| 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 | 38 | Very low | 44.4 | Very low | 242 Ų | 242 | 129 Ų | 129 | 100% | 1.192 | 83% | 0.831 | S | S | * | * | 0 | 143.9 | 0 | -88 | 177.3 | 142.1 | 0 | 0 | 108.1 | |||||
| 2 | P | 53.2 | Low | 43.6 | Very low | 117 Ų | 117 | 123.8 Ų | 123.8 | 76% | 0.76 | 82% | 0.819 | S | S | * | * | trans | -91.4 | 175.3 | -137.2 | 40.8 | -35.9 | 0 | 0 | 0 | 111.4 | ||||
| 3 | S | 40.9 | Very low | 44 | Very low | 109 Ų | 109 | 133.1 Ų | 133.1 | 76% | 0.762 | 83% | 0.827 | S | S | * | * | cis | -167 | 151.9 | 35.2 | -52.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 4 | D | 44.5 | Very low | 44.1 | Very low | 150 Ų | 150 | 132.1 Ų | 132.1 | 80% | 0.802 | 82% | 0.823 | S | S | * | * | trans | -55.7 | 164.7 | 150.8 | -116.5 | -91.8 | 0 | 0 | 0 | 110.4 | ||||
| 5 | P | 52.5 | Low | 44.6 | Very low | 120 Ų | 120 | 128.5 Ų | 128.5 | 78% | 0.779 | 82% | 0.823 | S | S | * | * | cis | -151.3 | 169.2 | 38.2 | 38.2 | -14.5 | 0 | 0 | 0 | 120 | ||||
| 6 | G | 37.9 | Very low | 44.6 | Very low | 62 Ų | 62 | 131.3 Ų | 131.3 | 64% | 0.639 | 83% | 0.828 | S | S | * | * | trans | 91.5 | 142.4 | 131.1 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 7 | P | 51.3 | Low | 45.1 | Very low | 135 Ų | 135 | 132.5 Ų | 132.5 | 88% | 0.877 | 83% | 0.826 | S | S | * | * | trans | -86.2 | 126.4 | 172.8 | 33.2 | -30.6 | 0 | 0 | 0 | 112.4 | ||||
| 8 | E | 42.3 | Very low | 45.6 | Very low | 189 Ų | 189 | 134.6 Ų | 134.6 | 88% | 0.883 | 83% | 0.827 | S | S | * | * | trans | -76.2 | 121.4 | 174.7 | -95.4 | -96.5 | 86.4 | 0 | 0 | 111.6 | G10 | E8-G10 PolarHBondContact O-N 3.48Š| ||
| 9 | A | 44.4 | Very low | 46.1 | Very low | 87 Ų | 87 | 133.5 Ų | 133.5 | 72% | 0.719 | 83% | 0.825 | S | S | * | * | trans | -80.5 | 100.4 | 169.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | S11 | A9-S11 PolarHBondContact O-N 3.32Š| ||
| 10 | G | 39.5 | Very low | 46.5 | Very low | 83 Ų | 83 | 133.2 Ų | 133.2 | 86% | 0.856 | 83% | 0.826 | S | S | * | * | trans | -73.4 | 108.2 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | E8 | E8-G10 PolarHBondContact O-N 3.48Š| ||
| 11 | S | 43.3 | Very low | 47 | Very low | 125 Ų | 125 | 135.3 Ų | 135.3 | 87% | 0.874 | 83% | 0.831 | S | S | * | * | trans | -83 | 142.8 | 168.5 | 45.3 | 0 | 0 | 0 | 0 | 110.2 | A9 | A9-S11 PolarHBondContact O-N 3.32Š| ||
| 12 | G | 35.2 | Very low | 47.8 | Very low | 66 Ų | 66 | 134 Ų | 134 | 68% | 0.68 | 82% | 0.819 | S | S | * | * | trans | 153.3 | 66.5 | 164.9 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 13 | W | 48.7 | Very low | 47.9 | Very low | 245 Ų | 245 | 130.7 Ų | 130.7 | 93% | 0.928 | 81% | 0.807 | S | S | * | * | trans | 83 | 103.1 | 142.9 | -56.8 | 18.8 | 0 | 0 | 0 | 118.5 | ||||
| 14 | P | 45.1 | Very low | 48.4 | Very low | 119 Ų | 119 | 131.3 Ų | 131.3 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | trans | -75.9 | 137.8 | 162.8 | 29.4 | -30.1 | 0 | 0 | 0 | 111 | L16 | P14-L16 PolarHBondContact O-N 3.18Š| ||
| 15 | G | 51.6 | Low | 49 | Very low | 79 Ų | 79 | 132.8 Ų | 132.8 | 81% | 0.814 | 81% | 0.81 | S | S | * | * | trans | -54.6 | 118.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | L17 | G15-L17 PolarHBondContact O-N 2.77Š| ||
| 16 | L | 44.8 | Very low | 48.7 | Very low | 173 Ų | 173 | 132.5 Ų | 132.5 | 91% | 0.906 | 81% | 0.806 | S | S | * | * | trans | -94.9 | 75.6 | 167.6 | -130.1 | 79.8 | 0 | 0 | 0 | 108.6 | P14 M18 | P14-L16 PolarHBondContact O-N 3.18Å; L16-M18 PolarHBondContact O-N 3.04Å | ||
| 17 | L | 53 | Low | 49.4 | Very low | 151 Ų | 151 | 136.7 Ų | 136.7 | 79% | 0.791 | 81% | 0.812 | S | S | * | * | trans | -74.4 | 116.3 | 165.7 | -91 | 161.1 | 0 | 0 | 0 | 109.2 | G15 | G15-L17 PolarHBondContact O-N 2.77Š| ||
| 18 | M | 55.1 | Low | 49.4 | Very low | 171 Ų | 171 | 137.7 Ų | 137.7 | 84% | 0.842 | 81% | 0.809 | S | S | * | * | trans | 45 | 83.2 | 140.9 | -62.9 | -64.4 | 134.9 | 0 | 0 | 116.7 | L16 | L16-M18 PolarHBondContact O-N 3.04Š| ||
| 19 | S | 54.3 | Low | 49.7 | Very low | 114 Ų | 114 | 137 Ų | 137 | 80% | 0.797 | 80% | 0.803 | S | S | * | * | trans | -147.8 | 73.6 | 164.7 | -76.4 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 20 | C | 53.9 | Low | 50.1 | Low | 126 Ų | 126 | 140.6 Ų | 140.6 | 85% | 0.851 | 81% | 0.807 | S | S | * | * | trans | -152.9 | 52.6 | 166 | -86.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 21 | L | 56.4 | Low | 51.1 | Low | 178 Ų | 178 | 143.9 Ų | 143.9 | 93% | 0.932 | 80% | 0.8 | S | S | * | * | trans | -139.7 | 72.3 | 162.9 | -72.5 | 175.2 | 0 | 0 | 0 | 108.9 | ||||
| 22 | K | 56.2 | Low | 52 | Low | 214 Ų | 214 | 142.8 Ų | 142.8 | 93% | 0.93 | 80% | 0.798 | S | S | * | * | trans | -137.1 | 62.6 | 163.6 | -141 | 153 | -173.8 | -174.7 | 0 | 109.5 | ||||
| 23 | G | 54.7 | Low | 52.9 | Low | 49 Ų | 49 | 147.1 Ų | 147.1 | 51% | 0.505 | 80% | 0.803 | S | S | . | * | S | Bend | trans | -80.6 | 152.3 | 154 | 0 | 0 | 0 | 0 | 0 | 109 | H25 | G23-H25 PolarHBondContact O-N 3.44Š|
| 24 | P | 52 | Low | 53.2 | Low | 122 Ų | 122 | 144.6 Ų | 144.6 | 79% | 0.792 | 80% | 0.798 | S | S | * | * | trans | -60.3 | 123.3 | 175.3 | 25 | -31.4 | 0 | 0 | 0 | 109.2 | V26 | P24-V26 VanDerWaalsContact C-N 3.31Å; P24-V26 PolarHBondContact O-N 3.18Å | ||
| 25 | H | 56.4 | Low | 53.9 | Low | 181 Ų | 181 | 146 Ų | 146 | 84% | 0.838 | 80% | 0.798 | S | S | * | * | trans | -64.8 | 97 | 163.4 | -84 | -98.2 | 0 | 0 | 0 | 107.3 | G23 I27 | G23-H25 PolarHBondContact O-N 3.44Å; H25-I27 VanDerWaalsContact C-N 3.29Å; H25-I27 PolarHBondContact O-N 3.44Å | ||
| 26 | V | 47.1 | Very low | 54.2 | Low | 114 Ų | 114 | 148.3 Ų | 148.3 | 69% | 0.691 | 80% | 0.796 | S | S | * | * | trans | -72.6 | 95.2 | 165 | -174.3 | 0 | 0 | 0 | 0 | 106 | P24 L28 | P24-V26 VanDerWaalsContact C-N 3.31Å; P24-V26 PolarHBondContact O-N 3.18Å; V26-L28 VanDerWaalsContact C-N 3.26Å; V26-L28 HydrophobicContact CG1-CG 4.39Å; V26-L28 PolarHBondContact O-N 2.74Å | ||
| 27 | I | 52.9 | Low | 54.6 | Low | 150 Ų | 150 | 147.1 Ų | 147.1 | 77% | 0.769 | 79% | 0.785 | S | S | * | * | trans | -68.3 | 92.2 | 168.1 | -65.1 | 166.4 | 0 | 0 | 0 | 105.9 | H25 K29 | H25-I27 VanDerWaalsContact C-N 3.29Å; H25-I27 PolarHBondContact O-N 3.44Å; I27-K29 VanDerWaalsContact C-N 3.31Å; I27-K29 PolarHBondContact O-N 3.05Å | ||
| 28 | L | 49.8 | Very low | 54.4 | Low | 156 Ų | 156 | 146 Ų | 146 | 82% | 0.817 | 79% | 0.787 | S | S | * | * | trans | -66.8 | 98.3 | 162.1 | -80.4 | 153.6 | 0 | 0 | 0 | 106.4 | V26 M30 | V26-L28 VanDerWaalsContact C-N 3.26Å; V26-L28 HydrophobicContact CG1-CG 4.39Å; V26-L28 PolarHBondContact O-N 2.74Å; L28-M30 VanDerWaalsContact C-N 3.29Å; L28-M30 PolarHBondContact O-N 3.48Å | ||
| 29 | K | 49.4 | Very low | 54.2 | Low | 173 Ų | 173 | 145.6 Ų | 145.6 | 75% | 0.752 | 78% | 0.783 | S | S | * | * | trans | -66 | 94.6 | 170.1 | -167.4 | 175 | -180 | 174.3 | 0 | 106.7 | I27 E31 | I27-K29 VanDerWaalsContact C-N 3.31Å; I27-K29 PolarHBondContact O-N 3.05Å; K29-E31 VanDerWaalsContact C-N 3.32Å; K29-E31 PolarHBondContact O-N 2.93Å | ||
| 30 | M | 53.2 | Low | 53.8 | Low | 164 Ų | 164 | 149.4 Ų | 149.4 | 81% | 0.808 | 79% | 0.785 | S | S | * | * | trans | -70.6 | 96 | 174.1 | -163.8 | 140.2 | 73.2 | 0 | 0 | 107 | L28 A32 | L28-M30 VanDerWaalsContact C-N 3.29Å; L28-M30 PolarHBondContact O-N 3.48Å; M30-A32 PolarHBondContact O-N 3.04Å | ||
| 31 | E | 61 | Low | 53.1 | Low | 152 Ų | 152 | 152.6 Ų | 152.6 | 71% | 0.71 | 79% | 0.785 | S | S | * | * | trans | -64.3 | 130 | 171.7 | -54.1 | -166.5 | 139.2 | 0 | 0 | 107.4 | K29 M33 | K29-E31 VanDerWaalsContact C-N 3.32Å; K29-E31 PolarHBondContact O-N 2.93Å; E31-M33 PolarHBondContact O-N 3.39Å | ||
| 32 | A | 60.5 | Low | 52.5 | Low | 101 Ų | 101 | 149 Ų | 149 | 84% | 0.835 | 77% | 0.772 | S | S | * | * | trans | -56.5 | 110.5 | -175.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | M30 K34 | M30-A32 PolarHBondContact O-N 3.04Å; A32-K34 PolarHBondContact O-N 3.33Å | ||
| 33 | M | 55.4 | Low | 52.3 | Low | 157 Ų | 157 | 148 Ų | 148 | 77% | 0.773 | 77% | 0.771 | S | S | * | * | trans | -61.6 | 111.8 | 170.2 | -53.3 | 176.4 | 179.9 | 0 | 0 | 106.6 | E31 I35 | E31-M33 PolarHBondContact O-N 3.39Å; M33-I35 PolarHBondContact O-N 3.22Å | ||
| 34 | K | 54.2 | Low | 52 | Low | 193 Ų | 193 | 152.5 Ų | 152.5 | 84% | 0.839 | 78% | 0.783 | S | S | * | * | trans | -64.4 | 104.2 | 176.7 | -170.6 | 174.8 | -178.3 | -179.9 | 0 | 107.8 | A32 V36 | A32-K34 PolarHBondContact O-N 3.33Å; K34-V36 PolarHBondContact O-N 2.75Å | ||
| 35 | I | 59.3 | Low | 51.8 | Low | 148 Ų | 148 | 152.2 Ų | 152.2 | 76% | 0.759 | 78% | 0.781 | S | S | * | * | trans | -60.4 | 111.1 | 171.8 | -62.9 | 166.6 | 0 | 0 | 0 | 106.7 | M33 H37 | M33-I35 PolarHBondContact O-N 3.22Å; I35-H37 PolarHBondContact O-N 3.05Å | ||
| 36 | V | 58 | Low | 51.6 | Low | 127 Ų | 127 | 148.4 Ų | 148.4 | 77% | 0.77 | 78% | 0.781 | S | S | * | * | trans | -74.2 | 111.1 | 171 | 176.5 | 0 | 0 | 0 | 0 | 106.8 | K34 | K34-V36 PolarHBondContact O-N 2.75Š| ||
| 37 | H | 53.3 | Low | 52 | Low | 148 Ų | 148 | 146.9 Ų | 146.9 | 69% | 0.685 | 78% | 0.78 | S | S | * | * | trans | -63.4 | 135.9 | 168.4 | -100.7 | -103.8 | 0 | 0 | 0 | 109.5 | I35 E39 | I35-H37 PolarHBondContact O-N 3.05Å; H37-E39 VanDerWaalsContact C-N 3.28Å; H37-E39 PolarHBondContact O-N 2.85Å | ||
| 38 | P | 49.7 | Very low | 51.9 | Low | 129 Ų | 129 | 144.4 Ų | 144.4 | 84% | 0.838 | 77% | 0.774 | S | S | * | * | trans | -78 | 82.1 | 173.9 | 32.7 | -32.3 | 0 | 0 | 0 | 108.8 | ||||
| 39 | E | 51 | Low | 52.1 | Low | 162 Ų | 162 | 143.2 Ų | 143.2 | 76% | 0.757 | 78% | 0.777 | S | S | * | * | trans | -117.6 | 126.6 | 164.2 | -75.1 | -153.3 | 86.9 | 0 | 0 | 110.8 | H37 | H37-E39 VanDerWaalsContact C-N 3.28Å; H37-E39 PolarHBondContact O-N 2.85Å | ||
| 40 | K | 45.7 | Very low | 52.3 | Low | 193 Ų | 193 | 143 Ų | 143 | 84% | 0.839 | 78% | 0.777 | S | S | * | * | trans | 67.4 | 88.1 | 170.4 | -80.2 | 167.3 | 171.6 | 173.8 | 0 | 116.4 | P42 | K40-P42 WeakPolarHBondContact O-CD 3.44Š| ||
| 41 | F | 38 | Very low | 52.8 | Low | 194 Ų | 194 | 140.4 Ų | 140.4 | 85% | 0.851 | 77% | 0.772 | S | S | * | * | trans | -64.3 | 122.9 | 146.1 | -125.6 | -94.8 | 0 | 0 | 0 | 108.3 | E43 | F41-E43 PolarHBondContact O-N 2.59Š| ||
| 42 | P | 45.4 | Very low | 52.4 | Low | 102 Ų | 102 | 139 Ų | 139 | 66% | 0.662 | 78% | 0.776 | S | S | * | * | trans | -67.6 | 124.8 | 159.6 | -7.7 | 24.3 | 0 | 0 | 0 | 107.2 | K40 L44 | K40-P42 WeakPolarHBondContact O-CD 3.44Å; P42-L44 PolarHBondContact O-N 2.92Å | ||
| 43 | E | 50.5 | Low | 52.4 | Low | 193 Ų | 193 | 138.3 Ų | 138.3 | 90% | 0.902 | 77% | 0.77 | S | S | * | * | trans | -56 | 107.3 | 171.3 | -162.5 | 169.3 | 93.5 | 0 | 0 | 108.5 | F41 | F41-E43 PolarHBondContact O-N 2.59Š| ||
| 44 | L | 48.4 | Very low | 52.4 | Low | 143 Ų | 143 | 136.7 Ų | 136.7 | 75% | 0.749 | 77% | 0.771 | S | S | * | * | trans | -78.7 | 133.6 | 171 | -74.9 | 173.2 | 0 | 0 | 0 | 108 | P42 | P42-L44 PolarHBondContact O-N 2.92Š| ||
| 45 | P | 49 | Very low | 52.5 | Low | 117 Ų | 117 | 138.6 Ų | 138.6 | 76% | 0.76 | 77% | 0.773 | S | S | * | * | trans | -62.2 | 141.3 | 177.2 | 25.2 | -31.4 | 0 | 0 | 0 | 110 | A47 | P45-A47 PolarHBondContact O-N 3.27Š| ||
| 46 | A | 51 | Low | 52.1 | Low | 100 Ų | 100 | 137.3 Ų | 137.3 | 83% | 0.826 | 77% | 0.774 | S | S | * | * | trans | -43.2 | 121 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 47 | A | 56.7 | Low | 51.7 | Low | 83 Ų | 83 | 137.2 Ų | 137.2 | 69% | 0.686 | 77% | 0.774 | S | S | * | * | trans | -58.6 | 139.5 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | P45 C49 | P45-A47 PolarHBondContact O-N 3.27Å; A47-C49 PolarHBondContact O-N 3.15Å | ||
| 48 | P | 51.1 | Low | 51.3 | Low | 97 Ų | 97 | 135.8 Ų | 135.8 | 63% | 0.63 | 78% | 0.778 | S | S | * | * | trans | -57.4 | 127.1 | 174.3 | -18.8 | 29.4 | 0 | 0 | 0 | 109.6 | F50 | P48-F50 VanDerWaalsContact C-N 3.33Å; P48-F50 HydrophobicContact CB-CE2 4.15Å; P48-F50 HydrophobicContact CG-CE2 4.47Å; P48-F50 VanDerWaalsContact O-CD2 3.31Å; P48-F50 WeakPolarHBondContact O-CD2 3.47Å; P48-F50 PolarHBondContact O-N 2.84Å | ||
| 49 | C | 53.2 | Low | 51.3 | Low | 131 Ų | 131 | 136 Ų | 136 | 89% | 0.885 | 78% | 0.777 | S | S | * | * | trans | -64.1 | 94.2 | 170.8 | -67.8 | 0 | 0 | 0 | 0 | 109 | A47 | A47-C49 PolarHBondContact O-N 3.15Š| ||
| 50 | F | 54.7 | Low | 51.3 | Low | 170 Ų | 170 | 136.2 Ų | 136.2 | 75% | 0.746 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 131.7 | 164.3 | -69.4 | -81.4 | 0 | 0 | 0 | 108.5 | P48 | P48-F50 VanDerWaalsContact C-N 3.33Å; P48-F50 HydrophobicContact CB-CE2 4.15Å; P48-F50 HydrophobicContact CG-CE2 4.47Å; P48-F50 VanDerWaalsContact O-CD2 3.31Å; P48-F50 WeakPolarHBondContact O-CD2 3.47Å; P48-F50 PolarHBondContact O-N 2.84Å |
| 51 | P | 61.9 | Low | 51.3 | Low | 109 Ų | 109 | 130.8 Ų | 130.8 | 71% | 0.708 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 146.9 | 171.8 | 26.6 | -32.8 | 0 | 0 | 0 | 109.5 | A53 | P51-A53 PolarHBondContact O-N 3.41Š|
| 52 | P | 53.7 | Low | 51.7 | Low | 122 Ų | 122 | 126.9 Ų | 126.9 | 79% | 0.792 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 135.3 | 176.5 | 25 | -32.5 | 0 | 0 | 0 | 109.9 | ||
| 53 | A | 61.2 | Low | 51.6 | Low | 86 Ų | 86 | 132.1 Ų | 132.1 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 139.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | P51 R55 | P51-A53 PolarHBondContact O-N 3.41Å; A53-R55 PolarHBondContact O-N 3.16Å |
| 54 | P | 54.5 | Low | 51.1 | Low | 123 Ų | 123 | 134.1 Ų | 134.1 | 80% | 0.799 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 124.9 | 176.4 | 22.3 | -30.3 | 0 | 0 | 0 | 109.5 | ||
| 55 | R | 55.9 | Low | 51 | Low | 233 Ų | 233 | 131.5 Ų | 131.5 | 88% | 0.879 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 133.3 | 171.9 | -78.9 | -177.3 | -175.6 | -135 | 0.5 | 108.6 | A53 T57 | A53-R55 PolarHBondContact O-N 3.16Å; R55-T57 PolarHBondContact O-N 3.28Å |
| 56 | P | 50.8 | Low | 50.6 | Low | 121 Ų | 121 | 137.2 Ų | 137.2 | 79% | 0.786 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 126.2 | 166 | -13.7 | 25.5 | 0 | 0 | 0 | 108.4 | ||
| 57 | T | 50.9 | Low | 50.1 | Low | 126 Ų | 126 | 137 Ų | 137 | 77% | 0.773 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 127 | 171.2 | -27.4 | 0 | 0 | 0 | 0 | 107.2 | R55 T59 | R55-T57 PolarHBondContact O-N 3.28Å; T57-T59 PolarHBondContact O-N 2.88Å |
| 58 | P | 44.9 | Very low | 49.5 | Very low | 117 Ų | 117 | 138.1 Ų | 138.1 | 76% | 0.76 | 78% | 0.778 | S | S | * | * | trans | -62.7 | 114.4 | 174.4 | 24.2 | -30 | 0 | 0 | 0 | 107.4 | L60 | P58-L60 PolarHBondContact O-N 3.49Å; P58-L60 VanDerWaalsContact O-N 3.11Å | ||
| 59 | T | 49.1 | Very low | 49.4 | Very low | 134 Ų | 134 | 141.3 Ų | 141.3 | 82% | 0.822 | 79% | 0.79 | S | S | * | * | trans | -53.5 | 121 | 171.8 | -40.8 | 0 | 0 | 0 | 0 | 107 | T57 A61 | T57-T59 PolarHBondContact O-N 2.88Å; T59-A61 VanDerWaalsContact C-N 3.31Å; T59-A61 PolarHBondContact O-N 3.3Å | ||
| 60 | L | 50.5 | Low | 49.5 | Very low | 166 Ų | 166 | 141.1 Ų | 141.1 | 87% | 0.869 | 79% | 0.785 | S | S | * | * | trans | -55.4 | 99.9 | 170.7 | -80.4 | 162.7 | 0 | 0 | 0 | 107.4 | P58 | P58-L60 PolarHBondContact O-N 3.49Å; P58-L60 VanDerWaalsContact O-N 3.11Å | ||
| 61 | A | 46.6 | Very low | 49.1 | Very low | 80 Ų | 80 | 140.7 Ų | 140.7 | 66% | 0.661 | 79% | 0.785 | S | S | * | * | trans | -57.1 | 131.5 | 167.7 | 0 | 0 | 0 | 0 | 0 | 106.6 | T59 K63 | T59-A61 VanDerWaalsContact C-N 3.31Å; T59-A61 PolarHBondContact O-N 3.3Å; A61-K63 PolarHBondContact O-N 3.46Å | ||
| 62 | P | 45.4 | Very low | 48.7 | Very low | 112 Ų | 112 | 142.9 Ų | 142.9 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | trans | -55.5 | 131.6 | 175 | 22.7 | -30.6 | 0 | 0 | 0 | 107.4 | R64 | P62-R64 PolarHBondContact O-N 3.35Š| ||
| 63 | K | 43.7 | Very low | 48.7 | Very low | 212 Ų | 212 | 144.3 Ų | 144.3 | 92% | 0.922 | 79% | 0.789 | S | S | * | * | trans | -56.6 | 91.7 | 173.4 | -76.5 | -155.3 | 173.5 | -169.6 | 0 | 108.4 | A61 A65 | A61-K63 PolarHBondContact O-N 3.46Å; K63-A65 PolarHBondContact O-N 2.88Å | ||
| 64 | R | 39.2 | Very low | 48.1 | Very low | 235 Ų | 235 | 145.9 Ų | 145.9 | 89% | 0.887 | 79% | 0.789 | S | S | * | * | trans | -68.1 | 112.2 | 160.5 | -81.8 | -173.3 | 177.4 | -177.1 | -0.6 | 105.4 | P62 W66 | P62-R64 PolarHBondContact O-N 3.35Å; R64-W66 PolarHBondContact O-N 3.24Å | ||
| 65 | A | 46.3 | Very low | 47.5 | Very low | 88 Ų | 88 | 147.2 Ų | 147.2 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | trans | -47.3 | 138 | 164.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | K63 | K63-A65 PolarHBondContact O-N 2.88Š| ||
| 66 | W | 41.1 | Very low | 47.4 | Very low | 237 Ų | 237 | 145.7 Ų | 145.7 | 90% | 0.898 | 79% | 0.793 | S | S | * | * | trans | -45.9 | 129 | 167.8 | -95.3 | 63 | 0 | 0 | 0 | 109.3 | R64 S68 | R64-W66 PolarHBondContact O-N 3.24Å; W66-S68 PolarHBondContact O-N 3.33Å | ||
| 67 | P | 41.5 | Very low | 47.1 | Very low | 94 Ų | 94 | 143.8 Ų | 143.8 | 61% | 0.61 | 79% | 0.787 | S | S | * | * | trans | -63.5 | 127 | 172.2 | 25.7 | -29.9 | 0 | 0 | 0 | 108.2 | D69 | P67-D69 PolarHBondContact O-N 3.48Š| ||
| 68 | S | 43.8 | Very low | 46.6 | Very low | 107 Ų | 107 | 144 Ų | 144 | 75% | 0.748 | 79% | 0.792 | S | S | * | * | trans | -63.2 | 123.3 | 178.4 | -55 | 0 | 0 | 0 | 0 | 110.5 | W66 T70 | W66-S68 PolarHBondContact O-N 3.33Å; S68-T70 VanDerWaalsContact C-N 3.28Å; S68-T70 PolarHBondContact O-N 3.3Å | ||
| 69 | D | 49.3 | Very low | 46.4 | Very low | 165 Ų | 165 | 142.6 Ų | 142.6 | 88% | 0.882 | 80% | 0.799 | S | S | * | * | S | Bend | trans | 20.7 | 19.4 | 155.9 | -140.2 | -119.1 | 0 | 0 | 0 | 123.4 | P67 | P67-D69 PolarHBondContact O-N 3.48Š|
| 70 | T | 54.4 | Low | 45.7 | Very low | 127 Ų | 127 | 139.9 Ų | 139.9 | 78% | 0.779 | 80% | 0.797 | S | S | * | * | trans | -139.4 | 7.1 | 178.8 | 53.8 | 0 | 0 | 0 | 0 | 117.3 | S68 | S68-T70 VanDerWaalsContact C-N 3.28Å; S68-T70 PolarHBondContact O-N 3.3Å | ||
| 71 | E | 45.8 | Very low | 45.2 | Very low | 161 Ų | 161 | 139.1 Ų | 139.1 | 75% | 0.752 | 79% | 0.794 | S | S | * | * | trans | -108.6 | 101.9 | 174.7 | -72.3 | -172.4 | 131.9 | 0 | 0 | 111.6 | I73 | E71-I73 PolarHBondContact O-N 3.15Š| ||
| 72 | I | 53.2 | Low | 44.6 | Very low | 155 Ų | 155 | 142.9 Ų | 142.9 | 80% | 0.795 | 80% | 0.8 | S | S | * | * | trans | -72.2 | 112.2 | 170.8 | -61.8 | 155.6 | 0 | 0 | 0 | 107.3 | V74 | I72-V74 HydrophobicContact CG2-CG2 4.28Å; I72-V74 PolarHBondContact O-N 3.03Å; I72-V74 VanDerWaalsContact O-N 3.11Å | ||
| 73 | I | 53.8 | Low | 44.7 | Very low | 152 Ų | 152 | 142.6 Ų | 142.6 | 78% | 0.779 | 80% | 0.798 | S | S | * | * | trans | -73.7 | 101.8 | 172.5 | -57.3 | 171.5 | 0 | 0 | 0 | 107.5 | E71 | E71-I73 PolarHBondContact O-N 3.15Š| ||
| 74 | V | 48.4 | Very low | 44.7 | Very low | 118 Ų | 118 | 137.2 Ų | 137.2 | 72% | 0.715 | 79% | 0.794 | S | S | * | * | trans | -79.1 | 120.7 | 171.7 | -177.3 | 0 | 0 | 0 | 0 | 108.1 | I72 Q76 | I72-V74 HydrophobicContact CG2-CG2 4.28Å; I72-V74 PolarHBondContact O-N 3.03Å; I72-V74 VanDerWaalsContact O-N 3.11Å; V74-Q76 PolarHBondContact O-N 3.48Å | ||
| 75 | N | 42.4 | Very low | 44.7 | Very low | 151 Ų | 151 | 134.3 Ų | 134.3 | 81% | 0.807 | 79% | 0.794 | S | S | * | * | trans | -62.9 | 103.7 | 172.8 | -76.5 | -30.3 | 0 | 0 | 0 | 109.2 | A77 | N75-A77 PolarHBondContact O-N 3.11Å; N75-A77 VanDerWaalsContact O-N 3.07Å | ||
| 76 | Q | 55.3 | Low | 44.6 | Very low | 202 Ų | 202 | 139.8 Ų | 139.8 | 94% | 0.944 | 81% | 0.805 | S | S | * | * | trans | -79.3 | 89.7 | 177.8 | -166.1 | 166 | 55.9 | 0 | 0 | 109.2 | V74 | V74-Q76 PolarHBondContact O-N 3.48Š| ||
| 77 | A | 42.6 | Very low | 44.5 | Very low | 81 Ų | 81 | 131.8 Ų | 131.8 | 67% | 0.669 | 80% | 0.797 | S | S | * | * | trans | -127.4 | 134.6 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | N75 | N75-A77 PolarHBondContact O-N 3.11Å; N75-A77 VanDerWaalsContact O-N 3.07Å | ||
| 78 | C | 40.8 | Very low | 44.7 | Very low | 130 Ų | 130 | 131.6 Ų | 131.6 | 88% | 0.878 | 80% | 0.803 | S | S | * | * | trans | 81.4 | 98.6 | 174.6 | -56.8 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 79 | G | 40.9 | Very low | 44.5 | Very low | 87 Ų | 87 | 132.5 Ų | 132.5 | 90% | 0.897 | 81% | 0.806 | S | S | * | * | trans | -74.8 | 142.6 | 155.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 80 | G | 34.3 | Very low | 44.2 | Very low | 77 Ų | 77 | 133.5 Ų | 133.5 | 79% | 0.794 | 81% | 0.805 | S | S | * | * | trans | 158.6 | 83 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 81 | D | 40.6 | Very low | 43.7 | Very low | 151 Ų | 151 | 133.6 Ų | 133.6 | 81% | 0.807 | 81% | 0.806 | S | S | * | * | trans | 43.3 | 123.9 | 144.7 | -136.3 | -117.8 | 0 | 0 | 0 | 122.9 | ||||
| 82 | M | 34.3 | Very low | 43.5 | Very low | 158 Ų | 158 | 131.4 Ų | 131.4 | 78% | 0.778 | 81% | 0.805 | S | S | * | * | trans | 131.9 | 151.4 | 143.2 | -74.9 | -59.7 | -89.3 | 0 | 0 | 117.1 | ||||
| 83 | P | 46.2 | Very low | 43 | Very low | 106 Ų | 106 | 130.3 Ų | 130.3 | 69% | 0.688 | 81% | 0.808 | S | S | * | * | -99.5 | 168.1 | -122.7 | 38.7 | -38.1 | 0 | 0 | 0 | 115.4 | |||||
| 84 | A | 44.4 | Very low | 42.5 | Very low | 100 Ų | 100 | 130.9 Ų | 130.9 | 83% | 0.826 | 81% | 0.812 | S | S | * | * | trans | -56.4 | 129.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 85 | L | 39 | Very low | 41.9 | Very low | 173 Ų | 173 | 131.1 Ų | 131.1 | 91% | 0.906 | 82% | 0.816 | S | S | * | * | trans | -135.1 | 132.9 | 154.6 | -85.1 | 171.6 | 0 | 0 | 0 | 109.3 | ||||
| 86 | E | 44.4 | Very low | 42.1 | Very low | 203 Ų | 203 | 135.7 Ų | 135.7 | 95% | 0.949 | 82% | 0.822 | S | S | * | * | trans | -56.7 | 137.4 | -173.1 | -66.2 | 179.4 | 79.4 | 0 | 0 | 113.7 | ||||
| 87 | G | 38.2 | Very low | 41.7 | Very low | 70 Ų | 70 | 137.7 Ų | 137.7 | 72% | 0.722 | 82% | 0.821 | S | S | * | * | trans | -174.3 | 109.5 | 169 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 88 | A | 47.2 | Very low | 41.6 | Very low | 89 Ų | 89 | 139.9 Ų | 139.9 | 74% | 0.736 | 83% | 0.828 | S | S | * | * | trans | -57.4 | 136.4 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | H90 | A88-H90 PolarHBondContact O-N 3.5Š| ||
| 89 | P | 38.7 | Very low | 41.7 | Very low | 126 Ų | 126 | 145.5 Ų | 145.5 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | trans | -80.3 | 120.4 | 173.3 | 13.1 | -2.5 | 0 | 0 | 0 | 111 | T91 | P89-T91 PolarHBondContact O-N 3.48Š| ||
| 90 | H | 43.1 | Very low | 41.6 | Very low | 186 Ų | 186 | 151.4 Ų | 151.4 | 86% | 0.861 | 83% | 0.832 | S | S | * | * | trans | -63 | 113.2 | 164.5 | -69.3 | -91.6 | 0 | 0 | 0 | 109.8 | A88 | A88-H90 PolarHBondContact O-N 3.5Š| ||
| 91 | T | 44.2 | Very low | 41.6 | Very low | 130 Ų | 130 | 151 Ų | 151 | 80% | 0.798 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 124.6 | 170.1 | 41.9 | 0 | 0 | 0 | 0 | 110.8 | P89 | P89-T91 PolarHBondContact O-N 3.48Š|
| 92 | P | 41.3 | Very low | 41.8 | Very low | 115 Ų | 115 | 149.4 Ų | 149.4 | 75% | 0.747 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 145.7 | 167.8 | 29.8 | -31.9 | 0 | 0 | 0 | 110.7 | ||
| 93 | P | 42.5 | Very low | 42 | Very low | 131 Ų | 131 | 148.8 Ų | 148.8 | 85% | 0.851 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 142 | -178.5 | 30.9 | -32.6 | 0 | 0 | 0 | 111.8 | ||
| 94 | L | 44.3 | Very low | 42.1 | Very low | 164 Ų | 164 | 152 Ų | 152 | 86% | 0.859 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 145.1 | 178.2 | -70.9 | 165.3 | 0 | 0 | 0 | 112.6 | ||
| 95 | P | 36.1 | Very low | 42 | Very low | 123 Ų | 123 | 155.9 Ų | 155.9 | 80% | 0.799 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 126.3 | 174.2 | 26.6 | -28.3 | 0 | 0 | 0 | 111.7 | R97 | P95-R97 PolarHBondContact O-N 3.05Š|
| 96 | R | 45.3 | Very low | 41.8 | Very low | 248 Ų | 248 | 150.5 Ų | 150.5 | 94% | 0.936 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 119.9 | 175.7 | -74.3 | 177.9 | 162.8 | -171.4 | -4.7 | 110.9 | ||
| 97 | R | 47.5 | Very low | 41.2 | Very low | 243 Ų | 243 | 150.8 Ų | 150.8 | 92% | 0.917 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 136.6 | 167.2 | -90 | -173.4 | 175.9 | -159 | 1.2 | 111.4 | P95 | P95-R97 PolarHBondContact O-N 3.05Š|
| 98 | P | 40.4 | Very low | 41.6 | Very low | 128 Ų | 128 | 152.8 Ų | 152.8 | 83% | 0.831 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 140.4 | 170.5 | -16.6 | 30.9 | 0 | 0 | 0 | 112.6 | ||
| 99 | R | 42.4 | Very low | 41.3 | Very low | 247 Ų | 247 | 160.3 Ų | 160.3 | 93% | 0.932 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 130.8 | -177.5 | -159.1 | 173.8 | -180 | -173.5 | -0.4 | 110.1 | G101 | R99-G101 PolarHBondContact O-N 2.81Š|
| 100 | K | 39.4 | Very low | 41.3 | Very low | 211 Ų | 211 | 160.5 Ų | 160.5 | 92% | 0.917 | 84% | 0.839 | S | S | * | * | trans | -73.9 | 115.6 | 177.4 | -168.3 | 161.7 | -174.8 | 176.9 | 0 | 109.9 | ||||
| 101 | G | 33.4 | Very low | 41.4 | Very low | 70 Ų | 70 | 155.1 Ų | 155.1 | 72% | 0.722 | 83% | 0.826 | S | S | * | * | trans | -110.4 | 122.5 | 169.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | R99 | R99-G101 PolarHBondContact O-N 2.81Š| ||
| 102 | S | 44.9 | Very low | 41.4 | Very low | 117 Ų | 117 | 154.2 Ų | 154.2 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | trans | -62 | 141 | 170.4 | -56.7 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 103 | T | 38.7 | Very low | 41.8 | Very low | 144 Ų | 144 | 157.1 Ų | 157.1 | 88% | 0.883 | 83% | 0.827 | S | S | * | * | trans | -165.1 | 128.1 | 137.1 | -57 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 104 | E | 48.2 | Very low | 42.4 | Very low | 173 Ų | 173 | 157.8 Ų | 157.8 | 81% | 0.808 | 82% | 0.823 | S | S | * | * | trans | -66.6 | 161.6 | -179.9 | -56.9 | -98.8 | 81.3 | 0 | 0 | 112.6 | ||||
| 105 | L | 43.1 | Very low | 42.5 | Very low | 182 Ų | 182 | 158.6 Ų | 158.6 | 95% | 0.953 | 82% | 0.823 | S | S | * | * | trans | 154.2 | 121.4 | 147.7 | -75.9 | -157.8 | 0 | 0 | 0 | 107.1 | ||||
| 106 | G | 34.5 | Very low | 43.2 | Very low | 60 Ų | 60 | 157.9 Ų | 157.9 | 62% | 0.619 | 82% | 0.816 | S | S | * | * | cis | 174.2 | 157.5 | -0.1 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 107 | F | 31.6 | Very low | 43.7 | Very low | 209 Ų | 209 | 153.7 Ų | 153.7 | 92% | 0.917 | 81% | 0.81 | S | S | * | * | trans | 97.5 | 139.4 | 161.2 | -56.5 | -74.1 | 0 | 0 | 0 | 120.9 | ||||
| 108 | P | 48 | Very low | 43.6 | Very low | 112 Ų | 112 | 147.5 Ų | 147.5 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | trans | -93.1 | 135.2 | -148.2 | 34.6 | -30.2 | 0 | 0 | 0 | 112 | V110 | P108-V110 PolarHBondContact O-N 2.98Š| ||
| 109 | R | 39.8 | Very low | 43.8 | Very low | 247 Ų | 247 | 147.5 Ų | 147.5 | 93% | 0.932 | 79% | 0.792 | S | S | * | * | trans | -90.3 | 105.2 | 165.3 | -75.4 | -158.3 | 154.8 | 98 | 2.2 | 109.2 | A111 | R109-A111 PolarHBondContact O-N 3.28Š| ||
| 110 | V | 39.3 | Very low | 44.3 | Very low | 130 Ų | 130 | 144.7 Ų | 144.7 | 79% | 0.788 | 79% | 0.789 | S | S | * | * | trans | -48.8 | 123.3 | 157.4 | 174 | 0 | 0 | 0 | 0 | 107.5 | P108 P112 | P108-V110 PolarHBondContact O-N 2.98Å; V110-P112 WeakPolarHBondContact O-CD 3.49Å | ||
| 111 | A | 45.2 | Very low | 44.9 | Very low | 73 Ų | 73 | 143 Ų | 143 | 60% | 0.603 | 78% | 0.778 | S | S | * | * | trans | -74.1 | 125.9 | 171 | 0 | 0 | 0 | 0 | 0 | 108.6 | R109 | R109-A111 PolarHBondContact O-N 3.28Š| ||
| 112 | P | 42.8 | Very low | 45.7 | Very low | 112 Ų | 112 | 145.1 Ų | 145.1 | 73% | 0.727 | 78% | 0.777 | S | S | * | * | trans | -85.1 | 112.5 | 155.2 | 11.6 | 7.5 | 0 | 0 | 0 | 107.2 | V110 | V110-P112 WeakPolarHBondContact O-CD 3.49Š| ||
| 113 | E | 50.1 | Low | 45.6 | Very low | 175 Ų | 175 | 143.6 Ų | 143.6 | 82% | 0.818 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -55.1 | 144.2 | 158.4 | -44.3 | -84.7 | 87.8 | 0 | 0 | 107.7 | ||
| 114 | D | 55.5 | Low | 45.9 | Very low | 145 Ų | 145 | 147 Ų | 147 | 78% | 0.775 | 76% | 0.756 | S | S | * | * | trans | 90 | 64.1 | 177 | -128.1 | -89.3 | 0 | 0 | 0 | 117 | ||||
| 115 | E | 46.1 | Very low | 45.5 | Very low | 182 Ų | 182 | 145.2 Ų | 145.2 | 85% | 0.85 | 76% | 0.759 | S | S | * | * | trans | -105 | 90.3 | 151.2 | -71.7 | -162.3 | 169.9 | 0 | 0 | 109.5 | I117 | E115-I117 PolarHBondContact O-N 3.42Š| ||
| 116 | V | 52 | Low | 45.2 | Very low | 108 Ų | 108 | 139.6 Ų | 139.6 | 66% | 0.655 | 75% | 0.745 | S | S | * | * | trans | -57.7 | 118.4 | 157.8 | 177.7 | 0 | 0 | 0 | 0 | 107.1 | V118 | V116-V118 HydrophobicContact CG1-CG2 4.31Å; V116-V118 PolarHBondContact O-N 2.98Å | ||
| 117 | I | 55.3 | Low | 45.8 | Very low | 160 Ų | 160 | 142.7 Ų | 142.7 | 82% | 0.821 | 75% | 0.754 | S | S | * | * | trans | -65.9 | 85.4 | 173.7 | -57.9 | 166.5 | 0 | 0 | 0 | 107.7 | E115 N119 | E115-I117 PolarHBondContact O-N 3.42Å; I117-N119 PolarHBondContact O-N 2.85Å | ||
| 118 | V | 44.6 | Very low | 46.7 | Very low | 113 Ų | 113 | 138.2 Ų | 138.2 | 69% | 0.685 | 75% | 0.749 | S | S | * | * | trans | -72.1 | 126 | 167.6 | 178.9 | 0 | 0 | 0 | 0 | 106.6 | V116 Q120 | V116-V118 HydrophobicContact CG1-CG2 4.31Å; V116-V118 PolarHBondContact O-N 2.98Å; V118-Q120 PolarHBondContact O-N 3.4Å | ||
| 119 | N | 45.3 | Very low | 46.5 | Very low | 128 Ų | 128 | 137.5 Ų | 137.5 | 68% | 0.684 | 75% | 0.753 | S | S | * | * | trans | -36.7 | 115.1 | 179 | -101.6 | 6.6 | 0 | 0 | 0 | 112.2 | I117 Y121 | I117-N119 PolarHBondContact O-N 2.85Å; N119-Y121 HydrophobicContact CB-CD2 4.36Å; N119-Y121 PolarHBondContact O-N 3.29Å | ||
| 120 | Q | 52.5 | Low | 46.9 | Very low | 187 Ų | 187 | 131.1 Ų | 131.1 | 87% | 0.874 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.2 | 64.2 | 179.5 | -170 | 174.2 | 54.7 | 0 | 0 | 111.1 | V118 | V118-Q120 PolarHBondContact O-N 3.4Š|
| 121 | Y | 52.8 | Low | 47.1 | Very low | 175 Ų | 175 | 130 Ų | 130 | 69% | 0.686 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.8 | 6.8 | 167.9 | -65.8 | -72.9 | 0 | 0 | 0 | 113 | N119 I123 | N119-Y121 HydrophobicContact CB-CD2 4.36Å; N119-Y121 PolarHBondContact O-N 3.29Å; Y121-I123 PolarHBondContact O-N 2.9Å |
| 122 | V | 49.8 | Very low | 47.1 | Very low | 115 Ų | 115 | 131.2 Ų | 131.2 | 70% | 0.697 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -82.1 | 98.5 | 162.4 | -175.9 | 0 | 0 | 0 | 0 | 106.6 | R124 | V122-R124 VanDerWaalsContact C-N 3.32Å; V122-R124 PolarHBondContact O-N 3.1Å |
| 123 | I | 43.2 | Very low | 47.1 | Very low | 86 Ų | 86 | 131.3 Ų | 131.3 | 44% | 0.441 | 76% | 0.764 | S | S | . | * | trans | -61.2 | 99 | 169.7 | -58.5 | -176.8 | 0 | 0 | 0 | 106.9 | Y121 | Y121-I123 PolarHBondContact O-N 2.9Š| ||
| 124 | R | 43.3 | Very low | 46.7 | Very low | 216 Ų | 216 | 127.7 Ų | 127.7 | 82% | 0.815 | 76% | 0.758 | S | S | * | * | trans | -77.1 | 136.7 | 167.8 | -75.8 | -177.3 | 163.8 | 176.8 | -3.5 | 108 | V122 G126 | V122-R124 VanDerWaalsContact C-N 3.32Å; V122-R124 PolarHBondContact O-N 3.1Å; R124-G126 PolarHBondContact O-N 3.49Å | ||
| 125 | P | 40.6 | Very low | 46.2 | Very low | 134 Ų | 134 | 126.3 Ų | 126.3 | 87% | 0.87 | 77% | 0.766 | S | S | * | * | trans | -65.1 | 109.2 | 172 | -7.8 | 20.8 | 0 | 0 | 0 | 108.9 | ||||
| 126 | G | 36.2 | Very low | 46.1 | Very low | 65 Ų | 65 | 122.5 Ų | 122.5 | 67% | 0.67 | 77% | 0.766 | S | S | * | * | trans | -85.6 | 144.8 | 172 | 0 | 0 | 0 | 0 | 0 | 111 | R124 S128 | R124-G126 PolarHBondContact O-N 3.49Å; G126-S128 PolarHBondContact O-N 2.93Å | ||
| 127 | P | 48.3 | Very low | 45.9 | Very low | 124 Ų | 124 | 120.6 Ų | 120.6 | 81% | 0.805 | 76% | 0.762 | S | S | * | * | trans | -79.4 | 124.4 | 178.3 | 31.1 | -29.9 | 0 | 0 | 0 | 111.5 | ||||
| 128 | S | 50.8 | Low | 46.2 | Very low | 115 Ų | 115 | 114.8 Ų | 114.8 | 80% | 0.804 | 74% | 0.741 | S | S | * | * | trans | 56.3 | 113.4 | 146.7 | 66.5 | 0 | 0 | 0 | 0 | 121.1 | G126 | G126-S128 PolarHBondContact O-N 2.93Š| ||
| 129 | A | 43.6 | Very low | 47.3 | Very low | 98 Ų | 98 | 114 Ų | 114 | 81% | 0.81 | 73% | 0.73 | S | S | * | * | trans | -123.7 | 98.8 | 132.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 130 | S | 48.2 | Very low | 49 | Very low | 113 Ų | 113 | 111.8 Ų | 111.8 | 79% | 0.79 | 72% | 0.723 | S | S | * | * | S | Bend | trans | 39.6 | 96.7 | 150.5 | 57.2 | 0 | 0 | 0 | 0 | 120.9 | ||
| 131 | A | 42.1 | Very low | 50.7 | Low | 105 Ų | 105 | 105 Ų | 105 | 87% | 0.868 | 69% | 0.693 | S | S | * | * | 174.1 | 133.4 | 116.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 132 | A | 46.4 | Very low | 52.5 | Low | 99 Ų | 99 | 102 Ų | 102 | 82% | 0.818 | 69% | 0.685 | S | S | * | * | trans | -71.7 | 132.2 | -170.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 133 | S | 41.9 | Very low | 54.5 | Low | 115 Ų | 115 | 96.6 Ų | 96.6 | 80% | 0.804 | 65% | 0.652 | S | S | * | * | S | Bend | 173.6 | 123.5 | 128.7 | -72.3 | 0 | 0 | 0 | 0 | 109.9 | |||
| 134 | S | 43.2 | Very low | 56.6 | Low | 98 Ų | 98 | 96.4 Ų | 96.4 | 69% | 0.685 | 66% | 0.656 | S | S | * | * | trans | 81.2 | 59.4 | -179.8 | 76.4 | 0 | 0 | 0 | 0 | 118.4 | A136 A137 | S134-A136 PolarHBondContact O-N 2.95Å; S134-A137 PolarHBondContact O-N 2.83Å; S134-A137 VanDerWaalsContact O-N 3.15Å | ||
| 135 | A | 44.3 | Very low | 58.7 | Low | 116 Ų | 116 | 86.8 Ų | 86.8 | 96% | 0.959 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.7 | 69 | 167.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 136 | A | 44.5 | Very low | 60.9 | Low | 102 Ų | 102 | 80.8 Ų | 80.8 | 84% | 0.843 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -166.4 | 0.8 | 157.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | S134 G138 | S134-A136 PolarHBondContact O-N 2.95Å; A136-G138 PolarHBondContact O-N 2.97Å |
| 137 | A | 46.5 | Very low | 63.4 | Low | 69 Ų | 69 | 80 Ų | 80 | 57% | 0.57 | 58% | 0.575 | S | S | * | * | trans | -88.8 | 94.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | S134 | S134-A137 PolarHBondContact O-N 2.83Å; S134-A137 VanDerWaalsContact O-N 3.15Å | ||
| 138 | G | 61.6 | Low | 65.3 | Low | 38 Ų | 38 | 76.2 Ų | 76.2 | 39% | 0.392 | 55% | 0.546 | S | S | . | . | trans | -60.7 | 164.5 | 164.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | A136 R213 | A136-G138 PolarHBondContact O-N 2.97Å; G138-R213 VanDerWaalsContact C-CZ 3.42Å; G138-R213 PolarHBondContact O-NH1 3.48Å; G138-R213 PolarHBondContact O-NH2 2.76Å | ||
| 139 | E | 67.4 | Low | 67.2 | Low | 97 Ų | 97 | 74 Ų | 74 | 45% | 0.453 | 53% | 0.528 | S | S | . | . | S | Bend | trans | -22.2 | 135.9 | 173.9 | -76.2 | -90.3 | 99.3 | 0 | 0 | 114.9 | L141 I210 R213 | E139-L141 PolarHBondContact O-N 3.06Å; E139-I210 HydrophobicContact CB-CG1 4.15Å; E139-R213 VanDerWaalsContact N-NH1 3.11Å; E139-R213 PolarHBondContact O-NH1 3.19Å |
| 140 | P | 81.3 | Confident | 69.4 | Low | 81 Ų | 81 | 69.5 Ų | 69.5 | 53% | 0.526 | 49% | 0.49 | S | S | . | . | trans | -55.4 | 135.2 | -179.6 | 24.6 | -33.5 | 0 | 0 | 0 | 110.5 | E142 | P140-E142 PolarHBondContact O-N 2.87Š| ||
| 141 | L | 89.3 | Confident | 71.4 | Confident | 45 Ų | 45 | 65.2 Ų | 65.2 | 24% | 0.236 | 46% | 0.458 | C | S | . | . | S | Bend | trans | -83.6 | 10.7 | 179.4 | -59.3 | -179.4 | 0 | 0 | 0 | 112.4 | E139 T149 Y150 I210 R213 L214 | E139-L141 PolarHBondContact O-N 3.06Å; L141-T149 CarbonylContact O-C 3.56Å; L141-T149 WeakPolarHBondContact O-CA 3.49Å; L141-Y150 WeakPolarHBondContact O-CD2 3.5Å; L141-Y150 PolarHBondContact O-N 3.39Å; L141-I210 HydrophobicContact CD2-CG2 4.14Å; L141-R213 WeakPolarHBondContact CD1-O 3.25Å; L141-R213 HydrophobicContact CD2-CB 3.88Å; L141-L214 HydrophobicContact CB-CD2 4.08Å; L141-L214 HydrophobicContact CD2-CD2 4.21Å |
| 142 | E | 91.1 | Very high | 73.6 | Confident | 111 Ų | 111 | 62.5 Ų | 62.5 | 52% | 0.519 | 43% | 0.431 | S | S | . | . | B | Isolated β-bridge | trans | -121.9 | 144.6 | -173.6 | -53.3 | 173.4 | 141.6 | 0 | 0 | 109.5 | P140 H148 Y150 | P140-E142 PolarHBondContact O-N 2.87Å; E142-H148 WeakPolarHBondContact CA-O 3.24Å; E142-Y150 VanDerWaalsContact C-CE2 3.44Å; E142-Y150 VanDerWaalsContact O-CE2 3.31Å; E142-Y150 WeakPolarHBondContact O-CE2 3.48Å |
| 143 | C | 90.8 | Very high | 75.5 | Confident | 2 Ų | 2 | 60 Ų | 60 | 1% | 0.014 | 41% | 0.406 | C | S | . | . | trans | -72 | 126.9 | 176.9 | -179.8 | 0 | 0 | 0 | 0 | 110.6 | T145 C146 G147 H148 Y150 C167 | C143-T145 PolarHBondContact O-N 2.95Å; C143-T145 VanDerWaalsContact O-N 3.09Å; C143-C146 VanDerWaalsContact CB-SG 3.52Å; C143-G147 WeakPolarHBondContact O-CA 3.47Å; C143-G147 PolarHBondContact O-N 3.23Å; C143-H148 PolarHBondContact N-O 2.94Å; C143-Y150 HydrophobicContact CB-CE1 3.93Å; C143-C167 HydrophobicContact CB-CB 4Å; C143-C167 PolarHBondContact SG-N 3.21Å; C143-C167 VanDerWaalsContact SG-N 3.43Å | ||
| 144 | P | 88 | Confident | 77.4 | Confident | 81 Ų | 81 | 59.1 Ų | 59.1 | 53% | 0.526 | 39% | 0.389 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.7 | -15.2 | 179.6 | 28 | -36.1 | 0 | 0 | 0 | 113.3 | Y150 | P144-Y150 WeakPolarHBondContact CD-OH 3.44Š|
| 145 | T | 87.2 | Confident | 79.6 | Confident | 15 Ų | 15 | 55.6 Ų | 55.6 | 9% | 0.092 | 36% | 0.36 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87 | -54.7 | 179.1 | -51.4 | 0 | 0 | 0 | 0 | 111.1 | C143 C170 P187 T238 | C143-T145 PolarHBondContact O-N 2.95Å; C143-T145 VanDerWaalsContact O-N 3.09Å; T145-C170 HydrophobicContact CG2-CB 4.07Å; T145-P187 WeakPolarHBondContact OG1-CG 3.44Å; T145-T238 HydrophobicContact CG2-CG2 3.41Å; T145-T238 VanDerWaalsContact CG2-CG2 3.41Å; T145-T238 VanDerWaalsContact O-CB 3.27Å; T145-T238 WeakPolarHBondContact O-CB 3.45Å; T145-T238 WeakPolarHBondContact O-CG2 3.33Å; T145-T238 PolarHBondContact O-OG1 2.9Å |
| 146 | C | 87.1 | Confident | 82 | Confident | 7 Ų | 7 | 54.5 Ų | 54.5 | 5% | 0.047 | 33% | 0.331 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -102.5 | -6.2 | -175.6 | 60 | 0 | 0 | 0 | 0 | 114.5 | C143 H148 R155 C167 C170 S234 C235 | C143-C146 VanDerWaalsContact CB-SG 3.52Å; C146-H148 PolarHBondContact O-CE1 3.02Å; C146-H148 PolarHBondContact O-N 2.83Å; C146-H148 VanDerWaalsContact O-N 3.16Å; C146-H148 PolarHBondContact O-ND1 3.19Å; C146-R155 PolarHBondContact SG-NH1 3.16Å; C146-C167 VanDerWaalsContact SG-SG 3.64Å; C146-C170 VanDerWaalsContact SG-SG 3.7Å; C146-S234 WeakPolarHBondContact CA-OG 3.07Å; C146-S234 PolarHBondContact O-OG 2.95Å; C146-C235 HydrophobicContact CB-CB 4.4Å; C146-C235 WeakPolarHBondContact CB-SG 3.14Å |
| 147 | G | 87.5 | Confident | 84.3 | Confident | 49 Ų | 49 | 49.7 Ų | 49.7 | 51% | 0.505 | 29% | 0.291 | S | S | . | . | trans | 67.8 | 7.1 | -177 | 0 | 0 | 0 | 0 | 0 | 114.8 | C143 | C143-G147 WeakPolarHBondContact O-CA 3.47Å; C143-G147 PolarHBondContact O-N 3.23Å | ||
| 148 | H | 88.3 | Confident | 86.6 | Confident | 44 Ų | 44 | 47.6 Ų | 47.6 | 20% | 0.204 | 27% | 0.269 | C | S | . | . | P | Polyproline II helix | trans | -89.4 | 145.6 | -179.6 | -68.3 | 66.6 | 0 | 0 | 0 | 111 | E142 C143 C146 R155 S234 | E142-H148 WeakPolarHBondContact CA-O 3.24Å; C143-H148 PolarHBondContact N-O 2.94Å; C146-H148 PolarHBondContact O-CE1 3.02Å; C146-H148 PolarHBondContact O-N 2.83Å; C146-H148 VanDerWaalsContact O-N 3.16Å; C146-H148 PolarHBondContact O-ND1 3.19Å; H148-R155 VanDerWaalsContact CG-NH1 3.28Å; H148-S234 VanDerWaalsContact CE1-CB 3.43Å; H148-S234 WeakPolarHBondContact CE1-CB 3.5Å |
| 149 | T | 90.3 | Very high | 88.1 | Confident | 69 Ų | 69 | 46.6 Ų | 46.6 | 42% | 0.423 | 26% | 0.255 | S | S | . | . | B | Isolated β-bridge | trans | -55.4 | 137.8 | 171.2 | -46.1 | 0 | 0 | 0 | 0 | 111.3 | L141 L214 | L141-T149 CarbonylContact O-C 3.56Å; L141-T149 WeakPolarHBondContact O-CA 3.49Å; T149-L214 HydrophobicContact CG2-CD2 4.08Å |
| 150 | Y | 91.3 | Very high | 89.3 | Confident | 4 Ų | 4 | 42.2 Ų | 42.2 | 2% | 0.016 | 23% | 0.234 | C | C | . | . | P | Polyproline II helix | trans | -65.4 | 156 | 174.5 | -65.8 | -71.9 | 0 | 0 | 0 | 111.5 | L141 E142 C143 P144 R155 P157 S165 C167 I210 L214 A218 | L141-Y150 WeakPolarHBondContact O-CD2 3.5Å; L141-Y150 PolarHBondContact O-N 3.39Å; E142-Y150 VanDerWaalsContact C-CE2 3.44Å; E142-Y150 VanDerWaalsContact O-CE2 3.31Å; E142-Y150 WeakPolarHBondContact O-CE2 3.48Å; C143-Y150 HydrophobicContact CB-CE1 3.93Å; P144-Y150 WeakPolarHBondContact CD-OH 3.44Å; Y150-R155 WeakPolarHBondContact CA-O 3.48Å; Y150-R155 WeakPolarHBondContact CD1-O 3.49Å; Y150-P157 HydrophobicContact CD1-CB 3.59Å; Y150-P157 HydrophobicContact CD1-CG 4.25Å; Y150-P157 HydrophobicContact CD2-CB 4.39Å; Y150-P157 HydrophobicContact CE1-CB 3.64Å; Y150-P157 HydrophobicContact CE2-CB 4.44Å; Y150-P157 HydrophobicContact CG-CB 3.97Å; Y150-P157 HydrophobicContact CG-CG 4.29Å; Y150-S165 PolarHBondContact OH-O 3.41Å; Y150-C167 HydrophobicContact CD1-CB 3.95Å; Y150-C167 HydrophobicContact CE1-CB 3.9Å; Y150-I210 HydrophobicContact CD2-CD1 4.42Å; Y150-I210 HydrophobicContact CD2-CG2 3.38Å; Y150-I210 HydrophobicContact CE2-CD1 3.95Å; Y150-I210 HydrophobicContact CE2-CG2 3.98Å; Y150-I210 HydrophobicContact CG-CG2 3.97Å; Y150-L214 WeakPolarHBondContact O-CD1 3.3Å; Y150-A218 WeakPolarHBondContact O-CB 3.35Å |
| 151 | N | 90.3 | Very high | 89.8 | Confident | 22 Ų | 22 | 41.8 Ų | 41.8 | 12% | 0.118 | 23% | 0.233 | C | C | . | . | trans | -145 | 157.9 | -178.6 | -165 | -71.2 | 0 | 0 | 0 | 110.1 | T153 R155 R156 A218 A221 | N151-T153 VanDerWaalsContact C-N 3.32Å; N151-T153 PolarHBondContact O-N 2.84Å; N151-T153 PolarHBondContact OD1-N 3.43Å; N151-T153 PolarHBondContact OD1-OG1 3.09Å; N151-R155 HydrophobicContact CB-CB 4.02Å; N151-R155 PolarHBondContact N-O 2.85Å; N151-R155 CarbonylContact O-C 3.59Å; N151-R156 WeakPolarHBondContact O-CA 2.99Å; N151-R156 PolarHBondContact O-N 3.25Å; N151-R156 VanDerWaalsContact O-N 3.1Å; N151-A218 WeakPolarHBondContact CA-O 3.45Å; N151-A218 PolarHBondContact ND2-O 2.95Å; N151-A218 PolarHBondContact OD1-O 3.29Å; N151-A221 WeakPolarHBondContact ND2-CB 3.5Å | ||
| 152 | V | 88.1 | Confident | 89.9 | Confident | 49 Ų | 49 | 40.7 Ų | 40.7 | 30% | 0.297 | 23% | 0.229 | S | C | . | . | S | Bend | trans | -72.1 | -21.2 | 175.1 | -64.6 | 0 | 0 | 0 | 0 | 114.4 | L211 A218 L219 | V152-L211 HydrophobicContact CG1-CD2 4.04Å; V152-A218 PolarHBondContact N-O 2.85Å; V152-L219 HydrophobicContact CG1-CD2 3.52Å; V152-L219 VanDerWaalsContact CG2-O 3.24Å; V152-L219 WeakPolarHBondContact CG2-O 3.39Å |
| 153 | T | 85.6 | Confident | 90 | Very high | 47 Ų | 47 | 40.8 Ų | 40.8 | 29% | 0.288 | 23% | 0.233 | S | C | . | . | S | Bend | trans | -91 | -88.4 | -175.5 | 60.9 | 0 | 0 | 0 | 0 | 112.5 | N151 A221 | N151-T153 VanDerWaalsContact C-N 3.32Å; N151-T153 PolarHBondContact O-N 2.84Å; N151-T153 PolarHBondContact OD1-N 3.43Å; N151-T153 PolarHBondContact OD1-OG1 3.09Å; T153-A221 WeakPolarHBondContact CG2-O 3.42Å |
| 154 | Q | 82.8 | Confident | 90 | Very high | 96 Ų | 96 | 44 Ų | 44 | 45% | 0.449 | 25% | 0.247 | S | C | . | . | S | Bend | trans | -90.2 | -27.5 | -172.6 | -64.4 | -174.2 | -12.9 | 0 | 0 | 113.7 | Q169 | Q154-Q169 PolarHBondContact O-N 2.76Å; Q154-Q169 VanDerWaalsContact O-N 3.16Å |
| 155 | R | 89.5 | Confident | 90.3 | Very high | 24 Ų | 24 | 40.5 Ų | 40.5 | 9% | 0.091 | 23% | 0.225 | C | C | . | . | S | Bend | trans | -107.5 | 41.6 | -176.4 | -63.1 | 179.2 | -173.4 | -88 | -3.9 | 111.3 | C146 H148 Y150 N151 C167 E232 C235 | C146-R155 PolarHBondContact SG-NH1 3.16Å; H148-R155 VanDerWaalsContact CG-NH1 3.28Å; Y150-R155 WeakPolarHBondContact CA-O 3.48Å; Y150-R155 WeakPolarHBondContact CD1-O 3.49Å; N151-R155 HydrophobicContact CB-CB 4.02Å; N151-R155 PolarHBondContact N-O 2.85Å; N151-R155 CarbonylContact O-C 3.59Å; R155-C167 HydrophobicContact CB-CB 4.05Å; R155-E232 IonicContact NH2-OE2 2.87Å; R155-E232 PolarHBondContact NH2-OE2 3.2Å; R155-C235 PolarHBondContact NH1-SG 3.43Å |
| 156 | R | 92.9 | Very high | 90.6 | Very high | 93 Ų | 93 | 39.8 Ų | 39.8 | 35% | 0.351 | 22% | 0.221 | S | C | . | . | trans | -69 | 129.4 | -179.7 | -164.2 | 171.7 | 179.4 | 169.3 | -3.3 | 110.6 | N151 R158 C167 E168 V206 L211 | N151-R156 WeakPolarHBondContact O-CA 2.99Å; N151-R156 PolarHBondContact O-N 3.25Å; N151-R156 VanDerWaalsContact O-N 3.1Å; R156-R158 PolarHBondContact O-N 2.77Å; R156-C167 CarbonylContact O-C 3.58Å; R156-C167 WeakPolarHBondContact O-CA 3.34Å; R156-E168 HydrophobicContact CB-CB 4.25Å; R156-E168 PolarHBondContact O-N 3.17Å; R156-V206 HydrophobicContact CG-CG1 3.87Å; R156-V206 HydrophobicContact CG-CG2 4.22Å; R156-V206 VanDerWaalsContact NE-CG1 3.27Å; R156-L211 HydrophobicContact CG-CD1 4.43Å | ||
| 157 | P | 93.6 | Very high | 90.9 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 22% | 0.218 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -73.8 | 110.8 | -178 | 28 | -31.4 | 0 | 0 | 0 | 109.7 | Y150 V206 N207 I210 L211 | Y150-P157 HydrophobicContact CD1-CB 3.59Å; Y150-P157 HydrophobicContact CD1-CG 4.25Å; Y150-P157 HydrophobicContact CD2-CB 4.39Å; Y150-P157 HydrophobicContact CE1-CB 3.64Å; Y150-P157 HydrophobicContact CE2-CB 4.44Å; Y150-P157 HydrophobicContact CG-CB 3.97Å; Y150-P157 HydrophobicContact CG-CG 4.29Å; P157-V206 CarbonylContact O-C 3.53Å; P157-V206 WeakPolarHBondContact O-CA 3.43Å; P157-N207 HydrophobicContact CB-CB 4.08Å; P157-N207 HydrophobicContact CG-CB 4.21Å; P157-N207 WeakPolarHBondContact CG-O 3.4Å; P157-N207 PolarHBondContact O-N 2.69Å; P157-I210 HydrophobicContact CB-CB 4.46Å; P157-I210 HydrophobicContact CB-CD1 4.12Å; P157-I210 HydrophobicContact CB-CG2 4.36Å; P157-I210 HydrophobicContact CG-CB 4.08Å; P157-I210 HydrophobicContact CG-CG2 4.04Å; P157-L211 HydrophobicContact CG-CD2 3.93Å; P157-L211 HydrophobicContact CG-CG 3.9Å |
| 158 | R | 94.6 | Very high | 91.1 | Very high | 25 Ų | 25 | 39.2 Ų | 39.2 | 9% | 0.094 | 20% | 0.204 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -100.3 | 138.3 | 176 | -66.3 | -75.1 | -177 | 162.7 | 7.3 | 109.6 | R156 S165 V166 E168 L171 A202 L204 A205 | R156-R158 PolarHBondContact O-N 2.77Å; R158-S165 WeakPolarHBondContact O-CA 3.47Å; R158-V166 PolarHBondContact N-O 3.16Å; R158-V166 PolarHBondContact O-N 2.87Å; R158-E168 HydrophobicContact CG-CB 4.19Å; R158-E168 IonicContact CZ-OE1 3.9Å; R158-E168 IonicContact CZ-OE2 3.3Å; R158-E168 VanDerWaalsContact CZ-OE2 3.3Å; R158-E168 IonicContact NE-OE1 3.93Å; R158-E168 IonicContact NE-OE2 2.83Å; R158-E168 PolarHBondContact NE-OE2 2.63Å; R158-E168 VanDerWaalsContact NH2-CD 3.3Å; R158-E168 IonicContact NH2-OE1 3.02Å; R158-E168 PolarHBondContact NH2-OE1 2.63Å; R158-E168 IonicContact NH2-OE2 2.9Å; R158-E168 PolarHBondContact NH2-OE2 3.48Å; R158-L171 HydrophobicContact CB-CD1 3.46Å; R158-L171 VanDerWaalsContact CB-CD1 3.46Å; R158-L171 HydrophobicContact CG-CD1 4.13Å; R158-A202 PolarHBondContact NH1-O 3.4Å; R158-L204 HydrophobicContact CB-CB 4.2Å; R158-L204 HydrophobicContact CB-CD1 4.46Å; R158-L204 WeakPolarHBondContact CD-O 3.41Å; R158-L204 PolarHBondContact NH1-O 3.36Å; R158-A205 CarbonylContact C-O 3.16Å; R158-A205 WeakPolarHBondContact CA-O 3.35Å |
| 159 | V | 93.8 | Very high | 91.2 | Very high | 17 Ų | 17 | 39.2 Ų | 39.2 | 10% | 0.103 | 20% | 0.204 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -97.6 | 122.6 | -176.9 | -174.2 | 0 | 0 | 0 | 0 | 109.4 | L163 A205 N207 | V159-L163 HydrophobicContact CG1-CD2 4.3Å; V159-A205 HydrophobicContact CB-CB 4.45Å; V159-A205 PolarHBondContact N-O 3.4Å; V159-N207 HydrophobicContact CG2-CB 3.66Å |
| 160 | L | 92.8 | Very high | 91.2 | Very high | 5 Ų | 5 | 36.1 Ų | 36.1 | 3% | 0.026 | 19% | 0.185 | C | C | . | . | P | Polyproline II helix | trans | -80.8 | 170.1 | 173.4 | -67.9 | 174.8 | 0 | 0 | 0 | 111.2 | C162 L163 H164 V166 L171 C186 T193 L204 | L160-C162 PolarHBondContact O-N 3.35Å; L160-L163 PolarHBondContact O-N 3.23Å; L160-H164 PolarHBondContact N-O 2.88Å; L160-V166 HydrophobicContact CD1-CG2 4.26Å; L160-L171 HydrophobicContact CD1-CD2 4.38Å; L160-L171 HydrophobicContact CD2-CD1 4.5Å; L160-L171 HydrophobicContact CD2-CD2 4.1Å; L160-C186 HydrophobicContact CD1-CB 3.71Å; L160-T193 WeakPolarHBondContact CB-OG1 3.42Å; L160-T193 HydrophobicContact CD2-CG2 4.09Å; L160-L204 HydrophobicContact CD2-CD1 3.85Å; L160-L204 HydrophobicContact CD2-CD2 4.41Å |
| 161 | S | 90.9 | Very high | 91.1 | Very high | 72 Ų | 72 | 35.9 Ų | 35.9 | 50% | 0.503 | 19% | 0.185 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -59.1 | -23.6 | 178.3 | 63.2 | 0 | 0 | 0 | 0 | 113.9 | L163 E192 T193 | S161-L163 VanDerWaalsContact C-N 3.27Å; S161-L163 PolarHBondContact O-N 3.08Å; S161-E192 PolarHBondContact OG-O 3.03Å; S161-E192 VanDerWaalsContact OG-O 3.1Å; S161-T193 PolarHBondContact N-OG1 3.06Å; S161-T193 VanDerWaalsContact N-OG1 3.08Å; S161-T193 PolarHBondContact OG-OG1 3.19Å |
| 162 | C | 92.3 | Very high | 91 | Very high | 22 Ų | 22 | 37.8 Ų | 37.8 | 15% | 0.149 | 19% | 0.192 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -83 | 4.6 | 175.2 | 61.7 | 0 | 0 | 0 | 0 | 114.4 | L160 H164 C186 C189 R191 | L160-C162 PolarHBondContact O-N 3.35Å; C162-H164 PolarHBondContact O-N 3.46Å; C162-H164 PolarHBondContact SG-ND1 3.02Å; C162-H164 VanDerWaalsContact SG-ND1 3.35Å; C162-C186 VanDerWaalsContact SG-CB 3.59Å; C162-C186 PolarHBondContact SG-SG 3.42Å; C162-C189 VanDerWaalsContact CB-SG 3.57Å; C162-C189 VanDerWaalsContact SG-SG 3.64Å; C162-R191 HydrophobicContact CB-CB 3.95Å; C162-R191 HydrophobicContact CB-CG 4.28Å |
| 163 | L | 91.8 | Very high | 90.9 | Very high | 114 Ų | 114 | 36.4 Ų | 36.4 | 60% | 0.597 | 18% | 0.183 | S | C | * | . | S | Bend | trans | 67.7 | 4 | -176.6 | -53 | 175.3 | 0 | 0 | 0 | 115.9 | V159 L160 S161 | V159-L163 HydrophobicContact CG1-CD2 4.3Å; L160-L163 PolarHBondContact O-N 3.23Å; S161-L163 VanDerWaalsContact C-N 3.27Å; S161-L163 PolarHBondContact O-N 3.08Å |
| 164 | H | 92.4 | Very high | 90.7 | Very high | 68 Ų | 68 | 34.8 Ų | 34.8 | 32% | 0.315 | 17% | 0.173 | S | C | . | . | trans | -74.5 | 140 | 169.5 | -66.7 | 115.8 | 0 | 0 | 0 | 111.5 | L160 C162 C189 | L160-H164 PolarHBondContact N-O 2.88Å; C162-H164 PolarHBondContact O-N 3.46Å; C162-H164 PolarHBondContact SG-ND1 3.02Å; C162-H164 VanDerWaalsContact SG-ND1 3.35Å; H164-C189 PolarHBondContact ND1-SG 3.35Å; H164-C189 VanDerWaalsContact ND1-SG 3.42Å | ||
| 165 | S | 93.8 | Very high | 90.7 | Very high | 8 Ų | 8 | 34 Ų | 34 | 6% | 0.056 | 17% | 0.166 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -96 | 128.6 | 176.1 | -58.3 | 0 | 0 | 0 | 0 | 110.6 | Y150 R158 N207 | Y150-S165 PolarHBondContact OH-O 3.41Å; R158-S165 WeakPolarHBondContact O-CA 3.47Å; S165-N207 PolarHBondContact OG-ND2 2.95Å |
| 166 | V | 92.8 | Very high | 90.3 | Very high | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 19% | 0.188 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -131.9 | 146.1 | 175.5 | -177.4 | 0 | 0 | 0 | 0 | 107.9 | R158 L160 C170 L171 P187 | R158-V166 PolarHBondContact N-O 3.16Å; R158-V166 PolarHBondContact O-N 2.87Å; L160-V166 HydrophobicContact CD1-CG2 4.26Å; V166-C170 HydrophobicContact CG1-CB 3.79Å; V166-L171 HydrophobicContact CB-CD1 4.32Å; V166-L171 HydrophobicContact CB-CD2 3.97Å; V166-L171 HydrophobicContact CB-CG 4Å; V166-L171 HydrophobicContact CG1-CD2 3.96Å; V166-L171 HydrophobicContact CG1-CG 3.94Å; V166-P187 HydrophobicContact CG1-CG 4.39Å; V166-P187 HydrophobicContact CG2-CG 3.74Å |
| 167 | C | 92.9 | Very high | 89.3 | Confident | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 18% | 0.175 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -70.1 | 147.4 | -178.8 | 73.9 | 0 | 0 | 0 | 0 | 111.5 | C143 C146 Y150 R155 R156 Q169 C170 L171 | C143-C167 HydrophobicContact CB-CB 4Å; C143-C167 PolarHBondContact SG-N 3.21Å; C143-C167 VanDerWaalsContact SG-N 3.43Å; C146-C167 VanDerWaalsContact SG-SG 3.64Å; Y150-C167 HydrophobicContact CD1-CB 3.95Å; Y150-C167 HydrophobicContact CE1-CB 3.9Å; R155-C167 HydrophobicContact CB-CB 4.05Å; R156-C167 CarbonylContact O-C 3.58Å; R156-C167 WeakPolarHBondContact O-CA 3.34Å; C167-Q169 VanDerWaalsContact C-N 3.3Å; C167-Q169 PolarHBondContact O-N 3.45Å; C167-C170 PolarHBondContact O-N 2.99Å; C167-C170 VanDerWaalsContact O-N 3.07Å; C167-C170 PolarHBondContact SG-SG 3.33Å; C167-L171 PolarHBondContact O-N 2.99Å; C167-L171 VanDerWaalsContact O-N 3.13Å |
| 168 | E | 92.2 | Very high | 88 | Confident | 45 Ų | 45 | 35.6 Ų | 35.6 | 21% | 0.21 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -55.5 | -42.8 | -177.1 | -172.4 | 155.7 | 172.5 | 0 | 0 | 112.4 | R156 R158 C170 L171 Q172 | R156-E168 HydrophobicContact CB-CB 4.25Å; R156-E168 PolarHBondContact O-N 3.17Å; R158-E168 HydrophobicContact CG-CB 4.19Å; R158-E168 IonicContact CZ-OE1 3.9Å; R158-E168 IonicContact CZ-OE2 3.3Å; R158-E168 VanDerWaalsContact CZ-OE2 3.3Å; R158-E168 IonicContact NE-OE1 3.93Å; R158-E168 IonicContact NE-OE2 2.83Å; R158-E168 PolarHBondContact NE-OE2 2.63Å; R158-E168 VanDerWaalsContact NH2-CD 3.3Å; R158-E168 IonicContact NH2-OE1 3.02Å; R158-E168 PolarHBondContact NH2-OE1 2.63Å; R158-E168 IonicContact NH2-OE2 2.9Å; R158-E168 PolarHBondContact NH2-OE2 3.48Å; E168-C170 PolarHBondContact O-N 3.07Å; E168-L171 PolarHBondContact O-N 3.3Å; E168-Q172 WeakPolarHBondContact O-CB 3.18Å; E168-Q172 PolarHBondContact O-N 2.72Å |
| 169 | Q | 91.3 | Very high | 86.5 | Confident | 43 Ų | 43 | 39.3 Ų | 39.3 | 20% | 0.201 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -56.2 | -44.2 | 174.9 | -168.1 | 64.2 | 20 | 0 | 0 | 113.8 | Q154 C167 Q172 I173 | Q154-Q169 PolarHBondContact O-N 2.76Å; Q154-Q169 VanDerWaalsContact O-N 3.16Å; C167-Q169 VanDerWaalsContact C-N 3.3Å; C167-Q169 PolarHBondContact O-N 3.45Å; Q169-Q172 PolarHBondContact O-N 2.73Å; Q169-I173 WeakPolarHBondContact O-CG1 3.39Å; Q169-I173 PolarHBondContact O-N 3.13Å |
| 170 | C | 89 | Confident | 84.8 | Confident | 4 Ų | 4 | 46 Ų | 46 | 3% | 0.027 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -67.6 | -39.8 | 178.6 | -76.9 | 0 | 0 | 0 | 0 | 111.6 | T145 C146 V166 C167 E168 Q172 L174 C235 | T145-C170 HydrophobicContact CG2-CB 4.07Å; C146-C170 VanDerWaalsContact SG-SG 3.7Å; V166-C170 HydrophobicContact CG1-CB 3.79Å; C167-C170 PolarHBondContact O-N 2.99Å; C167-C170 VanDerWaalsContact O-N 3.07Å; C167-C170 PolarHBondContact SG-SG 3.33Å; E168-C170 PolarHBondContact O-N 3.07Å; C170-Q172 VanDerWaalsContact C-N 3.35Å; C170-L174 WeakPolarHBondContact O-CD1 3.37Å; C170-L174 WeakPolarHBondContact O-CG 3.07Å; C170-L174 PolarHBondContact O-N 3.21Å; C170-C235 VanDerWaalsContact SG-SG 3.66Å |
| 171 | L | 89.5 | Confident | 83.2 | Confident | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -67.6 | -36 | 176.3 | -67.5 | 179.3 | 0 | 0 | 0 | 112.2 | R158 L160 V166 C167 E168 L174 Y175 I184 L201 L204 | R158-L171 HydrophobicContact CB-CD1 3.46Å; R158-L171 VanDerWaalsContact CB-CD1 3.46Å; R158-L171 HydrophobicContact CG-CD1 4.13Å; L160-L171 HydrophobicContact CD1-CD2 4.38Å; L160-L171 HydrophobicContact CD2-CD1 4.5Å; L160-L171 HydrophobicContact CD2-CD2 4.1Å; V166-L171 HydrophobicContact CB-CD1 4.32Å; V166-L171 HydrophobicContact CB-CD2 3.97Å; V166-L171 HydrophobicContact CB-CG 4Å; V166-L171 HydrophobicContact CG1-CD2 3.96Å; V166-L171 HydrophobicContact CG1-CG 3.94Å; C167-L171 PolarHBondContact O-N 2.99Å; C167-L171 VanDerWaalsContact O-N 3.13Å; E168-L171 PolarHBondContact O-N 3.3Å; L171-L174 HydrophobicContact CD2-CD1 4.28Å; L171-L174 PolarHBondContact O-N 3.36Å; L171-Y175 VanDerWaalsContact O-CB 3.3Å; L171-Y175 WeakPolarHBondContact O-CB 3.38Å; L171-Y175 PolarHBondContact O-N 3.45Å; L171-I184 HydrophobicContact CD2-CG2 4.25Å; L171-L201 HydrophobicContact CB-CD1 4.12Å; L171-L201 HydrophobicContact CB-CD2 3.83Å; L171-L204 HydrophobicContact CD1-CD1 3.82Å |
| 172 | Q | 87.9 | Confident | 82.4 | Confident | 61 Ų | 61 | 52.1 Ų | 52.1 | 29% | 0.285 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -59.9 | -49.1 | 176 | -170.4 | 68.3 | 31.4 | 0 | 0 | 110.9 | E168 Q169 C170 L174 Y175 E176 L201 | E168-Q172 WeakPolarHBondContact O-CB 3.18Å; E168-Q172 PolarHBondContact O-N 2.72Å; Q169-Q172 PolarHBondContact O-N 2.73Å; C170-Q172 VanDerWaalsContact C-N 3.35Å; Q172-L174 VanDerWaalsContact C-N 3.31Å; Q172-L174 PolarHBondContact O-N 2.76Å; Q172-Y175 PolarHBondContact O-N 3.45Å; Q172-E176 HydrophobicContact CG-CG 4.43Å; Q172-E176 WeakPolarHBondContact CG-OE1 3.42Å; Q172-E176 PolarHBondContact NE2-OE1 3.42Å; Q172-E176 WeakPolarHBondContact O-CB 3.33Å; Q172-E176 WeakPolarHBondContact O-CG 3.31Å; Q172-E176 PolarHBondContact O-N 3.11Å; Q172-L201 VanDerWaalsContact CA-CD1 3.45Å; Q172-L201 HydrophobicContact CB-CD1 4.16Å; Q172-L201 VanDerWaalsContact OE1-CD1 3.3Å |
| 173 | I | 85.6 | Confident | 82 | Confident | 20 Ų | 20 | 53.6 Ų | 53.6 | 10% | 0.103 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.1 | -43 | 177.5 | -62.1 | 163.4 | 0 | 0 | 0 | 110.7 | Q169 S177 C235 F239 | Q169-I173 WeakPolarHBondContact O-CG1 3.39Å; Q169-I173 PolarHBondContact O-N 3.13Å; I173-S177 VanDerWaalsContact O-CB 3.29Å; I173-S177 WeakPolarHBondContact O-CB 3.34Å; I173-S177 PolarHBondContact O-N 2.81Å; I173-S177 VanDerWaalsContact O-N 3.12Å; I173-S177 PolarHBondContact O-OG 3.19Å; I173-C235 HydrophobicContact CD1-CB 3.62Å; I173-F239 HydrophobicContact CG2-CB 3.79Å; I173-F239 HydrophobicContact CG2-CD1 4.02Å; I173-F239 HydrophobicContact CG2-CD2 3.69Å; I173-F239 HydrophobicContact CG2-CE2 4.3Å; I173-F239 HydrophobicContact CG2-CG 3.53Å |
| 174 | L | 83.2 | Confident | 81.7 | Confident | 13 Ų | 13 | 48.5 Ų | 48.5 | 7% | 0.068 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -62.9 | -42.5 | 176.9 | -74.3 | 162.2 | 0 | 0 | 0 | 112.2 | C170 L171 Q172 C178 I184 F239 Y242 | C170-L174 WeakPolarHBondContact O-CD1 3.37Å; C170-L174 WeakPolarHBondContact O-CG 3.07Å; C170-L174 PolarHBondContact O-N 3.21Å; L171-L174 HydrophobicContact CD2-CD1 4.28Å; L171-L174 PolarHBondContact O-N 3.36Å; Q172-L174 VanDerWaalsContact C-N 3.31Å; Q172-L174 PolarHBondContact O-N 2.76Å; L174-C178 PolarHBondContact O-N 3.41Å; L174-I184 HydrophobicContact CB-CG2 4.39Å; L174-I184 HydrophobicContact CD1-CG2 4.44Å; L174-F239 HydrophobicContact CD2-CD2 3.77Å; L174-F239 HydrophobicContact CD2-CE2 4.05Å; L174-F239 HydrophobicContact CG-CD2 4.2Å; L174-Y242 HydrophobicContact CD2-CD1 3.42Å; L174-Y242 VanDerWaalsContact CD2-CD1 3.42Å; L174-Y242 HydrophobicContact CD2-CE1 3.67Å; L174-Y242 HydrophobicContact CD2-CG 4.4Å |
| 175 | Y | 82.8 | Confident | 81.4 | Confident | 80 Ų | 80 | 46 Ų | 46 | 31% | 0.314 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -66.6 | -47.2 | -180 | -176 | -109.9 | 0 | 0 | 0 | 112.1 | L171 Q172 S177 C178 I184 L195 L201 | L171-Y175 VanDerWaalsContact O-CB 3.3Å; L171-Y175 WeakPolarHBondContact O-CB 3.38Å; L171-Y175 PolarHBondContact O-N 3.45Å; Q172-Y175 PolarHBondContact O-N 3.45Å; Y175-S177 VanDerWaalsContact C-N 3.32Å; Y175-S177 PolarHBondContact O-N 3.23Å; Y175-C178 PolarHBondContact O-N 2.82Å; Y175-I184 HydrophobicContact CD2-CD1 4.13Å; Y175-I184 HydrophobicContact CD2-CG1 4.49Å; Y175-L195 HydrophobicContact CD2-CD1 3.41Å; Y175-L195 VanDerWaalsContact CD2-CD1 3.41Å; Y175-L195 HydrophobicContact CE2-CD1 3.5Å; Y175-L201 HydrophobicContact CD1-CD1 4.44Å; Y175-L201 HydrophobicContact CD1-CG 4.47Å; Y175-L201 HydrophobicContact CD2-CG 4.47Å; Y175-L201 HydrophobicContact CG-CD1 4.19Å; Y175-L201 HydrophobicContact CG-CG 4.09Å |
| 176 | E | 79.3 | Confident | 81.1 | Confident | 116 Ų | 116 | 45.6 Ų | 45.6 | 54% | 0.542 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -68.6 | -29.7 | -178.6 | -71.3 | 174.4 | 172.5 | 0 | 0 | 113.2 | Q172 P179 | Q172-E176 HydrophobicContact CG-CG 4.43Å; Q172-E176 WeakPolarHBondContact CG-OE1 3.42Å; Q172-E176 PolarHBondContact NE2-OE1 3.42Å; Q172-E176 WeakPolarHBondContact O-CB 3.33Å; Q172-E176 WeakPolarHBondContact O-CG 3.31Å; Q172-E176 PolarHBondContact O-N 3.11Å; E176-P179 WeakPolarHBondContact O-CD 3.32Å |
| 177 | S | 72.4 | Confident | 80.7 | Confident | 11 Ų | 11 | 47.2 Ų | 47.2 | 8% | 0.077 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -82.9 | -20.2 | -177.5 | -53.9 | 0 | 0 | 0 | 0 | 113.4 | I173 Y175 P179 F239 | I173-S177 VanDerWaalsContact O-CB 3.29Å; I173-S177 WeakPolarHBondContact O-CB 3.34Å; I173-S177 PolarHBondContact O-N 2.81Å; I173-S177 VanDerWaalsContact O-N 3.12Å; I173-S177 PolarHBondContact O-OG 3.19Å; Y175-S177 VanDerWaalsContact C-N 3.32Å; Y175-S177 PolarHBondContact O-N 3.23Å; S177-P179 WeakPolarHBondContact O-CD 3.3Å; S177-F239 WeakPolarHBondContact OG-CZ 3.44Å |
| 178 | C | 67.3 | Low | 80.4 | Confident | 23 Ų | 23 | 50.7 Ų | 50.7 | 16% | 0.155 | 25% | 0.25 | C | C | . | . | trans | -119.2 | 52.5 | 178.6 | -67.3 | 0 | 0 | 0 | 0 | 112.5 | L174 Y175 K180 Y181 | L174-C178 PolarHBondContact O-N 3.41Å; Y175-C178 PolarHBondContact O-N 2.82Å; C178-K180 PolarHBondContact O-N 2.87Å; C178-Y181 PolarHBondContact O-N 2.77Å | ||
| 179 | P | 62.8 | Low | 80.1 | Confident | 104 Ų | 104 | 51.1 Ų | 51.1 | 68% | 0.675 | 26% | 0.257 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.9 | -13.2 | -170.9 | 30 | -36.2 | 0 | 0 | 0 | 113.4 | E176 S177 Y181 | E176-P179 WeakPolarHBondContact O-CD 3.32Å; S177-P179 WeakPolarHBondContact O-CD 3.3Å; P179-Y181 PolarHBondContact O-N 3.1Å |
| 180 | K | 57.8 | Low | 79.9 | Confident | 157 Ų | 157 | 57.2 Ų | 57.2 | 68% | 0.683 | 28% | 0.278 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.7 | -19.5 | 178.2 | -78.9 | -175.9 | 175 | -179.1 | 0 | 113.2 | C178 | C178-K180 PolarHBondContact O-N 2.87Š|
| 181 | Y | 60 | Low | 79.8 | Confident | 76 Ų | 76 | 64.7 Ų | 64.7 | 30% | 0.298 | 31% | 0.306 | S | S | . | . | trans | -125.4 | 128.6 | -169.5 | -60.5 | -69.2 | 0 | 0 | 0 | 110.8 | C178 P179 F183 | C178-Y181 PolarHBondContact O-N 2.77Å; P179-Y181 PolarHBondContact O-N 3.1Å; Y181-F183 VanDerWaalsContact CB-CE1 3.45Å; Y181-F183 HydrophobicContact CD1-CD1 4.44Å; Y181-F183 AromaticContact CD1-CE1 3.45Å; Y181-F183 HydrophobicContact CD1-CE1 3.45Å; Y181-F183 VanDerWaalsContact CD1-CE1 3.45Å; Y181-F183 AromaticContact CD1-CZ 3.62Å; Y181-F183 HydrophobicContact CD1-CZ 3.62Å; Y181-F183 HydrophobicContact CD2-CZ 4.32Å; Y181-F183 HydrophobicContact CE1-CE1 4.42Å; Y181-F183 HydrophobicContact CE1-CZ 4.38Å; Y181-F183 HydrophobicContact CG-CD1 4.42Å; Y181-F183 AromaticContact CG-CE1 3.65Å; Y181-F183 HydrophobicContact CG-CE1 3.65Å; Y181-F183 HydrophobicContact CG-CE2 4.32Å; Y181-F183 AromaticContact CG-CZ 3.58Å; Y181-F183 HydrophobicContact CG-CZ 3.58Å; Y181-F183 PolarHBondContact O-N 2.89Å | ||
| 182 | K | 74.2 | Confident | 79.7 | Confident | 129 Ų | 129 | 69.5 Ų | 69.5 | 56% | 0.561 | 33% | 0.328 | S | S | * | . | S | Bend | trans | -76 | 29.9 | 175.1 | -59 | 178.9 | -177.8 | -169.7 | 0 | 111.9 | L195 T197 | K182-L195 PolarHBondContact O-N 2.84Å; K182-T197 HydrophobicContact CD-CG2 3.52Å; K182-T197 HydrophobicContact CG-CG2 4.1Å |
| 183 | F | 83.1 | Confident | 79.7 | Confident | 53 Ų | 53 | 66.9 Ų | 66.9 | 23% | 0.232 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.2 | 147.1 | -177.9 | 60.5 | -102.3 | 0 | 0 | 0 | 111.4 | Y181 E192 T193 | Y181-F183 VanDerWaalsContact CB-CE1 3.45Å; Y181-F183 HydrophobicContact CD1-CD1 4.44Å; Y181-F183 AromaticContact CD1-CE1 3.45Å; Y181-F183 HydrophobicContact CD1-CE1 3.45Å; Y181-F183 VanDerWaalsContact CD1-CE1 3.45Å; Y181-F183 AromaticContact CD1-CZ 3.62Å; Y181-F183 HydrophobicContact CD1-CZ 3.62Å; Y181-F183 HydrophobicContact CD2-CZ 4.32Å; Y181-F183 HydrophobicContact CE1-CE1 4.42Å; Y181-F183 HydrophobicContact CE1-CZ 4.38Å; Y181-F183 HydrophobicContact CG-CD1 4.42Å; Y181-F183 AromaticContact CG-CE1 3.65Å; Y181-F183 HydrophobicContact CG-CE1 3.65Å; Y181-F183 HydrophobicContact CG-CE2 4.32Å; Y181-F183 AromaticContact CG-CZ 3.58Å; Y181-F183 HydrophobicContact CG-CZ 3.58Å; Y181-F183 PolarHBondContact O-N 2.89Å; F183-E192 HydrophobicContact CD2-CG 4.35Å; F183-T193 CarbonylContact C-O 3.54Å; F183-T193 VanDerWaalsContact CA-O 3.25Å; F183-T193 WeakPolarHBondContact CA-O 3.4Å |
| 184 | I | 85.3 | Confident | 79.8 | Confident | 8 Ų | 8 | 70.6 Ų | 70.6 | 4% | 0.041 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.6 | 127.6 | 172.2 | -63.4 | -178.9 | 0 | 0 | 0 | 108.3 | L171 L174 Y175 E192 T193 L195 L201 | L171-I184 HydrophobicContact CD2-CG2 4.25Å; L174-I184 HydrophobicContact CB-CG2 4.39Å; L174-I184 HydrophobicContact CD1-CG2 4.44Å; Y175-I184 HydrophobicContact CD2-CD1 4.13Å; Y175-I184 HydrophobicContact CD2-CG1 4.49Å; I184-E192 CarbonylContact O-C 3.58Å; I184-T193 PolarHBondContact N-O 2.9Å; I184-T193 PolarHBondContact O-N 3.08Å; I184-L195 HydrophobicContact CD1-CD1 3.56Å; I184-L195 HydrophobicContact CG1-CD1 3.77Å; I184-L195 HydrophobicContact CG1-CG 4.49Å; I184-L201 HydrophobicContact CD1-CD2 3.4Å; I184-L201 HydrophobicContact CD1-CG 4.48Å |
| 185 | S | 86.4 | Confident | 79.8 | Confident | 15 Ų | 15 | 70.3 Ų | 70.3 | 11% | 0.105 | 34% | 0.338 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82 | 132.4 | 171.9 | 45.2 | 0 | 0 | 0 | 0 | 110.4 | Y242 | S185-Y242 VanDerWaalsContact C-OH 3.29Å; S185-Y242 WeakPolarHBondContact CB-OH 3.41Å; S185-Y242 PolarHBondContact O-OH 2.93Å; S185-Y242 PolarHBondContact OG-OH 3.3Å |
| 186 | C | 87.6 | Confident | 79.5 | Confident | 0 Ų | 0 | 73.7 Ų | 73.7 | 0% | 0 | 36% | 0.355 | C | S | . | . | trans | -65.6 | 129.1 | -179.6 | 175.7 | 0 | 0 | 0 | 0 | 111.2 | L160 C162 T188 C189 R190 R191 | L160-C186 HydrophobicContact CD1-CB 3.71Å; C162-C186 VanDerWaalsContact SG-CB 3.59Å; C162-C186 PolarHBondContact SG-SG 3.42Å; C186-T188 PolarHBondContact O-N 2.78Å; C186-T188 PolarHBondContact SG-N 2.78Å; C186-T188 VanDerWaalsContact SG-N 3.4Å; C186-C189 VanDerWaalsContact SG-SG 3.7Å; C186-R190 WeakPolarHBondContact O-CA 3.21Å; C186-R190 PolarHBondContact O-N 2.91Å; C186-R191 WeakPolarHBondContact CB-O 3.43Å; C186-R191 PolarHBondContact N-O 3.22Å | ||
| 187 | P | 84.8 | Confident | 78.9 | Confident | 33 Ų | 33 | 71.8 Ų | 71.8 | 21% | 0.214 | 35% | 0.352 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.9 | -24.5 | 179.1 | 25.4 | -33.4 | 0 | 0 | 0 | 113.8 | T145 V166 Y242 | T145-P187 WeakPolarHBondContact OG1-CG 3.44Å; V166-P187 HydrophobicContact CG1-CG 4.39Å; V166-P187 HydrophobicContact CG2-CG 3.74Å; P187-Y242 VanDerWaalsContact CA-CE2 3.47Å; P187-Y242 HydrophobicContact CB-CD2 4.03Å; P187-Y242 HydrophobicContact CB-CE2 4.08Å |
| 188 | T | 86.1 | Confident | 78.8 | Confident | 74 Ų | 74 | 77.7 Ų | 77.7 | 45% | 0.454 | 38% | 0.382 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86 | -43 | -177.8 | -47.4 | 0 | 0 | 0 | 0 | 112.5 | C186 | C186-T188 PolarHBondContact O-N 2.78Å; C186-T188 PolarHBondContact SG-N 2.78Å; C186-T188 VanDerWaalsContact SG-N 3.4Å |
| 189 | C | 86.4 | Confident | 79.3 | Confident | 54 Ų | 54 | 84.7 Ų | 84.7 | 37% | 0.365 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -129.4 | 5.7 | -170.8 | 76.3 | 0 | 0 | 0 | 0 | 114.9 | C162 H164 C186 R191 | C162-C189 VanDerWaalsContact CB-SG 3.57Å; C162-C189 VanDerWaalsContact SG-SG 3.64Å; H164-C189 PolarHBondContact ND1-SG 3.35Å; H164-C189 VanDerWaalsContact ND1-SG 3.42Å; C186-C189 VanDerWaalsContact SG-SG 3.7Å; C189-R191 PolarHBondContact O-N 3.4Å |
| 190 | R | 86.1 | Confident | 80.2 | Confident | 171 Ų | 171 | 80 Ų | 80 | 65% | 0.645 | 38% | 0.377 | S | S | * | . | trans | 57.9 | 7.5 | 179.6 | -54.3 | -175 | -174.9 | -171.2 | -0.9 | 116.1 | C186 | C186-R190 WeakPolarHBondContact O-CA 3.21Å; C186-R190 PolarHBondContact O-N 2.91Å | ||
| 191 | R | 86.4 | Confident | 81.6 | Confident | 161 Ų | 161 | 73 Ų | 73 | 61% | 0.608 | 35% | 0.347 | S | S | * | . | trans | -70.3 | 132.9 | 175.8 | -171.8 | 174.2 | -58 | -89.4 | -1.8 | 109.9 | C162 C186 C189 | C162-R191 HydrophobicContact CB-CB 3.95Å; C162-R191 HydrophobicContact CB-CG 4.28Å; C186-R191 WeakPolarHBondContact CB-O 3.43Å; C186-R191 PolarHBondContact N-O 3.22Å; C189-R191 PolarHBondContact O-N 3.4Å | ||
| 192 | E | 87.5 | Confident | 82.8 | Confident | 100 Ų | 100 | 72.6 Ų | 72.6 | 47% | 0.467 | 36% | 0.359 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.4 | 138.2 | 179.9 | -62.5 | 178.8 | 160.1 | 0 | 0 | 111.4 | S161 F183 I184 | S161-E192 PolarHBondContact OG-O 3.03Å; S161-E192 VanDerWaalsContact OG-O 3.1Å; F183-E192 HydrophobicContact CD2-CG 4.35Å; I184-E192 CarbonylContact O-C 3.58Å |
| 193 | T | 88.7 | Confident | 83.4 | Confident | 6 Ų | 6 | 69 Ų | 69 | 4% | 0.037 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117 | 114.7 | 171.9 | -59 | 0 | 0 | 0 | 0 | 107.9 | L160 S161 F183 I184 L195 L204 | L160-T193 WeakPolarHBondContact CB-OG1 3.42Å; L160-T193 HydrophobicContact CD2-CG2 4.09Å; S161-T193 PolarHBondContact N-OG1 3.06Å; S161-T193 VanDerWaalsContact N-OG1 3.08Å; S161-T193 PolarHBondContact OG-OG1 3.19Å; F183-T193 CarbonylContact C-O 3.54Å; F183-T193 VanDerWaalsContact CA-O 3.25Å; F183-T193 WeakPolarHBondContact CA-O 3.4Å; I184-T193 PolarHBondContact N-O 2.9Å; I184-T193 PolarHBondContact O-N 3.08Å; T193-L195 HydrophobicContact CG2-CD2 4.48Å; T193-L204 HydrophobicContact CG2-CD2 3.71Å |
| 194 | V | 86.9 | Confident | 83.8 | Confident | 99 Ų | 99 | 67.2 Ų | 67.2 | 60% | 0.6 | 35% | 0.347 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -73.2 | 131.4 | 176.6 | -177.8 | 0 | 0 | 0 | 0 | 108.9 | ||
| 195 | L | 84.8 | Confident | 84.1 | Confident | 6 Ų | 6 | 68.7 Ų | 68.7 | 3% | 0.031 | 36% | 0.36 | C | S | . | . | trans | -105.3 | 130.6 | 174.8 | -59.4 | -179.1 | 0 | 0 | 0 | 109.3 | Y175 K182 I184 T193 L201 L204 | Y175-L195 HydrophobicContact CD2-CD1 3.41Å; Y175-L195 VanDerWaalsContact CD2-CD1 3.41Å; Y175-L195 HydrophobicContact CE2-CD1 3.5Å; K182-L195 PolarHBondContact O-N 2.84Å; I184-L195 HydrophobicContact CD1-CD1 3.56Å; I184-L195 HydrophobicContact CG1-CD1 3.77Å; I184-L195 HydrophobicContact CG1-CG 4.49Å; T193-L195 HydrophobicContact CG2-CD2 4.48Å; L195-L201 HydrophobicContact CD1-CD2 4.06Å; L195-L204 HydrophobicContact CD2-CD1 4.2Å; L195-L204 HydrophobicContact CD2-CD2 3.85Å; L195-L204 HydrophobicContact CD2-CG 3.98Å | ||
| 196 | F | 76 | Confident | 84.4 | Confident | 151 Ų | 151 | 69.4 Ų | 69.4 | 66% | 0.662 | 36% | 0.364 | S | S | * | . | trans | -77.4 | 135.2 | 172.7 | -60.3 | -80.6 | 0 | 0 | 0 | 109.2 | D198 Y199 G200 | F196-D198 PolarHBondContact O-N 3.38Å; F196-D198 VanDerWaalsContact O-N 3.08Å; F196-Y199 PolarHBondContact O-N 3.29Å; F196-G200 PolarHBondContact O-N 2.69Å | ||
| 197 | T | 65.4 | Low | 84.7 | Confident | 77 Ų | 77 | 69.8 Ų | 69.8 | 47% | 0.472 | 37% | 0.366 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.4 | -25.2 | -167.6 | 38.9 | 0 | 0 | 0 | 0 | 115 | K182 | K182-T197 HydrophobicContact CD-CG2 3.52Å; K182-T197 HydrophobicContact CG-CG2 4.1Å |
| 198 | D | 72 | Confident | 85 | Confident | 134 Ų | 134 | 73 Ų | 73 | 72% | 0.717 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.9 | -19.1 | -168.3 | -46.4 | -37.6 | 0 | 0 | 0 | 111.8 | F196 | F196-D198 PolarHBondContact O-N 3.38Å; F196-D198 VanDerWaalsContact O-N 3.08Å |
| 199 | Y | 76.2 | Confident | 85.2 | Confident | 171 Ų | 171 | 71.4 Ų | 71.4 | 67% | 0.671 | 38% | 0.377 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -124.8 | -15.4 | -177.7 | -66 | -80.9 | 0 | 0 | 0 | 113.9 | F196 L201 A202 | F196-Y199 PolarHBondContact O-N 3.29Å; Y199-L201 PolarHBondContact O-N 3.17Å; Y199-A202 VanDerWaalsContact O-CB 3.3Å; Y199-A202 WeakPolarHBondContact O-CB 3.12Å; Y199-A202 PolarHBondContact O-N 3.12Å |
| 200 | G | 83.4 | Confident | 85.3 | Confident | 6 Ų | 6 | 68.9 Ų | 68.9 | 6% | 0.062 | 36% | 0.36 | C | S | . | . | G | 310 helix | trans | 52.7 | -129.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | F196 A202 A203 | F196-G200 PolarHBondContact O-N 2.69Å; G200-A202 VanDerWaalsContact C-N 3.3Å; G200-A202 PolarHBondContact O-N 3Å; G200-A203 WeakPolarHBondContact O-CB 3.27Å; G200-A203 PolarHBondContact O-N 3.36Å |
| 201 | L | 85.9 | Confident | 85.5 | Confident | 10 Ų | 10 | 61.8 Ų | 61.8 | 5% | 0.052 | 33% | 0.334 | C | S | . | . | G | 310 helix | trans | -67.9 | -25.8 | 176.7 | -71.5 | 177.4 | 0 | 0 | 0 | 114.3 | L171 Q172 Y175 I184 L195 Y199 A203 L204 | L171-L201 HydrophobicContact CB-CD1 4.12Å; L171-L201 HydrophobicContact CB-CD2 3.83Å; Q172-L201 VanDerWaalsContact CA-CD1 3.45Å; Q172-L201 HydrophobicContact CB-CD1 4.16Å; Q172-L201 VanDerWaalsContact OE1-CD1 3.3Å; Y175-L201 HydrophobicContact CD1-CD1 4.44Å; Y175-L201 HydrophobicContact CD1-CG 4.47Å; Y175-L201 HydrophobicContact CD2-CG 4.47Å; Y175-L201 HydrophobicContact CG-CD1 4.19Å; Y175-L201 HydrophobicContact CG-CG 4.09Å; I184-L201 HydrophobicContact CD1-CD2 3.4Å; I184-L201 HydrophobicContact CD1-CG 4.48Å; L195-L201 HydrophobicContact CD1-CD2 4.06Å; Y199-L201 PolarHBondContact O-N 3.17Å; L201-A203 PolarHBondContact O-N 2.98Å; L201-L204 HydrophobicContact CD2-CD1 3.82Å; L201-L204 WeakPolarHBondContact O-CB 3.46Å; L201-L204 PolarHBondContact O-N 3.44Å |
| 202 | A | 86.1 | Confident | 85.6 | Confident | 66 Ų | 66 | 58.7 Ų | 58.7 | 55% | 0.545 | 34% | 0.337 | S | S | . | . | G | 310 helix | trans | -65 | -22.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | R158 Y199 G200 L204 | R158-A202 PolarHBondContact NH1-O 3.4Å; Y199-A202 VanDerWaalsContact O-CB 3.3Å; Y199-A202 WeakPolarHBondContact O-CB 3.12Å; Y199-A202 PolarHBondContact O-N 3.12Å; G200-A202 VanDerWaalsContact C-N 3.3Å; G200-A202 PolarHBondContact O-N 3Å; A202-L204 PolarHBondContact O-N 2.81Å |
| 203 | A | 86.7 | Confident | 85.7 | Confident | 55 Ų | 55 | 58.7 Ų | 58.7 | 46% | 0.455 | 33% | 0.333 | S | S | . | . | G | 310 helix | trans | -67.6 | -21 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | G200 L201 A205 | G200-A203 WeakPolarHBondContact O-CB 3.27Å; G200-A203 PolarHBondContact O-N 3.36Å; L201-A203 PolarHBondContact O-N 2.98Å; A203-A205 PolarHBondContact O-N 3.19Å |
| 204 | L | 90.8 | Very high | 85.6 | Confident | 15 Ų | 15 | 59 Ų | 59 | 8% | 0.079 | 33% | 0.334 | C | S | . | . | S | Bend | trans | -73.4 | 129.9 | 179.8 | -62.4 | 176.5 | 0 | 0 | 0 | 110.1 | R158 L160 L171 T193 L195 L201 A202 | R158-L204 HydrophobicContact CB-CB 4.2Å; R158-L204 HydrophobicContact CB-CD1 4.46Å; R158-L204 WeakPolarHBondContact CD-O 3.41Å; R158-L204 PolarHBondContact NH1-O 3.36Å; L160-L204 HydrophobicContact CD2-CD1 3.85Å; L160-L204 HydrophobicContact CD2-CD2 4.41Å; L171-L204 HydrophobicContact CD1-CD1 3.82Å; T193-L204 HydrophobicContact CG2-CD2 3.71Å; L195-L204 HydrophobicContact CD2-CD1 4.2Å; L195-L204 HydrophobicContact CD2-CD2 3.85Å; L195-L204 HydrophobicContact CD2-CG 3.98Å; L201-L204 HydrophobicContact CD2-CD1 3.82Å; L201-L204 WeakPolarHBondContact O-CB 3.46Å; L201-L204 PolarHBondContact O-N 3.44Å; A202-L204 PolarHBondContact O-N 2.81Å |
| 205 | A | 91.6 | Very high | 85.5 | Confident | 39 Ų | 39 | 56.5 Ų | 56.5 | 32% | 0.322 | 32% | 0.32 | S | S | . | . | P | Polyproline II helix | trans | -58.7 | 146.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | R158 V159 A203 | R158-A205 CarbonylContact C-O 3.16Å; R158-A205 WeakPolarHBondContact CA-O 3.35Å; V159-A205 HydrophobicContact CB-CB 4.45Å; V159-A205 PolarHBondContact N-O 3.4Å; A203-A205 PolarHBondContact O-N 3.19Å |
| 206 | V | 93.1 | Very high | 85.1 | Confident | 30 Ų | 30 | 60.8 Ų | 60.8 | 18% | 0.182 | 35% | 0.348 | C | S | . | . | B | Isolated β-bridge | trans | -94 | 132.2 | 175.2 | 171.2 | 0 | 0 | 0 | 0 | 108.4 | R156 P157 T208 L211 | R156-V206 HydrophobicContact CG-CG1 3.87Å; R156-V206 HydrophobicContact CG-CG2 4.22Å; R156-V206 VanDerWaalsContact NE-CG1 3.27Å; P157-V206 CarbonylContact O-C 3.53Å; P157-V206 WeakPolarHBondContact O-CA 3.43Å; V206-T208 PolarHBondContact O-N 2.65Å; V206-L211 HydrophobicContact CG1-CD1 3.53Å; V206-L211 HydrophobicContact CG1-CG 4.45Å |
| 207 | N | 93.3 | Very high | 85.2 | Confident | 7 Ų | 7 | 60.8 Ų | 60.8 | 4% | 0.037 | 35% | 0.35 | C | S | . | . | trans | -75.1 | 91.5 | 173.6 | -165.7 | -25.5 | 0 | 0 | 0 | 110.5 | P157 V159 S165 S209 I210 L211 | P157-N207 HydrophobicContact CB-CB 4.08Å; P157-N207 HydrophobicContact CG-CB 4.21Å; P157-N207 WeakPolarHBondContact CG-O 3.4Å; P157-N207 PolarHBondContact O-N 2.69Å; V159-N207 HydrophobicContact CG2-CB 3.66Å; S165-N207 PolarHBondContact OG-ND2 2.95Å; N207-S209 VanDerWaalsContact C-N 3.27Å; N207-S209 PolarHBondContact O-N 3.18Å; N207-S209 WeakPolarHBondContact OD1-CB 3.21Å; N207-S209 PolarHBondContact OD1-N 3.01Å; N207-S209 VanDerWaalsContact OD1-N 3.16Å; N207-S209 PolarHBondContact OD1-OG 2.81Å; N207-I210 HydrophobicContact CB-CD1 4.07Å; N207-I210 HydrophobicContact CB-CG1 4.32Å; N207-I210 WeakPolarHBondContact ND2-CD1 3.49Å; N207-I210 PolarHBondContact O-N 2.76Å; N207-I210 PolarHBondContact OD1-N 3.12Å; N207-L211 PolarHBondContact O-N 3.35Å | ||
| 208 | T | 91.3 | Very high | 85.7 | Confident | 100 Ų | 100 | 57.5 Ų | 57.5 | 61% | 0.613 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -68.8 | -25 | 179.5 | 54.4 | 0 | 0 | 0 | 0 | 112.9 | V206 I210 L211 S212 | V206-T208 PolarHBondContact O-N 2.65Å; T208-I210 VanDerWaalsContact C-N 3.35Å; T208-I210 PolarHBondContact O-N 2.87Å; T208-L211 PolarHBondContact O-N 3.22Å; T208-S212 WeakPolarHBondContact O-CB 3.39Å; T208-S212 PolarHBondContact O-N 3.38Å; T208-S212 PolarHBondContact O-OG 3.2Å |
| 209 | S | 90.3 | Very high | 85.9 | Confident | 42 Ų | 42 | 54.9 Ų | 54.9 | 29% | 0.294 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -64.6 | -39.5 | 177.7 | 76.2 | 0 | 0 | 0 | 0 | 111.9 | N207 S212 R213 | N207-S209 VanDerWaalsContact C-N 3.27Å; N207-S209 PolarHBondContact O-N 3.18Å; N207-S209 WeakPolarHBondContact OD1-CB 3.21Å; N207-S209 PolarHBondContact OD1-N 3.01Å; N207-S209 VanDerWaalsContact OD1-N 3.16Å; N207-S209 PolarHBondContact OD1-OG 2.81Å; S209-S212 PolarHBondContact O-OG 2.76Å; S209-R213 WeakPolarHBondContact O-CG 3.33Å |
| 210 | I | 89.7 | Confident | 85.6 | Confident | 1 Ų | 1 | 52 Ų | 52 | 1% | 0.005 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -65.5 | -49.3 | 173.2 | -66.7 | 175.7 | 0 | 0 | 0 | 109.4 | E139 L141 Y150 P157 N207 T208 S212 R213 L214 | E139-I210 HydrophobicContact CB-CG1 4.15Å; L141-I210 HydrophobicContact CD2-CG2 4.14Å; Y150-I210 HydrophobicContact CD2-CD1 4.42Å; Y150-I210 HydrophobicContact CD2-CG2 3.38Å; Y150-I210 HydrophobicContact CE2-CD1 3.95Å; Y150-I210 HydrophobicContact CE2-CG2 3.98Å; Y150-I210 HydrophobicContact CG-CG2 3.97Å; P157-I210 HydrophobicContact CB-CB 4.46Å; P157-I210 HydrophobicContact CB-CD1 4.12Å; P157-I210 HydrophobicContact CB-CG2 4.36Å; P157-I210 HydrophobicContact CG-CB 4.08Å; P157-I210 HydrophobicContact CG-CG2 4.04Å; N207-I210 HydrophobicContact CB-CD1 4.07Å; N207-I210 HydrophobicContact CB-CG1 4.32Å; N207-I210 WeakPolarHBondContact ND2-CD1 3.49Å; N207-I210 PolarHBondContact O-N 2.76Å; N207-I210 PolarHBondContact OD1-N 3.12Å; T208-I210 VanDerWaalsContact C-N 3.35Å; T208-I210 PolarHBondContact O-N 2.87Å; I210-S212 VanDerWaalsContact C-N 3.3Å; I210-S212 PolarHBondContact O-N 3.42Å; I210-R213 PolarHBondContact O-N 3Å; I210-L214 WeakPolarHBondContact O-CG 3.36Å; I210-L214 PolarHBondContact O-N 3.49Å |
| 211 | L | 89.3 | Confident | 84.5 | Confident | 21 Ų | 21 | 53.1 Ų | 53.1 | 11% | 0.11 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -57.7 | -40.4 | -179.6 | -68.4 | -179.3 | 0 | 0 | 0 | 112.9 | V152 R156 P157 V206 N207 T208 R213 L214 | V152-L211 HydrophobicContact CG1-CD2 4.04Å; R156-L211 HydrophobicContact CG-CD1 4.43Å; P157-L211 HydrophobicContact CG-CD2 3.93Å; P157-L211 HydrophobicContact CG-CG 3.9Å; V206-L211 HydrophobicContact CG1-CD1 3.53Å; V206-L211 HydrophobicContact CG1-CG 4.45Å; N207-L211 PolarHBondContact O-N 3.35Å; T208-L211 PolarHBondContact O-N 3.22Å; L211-R213 PolarHBondContact O-N 3.45Å; L211-L214 HydrophobicContact CD2-CD1 3.58Å; L211-L214 WeakPolarHBondContact O-CB 3.45Å; L211-L214 PolarHBondContact O-N 3.44Å |
| 212 | S | 88.6 | Confident | 82.9 | Confident | 96 Ų | 96 | 57.8 Ų | 57.8 | 67% | 0.671 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -64.9 | -18.1 | 179.1 | 67.6 | 0 | 0 | 0 | 0 | 114.4 | T208 S209 I210 | T208-S212 WeakPolarHBondContact O-CB 3.39Å; T208-S212 PolarHBondContact O-N 3.38Å; T208-S212 PolarHBondContact O-OG 3.2Å; S209-S212 PolarHBondContact O-OG 2.76Å; I210-S212 VanDerWaalsContact C-N 3.3Å; I210-S212 PolarHBondContact O-N 3.42Å |
| 213 | R | 89.6 | Confident | 81.3 | Confident | 101 Ų | 101 | 59.4 Ų | 59.4 | 38% | 0.381 | 36% | 0.364 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.1 | -1.4 | -177.7 | -68.2 | 173 | 58.5 | -134.2 | -4.5 | 112.7 | G138 E139 L141 S209 I210 L211 | G138-R213 VanDerWaalsContact C-CZ 3.42Å; G138-R213 PolarHBondContact O-NH1 3.48Å; G138-R213 PolarHBondContact O-NH2 2.76Å; E139-R213 VanDerWaalsContact N-NH1 3.11Å; E139-R213 PolarHBondContact O-NH1 3.19Å; L141-R213 WeakPolarHBondContact CD1-O 3.25Å; L141-R213 HydrophobicContact CD2-CB 3.88Å; S209-R213 WeakPolarHBondContact O-CG 3.33Å; I210-R213 PolarHBondContact O-N 3Å; L211-R213 PolarHBondContact O-N 3.45Å |
| 214 | L | 87.5 | Confident | 79.3 | Confident | 11 Ų | 11 | 59.6 Ų | 59.6 | 6% | 0.058 | 37% | 0.371 | C | S | . | . | S | Bend | trans | -71 | 147.7 | 178 | -71.3 | 179.6 | 0 | 0 | 0 | 111.4 | L141 T149 Y150 I210 L211 A218 L219 | L141-L214 HydrophobicContact CB-CD2 4.08Å; L141-L214 HydrophobicContact CD2-CD2 4.21Å; T149-L214 HydrophobicContact CG2-CD2 4.08Å; Y150-L214 WeakPolarHBondContact O-CD1 3.3Å; I210-L214 WeakPolarHBondContact O-CG 3.36Å; I210-L214 PolarHBondContact O-N 3.49Å; L211-L214 HydrophobicContact CD2-CD1 3.58Å; L211-L214 WeakPolarHBondContact O-CB 3.45Å; L211-L214 PolarHBondContact O-N 3.44Å; L214-A218 HydrophobicContact CB-CB 4.1Å; L214-A218 HydrophobicContact CD1-CB 4.19Å; L214-L219 HydrophobicContact CB-CD2 4.17Å; L214-L219 HydrophobicContact CD1-CD2 4.43Å |
| 215 | P | 83.1 | Confident | 76.7 | Confident | 47 Ų | 47 | 62.3 Ų | 62.3 | 31% | 0.305 | 40% | 0.403 | S | S | . | . | trans | -61.5 | 152.1 | 171.1 | 27.6 | -33.8 | 0 | 0 | 0 | 110.2 | E217 A218 L219 | P215-E217 PolarHBondContact O-N 3.41Å; P215-A218 HydrophobicContact CG-CB 4.12Å; P215-A218 PolarHBondContact O-N 3.37Å; P215-L219 PolarHBondContact O-N 2.95Å | ||
| 216 | P | 77.6 | Confident | 74.2 | Confident | 96 Ų | 96 | 68.3 Ų | 68.3 | 62% | 0.623 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -57.2 | -26.8 | -178.8 | 21.9 | -32.5 | 0 | 0 | 0 | 113 | A218 L219 T220 | P216-A218 VanDerWaalsContact C-N 3.32Å; P216-A218 PolarHBondContact O-N 3.09Å; P216-L219 PolarHBondContact O-N 2.94Å; P216-T220 WeakPolarHBondContact O-CB 3.29Å; P216-T220 PolarHBondContact O-N 3.02Å; P216-T220 PolarHBondContact O-OG1 3.4Å |
| 217 | E | 78.1 | Confident | 72 | Confident | 151 Ų | 151 | 77.3 Ų | 77.3 | 71% | 0.706 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -57.6 | -42.9 | 174.2 | -47.6 | 172.3 | 122.8 | 0 | 0 | 111.7 | P215 L219 T220 A221 | P215-E217 PolarHBondContact O-N 3.41Å; E217-L219 VanDerWaalsContact C-N 3.31Å; E217-L219 PolarHBondContact O-N 3.41Å; E217-T220 PolarHBondContact O-N 3.18Å; E217-A221 PolarHBondContact O-N 3.47Å; E217-A221 VanDerWaalsContact O-N 3.11Å |
| 218 | A | 75.5 | Confident | 69.6 | Low | 9 Ų | 9 | 79.5 Ų | 79.5 | 7% | 0.074 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -80.2 | -12.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y150 N151 V152 L214 P215 P216 | Y150-A218 WeakPolarHBondContact O-CB 3.35Å; N151-A218 WeakPolarHBondContact CA-O 3.45Å; N151-A218 PolarHBondContact ND2-O 2.95Å; N151-A218 PolarHBondContact OD1-O 3.29Å; V152-A218 PolarHBondContact N-O 2.85Å; L214-A218 HydrophobicContact CB-CB 4.1Å; L214-A218 HydrophobicContact CD1-CB 4.19Å; P215-A218 HydrophobicContact CG-CB 4.12Å; P215-A218 PolarHBondContact O-N 3.37Å; P216-A218 VanDerWaalsContact C-N 3.32Å; P216-A218 PolarHBondContact O-N 3.09Å |
| 219 | L | 76.5 | Confident | 67.3 | Low | 79 Ų | 79 | 79.4 Ų | 79.4 | 41% | 0.414 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -90.2 | -22.7 | 171.8 | -56.9 | 179.7 | 0 | 0 | 0 | 112.2 | V152 L214 P215 P216 E217 | V152-L219 HydrophobicContact CG1-CD2 3.52Å; V152-L219 VanDerWaalsContact CG2-O 3.24Å; V152-L219 WeakPolarHBondContact CG2-O 3.39Å; L214-L219 HydrophobicContact CB-CD2 4.17Å; L214-L219 HydrophobicContact CD1-CD2 4.43Å; P215-L219 PolarHBondContact O-N 2.95Å; P216-L219 PolarHBondContact O-N 2.94Å; E217-L219 VanDerWaalsContact C-N 3.31Å; E217-L219 PolarHBondContact O-N 3.41Å |
| 220 | T | 69.6 | Low | 65.3 | Low | 110 Ų | 110 | 85.4 Ų | 85.4 | 68% | 0.675 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -107.5 | -2.9 | -174 | -40 | 0 | 0 | 0 | 0 | 112.6 | P216 E217 P222 | P216-T220 WeakPolarHBondContact O-CB 3.29Å; P216-T220 PolarHBondContact O-N 3.02Å; P216-T220 PolarHBondContact O-OG1 3.4Å; E217-T220 PolarHBondContact O-N 3.18Å; T220-P222 WeakPolarHBondContact O-CD 3.35Å; T220-P222 VanDerWaalsContact O-N 3.11Å |
| 221 | A | 60.2 | Low | 63.5 | Low | 30 Ų | 30 | 89 Ų | 89 | 25% | 0.248 | 54% | 0.536 | C | S | . | . | trans | -55.5 | 122.3 | -174.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | N151 T153 E217 S223 | N151-A221 WeakPolarHBondContact ND2-CB 3.5Å; T153-A221 WeakPolarHBondContact CG2-O 3.42Å; E217-A221 PolarHBondContact O-N 3.47Å; E217-A221 VanDerWaalsContact O-N 3.11Å; A221-S223 PolarHBondContact O-N 3.2Å | ||
| 222 | P | 52.5 | Low | 61.7 | Low | 107 Ų | 107 | 91.3 Ų | 91.3 | 70% | 0.695 | 55% | 0.546 | S | S | * | . | trans | -63.1 | 139.6 | -178.2 | 23.4 | -30.7 | 0 | 0 | 0 | 109.8 | T220 G224 | T220-P222 WeakPolarHBondContact O-CD 3.35Å; T220-P222 VanDerWaalsContact O-N 3.11Å; P222-G224 PolarHBondContact O-N 2.79Å | ||
| 223 | S | 52.1 | Low | 60.2 | Low | 100 Ų | 100 | 88.6 Ų | 88.6 | 70% | 0.699 | 53% | 0.533 | S | S | * | . | S | Bend | trans | -64.9 | 19.2 | 171.4 | -59.8 | 0 | 0 | 0 | 0 | 113.9 | A221 | A221-S223 PolarHBondContact O-N 3.2Š|
| 224 | G | 45.1 | Very low | 59.4 | Low | 59 Ų | 59 | 85.2 Ų | 85.2 | 61% | 0.608 | 53% | 0.525 | S | S | * | . | trans | -148.1 | 101.5 | -163.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | P222 | P222-G224 PolarHBondContact O-N 2.79Š| ||
| 225 | G | 36.8 | Very low | 58.8 | Low | 72 Ų | 72 | 84.9 Ų | 84.9 | 74% | 0.742 | 52% | 0.523 | S | S | * | . | trans | -176.4 | 97.1 | 165.3 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 226 | Q | 38.5 | Very low | 58.5 | Low | 166 Ų | 166 | 87.3 Ų | 87.3 | 78% | 0.776 | 53% | 0.527 | S | S | * | . | trans | 16.5 | 128.1 | 158.2 | -153.5 | 79.1 | 60.2 | 0 | 0 | 116.7 | G228 | Q226-G228 PolarHBondContact O-N 3.11Š| ||
| 227 | W | 46.1 | Very low | 58.4 | Low | 218 Ų | 218 | 89.2 Ų | 89.2 | 83% | 0.826 | 53% | 0.528 | S | S | * | . | S | Bend | trans | -51.3 | 75.9 | 156 | -69.3 | 77.3 | 0 | 0 | 0 | 111.5 | ||
| 228 | G | 43.6 | Very low | 58 | Low | 53 Ų | 53 | 83.4 Ų | 83.4 | 55% | 0.546 | 50% | 0.503 | S | S | . | . | trans | 172.8 | 111.9 | -168 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q226 | Q226-G228 PolarHBondContact O-N 3.11Š| ||
| 229 | A | 43.9 | Very low | 58 | Low | 99 Ų | 99 | 83.3 Ų | 83.3 | 82% | 0.818 | 50% | 0.501 | S | S | * | . | S | Bend | trans | 85.7 | 61.1 | 167.7 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||
| 230 | E | 46.5 | Very low | 57.9 | Low | 167 Ų | 167 | 87.2 Ų | 87.2 | 78% | 0.78 | 51% | 0.51 | S | S | * | . | S | Bend | -166.7 | 175.6 | 127.1 | -98.8 | -56.6 | 87.7 | 0 | 0 | 106.1 | E232 | E230-E232 PolarHBondContact O-N 2.99Š| |
| 231 | P | 52 | Low | 58.1 | Low | 76 Ų | 76 | 88.8 Ų | 88.8 | 49% | 0.494 | 51% | 0.51 | S | S | . | . | trans | -74.6 | 63.9 | -159.9 | 32.7 | -36.6 | 0 | 0 | 0 | 113.6 | G233 S234 | P231-G233 PolarHBondContact O-N 3.22Å; P231-G233 VanDerWaalsContact O-N 3.11Å; P231-S234 WeakPolarHBondContact O-CB 3.03Å; P231-S234 PolarHBondContact O-N 3.37Å | ||
| 232 | E | 52.2 | Low | 58.6 | Low | 71 Ų | 71 | 88.6 Ų | 88.6 | 33% | 0.332 | 50% | 0.502 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.5 | -17.5 | 168.3 | -154.8 | 93.9 | 124.1 | 0 | 0 | 111.5 | R155 E230 S234 | R155-E232 IonicContact NH2-OE2 2.87Å; R155-E232 PolarHBondContact NH2-OE2 3.2Å; E230-E232 PolarHBondContact O-N 2.99Å; E232-S234 PolarHBondContact O-N 2.82Å |
| 233 | G | 57.4 | Low | 59.3 | Low | 38 Ų | 38 | 84.1 Ų | 84.1 | 39% | 0.392 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -55.7 | -26.3 | 163.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | P231 C235 Y236 Q237 | P231-G233 PolarHBondContact O-N 3.22Å; P231-G233 VanDerWaalsContact O-N 3.11Å; G233-C235 PolarHBondContact O-N 2.93Å; G233-Y236 PolarHBondContact O-N 3.31Å; G233-Q237 WeakPolarHBondContact O-CA 3.31Å; G233-Q237 WeakPolarHBondContact O-CB 3.43Å; G233-Q237 WeakPolarHBondContact O-CG 3.39Å; G233-Q237 PolarHBondContact O-N 3.06Å |
| 234 | S | 72.2 | Confident | 60 | Low | 30 Ų | 30 | 81.6 Ų | 81.6 | 21% | 0.21 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -60.3 | -46.5 | -177.2 | 179.2 | 0 | 0 | 0 | 0 | 112.8 | C146 H148 P231 E232 Y236 Q237 T238 | C146-S234 WeakPolarHBondContact CA-OG 3.07Å; C146-S234 PolarHBondContact O-OG 2.95Å; H148-S234 VanDerWaalsContact CE1-CB 3.43Å; H148-S234 WeakPolarHBondContact CE1-CB 3.5Å; P231-S234 WeakPolarHBondContact O-CB 3.03Å; P231-S234 PolarHBondContact O-N 3.37Å; E232-S234 PolarHBondContact O-N 2.82Å; S234-Y236 VanDerWaalsContact C-N 3.35Å; S234-Y236 PolarHBondContact O-N 3.39Å; S234-Q237 PolarHBondContact O-N 2.89Å; S234-T238 WeakPolarHBondContact O-CB 3.33Å; S234-T238 PolarHBondContact O-N 2.95Å; S234-T238 PolarHBondContact O-OG1 3.28Å |
| 235 | C | 75.4 | Confident | 60.9 | Low | 4 Ų | 4 | 81.8 Ų | 81.8 | 3% | 0.027 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -62.8 | -43.9 | -179.7 | -64.9 | 0 | 0 | 0 | 0 | 111.6 | C146 R155 C170 I173 G233 F239 | C146-C235 HydrophobicContact CB-CB 4.4Å; C146-C235 WeakPolarHBondContact CB-SG 3.14Å; R155-C235 PolarHBondContact NH1-SG 3.43Å; C170-C235 VanDerWaalsContact SG-SG 3.66Å; I173-C235 HydrophobicContact CD1-CB 3.62Å; G233-C235 PolarHBondContact O-N 2.93Å; C235-F239 WeakPolarHBondContact O-CB 3.44Å; C235-F239 PolarHBondContact O-N 3.35Å |
| 236 | Y | 76.1 | Confident | 62 | Low | 99 Ų | 99 | 79.6 Ų | 79.6 | 39% | 0.388 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -73.8 | -35.6 | 178.9 | -171.9 | -100.6 | 0 | 0 | 0 | 112.6 | G233 S234 F239 R240 P254 | G233-Y236 PolarHBondContact O-N 3.31Å; S234-Y236 VanDerWaalsContact C-N 3.35Å; S234-Y236 PolarHBondContact O-N 3.39Å; Y236-F239 WeakPolarHBondContact O-CB 3.32Å; Y236-F239 PolarHBondContact O-N 2.73Å; Y236-R240 HydrophobicContact CD1-CG 4.41Å; Y236-R240 HydrophobicContact CE1-CG 4.19Å; Y236-R240 WeakPolarHBondContact O-CG 3.04Å; Y236-R240 PolarHBondContact O-N 3.4Å; Y236-P254 WeakPolarHBondContact OH-CG 3.15Å |
| 237 | Q | 76.5 | Confident | 62.8 | Low | 135 Ų | 135 | 72.1 Ų | 72.1 | 63% | 0.631 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -67 | -46.8 | 175.6 | -75.4 | -126.8 | 67.6 | 0 | 0 | 110.9 | G233 S234 F239 R240 Q241 | G233-Q237 WeakPolarHBondContact O-CA 3.31Å; G233-Q237 WeakPolarHBondContact O-CB 3.43Å; G233-Q237 WeakPolarHBondContact O-CG 3.39Å; G233-Q237 PolarHBondContact O-N 3.06Å; S234-Q237 PolarHBondContact O-N 2.89Å; Q237-F239 VanDerWaalsContact C-N 3.26Å; Q237-F239 PolarHBondContact O-N 2.7Å; Q237-R240 WeakPolarHBondContact O-CB 3.16Å; Q237-R240 PolarHBondContact O-N 3.29Å; Q237-R240 VanDerWaalsContact O-N 3.09Å; Q237-Q241 PolarHBondContact O-N 3.3Å |
| 238 | T | 69.3 | Low | 63.2 | Low | 29 Ų | 29 | 68.5 Ų | 68.5 | 18% | 0.178 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -63.2 | -37.6 | 173.9 | -52.3 | 0 | 0 | 0 | 0 | 110.7 | T145 S234 R240 Q241 Y242 | T145-T238 HydrophobicContact CG2-CG2 3.41Å; T145-T238 VanDerWaalsContact CG2-CG2 3.41Å; T145-T238 VanDerWaalsContact O-CB 3.27Å; T145-T238 WeakPolarHBondContact O-CB 3.45Å; T145-T238 WeakPolarHBondContact O-CG2 3.33Å; T145-T238 PolarHBondContact O-OG1 2.9Å; S234-T238 WeakPolarHBondContact O-CB 3.33Å; S234-T238 PolarHBondContact O-N 2.95Å; S234-T238 PolarHBondContact O-OG1 3.28Å; T238-R240 VanDerWaalsContact C-N 3.34Å; T238-R240 PolarHBondContact O-N 3.06Å; T238-Q241 WeakPolarHBondContact O-CB 3.33Å; T238-Q241 PolarHBondContact O-N 2.95Å; T238-Y242 WeakPolarHBondContact O-CB 3.21Å; T238-Y242 PolarHBondContact O-N 3.41Å |
| 239 | F | 75.2 | Confident | 63.5 | Low | 8 Ų | 8 | 68.5 Ų | 68.5 | 4% | 0.035 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -56.9 | -46.4 | 171.4 | 169.1 | -94.9 | 0 | 0 | 0 | 111.9 | I173 L174 S177 C235 Y236 Q237 Q241 Y242 C243 P254 | I173-F239 HydrophobicContact CG2-CB 3.79Å; I173-F239 HydrophobicContact CG2-CD1 4.02Å; I173-F239 HydrophobicContact CG2-CD2 3.69Å; I173-F239 HydrophobicContact CG2-CE2 4.3Å; I173-F239 HydrophobicContact CG2-CG 3.53Å; L174-F239 HydrophobicContact CD2-CD2 3.77Å; L174-F239 HydrophobicContact CD2-CE2 4.05Å; L174-F239 HydrophobicContact CG-CD2 4.2Å; S177-F239 WeakPolarHBondContact OG-CZ 3.44Å; C235-F239 WeakPolarHBondContact O-CB 3.44Å; C235-F239 PolarHBondContact O-N 3.35Å; Y236-F239 WeakPolarHBondContact O-CB 3.32Å; Y236-F239 PolarHBondContact O-N 2.73Å; Q237-F239 VanDerWaalsContact C-N 3.26Å; Q237-F239 PolarHBondContact O-N 2.7Å; F239-Q241 VanDerWaalsContact C-N 3.3Å; F239-Q241 PolarHBondContact O-N 3.01Å; F239-Y242 PolarHBondContact O-N 2.95Å; F239-C243 WeakPolarHBondContact CE2-SG 3.44Å; F239-C243 HydrophobicContact CZ-CB 4.29Å; F239-C243 WeakPolarHBondContact CZ-SG 3.44Å; F239-C243 WeakPolarHBondContact O-CB 3.24Å; F239-C243 PolarHBondContact O-N 3.01Å; F239-P254 HydrophobicContact CE1-CB 4.38Å |
| 240 | R | 74.1 | Confident | 63.9 | Low | 160 Ų | 160 | 71.9 Ų | 71.9 | 60% | 0.604 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -60.3 | -39.8 | 175.8 | -68.5 | 178.9 | 85.1 | 152.6 | 6.3 | 112.2 | Y236 Q237 T238 G244 | Y236-R240 HydrophobicContact CD1-CG 4.41Å; Y236-R240 HydrophobicContact CE1-CG 4.19Å; Y236-R240 WeakPolarHBondContact O-CG 3.04Å; Y236-R240 PolarHBondContact O-N 3.4Å; Q237-R240 WeakPolarHBondContact O-CB 3.16Å; Q237-R240 PolarHBondContact O-N 3.29Å; Q237-R240 VanDerWaalsContact O-N 3.09Å; T238-R240 VanDerWaalsContact C-N 3.34Å; T238-R240 PolarHBondContact O-N 3.06Å; R240-G244 PolarHBondContact O-N 2.93Å |
| 241 | Q | 73.4 | Confident | 64 | Low | 144 Ų | 144 | 69.7 Ų | 69.7 | 67% | 0.673 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -66.3 | -42.8 | 176 | -172 | 176.9 | 2.6 | 0 | 0 | 111.6 | Q237 T238 F239 G244 A245 | Q237-Q241 PolarHBondContact O-N 3.3Å; T238-Q241 WeakPolarHBondContact O-CB 3.33Å; T238-Q241 PolarHBondContact O-N 2.95Å; F239-Q241 VanDerWaalsContact C-N 3.3Å; F239-Q241 PolarHBondContact O-N 3.01Å; Q241-G244 PolarHBondContact O-N 3.19Å; Q241-A245 WeakPolarHBondContact O-CB 3.43Å; Q241-A245 PolarHBondContact O-N 3.48Å |
| 242 | Y | 71.7 | Confident | 63.6 | Low | 25 Ų | 25 | 77 Ų | 77 | 10% | 0.098 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -65 | -51.2 | 178 | -178.1 | -104 | 0 | 0 | 0 | 111.4 | L174 S185 P187 T238 F239 G244 A245 A246 | L174-Y242 HydrophobicContact CD2-CD1 3.42Å; L174-Y242 VanDerWaalsContact CD2-CD1 3.42Å; L174-Y242 HydrophobicContact CD2-CE1 3.67Å; L174-Y242 HydrophobicContact CD2-CG 4.4Å; S185-Y242 VanDerWaalsContact C-OH 3.29Å; S185-Y242 WeakPolarHBondContact CB-OH 3.41Å; S185-Y242 PolarHBondContact O-OH 2.93Å; S185-Y242 PolarHBondContact OG-OH 3.3Å; P187-Y242 VanDerWaalsContact CA-CE2 3.47Å; P187-Y242 HydrophobicContact CB-CD2 4.03Å; P187-Y242 HydrophobicContact CB-CE2 4.08Å; T238-Y242 WeakPolarHBondContact O-CB 3.21Å; T238-Y242 PolarHBondContact O-N 3.41Å; F239-Y242 PolarHBondContact O-N 2.95Å; Y242-G244 VanDerWaalsContact C-N 3.32Å; Y242-G244 PolarHBondContact O-N 2.9Å; Y242-A245 CarbonylContact O-C 3.59Å; Y242-A245 PolarHBondContact O-N 3.44Å; Y242-A245 VanDerWaalsContact O-N 3.12Å; Y242-A246 HydrophobicContact CD1-CB 4.43Å; Y242-A246 HydrophobicContact CE1-CB 4.11Å; Y242-A246 HydrophobicContact CE2-CB 4.26Å; Y242-A246 WeakPolarHBondContact O-CB 3.4Å; Y242-A246 PolarHBondContact O-N 3.41Å |
| 243 | C | 68.1 | Low | 63.2 | Low | 14 Ų | 14 | 78.1 Ų | 78.1 | 10% | 0.095 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -62.3 | -38.2 | 175.7 | -81.7 | 0 | 0 | 0 | 0 | 112.2 | F239 A245 C247 | F239-C243 WeakPolarHBondContact CE2-SG 3.44Å; F239-C243 HydrophobicContact CZ-CB 4.29Å; F239-C243 WeakPolarHBondContact CZ-SG 3.44Å; F239-C243 WeakPolarHBondContact O-CB 3.24Å; F239-C243 PolarHBondContact O-N 3.01Å; C243-A245 VanDerWaalsContact C-N 3.27Å; C243-A245 PolarHBondContact O-N 3.01Å; C243-C247 WeakPolarHBondContact O-CA 3.32Å; C243-C247 WeakPolarHBondContact O-CB 3.3Å; C243-C247 PolarHBondContact O-N 2.93Å |
| 244 | G | 66.4 | Low | 62.8 | Low | 47 Ų | 47 | 78.9 Ų | 78.9 | 49% | 0.485 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -64.8 | -29.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | R240 Q241 Y242 | R240-G244 PolarHBondContact O-N 2.93Å; Q241-G244 PolarHBondContact O-N 3.19Å; Y242-G244 VanDerWaalsContact C-N 3.32Å; Y242-G244 PolarHBondContact O-N 2.9Å |
| 245 | A | 63.5 | Low | 61.5 | Low | 63 Ų | 63 | 83.7 Ų | 83.7 | 52% | 0.521 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -91.1 | -28 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q241 Y242 C243 | Q241-A245 WeakPolarHBondContact O-CB 3.43Å; Q241-A245 PolarHBondContact O-N 3.48Å; Y242-A245 CarbonylContact O-C 3.59Å; Y242-A245 PolarHBondContact O-N 3.44Å; Y242-A245 VanDerWaalsContact O-N 3.12Å; C243-A245 VanDerWaalsContact C-N 3.27Å; C243-A245 PolarHBondContact O-N 3.01Å |
| 246 | A | 60.1 | Low | 60 | Low | 25 Ų | 25 | 86.8 Ų | 86.8 | 21% | 0.207 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -98.1 | -22.2 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y242 I260 | Y242-A246 HydrophobicContact CD1-CB 4.43Å; Y242-A246 HydrophobicContact CE1-CB 4.11Å; Y242-A246 HydrophobicContact CE2-CB 4.26Å; Y242-A246 WeakPolarHBondContact O-CB 3.4Å; Y242-A246 PolarHBondContact O-N 3.41Å; A246-I260 HydrophobicContact CB-CD1 3.87Å |
| 247 | C | 55.4 | Low | 58.9 | Low | 10 Ų | 10 | 84.2 Ų | 84.2 | 7% | 0.068 | 46% | 0.457 | C | S | . | . | trans | -120.7 | 140.7 | -179.1 | -45.2 | 0 | 0 | 0 | 0 | 110.4 | C243 C249 C258 I260 | C243-C247 WeakPolarHBondContact O-CA 3.32Å; C243-C247 WeakPolarHBondContact O-CB 3.3Å; C243-C247 PolarHBondContact O-N 2.93Å; C247-C249 WeakPolarHBondContact CB-SG 3.13Å; C247-C249 PolarHBondContact O-N 3.21Å; C247-C258 HydrophobicContact CB-CB 4.41Å; C247-C258 VanDerWaalsContact SG-CB 3.57Å; C247-I260 HydrophobicContact CB-CG1 4.38Å; C247-I260 WeakPolarHBondContact SG-CG1 3.36Å | ||
| 248 | T | 53.5 | Low | 57.5 | Low | 141 Ų | 141 | 78.4 Ų | 78.4 | 87% | 0.865 | 43% | 0.431 | S | S | * | . | trans | -77.7 | 1.6 | 172.7 | 51.5 | 0 | 0 | 0 | 0 | 113.3 | H250 | T248-H250 PolarHBondContact O-N 3.19Š| ||
| 249 | C | 49.6 | Very low | 56.6 | Low | 54 Ų | 54 | 79.7 Ų | 79.7 | 37% | 0.365 | 44% | 0.441 | S | S | . | . | trans | -80.5 | 82.4 | -179.3 | 58.6 | 0 | 0 | 0 | 0 | 111.2 | C247 V251 | C247-C249 WeakPolarHBondContact CB-SG 3.13Å; C247-C249 PolarHBondContact O-N 3.21Å; C249-V251 PolarHBondContact O-N 3.29Å | ||
| 250 | H | 52.8 | Low | 55.2 | Low | 170 Ų | 170 | 81.2 Ų | 81.2 | 79% | 0.787 | 45% | 0.45 | S | S | * | . | trans | -67.7 | 112.2 | 170 | -127.8 | -108 | 0 | 0 | 0 | 109.7 | T248 | T248-H250 PolarHBondContact O-N 3.19Š| ||
| 251 | V | 49.4 | Very low | 53.4 | Low | 121 Ų | 121 | 84.9 Ų | 84.9 | 73% | 0.733 | 48% | 0.477 | S | S | * | . | S | Bend | trans | 64 | 55.9 | 152.1 | -160.9 | 0 | 0 | 0 | 0 | 116.5 | C249 | C249-V251 PolarHBondContact O-N 3.29Š|
| 252 | R | 44.2 | Very low | 52.4 | Low | 229 Ų | 229 | 82 Ų | 82 | 86% | 0.864 | 47% | 0.467 | S | S | * | . | S | Bend | trans | -148.7 | 96.8 | 159.1 | -133 | 156 | 165.3 | 178.6 | -7 | 111.9 | ||
| 253 | N | 43.1 | Very low | 51.4 | Low | 95 Ų | 95 | 84.9 Ų | 84.9 | 51% | 0.508 | 49% | 0.486 | S | S | . | . | trans | 57.6 | 106.5 | 171.8 | -164.8 | -5.3 | 0 | 0 | 0 | 115.1 | L255 S256 | N253-L255 PolarHBondContact O-N 3.38Å; N253-L255 PolarHBondContact OD1-N 3.25Å; N253-S256 PolarHBondContact ND2-OG 2.97Å; N253-S256 PolarHBondContact O-N 3.11Å | ||
| 254 | P | 49.9 | Very low | 50.5 | Low | 53 Ų | 53 | 88.9 Ų | 88.9 | 34% | 0.344 | 51% | 0.508 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.3 | -12.4 | -178.6 | 26.5 | -34.9 | 0 | 0 | 0 | 114.3 | Y236 F239 | Y236-P254 WeakPolarHBondContact OH-CG 3.15Å; F239-P254 HydrophobicContact CE1-CB 4.38Å |
| 255 | L | 44.7 | Very low | 49.5 | Very low | 132 Ų | 132 | 91.4 Ų | 91.4 | 69% | 0.691 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.7 | -3 | 176.6 | -60.4 | 175.6 | 0 | 0 | 0 | 113.9 | N253 | N253-L255 PolarHBondContact O-N 3.38Å; N253-L255 PolarHBondContact OD1-N 3.25Å |
| 256 | S | 43.8 | Very low | 48.6 | Very low | 69 Ų | 69 | 93.1 Ų | 93.1 | 48% | 0.483 | 51% | 0.509 | S | S | . | . | S | Bend | trans | -130.1 | 81.6 | -168.4 | -54.2 | 0 | 0 | 0 | 0 | 111.3 | N253 | N253-S256 PolarHBondContact ND2-OG 2.97Å; N253-S256 PolarHBondContact O-N 3.11Å |
| 257 | A | 51.7 | Low | 47.9 | Very low | 45 Ų | 45 | 97.7 Ų | 97.7 | 37% | 0.372 | 53% | 0.529 | S | S | . | . | trans | 71.1 | 75.4 | 161.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | S259 | A257-S259 PolarHBondContact O-N 3.07Š| ||
| 258 | C | 47.3 | Very low | 47.3 | Very low | 12 Ų | 12 | 103.9 Ų | 103.9 | 8% | 0.081 | 56% | 0.562 | C | S | . | * | trans | -71.4 | 101.7 | 145.1 | -71.8 | 0 | 0 | 0 | 0 | 108.4 | C247 | C247-C258 HydrophobicContact CB-CB 4.41Å; C247-C258 VanDerWaalsContact SG-CB 3.57Å | ||
| 259 | S | 50.2 | Low | 46.9 | Very low | 56 Ų | 56 | 101.1 Ų | 101.1 | 39% | 0.392 | 54% | 0.538 | S | S | . | . | trans | -98.7 | 91.4 | 169.1 | 52 | 0 | 0 | 0 | 0 | 108.4 | A257 M261 | A257-S259 PolarHBondContact O-N 3.07Å; S259-M261 PolarHBondContact O-N 3.44Å | ||
| 260 | I | 45.5 | Very low | 46.6 | Very low | 41 Ų | 41 | 105 Ų | 105 | 21% | 0.21 | 55% | 0.553 | C | S | . | * | trans | -76 | 112.5 | 164 | -55.5 | 178.4 | 0 | 0 | 0 | 105.3 | A246 C247 | A246-I260 HydrophobicContact CB-CD1 3.87Å; C247-I260 HydrophobicContact CB-CG1 4.38Å; C247-I260 WeakPolarHBondContact SG-CG1 3.36Å | ||
| 261 | M | 37.2 | Very low | 46.1 | Very low | 237 Ų | 237 | 99.1 Ų | 99.1 | 100% | 1.167 | 53% | 0.531 | S | S | * | . | trans | -94.7 | 0 | 166.8 | -78.3 | -170.5 | -66.1 | 0 | 0 | 109.4 | S259 | S259-M261 PolarHBondContact O-N 3.44Š|
Retrieved 261 of 261 residues in 224.2 ms
(Link to these results)