| 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 | 40.5 | Very low | 44.9 | Very low | 250 Ų | 250 | 157.6 Ų | 157.6 | 100% | 1.232 | 83% | 0.829 | S | S | * | * | 0 | 130 | 0 | -72 | 155.2 | 105.6 | 0 | 0 | 107.7 | |||||
| 2 | R | 46.7 | Very low | 44.8 | Very low | 254 Ų | 254 | 160.3 Ų | 160.3 | 96% | 0.958 | 83% | 0.834 | S | S | * | * | trans | -80.7 | 144.2 | -173.6 | -72.8 | 162.2 | 118.8 | -144.4 | 4.9 | 111.4 | ||||
| 3 | S | 46.6 | Very low | 45.1 | Very low | 116 Ų | 116 | 154.4 Ų | 154.4 | 81% | 0.811 | 82% | 0.822 | S | S | * | * | trans | -168 | 125 | 143.5 | -160.8 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 4 | G | 44.6 | Very low | 45.4 | Very low | 67 Ų | 67 | 153.2 Ų | 153.2 | 69% | 0.691 | 82% | 0.823 | S | S | * | * | cis | 107.4 | 67.6 | 21.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 5 | F | 42.3 | Very low | 45.9 | Very low | 214 Ų | 214 | 148.7 Ų | 148.7 | 94% | 0.939 | 82% | 0.816 | S | S | * | * | trans | -129.7 | 133.6 | 159.1 | -109.7 | -91.9 | 0 | 0 | 0 | 109.3 | ||||
| 6 | R | 49.1 | Very low | 46.3 | Very low | 223 Ų | 223 | 147 Ų | 147 | 84% | 0.842 | 81% | 0.814 | S | S | * | * | trans | -125.1 | 158.9 | -169.7 | -160.2 | -165.5 | -149.3 | 175 | 5.6 | 107.6 | ||||
| 7 | C | 42.8 | Very low | 46.4 | Very low | 109 Ų | 109 | 147.2 Ų | 147.2 | 74% | 0.736 | 81% | 0.807 | S | S | * | * | trans | 83.1 | 125.2 | 167.3 | -46.2 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 8 | D | 37.8 | Very low | 46.6 | Very low | 143 Ų | 143 | 151.2 Ų | 151.2 | 77% | 0.765 | 81% | 0.809 | S | S | * | * | -163.3 | 137.2 | 55.3 | -151.3 | -120.3 | 0 | 0 | 0 | 110.9 | P10 | D8-P10 WeakPolarHBondContact OD1-CD 3.43Š| |||
| 9 | E | 50.8 | Low | 46.5 | Very low | 180 Ų | 180 | 151.9 Ų | 151.9 | 84% | 0.841 | 81% | 0.807 | S | S | * | * | trans | -104.5 | 130.6 | 157.6 | -169.5 | -155.1 | 94 | 0 | 0 | 105.3 | ||||
| 10 | P | 48 | Very low | 46.8 | Very low | 96 Ų | 96 | 149.6 Ų | 149.6 | 62% | 0.623 | 80% | 0.798 | S | S | * | * | -149.8 | 148.6 | 112.4 | 33.1 | -13.4 | 0 | 0 | 0 | 115.8 | D8 | D8-P10 WeakPolarHBondContact OD1-CD 3.43Š| |||
| 11 | A | 44.8 | Very low | 46.9 | Very low | 82 Ų | 82 | 148.8 Ų | 148.8 | 68% | 0.678 | 80% | 0.799 | S | S | * | * | trans | 60.9 | 114.5 | 130.6 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 12 | E | 43.8 | Very low | 47.3 | Very low | 190 Ų | 190 | 141.5 Ų | 141.5 | 89% | 0.888 | 77% | 0.772 | S | S | * | * | 83.4 | 137.5 | 123.3 | -143.6 | -176.2 | 116.9 | 0 | 0 | 120.9 | |||||
| 13 | A | 48.6 | Very low | 47.1 | Very low | 83 Ų | 83 | 132.5 Ų | 132.5 | 69% | 0.686 | 76% | 0.759 | S | S | * | * | trans | 73.7 | 102.3 | 157.3 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 14 | V | 48.7 | Very low | 47.1 | Very low | 138 Ų | 138 | 131.1 Ų | 131.1 | 84% | 0.836 | 75% | 0.754 | S | S | * | * | -178.9 | 126.9 | 83.5 | 78.5 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 15 | A | 53.6 | Low | 47.3 | Very low | 86 Ų | 86 | 133.9 Ų | 133.9 | 71% | 0.711 | 76% | 0.757 | S | S | * | * | trans | -66.3 | 155.9 | 164.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 16 | P | 52.5 | Low | 47.6 | Very low | 121 Ų | 121 | 127.9 Ų | 127.9 | 79% | 0.786 | 75% | 0.747 | S | S | * | * | -133.7 | 128.9 | 114.6 | 27.1 | -11.6 | 0 | 0 | 0 | 112.9 | |||||
| 17 | E | 48.1 | Very low | 47.5 | Very low | 150 Ų | 150 | 124.7 Ų | 124.7 | 70% | 0.701 | 75% | 0.746 | S | S | * | * | trans | 61.2 | 108.3 | 131.6 | -143.5 | -165.8 | 110.1 | 0 | 0 | 119.3 | Q19 | E17-Q19 PolarHBondContact OE1-NE2 3.11Š| ||
| 18 | R | 49.8 | Very low | 47.6 | Very low | 220 Ų | 220 | 123.9 Ų | 123.9 | 83% | 0.83 | 75% | 0.747 | S | S | * | * | trans | -54.2 | 127.6 | 157.2 | -61.3 | 176.8 | 131.8 | -167.6 | -4.1 | 110.9 | ||||
| 19 | Q | 45.3 | Very low | 47.6 | Very low | 165 Ų | 165 | 122 Ų | 122 | 77% | 0.771 | 75% | 0.746 | S | S | * | * | trans | -122.9 | 87 | 142.1 | -74.2 | -172.8 | 22.4 | 0 | 0 | 110.2 | E17 V21 | E17-Q19 PolarHBondContact OE1-NE2 3.11Å; Q19-V21 PolarHBondContact O-N 3.2Å | ||
| 20 | T | 50.9 | Low | 47 | Very low | 104 Ų | 104 | 122.9 Ų | 122.9 | 64% | 0.638 | 75% | 0.747 | S | S | * | * | trans | -55.7 | 114.5 | 149.9 | -64 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 21 | V | 49.8 | Very low | 46.9 | Very low | 134 Ų | 134 | 124.3 Ų | 124.3 | 81% | 0.812 | 75% | 0.754 | S | S | * | * | trans | -119.5 | 90 | 141.8 | 175.6 | 0 | 0 | 0 | 0 | 106.7 | Q19 G23 | Q19-V21 PolarHBondContact O-N 3.2Å; V21-G23 VanDerWaalsContact C-N 3.27Å; V21-G23 PolarHBondContact O-N 3.07Å | ||
| 22 | S | 47.7 | Very low | 46.9 | Very low | 97 Ų | 97 | 124.6 Ų | 124.6 | 68% | 0.678 | 75% | 0.751 | S | S | * | * | trans | -61.4 | 93.7 | 159 | -176.5 | 0 | 0 | 0 | 0 | 107.1 | A24 | S22-A24 PolarHBondContact O-N 3.01Š| ||
| 23 | G | 43.6 | Very low | 47.1 | Very low | 65 Ų | 65 | 120.6 Ų | 120.6 | 67% | 0.67 | 74% | 0.741 | S | S | * | * | trans | -74.4 | 70.1 | 168.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | V21 V25 | V21-G23 VanDerWaalsContact C-N 3.27Å; V21-G23 PolarHBondContact O-N 3.07Å; G23-V25 PolarHBondContact O-N 2.94Å | ||
| 24 | A | 46.6 | Very low | 46.7 | Very low | 86 Ų | 86 | 124.6 Ų | 124.6 | 71% | 0.711 | 75% | 0.746 | S | S | * | * | trans | -64.6 | 91 | 163.9 | 0 | 0 | 0 | 0 | 0 | 107.6 | S22 A26 | S22-A24 PolarHBondContact O-N 3.01Å; A24-A26 VanDerWaalsContact C-N 3.33Å; A24-A26 PolarHBondContact O-N 2.98Å | ||
| 25 | V | 49.2 | Very low | 46.7 | Very low | 126 Ų | 126 | 123.4 Ų | 123.4 | 76% | 0.764 | 74% | 0.738 | S | S | * | * | trans | -64.6 | 103.5 | 160.8 | 160 | 0 | 0 | 0 | 0 | 105.7 | G23 L27 | G23-V25 PolarHBondContact O-N 2.94Å; V25-L27 PolarHBondContact O-N 3.49Å | ||
| 26 | A | 48.3 | Very low | 46.6 | Very low | 88 Ų | 88 | 127.1 Ų | 127.1 | 73% | 0.727 | 74% | 0.741 | S | S | * | * | trans | -57.2 | 104.8 | 165.5 | 0 | 0 | 0 | 0 | 0 | 107.4 | A24 A28 | A24-A26 VanDerWaalsContact C-N 3.33Å; A24-A26 PolarHBondContact O-N 2.98Å; A26-A28 PolarHBondContact O-N 2.88Å | ||
| 27 | L | 47.6 | Very low | 46.8 | Very low | 156 Ų | 156 | 126.2 Ų | 126.2 | 82% | 0.817 | 74% | 0.735 | S | S | * | * | trans | -65.6 | 88.5 | 158.6 | -68.5 | 173.8 | 0 | 0 | 0 | 105.9 | V25 S29 | V25-L27 PolarHBondContact O-N 3.49Å; L27-S29 VanDerWaalsContact C-N 3.31Å; L27-S29 PolarHBondContact O-N 3.23Å | ||
| 28 | A | 43.6 | Very low | 46.9 | Very low | 92 Ų | 92 | 125.4 Ų | 125.4 | 76% | 0.76 | 74% | 0.74 | S | S | * | * | trans | -66.4 | 100.8 | 165 | 0 | 0 | 0 | 0 | 0 | 106.5 | A26 F30 | A26-A28 PolarHBondContact O-N 2.88Å; A28-F30 PolarHBondContact O-N 3.26Å | ||
| 29 | S | 37.6 | Very low | 46.5 | Very low | 104 Ų | 104 | 122.2 Ų | 122.2 | 73% | 0.727 | 74% | 0.74 | S | S | * | * | trans | -47.9 | 112.9 | 170.5 | -58.5 | 0 | 0 | 0 | 0 | 109.6 | L27 T31 | L27-S29 VanDerWaalsContact C-N 3.31Å; L27-S29 PolarHBondContact O-N 3.23Å; S29-T31 VanDerWaalsContact C-N 3.31Å; S29-T31 PolarHBondContact O-N 3.28Å | ||
| 30 | F | 38.6 | Very low | 46.8 | Very low | 197 Ų | 197 | 121.8 Ų | 121.8 | 86% | 0.864 | 74% | 0.742 | S | S | * | * | trans | -76 | 87.2 | 172.5 | -162.4 | -93.7 | 0 | 0 | 0 | 108.1 | A28 S32 | A28-F30 PolarHBondContact O-N 3.26Å; F30-S32 PolarHBondContact O-N 3.33Å | ||
| 31 | T | 46.3 | Very low | 46.3 | Very low | 127 Ų | 127 | 119.8 Ų | 119.8 | 78% | 0.779 | 74% | 0.743 | S | S | * | * | trans | -79.4 | 95 | 169.7 | 61.7 | 0 | 0 | 0 | 0 | 108.6 | S29 | S29-T31 VanDerWaalsContact C-N 3.31Å; S29-T31 PolarHBondContact O-N 3.28Å | ||
| 32 | S | 44.4 | Very low | 46.4 | Very low | 88 Ų | 88 | 117 Ų | 117 | 62% | 0.615 | 74% | 0.741 | S | S | * | * | trans | -67.3 | 150 | 136.4 | -80.3 | 0 | 0 | 0 | 0 | 107.4 | F30 | F30-S32 PolarHBondContact O-N 3.33Š| ||
| 33 | P | 49.2 | Very low | 46.4 | Very low | 105 Ų | 105 | 123.7 Ų | 123.7 | 68% | 0.682 | 75% | 0.751 | S | S | * | * | cis | -145.4 | 163.3 | 41.2 | 38 | -18.1 | 0 | 0 | 0 | 115.5 | ||||
| 34 | H | 38.7 | Very low | 46.7 | Very low | 168 Ų | 168 | 129 Ų | 129 | 78% | 0.778 | 76% | 0.758 | S | S | * | * | -160 | 111.3 | 127.9 | -121.1 | -84 | 0 | 0 | 0 | 110.6 | H36 | H34-H36 AromaticContact ND1-NE2 3.84Š| |||
| 35 | T | 50.2 | Low | 46.3 | Very low | 112 Ų | 112 | 134.6 Ų | 134.6 | 69% | 0.687 | 76% | 0.762 | S | S | * | * | trans | -67 | 130.4 | 165.2 | -51 | 0 | 0 | 0 | 0 | 109 | ||||
| 36 | H | 50.3 | Low | 46.2 | Very low | 165 Ų | 165 | 133.5 Ų | 133.5 | 76% | 0.764 | 76% | 0.76 | S | S | * | * | trans | -131.9 | 121.3 | 147.5 | -78.7 | -83.1 | 0 | 0 | 0 | 107.5 | H34 | H34-H36 AromaticContact ND1-NE2 3.84Š| ||
| 37 | P | 56.2 | Low | 45.7 | Very low | 101 Ų | 101 | 139.8 Ų | 139.8 | 66% | 0.656 | 77% | 0.766 | S | S | * | * | trans | -95.9 | 162.1 | 174.3 | 37.8 | -29.4 | 0 | 0 | 0 | 111.2 | ||||
| 38 | V | 50.3 | Low | 45.1 | Very low | 134 Ų | 134 | 135.8 Ų | 135.8 | 81% | 0.812 | 76% | 0.762 | S | S | * | * | trans | 78.5 | 111.3 | 163.8 | -171.1 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 39 | D | 42.9 | Very low | 45.1 | Very low | 153 Ų | 153 | 136.5 Ų | 136.5 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | -160.3 | 129.8 | 111.5 | -159.8 | -129.9 | 0 | 0 | 0 | 112.1 | |||||
| 40 | D | 51.2 | Low | 45.4 | Very low | 155 Ų | 155 | 137.9 Ų | 137.9 | 83% | 0.829 | 77% | 0.768 | S | S | * | * | trans | -78.7 | 122.5 | 175.9 | -172.8 | -87 | 0 | 0 | 0 | 108.9 | ||||
| 41 | G | 40.7 | Very low | 46.1 | Very low | 63 Ų | 63 | 138 Ų | 138 | 65% | 0.649 | 77% | 0.768 | S | S | * | * | trans | -167.9 | 61.8 | -172.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | R43 | G41-R43 PolarHBondContact O-N 3.31Å; G41-R43 VanDerWaalsContact O-N 3.11Å | ||
| 42 | G | 51.2 | Low | 46.5 | Very low | 75 Ų | 75 | 141.4 Ų | 141.4 | 77% | 0.773 | 77% | 0.767 | S | S | * | * | trans | -57.9 | 112.7 | 167.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 43 | R | 47.1 | Very low | 46.6 | Very low | 237 Ų | 237 | 145.2 Ų | 145.2 | 89% | 0.894 | 78% | 0.778 | S | S | * | * | trans | -145.4 | 100 | 159 | -68.5 | -163.4 | -167.2 | -92 | -1 | 111.5 | G41 | G41-R43 PolarHBondContact O-N 3.31Å; G41-R43 VanDerWaalsContact O-N 3.11Å | ||
| 44 | H | 49.4 | Very low | 46.6 | Very low | 176 Ų | 176 | 146.4 Ų | 146.4 | 82% | 0.815 | 78% | 0.778 | S | S | * | * | trans | 33.8 | 100.5 | 132.5 | -126.5 | -98.7 | 0 | 0 | 0 | 117.4 | S46 | H44-S46 PolarHBondContact O-N 3.06Å; H44-S46 VanDerWaalsContact O-N 3.08Å | ||
| 45 | Y | 39.9 | Very low | 46.7 | Very low | 204 Ų | 204 | 141.2 Ų | 141.2 | 80% | 0.8 | 77% | 0.77 | S | S | * | * | trans | -74.2 | 95.3 | 159.5 | 49.5 | -89.5 | 0 | 0 | 0 | 108.8 | W47 | Y45-W47 AromaticContact CD2-CD1 3.79Å; Y45-W47 AromaticContact CD2-NE1 3.53Å; Y45-W47 PolarHBondContact O-N 3.37Å | ||
| 46 | S | 47.3 | Very low | 46.3 | Very low | 103 Ų | 103 | 143.8 Ų | 143.8 | 72% | 0.72 | 78% | 0.779 | S | S | * | * | trans | -81.8 | 107.3 | 168.8 | -169.5 | 0 | 0 | 0 | 0 | 108.4 | H44 G48 | H44-S46 PolarHBondContact O-N 3.06Å; H44-S46 VanDerWaalsContact O-N 3.08Å; S46-G48 PolarHBondContact O-N 3.35Å | ||
| 47 | W | 37 | Very low | 45.5 | Very low | 221 Ų | 221 | 139.5 Ų | 139.5 | 84% | 0.837 | 78% | 0.779 | S | S | * | * | trans | -65.9 | 102.8 | 170.4 | -71.9 | 68.3 | 0 | 0 | 0 | 107.8 | Y45 S49 | Y45-W47 AromaticContact CD2-CD1 3.79Å; Y45-W47 AromaticContact CD2-NE1 3.53Å; Y45-W47 PolarHBondContact O-N 3.37Å; W47-S49 PolarHBondContact O-N 3.18Å | ||
| 48 | G | 35.6 | Very low | 45.2 | Very low | 72 Ų | 72 | 140.8 Ų | 140.8 | 74% | 0.742 | 79% | 0.788 | S | S | * | * | trans | -57.7 | 111.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | S46 | S46-G48 PolarHBondContact O-N 3.35Š| ||
| 49 | S | 43.1 | Very low | 44.7 | Very low | 107 Ų | 107 | 137.6 Ų | 137.6 | 75% | 0.748 | 78% | 0.782 | S | S | * | * | trans | -62 | 134.4 | 166.1 | -62.4 | 0 | 0 | 0 | 0 | 109.8 | W47 K51 | W47-S49 PolarHBondContact O-N 3.18Å; S49-K51 PolarHBondContact O-N 3.43Å; S49-K51 VanDerWaalsContact O-N 3.09Å | ||
| 50 | P | 43.9 | Very low | 44.4 | Very low | 132 Ų | 132 | 138 Ų | 138 | 86% | 0.857 | 78% | 0.784 | S | S | * | * | trans | -69.3 | 108.8 | 170.9 | 24.5 | -28.7 | 0 | 0 | 0 | 109.6 | ||||
| 51 | K | 53.2 | Low | 44.2 | Very low | 200 Ų | 200 | 135.4 Ų | 135.4 | 87% | 0.87 | 78% | 0.784 | S | S | * | * | trans | -79.8 | 120.3 | 177.7 | -147.9 | 162.3 | -176.1 | 164.8 | 0 | 109 | S49 | S49-K51 PolarHBondContact O-N 3.43Å; S49-K51 VanDerWaalsContact O-N 3.09Å | ||
| 52 | R | 54.5 | Low | 44.2 | Very low | 199 Ų | 199 | 136.9 Ų | 136.9 | 75% | 0.751 | 79% | 0.79 | S | S | * | * | trans | -44.8 | 132.3 | 166.6 | -76.1 | 167.1 | 42.8 | 103 | -4.3 | 111.1 | ||||
| 53 | I | 47 | Very low | 43.8 | Very low | 167 Ų | 167 | 142.6 Ų | 142.6 | 86% | 0.856 | 79% | 0.794 | S | S | * | * | trans | -116.9 | 100.7 | 155.9 | -58.3 | -179.9 | 0 | 0 | 0 | 107.2 | ||||
| 54 | L | 48.8 | Very low | 43.4 | Very low | 130 Ų | 130 | 138.9 Ų | 138.9 | 68% | 0.681 | 79% | 0.786 | S | S | * | * | trans | -98.6 | 125 | 156.3 | -112.3 | 146.1 | 0 | 0 | 0 | 105.6 | ||||
| 55 | G | 39.8 | Very low | 43 | Very low | 59 Ų | 59 | 134.8 Ų | 134.8 | 61% | 0.608 | 78% | 0.783 | S | S | * | * | trans | -179.1 | 90 | 171.8 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 56 | L | 42.2 | Very low | 42.8 | Very low | 167 Ų | 167 | 128.7 Ų | 128.7 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | 44.9 | 100.1 | 90.1 | -88.2 | 130.8 | 0 | 0 | 0 | 112.7 | |||||
| 57 | G | 34.4 | Very low | 42.8 | Very low | 75 Ų | 75 | 131.8 Ų | 131.8 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | trans | -121.3 | 120.6 | 153.4 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 58 | P | 50.5 | Low | 43.2 | Very low | 128 Ų | 128 | 127.1 Ų | 127.1 | 83% | 0.831 | 79% | 0.786 | S | S | * | * | trans | -89.5 | 141.7 | 165.4 | 34.1 | -26.3 | 0 | 0 | 0 | 109.3 | ||||
| 59 | G | 38.3 | Very low | 44.1 | Very low | 67 Ų | 67 | 134.7 Ų | 134.7 | 69% | 0.691 | 79% | 0.792 | S | S | * | * | trans | -166.4 | 87.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 60 | D | 37.5 | Very low | 44.2 | Very low | 161 Ų | 161 | 134.9 Ų | 134.9 | 86% | 0.861 | 79% | 0.79 | S | S | * | * | trans | 49.5 | 106.5 | 147 | -69.9 | -80.2 | 0 | 0 | 0 | 123.1 | ||||
| 61 | A | 45.8 | Very low | 44.6 | Very low | 100 Ų | 100 | 136.4 Ų | 136.4 | 83% | 0.826 | 79% | 0.791 | S | S | * | * | 10.6 | 127 | 129 | 0 | 0 | 0 | 0 | 0 | 121.7 | |||||
| 62 | A | 41.3 | Very low | 44.8 | Very low | 94 Ų | 94 | 135.9 Ų | 135.9 | 78% | 0.777 | 79% | 0.791 | S | S | * | * | trans | -150.1 | 109.9 | 140 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 63 | K | 43.1 | Very low | 45 | Very low | 196 Ų | 196 | 129.4 Ų | 129.4 | 85% | 0.852 | 79% | 0.786 | S | S | * | * | 48.5 | 136 | 102.5 | -86.6 | -152.6 | 175.5 | -149.2 | 0 | 113.9 | |||||
| 64 | E | 38.3 | Very low | 45.4 | Very low | 158 Ų | 158 | 129.5 Ų | 129.5 | 74% | 0.738 | 78% | 0.783 | S | S | * | * | cis | -178.1 | 154.4 | -2.4 | -123.4 | -102 | 102.6 | 0 | 0 | 104.8 | ||||
| 65 | A | 40.9 | Very low | 45.5 | Very low | 90 Ų | 90 | 126.1 Ų | 126.1 | 74% | 0.744 | 77% | 0.77 | S | S | * | * | trans | 52.5 | 126.5 | 152.7 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 66 | G | 36 | Very low | 46.2 | Very low | 77 Ų | 77 | 132.2 Ų | 132.2 | 79% | 0.794 | 78% | 0.783 | S | S | * | * | trans | 174 | 63.5 | 165.1 | 0 | 0 | 0 | 0 | 0 | 116.7 | V68 | G66-V68 PolarHBondContact O-N 3.08Š| ||
| 67 | L | 48.4 | Very low | 46.8 | Very low | 167 Ų | 167 | 131.1 Ų | 131.1 | 87% | 0.874 | 77% | 0.771 | S | S | * | * | trans | -19.3 | 114.3 | 155 | 177.9 | 101.7 | 0 | 0 | 0 | 115.6 | ||||
| 68 | V | 44.3 | Very low | 47.8 | Very low | 124 Ų | 124 | 133.6 Ų | 133.6 | 75% | 0.752 | 77% | 0.765 | S | S | * | * | trans | -156.7 | 113.9 | 132.5 | -176 | 0 | 0 | 0 | 0 | 108.5 | G66 | G66-V68 PolarHBondContact O-N 3.08Š| ||
| 69 | R | 53.8 | Low | 48.1 | Very low | 231 Ų | 231 | 134.9 Ų | 134.9 | 87% | 0.872 | 76% | 0.764 | S | S | * | * | trans | -82.2 | 133.1 | 158.8 | -59.6 | 177.6 | 78.1 | 179.7 | 4.4 | 107.5 | ||||
| 70 | P | 46.9 | Very low | 49 | Very low | 110 Ų | 110 | 137.8 Ų | 137.8 | 71% | 0.714 | 76% | 0.763 | S | S | * | * | trans | -111.7 | 115.1 | 150.5 | 16.8 | 1.6 | 0 | 0 | 0 | 109.4 | Q72 | P70-Q72 PolarHBondContact O-N 2.89Š| ||
| 71 | L | 51.2 | Low | 49.9 | Very low | 165 Ų | 165 | 141.6 Ų | 141.6 | 86% | 0.864 | 77% | 0.766 | S | S | * | * | trans | 26 | 92.7 | 140.2 | -70.2 | 157.5 | 0 | 0 | 0 | 116.3 | G73 | L71-G73 PolarHBondContact O-N 2.88Š| ||
| 72 | Q | 58.6 | Low | 50.4 | Low | 189 Ų | 189 | 143.2 Ų | 143.2 | 88% | 0.883 | 77% | 0.765 | S | S | * | * | S | Bend | -10.1 | 108 | 126.2 | -164.4 | 102.9 | 38.1 | 0 | 0 | 113.1 | P70 | P70-Q72 PolarHBondContact O-N 2.89Š| |
| 73 | G | 57.4 | Low | 50.9 | Low | 62 Ų | 62 | 149.2 Ų | 149.2 | 64% | 0.639 | 77% | 0.768 | S | S | * | * | trans | 140.6 | 114.3 | 167.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | L71 | L71-G73 PolarHBondContact O-N 2.88Š| ||
| 74 | Q | 54.8 | Low | 51.6 | Low | 170 Ų | 170 | 145.2 Ų | 145.2 | 79% | 0.794 | 76% | 0.756 | S | S | * | * | trans | 83.4 | 84.4 | 168.1 | -47.6 | -156.4 | 12.4 | 0 | 0 | 117.3 | ||||
| 75 | S | 52.6 | Low | 52.3 | Low | 59 Ų | 59 | 149.4 Ų | 149.4 | 41% | 0.413 | 77% | 0.765 | S | S | . | * | -168.8 | 58.1 | 119.9 | -133.6 | 0 | 0 | 0 | 0 | 113 | K77 I78 | S75-K77 PolarHBondContact O-N 3.01Å; S75-K77 VanDerWaalsContact O-N 3.09Å; S75-I78 VanDerWaalsContact OG-CD1 3.28Å; S75-I78 WeakPolarHBondContact OG-CD1 3.41Å; S75-I78 WeakPolarHBondContact OG-CG1 3.42Å | |||
| 76 | E | 53.9 | Low | 52.6 | Low | 186 Ų | 186 | 152.4 Ų | 152.4 | 87% | 0.869 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.2 | -1.5 | 167.9 | -66.8 | 179.1 | 97.5 | 0 | 0 | 112.8 | ||
| 77 | K | 55.6 | Low | 53.3 | Low | 145 Ų | 145 | 154 Ų | 154 | 63% | 0.63 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.5 | -2.6 | -177 | 62.5 | -170.7 | 176.3 | -116.4 | 0 | 115.6 | S75 | S75-K77 PolarHBondContact O-N 3.01Å; S75-K77 VanDerWaalsContact O-N 3.09Å |
| 78 | I | 54.5 | Low | 53.1 | Low | 127 Ų | 127 | 154.5 Ų | 154.5 | 65% | 0.651 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -90.3 | -15 | 173.5 | -57.8 | 172.6 | 0 | 0 | 0 | 111.5 | S75 L80 | S75-I78 VanDerWaalsContact OG-CD1 3.28Å; S75-I78 WeakPolarHBondContact OG-CD1 3.41Å; S75-I78 WeakPolarHBondContact OG-CG1 3.42Å; I78-L80 VanDerWaalsContact C-N 3.29Å; I78-L80 PolarHBondContact O-N 2.94Å |
| 79 | L | 57.1 | Low | 53.7 | Low | 155 Ų | 155 | 157.4 Ų | 157.4 | 81% | 0.812 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | -8.5 | 178.4 | -120.1 | 94.2 | 0 | 0 | 0 | 114.5 | ||
| 80 | L | 56 | Low | 54.1 | Low | 128 Ų | 128 | 151.5 Ų | 151.5 | 67% | 0.67 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.5 | -7.1 | -169.8 | -60 | 174.9 | 0 | 0 | 0 | 115 | I78 R83 | I78-L80 VanDerWaalsContact C-N 3.29Å; I78-L80 PolarHBondContact O-N 2.94Å; L80-R83 WeakPolarHBondContact O-CB 3.42Å |
| 81 | R | 57.1 | Low | 54.7 | Low | 241 Ų | 241 | 152.4 Ų | 152.4 | 91% | 0.909 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.9 | -12.5 | 176.8 | -159.5 | 178.3 | 169.6 | 152.6 | -0.3 | 113.6 | R83 | R81-R83 VanDerWaalsContact C-N 3.32Š|
| 82 | T | 55.8 | Low | 54.7 | Low | 133 Ų | 133 | 152.9 Ų | 152.9 | 82% | 0.816 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.4 | 38.2 | 169.1 | -21.5 | 0 | 0 | 0 | 0 | 110.1 | N84 | T82-N84 PolarHBondContact O-N 3.47Š|
| 83 | R | 53.4 | Low | 54.3 | Low | 220 Ų | 220 | 151.2 Ų | 151.2 | 83% | 0.83 | 76% | 0.755 | S | S | * | * | trans | -61.9 | 105.8 | 167 | -178.4 | -179.9 | 178.7 | 171.2 | 0.6 | 108.7 | L80 R81 | L80-R83 WeakPolarHBondContact O-CB 3.42Å; R81-R83 VanDerWaalsContact C-N 3.32Å | ||
| 84 | N | 56.3 | Low | 54.2 | Low | 113 Ų | 113 | 155 Ų | 155 | 60% | 0.604 | 77% | 0.768 | S | S | * | * | trans | 67.8 | 67.3 | 138.1 | -153.4 | -82.5 | 0 | 0 | 0 | 116.5 | T82 | T82-N84 PolarHBondContact O-N 3.47Š| ||
| 85 | R | 52.7 | Low | 54.4 | Low | 246 Ų | 246 | 151.6 Ų | 151.6 | 93% | 0.928 | 76% | 0.763 | S | S | * | * | trans | -96.9 | 101.9 | 140.7 | -99.6 | -174.4 | 158.6 | 133.5 | -3.1 | 106.4 | P87 | R85-P87 VanDerWaalsContact O-CD 3.31Å; R85-P87 WeakPolarHBondContact O-CD 3.33Å | ||
| 86 | Q | 49 | Very low | 53.8 | Low | 153 Ų | 153 | 151.7 Ų | 151.7 | 72% | 0.715 | 77% | 0.773 | S | S | * | * | trans | -87.7 | 112.9 | 160.9 | -65.2 | -169.3 | -2.9 | 0 | 0 | 107.6 | ||||
| 87 | P | 49.9 | Very low | 53.5 | Low | 111 Ų | 111 | 146.9 Ų | 146.9 | 72% | 0.721 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 125.7 | 141 | 2 | 17 | 0 | 0 | 0 | 106.1 | R85 E89 | R85-P87 VanDerWaalsContact O-CD 3.31Å; R85-P87 WeakPolarHBondContact O-CD 3.33Å; P87-E89 PolarHBondContact O-N 3.1Å |
| 88 | M | 43.7 | Very low | 53.1 | Low | 177 Ų | 177 | 147.7 Ų | 147.7 | 87% | 0.872 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 117 | 166.9 | -73.9 | -142 | -60.6 | 0 | 0 | 108.8 | P90 | M88-P90 WeakPolarHBondContact O-CD 3.36Š|
| 89 | E | 56.5 | Low | 52.9 | Low | 185 Ų | 185 | 150.8 Ų | 150.8 | 86% | 0.864 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 120.1 | 159.4 | -76.3 | -155.7 | 120.2 | 0 | 0 | 107.9 | P87 | P87-E89 PolarHBondContact O-N 3.1Š|
| 90 | P | 62.9 | Low | 52.3 | Low | 107 Ų | 107 | 150.1 Ų | 150.1 | 70% | 0.695 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 135.2 | 158.9 | 29.5 | -29.2 | 0 | 0 | 0 | 108.1 | M88 M92 | M88-P90 WeakPolarHBondContact O-CD 3.36Å; P90-M92 PolarHBondContact O-N 3.43Å |
| 91 | P | 59.5 | Low | 52 | Low | 129 Ų | 129 | 150.1 Ų | 150.1 | 84% | 0.838 | 79% | 0.792 | S | S | * | * | trans | -73.2 | 104.7 | 169.7 | 30 | -28.4 | 0 | 0 | 0 | 106.9 | ||||
| 92 | M | 50.3 | Low | 51.6 | Low | 174 Ų | 174 | 141 Ų | 141 | 86% | 0.857 | 77% | 0.773 | S | S | * | * | trans | -128.8 | 87.9 | 160.3 | -156.6 | 145.2 | -158.8 | 0 | 0 | 109.4 | P90 | P90-M92 PolarHBondContact O-N 3.43Š| ||
| 93 | E | 51.5 | Low | 51.3 | Low | 155 Ų | 155 | 137.9 Ų | 137.9 | 72% | 0.724 | 76% | 0.761 | S | S | * | * | trans | -45.4 | 126 | 154.7 | -58.5 | -106 | 108.5 | 0 | 0 | 109 | S95 | E93-S95 PolarHBondContact O-N 3.29Š| ||
| 94 | P | 55 | Low | 51.1 | Low | 140 Ų | 140 | 131.6 Ų | 131.6 | 91% | 0.909 | 75% | 0.747 | S | S | * | * | trans | -82.3 | 65 | 158.6 | 33.8 | -31 | 0 | 0 | 0 | 107.8 | ||||
| 95 | S | 58.5 | Low | 51.2 | Low | 99 Ų | 99 | 132.7 Ų | 132.7 | 69% | 0.692 | 74% | 0.742 | S | S | * | * | trans | -109.8 | 123.9 | 171 | -169.1 | 0 | 0 | 0 | 0 | 108.4 | E93 | E93-S95 PolarHBondContact O-N 3.29Š| ||
| 96 | G | 40.6 | Very low | 51.1 | Low | 61 Ų | 61 | 128.9 Ų | 128.9 | 63% | 0.629 | 73% | 0.733 | S | S | * | * | trans | 96.6 | 116.9 | -177.3 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 97 | G | 48.3 | Very low | 51.3 | Low | 86 Ų | 86 | 123.4 Ų | 123.4 | 89% | 0.887 | 71% | 0.708 | S | S | * | * | cis | 86.9 | 11.3 | 42.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 98 | E | 47 | Very low | 51.7 | Low | 161 Ų | 161 | 122.6 Ų | 122.6 | 75% | 0.752 | 70% | 0.698 | S | S | * | * | trans | -152.4 | 104.4 | 163.5 | 53.4 | -146.7 | 104.8 | 0 | 0 | 108.9 | E100 | E98-E100 VanDerWaalsContact C-N 3.29Å; E98-E100 PolarHBondContact O-N 2.91Å | ||
| 99 | Q | 50.6 | Low | 52.1 | Low | 193 Ų | 193 | 119.2 Ų | 119.2 | 90% | 0.902 | 68% | 0.683 | S | S | * | * | trans | -58.3 | 104.4 | 152.9 | -82.9 | 160.3 | 83.9 | 0 | 0 | 105.6 | P101 | Q99-P101 WeakPolarHBondContact O-CD 3.37Š| ||
| 100 | E | 43.4 | Very low | 52.3 | Low | 140 Ų | 140 | 114.8 Ų | 114.8 | 65% | 0.654 | 67% | 0.67 | S | S | * | * | trans | -39.5 | 109.3 | 166.1 | -109.4 | -75.6 | 144.9 | 0 | 0 | 109.7 | E98 G102 | E98-E100 VanDerWaalsContact C-N 3.29Å; E98-E100 PolarHBondContact O-N 2.91Å; E100-G102 PolarHBondContact O-N 2.78Å; E100-G102 VanDerWaalsContact O-N 3.16Å; E100-G102 PolarHBondContact OE2-N 3.23Å | ||
| 101 | P | 50.3 | Low | 51.8 | Low | 128 Ų | 128 | 111.4 Ų | 111.4 | 83% | 0.831 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | 18.8 | 174.8 | 32.4 | -29.9 | 0 | 0 | 0 | 111.8 | Q99 | Q99-P101 WeakPolarHBondContact O-CD 3.37Š|
| 102 | G | 49.3 | Very low | 51.7 | Low | 50 Ų | 50 | 108.3 Ų | 108.3 | 52% | 0.515 | 62% | 0.618 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -100.2 | -19.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114 | E100 V104 | E100-G102 PolarHBondContact O-N 2.78Å; E100-G102 VanDerWaalsContact O-N 3.16Å; E100-G102 PolarHBondContact OE2-N 3.23Å; G102-V104 PolarHBondContact O-N 3.44Å |
| 103 | A | 48.9 | Very low | 52.1 | Low | 67 Ų | 67 | 105.3 Ų | 105.3 | 55% | 0.554 | 61% | 0.605 | S | S | * | * | trans | -80.8 | 69.7 | 164.6 | 0 | 0 | 0 | 0 | 0 | 107.8 | R105 | A103-R105 PolarHBondContact O-N 3.01Š| ||
| 104 | V | 48.6 | Very low | 52.6 | Low | 88 Ų | 88 | 102.5 Ų | 102.5 | 53% | 0.533 | 60% | 0.598 | S | S | . | * | trans | -53.3 | 95.4 | 150.7 | -100.1 | 0 | 0 | 0 | 0 | 104 | G102 F106 D108 L109 | G102-V104 PolarHBondContact O-N 3.44Å; V104-F106 PolarHBondContact O-N 3.22Å; V104-D108 HydrophobicContact CG1-CB 4.3Å; V104-L109 HydrophobicContact CB-CD1 4.35Å; V104-L109 HydrophobicContact CG1-CD1 3.74Å | ||
| 105 | R | 58.3 | Low | 52.9 | Low | 137 Ų | 137 | 99.7 Ų | 99.7 | 52% | 0.517 | 58% | 0.575 | S | S | . | * | trans | -54.6 | 149.9 | 171.3 | -61.9 | 174 | 61.2 | -112.6 | -1 | 102.9 | A103 L107 D108 | A103-R105 PolarHBondContact O-N 3.01Å; R105-L107 HydrophobicContact CB-CB 4.36Å; R105-L107 CarbonylContact O-C 3.6Å; R105-L107 PolarHBondContact O-N 3.01Å; R105-D108 WeakPolarHBondContact CB-OD2 3.47Å; R105-D108 VanDerWaalsContact CG-OD2 3.28Å; R105-D108 WeakPolarHBondContact CG-OD2 3.34Å; R105-D108 PolarHBondContact N-OD2 3.37Å; R105-D108 PolarHBondContact O-N 3Å | ||
| 106 | F | 50.8 | Low | 53.2 | Low | 166 Ų | 166 | 95.4 Ų | 95.4 | 73% | 0.728 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | -2.9 | 172.9 | -150 | -91.7 | 0 | 0 | 0 | 112.4 | V104 W111 | V104-F106 PolarHBondContact O-N 3.22Å; F106-W111 WeakPolarHBondContact O-CZ2 3.49Å; F106-W111 PolarHBondContact O-NE1 2.92Å |
| 107 | L | 54 | Low | 54.4 | Low | 38 Ų | 38 | 94 Ų | 94 | 20% | 0.199 | 53% | 0.525 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -95.7 | -15.5 | 172 | -74.1 | 139.8 | 0 | 0 | 0 | 116.4 | R105 W111 A137 L141 | R105-L107 HydrophobicContact CB-CB 4.36Å; R105-L107 CarbonylContact O-C 3.6Å; R105-L107 PolarHBondContact O-N 3.01Å; L107-W111 VanDerWaalsContact CA-CE2 3.47Å; L107-W111 VanDerWaalsContact CA-CZ2 3.45Å; L107-W111 HydrophobicContact CB-CZ2 3.97Å; L107-W111 HydrophobicContact CD2-CH2 3.61Å; L107-W111 HydrophobicContact CD2-CZ2 3.29Å; L107-W111 HydrophobicContact CG-CH2 4.11Å; L107-W111 HydrophobicContact CG-CZ2 3.57Å; L107-W111 PolarHBondContact O-NE1 3.05Å; L107-A137 HydrophobicContact CD2-CB 4.09Å; L107-L141 HydrophobicContact CD2-CD1 3.69Å |
| 108 | D | 57 | Low | 55.1 | Low | 94 Ų | 94 | 95.7 Ų | 95.7 | 50% | 0.503 | 51% | 0.509 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.4 | -3.3 | -170.5 | -57.6 | -35.6 | 0 | 0 | 0 | 114 | V104 R105 | V104-D108 HydrophobicContact CG1-CB 4.3Å; R105-D108 WeakPolarHBondContact CB-OD2 3.47Å; R105-D108 VanDerWaalsContact CG-OD2 3.28Å; R105-D108 WeakPolarHBondContact CG-OD2 3.34Å; R105-D108 PolarHBondContact N-OD2 3.37Å; R105-D108 PolarHBondContact O-N 3Å |
| 109 | L | 52.7 | Low | 56 | Low | 105 Ų | 105 | 91.6 Ų | 91.6 | 55% | 0.55 | 50% | 0.495 | S | S | . | . | S | Bend | trans | -90.5 | 161.8 | 166.6 | -119.3 | 71.2 | 0 | 0 | 0 | 109.8 | V104 W111 | V104-L109 HydrophobicContact CB-CD1 4.35Å; V104-L109 HydrophobicContact CG1-CD1 3.74Å; L109-W111 PolarHBondContact O-N 3.48Å; L109-W111 PolarHBondContact O-NE1 2.93Å |
| 110 | P | 61.3 | Low | 56.6 | Low | 92 Ų | 92 | 83.1 Ų | 83.1 | 60% | 0.597 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.4 | 41 | 174 | 34.4 | -34.9 | 0 | 0 | 0 | 112.1 | E112 | P110-E112 PolarHBondContact O-N 3.46Š|
| 111 | W | 51 | Low | 57.5 | Low | 37 Ų | 37 | 82.7 Ų | 82.7 | 14% | 0.14 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -71 | -15.9 | 170.9 | 62 | -81.2 | 0 | 0 | 0 | 110.9 | F106 L107 L109 D113 V114 L115 L116 L141 | F106-W111 WeakPolarHBondContact O-CZ2 3.49Å; F106-W111 PolarHBondContact O-NE1 2.92Å; L107-W111 VanDerWaalsContact CA-CE2 3.47Å; L107-W111 VanDerWaalsContact CA-CZ2 3.45Å; L107-W111 HydrophobicContact CB-CZ2 3.97Å; L107-W111 HydrophobicContact CD2-CH2 3.61Å; L107-W111 HydrophobicContact CD2-CZ2 3.29Å; L107-W111 HydrophobicContact CG-CH2 4.11Å; L107-W111 HydrophobicContact CG-CZ2 3.57Å; L107-W111 PolarHBondContact O-NE1 3.05Å; L109-W111 PolarHBondContact O-N 3.48Å; L109-W111 PolarHBondContact O-NE1 2.93Å; W111-D113 VanDerWaalsContact C-N 3.3Å; W111-D113 PolarHBondContact O-N 3.45Å; W111-V114 PolarHBondContact O-N 3.11Å; W111-L115 HydrophobicContact CB-CB 4.24Å; W111-L115 HydrophobicContact CB-CD1 3.65Å; W111-L115 HydrophobicContact CB-CG 4.21Å; W111-L115 WeakPolarHBondContact O-CA 3.25Å; W111-L115 WeakPolarHBondContact O-CB 3.16Å; W111-L115 PolarHBondContact O-N 3.47Å; W111-L116 HydrophobicContact CH2-CD1 4.26Å; W111-L116 HydrophobicContact CZ3-CD1 3.77Å; W111-L116 PolarHBondContact O-N 3.3Å; W111-L141 HydrophobicContact CH2-CD1 3.54Å; W111-L141 HydrophobicContact CZ2-CD1 4.06Å |
| 112 | E | 57.4 | Low | 58.3 | Low | 63 Ų | 63 | 87 Ų | 87 | 29% | 0.294 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -63.9 | -32.7 | -179 | -62 | 164.4 | 144.1 | 0 | 0 | 112.5 | P110 L116 L141 | P110-E112 PolarHBondContact O-N 3.46Å; E112-L116 WeakPolarHBondContact O-CB 3.31Å; E112-L116 WeakPolarHBondContact O-CD2 2.91Å; E112-L141 HydrophobicContact CB-CD2 3.9Å; E112-L141 HydrophobicContact CG-CD2 3.69Å |
| 113 | D | 59 | Low | 59 | Low | 112 Ų | 112 | 86.7 Ų | 86.7 | 60% | 0.599 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -91.3 | -24.2 | 179.1 | -66.9 | -50.5 | 0 | 0 | 0 | 112.5 | W111 P117 | W111-D113 VanDerWaalsContact C-N 3.3Å; W111-D113 PolarHBondContact O-N 3.45Å; D113-P117 WeakPolarHBondContact O-CD 3.18Å; D113-P117 WeakPolarHBondContact O-CG 3.49Å |
| 114 | V | 62.1 | Low | 59.7 | Low | 96 Ų | 96 | 87.5 Ų | 87.5 | 58% | 0.582 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -107.3 | -49.3 | -171.2 | -171.3 | 0 | 0 | 0 | 0 | 113 | W111 | W111-V114 PolarHBondContact O-N 3.11Å |
| 115 | L | 61.3 | Low | 60.3 | Low | 81 Ų | 81 | 89.8 Ų | 89.8 | 42% | 0.424 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -82.2 | -31.4 | -179.3 | -71.5 | 172.9 | 0 | 0 | 0 | 111.6 | W111 H118 V119 | W111-L115 HydrophobicContact CB-CB 4.24Å; W111-L115 HydrophobicContact CB-CD1 3.65Å; W111-L115 HydrophobicContact CB-CG 4.21Å; W111-L115 WeakPolarHBondContact O-CA 3.25Å; W111-L115 WeakPolarHBondContact O-CB 3.16Å; W111-L115 PolarHBondContact O-N 3.47Å; L115-H118 CarbonylContact O-C 3.58Å; L115-H118 PolarHBondContact O-N 3.09Å; L115-V119 WeakPolarHBondContact O-CB 3.17Å; L115-V119 VanDerWaalsContact O-CG2 3.23Å; L115-V119 WeakPolarHBondContact O-CG2 3.36Å; L115-V119 PolarHBondContact O-N 2.92Å |
| 116 | L | 66.3 | Low | 60.8 | Low | 9 Ų | 9 | 93.4 Ų | 93.4 | 5% | 0.047 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -63.9 | -49.4 | -174.9 | -156.5 | 78.9 | 0 | 0 | 0 | 113.7 | W111 E112 H118 V119 L120 L141 | W111-L116 HydrophobicContact CH2-CD1 4.26Å; W111-L116 HydrophobicContact CZ3-CD1 3.77Å; W111-L116 PolarHBondContact O-N 3.3Å; E112-L116 WeakPolarHBondContact O-CB 3.31Å; E112-L116 WeakPolarHBondContact O-CD2 2.91Å; L116-H118 PolarHBondContact O-N 2.84Å; L116-V119 PolarHBondContact O-N 3.4Å; L116-L120 HydrophobicContact CD1-CD1 4.4Å; L116-L120 HydrophobicContact CD1-CG 4.42Å; L116-L120 HydrophobicContact CD2-CD1 4.07Å; L116-L120 HydrophobicContact CG-CD1 3.73Å; L116-L120 HydrophobicContact CG-CG 4.03Å; L116-L120 VanDerWaalsContact O-CB 3.25Å; L116-L120 WeakPolarHBondContact O-CB 3.43Å; L116-L120 WeakPolarHBondContact O-CG 3.39Å; L116-L120 PolarHBondContact O-N 3.29Å; L116-L141 HydrophobicContact CD1-CB 4.4Å; L116-L141 HydrophobicContact CD1-CD1 4.29Å; L116-L141 HydrophobicContact CD2-CB 3.84Å; L116-L141 HydrophobicContact CD2-CD2 4.15Å; L116-L141 HydrophobicContact CD2-CG 4.48Å |
| 117 | P | 64.1 | Low | 61.6 | Low | 32 Ų | 32 | 90.5 Ų | 90.5 | 21% | 0.208 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -61 | -34.3 | 175.1 | 9.5 | -11.5 | 0 | 0 | 0 | 111.7 | D113 N121 | D113-P117 WeakPolarHBondContact O-CD 3.18Å; D113-P117 WeakPolarHBondContact O-CG 3.49Å; P117-N121 WeakPolarHBondContact O-CB 3.45Å; P117-N121 VanDerWaalsContact O-CG 3.25Å; P117-N121 PolarHBondContact O-N 3.21Å; P117-N121 PolarHBondContact O-ND2 3.36Å; P117-N121 VanDerWaalsContact O-ND2 3.14Å |
| 118 | H | 63.1 | Low | 62.2 | Low | 120 Ų | 120 | 89.8 Ų | 89.8 | 56% | 0.556 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -74.6 | -34.7 | -178.6 | -69.5 | 14.6 | 0 | 0 | 0 | 113.2 | L115 L116 R122 | L115-H118 CarbonylContact O-C 3.58Å; L115-H118 PolarHBondContact O-N 3.09Å; L116-H118 PolarHBondContact O-N 2.84Å; H118-R122 VanDerWaalsContact O-CG 3.27Å; H118-R122 WeakPolarHBondContact O-CG 3.28Å |
| 119 | V | 65.9 | Low | 62.5 | Low | 75 Ų | 75 | 90 Ų | 90 | 46% | 0.455 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -81 | -44.3 | 176.8 | 174.6 | 0 | 0 | 0 | 0 | 110.4 | L115 L116 N121 R122 V123 | L115-V119 WeakPolarHBondContact O-CB 3.17Å; L115-V119 VanDerWaalsContact O-CG2 3.23Å; L115-V119 WeakPolarHBondContact O-CG2 3.36Å; L115-V119 PolarHBondContact O-N 2.92Å; L116-V119 PolarHBondContact O-N 3.4Å; V119-N121 VanDerWaalsContact C-N 3.3Å; V119-N121 PolarHBondContact O-N 2.81Å; V119-R122 PolarHBondContact O-N 3.41Å; V119-V123 HydrophobicContact CG1-CG2 3.88Å; V119-V123 WeakPolarHBondContact O-CB 3.15Å; V119-V123 WeakPolarHBondContact O-CG2 3.49Å; V119-V123 PolarHBondContact O-N 3.41Å |
| 120 | L | 63.5 | Low | 63.3 | Low | 16 Ų | 16 | 93.8 Ų | 93.8 | 8% | 0.084 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -64.6 | -33.6 | 178.1 | -62.4 | -178.7 | 0 | 0 | 0 | 112 | L116 R122 L128 F138 H145 | L116-L120 HydrophobicContact CD1-CD1 4.4Å; L116-L120 HydrophobicContact CD1-CG 4.42Å; L116-L120 HydrophobicContact CD2-CD1 4.07Å; L116-L120 HydrophobicContact CG-CD1 3.73Å; L116-L120 HydrophobicContact CG-CG 4.03Å; L116-L120 VanDerWaalsContact O-CB 3.25Å; L116-L120 WeakPolarHBondContact O-CB 3.43Å; L116-L120 WeakPolarHBondContact O-CG 3.39Å; L116-L120 PolarHBondContact O-N 3.29Å; L120-R122 VanDerWaalsContact C-N 3.26Å; L120-R122 PolarHBondContact O-N 3.22Å; L120-L128 HydrophobicContact CD2-CD1 3.67Å; L120-L128 HydrophobicContact CD2-CD2 3.79Å; L120-L128 HydrophobicContact CD2-CG 3.73Å; L120-F138 HydrophobicContact CD2-CE1 4.43Å; L120-F138 HydrophobicContact CD2-CZ 3.82Å; L120-H145 HydrophobicContact CD1-CB 3.99Å |
| 121 | N | 63.6 | Low | 63.4 | Low | 131 Ų | 131 | 93.2 Ų | 93.2 | 70% | 0.701 | 45% | 0.451 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.4 | -19.8 | 172.6 | -83.2 | -28.5 | 0 | 0 | 0 | 113.9 | P117 V119 | P117-N121 WeakPolarHBondContact O-CB 3.45Å; P117-N121 VanDerWaalsContact O-CG 3.25Å; P117-N121 PolarHBondContact O-N 3.21Å; P117-N121 PolarHBondContact O-ND2 3.36Å; P117-N121 VanDerWaalsContact O-ND2 3.14Å; V119-N121 VanDerWaalsContact C-N 3.3Å; V119-N121 PolarHBondContact O-N 2.81Å |
| 122 | R | 66 | Low | 64.2 | Low | 218 Ų | 218 | 94 Ų | 94 | 82% | 0.823 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.6 | -14.1 | -179.3 | -71.5 | -176 | -179.3 | -173 | 3 | 113.6 | H118 V119 L120 | H118-R122 VanDerWaalsContact O-CG 3.27Å; H118-R122 WeakPolarHBondContact O-CG 3.28Å; V119-R122 PolarHBondContact O-N 3.41Å; L120-R122 VanDerWaalsContact C-N 3.26Å; L120-R122 PolarHBondContact O-N 3.22Å |
| 123 | V | 65.1 | Low | 64.6 | Low | 43 Ų | 43 | 101.8 Ų | 101.8 | 26% | 0.261 | 48% | 0.483 | S | S | . | . | S | Bend | trans | -100.8 | 125.8 | -176.2 | 176.9 | 0 | 0 | 0 | 0 | 110 | V119 L125 Q127 L128 | V119-V123 HydrophobicContact CG1-CG2 3.88Å; V119-V123 WeakPolarHBondContact O-CB 3.15Å; V119-V123 WeakPolarHBondContact O-CG2 3.49Å; V119-V123 PolarHBondContact O-N 3.41Å; V123-L125 PolarHBondContact O-N 3.27Å; V123-Q127 HydrophobicContact CG1-CB 3.53Å; V123-Q127 HydrophobicContact CG1-CG 4.21Å; V123-L128 HydrophobicContact CB-CD1 3.74Å; V123-L128 HydrophobicContact CG1-CD1 3.64Å |
| 124 | P | 63.7 | Low | 64.9 | Low | 85 Ų | 85 | 102.1 Ų | 102.1 | 55% | 0.552 | 49% | 0.489 | S | S | * | . | trans | -62.5 | 138.5 | 178.9 | 23.4 | -31.6 | 0 | 0 | 0 | 111.2 | R126 Q127 L128 | P124-R126 PolarHBondContact O-N 2.81Å; P124-Q127 WeakPolarHBondContact O-CB 3.23Å; P124-Q127 PolarHBondContact O-N 3.26Å; P124-L128 PolarHBondContact O-N 3.35Å | ||
| 125 | L | 59.4 | Low | 65.2 | Low | 135 Ų | 135 | 99.7 Ų | 99.7 | 71% | 0.707 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -44.1 | -34.8 | -177 | -86.4 | 150.3 | 0 | 0 | 0 | 114.8 | V123 Q127 L128 L129 | V123-L125 PolarHBondContact O-N 3.27Å; L125-Q127 VanDerWaalsContact C-N 3.3Å; L125-Q127 PolarHBondContact O-N 3.21Å; L125-L128 WeakPolarHBondContact O-CB 3.27Å; L125-L128 PolarHBondContact O-N 3.02Å; L125-L129 WeakPolarHBondContact O-CG 3.37Å; L125-L129 PolarHBondContact O-N 3.33Å |
| 126 | R | 69.4 | Low | 65.4 | Low | 214 Ų | 214 | 106.6 Ų | 106.6 | 81% | 0.808 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.1 | -35 | 178.3 | -63.6 | -177.2 | -177.2 | -166.5 | -0.2 | 112.8 | P124 R130 | P124-R126 PolarHBondContact O-N 2.81Å; R126-R130 WeakPolarHBondContact O-CG 3.46Å; R126-R130 PolarHBondContact O-N 3.19Å |
| 127 | Q | 68.3 | Low | 65.5 | Low | 105 Ų | 105 | 107.9 Ų | 107.9 | 49% | 0.491 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -76.1 | -40 | 177.5 | -138.4 | 97.9 | -30.6 | 0 | 0 | 110.9 | V123 P124 L125 L129 R130 L131 | V123-Q127 HydrophobicContact CG1-CB 3.53Å; V123-Q127 HydrophobicContact CG1-CG 4.21Å; P124-Q127 WeakPolarHBondContact O-CB 3.23Å; P124-Q127 PolarHBondContact O-N 3.26Å; L125-Q127 VanDerWaalsContact C-N 3.3Å; L125-Q127 PolarHBondContact O-N 3.21Å; Q127-L129 VanDerWaalsContact C-N 3.32Å; Q127-L129 PolarHBondContact O-N 3.14Å; Q127-R130 PolarHBondContact O-N 3.07Å; Q127-L131 PolarHBondContact O-N 3.31Å |
| 128 | L | 65.4 | Low | 65.8 | Low | 22 Ų | 22 | 108.3 Ų | 108.3 | 12% | 0.115 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -55.3 | -47.9 | 173.9 | -111.1 | 79.9 | 0 | 0 | 0 | 111.4 | L120 V123 P124 L125 R130 L131 Q132 F138 V142 | L120-L128 HydrophobicContact CD2-CD1 3.67Å; L120-L128 HydrophobicContact CD2-CD2 3.79Å; L120-L128 HydrophobicContact CD2-CG 3.73Å; V123-L128 HydrophobicContact CB-CD1 3.74Å; V123-L128 HydrophobicContact CG1-CD1 3.64Å; P124-L128 PolarHBondContact O-N 3.35Å; L125-L128 WeakPolarHBondContact O-CB 3.27Å; L125-L128 PolarHBondContact O-N 3.02Å; L128-R130 VanDerWaalsContact C-N 3.29Å; L128-R130 PolarHBondContact O-N 3.38Å; L128-L131 PolarHBondContact O-N 3.18Å; L128-Q132 WeakPolarHBondContact O-CB 3.19Å; L128-Q132 PolarHBondContact O-N 3.42Å; L128-F138 HydrophobicContact CG-CE1 4.37Å; L128-V142 HydrophobicContact CD2-CG2 4.38Å |
| 129 | L | 64.6 | Low | 66.2 | Low | 99 Ų | 99 | 109 Ų | 109 | 52% | 0.518 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.2 | -30 | -179.3 | -68.4 | 172.3 | 0 | 0 | 0 | 112.4 | L125 Q127 | L125-L129 WeakPolarHBondContact O-CG 3.37Å; L125-L129 PolarHBondContact O-N 3.33Å; Q127-L129 VanDerWaalsContact C-N 3.32Å; Q127-L129 PolarHBondContact O-N 3.14Å |
| 130 | R | 70 | Confident | 66.4 | Low | 185 Ų | 185 | 108.9 Ų | 108.9 | 70% | 0.698 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -69.8 | -43.9 | 172 | -74.7 | 179.8 | 177.9 | -170 | -0.7 | 111.2 | R126 Q127 L128 R133 V134 | R126-R130 WeakPolarHBondContact O-CG 3.46Å; R126-R130 PolarHBondContact O-N 3.19Å; Q127-R130 PolarHBondContact O-N 3.07Å; L128-R130 VanDerWaalsContact C-N 3.29Å; L128-R130 PolarHBondContact O-N 3.38Å; R130-R133 PolarHBondContact O-N 3.27Å; R130-V134 WeakPolarHBondContact O-CG2 3.41Å |
| 131 | L | 62.6 | Low | 66.8 | Low | 79 Ų | 79 | 108.6 Ų | 108.6 | 41% | 0.414 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.8 | -33.1 | 178.4 | -72.7 | 166.2 | 0 | 0 | 0 | 113.1 | Q127 L128 R133 V134 S135 F138 | Q127-L131 PolarHBondContact O-N 3.31Å; L128-L131 PolarHBondContact O-N 3.18Å; L131-R133 PolarHBondContact O-N 3.34Å; L131-V134 WeakPolarHBondContact O-CB 3.49Å; L131-V134 PolarHBondContact O-N 3.3Å; L131-S135 PolarHBondContact O-N 3.02Å; L131-F138 HydrophobicContact CB-CD1 3.96Å; L131-F138 HydrophobicContact CB-CE1 3.81Å; L131-F138 HydrophobicContact CB-CZ 4.28Å; L131-F138 HydrophobicContact CD1-CZ 4.35Å |
| 132 | Q | 67.3 | Low | 67.2 | Low | 53 Ų | 53 | 103.4 Ų | 103.4 | 25% | 0.248 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -60.4 | -30.3 | 173.4 | -170.3 | -176.9 | 12.9 | 0 | 0 | 112.6 | L128 V134 R139 | L128-Q132 WeakPolarHBondContact O-CB 3.19Å; L128-Q132 PolarHBondContact O-N 3.42Å; Q132-V134 VanDerWaalsContact C-N 3.32Å; Q132-R139 HydrophobicContact CG-CB 3.92Å; Q132-R139 HydrophobicContact CG-CG 4.03Å |
| 133 | R | 65.3 | Low | 67.6 | Low | 228 Ų | 228 | 98 Ų | 98 | 86% | 0.86 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80 | -14.1 | 176 | -66 | -178.4 | 77.8 | 159.7 | 3.8 | 113.2 | R130 L131 | R130-R133 PolarHBondContact O-N 3.27Å; L131-R133 PolarHBondContact O-N 3.34Å |
| 134 | V | 66.4 | Low | 68 | Low | 118 Ų | 118 | 100.7 Ų | 100.7 | 72% | 0.715 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.2 | -28.8 | -178.4 | 179.7 | 0 | 0 | 0 | 0 | 111.7 | R130 L131 Q132 | R130-V134 WeakPolarHBondContact O-CG2 3.41Å; L131-V134 WeakPolarHBondContact O-CB 3.49Å; L131-V134 PolarHBondContact O-N 3.3Å; Q132-V134 VanDerWaalsContact C-N 3.32Å |
| 135 | S | 67.9 | Low | 68.3 | Low | 45 Ų | 45 | 98.3 Ų | 98.3 | 32% | 0.315 | 46% | 0.457 | S | S | . | . | trans | -144.7 | 130.5 | -176.3 | -179.4 | 0 | 0 | 0 | 0 | 113.9 | L131 A137 F138 R139 | L131-S135 PolarHBondContact O-N 3.02Å; S135-A137 VanDerWaalsContact C-N 3.28Å; S135-A137 PolarHBondContact O-N 3.05Å; S135-A137 PolarHBondContact OG-N 2.9Å; S135-F138 PolarHBondContact O-N 2.66Å; S135-R139 PolarHBondContact O-N 2.71Å | ||
| 136 | R | 66.3 | Low | 68.8 | Low | 227 Ų | 227 | 96.9 Ų | 96.9 | 86% | 0.857 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -61.8 | -34.6 | 172.1 | -72.8 | -174.2 | 176.7 | -169.9 | -0.1 | 112.3 | F138 R139 S140 | R136-F138 VanDerWaalsContact C-N 3.35Å; R136-R139 WeakPolarHBondContact O-CB 3.32Å; R136-R139 PolarHBondContact O-N 3.27Å; R136-S140 PolarHBondContact O-N 2.78Å; R136-S140 PolarHBondContact O-OG 3.41Å |
| 137 | A | 67.5 | Low | 68.8 | Low | 36 Ų | 36 | 89.5 Ų | 89.5 | 30% | 0.298 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -64.1 | -42.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | L107 S135 R139 S140 L141 | L107-A137 HydrophobicContact CD2-CB 4.09Å; S135-A137 VanDerWaalsContact C-N 3.28Å; S135-A137 PolarHBondContact O-N 3.05Å; S135-A137 PolarHBondContact OG-N 2.9Å; A137-R139 VanDerWaalsContact C-N 3.28Å; A137-R139 PolarHBondContact O-N 2.77Å; A137-S140 PolarHBondContact O-N 2.79Å; A137-L141 VanDerWaalsContact O-CG 3.31Å; A137-L141 WeakPolarHBondContact O-CG 3.38Å; A137-L141 PolarHBondContact O-N 3.02Å |
| 138 | F | 69.8 | Low | 68.8 | Low | 40 Ų | 40 | 85.9 Ų | 85.9 | 18% | 0.175 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -64.8 | -33.8 | 177.7 | -157.3 | -98.3 | 0 | 0 | 0 | 112.4 | L120 L128 L131 S135 R136 L141 V142 | L120-F138 HydrophobicContact CD2-CE1 4.43Å; L120-F138 HydrophobicContact CD2-CZ 3.82Å; L128-F138 HydrophobicContact CG-CE1 4.37Å; L131-F138 HydrophobicContact CB-CD1 3.96Å; L131-F138 HydrophobicContact CB-CE1 3.81Å; L131-F138 HydrophobicContact CB-CZ 4.28Å; L131-F138 HydrophobicContact CD1-CZ 4.35Å; S135-F138 PolarHBondContact O-N 2.66Å; R136-F138 VanDerWaalsContact C-N 3.35Å; F138-L141 PolarHBondContact O-N 3.47Å; F138-V142 HydrophobicContact CD1-CG2 4.08Å; F138-V142 HydrophobicContact CE1-CG2 3.94Å; F138-V142 WeakPolarHBondContact O-CG2 3.42Å; F138-V142 PolarHBondContact O-N 3.31Å |
| 139 | R | 71.9 | Confident | 68.7 | Low | 135 Ų | 135 | 89.3 Ų | 89.3 | 51% | 0.509 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.4 | -43.7 | 173.8 | -175.2 | 167.2 | -176.5 | -102.2 | 4.2 | 112.2 | Q132 S135 R136 A137 L141 Q143 | Q132-R139 HydrophobicContact CG-CB 3.92Å; Q132-R139 HydrophobicContact CG-CG 4.03Å; S135-R139 PolarHBondContact O-N 2.71Å; R136-R139 WeakPolarHBondContact O-CB 3.32Å; R136-R139 PolarHBondContact O-N 3.27Å; A137-R139 VanDerWaalsContact C-N 3.28Å; A137-R139 PolarHBondContact O-N 2.77Å; R139-L141 VanDerWaalsContact C-N 3.33Å; R139-Q143 WeakPolarHBondContact O-CG 3.44Å; R139-Q143 PolarHBondContact O-N 2.86Å |
| 140 | S | 70.3 | Confident | 68.4 | Low | 73 Ų | 73 | 94.9 Ų | 94.9 | 51% | 0.51 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -64.2 | -38.3 | 175 | -57.5 | 0 | 0 | 0 | 0 | 112 | R136 A137 Q143 L144 | R136-S140 PolarHBondContact O-N 2.78Å; R136-S140 PolarHBondContact O-OG 3.41Å; A137-S140 PolarHBondContact O-N 2.79Å; S140-Q143 WeakPolarHBondContact O-CB 3.44Å; S140-Q143 PolarHBondContact O-N 3Å; S140-L144 PolarHBondContact O-N 3.27Å |
| 141 | L | 71.3 | Confident | 67.6 | Low | 10 Ų | 10 | 95.9 Ų | 95.9 | 5% | 0.052 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -66.3 | -42.4 | 178.7 | -71.5 | 172.1 | 0 | 0 | 0 | 113.2 | L107 W111 E112 L116 A137 F138 R139 Q143 L144 H145 | L107-L141 HydrophobicContact CD2-CD1 3.69Å; W111-L141 HydrophobicContact CH2-CD1 3.54Å; W111-L141 HydrophobicContact CZ2-CD1 4.06Å; E112-L141 HydrophobicContact CB-CD2 3.9Å; E112-L141 HydrophobicContact CG-CD2 3.69Å; L116-L141 HydrophobicContact CD1-CB 4.4Å; L116-L141 HydrophobicContact CD1-CD1 4.29Å; L116-L141 HydrophobicContact CD2-CB 3.84Å; L116-L141 HydrophobicContact CD2-CD2 4.15Å; L116-L141 HydrophobicContact CD2-CG 4.48Å; A137-L141 VanDerWaalsContact O-CG 3.31Å; A137-L141 WeakPolarHBondContact O-CG 3.38Å; A137-L141 PolarHBondContact O-N 3.02Å; F138-L141 PolarHBondContact O-N 3.47Å; R139-L141 VanDerWaalsContact C-N 3.33Å; L141-Q143 VanDerWaalsContact C-N 3.3Å; L141-Q143 PolarHBondContact O-N 2.98Å; L141-L144 PolarHBondContact O-N 3.4Å; L141-H145 PolarHBondContact O-N 3.32Å |
| 142 | V | 71.8 | Confident | 66.8 | Low | 21 Ų | 21 | 99.3 Ų | 99.3 | 13% | 0.127 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -63.6 | -38.5 | 174.1 | 172.7 | 0 | 0 | 0 | 0 | 111 | L128 F138 H145 L146 | L128-V142 HydrophobicContact CD2-CG2 4.38Å; F138-V142 HydrophobicContact CD1-CG2 4.08Å; F138-V142 HydrophobicContact CE1-CG2 3.94Å; F138-V142 WeakPolarHBondContact O-CG2 3.42Å; F138-V142 PolarHBondContact O-N 3.31Å; V142-H145 PolarHBondContact O-N 3.45Å; V142-L146 HydrophobicContact CG1-CD1 4.25Å; V142-L146 WeakPolarHBondContact O-CG 3.31Å; V142-L146 PolarHBondContact O-N 2.92Å; V142-L146 VanDerWaalsContact O-N 3.11Å |
| 143 | Q | 74.7 | Confident | 65.8 | Low | 106 Ų | 106 | 102.5 Ų | 102.5 | 50% | 0.495 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.8 | -42.1 | 175.4 | -73.4 | 178.7 | -33 | 0 | 0 | 112 | R139 S140 L141 L146 A147 | R139-Q143 WeakPolarHBondContact O-CG 3.44Å; R139-Q143 PolarHBondContact O-N 2.86Å; S140-Q143 WeakPolarHBondContact O-CB 3.44Å; S140-Q143 PolarHBondContact O-N 3Å; L141-Q143 VanDerWaalsContact C-N 3.3Å; L141-Q143 PolarHBondContact O-N 2.98Å; Q143-L146 PolarHBondContact O-N 3.39Å; Q143-A147 WeakPolarHBondContact O-CB 3.47Å; Q143-A147 PolarHBondContact O-N 3.05Å |
| 144 | L | 74.1 | Confident | 64.9 | Low | 98 Ų | 98 | 95.5 Ų | 95.5 | 51% | 0.513 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.9 | -43 | 176.2 | -176.6 | 62.5 | 0 | 0 | 0 | 111.7 | S140 L141 L146 A147 G148 | S140-L144 PolarHBondContact O-N 3.27Å; L141-L144 PolarHBondContact O-N 3.4Å; L144-L146 PolarHBondContact O-N 3.22Å; L144-A147 PolarHBondContact O-N 2.82Å; L144-G148 PolarHBondContact O-N 3.35Å |
| 145 | H | 70.3 | Confident | 64 | Low | 35 Ų | 35 | 93.7 Ų | 93.7 | 16% | 0.162 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -60.8 | -45.7 | 177.3 | -176.4 | 62.4 | 0 | 0 | 0 | 112.1 | L120 L141 V142 A147 G148 L149 | L120-H145 HydrophobicContact CD1-CB 3.99Å; L141-H145 PolarHBondContact O-N 3.32Å; V142-H145 PolarHBondContact O-N 3.45Å; H145-A147 VanDerWaalsContact C-N 3.32Å; H145-A147 PolarHBondContact O-N 3.25Å; H145-G148 PolarHBondContact O-N 3.41Å; H145-L149 WeakPolarHBondContact O-CG 3.4Å; H145-L149 PolarHBondContact O-N 3.44Å |
| 146 | L | 69.4 | Low | 63 | Low | 106 Ų | 106 | 98.7 Ų | 98.7 | 56% | 0.555 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.1 | -36.6 | 176 | -68.5 | 172.4 | 0 | 0 | 0 | 112.5 | V142 Q143 L144 R150 | V142-L146 HydrophobicContact CG1-CD1 4.25Å; V142-L146 WeakPolarHBondContact O-CG 3.31Å; V142-L146 PolarHBondContact O-N 2.92Å; V142-L146 VanDerWaalsContact O-N 3.11Å; Q143-L146 PolarHBondContact O-N 3.39Å; L144-L146 PolarHBondContact O-N 3.22Å; L146-R150 PolarHBondContact O-N 2.99Å |
| 147 | A | 70.6 | Confident | 61.7 | Low | 58 Ų | 58 | 97.3 Ų | 97.3 | 48% | 0.479 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -68.6 | -38.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | Q143 L144 H145 R150 R151 | Q143-A147 WeakPolarHBondContact O-CB 3.47Å; Q143-A147 PolarHBondContact O-N 3.05Å; L144-A147 PolarHBondContact O-N 2.82Å; H145-A147 VanDerWaalsContact C-N 3.32Å; H145-A147 PolarHBondContact O-N 3.25Å; A147-R150 PolarHBondContact O-N 2.98Å; A147-R151 PolarHBondContact O-N 3.18Å |
| 148 | G | 66.5 | Low | 61.4 | Low | 29 Ų | 29 | 100.4 Ų | 100.4 | 30% | 0.299 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.4 | -42 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | L144 H145 R150 R151 F152 | L144-G148 PolarHBondContact O-N 3.35Å; H145-G148 PolarHBondContact O-N 3.41Å; G148-R150 PolarHBondContact O-N 2.96Å; G148-R151 PolarHBondContact O-N 3.16Å; G148-R151 VanDerWaalsContact O-N 3.1Å; G148-F152 PolarHBondContact O-N 3.06Å |
| 149 | L | 63.9 | Low | 60.9 | Low | 94 Ų | 94 | 103.6 Ų | 103.6 | 49% | 0.492 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -60.8 | -42.5 | 174.5 | -71.1 | 173.9 | 0 | 0 | 0 | 112.1 | H145 R151 F152 D153 | H145-L149 WeakPolarHBondContact O-CG 3.4Å; H145-L149 PolarHBondContact O-N 3.44Å; L149-R151 VanDerWaalsContact C-N 3.26Å; L149-R151 PolarHBondContact O-N 3.43Å; L149-F152 PolarHBondContact O-N 3.07Å; L149-D153 WeakPolarHBondContact O-CB 3.28Å; L149-D153 PolarHBondContact O-N 3.35Å |
| 150 | R | 59.4 | Low | 60.3 | Low | 216 Ų | 216 | 101.8 Ų | 101.8 | 82% | 0.815 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.1 | -32.9 | 173.6 | -84.1 | -150.5 | -167 | -156.7 | 6.7 | 113.3 | L146 A147 G148 A154 | L146-R150 PolarHBondContact O-N 2.99Å; A147-R150 PolarHBondContact O-N 2.98Å; G148-R150 PolarHBondContact O-N 2.96Å; R150-A154 PolarHBondContact O-N 3.05Å |
| 151 | R | 52.2 | Low | 59.7 | Low | 206 Ų | 206 | 103.5 Ų | 103.5 | 78% | 0.777 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -81.9 | -34.1 | -177.1 | -154.2 | 178.4 | -177.1 | 135.8 | 0.8 | 112.3 | A147 G148 L149 A155 | A147-R151 PolarHBondContact O-N 3.18Å; G148-R151 PolarHBondContact O-N 3.16Å; G148-R151 VanDerWaalsContact O-N 3.1Å; L149-R151 VanDerWaalsContact C-N 3.26Å; L149-R151 PolarHBondContact O-N 3.43Å; R151-A155 PolarHBondContact O-N 3.06Å |
| 152 | F | 45.8 | Very low | 59 | Low | 151 Ų | 151 | 109.4 Ų | 109.4 | 66% | 0.662 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -70.9 | -33.9 | 172.8 | -102.8 | -85.6 | 0 | 0 | 0 | 112.7 | G148 L149 A155 Q156 | G148-F152 PolarHBondContact O-N 3.06Å; L149-F152 PolarHBondContact O-N 3.07Å; F152-A155 PolarHBondContact O-N 3.37Å; F152-Q156 WeakPolarHBondContact O-CG 3.45Å; F152-Q156 PolarHBondContact O-N 3.22Å |
| 153 | D | 47.3 | Very low | 58.2 | Low | 120 Ų | 120 | 115.3 Ų | 115.3 | 64% | 0.642 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -66.2 | -39.9 | 173.5 | -167.8 | 44.9 | 0 | 0 | 0 | 111.4 | L149 A155 Q156 | L149-D153 WeakPolarHBondContact O-CB 3.28Å; L149-D153 PolarHBondContact O-N 3.35Å; D153-A155 VanDerWaalsContact C-N 3.26Å; D153-A155 PolarHBondContact O-N 3.41Å; D153-Q156 PolarHBondContact O-N 3.09Å |
| 154 | A | 45.6 | Very low | 57 | Low | 81 Ų | 81 | 115.9 Ų | 115.9 | 67% | 0.669 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.3 | -15.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | R150 | R150-A154 PolarHBondContact O-N 3.05Š|
| 155 | A | 47.3 | Very low | 55.7 | Low | 80 Ų | 80 | 117.3 Ų | 117.3 | 66% | 0.661 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98 | 0.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | R151 F152 D153 | R151-A155 PolarHBondContact O-N 3.06Å; F152-A155 PolarHBondContact O-N 3.37Å; D153-A155 VanDerWaalsContact C-N 3.26Å; D153-A155 PolarHBondContact O-N 3.41Å |
| 156 | Q | 46.3 | Very low | 54.4 | Low | 151 Ų | 151 | 124.2 Ų | 124.2 | 71% | 0.706 | 66% | 0.663 | S | S | * | * | trans | -102.2 | 22.9 | 177.8 | -82 | -171.2 | 94 | 0 | 0 | 113.5 | F152 D153 | F152-Q156 WeakPolarHBondContact O-CG 3.45Å; F152-Q156 PolarHBondContact O-N 3.22Å; D153-Q156 PolarHBondContact O-N 3.09Å | ||
| 157 | V | 39.1 | Very low | 53.1 | Low | 198 Ų | 198 | 125.8 Ų | 125.8 | 100% | 1.2 | 67% | 0.673 | S | S | * | * | trans | -125.5 | 0 | 169 | 174.2 | 0 | 0 | 0 | 0 | 110 |
Retrieved 157 of 157 residues in 81.2 ms
(Link to these results)