| 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 | 38.2 | Very low | 51.2 | Low | 250 Ų | 250 | 156 Ų | 156 | 100% | 1.232 | 84% | 0.843 | S | S | * | * | 0 | 115.3 | 0 | -169.5 | 160.7 | 163.5 | 0 | 0 | 107.6 | |||||
| 2 | A | 43.8 | Very low | 52.1 | Low | 90 Ų | 90 | 156.9 Ų | 156.9 | 74% | 0.744 | 85% | 0.845 | S | S | * | * | trans | -116.2 | 174.6 | 170.7 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 3 | P | 50.5 | Low | 51.9 | Low | 126 Ų | 126 | 160.4 Ų | 160.4 | 82% | 0.818 | 85% | 0.848 | S | S | * | * | cis | -104.3 | -166.8 | -4 | 39 | -25.4 | 0 | 0 | 0 | 111.4 | ||||
| 4 | G | 46.1 | Very low | 51.2 | Low | 62 Ų | 62 | 154.3 Ų | 154.3 | 64% | 0.639 | 84% | 0.843 | S | S | * | * | cis | 127.3 | 173.4 | -3.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 5 | R | 58.6 | Low | 50.9 | Low | 252 Ų | 252 | 153.6 Ų | 153.6 | 95% | 0.951 | 85% | 0.845 | S | S | * | * | trans | 76.5 | 129.5 | -172.2 | -45.9 | 166.7 | 84 | -134 | 6.3 | 113.6 | ||||
| 6 | G | 44.8 | Very low | 50.6 | Low | 71 Ų | 71 | 151.6 Ų | 151.6 | 73% | 0.732 | 84% | 0.841 | S | S | * | * | cis | 123.3 | 104.7 | -0.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 7 | L | 53.9 | Low | 50 | Low | 186 Ų | 186 | 147.5 Ų | 147.5 | 97% | 0.974 | 84% | 0.842 | S | S | * | * | trans | -133.5 | 114.3 | 165.4 | -72 | 173.6 | 0 | 0 | 0 | 108.3 | ||||
| 8 | W | 58.2 | Low | 49.7 | Very low | 233 Ų | 233 | 143.6 Ų | 143.6 | 88% | 0.883 | 84% | 0.839 | S | S | * | * | trans | -130.2 | -179.2 | 175.3 | 178.9 | 44.4 | 0 | 0 | 0 | 107.6 | ||||
| 9 | L | 55.8 | Low | 50.1 | Low | 143 Ų | 143 | 143.1 Ų | 143.1 | 75% | 0.749 | 84% | 0.841 | S | S | * | * | trans | 77.7 | 123.7 | -179.6 | -43.5 | 173.3 | 0 | 0 | 0 | 113.5 | ||||
| 10 | G | 51.8 | Low | 49.6 | Very low | 62 Ų | 62 | 140.8 Ų | 140.8 | 64% | 0.639 | 84% | 0.839 | S | S | * | * | cis | -168.7 | 144.9 | -3.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | L12 | G10-L12 PolarHBondContact O-N 3.32Š| ||
| 11 | R | 60.9 | Low | 49 | Very low | 241 Ų | 241 | 143.3 Ų | 143.3 | 91% | 0.909 | 84% | 0.842 | S | S | * | * | trans | -83.8 | 95.4 | 171.2 | -170.8 | -177.4 | -161.3 | -175.7 | 5.9 | 108.2 | ||||
| 12 | L | 62.1 | Low | 48.9 | Very low | 167 Ų | 167 | 137.2 Ų | 137.2 | 87% | 0.874 | 82% | 0.815 | S | S | * | * | trans | -94.4 | 103.8 | 173.3 | -69.4 | 176.3 | 0 | 0 | 0 | 110.1 | G10 | G10-L12 PolarHBondContact O-N 3.32Š| ||
| 13 | F | 49.8 | Very low | 48.9 | Very low | 202 Ų | 202 | 140.5 Ų | 140.5 | 89% | 0.886 | 82% | 0.815 | S | S | * | * | trans | -14.1 | 141.1 | 165.1 | -61.5 | -98.4 | 0 | 0 | 0 | 118.3 | ||||
| 14 | G | 42.1 | Very low | 48.5 | Very low | 75 Ų | 75 | 141.9 Ų | 141.9 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | trans | 137.8 | 89.5 | 151.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 15 | V | 46.4 | Very low | 48.3 | Very low | 144 Ų | 144 | 142.6 Ų | 142.6 | 87% | 0.873 | 82% | 0.822 | S | S | * | * | trans | -103.9 | 119.3 | 148.6 | 171.6 | 0 | 0 | 0 | 0 | 105 | ||||
| 16 | P | 47.3 | Very low | 47.9 | Very low | 121 Ų | 121 | 134.9 Ų | 134.9 | 79% | 0.786 | 81% | 0.813 | S | S | * | * | -148.7 | 144 | 106.9 | 36.3 | -19.2 | 0 | 0 | 0 | 116.4 | |||||
| 17 | G | 39.4 | Very low | 48.2 | Very low | 82 Ų | 82 | 139 Ų | 139 | 85% | 0.845 | 82% | 0.817 | S | S | * | * | trans | 49.6 | 130.6 | 130.7 | 0 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 18 | G | 44.1 | Very low | 48 | Very low | 78 Ų | 78 | 139.2 Ų | 139.2 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | trans | 118.5 | 160 | 137.3 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 19 | P | 58.3 | Low | 47.7 | Very low | 134 Ų | 134 | 132.3 Ų | 132.3 | 87% | 0.87 | 80% | 0.797 | S | S | * | * | trans | -122.3 | 151 | -153.3 | 39.4 | -25.4 | 0 | 0 | 0 | 116.6 | ||||
| 20 | A | 38.8 | Very low | 47.9 | Very low | 96 Ų | 96 | 137.4 Ų | 137.4 | 79% | 0.793 | 81% | 0.807 | S | S | * | * | trans | -170.4 | 118.7 | 150.9 | 0 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 21 | E | 38.4 | Very low | 48.2 | Very low | 195 Ų | 195 | 143.4 Ų | 143.4 | 91% | 0.911 | 81% | 0.81 | S | S | * | * | 72.7 | 140.4 | 63.5 | -142.5 | -174 | 117.2 | 0 | 0 | 114.9 | |||||
| 22 | N | 36 | Very low | 47.9 | Very low | 122 Ų | 122 | 138.2 Ų | 138.2 | 65% | 0.652 | 81% | 0.807 | S | S | * | * | trans | 93.7 | 93.2 | 173 | -144.1 | -52.8 | 0 | 0 | 0 | 119.9 | ||||
| 23 | E | 44.3 | Very low | 47.4 | Very low | 159 Ų | 159 | 133.8 Ų | 133.8 | 74% | 0.743 | 79% | 0.791 | S | S | * | * | trans | 19.9 | 131.6 | 135.8 | -41.7 | -174.7 | 87.9 | 0 | 0 | 121.5 | ||||
| 24 | N | 41.6 | Very low | 47.8 | Very low | 155 Ų | 155 | 129.6 Ų | 129.6 | 83% | 0.829 | 79% | 0.786 | S | S | * | * | 177.5 | 117.8 | 99 | -98.1 | -81.2 | 0 | 0 | 0 | 110.6 | |||||
| 25 | G | 41.4 | Very low | 48.7 | Very low | 77 Ų | 77 | 137 Ų | 137 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | trans | 156.6 | 87 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 26 | A | 50.3 | Low | 49.4 | Very low | 90 Ų | 90 | 136 Ų | 136 | 74% | 0.744 | 78% | 0.78 | S | S | * | * | trans | -68.3 | 158.2 | -170.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 27 | L | 51.9 | Low | 49.9 | Very low | 158 Ų | 158 | 134 Ų | 134 | 83% | 0.827 | 77% | 0.767 | S | S | * | * | trans | 72.6 | 121.9 | 170.9 | -43.1 | 177.2 | 0 | 0 | 0 | 113.9 | ||||
| 28 | K | 49.6 | Very low | 50.7 | Low | 190 Ų | 190 | 136.8 Ų | 136.8 | 83% | 0.826 | 77% | 0.77 | S | S | * | * | cis | -165.4 | 143.2 | 17.2 | 43.4 | -155.2 | 160.7 | -163.7 | 0 | 109.8 | R30 | K28-R30 PolarHBondContact O-N 3.19Š| ||
| 29 | S | 51 | Low | 51.4 | Low | 88 Ų | 88 | 138.9 Ų | 138.9 | 62% | 0.615 | 77% | 0.768 | S | S | * | * | trans | -52.8 | 114.5 | -169.6 | -172.9 | 0 | 0 | 0 | 0 | 113.7 | R31 | S29-R31 PolarHBondContact O-N 3.09Å; S29-R31 VanDerWaalsContact O-N 3.09Å; S29-R31 WeakPolarHBondContact OG-CG 3.41Å | ||
| 30 | R | 59.3 | Low | 51.3 | Low | 250 Ų | 250 | 137 Ų | 137 | 94% | 0.943 | 75% | 0.753 | S | S | * | * | trans | -78.2 | 78.2 | 158.6 | -65.2 | -163.9 | -160.3 | -80.3 | 4.8 | 109 | K28 | K28-R30 PolarHBondContact O-N 3.19Š| ||
| 31 | R | 58.7 | Low | 52.3 | Low | 187 Ų | 187 | 135.8 Ų | 135.8 | 71% | 0.706 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -131.6 | 147.1 | 165.7 | -70.4 | -176.5 | -176.1 | 178 | 2 | 108.9 | S29 S33 | S29-R31 PolarHBondContact O-N 3.09Å; S29-R31 VanDerWaalsContact O-N 3.09Å; S29-R31 WeakPolarHBondContact OG-CG 3.41Å; R31-S33 WeakPolarHBondContact CB-OG 3.46Å; R31-S33 PolarHBondContact O-N 3.26Å |
| 32 | P | 54.3 | Low | 53.1 | Low | 132 Ų | 132 | 132.3 Ų | 132.3 | 86% | 0.857 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -70.8 | 25.4 | 173.6 | 31.5 | -36.1 | 0 | 0 | 0 | 113.3 | ||
| 33 | S | 52.1 | Low | 54.1 | Low | 75 Ų | 75 | 133.7 Ų | 133.7 | 52% | 0.524 | 74% | 0.738 | S | S | . | * | trans | -98 | 24 | -176.1 | 64.2 | 0 | 0 | 0 | 0 | 113.2 | R31 W35 | R31-S33 WeakPolarHBondContact CB-OG 3.46Å; R31-S33 PolarHBondContact O-N 3.26Å; S33-W35 PolarHBondContact O-N 2.85Å | ||
| 34 | S | 58.7 | Low | 54.6 | Low | 113 Ų | 113 | 130.4 Ų | 130.4 | 79% | 0.79 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.1 | 18.9 | 174.6 | -168.3 | 0 | 0 | 0 | 0 | 113.2 | ||
| 35 | W | 61.3 | Low | 55.4 | Low | 232 Ų | 232 | 130.5 Ų | 130.5 | 88% | 0.879 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.6 | -1.2 | -173 | -77.7 | 82.7 | 0 | 0 | 0 | 114 | S33 | S33-W35 PolarHBondContact O-N 2.85Š|
| 36 | L | 60.4 | Low | 56.1 | Low | 122 Ų | 122 | 133.3 Ų | 133.3 | 64% | 0.639 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -116.4 | 130.5 | 174.3 | -62.1 | 178 | 0 | 0 | 0 | 109.6 | ||
| 37 | P | 57.4 | Low | 56 | Low | 79 Ų | 79 | 138.5 Ų | 138.5 | 51% | 0.513 | 74% | 0.744 | S | S | . | * | trans | -64.3 | 152.7 | 167.4 | 29.1 | -33.7 | 0 | 0 | 0 | 109.9 | T39 | P37-T39 PolarHBondContact O-N 3.33Š| ||
| 38 | P | 56.2 | Low | 55.9 | Low | 140 Ų | 140 | 143.1 Ų | 143.1 | 91% | 0.909 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.2 | 10.2 | -167 | 28 | -36.8 | 0 | 0 | 0 | 116 | ||
| 39 | T | 58.4 | Low | 55.2 | Low | 123 Ų | 123 | 137.4 Ų | 137.4 | 76% | 0.755 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.4 | -12.1 | -175 | 49.7 | 0 | 0 | 0 | 0 | 114.6 | P37 S41 | P37-T39 PolarHBondContact O-N 3.33Å; T39-S41 PolarHBondContact O-N 2.83Å |
| 40 | V | 57.2 | Low | 54.7 | Low | 93 Ų | 93 | 137.9 Ų | 137.9 | 56% | 0.564 | 76% | 0.755 | S | S | * | * | trans | -94.3 | 98.8 | -177.5 | -177.9 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 41 | S | 60.1 | Low | 54.6 | Low | 72 Ų | 72 | 131.9 Ų | 131.9 | 50% | 0.503 | 75% | 0.749 | S | S | . | * | trans | -108.4 | 119.7 | 168.4 | -176.5 | 0 | 0 | 0 | 0 | 110.5 | T39 L43 A44 | T39-S41 PolarHBondContact O-N 2.83Å; S41-L43 PolarHBondContact O-N 3.13Å; S41-L43 VanDerWaalsContact O-N 3.08Å; S41-A44 WeakPolarHBondContact O-CB 3.46Å; S41-A44 PolarHBondContact O-N 3.08Å; S41-A44 VanDerWaalsContact O-N 3.13Å | ||
| 42 | V | 55.8 | Low | 53.9 | Low | 121 Ų | 121 | 128.7 Ų | 128.7 | 73% | 0.733 | 75% | 0.752 | S | S | * | * | G | 310 helix | trans | -62.9 | -17.1 | -178.8 | -173 | 0 | 0 | 0 | 0 | 112.3 | A44 L45 | V42-A44 PolarHBondContact O-N 3.44Å; V42-L45 WeakPolarHBondContact O-CB 3.41Å; V42-L45 PolarHBondContact O-N 3.28Å |
| 43 | L | 56.3 | Low | 52.9 | Low | 152 Ų | 152 | 131.2 Ų | 131.2 | 80% | 0.796 | 75% | 0.752 | S | S | * | * | G | 310 helix | trans | -65.5 | -13.1 | 175.1 | -59.8 | 177.7 | 0 | 0 | 0 | 113.8 | S41 L45 | S41-L43 PolarHBondContact O-N 3.13Å; S41-L43 VanDerWaalsContact O-N 3.08Å; L43-L45 PolarHBondContact O-N 3.18Å |
| 44 | A | 54.3 | Low | 52.1 | Low | 89 Ų | 89 | 135.1 Ų | 135.1 | 74% | 0.736 | 76% | 0.764 | S | S | * | * | G | 310 helix | trans | -69.8 | -8.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | S41 V42 V46 | S41-A44 WeakPolarHBondContact O-CB 3.46Å; S41-A44 PolarHBondContact O-N 3.08Å; S41-A44 VanDerWaalsContact O-N 3.13Å; V42-A44 PolarHBondContact O-N 3.44Å; A44-V46 PolarHBondContact O-N 3.2Å |
| 45 | L | 58.5 | Low | 51.3 | Low | 158 Ų | 158 | 136 Ų | 136 | 83% | 0.827 | 77% | 0.767 | S | S | * | * | G | 310 helix | trans | -69.7 | -10.7 | -174.1 | -170.8 | 58.8 | 0 | 0 | 0 | 114.7 | V42 L43 | V42-L45 WeakPolarHBondContact O-CB 3.41Å; V42-L45 PolarHBondContact O-N 3.28Å; L43-L45 PolarHBondContact O-N 3.18Å |
| 46 | V | 56.4 | Low | 50.4 | Low | 135 Ų | 135 | 129 Ų | 129 | 82% | 0.818 | 75% | 0.753 | S | S | * | * | trans | -119 | 73 | -175.5 | 80.6 | 0 | 0 | 0 | 0 | 114.4 | A44 | A44-V46 PolarHBondContact O-N 3.2Š| ||
| 47 | K | 47.3 | Very low | 49.8 | Very low | 200 Ų | 200 | 128.1 Ų | 128.1 | 87% | 0.87 | 76% | 0.755 | S | S | * | * | trans | -144.1 | 104.7 | 151.5 | -156 | 174.1 | -177.7 | -176.7 | 0 | 111.8 | ||||
| 48 | R | 49.8 | Very low | 48.8 | Very low | 254 Ų | 254 | 133.2 Ų | 133.2 | 96% | 0.958 | 77% | 0.772 | S | S | * | * | trans | -63.8 | 138.6 | 169.9 | -73.6 | -173.2 | 170 | -146.2 | -1.1 | 110.1 | ||||
| 49 | G | 36.2 | Very low | 48 | Very low | 71 Ų | 71 | 134.5 Ų | 134.5 | 73% | 0.732 | 77% | 0.766 | S | S | * | * | trans | 163.5 | 77.8 | 166.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 50 | A | 40.8 | Very low | 47.6 | Very low | 97 Ų | 97 | 136.9 Ų | 136.9 | 80% | 0.802 | 77% | 0.773 | S | S | * | * | trans | 57.1 | 154 | 157.1 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 51 | P | 56.3 | Low | 47.1 | Very low | 125 Ų | 125 | 140.5 Ų | 140.5 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | trans | -91.2 | 146.9 | -166.5 | 35.5 | -34.6 | 0 | 0 | 0 | 113.6 | ||||
| 52 | P | 43.5 | Very low | 46.2 | Very low | 119 Ų | 119 | 141.3 Ų | 141.3 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | trans | -112.1 | 127.5 | 140.3 | 33.1 | -24.9 | 0 | 0 | 0 | 110.5 | ||||
| 53 | E | 33.6 | Very low | 45.5 | Very low | 186 Ų | 186 | 141.6 Ų | 141.6 | 87% | 0.869 | 80% | 0.802 | S | S | * | * | trans | 40.3 | 115.8 | 148.7 | -149.6 | 155.1 | 96.7 | 0 | 0 | 120.2 | P55 | E53-P55 VanDerWaalsContact O-CD 3.23Å; E53-P55 WeakPolarHBondContact O-CD 3.2Å | ||
| 54 | M | 36.6 | Very low | 45.6 | Very low | 157 Ų | 157 | 138 Ų | 138 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | trans | -92.1 | 117.4 | 175.9 | 178.9 | 172.7 | 69.2 | 0 | 0 | 111.2 | S56 | M54-S56 WeakPolarHBondContact CG-OG 3.23Å; M54-S56 PolarHBondContact SD-OG 3.41Å; M54-S56 VanDerWaalsContact SD-OG 3.41Å | ||
| 55 | P | 40.5 | Very low | 45.3 | Very low | 130 Ų | 130 | 138.3 Ų | 138.3 | 84% | 0.844 | 79% | 0.789 | S | S | * | * | trans | -95.8 | 95.3 | 149.5 | 32.8 | -29.2 | 0 | 0 | 0 | 109.5 | E53 | E53-P55 VanDerWaalsContact O-CD 3.23Å; E53-P55 WeakPolarHBondContact O-CD 3.2Å | ||
| 56 | S | 41.8 | Very low | 44.7 | Very low | 85 Ų | 85 | 142.8 Ų | 142.8 | 59% | 0.594 | 80% | 0.795 | S | S | * | * | trans | -114.7 | 152.3 | 161.4 | -63.3 | 0 | 0 | 0 | 0 | 107.6 | M54 | M54-S56 WeakPolarHBondContact CG-OG 3.23Å; M54-S56 PolarHBondContact SD-OG 3.41Å; M54-S56 VanDerWaalsContact SD-OG 3.41Å | ||
| 57 | P | 48.4 | Very low | 44.3 | Very low | 105 Ų | 105 | 142.1 Ų | 142.1 | 68% | 0.682 | 79% | 0.785 | S | S | * | * | cis | -130.2 | 154.9 | -4.4 | 39.5 | -25 | 0 | 0 | 0 | 114.1 | ||||
| 58 | Q | 37.8 | Very low | 44.2 | Very low | 185 Ų | 185 | 138.9 Ų | 138.9 | 86% | 0.864 | 78% | 0.781 | S | S | * | * | trans | 176 | 94.3 | 139.5 | 46.8 | -144.7 | -98.2 | 0 | 0 | 108 | ||||
| 59 | E | 39.4 | Very low | 44.2 | Very low | 168 Ų | 168 | 133.3 Ų | 133.3 | 79% | 0.785 | 77% | 0.766 | S | S | * | * | 62.9 | 83.6 | 85 | -160.2 | 164.1 | 108.2 | 0 | 0 | 109.8 | E61 | E59-E61 PolarHBondContact O-N 3.13Š| |||
| 60 | L | 48.4 | Very low | 45.2 | Very low | 173 Ų | 173 | 134 Ų | 134 | 91% | 0.906 | 76% | 0.757 | S | S | * | * | 59.4 | 11.6 | 94.3 | -148.5 | 88.7 | 0 | 0 | 0 | 115.6 | |||||
| 61 | E | 47.5 | Very low | 46.2 | Very low | 169 Ų | 169 | 136.2 Ų | 136.2 | 79% | 0.79 | 75% | 0.75 | S | S | * | * | trans | -131.5 | 65 | -177.5 | -160 | 85.8 | 108.6 | 0 | 0 | 113.3 | E59 | E59-E61 PolarHBondContact O-N 3.13Š| ||
| 62 | A | 41.5 | Very low | 47.6 | Very low | 89 Ų | 89 | 137.1 Ų | 137.1 | 74% | 0.736 | 74% | 0.737 | S | S | * | * | trans | -164.6 | 44.6 | 157.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | A64 | A62-A64 PolarHBondContact O-N 2.69Š| ||
| 63 | S | 41.4 | Very low | 49.9 | Very low | 126 Ų | 126 | 132.7 Ų | 132.7 | 88% | 0.881 | 71% | 0.71 | S | S | * | * | trans | -72.6 | 55.8 | 154 | -79.4 | 0 | 0 | 0 | 0 | 109.9 | P65 | S63-P65 VanDerWaalsContact O-CD 3.27Å; S63-P65 WeakPolarHBondContact O-CD 3.27Å | ||
| 64 | A | 56.8 | Low | 52.8 | Low | 78 Ų | 78 | 123.9 Ų | 123.9 | 65% | 0.645 | 67% | 0.669 | S | S | * | * | trans | -62.3 | 116.9 | 155.3 | 0 | 0 | 0 | 0 | 0 | 105.1 | A62 R66 | A62-A64 PolarHBondContact O-N 2.69Å; A64-R66 PolarHBondContact O-N 2.77Å | ||
| 65 | P | 49.3 | Very low | 55.6 | Low | 95 Ų | 95 | 122.8 Ų | 122.8 | 62% | 0.617 | 66% | 0.657 | S | S | * | * | trans | -56.5 | 122.5 | 170.3 | 24.9 | -32.1 | 0 | 0 | 0 | 105.6 | S63 M67 | S63-P65 VanDerWaalsContact O-CD 3.27Å; S63-P65 WeakPolarHBondContact O-CD 3.27Å; P65-M67 HydrophobicContact CB-CG 3.94Å; P65-M67 HydrophobicContact CG-CE 4.48Å; P65-M67 HydrophobicContact CG-CG 4Å; P65-M67 PolarHBondContact O-N 3.05Å | ||
| 66 | R | 45.3 | Very low | 58.2 | Low | 251 Ų | 251 | 116.6 Ų | 116.6 | 95% | 0.947 | 62% | 0.616 | S | S | * | * | trans | -71.4 | 59.7 | 167.1 | -165.5 | 174.1 | -177.6 | 170.2 | 0.6 | 107.4 | A64 V68 | A64-R66 PolarHBondContact O-N 2.77Å; R66-V68 PolarHBondContact O-N 2.7Å | ||
| 67 | M | 48.9 | Very low | 60.8 | Low | 121 Ų | 121 | 116.7 Ų | 116.7 | 60% | 0.596 | 61% | 0.61 | S | S | * | * | trans | -48.4 | 118.1 | 165.8 | -70.4 | -163.1 | -75.5 | 0 | 0 | 104.3 | P65 Q69 | P65-M67 HydrophobicContact CB-CG 3.94Å; P65-M67 HydrophobicContact CG-CE 4.48Å; P65-M67 HydrophobicContact CG-CG 4Å; P65-M67 PolarHBondContact O-N 3.05Å; M67-Q69 VanDerWaalsContact C-N 3.32Å; M67-Q69 PolarHBondContact O-N 2.99Å | ||
| 68 | V | 44.6 | Very low | 62.9 | Low | 132 Ų | 132 | 113.6 Ų | 113.6 | 80% | 0.8 | 59% | 0.59 | S | S | * | * | trans | -53.3 | 104.1 | 179 | -130 | 0 | 0 | 0 | 0 | 105.5 | R66 T70 | R66-V68 PolarHBondContact O-N 2.7Å; V68-T70 PolarHBondContact O-N 2.87Å | ||
| 69 | Q | 49.6 | Very low | 65.6 | Low | 137 Ų | 137 | 109.9 Ų | 109.9 | 64% | 0.64 | 58% | 0.576 | S | S | * | * | trans | -72.3 | 74.3 | 179.9 | -71.1 | -175.5 | 7.2 | 0 | 0 | 106.5 | M67 H71 | M67-Q69 VanDerWaalsContact C-N 3.32Å; M67-Q69 PolarHBondContact O-N 2.99Å; Q69-H71 VanDerWaalsContact C-N 3.3Å; Q69-H71 PolarHBondContact O-CD2 2.96Å; Q69-H71 PolarHBondContact O-N 3.39Å | ||
| 70 | T | 56.6 | Low | 68.1 | Low | 87 Ų | 87 | 103.5 Ų | 103.5 | 53% | 0.534 | 55% | 0.546 | S | S | . | . | trans | -51 | 107.9 | 151 | 44.6 | 0 | 0 | 0 | 0 | 104.5 | V68 R72 | V68-T70 PolarHBondContact O-N 2.87Å; T70-R72 PolarHBondContact O-N 3.17Å; T70-R72 PolarHBondContact OG1-NE 2.94Å; T70-R72 VanDerWaalsContact OG1-NE 3.13Å | ||
| 71 | H | 63.3 | Low | 70.2 | Confident | 142 Ų | 142 | 100.9 Ų | 100.9 | 66% | 0.657 | 54% | 0.538 | S | S | * | . | trans | -67.5 | 76.3 | 179.8 | -81.2 | -107 | 0 | 0 | 0 | 107.9 | Q69 A73 | Q69-H71 VanDerWaalsContact C-N 3.3Å; Q69-H71 PolarHBondContact O-CD2 2.96Å; Q69-H71 PolarHBondContact O-N 3.39Å; H71-A73 PolarHBondContact O-N 2.7Å | ||
| 72 | R | 84.3 | Confident | 72.2 | Confident | 144 Ų | 144 | 94.3 Ų | 94.3 | 54% | 0.543 | 51% | 0.513 | S | S | . | . | trans | -70.1 | 125.2 | 179.7 | -70.6 | 172.9 | -172.7 | -141.3 | -1.2 | 107.1 | T70 V98 L125 | T70-R72 PolarHBondContact O-N 3.17Å; T70-R72 PolarHBondContact OG1-NE 2.94Å; T70-R72 VanDerWaalsContact OG1-NE 3.13Å; R72-V98 HydrophobicContact CB-CB 4.3Å; R72-V98 HydrophobicContact CB-CG2 4.42Å; R72-V98 VanDerWaalsContact O-CB 3.25Å; R72-V98 WeakPolarHBondContact O-CB 3.43Å; R72-V98 WeakPolarHBondContact O-CG2 3.46Å; R72-V98 PolarHBondContact O-N 3.48Å; R72-L125 HydrophobicContact CB-CD2 4.43Å | ||
| 73 | A | 92.1 | Very high | 74.4 | Confident | 26 Ų | 26 | 94.4 Ų | 94.4 | 22% | 0.215 | 51% | 0.513 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.6 | 147.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | H71 V95 L96 V126 | H71-A73 PolarHBondContact O-N 2.7Å; A73-V95 HydrophobicContact CB-CG1 3.73Å; A73-L96 WeakPolarHBondContact CA-O 3.23Å; A73-V126 HydrophobicContact CB-CB 4.11Å; A73-V126 PolarHBondContact O-N 3.16Å |
| 74 | V | 94.1 | Very high | 76.8 | Confident | 1 Ų | 1 | 94.5 Ų | 94.5 | 1% | 0.006 | 50% | 0.495 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 141.5 | 171 | -69.1 | 0 | 0 | 0 | 0 | 109.6 | V95 L96 V98 L107 T123 S124 L125 | V74-V95 CarbonylContact O-C 3.56Å; V74-V95 WeakPolarHBondContact O-CA 3.23Å; V74-L96 HydrophobicContact CG2-CB 4.06Å; V74-L96 PolarHBondContact N-O 3.47Å; V74-L96 PolarHBondContact O-N 2.87Å; V74-V98 HydrophobicContact CB-CG2 4.29Å; V74-V98 HydrophobicContact CG1-CG2 3.6Å; V74-V98 HydrophobicContact CG2-CG2 3.88Å; V74-L107 HydrophobicContact CG1-CD1 3.98Å; V74-L107 HydrophobicContact CG2-CD1 4.37Å; V74-T123 HydrophobicContact CB-CG2 4.47Å; V74-T123 HydrophobicContact CG2-CG2 4.13Å; V74-S124 CarbonylContact C-O 3.46Å; V74-S124 VanDerWaalsContact CA-O 3.23Å; V74-S124 WeakPolarHBondContact CA-O 3.17Å; V74-L125 HydrophobicContact CG1-CD2 3.8Å; V74-L125 HydrophobicContact CG1-CG 4.39Å |
| 75 | R | 95.4 | Very high | 78.2 | Confident | 134 Ų | 134 | 97.5 Ų | 97.5 | 51% | 0.506 | 51% | 0.507 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.4 | 128.7 | 173.6 | -159.6 | 178.6 | 86.3 | -167.3 | 6.2 | 109.8 | G93 E94 V95 T123 S124 V126 | R75-G93 VanDerWaalsContact CG-O 3.32Å; R75-G93 WeakPolarHBondContact CG-O 3.44Å; R75-E94 CarbonylContact C-O 3.53Å; R75-E94 VanDerWaalsContact CA-O 3.29Å; R75-E94 WeakPolarHBondContact CA-O 3.46Å; R75-E94 WeakPolarHBondContact CG-O 3.38Å; R75-V95 HydrophobicContact CG-CG2 4.25Å; R75-T123 CarbonylContact O-C 3.48Å; R75-T123 WeakPolarHBondContact O-CA 3.24Å; R75-S124 PolarHBondContact N-O 3.46Å; R75-S124 PolarHBondContact O-N 2.77Å; R75-V126 HydrophobicContact CB-CG2 3.81Å |
| 76 | A | 95.5 | Very high | 80.2 | Confident | 0 Ų | 0 | 96.3 Ų | 96.3 | 0% | 0 | 50% | 0.496 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -63.6 | 133.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | F90 R91 G93 E94 | A76-F90 HydrophobicContact CB-CD2 3.43Å; A76-F90 VanDerWaalsContact CB-CD2 3.43Å; A76-F90 HydrophobicContact CB-CE2 3.87Å; A76-F90 HydrophobicContact CB-CG 4.28Å; A76-R91 WeakPolarHBondContact CB-O 3.25Å; A76-G93 PolarHBondContact O-N 3.07Å; A76-E94 HydrophobicContact CB-CB 4.41Å; A76-E94 PolarHBondContact N-O 2.87Å |
| 77 | L | 95.5 | Very high | 82.4 | Confident | 88 Ų | 88 | 85.5 Ų | 85.5 | 46% | 0.461 | 46% | 0.456 | S | S | . | . | S | Bend | trans | -91.1 | -24 | 178.5 | -61 | 177.1 | 0 | 0 | 0 | 112.3 | R92 Y122 | L77-R92 WeakPolarHBondContact O-CD 3.4Å; L77-R92 WeakPolarHBondContact O-CG 3.14Å; L77-Y122 WeakPolarHBondContact CB-O 3.49Å; L77-Y122 PolarHBondContact N-O 3.39Å |
| 78 | C | 93.9 | Very high | 84.5 | Confident | 40 Ų | 40 | 79.9 Ų | 79.9 | 27% | 0.27 | 43% | 0.428 | S | S | . | . | S | Bend | trans | -137.1 | 169.7 | -179.1 | 57 | 0 | 0 | 0 | 0 | 111.3 | R91 R92 Y122 | C78-R91 CarbonylContact O-C 3.56Å; C78-R92 WeakPolarHBondContact O-CA 3.23Å; C78-R92 PolarHBondContact O-N 2.82Å; C78-Y122 VanDerWaalsContact SG-CD2 3.55Å |
| 79 | D | 94.4 | Very high | 86.9 | Confident | 106 Ų | 106 | 75.8 Ų | 75.8 | 57% | 0.567 | 41% | 0.405 | S | S | * | . | trans | -83.6 | 133.6 | 167.7 | -55.1 | -77.1 | 0 | 0 | 0 | 109.7 | R91 R92 | D79-R91 WeakPolarHBondContact OD1-CA 3.32Å; D79-R91 VanDerWaalsContact OD1-CB 3.27Å; D79-R91 WeakPolarHBondContact OD1-CB 3.48Å; D79-R92 PolarHBondContact OD1-N 2.96Å | ||
| 80 | H | 91.9 | Very high | 88.9 | Confident | 34 Ų | 34 | 69.5 Ų | 69.5 | 16% | 0.157 | 38% | 0.376 | C | S | . | . | B | Isolated β-bridge | trans | -136.4 | 127.7 | -179.8 | -178.3 | 66.1 | 0 | 0 | 0 | 111.2 | Q87 S89 F90 | H80-Q87 PolarHBondContact NE2-OE1 2.92Å; H80-S89 CarbonylContact O-C 3.49Å; H80-S89 WeakPolarHBondContact O-CA 3.32Å; H80-F90 HydrophobicContact CB-CD1 4.2Å; H80-F90 HydrophobicContact CB-CD2 3.91Å; H80-F90 HydrophobicContact CB-CE1 3.74Å; H80-F90 HydrophobicContact CB-CE2 3.45Å; H80-F90 VanDerWaalsContact CB-CE2 3.45Å; H80-F90 HydrophobicContact CB-CG 4.28Å; H80-F90 HydrophobicContact CB-CZ 3.36Å; H80-F90 AromaticContact CD2-CE1 3.74Å; H80-F90 AromaticContact CG-CZ 3.89Å; H80-F90 PolarHBondContact N-O 3.31Å; H80-F90 PolarHBondContact O-N 2.77Å; H80-F90 VanDerWaalsContact O-O 3.04Å |
| 81 | T | 93.1 | Very high | 90.8 | Very high | 118 Ų | 118 | 74.1 Ų | 74.1 | 72% | 0.724 | 38% | 0.384 | S | S | * | . | trans | -101.4 | 124.1 | 171.5 | -57.3 | 0 | 0 | 0 | 0 | 108.3 | A83 | T81-A83 PolarHBondContact O-N 2.93Å; T81-A83 VanDerWaalsContact O-N 3.16Å | ||
| 82 | A | 89.8 | Confident | 92.3 | Very high | 32 Ų | 32 | 76.3 Ų | 76.3 | 26% | 0.264 | 39% | 0.386 | S | S | . | . | trans | -57 | 118.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q87 S89 | A82-Q87 HydrophobicContact CB-CB 3.8Å; A82-Q87 WeakPolarHBondContact CB-O 3.29Å; A82-S89 VanDerWaalsContact CB-OG 3.24Å; A82-S89 WeakPolarHBondContact CB-OG 3.42Å; A82-S89 PolarHBondContact N-OG 2.83Å | ||
| 83 | A | 87.5 | Confident | 92.8 | Very high | 91 Ų | 91 | 71.2 Ų | 71.2 | 75% | 0.752 | 38% | 0.378 | S | S | * | . | S | Bend | trans | -88.4 | -15.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | T81 | T81-A83 PolarHBondContact O-N 2.93Å; T81-A83 VanDerWaalsContact O-N 3.16Å |
| 84 | R | 90.1 | Very high | 92.9 | Very high | 128 Ų | 128 | 73.4 Ų | 73.4 | 48% | 0.483 | 38% | 0.384 | S | S | . | . | S | Bend | trans | -127.9 | 150.1 | 177.6 | -66.5 | -171 | -68.2 | 152.7 | -2.5 | 109.4 | D86 Q87 | R84-D86 PolarHBondContact O-N 2.87Å; R84-Q87 HydrophobicContact CB-CG 4.38Å; R84-Q87 PolarHBondContact O-N 3.35Å |
| 85 | P | 87.1 | Confident | 92.9 | Very high | 140 Ų | 140 | 77.2 Ų | 77.2 | 91% | 0.909 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.6 | -21.5 | -179.1 | 26.1 | -35.7 | 0 | 0 | 0 | 114 | ||
| 86 | D | 91.3 | Very high | 92.9 | Very high | 71 Ų | 71 | 70.9 Ų | 70.9 | 38% | 0.38 | 38% | 0.383 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.5 | 3.2 | 176.2 | -169.1 | 47.3 | 0 | 0 | 0 | 112.9 | R84 R108 G116 L117 | R84-D86 PolarHBondContact O-N 2.87Å; D86-R108 IonicContact OD1-NH1 3.86Å; D86-G116 CarbonylContact O-C 3.52Å; D86-G116 WeakPolarHBondContact O-CA 3.43Å; D86-L117 WeakPolarHBondContact O-CB 3.17Å; D86-L117 PolarHBondContact O-N 3.12Å; D86-L117 WeakPolarHBondContact OD2-CD1 3.27Å |
| 87 | Q | 92.4 | Very high | 92.8 | Very high | 23 Ų | 23 | 77.2 Ų | 77.2 | 11% | 0.107 | 41% | 0.407 | C | S | . | . | B | Isolated β-bridge | trans | -99.4 | 147.5 | 173.8 | -76.3 | -178 | -17.8 | 0 | 0 | 111.8 | H80 A82 R84 W106 L117 | H80-Q87 PolarHBondContact NE2-OE1 2.92Å; A82-Q87 HydrophobicContact CB-CB 3.8Å; A82-Q87 WeakPolarHBondContact CB-O 3.29Å; R84-Q87 HydrophobicContact CB-CG 4.38Å; R84-Q87 PolarHBondContact O-N 3.35Å; Q87-W106 VanDerWaalsContact NE2-CH2 3.34Å; Q87-L117 WeakPolarHBondContact CA-O 3.44Å; Q87-L117 HydrophobicContact CG-CB 4.5Å |
| 88 | L | 92.6 | Very high | 92.6 | Very high | 3 Ų | 3 | 74 Ų | 74 | 2% | 0.016 | 39% | 0.391 | C | S | . | . | P | Polyproline II helix | trans | -92.7 | 128.9 | 175.7 | -169.2 | 66.7 | 0 | 0 | 0 | 110.7 | F90 L96 C109 R111 M114 L117 V118 | L88-F90 WeakPolarHBondContact O-CD1 3.29Å; L88-L96 HydrophobicContact CD2-CD1 4.43Å; L88-L96 HydrophobicContact CD2-CD2 4.14Å; L88-C109 HydrophobicContact CD2-CB 4.09Å; L88-R111 HydrophobicContact CD2-CB 4.32Å; L88-M114 HydrophobicContact CD1-CB 3.87Å; L88-L117 PolarHBondContact N-O 3.1Å; L88-L117 VanDerWaalsContact N-O 3.1Å; L88-V118 HydrophobicContact CB-CG2 3.83Å; L88-V118 HydrophobicContact CD2-CG2 4.17Å |
| 89 | S | 93.5 | Very high | 92.5 | Very high | 46 Ų | 46 | 75 Ų | 75 | 32% | 0.322 | 39% | 0.393 | S | S | . | . | P | Polyproline II helix | trans | -81.5 | 128.3 | 171.7 | -64.5 | 0 | 0 | 0 | 0 | 111 | H80 A82 R111 | H80-S89 CarbonylContact O-C 3.49Å; H80-S89 WeakPolarHBondContact O-CA 3.32Å; A82-S89 VanDerWaalsContact CB-OG 3.24Å; A82-S89 WeakPolarHBondContact CB-OG 3.42Å; A82-S89 PolarHBondContact N-OG 2.83Å; S89-R111 PolarHBondContact O-NH1 2.86Å; S89-R111 PolarHBondContact O-NH2 3.47Å |
| 90 | F | 93.4 | Very high | 92.4 | Very high | 5 Ų | 5 | 72.4 Ų | 72.4 | 2% | 0.022 | 38% | 0.381 | C | S | . | . | B | Isolated β-bridge | trans | -142.2 | 164.4 | -178.5 | 54.3 | -97.7 | 0 | 0 | 0 | 112.2 | A76 H80 L88 L96 V118 Y122 | A76-F90 HydrophobicContact CB-CD2 3.43Å; A76-F90 VanDerWaalsContact CB-CD2 3.43Å; A76-F90 HydrophobicContact CB-CE2 3.87Å; A76-F90 HydrophobicContact CB-CG 4.28Å; H80-F90 HydrophobicContact CB-CD1 4.2Å; H80-F90 HydrophobicContact CB-CD2 3.91Å; H80-F90 HydrophobicContact CB-CE1 3.74Å; H80-F90 HydrophobicContact CB-CE2 3.45Å; H80-F90 VanDerWaalsContact CB-CE2 3.45Å; H80-F90 HydrophobicContact CB-CG 4.28Å; H80-F90 HydrophobicContact CB-CZ 3.36Å; H80-F90 AromaticContact CD2-CE1 3.74Å; H80-F90 AromaticContact CG-CZ 3.89Å; H80-F90 PolarHBondContact N-O 3.31Å; H80-F90 PolarHBondContact O-N 2.77Å; H80-F90 VanDerWaalsContact O-O 3.04Å; L88-F90 WeakPolarHBondContact O-CD1 3.29Å; F90-L96 HydrophobicContact CB-CD1 3.97Å; F90-L96 HydrophobicContact CB-CD2 4.14Å; F90-L96 HydrophobicContact CD1-CD1 3.86Å; F90-L96 HydrophobicContact CG-CD1 3.9Å; F90-V118 HydrophobicContact CD1-CG1 4.36Å; F90-V118 HydrophobicContact CD1-CG2 4.08Å; F90-V118 HydrophobicContact CE1-CB 4.22Å; F90-V118 HydrophobicContact CE1-CG1 3.61Å; F90-V118 HydrophobicContact CE1-CG2 3.86Å; F90-V118 HydrophobicContact CZ-CG1 3.93Å; F90-Y122 HydrophobicContact CZ-CD2 4.29Å |
| 91 | R | 95.4 | Very high | 92.3 | Very high | 185 Ų | 185 | 74.9 Ų | 74.9 | 70% | 0.698 | 40% | 0.399 | S | S | * | . | trans | -113.2 | 156.2 | 176.4 | -70.2 | -172.6 | -179.7 | -175.9 | 1 | 110.9 | A76 C78 D79 G93 E94 | A76-R91 WeakPolarHBondContact CB-O 3.25Å; C78-R91 CarbonylContact O-C 3.56Å; D79-R91 WeakPolarHBondContact OD1-CA 3.32Å; D79-R91 VanDerWaalsContact OD1-CB 3.27Å; D79-R91 WeakPolarHBondContact OD1-CB 3.48Å; R91-G93 PolarHBondContact O-N 3.09Å; R91-E94 HydrophobicContact CB-CG 3.81Å; R91-E94 WeakPolarHBondContact O-CB 3.41Å; R91-E94 WeakPolarHBondContact O-CG 3.36Å; R91-E94 PolarHBondContact O-N 2.91Å; R91-E94 VanDerWaalsContact O-N 3.11Å | ||
| 92 | R | 95.8 | Very high | 92.2 | Very high | 188 Ų | 188 | 73.1 Ų | 73.1 | 71% | 0.709 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.1 | 130 | 175.8 | 171.4 | 175.2 | 150.9 | 172.4 | -5.2 | 110.2 | L77 C78 D79 E94 | L77-R92 WeakPolarHBondContact O-CD 3.4Å; L77-R92 WeakPolarHBondContact O-CG 3.14Å; C78-R92 WeakPolarHBondContact O-CA 3.23Å; C78-R92 PolarHBondContact O-N 2.82Å; D79-R92 PolarHBondContact OD1-N 2.96Å; R92-E94 VanDerWaalsContact C-N 3.34Å |
| 93 | G | 94.9 | Very high | 92.3 | Very high | 36 Ų | 36 | 74.8 Ų | 74.8 | 37% | 0.371 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 89.6 | -12.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | R75 A76 R91 | R75-G93 VanDerWaalsContact CG-O 3.32Å; R75-G93 WeakPolarHBondContact CG-O 3.44Å; A76-G93 PolarHBondContact O-N 3.07Å; R91-G93 PolarHBondContact O-N 3.09Å |
| 94 | E | 94.3 | Very high | 92.5 | Very high | 72 Ų | 72 | 79.2 Ų | 79.2 | 34% | 0.336 | 40% | 0.398 | S | S | . | . | trans | -59.8 | 142.5 | 173.5 | -70.4 | -85.3 | 90 | 0 | 0 | 111.2 | R75 A76 R91 R92 L96 R111 | R75-E94 CarbonylContact C-O 3.53Å; R75-E94 VanDerWaalsContact CA-O 3.29Å; R75-E94 WeakPolarHBondContact CA-O 3.46Å; R75-E94 WeakPolarHBondContact CG-O 3.38Å; A76-E94 HydrophobicContact CB-CB 4.41Å; A76-E94 PolarHBondContact N-O 2.87Å; R91-E94 HydrophobicContact CB-CG 3.81Å; R91-E94 WeakPolarHBondContact O-CB 3.41Å; R91-E94 WeakPolarHBondContact O-CG 3.36Å; R91-E94 PolarHBondContact O-N 2.91Å; R91-E94 VanDerWaalsContact O-N 3.11Å; R92-E94 VanDerWaalsContact C-N 3.34Å; E94-L96 HydrophobicContact CB-CD2 4.43Å; E94-R111 WeakPolarHBondContact OE2-CD 3.27Å; E94-R111 IonicContact OE2-CZ 3.67Å; E94-R111 IonicContact OE2-NE 3.85Å; E94-R111 IonicContact OE2-NH1 2.74Å; E94-R111 PolarHBondContact OE2-NH1 2.9Å | ||
| 95 | V | 93.8 | Very high | 92.7 | Very high | 82 Ų | 82 | 78.7 Ų | 78.7 | 50% | 0.497 | 40% | 0.404 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.3 | 120.2 | 173.6 | -178.9 | 0 | 0 | 0 | 0 | 109.1 | A73 V74 R75 | A73-V95 HydrophobicContact CB-CG1 3.73Å; V74-V95 CarbonylContact O-C 3.56Å; V74-V95 WeakPolarHBondContact O-CA 3.23Å; R75-V95 HydrophobicContact CG-CG2 4.25Å |
| 96 | L | 93.9 | Very high | 92.9 | Very high | 0 Ų | 0 | 75.1 Ų | 75.1 | 0% | 0 | 37% | 0.372 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.7 | 137.6 | -177.7 | -50.3 | 173 | 0 | 0 | 0 | 109 | A73 V74 L88 F90 E94 C109 R111 V118 | A73-L96 WeakPolarHBondContact CA-O 3.23Å; V74-L96 HydrophobicContact CG2-CB 4.06Å; V74-L96 PolarHBondContact N-O 3.47Å; V74-L96 PolarHBondContact O-N 2.87Å; L88-L96 HydrophobicContact CD2-CD1 4.43Å; L88-L96 HydrophobicContact CD2-CD2 4.14Å; F90-L96 HydrophobicContact CB-CD1 3.97Å; F90-L96 HydrophobicContact CB-CD2 4.14Å; F90-L96 HydrophobicContact CD1-CD1 3.86Å; F90-L96 HydrophobicContact CG-CD1 3.9Å; E94-L96 HydrophobicContact CB-CD2 4.43Å; L96-C109 HydrophobicContact CB-CB 4.13Å; L96-R111 HydrophobicContact CD2-CB 3.94Å; L96-R111 HydrophobicContact CD2-CG 4.23Å; L96-V118 HydrophobicContact CD1-CG1 4.3Å; L96-V118 HydrophobicContact CD1-CG2 4.09Å |
| 97 | R | 93.5 | Very high | 93 | Very high | 133 Ų | 133 | 72.4 Ų | 72.4 | 50% | 0.502 | 36% | 0.358 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.7 | 119.8 | 176.4 | 179.9 | 175.6 | 66.1 | -125.1 | 3.1 | 109.2 | I99 C109 G110 | R97-I99 PolarHBondContact O-N 3.36Å; R97-C109 CarbonylContact O-C 3.57Å; R97-C109 VanDerWaalsContact O-CA 3.23Å; R97-C109 WeakPolarHBondContact O-CA 3.5Å; R97-G110 PolarHBondContact N-O 2.81Å; R97-G110 PolarHBondContact O-N 2.78Å |
| 98 | V | 92.8 | Very high | 93.1 | Very high | 21 Ų | 21 | 74.8 Ų | 74.8 | 13% | 0.127 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.9 | 126.9 | 171.3 | -174.7 | 0 | 0 | 0 | 0 | 108.6 | R72 V74 L107 | R72-V98 HydrophobicContact CB-CB 4.3Å; R72-V98 HydrophobicContact CB-CG2 4.42Å; R72-V98 VanDerWaalsContact O-CB 3.25Å; R72-V98 WeakPolarHBondContact O-CB 3.43Å; R72-V98 WeakPolarHBondContact O-CG2 3.46Å; R72-V98 PolarHBondContact O-N 3.48Å; V74-V98 HydrophobicContact CB-CG2 4.29Å; V74-V98 HydrophobicContact CG1-CG2 3.6Å; V74-V98 HydrophobicContact CG2-CG2 3.88Å; V98-L107 HydrophobicContact CG1-CD2 4.42Å; V98-L107 HydrophobicContact CG2-CD1 4.23Å |
| 99 | I | 91.9 | Very high | 93.2 | Very high | 61 Ų | 61 | 74.6 Ų | 74.6 | 31% | 0.313 | 37% | 0.365 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.6 | -49.6 | 176 | -57.8 | 169.4 | 0 | 0 | 0 | 108.8 | R97 R108 E115 | R97-I99 PolarHBondContact O-N 3.36Å; I99-R108 WeakPolarHBondContact CB-O 3.46Å; I99-R108 PolarHBondContact N-O 2.81Å; I99-E115 HydrophobicContact CD1-CB 3.95Å |
| 100 | T | 90.6 | Very high | 93.1 | Very high | 52 Ų | 52 | 72.6 Ų | 72.6 | 32% | 0.319 | 35% | 0.351 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.8 | 152.6 | 170.8 | -170.7 | 0 | 0 | 0 | 0 | 110.3 | R108 | T100-R108 HydrophobicContact CG2-CB 3.82Å; T100-R108 PolarHBondContact N-O 3.46Å; T100-R108 PolarHBondContact O-N 3.07Å |
| 101 | T | 91.4 | Very high | 92.9 | Very high | 86 Ų | 86 | 74.8 Ų | 74.8 | 53% | 0.528 | 36% | 0.36 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.6 | 135.3 | 157.9 | -58.6 | 0 | 0 | 0 | 0 | 107.4 | D103 L107 | T101-D103 WeakPolarHBondContact CG2-O 3.21Å; T101-L107 HydrophobicContact CG2-CD2 4.09Å |
| 102 | V | 90.8 | Very high | 92.6 | Very high | 81 Ų | 81 | 73.2 Ų | 73.2 | 49% | 0.491 | 37% | 0.365 | S | S | . | . | trans | -93.3 | -47.7 | 175.6 | -177.2 | 0 | 0 | 0 | 0 | 109.1 | W106 R108 L117 | V102-W106 HydrophobicContact CB-CB 4.29Å; V102-W106 WeakPolarHBondContact CB-O 3.21Å; V102-W106 PolarHBondContact N-O 2.88Å; V102-R108 HydrophobicContact CG2-CB 4.07Å; V102-L117 HydrophobicContact CG2-CD2 3.79Å | ||
| 103 | D | 91.8 | Very high | 92.1 | Very high | 66 Ų | 66 | 68.2 Ų | 68.2 | 35% | 0.353 | 37% | 0.372 | S | S | . | . | S | Bend | trans | -158.1 | -167.7 | -179.6 | 55.4 | -108.7 | 0 | 0 | 0 | 109.7 | T101 D105 W106 | T101-D103 WeakPolarHBondContact CG2-O 3.21Å; D103-D105 VanDerWaalsContact C-N 3.3Å; D103-D105 PolarHBondContact O-N 2.87Å; D103-D105 WeakPolarHBondContact OD2-CA 3.14Å; D103-D105 PolarHBondContact OD2-N 2.83Å; D103-W106 PolarHBondContact N-O 2.82Å; D103-W106 PolarHBondContact OD2-N 2.84Å |
| 104 | E | 91.4 | Very high | 91.8 | Very high | 185 Ų | 185 | 72.1 Ų | 72.1 | 86% | 0.864 | 38% | 0.382 | S | S | * | . | S | Bend | trans | -71.2 | -22.4 | -177.9 | -60.8 | -174.4 | 105.3 | 0 | 0 | 113.6 | V120 | E104-V120 WeakPolarHBondContact O-CG2 3.35Š|
| 105 | D | 93.4 | Very high | 91.7 | Very high | 116 Ų | 116 | 73.7 Ų | 73.7 | 62% | 0.62 | 39% | 0.389 | S | S | * | . | S | Bend | trans | -101.3 | -25.6 | -179.7 | -75.3 | -56.7 | 0 | 0 | 0 | 112.9 | D103 P119 V120 | D103-D105 VanDerWaalsContact C-N 3.3Å; D103-D105 PolarHBondContact O-N 2.87Å; D103-D105 WeakPolarHBondContact OD2-CA 3.14Å; D103-D105 PolarHBondContact OD2-N 2.83Å; D105-P119 CarbonylContact O-C 3.57Å; D105-P119 VanDerWaalsContact O-CA 3.29Å; D105-P119 WeakPolarHBondContact O-CA 3.17Å; D105-V120 PolarHBondContact O-N 3.3Å |
| 106 | W | 92.8 | Very high | 91.8 | Very high | 65 Ų | 65 | 69.8 Ų | 69.8 | 25% | 0.246 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.4 | 131.4 | -171.1 | -59.7 | 94.6 | 0 | 0 | 0 | 115.5 | Q87 V102 D103 L117 P119 | Q87-W106 VanDerWaalsContact NE2-CH2 3.34Å; V102-W106 HydrophobicContact CB-CB 4.29Å; V102-W106 WeakPolarHBondContact CB-O 3.21Å; V102-W106 PolarHBondContact N-O 2.88Å; D103-W106 PolarHBondContact N-O 2.82Å; D103-W106 PolarHBondContact OD2-N 2.84Å; W106-L117 HydrophobicContact CE3-CB 3.83Å; W106-L117 HydrophobicContact CZ3-CB 4.33Å; W106-P119 HydrophobicContact CE3-CG 4.3Å; W106-P119 HydrophobicContact CH2-CG 4.03Å; W106-P119 HydrophobicContact CZ3-CB 4.39Å; W106-P119 HydrophobicContact CZ3-CG 3.66Å |
| 107 | L | 93.6 | Very high | 91.8 | Very high | 14 Ų | 14 | 70.8 Ų | 70.8 | 7% | 0.073 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.3 | 137 | 167.7 | -56.8 | 176.3 | 0 | 0 | 0 | 109.7 | V74 V98 T101 L117 V118 V120 | V74-L107 HydrophobicContact CG1-CD1 3.98Å; V74-L107 HydrophobicContact CG2-CD1 4.37Å; V98-L107 HydrophobicContact CG1-CD2 4.42Å; V98-L107 HydrophobicContact CG2-CD1 4.23Å; T101-L107 HydrophobicContact CG2-CD2 4.09Å; L107-L117 CarbonylContact O-C 3.55Å; L107-L117 WeakPolarHBondContact O-CA 3.34Å; L107-V118 PolarHBondContact N-O 2.75Å; L107-V118 PolarHBondContact O-N 2.88Å; L107-V120 HydrophobicContact CD1-CG2 4.28Å; L107-V120 HydrophobicContact CD2-CG2 3.86Å; L107-V120 HydrophobicContact CG-CG2 3.66Å |
| 108 | R | 94.4 | Very high | 91.9 | Very high | 73 Ų | 73 | 64.4 Ų | 64.4 | 28% | 0.275 | 35% | 0.347 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.7 | 113.3 | 163 | -166.1 | 176.7 | -176.6 | 98.9 | -4.5 | 107.8 | D86 I99 T100 V102 E115 L117 | D86-R108 IonicContact OD1-NH1 3.86Å; I99-R108 WeakPolarHBondContact CB-O 3.46Å; I99-R108 PolarHBondContact N-O 2.81Å; T100-R108 HydrophobicContact CG2-CB 3.82Å; T100-R108 PolarHBondContact N-O 3.46Å; T100-R108 PolarHBondContact O-N 3.07Å; V102-R108 HydrophobicContact CG2-CB 4.07Å; R108-E115 IonicContact CZ-OE2 3.21Å; R108-E115 IonicContact NE-OE2 2.77Å; R108-E115 PolarHBondContact NE-OE2 2.95Å; R108-E115 IonicContact NH2-OE1 3.13Å; R108-E115 PolarHBondContact NH2-OE1 2.86Å; R108-E115 VanDerWaalsContact NH2-OE1 3.13Å; R108-E115 IonicContact NH2-OE2 2.86Å; R108-E115 PolarHBondContact NH2-OE2 3.13Å; R108-L117 HydrophobicContact CB-CD2 4.34Å |
| 109 | C | 94.1 | Very high | 91.9 | Very high | 0 Ų | 0 | 64.4 Ų | 64.4 | 0% | 0 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.8 | 155.9 | -176.9 | -70.5 | 0 | 0 | 0 | 0 | 111.4 | L88 L96 R97 E115 G116 V118 | L88-C109 HydrophobicContact CD2-CB 4.09Å; L96-C109 HydrophobicContact CB-CB 4.13Å; R97-C109 CarbonylContact O-C 3.57Å; R97-C109 VanDerWaalsContact O-CA 3.23Å; R97-C109 WeakPolarHBondContact O-CA 3.5Å; C109-E115 CarbonylContact O-C 3.59Å; C109-E115 VanDerWaalsContact O-CA 3.27Å; C109-E115 WeakPolarHBondContact O-CA 3.19Å; C109-G116 PolarHBondContact N-O 2.9Å; C109-G116 PolarHBondContact O-N 2.77Å; C109-V118 HydrophobicContact CB-CB 4.37Å; C109-V118 HydrophobicContact CB-CG2 3.75Å |
| 110 | G | 92 | Very high | 91.9 | Very high | 3 Ų | 3 | 64 Ų | 64 | 3% | 0.031 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.2 | 142.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | R97 M114 | R97-G110 PolarHBondContact N-O 2.81Å; R97-G110 PolarHBondContact O-N 2.78Å; G110-M114 CarbonylContact C-O 3.57Å; G110-M114 VanDerWaalsContact CA-O 3.23Å; G110-M114 WeakPolarHBondContact CA-O 3.39Å |
| 111 | R | 89.2 | Confident | 92.1 | Very high | 52 Ų | 52 | 64.7 Ų | 64.7 | 20% | 0.196 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.3 | 128 | 173.7 | -171.9 | -166 | 62.6 | -163.2 | -14.1 | 109.3 | L88 S89 E94 L96 G113 M114 | L88-R111 HydrophobicContact CD2-CB 4.32Å; S89-R111 PolarHBondContact O-NH1 2.86Å; S89-R111 PolarHBondContact O-NH2 3.47Å; E94-R111 WeakPolarHBondContact OE2-CD 3.27Å; E94-R111 IonicContact OE2-CZ 3.67Å; E94-R111 IonicContact OE2-NE 3.85Å; E94-R111 IonicContact OE2-NH1 2.74Å; E94-R111 PolarHBondContact OE2-NH1 2.9Å; L96-R111 HydrophobicContact CD2-CB 3.94Å; L96-R111 HydrophobicContact CD2-CG 4.23Å; R111-G113 VanDerWaalsContact C-N 3.25Å; R111-G113 PolarHBondContact O-N 3.33Å; R111-G113 VanDerWaalsContact O-N 3.12Å; R111-M114 PolarHBondContact N-O 2.87Å; R111-M114 WeakPolarHBondContact O-CA 3.48Å; R111-M114 WeakPolarHBondContact O-CB 3.43Å; R111-M114 PolarHBondContact O-N 3.11Å |
| 112 | D | 87.1 | Confident | 92.2 | Very high | 152 Ų | 152 | 65.9 Ų | 65.9 | 81% | 0.813 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48 | 39.9 | 175.8 | -62.2 | -60.3 | 0 | 0 | 0 | 115.6 | M114 | D112-M114 PolarHBondContact O-N 2.74Š|
| 113 | G | 86.1 | Confident | 92.3 | Very high | 82 Ų | 82 | 62.8 Ų | 62.8 | 85% | 0.845 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 81.3 | -9.9 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | R111 | R111-G113 VanDerWaalsContact C-N 3.25Å; R111-G113 PolarHBondContact O-N 3.33Å; R111-G113 VanDerWaalsContact O-N 3.12Å |
| 114 | M | 89.1 | Confident | 92.4 | Very high | 119 Ų | 119 | 62.6 Ų | 62.6 | 59% | 0.586 | 35% | 0.345 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -81.9 | 143.6 | 165.9 | -54.1 | -177.3 | 75.7 | 0 | 0 | 109.8 | L88 G110 R111 D112 | L88-M114 HydrophobicContact CD1-CB 3.87Å; G110-M114 CarbonylContact C-O 3.57Å; G110-M114 VanDerWaalsContact CA-O 3.23Å; G110-M114 WeakPolarHBondContact CA-O 3.39Å; R111-M114 PolarHBondContact N-O 2.87Å; R111-M114 WeakPolarHBondContact O-CA 3.48Å; R111-M114 WeakPolarHBondContact O-CB 3.43Å; R111-M114 PolarHBondContact O-N 3.11Å; D112-M114 PolarHBondContact O-N 2.74Å |
| 115 | E | 92.6 | Very high | 92.4 | Very high | 105 Ų | 105 | 58.4 Ų | 58.4 | 49% | 0.491 | 33% | 0.328 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.2 | 156.8 | 170.2 | 60 | 168 | 162.5 | 0 | 0 | 110.9 | I99 R108 C109 | I99-E115 HydrophobicContact CD1-CB 3.95Å; R108-E115 IonicContact CZ-OE2 3.21Å; R108-E115 IonicContact NE-OE2 2.77Å; R108-E115 PolarHBondContact NE-OE2 2.95Å; R108-E115 IonicContact NH2-OE1 3.13Å; R108-E115 PolarHBondContact NH2-OE1 2.86Å; R108-E115 VanDerWaalsContact NH2-OE1 3.13Å; R108-E115 IonicContact NH2-OE2 2.86Å; R108-E115 PolarHBondContact NH2-OE2 3.13Å; C109-E115 CarbonylContact O-C 3.59Å; C109-E115 VanDerWaalsContact O-CA 3.27Å; C109-E115 WeakPolarHBondContact O-CA 3.19Å |
| 116 | G | 94.4 | Very high | 92.1 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 174.7 | 173.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113 | D86 C109 | D86-G116 CarbonylContact O-C 3.52Å; D86-G116 WeakPolarHBondContact O-CA 3.43Å; C109-G116 PolarHBondContact N-O 2.9Å; C109-G116 PolarHBondContact O-N 2.77Å |
| 117 | L | 94.8 | Very high | 91.3 | Very high | 20 Ų | 20 | 63.8 Ų | 63.8 | 11% | 0.105 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.8 | 137.7 | 177.3 | -61.1 | -177.5 | 0 | 0 | 0 | 111.7 | D86 Q87 L88 V102 W106 L107 R108 | D86-L117 WeakPolarHBondContact O-CB 3.17Å; D86-L117 PolarHBondContact O-N 3.12Å; D86-L117 WeakPolarHBondContact OD2-CD1 3.27Å; Q87-L117 WeakPolarHBondContact CA-O 3.44Å; Q87-L117 HydrophobicContact CG-CB 4.5Å; L88-L117 PolarHBondContact N-O 3.1Å; L88-L117 VanDerWaalsContact N-O 3.1Å; V102-L117 HydrophobicContact CG2-CD2 3.79Å; W106-L117 HydrophobicContact CE3-CB 3.83Å; W106-L117 HydrophobicContact CZ3-CB 4.33Å; L107-L117 CarbonylContact O-C 3.55Å; L107-L117 WeakPolarHBondContact O-CA 3.34Å; R108-L117 HydrophobicContact CB-CD2 4.34Å |
| 118 | V | 94.5 | Very high | 91.2 | Very high | 0 Ų | 0 | 66.3 Ų | 66.3 | 0% | 0 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.3 | 129.9 | 179.9 | 174.4 | 0 | 0 | 0 | 0 | 108.3 | L88 F90 L96 L107 C109 V120 T123 | L88-V118 HydrophobicContact CB-CG2 3.83Å; L88-V118 HydrophobicContact CD2-CG2 4.17Å; F90-V118 HydrophobicContact CD1-CG1 4.36Å; F90-V118 HydrophobicContact CD1-CG2 4.08Å; F90-V118 HydrophobicContact CE1-CB 4.22Å; F90-V118 HydrophobicContact CE1-CG1 3.61Å; F90-V118 HydrophobicContact CE1-CG2 3.86Å; F90-V118 HydrophobicContact CZ-CG1 3.93Å; L96-V118 HydrophobicContact CD1-CG1 4.3Å; L96-V118 HydrophobicContact CD1-CG2 4.09Å; L107-V118 PolarHBondContact N-O 2.75Å; L107-V118 PolarHBondContact O-N 2.88Å; C109-V118 HydrophobicContact CB-CB 4.37Å; C109-V118 HydrophobicContact CB-CG2 3.75Å; V118-V120 PolarHBondContact O-N 2.99Å; V118-T123 HydrophobicContact CG1-CG2 3.39Å |
| 119 | P | 93.6 | Very high | 91 | Very high | 20 Ų | 20 | 65.9 Ų | 65.9 | 13% | 0.13 | 38% | 0.383 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.6 | 132.7 | 176.8 | -17.3 | 29.3 | 0 | 0 | 0 | 111.5 | D105 W106 G121 Y122 | D105-P119 CarbonylContact O-C 3.57Å; D105-P119 VanDerWaalsContact O-CA 3.29Å; D105-P119 WeakPolarHBondContact O-CA 3.17Å; W106-P119 HydrophobicContact CE3-CG 4.3Å; W106-P119 HydrophobicContact CH2-CG 4.03Å; W106-P119 HydrophobicContact CZ3-CB 4.39Å; W106-P119 HydrophobicContact CZ3-CG 3.66Å; P119-G121 VanDerWaalsContact C-N 3.31Å; P119-G121 PolarHBondContact O-N 2.81Å; P119-Y122 HydrophobicContact CB-CD1 4.27Å; P119-Y122 HydrophobicContact CB-CD2 4.42Å; P119-Y122 HydrophobicContact CB-CG 4.05Å; P119-Y122 HydrophobicContact CG-CD2 3.96Å; P119-Y122 HydrophobicContact CG-CE2 4.36Å; P119-Y122 HydrophobicContact CG-CG 4.1Å; P119-Y122 PolarHBondContact O-N 3.24Å; P119-Y122 VanDerWaalsContact O-N 3.09Å |
| 120 | V | 92.9 | Very high | 90.9 | Very high | 53 Ų | 53 | 69.6 Ų | 69.6 | 32% | 0.321 | 40% | 0.404 | S | S | . | . | G | 310 helix | trans | -52.8 | -50.9 | 176.3 | 171.1 | 0 | 0 | 0 | 0 | 110.1 | E104 D105 L107 V118 Y122 T123 | E104-V120 WeakPolarHBondContact O-CG2 3.35Å; D105-V120 PolarHBondContact O-N 3.3Å; L107-V120 HydrophobicContact CD1-CG2 4.28Å; L107-V120 HydrophobicContact CD2-CG2 3.86Å; L107-V120 HydrophobicContact CG-CG2 3.66Å; V118-V120 PolarHBondContact O-N 2.99Å; V120-Y122 PolarHBondContact O-N 2.85Å; V120-T123 PolarHBondContact O-N 2.93Å; V120-T123 VanDerWaalsContact O-O 3.11Å; V120-T123 PolarHBondContact O-OG1 2.92Å |
| 121 | G | 93.3 | Very high | 90.8 | Very high | 67 Ų | 67 | 73.5 Ų | 73.5 | 69% | 0.691 | 43% | 0.426 | S | S | * | . | G | 310 helix | trans | -63.4 | -12.7 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | P119 T123 | P119-G121 VanDerWaalsContact C-N 3.31Å; P119-G121 PolarHBondContact O-N 2.81Å; G121-T123 VanDerWaalsContact C-N 3.31Å |
| 122 | Y | 93.9 | Very high | 90.9 | Very high | 111 Ų | 111 | 74.9 Ų | 74.9 | 44% | 0.435 | 44% | 0.44 | S | S | . | . | G | 310 helix | trans | -91.8 | 2.7 | 175.4 | -74.8 | 18 | 0 | 0 | 0 | 112 | L77 C78 F90 P119 V120 | L77-Y122 WeakPolarHBondContact CB-O 3.49Å; L77-Y122 PolarHBondContact N-O 3.39Å; C78-Y122 VanDerWaalsContact SG-CD2 3.55Å; F90-Y122 HydrophobicContact CZ-CD2 4.29Å; P119-Y122 HydrophobicContact CB-CD1 4.27Å; P119-Y122 HydrophobicContact CB-CD2 4.42Å; P119-Y122 HydrophobicContact CB-CG 4.05Å; P119-Y122 HydrophobicContact CG-CD2 3.96Å; P119-Y122 HydrophobicContact CG-CE2 4.36Å; P119-Y122 HydrophobicContact CG-CG 4.1Å; P119-Y122 PolarHBondContact O-N 3.24Å; P119-Y122 VanDerWaalsContact O-N 3.09Å; V120-Y122 PolarHBondContact O-N 2.85Å |
| 123 | T | 94.1 | Very high | 91.2 | Very high | 16 Ų | 16 | 69.7 Ų | 69.7 | 10% | 0.098 | 42% | 0.416 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.6 | 158.6 | -173.1 | 69.3 | 0 | 0 | 0 | 0 | 112.5 | V74 R75 V118 V120 G121 | V74-T123 HydrophobicContact CB-CG2 4.47Å; V74-T123 HydrophobicContact CG2-CG2 4.13Å; R75-T123 CarbonylContact O-C 3.48Å; R75-T123 WeakPolarHBondContact O-CA 3.24Å; V118-T123 HydrophobicContact CG1-CG2 3.39Å; V120-T123 PolarHBondContact O-N 2.93Å; V120-T123 VanDerWaalsContact O-O 3.11Å; V120-T123 PolarHBondContact O-OG1 2.92Å; G121-T123 VanDerWaalsContact C-N 3.31Å |
| 124 | S | 93.9 | Very high | 91.5 | Very high | 61 Ų | 61 | 68.9 Ų | 68.9 | 43% | 0.427 | 39% | 0.385 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.8 | 138.7 | 169.9 | -179.4 | 0 | 0 | 0 | 0 | 109.7 | V74 R75 V126 | V74-S124 CarbonylContact C-O 3.46Å; V74-S124 VanDerWaalsContact CA-O 3.23Å; V74-S124 WeakPolarHBondContact CA-O 3.17Å; R75-S124 PolarHBondContact N-O 3.46Å; R75-S124 PolarHBondContact O-N 2.77Å; S124-V126 PolarHBondContact O-N 3.17Å |
| 125 | L | 90.4 | Very high | 91.7 | Very high | 97 Ų | 97 | 65 Ų | 65 | 51% | 0.508 | 37% | 0.369 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.6 | 135.1 | 173.7 | -73.8 | 165.1 | 0 | 0 | 0 | 110.5 | R72 V74 L127 | R72-L125 HydrophobicContact CB-CD2 4.43Å; V74-L125 HydrophobicContact CG1-CD2 3.8Å; V74-L125 HydrophobicContact CG1-CG 4.39Å; L125-L127 HydrophobicContact CB-CD1 4.44Å |
| 126 | V | 88 | Confident | 91.6 | Very high | 65 Ų | 65 | 61.7 Ų | 61.7 | 39% | 0.394 | 36% | 0.359 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.5 | 117.3 | 168.7 | -174.2 | 0 | 0 | 0 | 0 | 106.7 | A73 R75 S124 | A73-V126 HydrophobicContact CB-CB 4.11Å; A73-V126 PolarHBondContact O-N 3.16Å; R75-V126 HydrophobicContact CB-CG2 3.81Å; S124-V126 PolarHBondContact O-N 3.17Å |
| 127 | L | 75.9 | Confident | 91.4 | Very high | 230 Ų | 230 | 67.3 Ų | 67.3 | 100% | 1.204 | 39% | 0.392 | S | S | * | . | trans | -94.2 | 0 | 171.5 | -72 | 93.1 | 0 | 0 | 0 | 110.6 | L125 | L125-L127 HydrophobicContact CB-CD1 4.44Š|
Retrieved 127 of 127 residues in 214.6 ms
(Link to these results)