanDerWaalsContact O-N 3.08Å |
| 340 | E | 61 | Low | 54.8 | Low | 152 Ų | 152 | 129.5 Ų | 129.5 | 71% | 0.71 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -65 | -38.8 | 174.4 | -66.8 | 177.1 | 161.8 | 0 | 0 | 113.6 | S338 M342 S343 R344 | S338-E340 PolarHBondContact O-N 3.25Å; E340-M342 VanDerWaalsContact C-N 3.32Å; E340-M342 PolarHBondContact O-N 2.73Å; E340-S343 PolarHBondContact O-N 3.47Å; E340-R344 PolarHBondContact O-N 2.89Å; E340-R344 VanDerWaalsContact O-N 3.1Å |
| 341 | Q | 60.5 | Low | 57.1 | Low | 100 Ų | 100 | 129 Ų | 129 | 47% | 0.467 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -72 | -30 | 179.6 | -70.7 | -176.7 | 12 | 0 | 0 | 111.9 | F337 S338 R345 | F337-Q341 HydrophobicContact CD1-CB 4.49Å; F337-Q341 HydrophobicContact CE1-CB 3.76Å; F337-Q341 HydrophobicContact CZ-CB 4Å; S338-Q341 PolarHBondContact O-N 3.31Å; S338-Q341 WeakPolarHBondContact OG-CG 3.3Å; Q341-R345 PolarHBondContact O-N 3.36Å |
| 342 | M | 55.7 | Low | 59.1 | Low | 130 Ų | 130 | 126.4 Ų | 126.4 | 64% | 0.64 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -73.6 | -39.5 | 174.9 | -156.2 | 167.1 | -171 | 0 | 0 | 111 | G339 E340 R345 Y346 | G339-M342 PolarHBondContact O-N 3.47Å; E340-M342 VanDerWaalsContact C-N 3.32Å; E340-M342 PolarHBondContact O-N 2.73Å; M342-R345 PolarHBondContact O-N 3.47Å; M342-Y346 WeakPolarHBondContact O-CB 3.46Å; M342-Y346 PolarHBondContact O-N 2.93Å |
| 343 | S | 62.4 | Low | 61.6 | Low | 56 Ų | 56 | 115.5 Ų | 115.5 | 39% | 0.392 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62 | -45.8 | 176.2 | -171.7 | 0 | 0 | 0 | 0 | 112.4 | G339 E340 R345 Y346 Q347 | G339-S343 PolarHBondContact O-N 2.98Å; G339-S343 VanDerWaalsContact O-N 3.08Å; E340-S343 PolarHBondContact O-N 3.47Å; S343-R345 PolarHBondContact O-N 2.82Å; S343-Y346 PolarHBondContact O-N 3.3Å; S343-Q347 WeakPolarHBondContact O-CB 3.46Å; S343-Q347 VanDerWaalsContact O-CD 3.3Å; S343-Q347 WeakPolarHBondContact O-CG 3.46Å; S343-Q347 PolarHBondContact O-N 2.88Å; S343-Q347 PolarHBondContact O-OE1 2.98Å; S343-Q347 PolarHBondContact OG-NE2 2.74Å |
| 344 | R | 62.2 | Low | 63.9 | Low | 189 Ų | 189 | 109.4 Ų | 109.4 | 71% | 0.713 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -64.1 | -40.1 | 178.5 | -70.7 | -171.3 | -176.8 | -156.3 | 2.7 | 113 | E340 Q347 Q348 | E340-R344 PolarHBondContact O-N 2.89Å; E340-R344 VanDerWaalsContact O-N 3.1Å; R344-Q347 PolarHBondContact O-N 3.08Å; R344-Q348 PolarHBondContact O-N 2.89Å |
| 345 | R | 59.8 | Low | 66 | Low | 155 Ų | 155 | 108.1 Ų | 108.1 | 59% | 0.585 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -68.9 | -35.8 | 177.5 | -78.3 | -174.8 | 176.3 | 154.3 | 2.2 | 112.7 | Q341 M342 S343 | Q341-R345 PolarHBondContact O-N 3.36Å; M342-R345 PolarHBondContact O-N 3.47Å; S343-R345 PolarHBondContact O-N 2.82Å |
| 346 | Y | 59.2 | Low | 67.8 | Low | 137 Ų | 137 | 101.1 Ų | 101.1 | 54% | 0.537 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -73.5 | -35.7 | 177 | -150.1 | -97.1 | 0 | 0 | 0 | 111.5 | M342 S343 Q348 Y349 M350 | M342-Y346 WeakPolarHBondContact O-CB 3.46Å; M342-Y346 PolarHBondContact O-N 2.93Å; S343-Y346 PolarHBondContact O-N 3.3Å; Y346-Q348 VanDerWaalsContact C-N 3.29Å; Y346-Q348 PolarHBondContact O-N 3.38Å; Y346-Y349 PolarHBondContact O-N 2.79Å; Y346-M350 HydrophobicContact CD1-CE 3.91Å; Y346-M350 HydrophobicContact CD1-CG 4.37Å; Y346-M350 HydrophobicContact CD1-SD 4.12Å; Y346-M350 HydrophobicContact CE1-CE 3.55Å; Y346-M350 HydrophobicContact CE1-SD 3.79Å; Y346-M350 VanDerWaalsContact O-CG 3.29Å; Y346-M350 WeakPolarHBondContact O-CG 3.34Å |
| 347 | Q | 59.5 | Low | 69.9 | Low | 107 Ų | 107 | 97.1 Ų | 97.1 | 50% | 0.5 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.6 | -30.7 | 177.8 | -76.4 | 162.1 | -11.8 | 0 | 0 | 113.5 | S343 R344 Y349 | S343-Q347 WeakPolarHBondContact O-CB 3.46Å; S343-Q347 VanDerWaalsContact O-CD 3.3Å; S343-Q347 WeakPolarHBondContact O-CG 3.46Å; S343-Q347 PolarHBondContact O-N 2.88Å; S343-Q347 PolarHBondContact O-OE1 2.98Å; S343-Q347 PolarHBondContact OG-NE2 2.74Å; R344-Q347 PolarHBondContact O-N 3.08Å; Q347-Y349 PolarHBondContact O-N 3.26Å |
| 348 | Q | 57.4 | Low | 72 | Confident | 163 Ų | 163 | 99.4 Ų | 99.4 | 76% | 0.762 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.8 | -16.2 | 178.8 | -81.7 | -179.8 | -40.6 | 0 | 0 | 114.3 | R344 Y346 | R344-Q348 PolarHBondContact O-N 2.89Å; Y346-Q348 VanDerWaalsContact C-N 3.29Å; Y346-Q348 PolarHBondContact O-N 3.38Å |
| 349 | Y | 61.2 | Low | 73.9 | Confident | 162 Ų | 162 | 104.8 Ų | 104.8 | 64% | 0.635 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -113 | 12.5 | -175.7 | -128.5 | -92.4 | 0 | 0 | 0 | 114.3 | Y346 Q347 D351 | Y346-Y349 PolarHBondContact O-N 2.79Å; Q347-Y349 PolarHBondContact O-N 3.26Å; Y349-D351 PolarHBondContact O-N 2.87Å |
| 350 | M | 70.6 | Confident | 75.5 | Confident | 22 Ų | 22 | 102.1 Ų | 102.1 | 11% | 0.108 | 48% | 0.475 | C | S | . | . | trans | -101.6 | 78.7 | -176.1 | -62 | -67.6 | 110.4 | 0 | 0 | 110.5 | Y346 P362 | Y346-M350 HydrophobicContact CD1-CE 3.91Å; Y346-M350 HydrophobicContact CD1-CG 4.37Å; Y346-M350 HydrophobicContact CD1-SD 4.12Å; Y346-M350 HydrophobicContact CE1-CE 3.55Å; Y346-M350 HydrophobicContact CE1-SD 3.79Å; Y346-M350 VanDerWaalsContact O-CG 3.29Å; Y346-M350 WeakPolarHBondContact O-CG 3.34Å; M350-P362 HydrophobicContact CE-CG 4.28Å | ||
| 351 | D | 85.7 | Confident | 76.8 | Confident | 54 Ų | 54 | 101.7 Ų | 101.7 | 29% | 0.289 | 47% | 0.468 | S | S | . | . | P | Polyproline II helix | trans | -59.1 | 146.5 | 169.4 | -67.9 | -32.6 | 0 | 0 | 0 | 110.3 | Y349 I360 R365 V372 | Y349-D351 PolarHBondContact O-N 2.87Å; D351-I360 WeakPolarHBondContact O-CB 3.42Å; D351-I360 PolarHBondContact O-N 3.31Å; D351-R365 IonicContact OD2-CZ 3.53Å; D351-R365 IonicContact OD2-NE 3.96Å; D351-R365 PolarHBondContact OD2-NE 2.84Å; D351-R365 IonicContact OD2-NH2 3.2Å; D351-R365 PolarHBondContact OD2-NH2 2.7Å; D351-V372 HydrophobicContact CB-CB 4Å; D351-V372 HydrophobicContact CB-CG1 3.95Å; D351-V372 HydrophobicContact CB-CG2 3.93Å |
| 352 | L | 91.6 | Very high | 78.1 | Confident | 112 Ų | 112 | 100.3 Ų | 100.3 | 59% | 0.586 | 47% | 0.468 | S | S | * | . | B | Isolated β-bridge | trans | -93.2 | 138.4 | 174 | -67.3 | 118.8 | 0 | 0 | 0 | 109.8 | F354 G357 | L352-F354 PolarHBondContact O-N 3.29Å; L352-G357 WeakPolarHBondContact CD2-O 3.38Å |
| 353 | C | 94.1 | Very high | 79.7 | Confident | 3 Ų | 3 | 97.6 Ų | 97.6 | 2% | 0.02 | 46% | 0.459 | C | S | . | . | P | Polyproline II helix | trans | -70.5 | 127.5 | 174.2 | -179.4 | 0 | 0 | 0 | 0 | 111 | D355 C356 G357 K358 I360 V372 H374 | C353-D355 VanDerWaalsContact C-N 3.29Å; C353-D355 PolarHBondContact O-N 2.95Å; C353-C356 VanDerWaalsContact CB-SG 3.59Å; C353-G357 WeakPolarHBondContact O-CA 3.43Å; C353-G357 PolarHBondContact O-N 2.9Å; C353-K358 PolarHBondContact N-O 3.03Å; C353-I360 HydrophobicContact CB-CD1 3.71Å; C353-I360 HydrophobicContact CB-CG1 3.77Å; C353-V372 WeakPolarHBondContact CA-O 3.41Å; C353-H374 WeakPolarHBondContact CB-CE1 3.29Å; C353-H374 WeakPolarHBondContact CB-ND1 3.34Å; C353-H374 PolarHBondContact SG-N 2.92Å; C353-H374 PolarHBondContact SG-ND1 3.44Å |
| 354 | F | 91.5 | Very high | 81 | Confident | 113 Ų | 113 | 97.8 Ų | 97.8 | 50% | 0.496 | 46% | 0.455 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.5 | -34.2 | 179.8 | -173.4 | -92.1 | 0 | 0 | 0 | 112.7 | L352 R371 V372 Y373 | L352-F354 PolarHBondContact O-N 3.29Å; F354-R371 HydrophobicContact CB-CB 4.42Å; F354-R371 HydrophobicContact CD2-CG 4.1Å; F354-R371 HydrophobicContact CG-CG 4.37Å; F354-R371 VanDerWaalsContact CZ-CZ 3.42Å; F354-V372 PolarHBondContact N-O 3.37Å; F354-Y373 HydrophobicContact CB-CD1 4.25Å; F354-Y373 HydrophobicContact CB-CE1 3.68Å; F354-Y373 HydrophobicContact CD1-CE1 4.01Å; F354-Y373 HydrophobicContact CG-CE1 4.27Å |
| 355 | D | 91.4 | Very high | 82.3 | Confident | 86 Ų | 86 | 93.7 Ų | 93.7 | 46% | 0.46 | 44% | 0.44 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.6 | -39.5 | -178.5 | -68.9 | -27.9 | 0 | 0 | 0 | 113.5 | C353 Y373 C377 | C353-D355 VanDerWaalsContact C-N 3.29Å; C353-D355 PolarHBondContact O-N 2.95Å; D355-Y373 HydrophobicContact CB-CD1 4.44Å; D355-Y373 WeakPolarHBondContact OD1-CE1 3.37Å; D355-Y373 WeakPolarHBondContact OD2-CD1 3.42Å; D355-Y373 WeakPolarHBondContact OD2-CE1 3.39Å; D355-C377 HydrophobicContact CB-CB 4.02Å |
| 356 | C | 93.8 | Very high | 83.8 | Confident | 51 Ų | 51 | 87 Ų | 87 | 35% | 0.345 | 42% | 0.415 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -116.1 | -7 | -171.5 | 80.4 | 0 | 0 | 0 | 0 | 114.7 | C353 K358 H374 | C353-C356 VanDerWaalsContact CB-SG 3.59Å; C356-K358 PolarHBondContact O-N 3.27Å; C356-K358 VanDerWaalsContact O-N 3.14Å; C356-K358 VanDerWaalsContact SG-CB 3.59Å; C356-K358 PolarHBondContact SG-N 3.39Å; C356-H374 PolarHBondContact SG-CE1 3.38Å; C356-H374 PolarHBondContact SG-ND1 3.41Å; C356-H374 VanDerWaalsContact SG-ND1 3.38Å |
| 357 | G | 91.8 | Very high | 85.3 | Confident | 49 Ų | 49 | 82.9 Ų | 82.9 | 51% | 0.505 | 41% | 0.407 | S | S | . | . | trans | 65.4 | 12.3 | -179.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | L352 C353 | L352-G357 WeakPolarHBondContact CD2-O 3.38Å; C353-G357 WeakPolarHBondContact O-CA 3.43Å; C353-G357 PolarHBondContact O-N 2.9Å | ||
| 358 | K | 92.3 | Very high | 86.6 | Confident | 143 Ų | 143 | 78.7 Ų | 78.7 | 62% | 0.622 | 39% | 0.388 | S | S | * | . | P | Polyproline II helix | trans | -95.5 | 154 | -179.7 | -60.1 | 175 | -175.4 | 176.4 | 0 | 110.4 | C353 C356 | C353-K358 PolarHBondContact N-O 3.03Å; C356-K358 PolarHBondContact O-N 3.27Å; C356-K358 VanDerWaalsContact O-N 3.14Å; C356-K358 VanDerWaalsContact SG-CB 3.59Å; C356-K358 PolarHBondContact SG-N 3.39Å |
| 359 | R | 91.3 | Very high | 87.9 | Confident | 157 Ų | 157 | 74.4 Ų | 74.4 | 59% | 0.592 | 39% | 0.388 | S | S | * | . | B | Isolated β-bridge | trans | -60 | 136.8 | 174.4 | -62.2 | 178.7 | -173.4 | -95.2 | 0.8 | 110.4 | H374 | R359-H374 PolarHBondContact O-NE2 2.72Å |
| 360 | I | 91.9 | Very high | 89 | Confident | 3 Ų | 3 | 76.2 Ų | 76.2 | 2% | 0.015 | 40% | 0.402 | C | S | . | . | P | Polyproline II helix | trans | -97.6 | 125.8 | 177.5 | -65.9 | 176 | 0 | 0 | 0 | 108.4 | D351 C353 R365 V372 Y373 H374 | D351-I360 WeakPolarHBondContact O-CB 3.42Å; D351-I360 PolarHBondContact O-N 3.31Å; C353-I360 HydrophobicContact CB-CD1 3.71Å; C353-I360 HydrophobicContact CB-CG1 3.77Å; I360-R365 HydrophobicContact CG2-CB 3.76Å; I360-R365 HydrophobicContact CG2-CG 4.16Å; I360-V372 HydrophobicContact CD1-CB 3.87Å; I360-V372 HydrophobicContact CD1-CG1 3.43Å; I360-V372 VanDerWaalsContact CD1-CG1 3.43Å; I360-Y373 VanDerWaalsContact CD1-C 3.45Å; I360-H374 WeakPolarHBondContact CG1-NE2 3.11Å |
| 361 | Y | 89.4 | Confident | 90 | Very high | 144 Ų | 144 | 79.1 Ų | 79.1 | 57% | 0.565 | 41% | 0.412 | S | S | * | . | P | Polyproline II helix | trans | -73.9 | 145.6 | 167.4 | -69.8 | -74.7 | 0 | 0 | 0 | 109.7 | V363 D364 R365 | Y361-V363 PolarHBondContact O-N 2.88Å; Y361-D364 PolarHBondContact O-N 2.97Å; Y361-R365 PolarHBondContact O-N 3.32Å |
| 362 | P | 87 | Confident | 90.3 | Very high | 70 Ų | 70 | 77.3 Ų | 77.3 | 46% | 0.455 | 40% | 0.403 | S | S | . | . | G | 310 helix | trans | -50.9 | -32.4 | -178.8 | -29.4 | 35.2 | 0 | 0 | 0 | 114.3 | M350 R365 | M350-P362 HydrophobicContact CE-CG 4.28Å; P362-R365 WeakPolarHBondContact O-CB 3.38Å; P362-R365 PolarHBondContact O-N 3.03Å |
| 363 | V | 89 | Confident | 90.4 | Very high | 74 Ų | 74 | 72.2 Ų | 72.2 | 45% | 0.448 | 38% | 0.376 | S | S | . | . | G | 310 helix | trans | -70.4 | -29.7 | 179.4 | 177.6 | 0 | 0 | 0 | 0 | 113.2 | Y56 Y361 K375 | Y56-V363 HydrophobicContact CE1-CG2 4.48Å; Y56-V363 WeakPolarHBondContact OH-CG2 3.38Å; Y361-V363 PolarHBondContact O-N 2.88Å; V363-K375 WeakPolarHBondContact O-CE 3.27Å; V363-K375 PolarHBondContact O-NZ 3.14Å |
| 364 | D | 89.6 | Confident | 90.4 | Very high | 60 Ų | 60 | 73 Ų | 73 | 32% | 0.321 | 38% | 0.379 | S | S | . | . | G | 310 helix | trans | -99.4 | 6.3 | -179.4 | -71.1 | -31.9 | 0 | 0 | 0 | 113.1 | Y361 I366 H374 K375 | Y361-D364 PolarHBondContact O-N 2.97Å; D364-I366 PolarHBondContact O-N 3.44Å; D364-H374 CarbonylContact O-C 3.51Å; D364-H374 WeakPolarHBondContact O-CA 3.46Å; D364-K375 PolarHBondContact O-N 3.48Å |
| 365 | R | 90.5 | Very high | 90.4 | Very high | 102 Ų | 102 | 72.8 Ų | 72.8 | 39% | 0.385 | 38% | 0.378 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.2 | 116.7 | -175.4 | -169.1 | -178.2 | -174.6 | -99.1 | 0.1 | 111.6 | D351 I360 Y361 P362 V372 | D351-R365 IonicContact OD2-CZ 3.53Å; D351-R365 IonicContact OD2-NE 3.96Å; D351-R365 PolarHBondContact OD2-NE 2.84Å; D351-R365 IonicContact OD2-NH2 3.2Å; D351-R365 PolarHBondContact OD2-NH2 2.7Å; I360-R365 HydrophobicContact CG2-CB 3.76Å; I360-R365 HydrophobicContact CG2-CG 4.16Å; Y361-R365 PolarHBondContact O-N 3.32Å; P362-R365 WeakPolarHBondContact O-CB 3.38Å; P362-R365 PolarHBondContact O-N 3.03Å; R365-V372 HydrophobicContact CG-CG1 3.57Å |
| 366 | I | 91.4 | Very high | 90.4 | Very high | 14 Ų | 14 | 71.9 Ų | 71.9 | 7% | 0.072 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.2 | 116.9 | 164 | -62.4 | -174.2 | 0 | 0 | 0 | 107.7 | D364 V372 Y373 K375 F378 V389 | D364-I366 PolarHBondContact O-N 3.44Å; I366-V372 CarbonylContact O-C 3.53Å; I366-V372 WeakPolarHBondContact O-CA 3.35Å; I366-V372 WeakPolarHBondContact O-CG1 3.5Å; I366-Y373 PolarHBondContact N-O 3.37Å; I366-Y373 PolarHBondContact O-N 3.45Å; I366-K375 HydrophobicContact CD1-CB 4.28Å; I366-K375 HydrophobicContact CD1-CG 3.88Å; I366-K375 HydrophobicContact CG1-CG 3.91Å; I366-F378 HydrophobicContact CD1-CB 3.9Å; I366-F378 HydrophobicContact CD1-CD1 4.14Å; I366-F378 HydrophobicContact CD1-CG 4.08Å; I366-F378 HydrophobicContact CG2-CD1 4.46Å; I366-F378 HydrophobicContact CG2-CD2 4.1Å; I366-F378 HydrophobicContact CG2-CE2 4.18Å; I366-F378 HydrophobicContact CG2-CG 4.24Å; I366-F378 HydrophobicContact CG2-CZ 4.4Å; I366-V389 HydrophobicContact CG2-CG2 3.94Å |
| 367 | S | 90.4 | Very high | 90.4 | Very high | 52 Ų | 52 | 70.6 Ų | 70.6 | 36% | 0.364 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.7 | 130.5 | 172.9 | 176.5 | 0 | 0 | 0 | 0 | 109.2 | ||
| 368 | T | 86.8 | Confident | 90.5 | Very high | 18 Ų | 18 | 68.2 Ų | 68.2 | 11% | 0.11 | 35% | 0.346 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.1 | 92.9 | 177.6 | -63.1 | 0 | 0 | 0 | 0 | 107.5 | E370 R371 F378 F392 | T368-E370 PolarHBondContact O-N 3.47Å; T368-R371 PolarHBondContact N-O 3.1Å; T368-R371 PolarHBondContact O-N 3.31Å; T368-R371 VanDerWaalsContact O-N 3.08Å; T368-F378 VanDerWaalsContact OG1-CE2 3.29Å; T368-F378 WeakPolarHBondContact OG1-CE2 3.19Å; T368-F392 HydrophobicContact CG2-CD2 4.2Å; T368-F392 HydrophobicContact CG2-CE2 3.23Å; T368-F392 HydrophobicContact CG2-CZ 3.51Å |
| 369 | G | 84.6 | Confident | 90.6 | Very high | 73 Ų | 73 | 66.8 Ų | 66.8 | 75% | 0.753 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.9 | -119.8 | -171.2 | 0 | 0 | 0 | 0 | 0 | 111 | R371 | G369-R371 VanDerWaalsContact C-N 3.34Š|
| 370 | E | 85.3 | Confident | 90.8 | Very high | 200 Ų | 200 | 59.4 Ų | 59.4 | 94% | 0.935 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.1 | -7.9 | -178.3 | -61.7 | 178.5 | 176.3 | 0 | 0 | 114.2 | T368 | T368-E370 PolarHBondContact O-N 3.47Š|
| 371 | R | 90 | Very high | 90.8 | Very high | 83 Ų | 83 | 62 Ų | 62 | 31% | 0.313 | 33% | 0.331 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.1 | 148.1 | -173.9 | -63.1 | -179.6 | -174 | -173.9 | 0.3 | 111.5 | F354 T368 G369 Y373 G397 | F354-R371 HydrophobicContact CB-CB 4.42Å; F354-R371 HydrophobicContact CD2-CG 4.1Å; F354-R371 HydrophobicContact CG-CG 4.37Å; F354-R371 VanDerWaalsContact CZ-CZ 3.42Å; T368-R371 PolarHBondContact N-O 3.1Å; T368-R371 PolarHBondContact O-N 3.31Å; T368-R371 VanDerWaalsContact O-N 3.08Å; G369-R371 VanDerWaalsContact C-N 3.34Å; R371-Y373 HydrophobicContact CB-CD2 4.43Å; R371-Y373 HydrophobicContact CB-CE2 3.53Å; R371-Y373 WeakPolarHBondContact CD-OH 3.33Å; R371-G397 PolarHBondContact NH1-O 3.17Å |
| 372 | V | 92.1 | Very high | 91 | Very high | 17 Ų | 17 | 58.3 Ų | 58.3 | 10% | 0.103 | 32% | 0.323 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.6 | 138.4 | 179.4 | -161.1 | 0 | 0 | 0 | 0 | 109.2 | D351 C353 F354 I360 R365 I366 | D351-V372 HydrophobicContact CB-CB 4Å; D351-V372 HydrophobicContact CB-CG1 3.95Å; D351-V372 HydrophobicContact CB-CG2 3.93Å; C353-V372 WeakPolarHBondContact CA-O 3.41Å; F354-V372 PolarHBondContact N-O 3.37Å; I360-V372 HydrophobicContact CD1-CB 3.87Å; I360-V372 HydrophobicContact CD1-CG1 3.43Å; I360-V372 VanDerWaalsContact CD1-CG1 3.43Å; R365-V372 HydrophobicContact CG-CG1 3.57Å; I366-V372 CarbonylContact O-C 3.53Å; I366-V372 WeakPolarHBondContact O-CA 3.35Å; I366-V372 WeakPolarHBondContact O-CG1 3.5Å |
| 373 | Y | 93.7 | Very high | 91.4 | Very high | 4 Ų | 4 | 57.3 Ų | 57.3 | 2% | 0.016 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.1 | 150.3 | -175.5 | -61.7 | -88.6 | 0 | 0 | 0 | 110.3 | F354 D355 I360 I366 R371 F378 I399 | F354-Y373 HydrophobicContact CB-CD1 4.25Å; F354-Y373 HydrophobicContact CB-CE1 3.68Å; F354-Y373 HydrophobicContact CD1-CE1 4.01Å; F354-Y373 HydrophobicContact CG-CE1 4.27Å; D355-Y373 HydrophobicContact CB-CD1 4.44Å; D355-Y373 WeakPolarHBondContact OD1-CE1 3.37Å; D355-Y373 WeakPolarHBondContact OD2-CD1 3.42Å; D355-Y373 WeakPolarHBondContact OD2-CE1 3.39Å; I360-Y373 VanDerWaalsContact CD1-C 3.45Å; I366-Y373 PolarHBondContact N-O 3.37Å; I366-Y373 PolarHBondContact O-N 3.45Å; R371-Y373 HydrophobicContact CB-CD2 4.43Å; R371-Y373 HydrophobicContact CB-CE2 3.53Å; R371-Y373 WeakPolarHBondContact CD-OH 3.33Å; Y373-F378 AromaticContact CD2-CD2 3.91Å; Y373-F378 HydrophobicContact CD2-CD2 3.91Å; Y373-F378 HydrophobicContact CD2-CE2 4.16Å; Y373-F378 AromaticContact CG-CD2 3.88Å; Y373-F378 HydrophobicContact CG-CD2 3.88Å; Y373-I399 HydrophobicContact CD1-CD1 3.95Å; Y373-I399 HydrophobicContact CD2-CD1 4.04Å; Y373-I399 HydrophobicContact CE1-CD1 3.51Å; Y373-I399 HydrophobicContact CE2-CD1 3.65Å; Y373-I399 HydrophobicContact CG-CD1 4.19Å |
| 374 | H | 93.9 | Very high | 91.6 | Very high | 19 Ų | 19 | 60.5 Ų | 60.5 | 9% | 0.088 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.6 | 148.5 | 162.1 | -62.3 | 99.7 | 0 | 0 | 0 | 109.7 | C353 C356 R359 I360 D364 S376 C377 F378 | C353-H374 WeakPolarHBondContact CB-CE1 3.29Å; C353-H374 WeakPolarHBondContact CB-ND1 3.34Å; C353-H374 PolarHBondContact SG-N 2.92Å; C353-H374 PolarHBondContact SG-ND1 3.44Å; C356-H374 PolarHBondContact SG-CE1 3.38Å; C356-H374 PolarHBondContact SG-ND1 3.41Å; C356-H374 VanDerWaalsContact SG-ND1 3.38Å; R359-H374 PolarHBondContact O-NE2 2.72Å; I360-H374 WeakPolarHBondContact CG1-NE2 3.11Å; D364-H374 CarbonylContact O-C 3.51Å; D364-H374 WeakPolarHBondContact O-CA 3.46Å; H374-S376 PolarHBondContact O-N 3.38Å; H374-S376 VanDerWaalsContact O-N 3.08Å; H374-C377 HydrophobicContact CB-CB 3.98Å; H374-C377 PolarHBondContact O-N 2.97Å; H374-F378 PolarHBondContact O-N 3.4Å |
| 375 | K | 91.9 | Very high | 91.7 | Very high | 109 Ų | 109 | 66.2 Ų | 66.2 | 47% | 0.474 | 34% | 0.344 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -47.6 | -36.7 | 167.7 | -73.4 | 177.8 | 174.8 | 173.2 | 0 | 113.6 | V363 D364 I366 | V363-K375 WeakPolarHBondContact O-CE 3.27Å; V363-K375 PolarHBondContact O-NZ 3.14Å; D364-K375 PolarHBondContact O-N 3.48Å; I366-K375 HydrophobicContact CD1-CB 4.28Å; I366-K375 HydrophobicContact CD1-CG 3.88Å; I366-K375 HydrophobicContact CG1-CG 3.91Å |
| 376 | S | 92.6 | Very high | 91.8 | Very high | 67 Ų | 67 | 64.8 Ų | 64.8 | 47% | 0.469 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.4 | -19.9 | 178.7 | 60 | 0 | 0 | 0 | 0 | 114 | H374 R379 | H374-S376 PolarHBondContact O-N 3.38Å; H374-S376 VanDerWaalsContact O-N 3.08Å; S376-R379 PolarHBondContact O-NE 3.18Å; S376-R379 PolarHBondContact O-NH2 3.39Å |
| 377 | C | 93.8 | Very high | 91.9 | Very high | 24 Ų | 24 | 64.8 Ų | 64.8 | 16% | 0.162 | 35% | 0.347 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.9 | -30.7 | 178.5 | -71.5 | 0 | 0 | 0 | 0 | 111.7 | D355 H374 R379 | D355-C377 HydrophobicContact CB-CB 4.02Å; H374-C377 HydrophobicContact CB-CB 3.98Å; H374-C377 PolarHBondContact O-N 2.97Å; C377-R379 VanDerWaalsContact C-N 3.32Å; C377-R379 WeakPolarHBondContact O-CB 3.5Å; C377-R379 WeakPolarHBondContact O-CG 3.33Å; C377-R379 PolarHBondContact O-N 2.97Å |
| 378 | F | 93.9 | Very high | 91.8 | Very high | 0 Ų | 0 | 68.2 Ų | 68.2 | 0% | 0 | 36% | 0.361 | C | S | . | . | trans | -62.8 | 86.3 | -178.2 | -162 | -111.8 | 0 | 0 | 0 | 112.5 | I366 T368 Y373 H374 T386 L387 F392 I399 | I366-F378 HydrophobicContact CD1-CB 3.9Å; I366-F378 HydrophobicContact CD1-CD1 4.14Å; I366-F378 HydrophobicContact CD1-CG 4.08Å; I366-F378 HydrophobicContact CG2-CD1 4.46Å; I366-F378 HydrophobicContact CG2-CD2 4.1Å; I366-F378 HydrophobicContact CG2-CE2 4.18Å; I366-F378 HydrophobicContact CG2-CG 4.24Å; I366-F378 HydrophobicContact CG2-CZ 4.4Å; T368-F378 VanDerWaalsContact OG1-CE2 3.29Å; T368-F378 WeakPolarHBondContact OG1-CE2 3.19Å; Y373-F378 AromaticContact CD2-CD2 3.91Å; Y373-F378 HydrophobicContact CD2-CD2 3.91Å; Y373-F378 HydrophobicContact CD2-CE2 4.16Å; Y373-F378 AromaticContact CG-CD2 3.88Å; Y373-F378 HydrophobicContact CG-CD2 3.88Å; H374-F378 PolarHBondContact O-N 3.4Å; F378-T386 WeakPolarHBondContact O-CA 3.22Å; F378-L387 HydrophobicContact CD1-CB 3.59Å; F378-L387 WeakPolarHBondContact CD1-O 3.31Å; F378-L387 HydrophobicContact CE1-CB 3.61Å; F378-L387 PolarHBondContact O-N 2.94Å; F378-F392 HydrophobicContact CE1-CB 3.84Å; F378-F392 AromaticContact CE1-CD1 3.68Å; F378-F392 HydrophobicContact CE1-CD1 3.68Å; F378-F392 HydrophobicContact CE1-CE1 4.38Å; F378-F392 AromaticContact CE1-CG 3.8Å; F378-F392 HydrophobicContact CE1-CG 3.8Å; F378-F392 HydrophobicContact CE2-CG 4.48Å; F378-F392 HydrophobicContact CZ-CB 3.77Å; F378-F392 AromaticContact CZ-CD1 3.42Å; F378-F392 HydrophobicContact CZ-CD1 3.42Å; F378-F392 VanDerWaalsContact CZ-CD1 3.42Å; F378-F392 AromaticContact CZ-CD2 3.74Å; F378-F392 HydrophobicContact CZ-CD2 3.74Å; F378-F392 AromaticContact CZ-CE1 3.84Å; F378-F392 HydrophobicContact CZ-CE1 3.84Å; F378-F392 HydrophobicContact CZ-CE2 4.17Å; F378-F392 AromaticContact CZ-CG 3.35Å; F378-F392 HydrophobicContact CZ-CG 3.35Å; F378-F392 HydrophobicContact CZ-CZ 4.21Å; F378-I399 HydrophobicContact CD2-CD1 3.47Å; F378-I399 VanDerWaalsContact CD2-CD1 3.47Å; F378-I399 HydrophobicContact CE2-CD1 3.43Å; F378-I399 VanDerWaalsContact CE2-CD1 3.43Å; F378-I399 HydrophobicContact CE2-CG1 4.16Å; F378-I399 HydrophobicContact CE2-CG2 3.98Å; F378-I399 HydrophobicContact CZ-CD1 4.47Å; F378-I399 HydrophobicContact CZ-CG2 4Å | ||
| 379 | R | 94.3 | Very high | 91.8 | Very high | 113 Ų | 113 | 71.9 Ų | 71.9 | 43% | 0.426 | 38% | 0.383 | S | S | . | . | B | Isolated β-bridge | trans | -131.6 | 148.6 | -170.6 | -67.2 | 173.3 | -169.6 | -90.7 | -6 | 111 | S376 C377 Q384 R385 T386 | S376-R379 PolarHBondContact O-NE 3.18Å; S376-R379 PolarHBondContact O-NH2 3.39Å; C377-R379 VanDerWaalsContact C-N 3.32Å; C377-R379 WeakPolarHBondContact O-CB 3.5Å; C377-R379 WeakPolarHBondContact O-CG 3.33Å; C377-R379 PolarHBondContact O-N 2.97Å; R379-Q384 PolarHBondContact NH1-O 3.27Å; R379-R385 VanDerWaalsContact CA-O 3.27Å; R379-R385 WeakPolarHBondContact CA-O 3.37Å; R379-T386 HydrophobicContact CG-CG2 4.13Å |
| 380 | C | 95 | Very high | 91.9 | Very high | 1 Ų | 1 | 71 Ų | 71 | 1% | 0.007 | 37% | 0.374 | C | S | . | . | trans | -67.8 | 132.2 | 172 | 176.4 | 0 | 0 | 0 | 0 | 110.5 | T382 C383 Q384 R385 L387 I399 C401 H404 | C380-T382 VanDerWaalsContact C-N 3.27Å; C380-T382 PolarHBondContact O-N 3Å; C380-T382 PolarHBondContact SG-N 2.95Å; C380-T382 VanDerWaalsContact SG-N 3.44Å; C380-C383 VanDerWaalsContact CB-SG 3.5Å; C380-C383 VanDerWaalsContact SG-SG 3.64Å; C380-Q384 WeakPolarHBondContact O-CA 3.17Å; C380-Q384 PolarHBondContact O-N 3.49Å; C380-R385 PolarHBondContact N-O 3.31Å; C380-L387 HydrophobicContact CB-CD1 4.02Å; C380-L387 HydrophobicContact CB-CD2 4.26Å; C380-L387 HydrophobicContact CB-CG 4.37Å; C380-I399 WeakPolarHBondContact CA-O 3.43Å; C380-C401 HydrophobicContact CB-CB 4.3Å; C380-C401 PolarHBondContact SG-N 3.29Å; C380-C401 VanDerWaalsContact SG-N 3.39Å; C380-H404 PolarHBondContact SG-ND1 2.86Å; C380-H404 VanDerWaalsContact SG-ND1 3.42Å | ||
| 381 | A | 92.8 | Very high | 92.1 | Very high | 58 Ų | 58 | 65.6 Ų | 65.6 | 48% | 0.479 | 35% | 0.351 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.9 | -33.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | V398 I399 F400 | A381-V398 HydrophobicContact CB-CG1 3.53Å; A381-I399 PolarHBondContact N-O 3.21Å; A381-F400 HydrophobicContact CB-CD1 4.34Å; A381-F400 HydrophobicContact CB-CE1 3.83Å; A381-F400 HydrophobicContact CB-CZ 4.3Å |
| 382 | T | 92.9 | Very high | 92.2 | Very high | 66 Ų | 66 | 63.9 Ų | 63.9 | 41% | 0.405 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.5 | -46.4 | -178 | -45.8 | 0 | 0 | 0 | 0 | 113.3 | C380 F400 | C380-T382 VanDerWaalsContact C-N 3.27Å; C380-T382 PolarHBondContact O-N 3Å; C380-T382 PolarHBondContact SG-N 2.95Å; C380-T382 VanDerWaalsContact SG-N 3.44Å; T382-F400 WeakPolarHBondContact OG1-CD1 3.02Å; T382-F400 WeakPolarHBondContact OG1-CE1 3.39Å |
| 383 | C | 94.8 | Very high | 92.2 | Very high | 49 Ų | 49 | 64.1 Ų | 64.1 | 33% | 0.331 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -112 | -1.9 | -175.1 | 64.4 | 0 | 0 | 0 | 0 | 115.5 | C380 R385 H404 | C380-C383 VanDerWaalsContact CB-SG 3.5Å; C380-C383 VanDerWaalsContact SG-SG 3.64Å; C383-R385 PolarHBondContact O-N 2.96Å; C383-H404 WeakPolarHBondContact CB-CE1 3.48Å; C383-H404 PolarHBondContact SG-CE1 3.2Å |
| 384 | Q | 92.6 | Very high | 92.1 | Very high | 141 Ų | 141 | 67 Ų | 67 | 66% | 0.659 | 37% | 0.371 | S | S | * | . | trans | 56.8 | 13.2 | 177.9 | -55.4 | 178.3 | 10.2 | 0 | 0 | 115 | R379 C380 | R379-Q384 PolarHBondContact NH1-O 3.27Å; C380-Q384 WeakPolarHBondContact O-CA 3.17Å; C380-Q384 PolarHBondContact O-N 3.49Å | ||
| 385 | R | 92.6 | Very high | 91.9 | Very high | 180 Ų | 180 | 67.7 Ų | 67.7 | 68% | 0.679 | 38% | 0.375 | S | S | * | . | P | Polyproline II helix | trans | -72.7 | 137.2 | 176.6 | -166.4 | -180 | -63.1 | -176.8 | 1.5 | 109.4 | R379 C380 C383 L387 | R379-R385 VanDerWaalsContact CA-O 3.27Å; R379-R385 WeakPolarHBondContact CA-O 3.37Å; C380-R385 PolarHBondContact N-O 3.31Å; C383-R385 PolarHBondContact O-N 2.96Å; R385-L387 PolarHBondContact O-N 3.4Å |
| 386 | T | 92.7 | Very high | 91.6 | Very high | 72 Ų | 72 | 70 Ų | 70 | 44% | 0.442 | 39% | 0.392 | S | S | . | . | B | Isolated β-bridge | trans | -62.3 | 129.1 | 172.2 | 46.6 | 0 | 0 | 0 | 0 | 109.9 | F378 R379 | F378-T386 WeakPolarHBondContact O-CA 3.22Å; R379-T386 HydrophobicContact CG-CG2 4.13Å |
| 387 | L | 92.4 | Very high | 91.3 | Very high | 15 Ų | 15 | 67.9 Ų | 67.9 | 8% | 0.079 | 38% | 0.382 | C | S | . | . | P | Polyproline II helix | trans | -100.7 | 157.9 | -178.9 | -56.7 | 175.5 | 0 | 0 | 0 | 109.8 | F378 C380 R385 F392 I399 C401 | F378-L387 HydrophobicContact CD1-CB 3.59Å; F378-L387 WeakPolarHBondContact CD1-O 3.31Å; F378-L387 HydrophobicContact CE1-CB 3.61Å; F378-L387 PolarHBondContact O-N 2.94Å; C380-L387 HydrophobicContact CB-CD1 4.02Å; C380-L387 HydrophobicContact CB-CD2 4.26Å; C380-L387 HydrophobicContact CB-CG 4.37Å; R385-L387 PolarHBondContact O-N 3.4Å; L387-F392 HydrophobicContact CB-CB 4.23Å; L387-F392 HydrophobicContact CD1-CB 3.84Å; L387-I399 HydrophobicContact CD1-CG2 3.59Å; L387-C401 HydrophobicContact CD2-CB 3.56Å |
| 388 | L | 88.8 | Confident | 91.1 | Very high | 124 Ų | 124 | 69.9 Ų | 69.9 | 65% | 0.649 | 39% | 0.393 | S | S | * | . | trans | -107 | 157.3 | 168.8 | -67.6 | 118.8 | 0 | 0 | 0 | 108.2 | G390 N391 | L388-G390 PolarHBondContact O-N 3.08Å; L388-N391 PolarHBondContact O-N 3.49Å | ||
| 389 | V | 87.5 | Confident | 91 | Very high | 95 Ų | 95 | 70.4 Ų | 70.4 | 58% | 0.576 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.1 | -24.2 | 179.2 | -176.6 | 0 | 0 | 0 | 0 | 112.6 | I366 F392 | I366-V389 HydrophobicContact CG2-CG2 3.94Å; V389-F392 HydrophobicContact CG1-CE1 4.2Å; V389-F392 WeakPolarHBondContact O-CD1 3.46Å; V389-F392 WeakPolarHBondContact O-CE1 3.49Å |
| 390 | G | 86.9 | Confident | 91 | Very high | 55 Ų | 55 | 66 Ų | 66 | 57% | 0.567 | 38% | 0.379 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.2 | -11.3 | 176 | 0 | 0 | 0 | 0 | 0 | 116.5 | L388 K402 | L388-G390 PolarHBondContact O-N 3.08Å; G390-K402 VanDerWaalsContact O-CE 3.3Å; G390-K402 WeakPolarHBondContact O-CE 3.36Å; G390-K402 PolarHBondContact O-NZ 3.48Å |
| 391 | N | 89.3 | Confident | 91 | Very high | 85 Ų | 85 | 66.6 Ų | 66.6 | 46% | 0.455 | 38% | 0.384 | S | S | . | . | S | Bend | trans | -128.5 | 25.3 | -165.5 | -75.9 | -24.4 | 0 | 0 | 0 | 114.7 | L388 K402 | L388-N391 PolarHBondContact O-N 3.49Å; N391-K402 PolarHBondContact OD1-NZ 3.2Å; N391-K402 VanDerWaalsContact OD1-NZ 3.1Å |
| 392 | F | 92.8 | Very high | 90.9 | Very high | 47 Ų | 47 | 68.8 Ų | 68.8 | 21% | 0.206 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 162.9 | 177.4 | 79.4 | -88.4 | 0 | 0 | 0 | 111.3 | T368 F378 L387 V389 I399 F400 | T368-F392 HydrophobicContact CG2-CD2 4.2Å; T368-F392 HydrophobicContact CG2-CE2 3.23Å; T368-F392 HydrophobicContact CG2-CZ 3.51Å; F378-F392 HydrophobicContact CE1-CB 3.84Å; F378-F392 AromaticContact CE1-CD1 3.68Å; F378-F392 HydrophobicContact CE1-CD1 3.68Å; F378-F392 HydrophobicContact CE1-CE1 4.38Å; F378-F392 AromaticContact CE1-CG 3.8Å; F378-F392 HydrophobicContact CE1-CG 3.8Å; F378-F392 HydrophobicContact CE2-CG 4.48Å; F378-F392 HydrophobicContact CZ-CB 3.77Å; F378-F392 AromaticContact CZ-CD1 3.42Å; F378-F392 HydrophobicContact CZ-CD1 3.42Å; F378-F392 VanDerWaalsContact CZ-CD1 3.42Å; F378-F392 AromaticContact CZ-CD2 3.74Å; F378-F392 HydrophobicContact CZ-CD2 3.74Å; F378-F392 AromaticContact CZ-CE1 3.84Å; F378-F392 HydrophobicContact CZ-CE1 3.84Å; F378-F392 HydrophobicContact CZ-CE2 4.17Å; F378-F392 AromaticContact CZ-CG 3.35Å; F378-F392 HydrophobicContact CZ-CG 3.35Å; F378-F392 HydrophobicContact CZ-CZ 4.21Å; L387-F392 HydrophobicContact CB-CB 4.23Å; L387-F392 HydrophobicContact CD1-CB 3.84Å; V389-F392 HydrophobicContact CG1-CE1 4.2Å; V389-F392 WeakPolarHBondContact O-CD1 3.46Å; V389-F392 WeakPolarHBondContact O-CE1 3.49Å; F392-I399 HydrophobicContact CB-CG2 3.95Å; F392-I399 HydrophobicContact CD2-CG2 4.18Å; F392-I399 HydrophobicContact CG-CG2 4.42Å; F392-F400 CarbonylContact C-O 3.56Å; F392-F400 WeakPolarHBondContact CA-O 3.43Å |
| 393 | A | 91.7 | Very high | 90.9 | Very high | 22 Ų | 22 | 69.6 Ų | 69.6 | 18% | 0.182 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.3 | 141.5 | 164.5 | 0 | 0 | 0 | 0 | 0 | 108.4 | F400 Y405 | A393-F400 PolarHBondContact N-O 3.44Å; A393-F400 PolarHBondContact O-N 3.4Å; A393-Y405 HydrophobicContact CB-CD1 3.89Å; A393-Y405 HydrophobicContact CB-CD2 3.43Å; A393-Y405 VanDerWaalsContact CB-CD2 3.43Å; A393-Y405 HydrophobicContact CB-CE1 4.36Å; A393-Y405 HydrophobicContact CB-CE2 3.93Å; A393-Y405 HydrophobicContact CB-CG 3.4Å; A393-Y405 VanDerWaalsContact CB-CG 3.4Å |
| 394 | S | 90.6 | Very high | 90.8 | Very high | 65 Ų | 65 | 69.2 Ų | 69.2 | 46% | 0.455 | 38% | 0.382 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.5 | 128.4 | 178.8 | 53.7 | 0 | 0 | 0 | 0 | 110.3 | V398 | S394-V398 CarbonylContact C-O 3.58Å; S394-V398 VanDerWaalsContact CA-O 3.3Å; S394-V398 WeakPolarHBondContact CA-O 3.29Å |
| 395 | L | 89 | Confident | 90.8 | Very high | 33 Ų | 33 | 65.7 Ų | 65.7 | 17% | 0.173 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.2 | 122.5 | 171.4 | -173.1 | 66.4 | 0 | 0 | 0 | 108 | G397 V398 F400 Y405 Q408 F409 | L395-G397 PolarHBondContact O-N 2.85Å; L395-V398 PolarHBondContact N-O 3.24Å; L395-V398 PolarHBondContact O-N 3.34Å; L395-F400 HydrophobicContact CB-CD2 4.12Å; L395-F400 HydrophobicContact CB-CE2 4Å; L395-Y405 HydrophobicContact CB-CD2 4.1Å; L395-Y405 HydrophobicContact CB-CE2 3.82Å; L395-Y405 HydrophobicContact CD1-CE2 4.16Å; L395-Y405 HydrophobicContact CG-CE2 4.49Å; L395-Q408 HydrophobicContact CD2-CB 4.48Å; L395-F409 HydrophobicContact CD1-CD2 4.26Å |
| 396 | D | 86.6 | Confident | 90.7 | Very high | 157 Ų | 157 | 60.4 Ų | 60.4 | 84% | 0.84 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.3 | 32.8 | -179.2 | -55.9 | -34.2 | 0 | 0 | 0 | 114.3 | V398 | D396-V398 VanDerWaalsContact C-N 3.31Å; D396-V398 PolarHBondContact O-N 3.34Å |
| 397 | G | 86.1 | Confident | 90.5 | Very high | 24 Ų | 24 | 61.5 Ų | 61.5 | 25% | 0.247 | 35% | 0.348 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 80.7 | 1.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | R371 L395 | R371-G397 PolarHBondContact NH1-O 3.17Å; L395-G397 PolarHBondContact O-N 2.85Å |
| 398 | V | 89.7 | Confident | 90.2 | Very high | 66 Ų | 66 | 64.1 Ų | 64.1 | 40% | 0.4 | 36% | 0.36 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.3 | 136.8 | 172.3 | -176.3 | 0 | 0 | 0 | 0 | 109.8 | A381 S394 L395 D396 F400 | A381-V398 HydrophobicContact CB-CG1 3.53Å; S394-V398 CarbonylContact C-O 3.58Å; S394-V398 VanDerWaalsContact CA-O 3.3Å; S394-V398 WeakPolarHBondContact CA-O 3.29Å; L395-V398 PolarHBondContact N-O 3.24Å; L395-V398 PolarHBondContact O-N 3.34Å; D396-V398 VanDerWaalsContact C-N 3.31Å; D396-V398 PolarHBondContact O-N 3.34Å; V398-F400 HydrophobicContact CB-CE2 3.7Å; V398-F400 HydrophobicContact CB-CZ 4.06Å; V398-F400 HydrophobicContact CG1-CD2 4.34Å; V398-F400 HydrophobicContact CG1-CE1 4.24Å; V398-F400 HydrophobicContact CG1-CE2 3.59Å; V398-F400 HydrophobicContact CG1-CZ 3.52Å |
| 399 | I | 92.5 | Very high | 90.1 | Very high | 10 Ų | 10 | 62 Ų | 62 | 5% | 0.051 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92 | 129.5 | -177.1 | -50.9 | 160.4 | 0 | 0 | 0 | 110.3 | Y373 F378 C380 A381 L387 F392 | Y373-I399 HydrophobicContact CD1-CD1 3.95Å; Y373-I399 HydrophobicContact CD2-CD1 4.04Å; Y373-I399 HydrophobicContact CE1-CD1 3.51Å; Y373-I399 HydrophobicContact CE2-CD1 3.65Å; Y373-I399 HydrophobicContact CG-CD1 4.19Å; F378-I399 HydrophobicContact CD2-CD1 3.47Å; F378-I399 VanDerWaalsContact CD2-CD1 3.47Å; F378-I399 HydrophobicContact CE2-CD1 3.43Å; F378-I399 VanDerWaalsContact CE2-CD1 3.43Å; F378-I399 HydrophobicContact CE2-CG1 4.16Å; F378-I399 HydrophobicContact CE2-CG2 3.98Å; F378-I399 HydrophobicContact CZ-CD1 4.47Å; F378-I399 HydrophobicContact CZ-CG2 4Å; C380-I399 WeakPolarHBondContact CA-O 3.43Å; A381-I399 PolarHBondContact N-O 3.21Å; L387-I399 HydrophobicContact CD1-CG2 3.59Å; F392-I399 HydrophobicContact CB-CG2 3.95Å; F392-I399 HydrophobicContact CD2-CG2 4.18Å; F392-I399 HydrophobicContact CG-CG2 4.42Å |
| 400 | F | 93.5 | Very high | 89.9 | Confident | 20 Ų | 20 | 60.2 Ų | 60.2 | 9% | 0.088 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.8 | 154.8 | 175.1 | -62.1 | -82 | 0 | 0 | 0 | 111.2 | A381 T382 F392 A393 L395 V398 H404 Q408 | A381-F400 HydrophobicContact CB-CD1 4.34Å; A381-F400 HydrophobicContact CB-CE1 3.83Å; A381-F400 HydrophobicContact CB-CZ 4.3Å; T382-F400 WeakPolarHBondContact OG1-CD1 3.02Å; T382-F400 WeakPolarHBondContact OG1-CE1 3.39Å; F392-F400 CarbonylContact C-O 3.56Å; F392-F400 WeakPolarHBondContact CA-O 3.43Å; A393-F400 PolarHBondContact N-O 3.44Å; A393-F400 PolarHBondContact O-N 3.4Å; L395-F400 HydrophobicContact CB-CD2 4.12Å; L395-F400 HydrophobicContact CB-CE2 4Å; V398-F400 HydrophobicContact CB-CE2 3.7Å; V398-F400 HydrophobicContact CB-CZ 4.06Å; V398-F400 HydrophobicContact CG1-CD2 4.34Å; V398-F400 HydrophobicContact CG1-CE1 4.24Å; V398-F400 HydrophobicContact CG1-CE2 3.59Å; V398-F400 HydrophobicContact CG1-CZ 3.52Å; F400-H404 HydrophobicContact CD1-CB 4.4Å; F400-Q408 HydrophobicContact CD1-CG 4.17Å; F400-Q408 HydrophobicContact CE1-CG 3.87Å; F400-Q408 HydrophobicContact CZ-CG 4.23Å |
| 401 | C | 94.7 | Very high | 89.6 | Confident | 15 Ų | 15 | 64.4 Ų | 64.4 | 10% | 0.101 | 34% | 0.337 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.6 | 154.7 | 163.5 | 63.1 | 0 | 0 | 0 | 0 | 109.4 | C380 L387 P403 H404 Y405 | C380-C401 HydrophobicContact CB-CB 4.3Å; C380-C401 PolarHBondContact SG-N 3.29Å; C380-C401 VanDerWaalsContact SG-N 3.39Å; L387-C401 HydrophobicContact CD2-CB 3.56Å; C401-P403 VanDerWaalsContact C-CD 3.47Å; C401-P403 HydrophobicContact CB-CG 4.45Å; C401-H404 PolarHBondContact O-N 3.31Å; C401-H404 VanDerWaalsContact O-N 3.07Å; C401-H404 PolarHBondContact SG-ND1 3.14Å; C401-Y405 WeakPolarHBondContact O-CB 3.15Å; C401-Y405 PolarHBondContact O-N 3.06Å |
| 402 | K | 91.5 | Very high | 89 | Confident | 103 Ų | 103 | 64.3 Ų | 64.3 | 45% | 0.448 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -42.7 | -49.3 | 178.4 | -69.8 | 176.3 | 175.8 | 162.6 | 0 | 115.1 | G390 N391 Y405 I406 | G390-K402 VanDerWaalsContact O-CE 3.3Å; G390-K402 WeakPolarHBondContact O-CE 3.36Å; G390-K402 PolarHBondContact O-NZ 3.48Å; N391-K402 PolarHBondContact OD1-NZ 3.2Å; N391-K402 VanDerWaalsContact OD1-NZ 3.1Å; K402-Y405 PolarHBondContact O-N 3.14Å; K402-I406 WeakPolarHBondContact O-CG1 3.36Å; K402-I406 PolarHBondContact O-N 3.23Å |
| 403 | P | 92.5 | Very high | 87.9 | Confident | 83 Ų | 83 | 64 Ų | 64 | 54% | 0.539 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -67.5 | -41.6 | -179.7 | 25 | -33.3 | 0 | 0 | 0 | 113.1 | C401 I406 E407 | C401-P403 VanDerWaalsContact C-CD 3.47Å; C401-P403 HydrophobicContact CB-CG 4.45Å; P403-I406 PolarHBondContact O-N 3.33Å; P403-E407 PolarHBondContact O-N 3.17Å; P403-E407 VanDerWaalsContact O-N 3.08Å |
| 404 | H | 93.6 | Very high | 86.3 | Confident | 41 Ų | 41 | 66 Ų | 66 | 19% | 0.19 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -73.4 | -29.4 | 178 | -63.3 | 143 | 0 | 0 | 0 | 112.5 | C380 C383 F400 C401 I406 E407 Q408 | C380-H404 PolarHBondContact SG-ND1 2.86Å; C380-H404 VanDerWaalsContact SG-ND1 3.42Å; C383-H404 WeakPolarHBondContact CB-CE1 3.48Å; C383-H404 PolarHBondContact SG-CE1 3.2Å; F400-H404 HydrophobicContact CD1-CB 4.4Å; C401-H404 PolarHBondContact O-N 3.31Å; C401-H404 VanDerWaalsContact O-N 3.07Å; C401-H404 PolarHBondContact SG-ND1 3.14Å; H404-I406 VanDerWaalsContact C-N 3.32Å; H404-E407 IonicContact CD2-OE2 2.73Å; H404-E407 PolarHBondContact O-N 3.45Å; H404-Q408 VanDerWaalsContact O-CB 3.31Å; H404-Q408 WeakPolarHBondContact O-CB 3.29Å; H404-Q408 WeakPolarHBondContact O-CG 3.49Å; H404-Q408 PolarHBondContact O-N 2.87Å |
| 405 | Y | 92 | Very high | 84.5 | Confident | 68 Ų | 68 | 74.6 Ų | 74.6 | 27% | 0.267 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -60 | -47.2 | 172.6 | 175.3 | -95.8 | 0 | 0 | 0 | 110.6 | A393 L395 C401 K402 Q408 F409 | A393-Y405 HydrophobicContact CB-CD1 3.89Å; A393-Y405 HydrophobicContact CB-CD2 3.43Å; A393-Y405 VanDerWaalsContact CB-CD2 3.43Å; A393-Y405 HydrophobicContact CB-CE1 4.36Å; A393-Y405 HydrophobicContact CB-CE2 3.93Å; A393-Y405 HydrophobicContact CB-CG 3.4Å; A393-Y405 VanDerWaalsContact CB-CG 3.4Å; L395-Y405 HydrophobicContact CB-CD2 4.1Å; L395-Y405 HydrophobicContact CB-CE2 3.82Å; L395-Y405 HydrophobicContact CD1-CE2 4.16Å; L395-Y405 HydrophobicContact CG-CE2 4.49Å; C401-Y405 WeakPolarHBondContact O-CB 3.15Å; C401-Y405 PolarHBondContact O-N 3.06Å; K402-Y405 PolarHBondContact O-N 3.14Å; Y405-Q408 PolarHBondContact O-N 3.19Å; Y405-F409 WeakPolarHBondContact O-CB 3.47Å; Y405-F409 PolarHBondContact O-N 2.89Å |
| 406 | I | 89.6 | Confident | 83 | Confident | 68 Ų | 68 | 76.3 Ų | 76.3 | 35% | 0.349 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -57.9 | -55.6 | 176.1 | -69 | 168.2 | 0 | 0 | 0 | 108.7 | K402 P403 H404 Q408 F409 H410 Y416 | K402-I406 WeakPolarHBondContact O-CG1 3.36Å; K402-I406 PolarHBondContact O-N 3.23Å; P403-I406 PolarHBondContact O-N 3.33Å; H404-I406 VanDerWaalsContact C-N 3.32Å; I406-Q408 PolarHBondContact O-N 3.15Å; I406-F409 CarbonylContact O-C 3.58Å; I406-F409 WeakPolarHBondContact O-CA 3.35Å; I406-F409 WeakPolarHBondContact O-CB 3.39Å; I406-F409 PolarHBondContact O-N 3.14Å; I406-H410 VanDerWaalsContact C-CD2 3.45Å; I406-H410 WeakPolarHBondContact CG2-CD2 3.42Å; I406-H410 WeakPolarHBondContact CG2-NE2 3.38Å; I406-H410 PolarHBondContact O-CD2 3.1Å; I406-H410 PolarHBondContact O-N 3.17Å; I406-Y416 PolarHBondContact O-OH 3.12Å |
| 407 | E | 88.8 | Confident | 81.7 | Confident | 96 Ų | 96 | 76.8 Ų | 76.8 | 45% | 0.449 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -54.2 | -47 | 179.4 | -172.5 | 179.4 | -173.2 | 0 | 0 | 113.7 | P403 H404 F409 H410 M411 | P403-E407 PolarHBondContact O-N 3.17Å; P403-E407 VanDerWaalsContact O-N 3.08Å; H404-E407 IonicContact CD2-OE2 2.73Å; H404-E407 PolarHBondContact O-N 3.45Å; E407-F409 VanDerWaalsContact C-N 3.34Å; E407-H410 PolarHBondContact O-N 3.43Å; E407-M411 PolarHBondContact O-N 2.89Å |
| 408 | Q | 87.1 | Confident | 80.2 | Confident | 70 Ų | 70 | 83 Ų | 83 | 33% | 0.327 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -66.7 | -36.5 | 177.3 | -68.6 | -62.9 | -36 | 0 | 0 | 112 | L395 F400 H404 Y405 I406 M411 S412 | L395-Q408 HydrophobicContact CD2-CB 4.48Å; F400-Q408 HydrophobicContact CD1-CG 4.17Å; F400-Q408 HydrophobicContact CE1-CG 3.87Å; F400-Q408 HydrophobicContact CZ-CG 4.23Å; H404-Q408 VanDerWaalsContact O-CB 3.31Å; H404-Q408 WeakPolarHBondContact O-CB 3.29Å; H404-Q408 WeakPolarHBondContact O-CG 3.49Å; H404-Q408 PolarHBondContact O-N 2.87Å; Y405-Q408 PolarHBondContact O-N 3.19Å; I406-Q408 PolarHBondContact O-N 3.15Å; Q408-M411 PolarHBondContact O-N 3.05Å; Q408-S412 WeakPolarHBondContact O-CB 3.42Å; Q408-S412 PolarHBondContact O-N 2.8Å; Q408-S412 PolarHBondContact O-OG 3.11Å |
| 409 | F | 86.3 | Confident | 78.5 | Confident | 79 Ų | 79 | 89.4 Ų | 89.4 | 35% | 0.346 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -67.3 | -37.9 | 174.2 | -166.8 | -106.5 | 0 | 0 | 0 | 110.9 | L395 Y405 I406 E407 M411 S412 A413 Y416 | L395-F409 HydrophobicContact CD1-CD2 4.26Å; Y405-F409 WeakPolarHBondContact O-CB 3.47Å; Y405-F409 PolarHBondContact O-N 2.89Å; I406-F409 CarbonylContact O-C 3.58Å; I406-F409 WeakPolarHBondContact O-CA 3.35Å; I406-F409 WeakPolarHBondContact O-CB 3.39Å; I406-F409 PolarHBondContact O-N 3.14Å; E407-F409 VanDerWaalsContact C-N 3.34Å; F409-M411 VanDerWaalsContact C-N 3.32Å; F409-M411 PolarHBondContact O-N 3.04Å; F409-S412 WeakPolarHBondContact CA-OG 3.5Å; F409-S412 PolarHBondContact O-N 3.39Å; F409-S412 PolarHBondContact O-OG 3.18Å; F409-A413 HydrophobicContact CE1-CB 4.21Å; F409-A413 HydrophobicContact CE2-CB 4.33Å; F409-A413 HydrophobicContact CZ-CB 4.11Å; F409-A413 WeakPolarHBondContact O-CA 3.48Å; F409-A413 WeakPolarHBondContact O-CB 3.43Å; F409-A413 PolarHBondContact O-N 2.78Å; F409-Y416 HydrophobicContact CB-CE1 4.32Å; F409-Y416 HydrophobicContact CD1-CD1 4.19Å; F409-Y416 AromaticContact CD1-CE1 3.31Å; F409-Y416 HydrophobicContact CD1-CE1 3.31Å; F409-Y416 AromaticContact CD1-CZ 3.56Å; F409-Y416 WeakPolarHBondContact CD1-OH 3.35Å; F409-Y416 HydrophobicContact CE1-CD1 4.43Å; F409-Y416 AromaticContact CE1-CE1 3.96Å; F409-Y416 HydrophobicContact CE1-CE1 3.96Å; F409-Y416 HydrophobicContact CG-CE1 4.17Å |
| 410 | H | 82.3 | Confident | 76.7 | Confident | 57 Ų | 57 | 96.8 Ų | 96.8 | 26% | 0.264 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -65.2 | -36.9 | 175.1 | -73.8 | -95.9 | 0 | 0 | 0 | 111.9 | I406 E407 Y416 | I406-H410 VanDerWaalsContact C-CD2 3.45Å; I406-H410 WeakPolarHBondContact CG2-CD2 3.42Å; I406-H410 WeakPolarHBondContact CG2-NE2 3.38Å; I406-H410 PolarHBondContact O-CD2 3.1Å; I406-H410 PolarHBondContact O-N 3.17Å; E407-H410 PolarHBondContact O-N 3.43Å; H410-Y416 HydrophobicContact CB-CD1 4.4Å; H410-Y416 HydrophobicContact CB-CE1 3.77Å; H410-Y416 AromaticContact CD2-CE1 3.77Å; H410-Y416 AromaticContact CD2-CE2 3.57Å; H410-Y416 AromaticContact CD2-CZ 3.11Å; H410-Y416 PolarHBondContact CD2-OH 2.9Å; H410-Y416 AromaticContact CE1-CD2 3.25Å; H410-Y416 WeakPolarHBondContact CE1-CD2 3.4Å; H410-Y416 AromaticContact CE1-CE1 3.92Å; H410-Y416 AromaticContact CE1-CE2 2.94Å; H410-Y416 WeakPolarHBondContact CE1-CE2 3.37Å; H410-Y416 AromaticContact CE1-CG 3.87Å; H410-Y416 AromaticContact CE1-CZ 3.29Å; H410-Y416 PolarHBondContact CE1-O 2.82Å; H410-Y416 AromaticContact CG-CD1 3.91Å; H410-Y416 AromaticContact CG-CE1 3.28Å; H410-Y416 AromaticContact CG-CE2 3.72Å; H410-Y416 AromaticContact CG-CZ 3.13Å; H410-Y416 VanDerWaalsContact N-CE1 3.29Å; H410-Y416 PolarHBondContact N-OH 3.3Å; H410-Y416 AromaticContact ND1-CD1 3.61Å; H410-Y416 AromaticContact ND1-CD2 3.54Å; H410-Y416 AromaticContact ND1-CE1 3.43Å; H410-Y416 WeakPolarHBondContact ND1-CE1 3.39Å; H410-Y416 AromaticContact ND1-CE2 3.37Å; H410-Y416 WeakPolarHBondContact ND1-CE2 3.14Å; H410-Y416 AromaticContact ND1-CG 3.66Å; H410-Y416 AromaticContact ND1-CZ 3.28Å; H410-Y416 VanDerWaalsContact ND1-CZ 3.28Å; H410-Y416 PolarHBondContact ND1-O 2.79Å; H410-Y416 AromaticContact NE2-CD2 3.87Å; H410-Y416 AromaticContact NE2-CE2 3.06Å; H410-Y416 WeakPolarHBondContact NE2-CE2 3.43Å; H410-Y416 AromaticContact NE2-CZ 3.19Å; H410-Y416 PolarHBondContact NE2-OH 3.19Å |
| 411 | M | 80.7 | Confident | 74.6 | Confident | 144 Ų | 144 | 100.2 Ų | 100.2 | 71% | 0.709 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -71.7 | -34.6 | -179.3 | -151.7 | 69.8 | 67.5 | 0 | 0 | 112.2 | E407 Q408 F409 | E407-M411 PolarHBondContact O-N 2.89Å; Q408-M411 PolarHBondContact O-N 3.05Å; F409-M411 VanDerWaalsContact C-N 3.32Å; F409-M411 PolarHBondContact O-N 3.04Å |
| 412 | S | 77 | Confident | 72.3 | Confident | 82 Ų | 82 | 105.9 Ų | 105.9 | 57% | 0.573 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -88.9 | -42.6 | -178.4 | 51.1 | 0 | 0 | 0 | 0 | 113.1 | Q408 F409 G414 | Q408-S412 WeakPolarHBondContact O-CB 3.42Å; Q408-S412 PolarHBondContact O-N 2.8Å; Q408-S412 PolarHBondContact O-OG 3.11Å; F409-S412 WeakPolarHBondContact CA-OG 3.5Å; F409-S412 PolarHBondContact O-N 3.39Å; F409-S412 PolarHBondContact O-OG 3.18Å; S412-G414 PolarHBondContact O-N 3Å |
| 413 | A | 70 | Confident | 70.1 | Confident | 40 Ų | 40 | 109.5 Ų | 109.5 | 33% | 0.331 | 54% | 0.544 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.8 | 78.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | F409 R415 | F409-A413 HydrophobicContact CE1-CB 4.21Å; F409-A413 HydrophobicContact CE2-CB 4.33Å; F409-A413 HydrophobicContact CZ-CB 4.11Å; F409-A413 WeakPolarHBondContact O-CA 3.48Å; F409-A413 WeakPolarHBondContact O-CB 3.43Å; F409-A413 PolarHBondContact O-N 2.78Å; A413-R415 PolarHBondContact O-N 2.83Å |
| 414 | G | 58 | Low | 68.1 | Low | 64 Ų | 64 | 113 Ų | 113 | 66% | 0.66 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -33.5 | 127.2 | -171.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | S412 | S412-G414 PolarHBondContact O-N 3Š|
| 415 | R | 53.8 | Low | 65.9 | Low | 247 Ų | 247 | 117 Ų | 117 | 93% | 0.932 | 59% | 0.586 | S | S | * | * | trans | 49 | 72.8 | 168 | -53.3 | -171.4 | -139 | -156.5 | 4.3 | 115.7 | A413 | A413-R415 PolarHBondContact O-N 2.83Š| ||
| 416 | Y | 56.9 | Low | 63.9 | Low | 68 Ų | 68 | 117.6 Ų | 117.6 | 27% | 0.267 | 60% | 0.604 | S | S | . | * | trans | -101.4 | 119.6 | 149.7 | 68.4 | -86 | 0 | 0 | 0 | 109.6 | I406 F409 H410 Y418 | I406-Y416 PolarHBondContact O-OH 3.12Å; F409-Y416 HydrophobicContact CB-CE1 4.32Å; F409-Y416 HydrophobicContact CD1-CD1 4.19Å; F409-Y416 AromaticContact CD1-CE1 3.31Å; F409-Y416 HydrophobicContact CD1-CE1 3.31Å; F409-Y416 AromaticContact CD1-CZ 3.56Å; F409-Y416 WeakPolarHBondContact CD1-OH 3.35Å; F409-Y416 HydrophobicContact CE1-CD1 4.43Å; F409-Y416 AromaticContact CE1-CE1 3.96Å; F409-Y416 HydrophobicContact CE1-CE1 3.96Å; F409-Y416 HydrophobicContact CG-CE1 4.17Å; H410-Y416 HydrophobicContact CB-CD1 4.4Å; H410-Y416 HydrophobicContact CB-CE1 3.77Å; H410-Y416 AromaticContact CD2-CE1 3.77Å; H410-Y416 AromaticContact CD2-CE2 3.57Å; H410-Y416 AromaticContact CD2-CZ 3.11Å; H410-Y416 PolarHBondContact CD2-OH 2.9Å; H410-Y416 AromaticContact CE1-CD2 3.25Å; H410-Y416 WeakPolarHBondContact CE1-CD2 3.4Å; H410-Y416 AromaticContact CE1-CE1 3.92Å; H410-Y416 AromaticContact CE1-CE2 2.94Å; H410-Y416 WeakPolarHBondContact CE1-CE2 3.37Å; H410-Y416 AromaticContact CE1-CG 3.87Å; H410-Y416 AromaticContact CE1-CZ 3.29Å; H410-Y416 PolarHBondContact CE1-O 2.82Å; H410-Y416 AromaticContact CG-CD1 3.91Å; H410-Y416 AromaticContact CG-CE1 3.28Å; H410-Y416 AromaticContact CG-CE2 3.72Å; H410-Y416 AromaticContact CG-CZ 3.13Å; H410-Y416 VanDerWaalsContact N-CE1 3.29Å; H410-Y416 PolarHBondContact N-OH 3.3Å; H410-Y416 AromaticContact ND1-CD1 3.61Å; H410-Y416 AromaticContact ND1-CD2 3.54Å; H410-Y416 AromaticContact ND1-CE1 3.43Å; H410-Y416 WeakPolarHBondContact ND1-CE1 3.39Å; H410-Y416 AromaticContact ND1-CE2 3.37Å; H410-Y416 WeakPolarHBondContact ND1-CE2 3.14Å; H410-Y416 AromaticContact ND1-CG 3.66Å; H410-Y416 AromaticContact ND1-CZ 3.28Å; H410-Y416 VanDerWaalsContact ND1-CZ 3.28Å; H410-Y416 PolarHBondContact ND1-O 2.79Å; H410-Y416 AromaticContact NE2-CD2 3.87Å; H410-Y416 AromaticContact NE2-CE2 3.06Å; H410-Y416 WeakPolarHBondContact NE2-CE2 3.43Å; H410-Y416 AromaticContact NE2-CZ 3.19Å; H410-Y416 PolarHBondContact NE2-OH 3.19Å; Y416-Y418 PolarHBondContact O-N 2.89Å | ||
| 417 | E | 58.8 | Low | 62.1 | Low | 167 Ų | 167 | 119.7 Ų | 119.7 | 78% | 0.78 | 62% | 0.622 | S | S | * | * | trans | -76.4 | 108.7 | 167 | -79.1 | -173.1 | 159.4 | 0 | 0 | 108.2 | R419 | E417-R419 PolarHBondContact O-N 3.25Š| ||
| 418 | Y | 54.7 | Low | 59.7 | Low | 155 Ų | 155 | 123.9 Ų | 123.9 | 61% | 0.608 | 65% | 0.647 | S | S | * | * | trans | -76.3 | 93.5 | 167.6 | -174.5 | -109.2 | 0 | 0 | 0 | 108.4 | Y416 Q420 | Y416-Y418 PolarHBondContact O-N 2.89Å; Y418-Q420 HydrophobicContact CD1-CG 3.57Å; Y418-Q420 HydrophobicContact CE1-CG 3.33Å; Y418-Q420 PolarHBondContact O-N 2.81Å | ||
| 419 | R | 54.7 | Low | 57.8 | Low | 201 Ų | 201 | 124.9 Ų | 124.9 | 76% | 0.758 | 66% | 0.661 | S | S | * | * | trans | -65.9 | 97.3 | 168.2 | -80.1 | -179.2 | 121.3 | 115.2 | -5 | 108.6 | E417 S421 | E417-R419 PolarHBondContact O-N 3.25Å; R419-S421 PolarHBondContact O-N 3.11Å | ||
| 420 | Q | 53.4 | Low | 56 | Low | 164 Ų | 164 | 126.3 Ų | 126.3 | 77% | 0.766 | 68% | 0.682 | S | S | * | * | trans | -67 | 75.6 | 154.7 | -73.1 | 179.5 | 9.8 | 0 | 0 | 108.2 | Y418 L422 | Y418-Q420 HydrophobicContact CD1-CG 3.57Å; Y418-Q420 HydrophobicContact CE1-CG 3.33Å; Y418-Q420 PolarHBondContact O-N 2.81Å; Q420-L422 PolarHBondContact O-N 3.5Å | ||
| 421 | S | 49.2 | Very low | 54.6 | Low | 92 Ų | 92 | 129 Ų | 129 | 64% | 0.643 | 70% | 0.702 | S | S | * | * | trans | -71.9 | 100 | 165.5 | 51.6 | 0 | 0 | 0 | 0 | 108.4 | R419 | R419-S421 PolarHBondContact O-N 3.11Š| ||
| 422 | L | 47.5 | Very low | 52.9 | Low | 135 Ų | 135 | 131.9 Ų | 131.9 | 71% | 0.707 | 71% | 0.711 | S | S | * | * | trans | 69.4 | 73.7 | 137.2 | -65.1 | 145.3 | 0 | 0 | 0 | 116.8 | Q420 Q424 | Q420-L422 PolarHBondContact O-N 3.5Å; L422-Q424 HydrophobicContact CD2-CB 4.44Å | ||
| 423 | N | 45.2 | Very low | 51.7 | Low | 178 Ų | 178 | 138.9 Ų | 138.9 | 95% | 0.952 | 72% | 0.724 | S | S | * | * | trans | -95.3 | 48.2 | 139.8 | -98.3 | -14.6 | 0 | 0 | 0 | 110 | ||||
| 424 | Q | 51.4 | Low | 51.1 | Low | 158 Ų | 158 | 142.9 Ų | 142.9 | 74% | 0.738 | 75% | 0.745 | S | S | * | * | trans | -106.3 | 91.4 | 159.9 | -112.9 | 155.7 | 3.1 | 0 | 0 | 106.7 | L422 A426 | L422-Q424 HydrophobicContact CD2-CB 4.44Å; Q424-A426 PolarHBondContact O-N 2.74Å | ||
| 425 | S | 47.3 | Very low | 50.4 | Low | 125 Ų | 125 | 149.2 Ų | 149.2 | 87% | 0.874 | 76% | 0.757 | S | S | * | * | trans | -62 | 85.3 | 161.8 | 54 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 426 | A | 49.2 | Very low | 50.1 | Low | 79 Ų | 79 | 140.9 Ų | 140.9 | 65% | 0.653 | 75% | 0.748 | S | S | * | * | trans | -104.4 | 131.3 | 159 | 0 | 0 | 0 | 0 | 0 | 107.4 | Q424 L428 | Q424-A426 PolarHBondContact O-N 2.74Å; A426-L428 PolarHBondContact O-N 3.48Å | ||
| 427 | P | 50.9 | Low | 49.5 | Very low | 112 Ų | 112 | 146.3 Ų | 146.3 | 73% | 0.727 | 78% | 0.775 | S | S | * | * | trans | -67.4 | 134.2 | -169.1 | 26.5 | -32 | 0 | 0 | 0 | 111.3 | S429 | P427-S429 PolarHBondContact O-N 3.22Š| ||
| 428 | L | 40 | Very low | 48.9 | Very low | 184 Ų | 184 | 153.1 Ų | 153.1 | 96% | 0.963 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -64.5 | 82.9 | 165.2 | -72.3 | 172.2 | 0 | 0 | 0 | 109.4 | A426 | A426-L428 PolarHBondContact O-N 3.48Š|
| 429 | S | 46.2 | Very low | 48.6 | Very low | 91 Ų | 91 | 153.1 Ų | 153.1 | 64% | 0.636 | 81% | 0.806 | S | S | * | * | trans | -169.7 | 71.3 | 167.8 | 62.7 | 0 | 0 | 0 | 0 | 112.3 | P427 | P427-S429 PolarHBondContact O-N 3.22Š| ||
| 430 | S | 49.5 | Very low | 48.3 | Very low | 110 Ų | 110 | 150.5 Ų | 150.5 | 77% | 0.769 | 81% | 0.808 | S | S | * | * | trans | -170.7 | 112.3 | 151.1 | 39.5 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 431 | V | 51.9 | Low | 48 | Very low | 113 Ų | 113 | 149.8 Ų | 149.8 | 69% | 0.685 | 81% | 0.811 | S | S | * | * | trans | 78 | 86.7 | 138.8 | -169.4 | 0 | 0 | 0 | 0 | 115.6 | R433 | V431-R433 HydrophobicContact CG1-CB 4Å; V431-R433 PolarHBondContact O-N 3.49Å | ||
| 432 | F | 44.5 | Very low | 47.9 | Very low | 205 Ų | 205 | 153.2 Ų | 153.2 | 90% | 0.899 | 82% | 0.82 | S | S | * | * | trans | -45.2 | 114.7 | 133.8 | -87.3 | -99.4 | 0 | 0 | 0 | 108.9 | ||||
| 433 | R | 53.3 | Low | 48 | Very low | 229 Ų | 229 | 154.3 Ų | 154.3 | 86% | 0.864 | 83% | 0.828 | S | S | * | * | trans | -129.8 | 100 | 156.6 | -140.1 | 173.5 | -177.7 | 153.1 | -0.4 | 107.8 | V431 Q435 | V431-R433 HydrophobicContact CG1-CB 4Å; V431-R433 PolarHBondContact O-N 3.49Å; R433-Q435 PolarHBondContact O-N 3.03Å | ||
| 434 | V | 55.7 | Low | 48.1 | Very low | 124 Ų | 124 | 152.7 Ų | 152.7 | 75% | 0.752 | 82% | 0.819 | S | S | * | * | trans | -58.1 | 121.5 | 168 | 177 | 0 | 0 | 0 | 0 | 107.6 | G436 | V434-G436 PolarHBondContact O-N 3.17Š| ||
| 435 | Q | 44 | Very low | 47.9 | Very low | 196 Ų | 196 | 152.4 Ų | 152.4 | 92% | 0.916 | 83% | 0.825 | S | S | * | * | trans | -78.9 | 108.5 | 158.8 | -77.8 | 179.3 | -32 | 0 | 0 | 106.5 | R433 | R433-Q435 PolarHBondContact O-N 3.03Š| ||
| 436 | G | 48.5 | Very low | 48 | Very low | 72 Ų | 72 | 154.5 Ų | 154.5 | 74% | 0.742 | 82% | 0.821 | S | S | * | * | trans | -94.8 | 117.9 | 162.8 | 0 | 0 | 0 | 0 | 0 | 108 | V434 | V434-G436 PolarHBondContact O-N 3.17Š| ||
| 437 | E | 43.8 | Very low | 47.9 | Very low | 182 Ų | 182 | 160.8 Ų | 160.8 | 85% | 0.85 | 84% | 0.835 | S | S | * | * | trans | -70.4 | 131.9 | 163.7 | -62.7 | 171.8 | 145.2 | 0 | 0 | 108.8 | ||||
| 438 | Y | 46 | Very low | 47.6 | Very low | 311 Ų | 311 | 165.2 Ų | 165.2 | 100% | 1.22 | 85% | 0.845 | S | S | * | * | trans | -178 | 0 | 140.2 | -95.9 | -67 | 0 | 0 | 0 | 109.7 |
Retrieved 438 of 438 residues in 57.7 ms
(Link to these results)