| 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 | 39.2 | Very low | 41 | Very low | 251 Ų | 251 | 146.7 Ų | 146.7 | 100% | 1.236 | 87% | 0.869 | S | S | * | * | 0 | 136.7 | 0 | -69.6 | -175.9 | 170.7 | 0 | 0 | 107.8 | |||||
| 2 | A | 40.4 | Very low | 41.2 | Very low | 102 Ų | 102 | 152.4 Ų | 152.4 | 84% | 0.843 | 86% | 0.864 | S | S | * | * | cis | -160.1 | 144.1 | -30.8 | 0 | 0 | 0 | 0 | 0 | 104 | ||||
| 3 | T | 43.8 | Very low | 40.8 | Very low | 143 Ų | 143 | 154.3 Ų | 154.3 | 88% | 0.877 | 87% | 0.869 | S | S | * | * | trans | -68.7 | 148.9 | 176.7 | 48.9 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 4 | A | 50.1 | Low | 40.5 | Very low | 103 Ų | 103 | 150.2 Ų | 150.2 | 85% | 0.851 | 86% | 0.856 | S | S | * | * | trans | -156.9 | 108 | 152.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 5 | E | 41.8 | Very low | 40.6 | Very low | 177 Ų | 177 | 148.8 Ų | 148.8 | 83% | 0.827 | 85% | 0.851 | S | S | * | * | trans | -70 | 150.8 | 152.6 | -74.1 | -84.6 | 136.3 | 0 | 0 | 109.8 | ||||
| 6 | L | 45.5 | Very low | 40.9 | Very low | 174 Ų | 174 | 147.3 Ų | 147.3 | 91% | 0.911 | 85% | 0.848 | S | S | * | * | trans | -168 | 123 | 134.9 | -107.6 | 154 | 0 | 0 | 0 | 114.3 | ||||
| 7 | S | 36.1 | Very low | 40.6 | Very low | 111 Ų | 111 | 142.5 Ų | 142.5 | 78% | 0.776 | 84% | 0.839 | S | S | * | * | trans | -50.8 | 150 | 166.9 | 177.5 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 8 | G | 36 | Very low | 40.7 | Very low | 69 Ų | 69 | 142.1 Ų | 142.1 | 71% | 0.711 | 84% | 0.841 | S | S | * | * | trans | 114.2 | 122.5 | 135.1 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 9 | R | 40.9 | Very low | 40.6 | Very low | 257 Ų | 257 | 146.9 Ų | 146.9 | 97% | 0.97 | 84% | 0.843 | S | S | * | * | 167.5 | 142.9 | 89.1 | -149.8 | 168.5 | -178.3 | -176.4 | -0.5 | 111.3 | |||||
| 10 | A | 35.7 | Very low | 41 | Very low | 83 Ų | 83 | 145.3 Ų | 145.3 | 69% | 0.686 | 84% | 0.838 | S | S | * | * | trans | -74.9 | 157.4 | -174.5 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 11 | V | 41.4 | Very low | 40.6 | Very low | 144 Ų | 144 | 144.2 Ų | 144.2 | 87% | 0.873 | 84% | 0.839 | S | S | * | * | trans | -127.8 | 119.9 | 150.2 | 177.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 12 | R | 42.9 | Very low | 40.4 | Very low | 215 Ų | 215 | 135.7 Ų | 135.7 | 81% | 0.811 | 82% | 0.815 | S | S | * | * | trans | -85.7 | 147.2 | 169.7 | -65.6 | 178.7 | 171.3 | -135.1 | -0.2 | 108.9 | ||||
| 13 | L | 37 | Very low | 40.2 | Very low | 177 Ų | 177 | 135.5 Ų | 135.5 | 93% | 0.927 | 81% | 0.814 | S | S | * | * | trans | -132.6 | 140.6 | 146.8 | -78.2 | 174 | 0 | 0 | 0 | 109.8 | ||||
| 14 | S | 36.3 | Very low | 40.2 | Very low | 97 Ų | 97 | 139.8 Ų | 139.8 | 68% | 0.678 | 81% | 0.814 | S | S | * | * | trans | -100.1 | 144.8 | -156.9 | -56.7 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 15 | T | 42.1 | Very low | 39.6 | Very low | 129 Ų | 129 | 141.1 Ų | 141.1 | 79% | 0.791 | 81% | 0.807 | S | S | * | * | trans | -5.2 | 159.7 | 139.8 | 39.4 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 16 | P | 45 | Very low | 39.4 | Very low | 124 Ų | 124 | 144.2 Ų | 144.2 | 81% | 0.805 | 81% | 0.811 | S | S | * | * | cis | -148.7 | 166.6 | 49.1 | 36.8 | -13.5 | 0 | 0 | 0 | 119.9 | ||||
| 17 | G | 36.8 | Very low | 39 | Very low | 67 Ų | 67 | 140.3 Ų | 140.3 | 69% | 0.691 | 80% | 0.804 | S | S | * | * | trans | -76 | -167.9 | 170.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 18 | P | 41 | Very low | 39.5 | Very low | 134 Ų | 134 | 141.2 Ų | 141.2 | 87% | 0.87 | 81% | 0.807 | S | S | * | * | -145.3 | 170.9 | 69.7 | 35.4 | -14.7 | 0 | 0 | 0 | 116.8 | |||||
| 19 | R | 39.8 | Very low | 39.5 | Very low | 235 Ų | 235 | 141.8 Ų | 141.8 | 89% | 0.887 | 81% | 0.813 | S | S | * | * | trans | -87.9 | -165.7 | 165.3 | -57.7 | 176.5 | 159.8 | -162.4 | -5.2 | 109.3 | ||||
| 20 | P | 48 | Very low | 39.7 | Very low | 113 Ų | 113 | 134.8 Ų | 134.8 | 73% | 0.734 | 81% | 0.81 | S | S | * | * | cis | -143.7 | -167.2 | -4.6 | 40.6 | -18.5 | 0 | 0 | 0 | 115.8 | ||||
| 21 | S | 32.3 | Very low | 40 | Very low | 123 Ų | 123 | 135.7 Ų | 135.7 | 86% | 0.86 | 82% | 0.817 | S | S | * | * | trans | 78.6 | 147.1 | 158.8 | 85.3 | 0 | 0 | 0 | 0 | 117 | ||||
| 22 | G | 36 | Very low | 39.9 | Very low | 72 Ų | 72 | 132.2 Ų | 132.2 | 74% | 0.742 | 81% | 0.811 | S | S | * | * | cis | -169.2 | 169.9 | 6.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 23 | A | 36 | Very low | 40.4 | Very low | 99 Ų | 99 | 128 Ų | 128 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | trans | -60.9 | 157.4 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 24 | R | 43.4 | Very low | 41 | Very low | 232 Ų | 232 | 125.9 Ų | 125.9 | 88% | 0.875 | 81% | 0.808 | S | S | * | * | trans | -174.9 | 115.4 | 134.7 | -100.5 | 166.5 | 178 | -155.5 | -2.3 | 113.8 | ||||
| 25 | D | 37.7 | Very low | 41.3 | Very low | 132 Ų | 132 | 127 Ų | 127 | 71% | 0.706 | 82% | 0.816 | S | S | * | * | 62.3 | 122.2 | 124.9 | -59.8 | -27 | 0 | 0 | 0 | 124.5 | |||||
| 26 | R | 36.7 | Very low | 41.2 | Very low | 242 Ų | 242 | 124.3 Ų | 124.3 | 91% | 0.913 | 81% | 0.814 | S | S | * | * | 68.6 | 124.7 | 129.7 | -80.5 | -177.6 | 171.7 | 167.2 | -2 | 122.3 | |||||
| 27 | A | 37.8 | Very low | 41.1 | Very low | 91 Ų | 91 | 127.7 Ų | 127.7 | 75% | 0.752 | 82% | 0.819 | S | S | * | * | trans | -65.2 | -166.5 | 157.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 28 | P | 47.7 | Very low | 41.7 | Very low | 130 Ų | 130 | 132.4 Ų | 132.4 | 84% | 0.844 | 83% | 0.827 | S | S | * | * | cis | -128.7 | 179.7 | -17.9 | 37.5 | -19.4 | 0 | 0 | 0 | 112.6 | ||||
| 29 | G | 35.3 | Very low | 41.7 | Very low | 81 Ų | 81 | 129 Ų | 129 | 84% | 0.835 | 82% | 0.816 | S | S | * | * | trans | 179.2 | 111.2 | 167.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 30 | A | 45.3 | Very low | 41.7 | Very low | 110 Ų | 110 | 124.8 Ų | 124.8 | 91% | 0.909 | 81% | 0.812 | S | S | * | * | trans | -83.4 | 141.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 31 | A | 42.6 | Very low | 41.6 | Very low | 102 Ų | 102 | 130.2 Ų | 130.2 | 84% | 0.843 | 82% | 0.817 | S | S | * | * | trans | -162.1 | 107.5 | 158.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 32 | G | 38.4 | Very low | 42 | Very low | 72 Ų | 72 | 128 Ų | 128 | 74% | 0.742 | 81% | 0.807 | S | S | * | * | trans | 64.7 | 129.2 | 138 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 33 | P | 53.8 | Low | 42.7 | Very low | 127 Ų | 127 | 131.6 Ų | 131.6 | 83% | 0.825 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 137.9 | 158.3 | 33 | -28.9 | 0 | 0 | 0 | 110.6 | S35 | P33-S35 PolarHBondContact O-N 3.07Š|
| 34 | P | 48.2 | Very low | 43 | Very low | 131 Ų | 131 | 137.9 Ų | 137.9 | 85% | 0.851 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 124.4 | 166.7 | 28.8 | -29.5 | 0 | 0 | 0 | 110.9 | ||
| 35 | S | 42.6 | Very low | 43.1 | Very low | 121 Ų | 121 | 135.7 Ų | 135.7 | 85% | 0.846 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 140.3 | 165.3 | -177.5 | 0 | 0 | 0 | 0 | 113.5 | P33 | P33-S35 PolarHBondContact O-N 3.07Š|
| 36 | G | 41.9 | Very low | 43.6 | Very low | 73 Ų | 73 | 132 Ų | 132 | 75% | 0.753 | 81% | 0.809 | S | S | * | * | trans | 67 | 95.2 | 140.3 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 37 | Q | 41.4 | Very low | 44 | Very low | 194 Ų | 194 | 128.9 Ų | 128.9 | 91% | 0.907 | 80% | 0.804 | S | S | * | * | trans | -124.4 | 107.1 | 149.2 | -154.2 | 169.8 | 34.9 | 0 | 0 | 109.5 | G39 | Q37-G39 PolarHBondContact O-N 2.85Š| ||
| 38 | I | 49.9 | Very low | 44.4 | Very low | 166 Ų | 166 | 136.5 Ų | 136.5 | 85% | 0.851 | 81% | 0.813 | S | S | * | * | trans | -59.2 | 102.5 | 168.4 | -64.8 | 175.1 | 0 | 0 | 0 | 106.7 | ||||
| 39 | G | 40.1 | Very low | 44.7 | Very low | 63 Ų | 63 | 134.9 Ų | 134.9 | 65% | 0.649 | 80% | 0.802 | S | S | * | * | trans | -110.6 | 94.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | Q37 | Q37-G39 PolarHBondContact O-N 2.85Š| ||
| 40 | N | 41.4 | Very low | 45.5 | Very low | 147 Ų | 147 | 136.8 Ų | 136.8 | 79% | 0.786 | 80% | 0.799 | S | S | * | * | trans | 22.4 | 102.6 | 145.2 | -53.3 | -35.8 | 0 | 0 | 0 | 115.5 | A42 | N40-A42 PolarHBondContact O-N 3.28Š| ||
| 41 | R | 44.8 | Very low | 45.9 | Very low | 227 Ų | 227 | 134.8 Ų | 134.8 | 86% | 0.857 | 78% | 0.783 | S | S | * | * | trans | -54.7 | 77.8 | 168.1 | -172.1 | -175 | -173.4 | -145.5 | 3.8 | 110.8 | L43 | R41-L43 PolarHBondContact O-N 3.19Š| ||
| 42 | A | 40.2 | Very low | 46.8 | Very low | 77 Ų | 77 | 132.9 Ų | 132.9 | 64% | 0.636 | 77% | 0.767 | S | S | * | * | trans | -69.5 | 113.2 | 156.9 | 0 | 0 | 0 | 0 | 0 | 106.2 | N40 R44 | N40-A42 PolarHBondContact O-N 3.28Å; A42-R44 VanDerWaalsContact C-N 3.29Å; A42-R44 PolarHBondContact O-N 3.38Å | ||
| 43 | L | 52.1 | Low | 47.9 | Very low | 146 Ų | 146 | 132 Ų | 132 | 76% | 0.764 | 75% | 0.747 | S | S | * | * | trans | -56.1 | 92 | 175.1 | -69.2 | 166.3 | 0 | 0 | 0 | 109.4 | R41 L45 | R41-L43 PolarHBondContact O-N 3.19Å; L43-L45 VanDerWaalsContact C-N 3.27Å; L43-L45 PolarHBondContact O-N 3.31Å | ||
| 44 | R | 42 | Very low | 48.4 | Very low | 231 Ų | 231 | 129.7 Ų | 129.7 | 87% | 0.872 | 73% | 0.725 | S | S | * | * | trans | -75.4 | 89.4 | 163.3 | -68.3 | -86.1 | 175.2 | 165.6 | -3.8 | 105.8 | A42 G46 | A42-R44 VanDerWaalsContact C-N 3.29Å; A42-R44 PolarHBondContact O-N 3.38Å; R44-G46 PolarHBondContact O-N 3.21Å | ||
| 45 | L | 45.1 | Very low | 49.7 | Very low | 187 Ų | 187 | 131.5 Ų | 131.5 | 98% | 0.979 | 72% | 0.72 | S | S | * | * | trans | -65.5 | 79 | 158.5 | -179.7 | 63.2 | 0 | 0 | 0 | 107.1 | L43 | L43-L45 VanDerWaalsContact C-N 3.27Å; L43-L45 PolarHBondContact O-N 3.31Å | ||
| 46 | G | 49.1 | Very low | 51.2 | Low | 55 Ų | 55 | 133.3 Ų | 133.3 | 57% | 0.567 | 71% | 0.708 | S | S | * | * | trans | -130.9 | 137.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 108 | R44 | R44-G46 PolarHBondContact O-N 3.21Š| ||
| 47 | E | 43.9 | Very low | 52.8 | Low | 176 Ų | 176 | 131.8 Ų | 131.8 | 82% | 0.822 | 69% | 0.692 | S | S | * | * | trans | 82.1 | 64.5 | 179.3 | -59.5 | -171.5 | 110.3 | 0 | 0 | 116.6 | T49 | E47-T49 PolarHBondContact O-N 3.49Š| ||
| 48 | R | 46.2 | Very low | 54.4 | Low | 250 Ų | 250 | 129.7 Ų | 129.7 | 94% | 0.943 | 70% | 0.695 | S | S | * | * | trans | -81.5 | 86.5 | 131.5 | -101.8 | -175.6 | 173.3 | 163.6 | -0.7 | 107.8 | P50 | R48-P50 WeakPolarHBondContact O-CD 3.5Š| ||
| 49 | T | 54.6 | Low | 55.5 | Low | 97 Ų | 97 | 129.5 Ų | 129.5 | 60% | 0.595 | 69% | 0.685 | S | S | * | * | trans | -52.6 | 124.3 | 151.5 | 41.3 | 0 | 0 | 0 | 0 | 106.7 | E47 A51 | E47-T49 PolarHBondContact O-N 3.49Å; T49-A51 PolarHBondContact O-N 2.88Å | ||
| 50 | P | 51.2 | Low | 57.4 | Low | 121 Ų | 121 | 132.4 Ų | 132.4 | 79% | 0.786 | 68% | 0.683 | S | S | * | * | trans | -71.5 | 95.4 | 164.6 | 29.1 | -27.5 | 0 | 0 | 0 | 104.1 | R48 A52 | R48-P50 WeakPolarHBondContact O-CD 3.5Å; P50-A52 PolarHBondContact O-N 3.13Å | ||
| 51 | A | 54.9 | Low | 59.1 | Low | 68 Ų | 68 | 128.6 Ų | 128.6 | 56% | 0.562 | 67% | 0.665 | S | S | * | * | trans | -54.4 | 96.3 | 164.9 | 0 | 0 | 0 | 0 | 0 | 106 | T49 V53 | T49-A51 PolarHBondContact O-N 2.88Å; A51-V53 PolarHBondContact O-N 3.08Å | ||
| 52 | A | 61.7 | Low | 60.6 | Low | 62 Ų | 62 | 122.8 Ų | 122.8 | 51% | 0.512 | 66% | 0.655 | S | S | . | * | S | Bend | trans | -62.9 | -9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | P50 T62 R63 | P50-A52 PolarHBondContact O-N 3.13Å; A52-T62 CarbonylContact O-C 3.6Å; A52-T62 WeakPolarHBondContact O-CA 3.32Å; A52-T62 WeakPolarHBondContact O-CG2 3.43Å; A52-R63 PolarHBondContact O-N 2.94Å |
| 53 | V | 60 | Low | 62.2 | Low | 54 Ų | 54 | 127.6 Ų | 127.6 | 33% | 0.327 | 66% | 0.657 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -128.9 | 116.8 | 176.6 | 179.1 | 0 | 0 | 0 | 0 | 107.2 | A51 M60 V61 T62 | A51-V53 PolarHBondContact O-N 3.08Å; V53-M60 HydrophobicContact CG1-CB 3.45Å; V53-M60 VanDerWaalsContact CG1-CB 3.45Å; V53-M60 HydrophobicContact CG1-CE 4.44Å; V53-M60 HydrophobicContact CG1-CG 3.91Å; V53-M60 HydrophobicContact CG1-SD 3.9Å; V53-V61 CarbonylContact C-O 3.36Å; V53-V61 WeakPolarHBondContact CA-O 3.5Å; V53-T62 HydrophobicContact CG2-CG2 4.36Å |
| 54 | E | 65.3 | Low | 63.4 | Low | 77 Ų | 77 | 124.6 Ų | 124.6 | 36% | 0.36 | 65% | 0.653 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -98 | 130.8 | 174.9 | -167.3 | -178.4 | 177.6 | 0 | 0 | 108.2 | R56 V61 | E54-R56 VanDerWaalsContact CD-NE 3.32Å; E54-R56 PolarHBondContact O-N 2.95Å; E54-R56 VanDerWaalsContact O-N 3.07Å; E54-R56 IonicContact OE1-CZ 3.33Å; E54-R56 IonicContact OE1-NE 3.42Å; E54-R56 PolarHBondContact OE1-NE 2.99Å; E54-R56 IonicContact OE1-NH2 2.9Å; E54-R56 PolarHBondContact OE1-NH2 3.05Å; E54-R56 IonicContact OE2-CZ 3.42Å; E54-R56 IonicContact OE2-NE 3.21Å; E54-R56 PolarHBondContact OE2-NE 3.05Å; E54-R56 IonicContact OE2-NH2 2.81Å; E54-R56 PolarHBondContact OE2-NH2 2.62Å; E54-V61 PolarHBondContact N-O 3.49Å; E54-V61 PolarHBondContact O-N 3.41Å |
| 55 | K | 74.4 | Confident | 65.2 | Low | 169 Ų | 169 | 116.7 Ų | 116.7 | 74% | 0.735 | 63% | 0.632 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -72.4 | 102.7 | 175.4 | -175 | -168.3 | 176 | -173 | 0 | 108.7 | G57 | K55-G57 WeakPolarHBondContact CE-O 3.5Å; K55-G57 WeakPolarHBondContact CG-O 3.38Å |
| 56 | R | 74.7 | Confident | 67.1 | Low | 160 Ų | 160 | 110.9 Ų | 110.9 | 60% | 0.604 | 61% | 0.607 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -100.7 | 81.2 | 172.4 | -66.6 | -70.7 | 177.6 | 164 | -6.7 | 107.7 | E54 Y59 V61 | E54-R56 VanDerWaalsContact CD-NE 3.32Å; E54-R56 PolarHBondContact O-N 2.95Å; E54-R56 VanDerWaalsContact O-N 3.07Å; E54-R56 IonicContact OE1-CZ 3.33Å; E54-R56 IonicContact OE1-NE 3.42Å; E54-R56 PolarHBondContact OE1-NE 2.99Å; E54-R56 IonicContact OE1-NH2 2.9Å; E54-R56 PolarHBondContact OE1-NH2 3.05Å; E54-R56 IonicContact OE2-CZ 3.42Å; E54-R56 IonicContact OE2-NE 3.21Å; E54-R56 PolarHBondContact OE2-NE 3.05Å; E54-R56 IonicContact OE2-NH2 2.81Å; E54-R56 PolarHBondContact OE2-NH2 2.62Å; R56-Y59 CarbonylContact C-O 3.46Å; R56-Y59 PolarHBondContact N-O 2.91Å; R56-Y59 VanDerWaalsContact N-O 3.09Å; R56-V61 HydrophobicContact CB-CG2 4.09Å; R56-V61 HydrophobicContact CG-CB 4.47Å; R56-V61 HydrophobicContact CG-CG2 4.31Å |
| 57 | G | 75.7 | Confident | 69 | Low | 41 Ų | 41 | 114.8 Ų | 114.8 | 42% | 0.423 | 61% | 0.613 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 75.7 | -141.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | K55 Y59 | K55-G57 WeakPolarHBondContact CE-O 3.5Å; K55-G57 WeakPolarHBondContact CG-O 3.38Å; G57-Y59 PolarHBondContact O-N 3.14Å; G57-Y59 VanDerWaalsContact O-N 3.12Å |
| 58 | P | 76 | Confident | 71.3 | Confident | 150 Ų | 150 | 113.9 Ų | 113.9 | 97% | 0.974 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.8 | -9.7 | -179.5 | -18.7 | 30.9 | 0 | 0 | 0 | 114.5 | ||
| 59 | Y | 71.4 | Confident | 73.4 | Confident | 162 Ų | 162 | 103.6 Ų | 103.6 | 64% | 0.635 | 58% | 0.578 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -123.3 | 153.7 | -177.5 | -177.1 | -102.9 | 0 | 0 | 0 | 112.2 | R56 G57 V61 | R56-Y59 CarbonylContact C-O 3.46Å; R56-Y59 PolarHBondContact N-O 2.91Å; R56-Y59 VanDerWaalsContact N-O 3.09Å; G57-Y59 PolarHBondContact O-N 3.14Å; G57-Y59 VanDerWaalsContact O-N 3.12Å; Y59-V61 HydrophobicContact CD1-CG2 3.79Å; Y59-V61 HydrophobicContact CE1-CG2 4.04Å |
| 60 | M | 80.1 | Confident | 75.3 | Confident | 124 Ų | 124 | 104.5 Ų | 104.5 | 61% | 0.611 | 57% | 0.573 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -100.8 | 114.2 | 179.7 | -83 | -159.7 | -43.5 | 0 | 0 | 109.9 | V53 | V53-M60 HydrophobicContact CG1-CB 3.45Å; V53-M60 VanDerWaalsContact CG1-CB 3.45Å; V53-M60 HydrophobicContact CG1-CE 4.44Å; V53-M60 HydrophobicContact CG1-CG 3.91Å; V53-M60 HydrophobicContact CG1-SD 3.9Å |
| 61 | V | 76.9 | Confident | 77.4 | Confident | 67 Ų | 67 | 102.9 Ų | 102.9 | 41% | 0.406 | 56% | 0.558 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -99.6 | 124.2 | 180 | -179.5 | 0 | 0 | 0 | 0 | 109.7 | V53 E54 R56 Y59 R63 | V53-V61 CarbonylContact C-O 3.36Å; V53-V61 WeakPolarHBondContact CA-O 3.5Å; E54-V61 PolarHBondContact N-O 3.49Å; E54-V61 PolarHBondContact O-N 3.41Å; R56-V61 HydrophobicContact CB-CG2 4.09Å; R56-V61 HydrophobicContact CG-CB 4.47Å; R56-V61 HydrophobicContact CG-CG2 4.31Å; Y59-V61 HydrophobicContact CD1-CG2 3.79Å; Y59-V61 HydrophobicContact CE1-CG2 4.04Å; V61-R63 PolarHBondContact O-N 3.34Å |
| 62 | T | 77.5 | Confident | 79.3 | Confident | 104 Ų | 104 | 103.8 Ų | 103.8 | 64% | 0.638 | 55% | 0.55 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -70.4 | 118 | 172.2 | -46.8 | 0 | 0 | 0 | 0 | 109.6 | A52 V53 | A52-T62 CarbonylContact O-C 3.6Å; A52-T62 WeakPolarHBondContact O-CA 3.32Å; A52-T62 WeakPolarHBondContact O-CG2 3.43Å; V53-T62 HydrophobicContact CG2-CG2 4.36Å |
| 63 | R | 74.3 | Confident | 80.9 | Confident | 178 Ų | 178 | 107.3 Ų | 107.3 | 67% | 0.672 | 55% | 0.554 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 134.3 | 177.4 | -167.5 | 177.3 | 179.9 | -174.8 | 1.5 | 109.2 | A52 V61 | A52-R63 PolarHBondContact O-N 2.94Å; V61-R63 PolarHBondContact O-N 3.34Å |
| 64 | A | 77.6 | Confident | 82.6 | Confident | 83 Ų | 83 | 111 Ų | 111 | 69% | 0.686 | 57% | 0.567 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 135.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | S66 | A64-S66 PolarHBondContact O-N 2.86Š|
| 65 | P | 78.4 | Confident | 84.1 | Confident | 66 Ų | 66 | 114 Ų | 114 | 43% | 0.429 | 58% | 0.575 | S | S | . | * | P | Polyproline II helix | trans | -61.3 | 129.8 | -178.6 | 21.9 | -30.5 | 0 | 0 | 0 | 109.9 | A69 K70 | P65-A69 HydrophobicContact CB-CB 4.36Å; P65-K70 HydrophobicContact CB-CG 4.43Å |
| 66 | S | 86.3 | Confident | 85 | Confident | 65 Ų | 65 | 109.5 Ų | 109.5 | 46% | 0.455 | 56% | 0.559 | S | S | . | * | P | Polyproline II helix | trans | -61.1 | 157.5 | 178.8 | 69.4 | 0 | 0 | 0 | 0 | 111.1 | A64 Q68 A69 K70 | A64-S66 PolarHBondContact O-N 2.86Å; S66-Q68 PolarHBondContact O-N 3.42Å; S66-A69 WeakPolarHBondContact O-CA 3.34Å; S66-A69 WeakPolarHBondContact O-CB 2.93Å; S66-A69 PolarHBondContact O-N 3.39Å; S66-A69 WeakPolarHBondContact OG-CB 3.13Å; S66-A69 PolarHBondContact OG-N 2.93Å; S66-A69 VanDerWaalsContact OG-N 3.13Å; S66-K70 PolarHBondContact O-N 3.36Å |
| 67 | I | 88.5 | Confident | 86 | Confident | 137 Ų | 137 | 107 Ų | 107 | 70% | 0.703 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -54 | -42.1 | 175.5 | -61.6 | 171.7 | 0 | 0 | 0 | 110.1 | A69 K70 L71 | I67-A69 PolarHBondContact O-N 3.13Å; I67-K70 PolarHBondContact O-N 3.28Å; I67-L71 HydrophobicContact CG2-CD1 4.19Å; I67-L71 HydrophobicContact CG2-CG 4.45Å; I67-L71 WeakPolarHBondContact O-CG 3.29Å; I67-L71 PolarHBondContact O-N 3.02Å |
| 68 | Q | 92.3 | Very high | 86.8 | Confident | 156 Ų | 156 | 107.4 Ų | 107.4 | 73% | 0.729 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -60.6 | -42.7 | 175 | -66.5 | 179.5 | -13.7 | 0 | 0 | 112.6 | S66 K70 L71 Q72 | S66-Q68 PolarHBondContact O-N 3.42Å; Q68-K70 VanDerWaalsContact C-N 3.35Å; Q68-K70 PolarHBondContact O-N 3.38Å; Q68-L71 PolarHBondContact O-N 2.82Å; Q68-Q72 WeakPolarHBondContact O-CB 3.24Å; Q68-Q72 PolarHBondContact O-N 3.32Å |
| 69 | A | 90.6 | Very high | 87.6 | Confident | 35 Ų | 35 | 105.7 Ų | 105.7 | 29% | 0.289 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66 | -36.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | P65 S66 I67 K73 | P65-A69 HydrophobicContact CB-CB 4.36Å; S66-A69 WeakPolarHBondContact O-CA 3.34Å; S66-A69 WeakPolarHBondContact O-CB 2.93Å; S66-A69 PolarHBondContact O-N 3.39Å; S66-A69 WeakPolarHBondContact OG-CB 3.13Å; S66-A69 PolarHBondContact OG-N 2.93Å; S66-A69 VanDerWaalsContact OG-N 3.13Å; I67-A69 PolarHBondContact O-N 3.13Å; A69-K73 VanDerWaalsContact O-CG 3.28Å; A69-K73 WeakPolarHBondContact O-CG 3.29Å; A69-K73 PolarHBondContact O-N 3.45Å; A69-K73 VanDerWaalsContact O-N 3.09Å |
| 70 | K | 93.8 | Very high | 88.5 | Confident | 116 Ų | 116 | 100.3 Ų | 100.3 | 50% | 0.504 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.9 | -48.8 | 172.8 | -67.8 | -177.2 | -178 | -179.4 | 0 | 110.8 | P65 S66 I67 Q68 Q72 K73 H74 | P65-K70 HydrophobicContact CB-CG 4.43Å; S66-K70 PolarHBondContact O-N 3.36Å; I67-K70 PolarHBondContact O-N 3.28Å; Q68-K70 VanDerWaalsContact C-N 3.35Å; Q68-K70 PolarHBondContact O-N 3.38Å; K70-Q72 VanDerWaalsContact C-N 3.33Å; K70-Q72 PolarHBondContact O-N 2.87Å; K70-K73 WeakPolarHBondContact O-CB 3.46Å; K70-K73 PolarHBondContact O-N 2.87Å; K70-H74 PolarHBondContact O-CD2 2.78Å; K70-H74 PolarHBondContact O-N 2.87Å |
| 71 | L | 95.8 | Very high | 89.1 | Confident | 87 Ų | 87 | 97.6 Ų | 97.6 | 46% | 0.455 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.1 | -42.2 | 178.1 | -69.2 | 175.1 | 0 | 0 | 0 | 112.3 | I67 Q68 H74 R75 | I67-L71 HydrophobicContact CG2-CD1 4.19Å; I67-L71 HydrophobicContact CG2-CG 4.45Å; I67-L71 WeakPolarHBondContact O-CG 3.29Å; I67-L71 PolarHBondContact O-N 3.02Å; Q68-L71 PolarHBondContact O-N 2.82Å; L71-H74 PolarHBondContact O-N 3.36Å; L71-R75 WeakPolarHBondContact O-CG 3.14Å; L71-R75 PolarHBondContact O-N 3.48Å |
| 72 | Q | 93.8 | Very high | 89.5 | Confident | 87 Ų | 87 | 97.2 Ų | 97.2 | 41% | 0.407 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.1 | -45 | 176.4 | -173.6 | 58.4 | 35.7 | 0 | 0 | 111.5 | Q68 K70 H74 R75 D76 | Q68-Q72 WeakPolarHBondContact O-CB 3.24Å; Q68-Q72 PolarHBondContact O-N 3.32Å; K70-Q72 VanDerWaalsContact C-N 3.33Å; K70-Q72 PolarHBondContact O-N 2.87Å; Q72-H74 VanDerWaalsContact C-N 3.34Å; Q72-H74 PolarHBondContact O-N 3.39Å; Q72-R75 WeakPolarHBondContact O-CB 3.21Å; Q72-R75 PolarHBondContact O-N 3.33Å; Q72-D76 PolarHBondContact NE2-OD1 3.04Å; Q72-D76 PolarHBondContact NE2-OD2 2.75Å; Q72-D76 VanDerWaalsContact O-CG 3.28Å; Q72-D76 PolarHBondContact O-N 3.35Å |
| 73 | K | 95.6 | Very high | 89.9 | Confident | 136 Ų | 136 | 98.8 Ų | 98.8 | 59% | 0.591 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -58.7 | -42.8 | 175.5 | -74.1 | 175.8 | -179.7 | -171.6 | 0 | 112.7 | A69 K70 D76 L77 | A69-K73 VanDerWaalsContact O-CG 3.28Å; A69-K73 WeakPolarHBondContact O-CG 3.29Å; A69-K73 PolarHBondContact O-N 3.45Å; A69-K73 VanDerWaalsContact O-N 3.09Å; K70-K73 WeakPolarHBondContact O-CB 3.46Å; K70-K73 PolarHBondContact O-N 2.87Å; K73-D76 PolarHBondContact O-N 2.75Å; K73-L77 WeakPolarHBondContact O-CB 3.42Å; K73-L77 PolarHBondContact O-N 2.89Å |
| 74 | H | 96.1 | Very high | 90.4 | Very high | 132 Ų | 132 | 100.1 Ų | 100.1 | 61% | 0.611 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.7 | -40.5 | 176.7 | -78.4 | -78.8 | 0 | 0 | 0 | 112.1 | K70 L71 Q72 L77 A78 | K70-H74 PolarHBondContact O-CD2 2.78Å; K70-H74 PolarHBondContact O-N 2.87Å; L71-H74 PolarHBondContact O-N 3.36Å; Q72-H74 VanDerWaalsContact C-N 3.34Å; Q72-H74 PolarHBondContact O-N 3.39Å; H74-L77 PolarHBondContact O-N 2.62Å; H74-A78 WeakPolarHBondContact O-CB 3.41Å; H74-A78 PolarHBondContact O-N 3.35Å |
| 75 | R | 95.7 | Very high | 90.7 | Very high | 140 Ų | 140 | 103.9 Ų | 103.9 | 53% | 0.528 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.9 | -44.5 | 174.4 | -71.9 | 176 | 175.8 | 121.8 | 0.8 | 111.7 | L71 Q72 A78 K79 | L71-R75 WeakPolarHBondContact O-CG 3.14Å; L71-R75 PolarHBondContact O-N 3.48Å; Q72-R75 WeakPolarHBondContact O-CB 3.21Å; Q72-R75 PolarHBondContact O-N 3.33Å; R75-A78 PolarHBondContact O-N 2.5Å; R75-K79 WeakPolarHBondContact O-CB 3.34Å; R75-K79 VanDerWaalsContact O-CG 3.29Å; R75-K79 WeakPolarHBondContact O-CG 3.09Å; R75-K79 PolarHBondContact O-N 2.75Å |
| 76 | D | 94.4 | Very high | 90.6 | Very high | 73 Ų | 73 | 103.1 Ų | 103.1 | 39% | 0.39 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -70.8 | -37.3 | -178.3 | -64.2 | -27 | 0 | 0 | 0 | 111.7 | Q72 K73 K79 A80 | Q72-D76 PolarHBondContact NE2-OD1 3.04Å; Q72-D76 PolarHBondContact NE2-OD2 2.75Å; Q72-D76 VanDerWaalsContact O-CG 3.28Å; Q72-D76 PolarHBondContact O-N 3.35Å; K73-D76 PolarHBondContact O-N 2.75Å; D76-K79 PolarHBondContact O-N 2.94Å; D76-A80 WeakPolarHBondContact O-CB 3.06Å; D76-A80 PolarHBondContact O-N 2.95Å |
| 77 | L | 95.3 | Very high | 89.8 | Confident | 107 Ų | 107 | 106.2 Ų | 106.2 | 56% | 0.56 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.5 | -46.5 | 172 | 179.4 | 61.4 | 0 | 0 | 0 | 111.6 | K73 H74 K79 A80 V81 | K73-L77 WeakPolarHBondContact O-CB 3.42Å; K73-L77 PolarHBondContact O-N 2.89Å; H74-L77 PolarHBondContact O-N 2.62Å; L77-K79 VanDerWaalsContact C-N 3.35Å; L77-K79 PolarHBondContact O-N 2.67Å; L77-A80 PolarHBondContact O-N 3.19Å; L77-V81 HydrophobicContact CD1-CG2 4.41Å; L77-V81 WeakPolarHBondContact O-CG2 3.06Å; L77-V81 PolarHBondContact O-N 3.24Å |
| 78 | A | 93.7 | Very high | 88.5 | Confident | 50 Ų | 50 | 102.7 Ų | 102.7 | 41% | 0.413 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.1 | -46 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | H74 R75 A80 V81 L82 | H74-A78 WeakPolarHBondContact O-CB 3.41Å; H74-A78 PolarHBondContact O-N 3.35Å; R75-A78 PolarHBondContact O-N 2.5Å; A78-A80 VanDerWaalsContact C-N 3.35Å; A78-A80 PolarHBondContact O-N 2.76Å; A78-V81 PolarHBondContact O-N 3.14Å; A78-L82 WeakPolarHBondContact O-CD1 3.16Å; A78-L82 PolarHBondContact O-N 3.19Å |
| 79 | K | 91.6 | Very high | 86.9 | Confident | 115 Ų | 115 | 97.8 Ų | 97.8 | 50% | 0.5 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -57.6 | -46.6 | 173.8 | -74.1 | 172.6 | -177.2 | 175.9 | 0 | 111.4 | R75 D76 L77 V81 L82 R83 L88 | R75-K79 WeakPolarHBondContact O-CB 3.34Å; R75-K79 VanDerWaalsContact O-CG 3.29Å; R75-K79 WeakPolarHBondContact O-CG 3.09Å; R75-K79 PolarHBondContact O-N 2.75Å; D76-K79 PolarHBondContact O-N 2.94Å; L77-K79 VanDerWaalsContact C-N 3.35Å; L77-K79 PolarHBondContact O-N 2.67Å; K79-V81 VanDerWaalsContact C-N 3.35Å; K79-V81 PolarHBondContact O-N 3.12Å; K79-L82 PolarHBondContact O-N 2.92Å; K79-R83 WeakPolarHBondContact O-CB 3.21Å; K79-R83 WeakPolarHBondContact O-CG 3.23Å; K79-R83 PolarHBondContact O-N 2.83Å; K79-L88 HydrophobicContact CB-CD1 4.47Å; K79-L88 HydrophobicContact CG-CD1 4.4Å |
| 80 | A | 91.1 | Very high | 85.2 | Confident | 48 Ų | 48 | 100 Ų | 100 | 40% | 0.397 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.5 | -40 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | D76 L77 A78 R83 R84 | D76-A80 WeakPolarHBondContact O-CB 3.06Å; D76-A80 PolarHBondContact O-N 2.95Å; L77-A80 PolarHBondContact O-N 3.19Å; A78-A80 VanDerWaalsContact C-N 3.35Å; A78-A80 PolarHBondContact O-N 2.76Å; A80-R83 PolarHBondContact O-N 3.04Å; A80-R84 WeakPolarHBondContact O-CG 3.26Å; A80-R84 PolarHBondContact O-N 2.88Å |
| 81 | V | 92 | Very high | 83.2 | Confident | 67 Ų | 67 | 98 Ų | 98 | 41% | 0.406 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.6 | -49 | 175 | 171.3 | 0 | 0 | 0 | 0 | 110.9 | L77 A78 K79 R83 R84 K85 | L77-V81 HydrophobicContact CD1-CG2 4.41Å; L77-V81 WeakPolarHBondContact O-CG2 3.06Å; L77-V81 PolarHBondContact O-N 3.24Å; A78-V81 PolarHBondContact O-N 3.14Å; K79-V81 VanDerWaalsContact C-N 3.35Å; K79-V81 PolarHBondContact O-N 3.12Å; V81-R83 VanDerWaalsContact C-N 3.28Å; V81-R83 PolarHBondContact O-N 3.25Å; V81-R84 PolarHBondContact O-N 2.79Å; V81-K85 WeakPolarHBondContact O-CB 3.31Å; V81-K85 PolarHBondContact O-N 3.5Å |
| 82 | L | 85.5 | Confident | 81.2 | Confident | 59 Ų | 59 | 100.1 Ų | 100.1 | 31% | 0.309 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.2 | -32.3 | 177.4 | -91.1 | 102.3 | 0 | 0 | 0 | 112.7 | A78 K79 K85 G86 M87 L88 | A78-L82 WeakPolarHBondContact O-CD1 3.16Å; A78-L82 PolarHBondContact O-N 3.19Å; K79-L82 PolarHBondContact O-N 2.92Å; L82-K85 CarbonylContact O-C 3.55Å; L82-K85 PolarHBondContact O-N 3.11Å; L82-G86 PolarHBondContact O-N 3.17Å; L82-M87 HydrophobicContact CB-CB 4.46Å; L82-M87 HydrophobicContact CD2-CB 3.98Å; L82-M87 HydrophobicContact CD2-CE 4.09Å; L82-M87 HydrophobicContact CD2-SD 4.32Å; L82-M87 HydrophobicContact CG-CB 4.42Å; L82-M87 HydrophobicContact CG-SD 4.43Å; L82-M87 PolarHBondContact O-N 3.39Å; L82-L88 HydrophobicContact CB-CB 4.12Å; L82-L88 HydrophobicContact CB-CD1 3.32Å; L82-L88 HydrophobicContact CB-CG 3.63Å; L82-L88 HydrophobicContact CD2-CD1 3.9Å; L82-L88 HydrophobicContact CD2-CG 3.72Å; L82-L88 HydrophobicContact CG-CD1 4.1Å; L82-L88 HydrophobicContact CG-CG 4.29Å; L82-L88 PolarHBondContact O-N 3.11Å |
| 83 | R | 86.6 | Confident | 78.8 | Confident | 137 Ų | 137 | 101.9 Ų | 101.9 | 52% | 0.517 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65.7 | -45.8 | 173.1 | -70.3 | -76.5 | 159 | -172.1 | -11.9 | 111.4 | K79 A80 V81 K85 G86 L88 G89 | K79-R83 WeakPolarHBondContact O-CB 3.21Å; K79-R83 WeakPolarHBondContact O-CG 3.23Å; K79-R83 PolarHBondContact O-N 2.83Å; A80-R83 PolarHBondContact O-N 3.04Å; V81-R83 VanDerWaalsContact C-N 3.28Å; V81-R83 PolarHBondContact O-N 3.25Å; R83-K85 VanDerWaalsContact C-N 3.26Å; R83-K85 PolarHBondContact O-N 3.28Å; R83-G86 PolarHBondContact O-N 2.78Å; R83-L88 HydrophobicContact CG-CB 4.2Å; R83-L88 PolarHBondContact NH1-O 3.23Å; R83-L88 VanDerWaalsContact NH2-C 3.3Å; R83-L88 PolarHBondContact NH2-O 3.37Å; R83-G89 VanDerWaalsContact NH1-CA 3.25Å |
| 84 | R | 84.8 | Confident | 76.7 | Confident | 207 Ų | 207 | 105 Ų | 105 | 78% | 0.781 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -62.8 | -32.3 | 173.5 | -72.7 | -166.6 | -63.2 | 161.7 | -1.1 | 112.7 | A80 V81 G86 | A80-R84 WeakPolarHBondContact O-CG 3.26Å; A80-R84 PolarHBondContact O-N 2.88Å; V81-R84 PolarHBondContact O-N 2.79Å; R84-G86 PolarHBondContact O-N 2.9Å |
| 85 | K | 82 | Confident | 74.7 | Confident | 161 Ų | 161 | 104.6 Ų | 104.6 | 70% | 0.7 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | -1.8 | 174.9 | -162.3 | 65 | 172.7 | -170.5 | 0 | 113 | V81 L82 R83 M87 | V81-K85 WeakPolarHBondContact O-CB 3.31Å; V81-K85 PolarHBondContact O-N 3.5Å; L82-K85 CarbonylContact O-C 3.55Å; L82-K85 PolarHBondContact O-N 3.11Å; R83-K85 VanDerWaalsContact C-N 3.26Å; R83-K85 PolarHBondContact O-N 3.28Å; K85-M87 HydrophobicContact CB-CG 4.19Å; K85-M87 HydrophobicContact CB-SD 4.26Å; K85-M87 HydrophobicContact CG-CG 3.94Å; K85-M87 HydrophobicContact CG-SD 3.75Å; K85-M87 PolarHBondContact O-N 3.38Å |
| 86 | G | 77.8 | Confident | 72.4 | Confident | 51 Ų | 51 | 104.9 Ų | 104.9 | 53% | 0.526 | 57% | 0.574 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 73.7 | -1.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | L82 R83 R84 | L82-G86 PolarHBondContact O-N 3.17Å; R83-G86 PolarHBondContact O-N 2.78Å; R84-G86 PolarHBondContact O-N 2.9Å |
| 87 | M | 69.3 | Low | 70.8 | Confident | 129 Ų | 129 | 106.8 Ų | 106.8 | 64% | 0.635 | 59% | 0.594 | S | S | * | * | S | Bend | trans | -75.9 | -32.4 | -172.8 | -67.2 | 175.7 | 66.7 | 0 | 0 | 113.4 | L82 K85 | L82-M87 HydrophobicContact CB-CB 4.46Å; L82-M87 HydrophobicContact CD2-CB 3.98Å; L82-M87 HydrophobicContact CD2-CE 4.09Å; L82-M87 HydrophobicContact CD2-SD 4.32Å; L82-M87 HydrophobicContact CG-CB 4.42Å; L82-M87 HydrophobicContact CG-SD 4.43Å; L82-M87 PolarHBondContact O-N 3.39Å; K85-M87 HydrophobicContact CB-CG 4.19Å; K85-M87 HydrophobicContact CB-SD 4.26Å; K85-M87 HydrophobicContact CG-CG 3.94Å; K85-M87 HydrophobicContact CG-SD 3.75Å; K85-M87 PolarHBondContact O-N 3.38Å |
| 88 | L | 61 | Low | 69 | Low | 64 Ų | 64 | 106.2 Ų | 106.2 | 34% | 0.335 | 60% | 0.598 | S | S | . | * | S | Bend | trans | -93.3 | -15.1 | 179.7 | -84.2 | 176 | 0 | 0 | 0 | 111.4 | K79 L82 R83 A90 | K79-L88 HydrophobicContact CB-CD1 4.47Å; K79-L88 HydrophobicContact CG-CD1 4.4Å; L82-L88 HydrophobicContact CB-CB 4.12Å; L82-L88 HydrophobicContact CB-CD1 3.32Å; L82-L88 HydrophobicContact CB-CG 3.63Å; L82-L88 HydrophobicContact CD2-CD1 3.9Å; L82-L88 HydrophobicContact CD2-CG 3.72Å; L82-L88 HydrophobicContact CG-CD1 4.1Å; L82-L88 HydrophobicContact CG-CG 4.29Å; L82-L88 PolarHBondContact O-N 3.11Å; R83-L88 HydrophobicContact CG-CB 4.2Å; R83-L88 PolarHBondContact NH1-O 3.23Å; R83-L88 VanDerWaalsContact NH2-C 3.3Å; R83-L88 PolarHBondContact NH2-O 3.37Å; L88-A90 PolarHBondContact O-N 3.21Å |
| 89 | G | 59.5 | Low | 67.1 | Low | 53 Ų | 53 | 107.2 Ų | 107.2 | 55% | 0.546 | 61% | 0.613 | S | S | . | * | trans | -66.3 | -18.6 | -175 | 0 | 0 | 0 | 0 | 0 | 117.9 | R83 | R83-G89 VanDerWaalsContact NH1-CA 3.25Š| ||
| 90 | A | 53.2 | Low | 65.6 | Low | 81 Ų | 81 | 110.8 Ų | 110.8 | 67% | 0.669 | 63% | 0.629 | S | S | * | * | S | Bend | trans | -89.8 | 125.8 | -174.2 | 0 | 0 | 0 | 0 | 0 | 111 | L88 | L88-A90 PolarHBondContact O-N 3.21Š|
| 91 | S | 52.8 | Low | 64.3 | Low | 73 Ų | 73 | 119.3 Ų | 119.3 | 51% | 0.51 | 65% | 0.651 | S | S | . | * | trans | -39.3 | 151.3 | 157.1 | 177.5 | 0 | 0 | 0 | 0 | 110.9 | N93 | S91-N93 PolarHBondContact O-N 3.03Å; S91-N93 PolarHBondContact OG-ND2 2.97Å; S91-N93 VanDerWaalsContact OG-ND2 3.09Å | ||
| 92 | P | 53 | Low | 63 | Low | 133 Ų | 133 | 121.6 Ų | 121.6 | 86% | 0.864 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -71 | 68.4 | 168.2 | 33.5 | -34.1 | 0 | 0 | 0 | 108.3 | ||
| 93 | N | 44.3 | Very low | 62.2 | Low | 124 Ų | 124 | 124.6 Ų | 124.6 | 66% | 0.663 | 69% | 0.691 | S | S | * | * | trans | -134 | 104 | 173.1 | -93.3 | -75.6 | 0 | 0 | 0 | 106 | S91 | S91-N93 PolarHBondContact O-N 3.03Å; S91-N93 PolarHBondContact OG-ND2 2.97Å; S91-N93 VanDerWaalsContact OG-ND2 3.09Å | ||
| 94 | R | 51.6 | Low | 61.8 | Low | 202 Ų | 202 | 127.2 Ų | 127.2 | 76% | 0.762 | 71% | 0.705 | S | S | * | * | trans | 59 | 115.5 | 146.8 | -155.2 | -179.8 | -177.1 | 169.3 | 1.7 | 114.7 | D96 | R94-D96 PolarHBondContact O-N 3.39Š| ||
| 95 | P | 53.8 | Low | 61.1 | Low | 122 Ų | 122 | 123.6 Ų | 123.6 | 79% | 0.792 | 70% | 0.696 | S | S | * | * | trans | -60.1 | 107.6 | 164.9 | 26.5 | -30.1 | 0 | 0 | 0 | 106.8 | S97 | P95-S97 VanDerWaalsContact C-N 3.25Å; P95-S97 PolarHBondContact O-N 3.2Å | ||
| 96 | D | 47.2 | Very low | 61 | Low | 146 Ų | 146 | 121.7 Ų | 121.7 | 78% | 0.781 | 69% | 0.693 | S | S | * | * | trans | -60.5 | 98.3 | 170.7 | -79.4 | -40 | 0 | 0 | 0 | 106.7 | R94 S98 | R94-D96 PolarHBondContact O-N 3.39Å; D96-S98 PolarHBondContact O-N 2.83Å | ||
| 97 | S | 61.3 | Low | 61.2 | Low | 114 Ų | 114 | 129.6 Ų | 129.6 | 80% | 0.797 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -65.3 | 73 | 171.7 | 58.4 | 0 | 0 | 0 | 0 | 108.9 | P95 | P95-S97 VanDerWaalsContact C-N 3.25Å; P95-S97 PolarHBondContact O-N 3.2Å |
| 98 | S | 56.8 | Low | 61.6 | Low | 94 Ų | 94 | 126.8 Ų | 126.8 | 66% | 0.657 | 72% | 0.718 | S | S | * | * | trans | -158.7 | 33.8 | 172.7 | -172.7 | 0 | 0 | 0 | 0 | 112.8 | D96 K100 | D96-S98 PolarHBondContact O-N 2.83Å; S98-K100 PolarHBondContact O-N 3.04Å | ||
| 99 | G | 54.2 | Low | 62 | Low | 71 Ų | 71 | 132.2 Ų | 132.2 | 73% | 0.732 | 74% | 0.735 | S | S | * | * | trans | -84.2 | 66.3 | 161.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | R101 | G99-R101 PolarHBondContact O-N 2.91Š| ||
| 100 | K | 60.4 | Low | 62.7 | Low | 190 Ų | 190 | 135.3 Ų | 135.3 | 83% | 0.826 | 74% | 0.743 | S | S | * | * | trans | -67.8 | 76.9 | 174 | -61.3 | -154.8 | -177.4 | -170.8 | 0 | 109.9 | S98 S102 | S98-K100 PolarHBondContact O-N 3.04Å; K100-S102 PolarHBondContact O-N 3.5Å | ||
| 101 | R | 62.8 | Low | 63.6 | Low | 227 Ų | 227 | 135.7 Ų | 135.7 | 86% | 0.857 | 75% | 0.747 | S | S | * | * | trans | -72.4 | 90.2 | 156.9 | -66.3 | -171.5 | -63.2 | -160.7 | 0.5 | 105.4 | G99 V103 | G99-R101 PolarHBondContact O-N 2.91Å; R101-V103 VanDerWaalsContact C-N 3.27Å; R101-V103 PolarHBondContact O-N 3.43Å | ||
| 102 | S | 65 | Low | 64.5 | Low | 115 Ų | 115 | 139.5 Ų | 139.5 | 80% | 0.804 | 76% | 0.76 | S | S | * | * | trans | -67.6 | 92.2 | 173.5 | 57.2 | 0 | 0 | 0 | 0 | 108.2 | K100 K104 | K100-S102 PolarHBondContact O-N 3.5Å; S102-K104 PolarHBondContact O-N 3.43Å | ||
| 103 | V | 69.1 | Low | 65.4 | Low | 123 Ų | 123 | 138.1 Ų | 138.1 | 75% | 0.745 | 75% | 0.754 | S | S | * | * | trans | -72 | 118.8 | 168.3 | 179.6 | 0 | 0 | 0 | 0 | 106.5 | R101 F105 | R101-V103 VanDerWaalsContact C-N 3.27Å; R101-V103 PolarHBondContact O-N 3.43Å; V103-F105 PolarHBondContact O-N 3.43Å | ||
| 104 | K | 77.4 | Confident | 66.5 | Low | 191 Ų | 191 | 141.1 Ų | 141.1 | 83% | 0.83 | 76% | 0.764 | S | S | * | * | trans | -67.9 | 104.9 | 174.6 | -178.6 | -177.4 | 175.9 | -175.5 | 0 | 107.7 | S102 | S102-K104 PolarHBondContact O-N 3.43Š| ||
| 105 | F | 71.1 | Confident | 67.4 | Low | 131 Ų | 131 | 134 Ų | 134 | 58% | 0.575 | 75% | 0.745 | S | S | * | * | trans | -69.9 | 140.2 | 172.3 | 60.8 | -94.4 | 0 | 0 | 0 | 109.6 | V103 Y109 | V103-F105 PolarHBondContact O-N 3.43Å; F105-Y109 WeakPolarHBondContact CB-O 3.43Å; F105-Y109 WeakPolarHBondContact CD2-O 3.21Å; F105-Y109 VanDerWaalsContact CG-O 3.24Å; F105-Y109 WeakPolarHBondContact CG-O 3.37Å | ||
| 106 | N | 78.8 | Confident | 67.9 | Low | 122 Ų | 122 | 134 Ų | 134 | 65% | 0.652 | 75% | 0.745 | S | S | * | * | trans | -67.1 | 147.2 | 172.1 | -71.7 | -61.2 | 0 | 0 | 0 | 109.6 | G108 Y109 | N106-G108 PolarHBondContact O-N 3.27Å; N106-G108 VanDerWaalsContact O-N 3.07Å; N106-Y109 HydrophobicContact CB-CD2 4.39Å; N106-Y109 PolarHBondContact O-N 2.95Å | ||
| 107 | K | 81.6 | Confident | 68.6 | Low | 216 Ų | 216 | 134 Ų | 134 | 94% | 0.939 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.9 | 115.5 | -177.2 | -162.7 | 139.7 | 178.4 | 176.5 | 0 | 109.4 | ||
| 108 | G | 77.9 | Confident | 68.9 | Low | 71 Ų | 71 | 133.2 Ų | 133.2 | 73% | 0.732 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 117.2 | -13.9 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | N106 | N106-G108 PolarHBondContact O-N 3.27Å; N106-G108 VanDerWaalsContact O-N 3.07Å |
| 109 | Y | 69.6 | Low | 69.3 | Low | 178 Ų | 178 | 133.9 Ų | 133.9 | 70% | 0.698 | 73% | 0.725 | S | S | * | * | trans | -108.5 | 108.1 | 175.8 | -70.3 | -86.3 | 0 | 0 | 0 | 110.4 | F105 N106 | F105-Y109 WeakPolarHBondContact CB-O 3.43Å; F105-Y109 WeakPolarHBondContact CD2-O 3.21Å; F105-Y109 VanDerWaalsContact CG-O 3.24Å; F105-Y109 WeakPolarHBondContact CG-O 3.37Å; N106-Y109 HydrophobicContact CB-CD2 4.39Å; N106-Y109 PolarHBondContact O-N 2.95Å | ||
| 110 | T | 75.6 | Confident | 70 | Confident | 117 Ų | 117 | 138 Ų | 138 | 72% | 0.718 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -86.8 | 129.2 | 171.9 | 70.2 | 0 | 0 | 0 | 0 | 108.9 | L112 | T110-L112 PolarHBondContact O-N 3.41Š|
| 111 | A | 71.4 | Confident | 70.1 | Confident | 90 Ų | 90 | 133.4 Ų | 133.4 | 74% | 0.744 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 123.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||
| 112 | L | 72.4 | Confident | 70.5 | Confident | 152 Ų | 152 | 126.3 Ų | 126.3 | 80% | 0.796 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 138.3 | 169.7 | -64.7 | 174.1 | 0 | 0 | 0 | 108.3 | T110 Q114 | T110-L112 PolarHBondContact O-N 3.41Å; L112-Q114 PolarHBondContact O-N 2.95Å |
| 113 | S | 71.8 | Confident | 70.3 | Confident | 105 Ų | 105 | 128.3 Ų | 128.3 | 73% | 0.734 | 70% | 0.703 | S | S | * | * | trans | -65.2 | 102.1 | 177.3 | 52.6 | 0 | 0 | 0 | 0 | 108.9 | S115 | S113-S115 VanDerWaalsContact C-N 3.31Å; S113-S115 PolarHBondContact O-N 3.48Å; S113-S115 VanDerWaalsContact O-N 3.14Å | ||
| 114 | Q | 67.8 | Low | 70 | Confident | 187 Ų | 187 | 128.1 Ų | 128.1 | 87% | 0.874 | 70% | 0.698 | S | S | * | * | trans | -80 | 85.9 | 167.4 | -63.4 | -179.6 | -42.1 | 0 | 0 | 106.7 | L112 | L112-Q114 PolarHBondContact O-N 2.95Š| ||
| 115 | S | 70.4 | Confident | 69.3 | Low | 53 Ų | 53 | 124 Ų | 124 | 37% | 0.371 | 69% | 0.693 | S | S | . | * | trans | -74 | 142 | 168.4 | 80.5 | 0 | 0 | 0 | 0 | 108.1 | S113 D117 E118 | S113-S115 VanDerWaalsContact C-N 3.31Å; S113-S115 PolarHBondContact O-N 3.48Å; S113-S115 VanDerWaalsContact O-N 3.14Å; S115-D117 PolarHBondContact O-N 3.21Å; S115-E118 VanDerWaalsContact CA-OE1 3.23Å; S115-E118 WeakPolarHBondContact CA-OE1 3.36Å; S115-E118 WeakPolarHBondContact CB-OE1 3.44Å; S115-E118 PolarHBondContact N-OE1 2.91Å; S115-E118 VanDerWaalsContact O-CG 3.26Å; S115-E118 WeakPolarHBondContact O-CG 3.39Å; S115-E118 VanDerWaalsContact O-OE1 3.05Å; S115-E118 PolarHBondContact OG-OE1 3.33Å | ||
| 116 | P | 63.2 | Low | 69 | Low | 121 Ų | 121 | 125 Ų | 125 | 79% | 0.786 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.3 | -8.1 | 177.5 | 29.7 | -35.1 | 0 | 0 | 0 | 112.9 | ||
| 117 | D | 62.9 | Low | 68.1 | Low | 145 Ų | 145 | 124.4 Ų | 124.4 | 78% | 0.775 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.3 | -8.8 | -174.1 | -58.3 | -48.3 | 0 | 0 | 0 | 112.9 | S115 N119 | S115-D117 PolarHBondContact O-N 3.21Å; D117-N119 VanDerWaalsContact C-N 3.34Å; D117-N119 PolarHBondContact O-N 2.7Å; D117-N119 VanDerWaalsContact O-N 3.12Å |
| 118 | E | 67.7 | Low | 67.2 | Low | 99 Ų | 99 | 121.5 Ų | 121.5 | 46% | 0.463 | 71% | 0.705 | S | S | . | * | trans | -83.8 | 80.7 | 168.8 | 59.4 | -141.7 | 96.3 | 0 | 0 | 109.8 | S115 L120 | S115-E118 VanDerWaalsContact CA-OE1 3.23Å; S115-E118 WeakPolarHBondContact CA-OE1 3.36Å; S115-E118 WeakPolarHBondContact CB-OE1 3.44Å; S115-E118 PolarHBondContact N-OE1 2.91Å; S115-E118 VanDerWaalsContact O-CG 3.26Å; S115-E118 WeakPolarHBondContact O-CG 3.39Å; S115-E118 VanDerWaalsContact O-OE1 3.05Å; S115-E118 PolarHBondContact OG-OE1 3.33Å; E118-L120 VanDerWaalsContact C-N 3.34Å; E118-L120 PolarHBondContact O-N 3.44Å | ||
| 119 | N | 64.3 | Low | 66.3 | Low | 108 Ų | 108 | 120.6 Ų | 120.6 | 58% | 0.578 | 70% | 0.695 | S | S | * | * | trans | -66.6 | 90.1 | 176.4 | -171.7 | 11.7 | 0 | 0 | 0 | 110.4 | D117 V121 | D117-N119 VanDerWaalsContact C-N 3.34Å; D117-N119 PolarHBondContact O-N 2.7Å; D117-N119 VanDerWaalsContact O-N 3.12Å; N119-V121 PolarHBondContact ND2-O 2.86Å; N119-V121 PolarHBondContact O-N 2.97Å; N119-V121 VanDerWaalsContact O-N 3.17Å; N119-V121 VanDerWaalsContact OD1-C 3.29Å; N119-V121 PolarHBondContact OD1-N 3.4Å; N119-V121 PolarHBondContact OD1-O 3.38Å | ||
| 120 | L | 69.8 | Low | 65.8 | Low | 156 Ų | 156 | 120.3 Ų | 120.3 | 82% | 0.817 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -70.5 | -2.5 | 177.7 | -59.3 | -177.6 | 0 | 0 | 0 | 113.2 | E118 | E118-L120 VanDerWaalsContact C-N 3.34Å; E118-L120 PolarHBondContact O-N 3.44Å |
| 121 | V | 62 | Low | 64.8 | Low | 95 Ų | 95 | 120.8 Ų | 120.8 | 58% | 0.576 | 70% | 0.698 | S | S | * | * | trans | -146.2 | 93.7 | -174.9 | -137.3 | 0 | 0 | 0 | 0 | 110.2 | N119 L123 | N119-V121 PolarHBondContact ND2-O 2.86Å; N119-V121 PolarHBondContact O-N 2.97Å; N119-V121 VanDerWaalsContact O-N 3.17Å; N119-V121 VanDerWaalsContact OD1-C 3.29Å; N119-V121 PolarHBondContact OD1-N 3.4Å; N119-V121 PolarHBondContact OD1-O 3.38Å; V121-L123 HydrophobicContact CB-CD2 4.48Å; V121-L123 HydrophobicContact CG1-CD2 4.21Å; V121-L123 PolarHBondContact O-N 2.64Å; V121-L123 VanDerWaalsContact O-N 3.11Å | ||
| 122 | S | 70.6 | Confident | 63.8 | Low | 78 Ų | 78 | 125.2 Ų | 125.2 | 55% | 0.545 | 70% | 0.703 | S | S | . | * | trans | -65.3 | 105.4 | 164.4 | -67.5 | 0 | 0 | 0 | 0 | 109 | D124 | S122-D124 VanDerWaalsContact CA-OD1 3.31Å; S122-D124 WeakPolarHBondContact CA-OD1 3.41Å; S122-D124 WeakPolarHBondContact CB-OD1 3.1Å; S122-D124 PolarHBondContact O-N 2.67Å | ||
| 123 | L | 60.6 | Low | 63.1 | Low | 157 Ų | 157 | 121.8 Ų | 121.8 | 82% | 0.822 | 69% | 0.692 | S | S | * | * | trans | -82.9 | 5 | 178.3 | -63 | 178.6 | 0 | 0 | 0 | 112.7 | V121 S125 | V121-L123 HydrophobicContact CB-CD2 4.48Å; V121-L123 HydrophobicContact CG1-CD2 4.21Å; V121-L123 PolarHBondContact O-N 2.64Å; V121-L123 VanDerWaalsContact O-N 3.11Å; L123-S125 VanDerWaalsContact C-N 3.31Å; L123-S125 PolarHBondContact O-N 3.29Å | ||
| 124 | D | 62.4 | Low | 62.3 | Low | 118 Ų | 118 | 127.9 Ų | 127.9 | 63% | 0.631 | 70% | 0.699 | S | S | * | * | trans | -90.4 | 27.9 | -178.8 | 48.9 | -67.5 | 0 | 0 | 0 | 113.6 | S122 D126 | S122-D124 VanDerWaalsContact CA-OD1 3.31Å; S122-D124 WeakPolarHBondContact CA-OD1 3.41Å; S122-D124 WeakPolarHBondContact CB-OD1 3.1Å; S122-D124 PolarHBondContact O-N 2.67Å; D124-D126 VanDerWaalsContact C-N 3.3Å; D124-D126 PolarHBondContact O-N 3.05Å; D124-D126 VanDerWaalsContact O-N 3.1Å | ||
| 125 | S | 64.3 | Low | 61.7 | Low | 105 Ų | 105 | 130.5 Ų | 130.5 | 73% | 0.734 | 70% | 0.702 | S | S | * | * | trans | -80.1 | 79.7 | 164.5 | -73.6 | 0 | 0 | 0 | 0 | 110.4 | L123 S127 | L123-S125 VanDerWaalsContact C-N 3.31Å; L123-S125 PolarHBondContact O-N 3.29Å; S125-S127 VanDerWaalsContact C-N 3.31Å; S125-S127 PolarHBondContact O-N 3.46Å | ||
| 126 | D | 63.2 | Low | 60.7 | Low | 151 Ų | 151 | 133.5 Ų | 133.5 | 81% | 0.807 | 72% | 0.723 | S | S | * | * | trans | -75 | 85.2 | 166 | -77.1 | -32.6 | 0 | 0 | 0 | 109.1 | D124 D128 | D124-D126 VanDerWaalsContact C-N 3.3Å; D124-D126 PolarHBondContact O-N 3.05Å; D124-D126 VanDerWaalsContact O-N 3.1Å; D126-D128 PolarHBondContact O-N 3.46Å | ||
| 127 | S | 61.6 | Low | 60.3 | Low | 110 Ų | 110 | 133.8 Ų | 133.8 | 77% | 0.769 | 73% | 0.729 | S | S | * | * | trans | -89.3 | 78.7 | 172.3 | 177 | 0 | 0 | 0 | 0 | 110.1 | S125 G129 | S125-S127 VanDerWaalsContact C-N 3.31Å; S125-S127 PolarHBondContact O-N 3.46Å; S127-G129 VanDerWaalsContact C-N 3.32Å; S127-G129 PolarHBondContact O-N 3.35Å | ||
| 128 | D | 62.5 | Low | 59.8 | Low | 156 Ų | 156 | 130.1 Ų | 130.1 | 83% | 0.834 | 72% | 0.724 | S | S | * | * | trans | -75 | 84.7 | 165.2 | -75.6 | -46.3 | 0 | 0 | 0 | 109.9 | D126 | D126-D128 PolarHBondContact O-N 3.46Š| ||
| 129 | G | 57.3 | Low | 59 | Low | 51 Ų | 51 | 135.7 Ų | 135.7 | 53% | 0.526 | 74% | 0.743 | S | S | . | * | trans | -106.7 | 66.1 | 175 | 0 | 0 | 0 | 0 | 0 | 111.9 | S127 L131 | S127-G129 VanDerWaalsContact C-N 3.32Å; S127-G129 PolarHBondContact O-N 3.35Å; G129-L131 PolarHBondContact O-N 2.95Å | ||
| 130 | E | 60.3 | Low | 58.6 | Low | 172 Ų | 172 | 134.6 Ų | 134.6 | 80% | 0.804 | 74% | 0.744 | S | S | * | * | trans | -66.5 | 98.9 | 162.3 | -70.9 | -86 | 116.2 | 0 | 0 | 108.2 | ||||
| 131 | L | 53.7 | Low | 57.8 | Low | 128 Ų | 128 | 132.2 Ų | 132.2 | 67% | 0.67 | 74% | 0.74 | S | S | * | * | trans | -141.9 | 90.5 | 159.7 | 30.9 | 147 | 0 | 0 | 0 | 109.8 | G129 S133 | G129-L131 PolarHBondContact O-N 2.95Å; L131-S133 PolarHBondContact O-N 3.06Å | ||
| 132 | E | 52.1 | Low | 57.4 | Low | 182 Ų | 182 | 130.6 Ų | 130.6 | 85% | 0.85 | 74% | 0.736 | S | S | * | * | trans | -48.6 | 93.8 | 142.1 | -81.5 | 122.3 | 113.6 | 0 | 0 | 109.5 | ||||
| 133 | S | 57 | Low | 56.7 | Low | 81 Ų | 81 | 132.6 Ų | 132.6 | 57% | 0.566 | 74% | 0.737 | S | S | * | * | trans | -146.3 | 97.4 | 165.4 | 57.4 | 0 | 0 | 0 | 0 | 109.6 | L131 | L131-S133 PolarHBondContact O-N 3.06Š| ||
| 134 | R | 55.6 | Low | 56.6 | Low | 232 Ų | 232 | 132.4 Ų | 132.4 | 88% | 0.875 | 73% | 0.732 | S | S | * | * | trans | 34.8 | 120.9 | 142.2 | -59.6 | -168.2 | -176.6 | -162.7 | 2.7 | 116.9 | S136 | R134-S136 PolarHBondContact O-N 3.34Š| ||
| 135 | Y | 53.7 | Low | 56.3 | Low | 242 Ų | 242 | 131.8 Ų | 131.8 | 95% | 0.949 | 73% | 0.732 | S | S | * | * | trans | -12.9 | 101.8 | 141 | -84.4 | -101.2 | 0 | 0 | 0 | 112.8 | ||||
| 136 | S | 50.8 | Low | 56.2 | Low | 116 Ų | 116 | 131.1 Ų | 131.1 | 81% | 0.811 | 72% | 0.721 | S | S | * | * | trans | -156.1 | 121.9 | 162.9 | -129.7 | 0 | 0 | 0 | 0 | 109.7 | R134 G138 | R134-S136 PolarHBondContact O-N 3.34Å; S136-G138 PolarHBondContact O-N 3.1Å | ||
| 137 | S | 55 | Low | 56.7 | Low | 128 Ų | 128 | 129.3 Ų | 129.3 | 90% | 0.895 | 71% | 0.707 | S | S | * | * | trans | -42.5 | 123.9 | -175.4 | -49.1 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 138 | G | 51.3 | Low | 57.6 | Low | 67 Ų | 67 | 128.6 Ų | 128.6 | 69% | 0.691 | 70% | 0.695 | S | S | * | * | trans | -136.8 | 27.4 | -175.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | S136 S140 | S136-G138 PolarHBondContact O-N 3.1Å; G138-S140 VanDerWaalsContact C-N 3.31Å; G138-S140 PolarHBondContact O-N 3.17Å; G138-S140 VanDerWaalsContact O-N 3.11Å | ||
| 139 | Y | 51.3 | Low | 58.6 | Low | 217 Ų | 217 | 124.9 Ų | 124.9 | 85% | 0.851 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80 | 80.8 | 166 | -68.8 | -82.9 | 0 | 0 | 0 | 109.1 | ||
| 140 | S | 56.6 | Low | 59.4 | Low | 85 Ų | 85 | 124.1 Ų | 124.1 | 59% | 0.594 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -139.1 | -4.8 | 173.2 | -162.3 | 0 | 0 | 0 | 0 | 114.5 | G138 | G138-S140 VanDerWaalsContact C-N 3.31Å; G138-S140 PolarHBondContact O-N 3.17Å; G138-S140 VanDerWaalsContact O-N 3.11Å |
| 141 | S | 51.7 | Low | 60.4 | Low | 105 Ų | 105 | 121.9 Ų | 121.9 | 73% | 0.734 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -105.4 | -10.5 | 175.8 | -54.2 | 0 | 0 | 0 | 0 | 113.8 | ||
| 142 | A | 52.9 | Low | 61.9 | Low | 61 Ų | 61 | 120.1 Ų | 120.1 | 50% | 0.504 | 64% | 0.637 | S | S | . | * | S | Bend | trans | -85.7 | -23.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q144 N146 | A142-Q144 VanDerWaalsContact C-N 3.33Å; A142-Q144 PolarHBondContact O-N 3.18Å; A142-N146 WeakPolarHBondContact O-CB 3.45Å; A142-N146 PolarHBondContact O-N 3.39Å |
| 143 | E | 57.3 | Low | 63.4 | Low | 120 Ų | 120 | 114 Ų | 114 | 56% | 0.561 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -68.5 | -28.8 | -173.9 | -63 | -164 | 119.3 | 0 | 0 | 113.7 | Q147 | E143-Q147 WeakPolarHBondContact O-CG 3.36Å; E143-Q147 PolarHBondContact O-N 3.02Å |
| 144 | Q | 57.6 | Low | 64.4 | Low | 153 Ų | 153 | 114.7 Ų | 114.7 | 72% | 0.715 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -82.6 | -39.6 | -172.7 | -134.4 | 155.2 | 27.6 | 0 | 0 | 112.9 | A142 N146 | A142-Q144 VanDerWaalsContact C-N 3.33Å; A142-Q144 PolarHBondContact O-N 3.18Å; Q144-N146 VanDerWaalsContact C-N 3.26Å |
| 145 | V | 56.1 | Low | 65.6 | Low | 105 Ų | 105 | 110.5 Ų | 110.5 | 64% | 0.636 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -72.4 | -26.8 | 173.1 | -138.4 | 0 | 0 | 0 | 0 | 111.1 | V149 | V145-V149 WeakPolarHBondContact O-CG2 3.39Å |
| 146 | N | 61.9 | Low | 67.1 | Low | 91 Ų | 91 | 103.5 Ų | 103.5 | 49% | 0.487 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -73.3 | -35.7 | 178.4 | -161.9 | -1.6 | 0 | 0 | 0 | 111.5 | A142 Q144 D148 V149 S150 | A142-N146 WeakPolarHBondContact O-CB 3.45Å; A142-N146 PolarHBondContact O-N 3.39Å; Q144-N146 VanDerWaalsContact C-N 3.26Å; N146-D148 PolarHBondContact O-N 2.91Å; N146-V149 PolarHBondContact O-N 3.37Å; N146-S150 WeakPolarHBondContact O-CB 3.48Å; N146-S150 PolarHBondContact O-N 3.41Å; N146-S150 PolarHBondContact O-OG 3.46Å; N146-S150 PolarHBondContact OD1-OG 2.86Å |
| 147 | Q | 74.9 | Confident | 68.3 | Low | 114 Ų | 114 | 100.4 Ų | 100.4 | 53% | 0.533 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -60.9 | -41.7 | 179.5 | -80.5 | -179.1 | 46 | 0 | 0 | 114.3 | E143 S150 R151 | E143-Q147 WeakPolarHBondContact O-CG 3.36Å; E143-Q147 PolarHBondContact O-N 3.02Å; Q147-S150 PolarHBondContact O-N 2.94Å; Q147-R151 VanDerWaalsContact O-CG 3.29Å; Q147-R151 WeakPolarHBondContact O-CG 3.07Å; Q147-R151 PolarHBondContact O-N 2.93Å; Q147-R151 PolarHBondContact O-NH1 3.3Å |
| 148 | D | 80.9 | Confident | 69.2 | Low | 95 Ų | 95 | 102 Ų | 102 | 51% | 0.508 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -70.3 | -39.7 | -178.8 | -70.7 | 14.1 | 0 | 0 | 0 | 111.2 | N146 R151 Q152 | N146-D148 PolarHBondContact O-N 2.91Å; D148-R151 PolarHBondContact O-N 3.09Å; D148-R151 IonicContact OD1-CZ 3.06Å; D148-R151 IonicContact OD1-NH1 2.75Å; D148-R151 PolarHBondContact OD1-NH1 2.84Å; D148-R151 IonicContact OD1-NH2 2.62Å; D148-R151 PolarHBondContact OD1-NH2 2.83Å; D148-R151 IonicContact OD2-NH2 3.61Å; D148-Q152 PolarHBondContact O-N 3.06Å |
| 149 | V | 81.6 | Confident | 70.2 | Confident | 78 Ų | 78 | 104.8 Ų | 104.8 | 47% | 0.473 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -65.9 | -43.8 | 174 | 175 | 0 | 0 | 0 | 0 | 110.6 | V145 N146 R151 Q152 L153 | V145-V149 WeakPolarHBondContact O-CG2 3.39Å; N146-V149 PolarHBondContact O-N 3.37Å; V149-R151 VanDerWaalsContact C-N 3.33Å; V149-R151 PolarHBondContact O-N 2.05Å; V149-Q152 PolarHBondContact O-N 3.06Å; V149-Q152 VanDerWaalsContact O-N 3.13Å; V149-L153 HydrophobicContact CG1-CD1 3.9Å; V149-L153 HydrophobicContact CG1-CG 4.28Å; V149-L153 VanDerWaalsContact O-CG 3.29Å; V149-L153 WeakPolarHBondContact O-CG 3.29Å; V149-L153 PolarHBondContact O-N 3.5Å |
| 150 | S | 75.6 | Confident | 71.3 | Confident | 35 Ų | 35 | 99.8 Ų | 99.8 | 25% | 0.245 | 53% | 0.532 | C | S | . | . | H | α-helix | trans | -58.4 | -44.4 | 173.6 | -61.6 | 0 | 0 | 0 | 0 | 111.2 | N146 Q147 Q152 L153 L154 | N146-S150 WeakPolarHBondContact O-CB 3.48Å; N146-S150 PolarHBondContact O-N 3.41Å; N146-S150 PolarHBondContact O-OG 3.46Å; N146-S150 PolarHBondContact OD1-OG 2.86Å; Q147-S150 PolarHBondContact O-N 2.94Å; S150-Q152 VanDerWaalsContact C-N 3.31Å; S150-Q152 PolarHBondContact O-N 3.23Å; S150-L153 PolarHBondContact O-N 3.45Å; S150-L154 WeakPolarHBondContact O-CB 3.49Å; S150-L154 WeakPolarHBondContact O-CD1 3.48Å; S150-L154 PolarHBondContact O-N 3.4Å |
| 151 | R | 80.8 | Confident | 71.7 | Confident | 124 Ų | 124 | 102.4 Ų | 102.4 | 47% | 0.468 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.9 | -33.7 | 176.2 | -71.2 | -169.7 | -42.9 | -90.4 | 5.5 | 113 | Q147 D148 V149 Q155 | Q147-R151 VanDerWaalsContact O-CG 3.29Å; Q147-R151 WeakPolarHBondContact O-CG 3.07Å; Q147-R151 PolarHBondContact O-N 2.93Å; Q147-R151 PolarHBondContact O-NH1 3.3Å; D148-R151 PolarHBondContact O-N 3.09Å; D148-R151 IonicContact OD1-CZ 3.06Å; D148-R151 IonicContact OD1-NH1 2.75Å; D148-R151 PolarHBondContact OD1-NH1 2.84Å; D148-R151 IonicContact OD1-NH2 2.62Å; D148-R151 PolarHBondContact OD1-NH2 2.83Å; D148-R151 IonicContact OD2-NH2 3.61Å; V149-R151 VanDerWaalsContact C-N 3.33Å; V149-R151 PolarHBondContact O-N 2.05Å; R151-Q155 VanDerWaalsContact O-CG 3.32Å; R151-Q155 WeakPolarHBondContact O-CG 3.46Å; R151-Q155 PolarHBondContact O-N 2.88Å; R151-Q155 VanDerWaalsContact O-N 3.13Å; R151-Q155 PolarHBondContact O-NE2 3.34Å |
| 152 | Q | 85.6 | Confident | 72.2 | Confident | 91 Ų | 91 | 105.9 Ų | 105.9 | 43% | 0.425 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -71.3 | -44.9 | 175.1 | -176.6 | 61 | 47 | 0 | 0 | 111.4 | D148 V149 S150 L154 Q155 D156 | D148-Q152 PolarHBondContact O-N 3.06Å; V149-Q152 PolarHBondContact O-N 3.06Å; V149-Q152 VanDerWaalsContact O-N 3.13Å; S150-Q152 VanDerWaalsContact C-N 3.31Å; S150-Q152 PolarHBondContact O-N 3.23Å; Q152-L154 VanDerWaalsContact C-N 3.32Å; Q152-L154 PolarHBondContact O-N 2.93Å; Q152-Q155 WeakPolarHBondContact O-CA 3.38Å; Q152-Q155 WeakPolarHBondContact O-CB 3.28Å; Q152-Q155 PolarHBondContact O-N 3.31Å; Q152-Q155 VanDerWaalsContact O-N 3.08Å; Q152-D156 VanDerWaalsContact NE2-CG 3.25Å; Q152-D156 PolarHBondContact NE2-OD1 3.07Å; Q152-D156 PolarHBondContact NE2-OD2 3.09Å; Q152-D156 WeakPolarHBondContact O-CB 3.16Å; Q152-D156 VanDerWaalsContact O-CG 3.29Å; Q152-D156 PolarHBondContact O-N 3.21Å |
| 153 | L | 83.4 | Confident | 72.8 | Confident | 55 Ų | 55 | 108.9 Ų | 108.9 | 29% | 0.288 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -60.9 | -42 | 177.4 | -69.1 | 170.9 | 0 | 0 | 0 | 111.4 | V149 S150 Q155 D156 G157 Y158 | V149-L153 HydrophobicContact CG1-CD1 3.9Å; V149-L153 HydrophobicContact CG1-CG 4.28Å; V149-L153 VanDerWaalsContact O-CG 3.29Å; V149-L153 WeakPolarHBondContact O-CG 3.29Å; V149-L153 PolarHBondContact O-N 3.5Å; S150-L153 PolarHBondContact O-N 3.45Å; L153-Q155 VanDerWaalsContact C-N 3.35Å; L153-Q155 PolarHBondContact O-N 2.91Å; L153-D156 CarbonylContact O-C 3.58Å; L153-D156 PolarHBondContact O-N 2.98Å; L153-G157 PolarHBondContact O-N 3.02Å; L153-Y158 CarbonylContact C-O 3.55Å; L153-Y158 CarbonylContact O-C 3.55Å; L153-Y158 WeakPolarHBondContact O-CA 3.34Å; L153-Y158 WeakPolarHBondContact O-CB 3.44Å; L153-Y158 PolarHBondContact O-N 3.13Å |
| 154 | L | 77.7 | Confident | 73.1 | Confident | 94 Ų | 94 | 107 Ų | 107 | 49% | 0.492 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.9 | -39.3 | 173.1 | -91.9 | 68.8 | 0 | 0 | 0 | 112.2 | S150 Q152 D156 G157 | S150-L154 WeakPolarHBondContact O-CB 3.49Å; S150-L154 WeakPolarHBondContact O-CD1 3.48Å; S150-L154 PolarHBondContact O-N 3.4Å; Q152-L154 VanDerWaalsContact C-N 3.32Å; Q152-L154 PolarHBondContact O-N 2.93Å; L154-D156 VanDerWaalsContact C-N 3.31Å; L154-G157 PolarHBondContact O-N 3.04Å |
| 155 | Q | 81.8 | Confident | 73.3 | Confident | 144 Ų | 144 | 107 Ų | 107 | 67% | 0.673 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65.1 | -35.4 | 174.6 | -82.3 | 167.3 | 71.5 | 0 | 0 | 112.4 | R151 Q152 L153 G157 | R151-Q155 VanDerWaalsContact O-CG 3.32Å; R151-Q155 WeakPolarHBondContact O-CG 3.46Å; R151-Q155 PolarHBondContact O-N 2.88Å; R151-Q155 VanDerWaalsContact O-N 3.13Å; R151-Q155 PolarHBondContact O-NE2 3.34Å; Q152-Q155 WeakPolarHBondContact O-CA 3.38Å; Q152-Q155 WeakPolarHBondContact O-CB 3.28Å; Q152-Q155 PolarHBondContact O-N 3.31Å; Q152-Q155 VanDerWaalsContact O-N 3.08Å; L153-Q155 VanDerWaalsContact C-N 3.35Å; L153-Q155 PolarHBondContact O-N 2.91Å; Q155-G157 PolarHBondContact O-N 3.25Å |
| 156 | D | 83.6 | Confident | 73.8 | Confident | 96 Ų | 96 | 106.6 Ų | 106.6 | 51% | 0.513 | 55% | 0.547 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.8 | 3.9 | 179.4 | -64.4 | -24.8 | 0 | 0 | 0 | 112.8 | Q152 L153 L154 Y158 | Q152-D156 VanDerWaalsContact NE2-CG 3.25Å; Q152-D156 PolarHBondContact NE2-OD1 3.07Å; Q152-D156 PolarHBondContact NE2-OD2 3.09Å; Q152-D156 WeakPolarHBondContact O-CB 3.16Å; Q152-D156 VanDerWaalsContact O-CG 3.29Å; Q152-D156 PolarHBondContact O-N 3.21Å; L153-D156 CarbonylContact O-C 3.58Å; L153-D156 PolarHBondContact O-N 2.98Å; L154-D156 VanDerWaalsContact C-N 3.31Å; D156-Y158 VanDerWaalsContact C-N 3.31Å; D156-Y158 HydrophobicContact CB-CD2 4.23Å |
| 157 | G | 76.5 | Confident | 73.9 | Confident | 50 Ų | 50 | 110.1 Ų | 110.1 | 52% | 0.515 | 56% | 0.561 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 80.4 | 8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | L153 L154 Q155 H159 | L153-G157 PolarHBondContact O-N 3.02Å; L154-G157 PolarHBondContact O-N 3.04Å; Q155-G157 PolarHBondContact O-N 3.25Å; G157-H159 PolarHBondContact O-N 3.29Å |
| 158 | Y | 74.4 | Confident | 73.6 | Confident | 163 Ų | 163 | 111.5 Ų | 111.5 | 64% | 0.639 | 57% | 0.572 | S | S | * | * | trans | -86.4 | 87.4 | 170.8 | -74.7 | -87.6 | 0 | 0 | 0 | 109.2 | L153 D156 L160 | L153-Y158 CarbonylContact C-O 3.55Å; L153-Y158 CarbonylContact O-C 3.55Å; L153-Y158 WeakPolarHBondContact O-CA 3.34Å; L153-Y158 WeakPolarHBondContact O-CB 3.44Å; L153-Y158 PolarHBondContact O-N 3.13Å; D156-Y158 VanDerWaalsContact C-N 3.31Å; D156-Y158 HydrophobicContact CB-CD2 4.23Å; Y158-L160 PolarHBondContact O-N 3.32Å | ||
| 159 | H | 71.4 | Confident | 73.2 | Confident | 125 Ų | 125 | 112.3 Ų | 112.3 | 58% | 0.579 | 58% | 0.576 | S | S | * | * | trans | -74.7 | 119.1 | 164.6 | -58.7 | -77.9 | 0 | 0 | 0 | 107.3 | G157 D161 | G157-H159 PolarHBondContact O-N 3.29Å; H159-D161 PolarHBondContact O-N 2.83Å; H159-D161 VanDerWaalsContact O-N 3.14Å | ||
| 160 | L | 74.1 | Confident | 72.7 | Confident | 111 Ų | 111 | 114.9 Ų | 114.9 | 58% | 0.581 | 59% | 0.587 | S | S | * | * | trans | -71 | 107.9 | 168 | -60 | 178.5 | 0 | 0 | 0 | 105.7 | Y158 E162 | Y158-L160 PolarHBondContact O-N 3.32Å; L160-E162 VanDerWaalsContact C-N 3.3Å; L160-E162 PolarHBondContact O-N 2.96Å | ||
| 161 | D | 65.8 | Low | 72.4 | Confident | 140 Ų | 140 | 120.3 Ų | 120.3 | 75% | 0.749 | 61% | 0.612 | S | S | * | * | trans | -64.8 | 97 | 173.8 | -64.3 | -39.4 | 0 | 0 | 0 | 107.1 | H159 I163 | H159-D161 PolarHBondContact O-N 2.83Å; H159-D161 VanDerWaalsContact O-N 3.14Å; D161-I163 PolarHBondContact O-N 3.02Å | ||
| 162 | E | 62.9 | Low | 71.8 | Confident | 178 Ų | 178 | 120.3 Ų | 120.3 | 83% | 0.832 | 62% | 0.62 | S | S | * | * | trans | -76.9 | 2.4 | 176.5 | -70.5 | 176.5 | -172.4 | 0 | 0 | 111.9 | L160 P164 | L160-E162 VanDerWaalsContact C-N 3.3Å; L160-E162 PolarHBondContact O-N 2.96Å; E162-P164 WeakPolarHBondContact O-CD 3.4Å | ||
| 163 | I | 64.5 | Low | 71.1 | Confident | 124 Ų | 124 | 121 Ų | 121 | 64% | 0.636 | 63% | 0.633 | S | S | * | * | S | Bend | trans | -73.2 | 114.1 | 170.5 | -53.1 | 176.2 | 0 | 0 | 0 | 105.8 | D161 D165 | D161-I163 PolarHBondContact O-N 3.02Å; I163-D165 PolarHBondContact O-N 2.87Å |
| 164 | P | 63.8 | Low | 70.2 | Confident | 80 Ų | 80 | 124.1 Ų | 124.1 | 52% | 0.519 | 66% | 0.656 | S | S | . | * | trans | -61.2 | 135.3 | 176.2 | 22.6 | -24.7 | 0 | 0 | 0 | 109 | E162 D166 | E162-P164 WeakPolarHBondContact O-CD 3.4Å; P164-D166 VanDerWaalsContact C-OD1 3.29Å; P164-D166 WeakPolarHBondContact CB-OD1 3.5Å; P164-D166 WeakPolarHBondContact CG-OD1 3.33Å; P164-D166 PolarHBondContact O-N 2.71Å | ||
| 165 | D | 63 | Low | 69.5 | Low | 153 Ų | 153 | 128 Ų | 128 | 82% | 0.818 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.6 | 14.2 | 179 | -85.5 | -23.9 | 0 | 0 | 0 | 112.8 | I163 | I163-D165 PolarHBondContact O-N 2.87Š|
| 166 | D | 65.1 | Low | 68.6 | Low | 97 Ų | 97 | 126.9 Ų | 126.9 | 52% | 0.519 | 67% | 0.674 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.1 | -10.8 | -178.9 | 60.4 | -15.3 | 0 | 0 | 0 | 113.6 | P164 | P164-D166 VanDerWaalsContact C-OD1 3.29Å; P164-D166 WeakPolarHBondContact CB-OD1 3.5Å; P164-D166 WeakPolarHBondContact CG-OD1 3.33Å; P164-D166 PolarHBondContact O-N 2.71Å |
| 167 | E | 63.8 | Low | 67.2 | Low | 166 Ų | 166 | 130.5 Ų | 130.5 | 78% | 0.776 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -10.2 | 175.8 | -75.3 | -96.9 | 110.4 | 0 | 0 | 114.3 | ||
| 168 | D | 70 | Confident | 66.5 | Low | 143 Ų | 143 | 132.8 Ų | 132.8 | 77% | 0.765 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.6 | 4.4 | 173.9 | -72.5 | -10.5 | 0 | 0 | 0 | 112.7 | D170 | D168-D170 PolarHBondContact O-N 2.81Š|
| 169 | L | 72.3 | Confident | 65.4 | Low | 112 Ų | 112 | 129.6 Ų | 129.6 | 59% | 0.586 | 71% | 0.705 | S | S | * | * | trans | -70.6 | 87.8 | 162.1 | -62.1 | -178.8 | 0 | 0 | 0 | 106.5 | L171 | L169-L171 HydrophobicContact CB-CD2 4.48Å; L169-L171 PolarHBondContact O-N 2.9Å | ||
| 170 | D | 70.6 | Confident | 64.6 | Low | 131 Ų | 131 | 128.5 Ų | 128.5 | 70% | 0.701 | 71% | 0.712 | S | S | * | * | trans | -51.7 | 92.3 | 159.4 | 57.5 | -34.7 | 0 | 0 | 0 | 106.6 | D168 I172 | D168-D170 PolarHBondContact O-N 2.81Å; D170-I172 PolarHBondContact O-N 3.21Å | ||
| 171 | L | 70 | Confident | 63.6 | Low | 149 Ų | 149 | 128 Ų | 128 | 78% | 0.78 | 72% | 0.724 | S | S | * | * | trans | -61.7 | 88.1 | 177.9 | -66.2 | 179 | 0 | 0 | 0 | 105.4 | L169 P173 | L169-L171 HydrophobicContact CB-CD2 4.48Å; L169-L171 PolarHBondContact O-N 2.9Å; L171-P173 WeakPolarHBondContact O-CD 3.49Å | ||
| 172 | I | 66.8 | Low | 62.7 | Low | 125 Ų | 125 | 124.9 Ų | 124.9 | 64% | 0.641 | 71% | 0.712 | S | S | * | * | trans | -49 | 112.6 | 171.4 | -65.2 | 171.4 | 0 | 0 | 0 | 103 | D170 | D170-I172 PolarHBondContact O-N 3.21Š| ||
| 173 | P | 70.6 | Confident | 62.2 | Low | 105 Ų | 105 | 122.7 Ų | 122.7 | 68% | 0.682 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -51.5 | 126.5 | 178.1 | -26.6 | 35 | 0 | 0 | 0 | 106.2 | L171 K175 | L171-P173 WeakPolarHBondContact O-CD 3.49Å; P173-K175 PolarHBondContact O-N 3.42Å |
| 174 | P | 65.1 | Low | 61.5 | Low | 121 Ų | 121 | 122 Ų | 122 | 79% | 0.786 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -51 | 126.5 | -173.2 | 20 | -32.2 | 0 | 0 | 0 | 107.4 | ||
| 175 | K | 63.4 | Low | 60.9 | Low | 175 Ų | 175 | 121.7 Ų | 121.7 | 76% | 0.761 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -48 | 124.5 | -179.9 | -75.8 | 171.8 | -179.4 | 161.3 | 0 | 106.9 | P173 M177 | P173-K175 PolarHBondContact O-N 3.42Å; K175-M177 PolarHBondContact O-N 3.09Å |
| 176 | P | 62 | Low | 60.4 | Low | 120 Ų | 120 | 126.1 Ų | 126.1 | 78% | 0.779 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 118.3 | 178.4 | 20.8 | -31 | 0 | 0 | 0 | 107 | A178 | P176-A178 PolarHBondContact O-N 3.07Š|
| 177 | M | 56.2 | Low | 60 | Low | 173 Ų | 173 | 125.4 Ų | 125.4 | 85% | 0.852 | 73% | 0.727 | S | S | * | * | trans | -69.4 | 76.4 | 176.8 | -67.4 | 179.3 | 71.9 | 0 | 0 | 108 | K175 S179 | K175-M177 PolarHBondContact O-N 3.09Å; M177-S179 PolarHBondContact O-N 3.03Å | ||
| 178 | A | 61.1 | Low | 59.5 | Low | 98 Ų | 98 | 122.8 Ų | 122.8 | 81% | 0.81 | 73% | 0.726 | S | S | * | * | trans | -74.7 | 69.4 | 162.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | P176 | P176-A178 PolarHBondContact O-N 3.07Š| ||
| 179 | S | 50.8 | Low | 58.6 | Low | 95 Ų | 95 | 123.7 Ų | 123.7 | 66% | 0.664 | 73% | 0.73 | S | S | * | * | trans | -176.1 | 81.2 | 158.2 | 43.2 | 0 | 0 | 0 | 0 | 108.6 | M177 A181 | M177-S179 PolarHBondContact O-N 3.03Å; S179-A181 VanDerWaalsContact C-N 3.26Å; S179-A181 PolarHBondContact O-N 3.4Å | ||
| 180 | S | 53.9 | Low | 57.4 | Low | 103 Ų | 103 | 121 Ų | 121 | 72% | 0.72 | 73% | 0.73 | S | S | * | * | trans | -62 | 84.5 | 164.7 | 59 | 0 | 0 | 0 | 0 | 109.9 | C182 | S180-C182 PolarHBondContact O-N 3.12Š| ||
| 181 | A | 53.1 | Low | 56.6 | Low | 100 Ų | 100 | 122.9 Ų | 122.9 | 83% | 0.826 | 74% | 0.74 | S | S | * | * | trans | -76.8 | 85.4 | 161.3 | 0 | 0 | 0 | 0 | 0 | 107.8 | S179 S183 | S179-A181 VanDerWaalsContact C-N 3.26Å; S179-A181 PolarHBondContact O-N 3.4Å; A181-S183 PolarHBondContact O-N 2.86Å | ||
| 182 | C | 46.8 | Very low | 55.7 | Low | 75 Ų | 75 | 121.4 Ų | 121.4 | 51% | 0.507 | 74% | 0.742 | S | S | . | * | trans | -55.3 | 120.6 | 171.6 | 179.7 | 0 | 0 | 0 | 0 | 110.2 | S180 C184 | S180-C182 PolarHBondContact O-N 3.12Å; C182-C184 VanDerWaalsContact C-N 3.3Å; C182-C184 PolarHBondContact O-N 3.07Å; C182-C184 PolarHBondContact SG-SG 2.77Å | ||
| 183 | S | 54.1 | Low | 55.5 | Low | 131 Ų | 131 | 121 Ų | 121 | 92% | 0.916 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85 | 5.6 | 179.3 | 83.6 | 0 | 0 | 0 | 0 | 114.4 | A181 | A181-S183 PolarHBondContact O-N 2.86Š|
| 184 | C | 49.9 | Very low | 54.8 | Low | 111 Ų | 111 | 121 Ų | 121 | 75% | 0.75 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.8 | 14.5 | -175.3 | 61.5 | 0 | 0 | 0 | 0 | 116.3 | C182 | C182-C184 VanDerWaalsContact C-N 3.3Å; C182-C184 PolarHBondContact O-N 3.07Å; C182-C184 PolarHBondContact SG-SG 2.77Å |
| 185 | C | 49.3 | Very low | 53.9 | Low | 72 Ų | 72 | 120.3 Ų | 120.3 | 49% | 0.486 | 75% | 0.75 | S | S | . | * | trans | -152.1 | 130.9 | 170.8 | -142.8 | 0 | 0 | 0 | 0 | 111.8 | C187 | C185-C187 HydrophobicContact CB-CB 3.6Å; C185-C187 WeakPolarHBondContact CB-SG 3.19Å; C185-C187 PolarHBondContact O-N 2.72Å; C185-C187 WeakPolarHBondContact SG-CB 3.36Å; C185-C187 CovalentContact SG-SG 2.05Å; C185-C187 PolarHBondContact SG-SG 3.32Å | ||
| 186 | W | 54.4 | Low | 53.6 | Low | 246 Ų | 246 | 118 Ų | 118 | 93% | 0.932 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -69.1 | 29.9 | 167 | -148.2 | -30.9 | 0 | 0 | 0 | 112 | ||
| 187 | C | 55.8 | Low | 52.8 | Low | 82 Ų | 82 | 120.6 Ų | 120.6 | 55% | 0.554 | 76% | 0.757 | S | S | * | * | trans | -114.4 | 8.2 | -155.8 | -48.9 | 0 | 0 | 0 | 0 | 113.5 | C185 | C185-C187 HydrophobicContact CB-CB 3.6Å; C185-C187 WeakPolarHBondContact CB-SG 3.19Å; C185-C187 PolarHBondContact O-N 2.72Å; C185-C187 WeakPolarHBondContact SG-CB 3.36Å; C185-C187 CovalentContact SG-SG 2.05Å; C185-C187 PolarHBondContact SG-SG 3.32Å | ||
| 188 | C | 53.9 | Low | 51.8 | Low | 112 Ų | 112 | 124.7 Ų | 124.7 | 76% | 0.757 | 77% | 0.774 | S | S | * | * | trans | -116.4 | 29.2 | 176.6 | -58.1 | 0 | 0 | 0 | 0 | 113.2 | G190 | C188-G190 PolarHBondContact O-N 3.01Š| ||
| 189 | L | 49.9 | Very low | 51.3 | Low | 161 Ų | 161 | 126 Ų | 126 | 84% | 0.843 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -89.4 | 84.9 | 155.3 | -92.3 | 85 | 0 | 0 | 0 | 107.8 | ||
| 190 | G | 48.5 | Very low | 51.4 | Low | 57 Ų | 57 | 127.6 Ų | 127.6 | 59% | 0.588 | 78% | 0.778 | S | S | * | * | S | Bend | trans | 138.3 | 122.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | C188 S192 | C188-G190 PolarHBondContact O-N 3.01Å; G190-S192 PolarHBondContact O-N 3.47Å |
| 191 | D | 52.9 | Low | 51.2 | Low | 170 Ų | 170 | 129 Ų | 129 | 91% | 0.909 | 78% | 0.781 | S | S | * | * | trans | -38.7 | 108.7 | 174.5 | -83.1 | -39.4 | 0 | 0 | 0 | 112.3 | ||||
| 192 | S | 50.3 | Low | 51.1 | Low | 117 Ų | 117 | 130.7 Ų | 130.7 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | trans | -167.3 | 109.7 | 153.1 | -81 | 0 | 0 | 0 | 0 | 110.1 | G190 | G190-S192 PolarHBondContact O-N 3.47Š| ||
| 193 | S | 63.5 | Low | 51.4 | Low | 118 Ų | 118 | 134.2 Ų | 134.2 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | trans | -53.5 | 147.7 | 171.9 | 47.4 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 194 | S | 55.3 | Low | 51.2 | Low | 103 Ų | 103 | 134.4 Ų | 134.4 | 72% | 0.72 | 79% | 0.787 | S | S | * | * | trans | 112.4 | 90.2 | 154.5 | -175.1 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 195 | C | 46.4 | Very low | 51.3 | Low | 107 Ų | 107 | 136.1 Ų | 136.1 | 72% | 0.723 | 79% | 0.79 | S | S | * | * | trans | -103.6 | 108.8 | 146.7 | 66.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 196 | T | 57.8 | Low | 51.4 | Low | 127 Ų | 127 | 141 Ų | 141 | 78% | 0.779 | 81% | 0.813 | S | S | * | * | trans | -95.9 | 113.1 | 165.9 | 49.2 | 0 | 0 | 0 | 0 | 108 | ||||
| 197 | L | 43.9 | Very low | 51.2 | Low | 175 Ų | 175 | 132.3 Ų | 132.3 | 92% | 0.916 | 80% | 0.803 | S | S | * | * | trans | -76 | 127.7 | 168.1 | -98.9 | 142.9 | 0 | 0 | 0 | 108.7 | ||||
| 198 | Q | 36 | Very low | 50.8 | Low | 258 Ų | 258 | 136.8 Ų | 136.8 | 100% | 1.206 | 83% | 0.826 | S | S | * | * | trans | -106.8 | 0 | 166.2 | -175.7 | 177.5 | -7.1 | 0 | 0 | 109.1 |
Retrieved 198 of 198 residues in 36 ms
(Link to these results)