| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 41.3 | Very low | 41.7 | Very low | 236 Ų | 236 | 160.4 Ų | 160.4 | 100% | 1.163 | 85% | 0.853 | S | S | * | * | 0 | 117.4 | 0 | -86.5 | 165.9 | 172.3 | 0 | 0 | 106.9 | |||||
| 2 | E | 45.5 | Very low | 41.1 | Very low | 187 Ų | 187 | 155 Ų | 155 | 87% | 0.874 | 83% | 0.831 | S | S | * | * | trans | -63 | 144.7 | 162.6 | -82.7 | 161.7 | 99.6 | 0 | 0 | 110.6 | ||||
| 3 | N | 46.1 | Very low | 40.8 | Very low | 154 Ų | 154 | 157.2 Ų | 157.2 | 82% | 0.824 | 83% | 0.833 | S | S | * | * | trans | -144.4 | 104 | 146.7 | -16 | 15.8 | 0 | 0 | 0 | 108.6 | ||||
| 4 | S | 42.7 | Very low | 40.6 | Very low | 95 Ų | 95 | 153.1 Ų | 153.1 | 66% | 0.664 | 82% | 0.824 | S | S | * | * | trans | -73.9 | 138 | 163.1 | 149.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 5 | C | 45.4 | Very low | 40.1 | Very low | 136 Ų | 136 | 150.9 Ų | 150.9 | 92% | 0.919 | 82% | 0.818 | S | S | * | * | trans | -135.8 | 107 | 153.4 | -78.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 6 | K | 46.8 | Very low | 39.9 | Very low | 187 Ų | 187 | 151.9 Ų | 151.9 | 81% | 0.813 | 82% | 0.821 | S | S | * | * | trans | -80.2 | 150.5 | 163.6 | -90.7 | 170.1 | 167.4 | 175.8 | 0 | 109.8 | ||||
| 7 | G | 34.2 | Very low | 39.7 | Very low | 79 Ų | 79 | 153.7 Ų | 153.7 | 81% | 0.814 | 82% | 0.82 | S | S | * | * | trans | -161.4 | 104.9 | 159.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 8 | N | 39 | Very low | 39.6 | Very low | 132 Ų | 132 | 152.3 Ų | 152.3 | 71% | 0.706 | 82% | 0.818 | S | S | * | * | trans | -83.7 | 150 | -176.4 | -48.5 | -61.7 | 0 | 0 | 0 | 110.8 | ||||
| 9 | E | 41.3 | Very low | 39.1 | Very low | 201 Ų | 201 | 152 Ų | 152 | 94% | 0.939 | 82% | 0.816 | S | S | * | * | trans | -143.5 | 119.1 | 144.2 | -62.1 | -170.5 | 147.8 | 0 | 0 | 109.2 | ||||
| 10 | E | 41.3 | Very low | 39.2 | Very low | 184 Ų | 184 | 153 Ų | 153 | 86% | 0.86 | 82% | 0.815 | S | S | * | * | trans | -72.3 | 160.4 | 173.5 | -67.3 | 165 | 79.3 | 0 | 0 | 111 | ||||
| 11 | Q | 35.3 | Very low | 39 | Very low | 173 Ų | 173 | 155 Ų | 155 | 81% | 0.808 | 82% | 0.82 | S | S | * | * | 177.2 | 107.2 | 116.1 | -169.7 | 149.1 | 38 | 0 | 0 | 113 | |||||
| 12 | T | 34.5 | Very low | 38.8 | Very low | 96 Ų | 96 | 152.2 Ų | 152.2 | 59% | 0.589 | 80% | 0.804 | S | S | * | * | trans | 62.5 | 116.8 | 137.9 | 62.1 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 13 | Q | 37.3 | Very low | 39.2 | Very low | 184 Ų | 184 | 148 Ų | 148 | 86% | 0.86 | 79% | 0.793 | S | S | * | * | 85.5 | 140.2 | 101.5 | -72.6 | -178.6 | -17.3 | 0 | 0 | 112.4 | |||||
| 14 | S | 37.9 | Very low | 39 | Very low | 100 Ų | 100 | 146.7 Ų | 146.7 | 70% | 0.699 | 79% | 0.793 | S | S | * | * | cis | -165.2 | 150 | 16.2 | 52.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 15 | T | 33.4 | Very low | 39.1 | Very low | 120 Ų | 120 | 148.3 Ų | 148.3 | 74% | 0.736 | 80% | 0.798 | S | S | * | * | trans | 0.7 | 135.1 | 143.2 | 45.3 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 16 | L | 35.8 | Very low | 38.6 | Very low | 167 Ų | 167 | 149.4 Ų | 149.4 | 87% | 0.874 | 79% | 0.79 | S | S | * | * | -178.9 | 161.1 | 94 | -130.4 | 116.5 | 0 | 0 | 0 | 112 | |||||
| 17 | K | 37.9 | Very low | 38 | Very low | 182 Ų | 182 | 147.7 Ų | 147.7 | 79% | 0.791 | 79% | 0.785 | S | S | * | * | trans | -84.4 | 162.5 | -175 | -70.4 | 179.4 | 166.4 | -176.4 | 0 | 113.6 | ||||
| 18 | T | 36.8 | Very low | 38.4 | Very low | 128 Ų | 128 | 154.5 Ų | 154.5 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | trans | 42.7 | 116.7 | 140.3 | -53.1 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 19 | D | 30.6 | Very low | 38.7 | Very low | 147 Ų | 147 | 153.2 Ų | 153.2 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | -170.3 | 159.1 | 124.2 | -150.7 | -147.8 | 0 | 0 | 0 | 112.6 | |||||
| 20 | E | 40.6 | Very low | 38.2 | Very low | 172 Ų | 172 | 150.9 Ų | 150.9 | 80% | 0.804 | 78% | 0.776 | S | S | * | * | trans | -48.5 | 147.1 | 174.9 | -68 | -159.4 | 96.4 | 0 | 0 | 116.4 | ||||
| 21 | E | 35.2 | Very low | 37.9 | Very low | 196 Ų | 196 | 148 Ų | 148 | 92% | 0.916 | 77% | 0.766 | S | S | * | * | trans | -165.3 | 116.2 | 133.2 | -125.2 | -173.3 | 105.6 | 0 | 0 | 111.6 | ||||
| 22 | Q | 36.8 | Very low | 37.8 | Very low | 177 Ų | 177 | 147.1 Ų | 147.1 | 83% | 0.827 | 76% | 0.762 | S | S | * | * | trans | -105.8 | 161.6 | 148.2 | -141.4 | 175.4 | -24 | 0 | 0 | 105.4 | ||||
| 23 | P | 55 | Low | 37.5 | Very low | 97 Ų | 97 | 148 Ų | 148 | 63% | 0.63 | 77% | 0.771 | S | S | * | * | cis | -145.3 | -156.1 | 19.4 | 38.1 | -10.9 | 0 | 0 | 0 | 114 | ||||
| 24 | P | 42.1 | Very low | 37.2 | Very low | 127 Ų | 127 | 144.1 Ų | 144.1 | 83% | 0.825 | 76% | 0.764 | S | S | * | * | -137.7 | 145.3 | 75.4 | 34.1 | -15.9 | 0 | 0 | 0 | 115.5 | |||||
| 25 | V | 44.2 | Very low | 37.3 | Very low | 129 Ų | 129 | 147.3 Ų | 147.3 | 78% | 0.782 | 77% | 0.768 | S | S | * | * | trans | -90.4 | 131 | 159 | 164 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 26 | E | 35.1 | Very low | 37.4 | Very low | 160 Ų | 160 | 149.8 Ų | 149.8 | 75% | 0.748 | 77% | 0.771 | S | S | * | * | trans | -149.3 | 134.5 | 153.2 | -74 | -149.5 | 141.7 | 0 | 0 | 107.1 | ||||
| 27 | Q | 33.1 | Very low | 37.8 | Very low | 150 Ų | 150 | 150.2 Ų | 150.2 | 70% | 0.701 | 77% | 0.768 | S | S | * | * | cis | -161.3 | 137.7 | -1.8 | -98.5 | 164.8 | 9.6 | 0 | 0 | 105.5 | ||||
| 28 | Y | 42.4 | Very low | 37.7 | Very low | 223 Ų | 223 | 150.4 Ų | 150.4 | 88% | 0.875 | 77% | 0.772 | S | S | * | * | trans | -76.3 | 158.1 | 158.7 | -99.3 | -97.1 | 0 | 0 | 0 | 109.5 | ||||
| 29 | P | 45.6 | Very low | 37.9 | Very low | 104 Ų | 104 | 150 Ų | 150 | 68% | 0.675 | 78% | 0.775 | S | S | * | * | -140.2 | 161 | 112.9 | 28.4 | -10.4 | 0 | 0 | 0 | 110.6 | |||||
| 30 | E | 30.5 | Very low | 38.5 | Very low | 153 Ų | 153 | 148 Ų | 148 | 72% | 0.715 | 77% | 0.772 | S | S | * | * | cis | -162.6 | 125.9 | 10.8 | -117.4 | 163.9 | 121.1 | 0 | 0 | 103.3 | ||||
| 31 | N | 35.4 | Very low | 38.6 | Very low | 122 Ų | 122 | 148.9 Ų | 148.9 | 65% | 0.652 | 78% | 0.776 | S | S | * | * | 66 | 132.6 | 100.7 | -68.7 | -16.2 | 0 | 0 | 0 | 113.6 | |||||
| 32 | Q | 34 | Very low | 38.9 | Very low | 155 Ų | 155 | 146 Ų | 146 | 72% | 0.724 | 77% | 0.767 | S | S | * | * | cis | -178.9 | 170.1 | 15.7 | -111.6 | 172.1 | 72.8 | 0 | 0 | 107.3 | ||||
| 33 | C | 26.7 | Very low | 39 | Very low | 116 Ų | 116 | 144.5 Ų | 144.5 | 78% | 0.784 | 76% | 0.764 | S | S | * | * | trans | 76.5 | 134.9 | 160.6 | -84.6 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 34 | S | 32.2 | Very low | 38.7 | Very low | 102 Ų | 102 | 144.8 Ų | 144.8 | 71% | 0.713 | 77% | 0.769 | S | S | * | * | cis | -166.2 | 145.9 | 5.8 | 34.1 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 35 | E | 40.6 | Very low | 38.9 | Very low | 166 Ų | 166 | 143.9 Ų | 143.9 | 78% | 0.776 | 77% | 0.765 | S | S | * | * | trans | -54.4 | 173.5 | 154.3 | 52.8 | -135 | 101.9 | 0 | 0 | 112.3 | ||||
| 36 | E | 35.4 | Very low | 39 | Very low | 173 Ų | 173 | 145.7 Ų | 145.7 | 81% | 0.808 | 77% | 0.765 | S | S | * | * | trans | 101.6 | 99.1 | 169.9 | -46 | -163.7 | 169.3 | 0 | 0 | 116.4 | ||||
| 37 | E | 44.5 | Very low | 39.5 | Very low | 175 Ų | 175 | 146.3 Ų | 146.3 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | 47.4 | 119.9 | 128.9 | -45.7 | -139.2 | 128.5 | 0 | 0 | 118.7 | |||||
| 38 | Q | 34.7 | Very low | 40.2 | Very low | 186 Ų | 186 | 148.2 Ų | 148.2 | 87% | 0.869 | 78% | 0.777 | S | S | * | * | 165 | 148.9 | 118.5 | -88.7 | 166 | 8.7 | 0 | 0 | 111.4 | |||||
| 39 | S | 40.7 | Very low | 40.2 | Very low | 120 Ų | 120 | 143.2 Ų | 143.2 | 84% | 0.839 | 78% | 0.775 | S | S | * | * | trans | 81.7 | 116.4 | 159.1 | -130.1 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 40 | S | 43.9 | Very low | 40.5 | Very low | 105 Ų | 105 | 142.7 Ų | 142.7 | 73% | 0.734 | 77% | 0.773 | S | S | * | * | cis | -165.5 | 119.6 | 24.5 | 38.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 41 | E | 42.4 | Very low | 41.5 | Very low | 190 Ų | 190 | 143.7 Ų | 143.7 | 89% | 0.888 | 78% | 0.778 | S | S | * | * | trans | -71.4 | 116.6 | 150.1 | -42.7 | 175.6 | 119 | 0 | 0 | 106 | ||||
| 42 | D | 41.2 | Very low | 42.2 | Very low | 135 Ų | 135 | 145.1 Ų | 145.1 | 72% | 0.722 | 78% | 0.781 | S | S | * | * | trans | -169.1 | 99.8 | 148.5 | -98.4 | -39.3 | 0 | 0 | 0 | 107.3 | ||||
| 43 | L | 38.5 | Very low | 42.8 | Very low | 146 Ų | 146 | 145.2 Ų | 145.2 | 76% | 0.764 | 78% | 0.781 | S | S | * | * | 69.4 | 104.4 | 100.1 | -67.2 | -173.3 | 0 | 0 | 0 | 113.4 | |||||
| 44 | S | 49.5 | Very low | 44.1 | Very low | 104 Ų | 104 | 148.1 Ų | 148.1 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | 33.7 | 104.9 | 120.5 | -175.2 | 0 | 0 | 0 | 0 | 116.1 | |||||
| 45 | S | 46.3 | Very low | 45.6 | Very low | 107 Ų | 107 | 150.2 Ų | 150.2 | 75% | 0.748 | 78% | 0.777 | S | S | * | * | trans | -138.6 | 96.4 | 146.9 | -62 | 0 | 0 | 0 | 0 | 107.5 | E47 | S45-E47 PolarHBondContact O-N 3.11Š| ||
| 46 | E | 46.3 | Very low | 46.5 | Very low | 168 Ų | 168 | 145.6 Ų | 145.6 | 79% | 0.785 | 76% | 0.762 | S | S | * | * | trans | -61.7 | 109.4 | 155.2 | -62.2 | -150.5 | 101.7 | 0 | 0 | 107.2 | ||||
| 47 | E | 46.5 | Very low | 47.7 | Very low | 172 Ų | 172 | 145.9 Ų | 145.9 | 80% | 0.804 | 76% | 0.763 | S | S | * | * | trans | -116.3 | 92 | 162.5 | -69.2 | -78.6 | 98.7 | 0 | 0 | 106 | S45 S49 | S45-E47 PolarHBondContact O-N 3.11Å; E47-S49 VanDerWaalsContact C-N 3.3Å; E47-S49 PolarHBondContact O-N 2.86Å | ||
| 48 | Q | 46.2 | Very low | 48.5 | Very low | 190 Ų | 190 | 146.4 Ų | 146.4 | 89% | 0.888 | 77% | 0.766 | S | S | * | * | trans | -62.7 | 97 | 157.4 | -65 | -175.7 | -50.6 | 0 | 0 | 107 | ||||
| 49 | S | 43.8 | Very low | 49.5 | Very low | 119 Ų | 119 | 144.4 Ų | 144.4 | 83% | 0.832 | 76% | 0.76 | S | S | * | * | trans | -103.7 | 94.9 | 162.9 | -162.9 | 0 | 0 | 0 | 0 | 107.6 | E47 | E47-S49 VanDerWaalsContact C-N 3.3Å; E47-S49 PolarHBondContact O-N 2.86Å | ||
| 50 | S | 51.8 | Low | 50.8 | Low | 93 Ų | 93 | 145.2 Ų | 145.2 | 65% | 0.65 | 75% | 0.754 | S | S | * | * | trans | -63.5 | 148.3 | 172.7 | 46.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 51 | E | 50.2 | Low | 51.9 | Low | 174 Ų | 174 | 145 Ų | 145 | 81% | 0.813 | 75% | 0.75 | S | S | * | * | trans | 56.8 | 115 | 152.2 | 74.8 | 173.7 | 170 | 0 | 0 | 119.4 | ||||
| 52 | E | 50.3 | Low | 52.8 | Low | 151 Ų | 151 | 145.2 Ų | 145.2 | 71% | 0.706 | 75% | 0.752 | S | S | * | * | 159 | 76.1 | 123.2 | -165.8 | 81.7 | -112 | 0 | 0 | 105.1 | F54 | E52-F54 HydrophobicContact CG-CD2 4.26Å; E52-F54 PolarHBondContact O-N 2.76Å | |||
| 53 | E | 47.5 | Very low | 53.7 | Low | 158 Ų | 158 | 145.8 Ų | 145.8 | 74% | 0.738 | 75% | 0.754 | S | S | * | * | trans | -72.9 | 89.1 | 170.5 | -159.4 | 167.5 | -158.9 | 0 | 0 | 106.5 | F55 | E53-F55 VanDerWaalsContact C-N 3.26Å; E53-F55 HydrophobicContact CB-CD2 4.24Å; E53-F55 HydrophobicContact CB-CE2 3.9Å; E53-F55 VanDerWaalsContact CD-CE2 3.47Å; E53-F55 HydrophobicContact CG-CD2 4.03Å; E53-F55 HydrophobicContact CG-CE2 3.45Å; E53-F55 VanDerWaalsContact CG-CE2 3.45Å; E53-F55 HydrophobicContact CG-CZ 3.9Å; E53-F55 VanDerWaalsContact O-CD2 3.32Å; E53-F55 WeakPolarHBondContact O-CD2 3.45Å; E53-F55 PolarHBondContact O-N 3.15Å; E53-F55 WeakPolarHBondContact OE2-CE2 3.45Å | ||
| 54 | F | 52.9 | Low | 54.9 | Low | 176 Ų | 176 | 146.2 Ų | 146.2 | 77% | 0.772 | 76% | 0.756 | S | S | * | * | trans | -69.5 | 84 | -179.1 | -150.6 | -91 | 0 | 0 | 0 | 108.7 | E52 P56 | E52-F54 HydrophobicContact CG-CD2 4.26Å; E52-F54 PolarHBondContact O-N 2.76Å; F54-P56 VanDerWaalsContact O-CD 3.29Å; F54-P56 WeakPolarHBondContact O-CD 3.38Å | ||
| 55 | F | 63.4 | Low | 55.4 | Low | 146 Ų | 146 | 145.2 Ų | 145.2 | 64% | 0.64 | 75% | 0.747 | S | S | * | * | trans | -72.8 | 117.2 | 167.3 | -75.2 | -82.9 | 0 | 0 | 0 | 108 | E53 E57 | E53-F55 VanDerWaalsContact C-N 3.26Å; E53-F55 HydrophobicContact CB-CD2 4.24Å; E53-F55 HydrophobicContact CB-CE2 3.9Å; E53-F55 VanDerWaalsContact CD-CE2 3.47Å; E53-F55 HydrophobicContact CG-CD2 4.03Å; E53-F55 HydrophobicContact CG-CE2 3.45Å; E53-F55 VanDerWaalsContact CG-CE2 3.45Å; E53-F55 HydrophobicContact CG-CZ 3.9Å; E53-F55 VanDerWaalsContact O-CD2 3.32Å; E53-F55 WeakPolarHBondContact O-CD2 3.45Å; E53-F55 PolarHBondContact O-N 3.15Å; E53-F55 WeakPolarHBondContact OE2-CE2 3.45Å; F55-E57 PolarHBondContact O-N 2.7Å | ||
| 56 | P | 61.2 | Low | 56.1 | Low | 70 Ų | 70 | 148.5 Ų | 148.5 | 46% | 0.455 | 75% | 0.75 | S | S | . | * | trans | -64.2 | 113.9 | 171.2 | -16.6 | 31.1 | 0 | 0 | 0 | 108.5 | F54 E58 L59 | F54-P56 VanDerWaalsContact O-CD 3.29Å; F54-P56 WeakPolarHBondContact O-CD 3.38Å; P56-E58 PolarHBondContact O-N 3.05Å; P56-L59 PolarHBondContact O-N 3.16Å | ||
| 57 | E | 60.3 | Low | 56.6 | Low | 178 Ų | 178 | 148 Ų | 148 | 83% | 0.832 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -60.3 | -9.3 | 176.9 | -74.1 | 166.2 | 149.3 | 0 | 0 | 112.9 | F55 L59 L60 | F55-E57 PolarHBondContact O-N 2.7Å; E57-L59 PolarHBondContact O-N 2.99Å; E57-L60 PolarHBondContact O-N 2.75Å |
| 58 | E | 60 | Low | 57.1 | Low | 186 Ų | 186 | 147.7 Ų | 147.7 | 87% | 0.869 | 75% | 0.753 | S | S | * | * | G | 310 helix | trans | -70.4 | -7.6 | 174.8 | -60.4 | -174.7 | 170.7 | 0 | 0 | 114.4 | P56 | P56-E58 PolarHBondContact O-N 3.05Š|
| 59 | L | 57.1 | Low | 57.5 | Low | 144 Ų | 144 | 146.2 Ų | 146.2 | 75% | 0.754 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -89.8 | 0.4 | 176.8 | -70.7 | -179.9 | 0 | 0 | 0 | 114.4 | P56 E57 P61 | P56-L59 PolarHBondContact O-N 3.16Å; E57-L59 PolarHBondContact O-N 2.99Å; L59-P61 VanDerWaalsContact O-CD 3.27Å; L59-P61 WeakPolarHBondContact O-CD 3.43Å |
| 60 | L | 67.5 | Low | 57.8 | Low | 137 Ų | 137 | 145.4 Ų | 145.4 | 72% | 0.717 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -87.2 | 113.3 | 169.5 | -71.9 | 172.9 | 0 | 0 | 0 | 108.9 | E57 E62 | E57-L60 PolarHBondContact O-N 2.75Å; L60-E62 PolarHBondContact O-N 3.13Å; L60-E62 VanDerWaalsContact O-N 3.07Å |
| 61 | P | 65.9 | Low | 58 | Low | 100 Ų | 100 | 149.8 Ų | 149.8 | 65% | 0.649 | 76% | 0.755 | S | S | * | * | trans | -60.9 | 115.6 | 163.4 | -16.9 | 31.6 | 0 | 0 | 0 | 107.5 | L59 L63 | L59-P61 VanDerWaalsContact O-CD 3.27Å; L59-P61 WeakPolarHBondContact O-CD 3.43Å; P61-L63 HydrophobicContact CB-CD1 3.99Å; P61-L63 HydrophobicContact CB-CG 3.95Å; P61-L63 PolarHBondContact O-N 2.99Å | ||
| 62 | E | 63.3 | Low | 58.1 | Low | 196 Ų | 196 | 148.9 Ų | 148.9 | 92% | 0.916 | 76% | 0.756 | S | S | * | * | trans | -64.3 | 76.6 | 163.5 | -70.1 | -173.2 | 166.8 | 0 | 0 | 108.6 | L60 | L60-E62 PolarHBondContact O-N 3.13Å; L60-E62 VanDerWaalsContact O-N 3.07Å | ||
| 63 | L | 59.2 | Low | 57.8 | Low | 146 Ų | 146 | 151.8 Ų | 151.8 | 76% | 0.764 | 76% | 0.76 | S | S | * | * | trans | -107.9 | 66.5 | 170.3 | -67.7 | 174.7 | 0 | 0 | 0 | 107.6 | P61 P65 | P61-L63 HydrophobicContact CB-CD1 3.99Å; P61-L63 HydrophobicContact CB-CG 3.95Å; P61-L63 PolarHBondContact O-N 2.99Å; L63-P65 WeakPolarHBondContact O-CD 3.25Å | ||
| 64 | L | 62.8 | Low | 57.7 | Low | 156 Ų | 156 | 149 Ų | 149 | 82% | 0.817 | 76% | 0.756 | S | S | * | * | trans | -77.9 | 120.1 | 152.1 | -88.7 | 175.6 | 0 | 0 | 0 | 107.1 | E66 | L64-E66 PolarHBondContact O-N 2.95Š| ||
| 65 | P | 61.5 | Low | 57.4 | Low | 82 Ų | 82 | 146.4 Ų | 146.4 | 53% | 0.532 | 76% | 0.756 | S | S | . | * | trans | -62.1 | 111.3 | -177.6 | -24.4 | 35.1 | 0 | 0 | 0 | 110.7 | L63 M67 L68 | L63-P65 WeakPolarHBondContact O-CD 3.25Å; P65-M67 HydrophobicContact CB-CB 3.87Å; P65-M67 HydrophobicContact CB-CG 3.96Å; P65-M67 HydrophobicContact CB-SD 4.29Å; P65-M67 PolarHBondContact O-N 3.39Å; P65-L68 PolarHBondContact O-N 2.8Å | ||
| 66 | E | 59.8 | Low | 57 | Low | 176 Ų | 176 | 148 Ų | 148 | 82% | 0.822 | 77% | 0.766 | S | S | * | * | G | 310 helix | trans | -52.4 | -1.6 | 161.4 | -61.3 | 179.6 | 147.5 | 0 | 0 | 112.9 | L64 L68 L69 | L64-E66 PolarHBondContact O-N 2.95Å; E66-L68 PolarHBondContact O-N 3.23Å; E66-L69 PolarHBondContact O-N 3.28Å |
| 67 | M | 57.6 | Low | 56.5 | Low | 157 Ų | 157 | 152.8 Ų | 152.8 | 77% | 0.773 | 78% | 0.782 | S | S | * | * | G | 310 helix | trans | -62.6 | -12.1 | 171.7 | -66.6 | -174.2 | 59.2 | 0 | 0 | 115.4 | P65 L69 | P65-M67 HydrophobicContact CB-CB 3.87Å; P65-M67 HydrophobicContact CB-CG 3.96Å; P65-M67 HydrophobicContact CB-SD 4.29Å; P65-M67 PolarHBondContact O-N 3.39Å; M67-L69 VanDerWaalsContact C-N 3.33Å |
| 68 | L | 56.3 | Low | 55.7 | Low | 167 Ų | 167 | 150.5 Ų | 150.5 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | G | 310 helix | trans | -82.6 | -6.7 | 174.5 | -67.8 | 179.4 | 0 | 0 | 0 | 113.9 | P65 E66 | P65-L68 PolarHBondContact O-N 2.8Å; E66-L68 PolarHBondContact O-N 3.23Å |
| 69 | L | 54.7 | Low | 54.9 | Low | 158 Ų | 158 | 148.7 Ų | 148.7 | 83% | 0.827 | 78% | 0.78 | S | S | * | * | G | 310 helix | trans | -108.2 | 17.3 | -178.4 | -63.8 | 179.6 | 0 | 0 | 0 | 114.2 | E66 M67 E71 | E66-L69 PolarHBondContact O-N 3.28Å; M67-L69 VanDerWaalsContact C-N 3.33Å; L69-E71 PolarHBondContact O-N 3.19Å; L69-E71 VanDerWaalsContact O-N 3.16Å |
| 70 | S | 51 | Low | 54.7 | Low | 102 Ų | 102 | 145 Ų | 145 | 71% | 0.713 | 77% | 0.766 | S | S | * | * | trans | -84 | 83.6 | 167.4 | -57 | 0 | 0 | 0 | 0 | 109.9 | D72 | S70-D72 VanDerWaalsContact C-N 3.28Å; S70-D72 PolarHBondContact O-N 2.76Å | ||
| 71 | E | 55.9 | Low | 54 | Low | 186 Ų | 186 | 147.6 Ų | 147.6 | 87% | 0.869 | 78% | 0.775 | S | S | * | * | trans | -68.1 | 85.6 | 160.6 | -174.8 | 87.8 | 143.4 | 0 | 0 | 108.4 | L69 | L69-E71 PolarHBondContact O-N 3.19Å; L69-E71 VanDerWaalsContact O-N 3.16Å | ||
| 72 | D | 51.5 | Low | 53.4 | Low | 155 Ų | 155 | 150.5 Ų | 150.5 | 83% | 0.829 | 78% | 0.777 | S | S | * | * | trans | -159.5 | 109.7 | 145.4 | -141.1 | -13.3 | 0 | 0 | 0 | 111 | S70 | S70-D72 VanDerWaalsContact C-N 3.28Å; S70-D72 PolarHBondContact O-N 2.76Å | ||
| 73 | R | 44.7 | Very low | 52.9 | Low | 212 Ų | 212 | 146.6 Ų | 146.6 | 80% | 0.8 | 76% | 0.763 | S | S | * | * | trans | -90.9 | 126.4 | -169.2 | 173 | -165.8 | -61 | 177.2 | 2.5 | 110.7 | ||||
| 74 | P | 45.2 | Very low | 52.5 | Low | 99 Ų | 99 | 147.4 Ų | 147.4 | 64% | 0.643 | 77% | 0.767 | S | S | * | * | trans | -82.1 | 146.4 | 140.6 | 32.7 | -26.9 | 0 | 0 | 0 | 108.5 | Q76 | P74-Q76 VanDerWaalsContact C-N 3.34Å; P74-Q76 PolarHBondContact O-N 2.66Å | ||
| 75 | P | 47.2 | Very low | 52 | Low | 121 Ų | 121 | 148.7 Ų | 148.7 | 79% | 0.786 | 77% | 0.766 | S | S | * | * | trans | -63.7 | 98.3 | 178.2 | -5.6 | 19 | 0 | 0 | 0 | 108.2 | E77 | P75-E77 PolarHBondContact O-N 2.76Å; P75-E77 VanDerWaalsContact O-N 3.15Å | ||
| 76 | Q | 54 | Low | 51.8 | Low | 181 Ų | 181 | 152.1 Ų | 152.1 | 85% | 0.846 | 78% | 0.775 | S | S | * | * | trans | -73.2 | 108 | 169.4 | -136 | 171.3 | 13.1 | 0 | 0 | 105 | P74 C78 | P74-Q76 VanDerWaalsContact C-N 3.34Å; P74-Q76 PolarHBondContact O-N 2.66Å; Q76-C78 PolarHBondContact O-N 2.97Å; Q76-C78 VanDerWaalsContact O-N 3.11Å | ||
| 77 | E | 51.9 | Low | 51.7 | Low | 169 Ų | 169 | 151.1 Ų | 151.1 | 79% | 0.79 | 78% | 0.775 | S | S | * | * | trans | -41.2 | 121.3 | 170.1 | -65.9 | 175.7 | 157.1 | 0 | 0 | 107.9 | P75 L79 | P75-E77 PolarHBondContact O-N 2.76Å; P75-E77 VanDerWaalsContact O-N 3.15Å; E77-L79 PolarHBondContact O-N 3.26Å | ||
| 78 | C | 43 | Very low | 51.7 | Low | 130 Ų | 130 | 152.8 Ų | 152.8 | 88% | 0.878 | 77% | 0.773 | S | S | * | * | trans | -62.7 | 89.1 | 178.8 | -57.9 | 0 | 0 | 0 | 0 | 108.2 | Q76 S80 | Q76-C78 PolarHBondContact O-N 2.97Å; Q76-C78 VanDerWaalsContact O-N 3.11Å; C78-S80 PolarHBondContact O-N 2.8Å | ||
| 79 | L | 43.5 | Very low | 52.4 | Low | 149 Ų | 149 | 149.6 Ų | 149.6 | 78% | 0.78 | 76% | 0.762 | S | S | * | * | trans | -67.8 | 94.5 | 168.4 | -65.1 | -177 | 0 | 0 | 0 | 106.1 | E77 E81 | E77-L79 PolarHBondContact O-N 3.26Å; L79-E81 PolarHBondContact O-N 3.16Å | ||
| 80 | S | 51.8 | Low | 53.2 | Low | 67 Ų | 67 | 147.9 Ų | 147.9 | 47% | 0.469 | 76% | 0.761 | S | S | . | * | trans | -29.7 | 106.2 | 167.6 | 158.6 | 0 | 0 | 0 | 0 | 111.1 | C78 K82 | C78-S80 PolarHBondContact O-N 2.8Å; S80-K82 PolarHBondContact O-N 2.92Å; S80-K82 WeakPolarHBondContact OG-CG 3.07Å | ||
| 81 | E | 52.7 | Low | 53.9 | Low | 191 Ų | 191 | 151 Ų | 151 | 89% | 0.893 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.7 | 7.7 | 177.5 | -81.3 | -179.5 | 132 | 0 | 0 | 115.3 | L79 | L79-E81 PolarHBondContact O-N 3.16Š|
| 82 | K | 54.5 | Low | 54.5 | Low | 160 Ų | 160 | 151.1 Ų | 151.1 | 70% | 0.696 | 77% | 0.767 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.6 | -3.7 | -162.9 | -42.9 | 175.1 | -169.9 | -179.6 | 0 | 115 | S80 | S80-K82 PolarHBondContact O-N 2.92Å; S80-K82 WeakPolarHBondContact OG-CG 3.07Å |
| 83 | N | 52.3 | Low | 55.6 | Low | 115 Ų | 115 | 151 Ų | 151 | 62% | 0.615 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -142.4 | 19.9 | -168.8 | -67.8 | -69.4 | 0 | 0 | 0 | 115.6 | ||
| 84 | L | 50.8 | Low | 56.7 | Low | 163 Ų | 163 | 145.7 Ų | 145.7 | 85% | 0.853 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -105.3 | -6.1 | 176.1 | -120.2 | 103.3 | 0 | 0 | 0 | 114.7 | ||
| 85 | F | 51.4 | Low | 57.8 | Low | 182 Ų | 182 | 147 Ų | 147 | 80% | 0.798 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -103.9 | -10.1 | -179.5 | -71.9 | -77.9 | 0 | 0 | 0 | 114 | ||
| 86 | E | 57.8 | Low | 58.4 | Low | 154 Ų | 154 | 144.8 Ų | 144.8 | 72% | 0.72 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | -26.6 | -178.5 | -122.8 | 91.9 | -164.3 | 0 | 0 | 113.6 | ||
| 87 | D | 58.1 | Low | 58.6 | Low | 155 Ų | 155 | 140 Ų | 140 | 83% | 0.829 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | -4.8 | -172.1 | -77.7 | -20.5 | 0 | 0 | 0 | 114.4 | ||
| 88 | R | 57.5 | Low | 58.8 | Low | 192 Ų | 192 | 138.9 Ų | 138.9 | 73% | 0.725 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -88.2 | 119.9 | 170.8 | -177.3 | 177.7 | -85.1 | -132.6 | 0.3 | 107.6 | ||
| 89 | P | 70.8 | Confident | 59.4 | Low | 100 Ų | 100 | 135.2 Ų | 135.2 | 65% | 0.649 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -55 | 139 | 172.1 | 23.2 | -31.8 | 0 | 0 | 0 | 108.7 | M91 | P89-M91 PolarHBondContact O-N 3.07Å; P89-M91 VanDerWaalsContact O-N 3.13Å |
| 90 | P | 71.5 | Confident | 60.2 | Low | 123 Ų | 123 | 138.6 Ų | 138.6 | 80% | 0.799 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -48.4 | 126.7 | 175.2 | -24.1 | 31.8 | 0 | 0 | 0 | 108.7 | E92 | P90-E92 PolarHBondContact O-N 2.74Š|
| 91 | M | 66.4 | Low | 60.2 | Low | 168 Ų | 168 | 143.5 Ų | 143.5 | 83% | 0.828 | 76% | 0.761 | S | S | * | * | trans | -59.7 | 113.6 | 175.6 | -141.5 | 176.1 | 69.8 | 0 | 0 | 106.5 | P89 Q93 | P89-M91 PolarHBondContact O-N 3.07Å; P89-M91 VanDerWaalsContact O-N 3.13Å; M91-Q93 PolarHBondContact O-N 2.75Å | ||
| 92 | E | 68 | Low | 60.5 | Low | 188 Ų | 188 | 143.6 Ų | 143.6 | 88% | 0.879 | 76% | 0.759 | S | S | * | * | trans | -60.3 | 111.2 | -179.3 | -92.8 | -155 | 150.3 | 0 | 0 | 108.7 | P90 P94 | P90-E92 PolarHBondContact O-N 2.74Å; E92-P94 WeakPolarHBondContact O-CD 3.27Å | ||
| 93 | Q | 74.1 | Confident | 60.8 | Low | 151 Ų | 151 | 142 Ų | 142 | 71% | 0.706 | 76% | 0.757 | S | S | * | * | trans | -65.1 | 120.5 | 170.1 | -169.5 | 176.7 | 11.7 | 0 | 0 | 106.7 | M91 C96 | M91-Q93 PolarHBondContact O-N 2.75Å; Q93-C96 PolarHBondContact NE2-SG 2.88Å | ||
| 94 | P | 67.8 | Low | 61.2 | Low | 102 Ų | 102 | 142.6 Ų | 142.6 | 66% | 0.662 | 76% | 0.756 | S | S | * | * | trans | -54.7 | 140.3 | 174.1 | 21.9 | -30.7 | 0 | 0 | 0 | 107.9 | E92 C96 | E92-P94 WeakPolarHBondContact O-CD 3.27Å; P94-C96 PolarHBondContact O-N 2.79Å | ||
| 95 | P | 68.3 | Low | 61.9 | Low | 127 Ų | 127 | 144.1 Ų | 144.1 | 83% | 0.825 | 76% | 0.759 | S | S | * | * | trans | -52.9 | 103.8 | -168.2 | 19.4 | -32.1 | 0 | 0 | 0 | 110.1 | G97 | P95-G97 PolarHBondContact O-N 3.45Å; P95-G97 VanDerWaalsContact O-N 3.16Å | ||
| 96 | C | 60 | Low | 62.8 | Low | 73 Ų | 73 | 136.6 Ų | 136.6 | 49% | 0.493 | 73% | 0.732 | S | S | . | * | trans | -60.9 | 121.1 | 166 | -66.2 | 0 | 0 | 0 | 0 | 104.8 | Q93 P94 V98 | Q93-C96 PolarHBondContact NE2-SG 2.88Å; P94-C96 PolarHBondContact O-N 2.79Å; C96-V98 HydrophobicContact CB-CG2 4.24Å; C96-V98 WeakPolarHBondContact O-CG2 3.5Å; C96-V98 PolarHBondContact O-N 3.26Å | ||
| 97 | G | 58 | Low | 63.9 | Low | 82 Ų | 82 | 133 Ų | 133 | 85% | 0.845 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -64.4 | 35.2 | -164.5 | 0 | 0 | 0 | 0 | 0 | 117.1 | P95 | P95-G97 PolarHBondContact O-N 3.45Å; P95-G97 VanDerWaalsContact O-N 3.16Å |
| 98 | V | 56 | Low | 64.6 | Low | 144 Ų | 144 | 132.5 Ų | 132.5 | 87% | 0.873 | 72% | 0.715 | S | S | * | * | trans | -99.4 | 27 | 174.7 | -87.7 | 0 | 0 | 0 | 0 | 112 | C96 | C96-V98 HydrophobicContact CB-CG2 4.24Å; C96-V98 WeakPolarHBondContact O-CG2 3.5Å; C96-V98 PolarHBondContact O-N 3.26Å | ||
| 99 | G | 55.4 | Low | 65.5 | Low | 54 Ų | 54 | 131.3 Ų | 131.3 | 56% | 0.557 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -112.4 | 150.4 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | H101 | G99-H101 PolarHBondContact O-N 3.29Š|
| 100 | K | 60.1 | Low | 65.7 | Low | 219 Ų | 219 | 131.6 Ų | 131.6 | 95% | 0.952 | 71% | 0.708 | S | S | * | * | trans | -65.9 | 33.2 | 176.5 | -60.1 | -76.5 | -175.8 | 179 | 0 | 113.5 | K102 | K100-K102 PolarHBondContact O-N 3.46Š| ||
| 101 | H | 53.5 | Low | 66.1 | Low | 171 Ų | 171 | 130.5 Ų | 130.5 | 79% | 0.792 | 69% | 0.688 | S | S | * | * | trans | -65.9 | 122.3 | 165.6 | -142.3 | -89.1 | 0 | 0 | 0 | 105.7 | G99 L103 | G99-H101 PolarHBondContact O-N 3.29Å; H101-L103 VanDerWaalsContact C-N 3.32Å; H101-L103 PolarHBondContact O-N 3.35Å | ||
| 102 | K | 57.8 | Low | 66.5 | Low | 193 Ų | 193 | 127.2 Ų | 127.2 | 84% | 0.839 | 67% | 0.673 | S | S | * | * | trans | -55 | 107.5 | 170.6 | -64.9 | -159.7 | 175.3 | -169.1 | 0 | 105.2 | K100 E104 | K100-K102 PolarHBondContact O-N 3.46Å; K102-E104 VanDerWaalsContact C-N 3.33Å; K102-E104 PolarHBondContact O-N 3.49Å | ||
| 103 | L | 60.4 | Low | 66.8 | Low | 126 Ų | 126 | 121.1 Ų | 121.1 | 66% | 0.66 | 65% | 0.654 | S | S | * | * | trans | -53.2 | 112.1 | 167.5 | -72.1 | 167.6 | 0 | 0 | 0 | 102.9 | H101 E105 | H101-L103 VanDerWaalsContact C-N 3.32Å; H101-L103 PolarHBondContact O-N 3.35Å; L103-E105 PolarHBondContact O-N 3.18Å | ||
| 104 | E | 61.7 | Low | 66.7 | Low | 128 Ų | 128 | 117.9 Ų | 117.9 | 60% | 0.598 | 64% | 0.642 | S | S | * | * | trans | -46.1 | 112.8 | 167.7 | -172.9 | 170.9 | 37.3 | 0 | 0 | 105.3 | K102 G106 L114 | K102-E104 VanDerWaalsContact C-N 3.33Å; K102-E104 PolarHBondContact O-N 3.49Å; E104-G106 PolarHBondContact O-N 3.44Å; E104-L114 WeakPolarHBondContact OE1-CD1 3.29Å | ||
| 105 | E | 65.9 | Low | 66.6 | Low | 195 Ų | 195 | 119.1 Ų | 119.1 | 91% | 0.911 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -68.6 | 84.3 | -164.4 | -74.4 | 172.7 | 163.3 | 0 | 0 | 107.9 | L103 | L103-E105 PolarHBondContact O-N 3.18Š|
| 106 | G | 69.6 | Low | 66.4 | Low | 23 Ų | 23 | 121.9 Ų | 121.9 | 24% | 0.237 | 63% | 0.631 | C | S | . | * | trans | -156.5 | 148.3 | -172.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | E104 E110 | E104-G106 PolarHBondContact O-N 3.44Å; G106-E110 WeakPolarHBondContact CA-OE2 3.4Å | ||
| 107 | S | 81.1 | Confident | 66.6 | Low | 78 Ų | 78 | 122.6 Ų | 122.6 | 55% | 0.545 | 64% | 0.635 | S | S | . | * | trans | -55.5 | 153.3 | 177.9 | 173 | 0 | 0 | 0 | 0 | 110.7 | K109 E110 R111 | S107-K109 PolarHBondContact O-N 3.04Å; S107-K109 PolarHBondContact OG-N 2.87Å; S107-E110 PolarHBondContact N-OE2 3.24Å; S107-E110 WeakPolarHBondContact O-CA 3.46Å; S107-E110 WeakPolarHBondContact O-CB 3.33Å; S107-E110 PolarHBondContact O-N 3.42Å; S107-R111 PolarHBondContact O-N 3.4Å | ||
| 108 | F | 73.3 | Confident | 66.7 | Low | 145 Ų | 145 | 127.4 Ų | 127.4 | 64% | 0.636 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -48.1 | -35.7 | 171.3 | 176.3 | -101.2 | 0 | 0 | 0 | 112.2 | L112 | F108-L112 HydrophobicContact CE1-CD2 4.48Å; F108-L112 VanDerWaalsContact O-CB 3.29Å; F108-L112 WeakPolarHBondContact O-CB 3.43Å; F108-L112 PolarHBondContact O-N 3.32Å |
| 109 | K | 76.3 | Confident | 66.7 | Low | 168 Ų | 168 | 127 Ų | 127 | 73% | 0.73 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -66 | -37.7 | 175.4 | -171.9 | 177.8 | 179.7 | -177.5 | 0 | 113.4 | S107 L112 A113 | S107-K109 PolarHBondContact O-N 3.04Å; S107-K109 PolarHBondContact OG-N 2.87Å; K109-L112 PolarHBondContact O-N 3.31Å; K109-A113 WeakPolarHBondContact O-CB 3.29Å; K109-A113 PolarHBondContact O-N 3.02Å |
| 110 | E | 75.4 | Confident | 67 | Low | 106 Ų | 106 | 134.4 Ų | 134.4 | 50% | 0.495 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -71.2 | -44.5 | 177.4 | -176.6 | 173.7 | -171.9 | 0 | 0 | 110.7 | G106 S107 L112 A113 L114 | G106-E110 WeakPolarHBondContact CA-OE2 3.4Å; S107-E110 PolarHBondContact N-OE2 3.24Å; S107-E110 WeakPolarHBondContact O-CA 3.46Å; S107-E110 WeakPolarHBondContact O-CB 3.33Å; S107-E110 PolarHBondContact O-N 3.42Å; E110-L112 VanDerWaalsContact C-N 3.31Å; E110-L112 PolarHBondContact O-N 2.94Å; E110-A113 WeakPolarHBondContact O-CB 2.96Å; E110-A113 PolarHBondContact O-N 3.15Å; E110-A113 VanDerWaalsContact O-N 3.13Å; E110-L114 PolarHBondContact O-N 2.84Å |
| 111 | R | 79.7 | Confident | 66.9 | Low | 100 Ų | 100 | 126.4 Ų | 126.4 | 38% | 0.377 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -56.8 | -46.8 | 170.4 | -67.4 | -171.7 | -71.4 | 162.3 | -0.7 | 110.8 | S107 A113 L114 F115 | S107-R111 PolarHBondContact O-N 3.4Å; R111-A113 VanDerWaalsContact C-N 3.28Å; R111-A113 PolarHBondContact O-N 3.47Å; R111-L114 PolarHBondContact O-N 3.32Å; R111-L114 VanDerWaalsContact O-N 3.15Å; R111-F115 VanDerWaalsContact O-CD2 3.25Å; R111-F115 WeakPolarHBondContact O-CD2 3.47Å; R111-F115 PolarHBondContact O-N 2.79Å |
| 112 | L | 74.9 | Confident | 67 | Low | 98 Ų | 98 | 126.2 Ų | 126.2 | 51% | 0.513 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -61.7 | -35.2 | 178.5 | -169 | 64.7 | 0 | 0 | 0 | 112.5 | F108 K109 E110 L114 F115 R116 | F108-L112 HydrophobicContact CE1-CD2 4.48Å; F108-L112 VanDerWaalsContact O-CB 3.29Å; F108-L112 WeakPolarHBondContact O-CB 3.43Å; F108-L112 PolarHBondContact O-N 3.32Å; K109-L112 PolarHBondContact O-N 3.31Å; E110-L112 VanDerWaalsContact C-N 3.31Å; E110-L112 PolarHBondContact O-N 2.94Å; L112-L114 VanDerWaalsContact C-N 3.32Å; L112-L114 PolarHBondContact O-N 3.13Å; L112-F115 PolarHBondContact O-N 2.79Å; L112-R116 WeakPolarHBondContact O-CB 3.08Å; L112-R116 PolarHBondContact O-N 3.48Å |
| 113 | A | 73.6 | Confident | 67.3 | Low | 60 Ų | 60 | 121.5 Ų | 121.5 | 50% | 0.496 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -68 | -28.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | K109 E110 R111 P117 | K109-A113 WeakPolarHBondContact O-CB 3.29Å; K109-A113 PolarHBondContact O-N 3.02Å; E110-A113 WeakPolarHBondContact O-CB 2.96Å; E110-A113 PolarHBondContact O-N 3.15Å; E110-A113 VanDerWaalsContact O-N 3.13Å; R111-A113 VanDerWaalsContact C-N 3.28Å; R111-A113 PolarHBondContact O-N 3.47Å; A113-P117 WeakPolarHBondContact O-CD 3.32Å |
| 114 | L | 72.1 | Confident | 67.4 | Low | 83 Ų | 83 | 122.6 Ų | 122.6 | 44% | 0.435 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -79.2 | -29.7 | 176.6 | -64.6 | 172.6 | 0 | 0 | 0 | 112.9 | E104 E110 R111 L112 P117 | E104-L114 WeakPolarHBondContact OE1-CD1 3.29Å; E110-L114 PolarHBondContact O-N 2.84Å; R111-L114 PolarHBondContact O-N 3.32Å; R111-L114 VanDerWaalsContact O-N 3.15Å; L112-L114 VanDerWaalsContact C-N 3.32Å; L112-L114 PolarHBondContact O-N 3.13Å; L114-P117 WeakPolarHBondContact O-CD 3.48Å |
| 115 | F | 65.1 | Low | 67.2 | Low | 129 Ų | 129 | 120 Ų | 120 | 57% | 0.566 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -83.7 | -25.5 | 175.4 | -74.7 | -78.3 | 0 | 0 | 0 | 113.5 | R111 L112 R118 F119 | R111-F115 VanDerWaalsContact O-CD2 3.25Å; R111-F115 WeakPolarHBondContact O-CD2 3.47Å; R111-F115 PolarHBondContact O-N 2.79Å; L112-F115 PolarHBondContact O-N 2.79Å; F115-R118 PolarHBondContact O-N 2.96Å; F115-F119 PolarHBondContact O-N 3Å |
| 116 | R | 64.7 | Low | 67.5 | Low | 185 Ų | 185 | 121.2 Ų | 121.2 | 70% | 0.698 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58 | -39.6 | -179 | -151.7 | -175.7 | -165.6 | -170.7 | 5.4 | 114.5 | L112 | L112-R116 WeakPolarHBondContact O-CB 3.08Å; L112-R116 PolarHBondContact O-N 3.48Å |
| 117 | P | 63.8 | Low | 67.9 | Low | 88 Ų | 88 | 128 Ų | 128 | 57% | 0.571 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.3 | -33.4 | 176.8 | -22.3 | 34.7 | 0 | 0 | 0 | 113 | A113 L114 F119 R120 | A113-P117 WeakPolarHBondContact O-CD 3.32Å; L114-P117 WeakPolarHBondContact O-CD 3.48Å; P117-F119 VanDerWaalsContact C-N 3.3Å; P117-F119 PolarHBondContact O-N 3.23Å; P117-R120 PolarHBondContact O-N 3.06Å |
| 118 | R | 59.8 | Low | 67.8 | Low | 183 Ų | 183 | 128.8 Ų | 128.8 | 69% | 0.691 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.3 | -30.8 | -179.6 | -60.9 | -171.1 | -178.6 | -172.3 | 1.1 | 112.3 | F115 R120 | F115-R118 PolarHBondContact O-N 2.96Å; R118-R120 VanDerWaalsContact C-N 3.34Å; R118-R120 PolarHBondContact O-N 2.84Å |
| 119 | F | 56 | Low | 68.6 | Low | 134 Ų | 134 | 124.5 Ų | 124.5 | 59% | 0.588 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -82 | -9.5 | -176.2 | -158.8 | -107.1 | 0 | 0 | 0 | 114.4 | F115 P117 G121 I123 | F115-F119 PolarHBondContact O-N 3Å; P117-F119 VanDerWaalsContact C-N 3.3Å; P117-F119 PolarHBondContact O-N 3.23Å; F119-G121 VanDerWaalsContact C-N 3.29Å; F119-G121 PolarHBondContact O-N 3.46Å; F119-I123 HydrophobicContact CD1-CD1 3.93Å; F119-I123 HydrophobicContact CD1-CG1 4.47Å; F119-I123 HydrophobicContact CD2-CG2 4.35Å; F119-I123 HydrophobicContact CE1-CD1 3.29Å; F119-I123 HydrophobicContact CE1-CG1 4.18Å; F119-I123 HydrophobicContact CE2-CD1 4.26Å; F119-I123 HydrophobicContact CE2-CG2 3.71Å; F119-I123 HydrophobicContact CZ-CD1 3.5Å; F119-I123 HydrophobicContact CZ-CG1 4.21Å; F119-I123 HydrophobicContact CZ-CG2 3.94Å |
| 120 | R | 61.9 | Low | 69.3 | Low | 210 Ų | 210 | 122.9 Ų | 122.9 | 79% | 0.792 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -78.9 | -6.4 | -167.5 | -136.8 | -162.2 | -79.1 | -111.3 | 10.7 | 114.7 | P117 R118 | P117-R120 PolarHBondContact O-N 3.06Å; R118-R120 VanDerWaalsContact C-N 3.34Å; R118-R120 PolarHBondContact O-N 2.84Å |
| 121 | G | 57.8 | Low | 70.1 | Confident | 52 Ų | 52 | 124.2 Ų | 124.2 | 54% | 0.536 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -144.5 | -10.2 | -177.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | F119 | F119-G121 VanDerWaalsContact C-N 3.29Å; F119-G121 PolarHBondContact O-N 3.46Å |
| 122 | E | 56.2 | Low | 70.6 | Confident | 167 Ų | 167 | 124 Ų | 124 | 78% | 0.78 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -90.4 | -23 | -170.3 | -153.6 | 164 | -153.1 | 0 | 0 | 113.5 | ||
| 123 | I | 64.7 | Low | 71.3 | Confident | 93 Ų | 93 | 124.8 Ų | 124.8 | 48% | 0.477 | 62% | 0.62 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.8 | -12.6 | 178.3 | 47.6 | 156.8 | 0 | 0 | 0 | 114.4 | F119 | F119-I123 HydrophobicContact CD1-CD1 3.93Å; F119-I123 HydrophobicContact CD1-CG1 4.47Å; F119-I123 HydrophobicContact CD2-CG2 4.35Å; F119-I123 HydrophobicContact CE1-CD1 3.29Å; F119-I123 HydrophobicContact CE1-CG1 4.18Å; F119-I123 HydrophobicContact CE2-CD1 4.26Å; F119-I123 HydrophobicContact CE2-CG2 3.71Å; F119-I123 HydrophobicContact CZ-CD1 3.5Å; F119-I123 HydrophobicContact CZ-CG1 4.21Å; F119-I123 HydrophobicContact CZ-CG2 3.94Å |
| 124 | H | 61 | Low | 72.2 | Confident | 149 Ų | 149 | 126.3 Ų | 126.3 | 69% | 0.69 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128.8 | 54.9 | 178.2 | -61.8 | 92.1 | 0 | 0 | 0 | 109.9 | R126 | H124-R126 CarbonylContact O-C 3.46Å; H124-R126 PolarHBondContact O-N 3Å |
| 125 | G | 58.1 | Low | 73.3 | Confident | 73 Ų | 73 | 127 Ų | 127 | 75% | 0.753 | 62% | 0.62 | S | S | * | * | trans | -61.1 | 8.9 | -175.1 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 126 | R | 73.5 | Confident | 74.6 | Confident | 221 Ų | 221 | 123 Ų | 123 | 83% | 0.834 | 61% | 0.611 | S | S | * | * | S | Bend | trans | -102.8 | 111.2 | 161.5 | -88.5 | -178.5 | 167.7 | 140.7 | -2.5 | 108 | H124 L128 | H124-R126 CarbonylContact O-C 3.46Å; H124-R126 PolarHBondContact O-N 3Å; R126-L128 PolarHBondContact O-N 3.41Å |
| 127 | N | 77.4 | Confident | 76 | Confident | 165 Ų | 165 | 117 Ų | 117 | 88% | 0.882 | 60% | 0.6 | S | S | * | * | trans | -58.2 | 107.6 | 162.9 | -62.6 | -62.8 | 0 | 0 | 0 | 106.8 | S129 | N127-S129 PolarHBondContact O-N 2.87Š| ||
| 128 | L | 79.3 | Confident | 77.6 | Confident | 96 Ų | 96 | 117.2 Ų | 117.2 | 50% | 0.503 | 60% | 0.597 | S | S | . | * | trans | -55.1 | 138.5 | 168.4 | -68.4 | 167.4 | 0 | 0 | 0 | 107.5 | R126 E132 M133 | R126-L128 PolarHBondContact O-N 3.41Å; L128-E132 HydrophobicContact CB-CB 4.17Å; L128-E132 HydrophobicContact CD2-CB 4.05Å; L128-M133 HydrophobicContact CB-CG 3.9Å; L128-M133 HydrophobicContact CD1-CG 4.32Å | ||
| 129 | S | 88.8 | Confident | 79.4 | Confident | 55 Ų | 55 | 113.5 Ų | 113.5 | 39% | 0.385 | 59% | 0.588 | S | S | . | * | trans | -61.7 | 157.9 | 168.4 | 65.1 | 0 | 0 | 0 | 0 | 109.9 | N127 E131 E132 M133 | N127-S129 PolarHBondContact O-N 2.87Å; S129-E131 PolarHBondContact O-N 3.19Å; S129-E132 WeakPolarHBondContact CB-OE2 3.27Å; S129-E132 PolarHBondContact N-OE2 2.86Å; S129-E132 PolarHBondContact O-N 3.04Å; S129-E132 VanDerWaalsContact O-N 3.1Å; S129-E132 VanDerWaalsContact OG-CG 3.22Å; S129-E132 WeakPolarHBondContact OG-CG 3.44Å; S129-E132 PolarHBondContact OG-N 3.21Å; S129-E132 PolarHBondContact OG-OE2 2.9Å; S129-M133 PolarHBondContact O-N 2.9Å | ||
| 130 | N | 90.8 | Very high | 81.3 | Confident | 134 Ų | 134 | 111 Ų | 111 | 72% | 0.717 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -56.3 | -35.5 | 178.9 | -70.3 | -24.3 | 0 | 0 | 0 | 112.1 | M133 I134 | N130-M133 PolarHBondContact O-N 3.36Å; N130-I134 WeakPolarHBondContact O-CD1 3.34Å; N130-I134 VanDerWaalsContact O-CG1 3.26Å; N130-I134 WeakPolarHBondContact O-CG1 3.22Å; N130-I134 PolarHBondContact O-N 3.1Å; N130-I134 VanDerWaalsContact O-N 3.12Å |
| 131 | E | 92.5 | Very high | 83 | Confident | 134 Ų | 134 | 106.4 Ų | 106.4 | 63% | 0.626 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -65.4 | -47.1 | 176.4 | -171.7 | 63.1 | -160.4 | 0 | 0 | 111.6 | S129 M133 I134 Q135 | S129-E131 PolarHBondContact O-N 3.19Å; E131-M133 VanDerWaalsContact C-N 3.28Å; E131-M133 PolarHBondContact O-N 2.95Å; E131-I134 PolarHBondContact O-N 2.91Å; E131-I134 VanDerWaalsContact O-N 3.17Å; E131-Q135 PolarHBondContact O-N 3.17Å |
| 132 | E | 90.9 | Very high | 84.9 | Confident | 95 Ų | 95 | 108 Ų | 108 | 44% | 0.444 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.5 | -32.4 | 178.3 | -69.2 | 163.8 | 146.4 | 0 | 0 | 112 | L128 S129 A136 | L128-E132 HydrophobicContact CB-CB 4.17Å; L128-E132 HydrophobicContact CD2-CB 4.05Å; S129-E132 WeakPolarHBondContact CB-OE2 3.27Å; S129-E132 PolarHBondContact N-OE2 2.86Å; S129-E132 PolarHBondContact O-N 3.04Å; S129-E132 VanDerWaalsContact O-N 3.1Å; S129-E132 VanDerWaalsContact OG-CG 3.22Å; S129-E132 WeakPolarHBondContact OG-CG 3.44Å; S129-E132 PolarHBondContact OG-N 3.21Å; S129-E132 PolarHBondContact OG-OE2 2.9Å; E132-A136 VanDerWaalsContact O-CB 3.27Å; E132-A136 WeakPolarHBondContact O-CB 3.48Å; E132-A136 PolarHBondContact O-N 3.35Å |
| 133 | M | 90.4 | Very high | 87 | Confident | 114 Ų | 114 | 105.9 Ų | 105.9 | 56% | 0.562 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -64.6 | -43.7 | 172.3 | -90.3 | -166.8 | 53.7 | 0 | 0 | 112.4 | L128 S129 N130 E131 A136 A137 | L128-M133 HydrophobicContact CB-CG 3.9Å; L128-M133 HydrophobicContact CD1-CG 4.32Å; S129-M133 PolarHBondContact O-N 2.9Å; N130-M133 PolarHBondContact O-N 3.36Å; E131-M133 VanDerWaalsContact C-N 3.28Å; E131-M133 PolarHBondContact O-N 2.95Å; M133-A136 PolarHBondContact O-N 3.43Å; M133-A137 PolarHBondContact O-N 3.12Å; M133-A137 VanDerWaalsContact O-N 3.09Å |
| 134 | I | 92.1 | Very high | 88.6 | Confident | 92 Ų | 92 | 107.5 Ų | 107.5 | 47% | 0.472 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -64.1 | -48 | 177.6 | -67.8 | 162.9 | 0 | 0 | 0 | 109.1 | N130 E131 A136 A137 D138 | N130-I134 WeakPolarHBondContact O-CD1 3.34Å; N130-I134 VanDerWaalsContact O-CG1 3.26Å; N130-I134 WeakPolarHBondContact O-CG1 3.22Å; N130-I134 PolarHBondContact O-N 3.1Å; N130-I134 VanDerWaalsContact O-N 3.12Å; E131-I134 PolarHBondContact O-N 2.91Å; E131-I134 VanDerWaalsContact O-N 3.17Å; I134-A136 PolarHBondContact O-N 3.35Å; I134-A137 WeakPolarHBondContact O-CB 3.26Å; I134-A137 PolarHBondContact O-N 3.35Å; I134-A137 VanDerWaalsContact O-N 3.07Å; I134-D138 PolarHBondContact O-N 2.97Å |
| 135 | Q | 95.4 | Very high | 90.4 | Very high | 99 Ų | 99 | 106.3 Ų | 106.3 | 46% | 0.463 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -59.4 | -43.7 | 177.6 | -173.6 | 179.5 | -11.8 | 0 | 0 | 112.3 | E131 A137 D138 E139 | E131-Q135 PolarHBondContact O-N 3.17Å; Q135-A137 VanDerWaalsContact C-N 3.26Å; Q135-A137 PolarHBondContact O-N 3.37Å; Q135-D138 PolarHBondContact O-N 3.12Å; Q135-E139 HydrophobicContact CG-CG 4.37Å; Q135-E139 WeakPolarHBondContact CG-OE1 3.38Å; Q135-E139 PolarHBondContact NE2-OE1 3.09Å; Q135-E139 WeakPolarHBondContact O-CB 3.45Å; Q135-E139 WeakPolarHBondContact O-CG 3.46Å; Q135-E139 PolarHBondContact O-N 3.47Å |
| 136 | A | 92.6 | Very high | 92.3 | Very high | 45 Ų | 45 | 106.5 Ų | 106.5 | 37% | 0.372 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63 | -33.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | E132 M133 I134 L140 | E132-A136 VanDerWaalsContact O-CB 3.27Å; E132-A136 WeakPolarHBondContact O-CB 3.48Å; E132-A136 PolarHBondContact O-N 3.35Å; M133-A136 PolarHBondContact O-N 3.43Å; I134-A136 PolarHBondContact O-N 3.35Å; A136-L140 WeakPolarHBondContact O-CB 3.43Å; A136-L140 PolarHBondContact O-N 3.38Å; A136-L140 VanDerWaalsContact O-N 3.12Å |
| 137 | A | 94.1 | Very high | 93.5 | Very high | 57 Ų | 57 | 104.6 Ų | 104.6 | 47% | 0.471 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -68.2 | -44.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | M133 I134 Q135 L140 E141 | M133-A137 PolarHBondContact O-N 3.12Å; M133-A137 VanDerWaalsContact O-N 3.09Å; I134-A137 WeakPolarHBondContact O-CB 3.26Å; I134-A137 PolarHBondContact O-N 3.35Å; I134-A137 VanDerWaalsContact O-N 3.07Å; Q135-A137 VanDerWaalsContact C-N 3.26Å; Q135-A137 PolarHBondContact O-N 3.37Å; A137-L140 PolarHBondContact O-N 3.49Å; A137-E141 PolarHBondContact O-N 2.95Å |
| 138 | D | 96.8 | Very high | 94.4 | Very high | 94 Ų | 94 | 101.2 Ų | 101.2 | 50% | 0.503 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65 | -43.6 | 178 | -69.5 | -15.3 | 0 | 0 | 0 | 111.9 | I134 Q135 L140 E141 E142 | I134-D138 PolarHBondContact O-N 2.97Å; Q135-D138 PolarHBondContact O-N 3.12Å; D138-L140 VanDerWaalsContact C-N 3.32Å; D138-L140 PolarHBondContact O-N 3.27Å; D138-E141 WeakPolarHBondContact O-CB 3.33Å; D138-E141 PolarHBondContact O-N 2.82Å; D138-E141 VanDerWaalsContact O-N 3.16Å; D138-E142 PolarHBondContact O-N 3.49Å |
| 139 | E | 96.6 | Very high | 95.3 | Very high | 105 Ų | 105 | 103 Ų | 103 | 49% | 0.491 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.2 | -41.1 | 175.6 | -74.7 | 176.6 | -169 | 0 | 0 | 111.7 | Q135 E141 E142 M143 | Q135-E139 HydrophobicContact CG-CG 4.37Å; Q135-E139 WeakPolarHBondContact CG-OE1 3.38Å; Q135-E139 PolarHBondContact NE2-OE1 3.09Å; Q135-E139 WeakPolarHBondContact O-CB 3.45Å; Q135-E139 WeakPolarHBondContact O-CG 3.46Å; Q135-E139 PolarHBondContact O-N 3.47Å; E139-E141 VanDerWaalsContact C-N 3.34Å; E139-E142 PolarHBondContact O-N 2.95Å; E139-M143 WeakPolarHBondContact O-CG 3.49Å; E139-M143 PolarHBondContact O-N 3.07Å |
| 140 | L | 97.1 | Very high | 95.8 | Very high | 82 Ų | 82 | 105.4 Ų | 105.4 | 43% | 0.429 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.6 | -38.8 | 174.9 | -178.6 | 64.1 | 0 | 0 | 0 | 111.8 | A136 A137 D138 M143 K144 | A136-L140 WeakPolarHBondContact O-CB 3.43Å; A136-L140 PolarHBondContact O-N 3.38Å; A136-L140 VanDerWaalsContact O-N 3.12Å; A137-L140 PolarHBondContact O-N 3.49Å; D138-L140 VanDerWaalsContact C-N 3.32Å; D138-L140 PolarHBondContact O-N 3.27Å; L140-M143 HydrophobicContact CD1-CE 4.02Å; L140-K144 WeakPolarHBondContact O-CG 3.47Å; L140-K144 PolarHBondContact O-N 3.19Å |
| 141 | E | 97.5 | Very high | 96.1 | Very high | 112 Ų | 112 | 104.4 Ų | 104.4 | 52% | 0.523 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.9 | -43.6 | 174 | -169.3 | -177.6 | 147.2 | 0 | 0 | 111.5 | A137 D138 E139 M143 K144 R145 | A137-E141 PolarHBondContact O-N 2.95Å; D138-E141 WeakPolarHBondContact O-CB 3.33Å; D138-E141 PolarHBondContact O-N 2.82Å; D138-E141 VanDerWaalsContact O-N 3.16Å; E139-E141 VanDerWaalsContact C-N 3.34Å; E141-M143 PolarHBondContact O-N 2.88Å; E141-K144 WeakPolarHBondContact O-CB 3.47Å; E141-K144 PolarHBondContact O-N 2.57Å; E141-R145 WeakPolarHBondContact O-CB 3.41Å; E141-R145 PolarHBondContact O-N 2.87Å; E141-R145 IonicContact OE1-NH2 2.82Å |
| 142 | E | 98 | Very high | 96.3 | Very high | 86 Ų | 86 | 101.1 Ų | 101.1 | 40% | 0.402 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.5 | -48.3 | 175.5 | -171.2 | 66.1 | -116.7 | 0 | 0 | 111 | D138 E139 K144 R145 V146 | D138-E142 PolarHBondContact O-N 3.49Å; E139-E142 PolarHBondContact O-N 2.95Å; E142-K144 VanDerWaalsContact C-N 3.29Å; E142-K144 PolarHBondContact O-N 3.47Å; E142-R145 WeakPolarHBondContact O-CB 3.38Å; E142-R145 PolarHBondContact O-N 3.07Å; E142-R145 IonicContact OE1-CZ 2.57Å; E142-R145 IonicContact OE1-NH1 3.72Å; E142-R145 PolarHBondContact OE1-NH1 3.33Å; E142-R145 IonicContact OE2-CZ 3.76Å; E142-R145 IonicContact OE2-NH1 3.49Å; E142-R145 PolarHBondContact OE2-NH1 2.85Å; E142-R145 IonicContact OE2-NH2 3.78Å; E142-V146 WeakPolarHBondContact O-CG2 3.33Å; E142-V146 PolarHBondContact O-N 3.42Å |
| 143 | M | 98.5 | Very high | 96.6 | Very high | 122 Ų | 122 | 101.6 Ų | 101.6 | 60% | 0.601 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -58.4 | -42.1 | 176.7 | -77 | -166 | -72.3 | 0 | 0 | 112 | E139 L140 E141 R145 V146 R147 | E139-M143 WeakPolarHBondContact O-CG 3.49Å; E139-M143 PolarHBondContact O-N 3.07Å; L140-M143 HydrophobicContact CD1-CE 4.02Å; E141-M143 PolarHBondContact O-N 2.88Å; M143-R145 VanDerWaalsContact C-N 3.34Å; M143-R145 PolarHBondContact O-N 3.16Å; M143-V146 PolarHBondContact O-N 3.29Å; M143-R147 VanDerWaalsContact O-CB 3.32Å; M143-R147 WeakPolarHBondContact O-CB 3.32Å; M143-R147 PolarHBondContact O-N 3.49Å |
| 144 | K | 98.5 | Very high | 96.8 | Very high | 127 Ų | 127 | 101 Ų | 101 | 55% | 0.552 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62.9 | -41.5 | 175.5 | -75 | 170.7 | -178.8 | 170.9 | 0 | 111.4 | L140 E141 E142 N148 | L140-K144 WeakPolarHBondContact O-CG 3.47Å; L140-K144 PolarHBondContact O-N 3.19Å; E141-K144 WeakPolarHBondContact O-CB 3.47Å; E141-K144 PolarHBondContact O-N 2.57Å; E142-K144 VanDerWaalsContact C-N 3.29Å; E142-K144 PolarHBondContact O-N 3.47Å; K144-N148 VanDerWaalsContact O-CB 3.27Å; K144-N148 WeakPolarHBondContact O-CB 3.45Å; K144-N148 PolarHBondContact O-N 3.31Å |
| 145 | R | 98.6 | Very high | 96.9 | Very high | 124 Ų | 124 | 103.2 Ų | 103.2 | 47% | 0.468 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.7 | -47.9 | 178.5 | -165.2 | -170.9 | -51.5 | 135.1 | 4.5 | 111.5 | E141 E142 M143 N148 K149 | E141-R145 WeakPolarHBondContact O-CB 3.41Å; E141-R145 PolarHBondContact O-N 2.87Å; E141-R145 IonicContact OE1-NH2 2.82Å; E142-R145 WeakPolarHBondContact O-CB 3.38Å; E142-R145 PolarHBondContact O-N 3.07Å; E142-R145 IonicContact OE1-CZ 2.57Å; E142-R145 IonicContact OE1-NH1 3.72Å; E142-R145 PolarHBondContact OE1-NH1 3.33Å; E142-R145 IonicContact OE2-CZ 3.76Å; E142-R145 IonicContact OE2-NH1 3.49Å; E142-R145 PolarHBondContact OE2-NH1 2.85Å; E142-R145 IonicContact OE2-NH2 3.78Å; M143-R145 VanDerWaalsContact C-N 3.34Å; M143-R145 PolarHBondContact O-N 3.16Å; R145-N148 PolarHBondContact O-N 3.49Å; R145-K149 WeakPolarHBondContact O-CB 3.37Å; R145-K149 PolarHBondContact O-N 3.01Å |
| 146 | V | 98.6 | Very high | 96.8 | Very high | 77 Ų | 77 | 104.8 Ų | 104.8 | 47% | 0.467 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.1 | -47.4 | 177.3 | 173 | 0 | 0 | 0 | 0 | 110.7 | E142 M143 N148 K149 L150 | E142-V146 WeakPolarHBondContact O-CG2 3.33Å; E142-V146 PolarHBondContact O-N 3.42Å; M143-V146 PolarHBondContact O-N 3.29Å; V146-N148 PolarHBondContact O-N 3.05Å; V146-K149 WeakPolarHBondContact O-CB 3.44Å; V146-K149 PolarHBondContact O-N 2.9Å; V146-L150 HydrophobicContact CG1-CD1 4.26Å; V146-L150 WeakPolarHBondContact O-CG 3.04Å; V146-L150 PolarHBondContact O-N 3.3Å |
| 147 | R | 98.3 | Very high | 96.6 | Very high | 182 Ų | 182 | 105.8 Ų | 105.8 | 69% | 0.687 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -56 | -49.5 | 174.8 | -178.4 | -164.9 | 175.5 | -152.6 | 0.5 | 111.3 | M143 K149 L150 M151 | M143-R147 VanDerWaalsContact O-CB 3.32Å; M143-R147 WeakPolarHBondContact O-CB 3.32Å; M143-R147 PolarHBondContact O-N 3.49Å; R147-K149 PolarHBondContact O-N 2.95Å; R147-L150 PolarHBondContact O-N 2.93Å; R147-M151 WeakPolarHBondContact O-CG 3.27Å; R147-M151 PolarHBondContact O-N 3Å |
| 148 | N | 98.1 | Very high | 96.1 | Very high | 93 Ų | 93 | 108.8 Ų | 108.8 | 50% | 0.497 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.3 | -43.5 | -178.2 | -169.3 | -49.7 | 0 | 0 | 0 | 111.1 | K144 R145 V146 L150 M151 I152 | K144-N148 VanDerWaalsContact O-CB 3.27Å; K144-N148 WeakPolarHBondContact O-CB 3.45Å; K144-N148 PolarHBondContact O-N 3.31Å; R145-N148 PolarHBondContact O-N 3.49Å; V146-N148 PolarHBondContact O-N 3.05Å; N148-L150 VanDerWaalsContact C-N 3.33Å; N148-L150 PolarHBondContact O-N 2.9Å; N148-M151 WeakPolarHBondContact O-CB 3.33Å; N148-M151 PolarHBondContact O-N 3.47Å; N148-M151 VanDerWaalsContact O-N 3.17Å; N148-I152 WeakPolarHBondContact O-CG1 3.31Å; N148-I152 PolarHBondContact O-N 3.27Å; N148-I152 WeakPolarHBondContact OD1-CD1 3.49Å; N148-I152 WeakPolarHBondContact OD1-CG1 3.27Å |
| 149 | K | 98.3 | Very high | 95.3 | Very high | 133 Ų | 133 | 111.7 Ų | 111.7 | 58% | 0.578 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -55.6 | -48.1 | 175 | -179.7 | 65.7 | 174.6 | -162.5 | 0 | 111.6 | R145 V146 R147 I152 M153 | R145-K149 WeakPolarHBondContact O-CB 3.37Å; R145-K149 PolarHBondContact O-N 3.01Å; V146-K149 WeakPolarHBondContact O-CB 3.44Å; V146-K149 PolarHBondContact O-N 2.9Å; R147-K149 PolarHBondContact O-N 2.95Å; K149-I152 PolarHBondContact O-N 2.87Å; K149-M153 HydrophobicContact CD-CG 4.49Å; K149-M153 HydrophobicContact CD-SD 4.39Å; K149-M153 HydrophobicContact CG-SD 4.09Å; K149-M153 WeakPolarHBondContact O-CB 3.42Å; K149-M153 VanDerWaalsContact O-CG 3.27Å; K149-M153 WeakPolarHBondContact O-CG 3.47Å; K149-M153 PolarHBondContact O-N 3.17Å |
| 150 | L | 97.9 | Very high | 94.1 | Very high | 107 Ų | 107 | 111 Ų | 111 | 56% | 0.56 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.1 | -43.9 | 177.2 | -73 | 171.1 | 0 | 0 | 0 | 111.8 | V146 R147 N148 I152 M153 H154 | V146-L150 HydrophobicContact CG1-CD1 4.26Å; V146-L150 WeakPolarHBondContact O-CG 3.04Å; V146-L150 PolarHBondContact O-N 3.3Å; R147-L150 PolarHBondContact O-N 2.93Å; N148-L150 VanDerWaalsContact C-N 3.33Å; N148-L150 PolarHBondContact O-N 2.9Å; L150-I152 PolarHBondContact O-N 3.46Å; L150-M153 PolarHBondContact O-N 3.38Å; L150-H154 WeakPolarHBondContact O-CB 3.42Å; L150-H154 PolarHBondContact O-N 2.98Å |
| 151 | M | 97.3 | Very high | 93 | Very high | 112 Ų | 112 | 116.8 Ų | 116.8 | 55% | 0.552 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -59.4 | -45.9 | 175.8 | -72.5 | -62.5 | -64.9 | 0 | 0 | 112 | R147 N148 H154 W155 | R147-M151 WeakPolarHBondContact O-CG 3.27Å; R147-M151 PolarHBondContact O-N 3Å; N148-M151 WeakPolarHBondContact O-CB 3.33Å; N148-M151 PolarHBondContact O-N 3.47Å; N148-M151 VanDerWaalsContact O-N 3.17Å; M151-H154 PolarHBondContact O-N 2.93Å; M151-W155 VanDerWaalsContact O-CB 3.25Å; M151-W155 WeakPolarHBondContact O-CB 3.47Å; M151-W155 PolarHBondContact O-N 3.31Å |
| 152 | I | 96.4 | Very high | 92.2 | Very high | 65 Ų | 65 | 117 Ų | 117 | 33% | 0.333 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.4 | -43.1 | 176.9 | -69.2 | 174 | 0 | 0 | 0 | 110.9 | N148 K149 L150 W155 K156 | N148-I152 WeakPolarHBondContact O-CG1 3.31Å; N148-I152 PolarHBondContact O-N 3.27Å; N148-I152 WeakPolarHBondContact OD1-CD1 3.49Å; N148-I152 WeakPolarHBondContact OD1-CG1 3.27Å; K149-I152 PolarHBondContact O-N 2.87Å; L150-I152 PolarHBondContact O-N 3.46Å; I152-W155 PolarHBondContact O-N 3.35Å; I152-K156 HydrophobicContact CG2-CD 3.95Å; I152-K156 HydrophobicContact CG2-CG 4.26Å; I152-K156 WeakPolarHBondContact O-CB 3.44Å; I152-K156 WeakPolarHBondContact O-CG 3.25Å; I152-K156 PolarHBondContact O-N 2.86Å |
| 153 | M | 97.2 | Very high | 90.7 | Very high | 106 Ų | 106 | 123.1 Ų | 123.1 | 52% | 0.522 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -59.3 | -50.1 | 177.7 | -77.1 | 177 | 63 | 0 | 0 | 111.1 | K149 L150 W155 K156 A157 | K149-M153 HydrophobicContact CD-CG 4.49Å; K149-M153 HydrophobicContact CD-SD 4.39Å; K149-M153 HydrophobicContact CG-SD 4.09Å; K149-M153 WeakPolarHBondContact O-CB 3.42Å; K149-M153 VanDerWaalsContact O-CG 3.27Å; K149-M153 WeakPolarHBondContact O-CG 3.47Å; K149-M153 PolarHBondContact O-N 3.17Å; L150-M153 PolarHBondContact O-N 3.38Å; M153-W155 VanDerWaalsContact C-N 3.33Å; M153-W155 PolarHBondContact O-N 2.86Å; M153-K156 PolarHBondContact O-N 3.35Å; M153-A157 WeakPolarHBondContact O-CB 3.47Å; M153-A157 PolarHBondContact O-N 2.85Å |
| 154 | H | 94.1 | Very high | 89.8 | Confident | 101 Ų | 101 | 123.5 Ų | 123.5 | 47% | 0.468 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -58.7 | -45.1 | 177 | -179.1 | 61.4 | 0 | 0 | 0 | 112.3 | L150 M151 A157 K158 | L150-H154 WeakPolarHBondContact O-CB 3.42Å; L150-H154 PolarHBondContact O-N 2.98Å; M151-H154 PolarHBondContact O-N 2.93Å; H154-A157 PolarHBondContact O-N 3.38Å; H154-K158 WeakPolarHBondContact CE1-CE 3.36Å; H154-K158 PolarHBondContact CE1-NZ 3.4Å; H154-K158 VanDerWaalsContact NE2-CE 3.31Å; H154-K158 WeakPolarHBondContact NE2-CE 3.16Å; H154-K158 PolarHBondContact NE2-NZ 3.35Å; H154-K158 WeakPolarHBondContact O-CG 3.32Å; H154-K158 PolarHBondContact O-N 2.95Å |
| 155 | W | 94.8 | Very high | 88.4 | Confident | 138 Ų | 138 | 128.9 Ų | 128.9 | 52% | 0.523 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -64.7 | -42.7 | 179.2 | -177.5 | 55.3 | 0 | 0 | 0 | 112.5 | M151 I152 M153 K158 R159 | M151-W155 VanDerWaalsContact O-CB 3.25Å; M151-W155 WeakPolarHBondContact O-CB 3.47Å; M151-W155 PolarHBondContact O-N 3.31Å; I152-W155 PolarHBondContact O-N 3.35Å; M153-W155 VanDerWaalsContact C-N 3.33Å; M153-W155 PolarHBondContact O-N 2.86Å; W155-K158 PolarHBondContact O-N 3.22Å; W155-R159 VanDerWaalsContact CE2-NH2 3.29Å; W155-R159 PolarHBondContact O-N 3.36Å; W155-R159 VanDerWaalsContact O-N 3.09Å |
| 156 | K | 92.7 | Very high | 87.9 | Confident | 133 Ų | 133 | 129.1 Ų | 129.1 | 58% | 0.578 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -60.9 | -46.1 | 174.4 | -78.2 | -179 | 178.1 | -178.5 | 0 | 111.3 | I152 M153 K158 R159 S160 | I152-K156 HydrophobicContact CG2-CD 3.95Å; I152-K156 HydrophobicContact CG2-CG 4.26Å; I152-K156 WeakPolarHBondContact O-CB 3.44Å; I152-K156 WeakPolarHBondContact O-CG 3.25Å; I152-K156 PolarHBondContact O-N 2.86Å; M153-K156 PolarHBondContact O-N 3.35Å; K156-K158 VanDerWaalsContact C-N 3.31Å; K156-K158 PolarHBondContact O-N 3.09Å; K156-R159 PolarHBondContact O-N 3.38Å; K156-S160 PolarHBondContact O-N 3.43Å; K156-S160 PolarHBondContact O-OG 2.86Å |
| 157 | A | 89.8 | Confident | 87.4 | Confident | 66 Ų | 66 | 131.8 Ų | 131.8 | 55% | 0.545 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -61.7 | -37.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | M153 H154 | M153-A157 WeakPolarHBondContact O-CB 3.47Å; M153-A157 PolarHBondContact O-N 2.85Å; H154-A157 PolarHBondContact O-N 3.38Å |
| 158 | K | 83.9 | Confident | 86.8 | Confident | 120 Ų | 120 | 129.1 Ų | 129.1 | 52% | 0.522 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -71.8 | -29.4 | 177.3 | -77 | -179.8 | 164.4 | -177.2 | 0 | 113.7 | H154 W155 K156 | H154-K158 WeakPolarHBondContact CE1-CE 3.36Å; H154-K158 PolarHBondContact CE1-NZ 3.4Å; H154-K158 VanDerWaalsContact NE2-CE 3.31Å; H154-K158 WeakPolarHBondContact NE2-CE 3.16Å; H154-K158 PolarHBondContact NE2-NZ 3.35Å; H154-K158 WeakPolarHBondContact O-CG 3.32Å; H154-K158 PolarHBondContact O-N 2.95Å; W155-K158 PolarHBondContact O-N 3.22Å; K156-K158 VanDerWaalsContact C-N 3.31Å; K156-K158 PolarHBondContact O-N 3.09Å |
| 159 | R | 79 | Confident | 86.1 | Confident | 155 Ų | 155 | 131.2 Ų | 131.2 | 59% | 0.585 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -76.1 | -20.9 | 177.7 | -84.7 | -143.7 | -168.3 | 101.7 | -19.9 | 115 | W155 K156 R161 | W155-R159 VanDerWaalsContact CE2-NH2 3.29Å; W155-R159 PolarHBondContact O-N 3.36Å; W155-R159 VanDerWaalsContact O-N 3.09Å; K156-R159 PolarHBondContact O-N 3.38Å; R159-R161 PolarHBondContact O-N 3.3Å |
| 160 | S | 71.9 | Confident | 85.3 | Confident | 91 Ų | 91 | 131.1 Ų | 131.1 | 64% | 0.636 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | 7.5 | -176.5 | -18.6 | 0 | 0 | 0 | 0 | 113.2 | K156 P162 | K156-S160 PolarHBondContact O-N 3.43Å; K156-S160 PolarHBondContact O-OG 2.86Å; S160-P162 VanDerWaalsContact O-CD 3.22Å; S160-P162 WeakPolarHBondContact O-CD 3.22Å |
| 161 | R | 74.6 | Confident | 84.5 | Confident | 203 Ų | 203 | 132.7 Ų | 132.7 | 77% | 0.766 | 65% | 0.647 | S | S | * | * | trans | -72.3 | 114.4 | -179.1 | -70.4 | -171 | 175.2 | -144.9 | -1.2 | 109.1 | R159 | R159-R161 PolarHBondContact O-N 3.3Š| ||
| 162 | P | 79.1 | Confident | 83.6 | Confident | 117 Ų | 117 | 134.1 Ų | 134.1 | 76% | 0.76 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 142.7 | 172.3 | 26.1 | -31.7 | 0 | 0 | 0 | 108.8 | S160 | S160-P162 VanDerWaalsContact O-CD 3.22Å; S160-P162 WeakPolarHBondContact O-CD 3.22Å |
| 163 | Y | 68.4 | Low | 82.6 | Confident | 214 Ų | 214 | 139.5 Ų | 139.5 | 84% | 0.839 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 136.4 | 172.8 | -71.3 | -82 | 0 | 0 | 0 | 109 | I165 | Y163-I165 PolarHBondContact O-N 3.32Š|
| 164 | P | 77.7 | Confident | 81.4 | Confident | 130 Ų | 130 | 142.3 Ų | 142.3 | 84% | 0.844 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 131.2 | 175.6 | 24.2 | -30.7 | 0 | 0 | 0 | 109.1 | ||
| 165 | I | 70.6 | Confident | 80.2 | Confident | 239 Ų | 239 | 146 Ų | 146 | 100% | 1.226 | 71% | 0.711 | S | S | * | * | trans | -85.2 | 0 | 176.9 | -57.7 | 172 | 0 | 0 | 0 | 108.8 | Y163 | Y163-I165 PolarHBondContact O-N 3.32Š|
Retrieved 165 of 165 residues in 22.6 ms
(Link to these results)