| 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 | 36.7 | Very low | 47.3 | Very low | 252 Ų | 252 | 150.2 Ų | 150.2 | 100% | 1.241 | 86% | 0.855 | S | S | * | * | 0 | 106.1 | 0 | -72.5 | -142.6 | -126.2 | 0 | 0 | 108.2 | |||||
| 2 | A | 40.5 | Very low | 47.5 | Very low | 103 Ų | 103 | 144.8 Ų | 144.8 | 85% | 0.851 | 84% | 0.843 | S | S | * | * | trans | -99.1 | 125 | -178.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 3 | G | 42.5 | Very low | 47.2 | Very low | 73 Ų | 73 | 144.2 Ų | 144.2 | 75% | 0.753 | 84% | 0.842 | S | S | * | * | trans | -67.6 | 132.7 | -175.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | K5 | G3-K5 PolarHBondContact O-N 3.41Š| ||
| 4 | K | 51.3 | Low | 46.9 | Very low | 216 Ų | 216 | 150.1 Ų | 150.1 | 94% | 0.939 | 85% | 0.845 | S | S | * | * | trans | -74.6 | 113.2 | 171.1 | -65.4 | 174.5 | 177.6 | -177.7 | 0 | 108.2 | ||||
| 5 | K | 53.8 | Low | 46.4 | Very low | 194 Ų | 194 | 145.5 Ų | 145.5 | 84% | 0.843 | 83% | 0.834 | S | S | * | * | trans | -87.9 | 119 | 175.1 | 16.1 | 177.3 | 179.9 | 172.2 | 0 | 108.4 | G3 | G3-K5 PolarHBondContact O-N 3.41Š| ||
| 6 | N | 50.3 | Low | 46 | Very low | 140 Ų | 140 | 147.5 Ų | 147.5 | 75% | 0.749 | 83% | 0.833 | S | S | * | * | trans | -75.9 | 120.7 | -179 | -144.2 | 10 | 0 | 0 | 0 | 109 | ||||
| 7 | V | 52.4 | Low | 45.7 | Very low | 135 Ų | 135 | 148.6 Ų | 148.6 | 82% | 0.818 | 84% | 0.837 | S | S | * | * | trans | -95.3 | 20.7 | -170.1 | -93.5 | 0 | 0 | 0 | 0 | 114.3 | S9 | V7-S9 PolarHBondContact O-N 3.22Š| ||
| 8 | L | 46.6 | Very low | 45.5 | Very low | 151 Ų | 151 | 145.3 Ų | 145.3 | 79% | 0.791 | 83% | 0.825 | S | S | * | * | trans | -90.5 | 13.2 | -174.8 | -75.7 | 167.4 | 0 | 0 | 0 | 115.2 | S10 | L8-S10 PolarHBondContact O-N 2.69Š| ||
| 9 | S | 50.3 | Low | 45.4 | Very low | 111 Ų | 111 | 147.6 Ų | 147.6 | 78% | 0.776 | 83% | 0.828 | S | S | * | * | trans | -93.7 | 19.6 | -171.8 | 73.2 | 0 | 0 | 0 | 0 | 116.1 | V7 | V7-S9 PolarHBondContact O-N 3.22Š| ||
| 10 | S | 52.1 | Low | 45.2 | Very low | 112 Ų | 112 | 146.2 Ų | 146.2 | 78% | 0.783 | 83% | 0.825 | S | S | * | * | trans | -115.5 | 25.9 | -176.3 | -59.5 | 0 | 0 | 0 | 0 | 114.5 | L8 A12 | L8-S10 PolarHBondContact O-N 2.69Å; S10-A12 PolarHBondContact O-N 3.45Å | ||
| 11 | L | 43.4 | Very low | 44.7 | Very low | 165 Ų | 165 | 148 Ų | 148 | 86% | 0.864 | 83% | 0.827 | S | S | * | * | trans | -83.5 | 95 | 168.1 | -163.2 | 66.7 | 0 | 0 | 0 | 108.8 | V13 | L11-V13 PolarHBondContact O-N 2.98Š| ||
| 12 | A | 49.7 | Very low | 44.8 | Very low | 85 Ų | 85 | 141.3 Ų | 141.3 | 70% | 0.702 | 81% | 0.805 | S | S | * | * | trans | -64 | 130.8 | 177 | 0 | 0 | 0 | 0 | 0 | 110.8 | S10 Y14 | S10-A12 PolarHBondContact O-N 3.45Å; A12-Y14 PolarHBondContact O-N 3.47Å | ||
| 13 | V | 44.5 | Very low | 44.7 | Very low | 138 Ų | 138 | 143.9 Ų | 143.9 | 84% | 0.836 | 81% | 0.805 | S | S | * | * | trans | -72.3 | 118.1 | 172.8 | 173.3 | 0 | 0 | 0 | 0 | 108.3 | L11 | L11-V13 PolarHBondContact O-N 2.98Š| ||
| 14 | Y | 42.9 | Very low | 44.3 | Very low | 226 Ų | 226 | 143.8 Ų | 143.8 | 89% | 0.886 | 80% | 0.804 | S | S | * | * | trans | -105.5 | 100.3 | 168 | -118.3 | -91 | 0 | 0 | 0 | 107.4 | A12 | A12-Y14 PolarHBondContact O-N 3.47Š| ||
| 15 | A | 39.3 | Very low | 43.6 | Very low | 81 Ų | 81 | 142.7 Ų | 142.7 | 67% | 0.669 | 80% | 0.802 | S | S | * | * | trans | -178.3 | 137.9 | 153.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 16 | E | 40.3 | Very low | 42.7 | Very low | 178 Ų | 178 | 139.9 Ų | 139.9 | 83% | 0.832 | 80% | 0.801 | S | S | * | * | trans | 79.7 | 77.8 | 164.9 | -62.3 | -94.9 | 142.8 | 0 | 0 | 116.5 | ||||
| 17 | D | 41 | Very low | 41.7 | Very low | 166 Ų | 166 | 136.8 Ų | 136.8 | 89% | 0.888 | 80% | 0.802 | S | S | * | * | trans | -123.1 | 115.8 | 146.1 | -155.4 | 14.4 | 0 | 0 | 0 | 108.3 | ||||
| 18 | S | 41 | Very low | 40.9 | Very low | 90 Ų | 90 | 138.3 Ų | 138.3 | 63% | 0.629 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -79.1 | 132.9 | -175.6 | -69.7 | 0 | 0 | 0 | 0 | 109.7 | P20 | S18-P20 WeakPolarHBondContact O-CD 2.95Š|
| 19 | E | 43.2 | Very low | 40.3 | Very low | 189 Ų | 189 | 140 Ų | 140 | 88% | 0.883 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 134 | 172.8 | -59.6 | -151 | 160 | 0 | 0 | 111.4 | ||
| 20 | P | 42.4 | Very low | 39.3 | Very low | 119 Ų | 119 | 139.3 Ų | 139.3 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -93.4 | 118.6 | 156 | 31.3 | -27 | 0 | 0 | 0 | 110.2 | S18 | S18-P20 WeakPolarHBondContact O-CD 2.95Š|
| 21 | E | 35.3 | Very low | 38.2 | Very low | 183 Ų | 183 | 143.1 Ų | 143.1 | 86% | 0.855 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 135.9 | 162.3 | -65.8 | -150.3 | 156 | 0 | 0 | 110.6 | ||
| 22 | S | 38.6 | Very low | 37.5 | Very low | 113 Ų | 113 | 138.5 Ų | 138.5 | 79% | 0.79 | 81% | 0.81 | S | S | * | * | trans | -136.1 | 92.8 | 171.4 | -178.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 23 | D | 37.4 | Very low | 36.6 | Very low | 156 Ų | 156 | 140.7 Ų | 140.7 | 83% | 0.834 | 82% | 0.82 | S | S | * | * | trans | -62.4 | 138.1 | 159.8 | -72.1 | -28.4 | 0 | 0 | 0 | 110.6 | ||||
| 24 | G | 34.6 | Very low | 36 | Very low | 71 Ų | 71 | 139 Ų | 139 | 73% | 0.732 | 82% | 0.82 | S | S | * | * | trans | -170.6 | 77 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | T26 | G24-T26 PolarHBondContact O-N 3.2Š| ||
| 25 | E | 37.6 | Very low | 35.6 | Very low | 194 Ų | 194 | 133.4 Ų | 133.4 | 91% | 0.907 | 82% | 0.82 | S | S | * | * | trans | -51.6 | 127.2 | 163 | -69.9 | -176.4 | 131.7 | 0 | 0 | 111.1 | ||||
| 26 | T | 33.2 | Very low | 35.3 | Very low | 135 Ų | 135 | 138.2 Ų | 138.2 | 83% | 0.828 | 83% | 0.829 | S | S | * | * | trans | -150 | 103.1 | 143.8 | 40.2 | 0 | 0 | 0 | 0 | 109.5 | G24 | G24-T26 PolarHBondContact O-N 3.2Š| ||
| 27 | G | 31 | Very low | 35.3 | Very low | 75 Ų | 75 | 137 Ų | 137 | 77% | 0.773 | 82% | 0.824 | S | S | * | * | trans | -71.4 | 139.2 | 165.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 28 | I | 34.9 | Very low | 35.3 | Very low | 166 Ų | 166 | 137.7 Ų | 137.7 | 85% | 0.851 | 82% | 0.818 | S | S | * | * | trans | -133.2 | 115.1 | 159.6 | -52.2 | 178.3 | 0 | 0 | 0 | 107.2 | ||||
| 29 | E | 33.2 | Very low | 35.4 | Very low | 186 Ų | 186 | 137.5 Ų | 137.5 | 87% | 0.869 | 83% | 0.831 | S | S | * | * | trans | -90.5 | 142.3 | 178.1 | -41.6 | -169.7 | 163.4 | 0 | 0 | 109.7 | ||||
| 30 | A | 30.2 | Very low | 35 | Very low | 98 Ų | 98 | 131.7 Ų | 131.7 | 81% | 0.81 | 82% | 0.822 | S | S | * | * | trans | 179.8 | 104.2 | 141.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 31 | M | 28.9 | Very low | 34.9 | Very low | 191 Ų | 191 | 134.4 Ų | 134.4 | 94% | 0.941 | 83% | 0.829 | S | S | * | * | 60.5 | 101.7 | 123.1 | -154.1 | 72.9 | 131 | 0 | 0 | 121.9 | |||||
| 32 | G | 28.8 | Very low | 34.9 | Very low | 69 Ų | 69 | 132.8 Ų | 132.8 | 71% | 0.711 | 83% | 0.831 | S | S | * | * | 83.4 | 115.5 | 108.7 | 0 | 0 | 0 | 0 | 0 | 121.4 | |||||
| 33 | S | 30.1 | Very low | 35 | Very low | 131 Ų | 131 | 132.1 Ų | 132.1 | 92% | 0.916 | 83% | 0.827 | S | S | * | * | 176.8 | 144.9 | 116.8 | 48.7 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 34 | A | 32.3 | Very low | 35.2 | Very low | 102 Ų | 102 | 131.4 Ų | 131.4 | 84% | 0.843 | 82% | 0.823 | S | S | * | * | trans | -96.9 | 149.1 | -175 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 35 | A | 33.4 | Very low | 35.4 | Very low | 108 Ų | 108 | 133 Ų | 133 | 89% | 0.893 | 83% | 0.829 | S | S | * | * | trans | -171.3 | 151.4 | 144.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 36 | E | 34.5 | Very low | 35.7 | Very low | 183 Ų | 183 | 133.6 Ų | 133.6 | 86% | 0.855 | 82% | 0.824 | S | S | * | * | trans | -71 | 160.4 | -167.5 | -107.3 | 170.1 | 117.7 | 0 | 0 | 118.1 | ||||
| 37 | E | 40.2 | Very low | 35.9 | Very low | 153 Ų | 153 | 130.4 Ų | 130.4 | 72% | 0.715 | 82% | 0.818 | S | S | * | * | trans | 60 | 121.4 | 141.4 | -148.9 | -161.5 | 176.4 | 0 | 0 | 119.1 | ||||
| 38 | K | 40.6 | Very low | 36.4 | Very low | 179 Ų | 179 | 135.3 Ų | 135.3 | 78% | 0.778 | 82% | 0.821 | S | S | * | * | 175.8 | 124.9 | 114.5 | -74.8 | -117.1 | 174.9 | -177.5 | 0 | 110.1 | |||||
| 39 | G | 43.8 | Very low | 36.6 | Very low | 86 Ų | 86 | 134.3 Ų | 134.3 | 89% | 0.887 | 82% | 0.817 | S | S | * | * | trans | -63.2 | 141.1 | 162.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 40 | G | 34.1 | Very low | 37 | Very low | 68 Ų | 68 | 131 Ų | 131 | 70% | 0.701 | 81% | 0.805 | S | S | * | * | trans | -163.9 | 115.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 41 | L | 40 | Very low | 37.3 | Very low | 176 Ų | 176 | 136 Ų | 136 | 92% | 0.921 | 81% | 0.809 | S | S | * | * | trans | -53.6 | 129.7 | 171.2 | -67 | 136.3 | 0 | 0 | 0 | 110.1 | ||||
| 42 | V | 36.3 | Very low | 37.9 | Very low | 148 Ų | 148 | 131.5 Ų | 131.5 | 90% | 0.897 | 80% | 0.797 | S | S | * | * | trans | -99.4 | 109.6 | 166.4 | 176.3 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 43 | S | 39.1 | Very low | 38.6 | Very low | 100 Ų | 100 | 139.7 Ų | 139.7 | 70% | 0.699 | 81% | 0.806 | S | S | * | * | trans | -69.8 | 162 | 173.6 | -51.1 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 44 | D | 41.8 | Very low | 39.2 | Very low | 141 Ų | 141 | 141.5 Ų | 141.5 | 75% | 0.754 | 81% | 0.805 | S | S | * | * | trans | -19.6 | 130.9 | 163.8 | -84.2 | -47.3 | 0 | 0 | 0 | 116.9 | ||||
| 45 | A | 38.6 | Very low | 39.2 | Very low | 103 Ų | 103 | 140.2 Ų | 140.2 | 85% | 0.851 | 80% | 0.801 | S | S | * | * | trans | -131.4 | 89.2 | 144.7 | 0 | 0 | 0 | 0 | 0 | 108 | G47 | A45-G47 PolarHBondContact O-N 3.36Š| ||
| 46 | Y | 43.7 | Very low | 39.2 | Very low | 208 Ų | 208 | 138 Ų | 138 | 82% | 0.816 | 79% | 0.79 | S | S | * | * | trans | -57.7 | 108.7 | 159.9 | -103.5 | -108.3 | 0 | 0 | 0 | 108.2 | E48 | Y46-E48 PolarHBondContact O-N 3.22Š| ||
| 47 | G | 37.7 | Very low | 39.3 | Very low | 68 Ų | 68 | 137.5 Ų | 137.5 | 70% | 0.701 | 79% | 0.792 | S | S | * | * | trans | -78.8 | 90.5 | 161.5 | 0 | 0 | 0 | 0 | 0 | 108.4 | A45 D49 | A45-G47 PolarHBondContact O-N 3.36Å; G47-D49 PolarHBondContact O-N 3.4Å | ||
| 48 | E | 41.6 | Very low | 39.5 | Very low | 177 Ų | 177 | 139.6 Ų | 139.6 | 83% | 0.827 | 80% | 0.802 | S | S | * | * | trans | -66.4 | 102.5 | 162 | -173.8 | -170.2 | -152.5 | 0 | 0 | 107.8 | Y46 | Y46-E48 PolarHBondContact O-N 3.22Š| ||
| 49 | D | 39.8 | Very low | 39.3 | Very low | 145 Ų | 145 | 138 Ų | 138 | 78% | 0.775 | 80% | 0.802 | S | S | * | * | trans | -111.5 | 100.6 | 162.7 | -76.8 | -49 | 0 | 0 | 0 | 108.5 | G47 F51 | G47-D49 PolarHBondContact O-N 3.4Å; D49-F51 PolarHBondContact O-N 3.25Å | ||
| 50 | D | 40.8 | Very low | 39 | Very low | 116 Ų | 116 | 137.6 Ų | 137.6 | 62% | 0.62 | 80% | 0.798 | S | S | * | * | trans | -50.7 | 112.7 | 170.2 | -179.7 | 23.5 | 0 | 0 | 0 | 112.4 | S52 | D50-S52 VanDerWaalsContact OD1-CB 3.23Å; D50-S52 WeakPolarHBondContact OD1-CB 3.01Å; D50-S52 PolarHBondContact OD1-N 2.78Å; D50-S52 VanDerWaalsContact OD1-N 3.1Å; D50-S52 PolarHBondContact OD1-OG 2.97Å | ||
| 51 | F | 37.7 | Very low | 39.1 | Very low | 203 Ų | 203 | 144.1 Ų | 144.1 | 89% | 0.89 | 80% | 0.803 | S | S | * | * | trans | -121.3 | 62.1 | 160 | -81.5 | -81.2 | 0 | 0 | 0 | 109.7 | D49 | D49-F51 PolarHBondContact O-N 3.25Š| ||
| 52 | S | 42.1 | Very low | 39 | Very low | 98 Ų | 98 | 144 Ų | 144 | 69% | 0.685 | 80% | 0.798 | S | S | * | * | trans | -105.3 | 62.5 | 173.8 | -36.5 | 0 | 0 | 0 | 0 | 112 | D50 | D50-S52 VanDerWaalsContact OD1-CB 3.23Å; D50-S52 WeakPolarHBondContact OD1-CB 3.01Å; D50-S52 PolarHBondContact OD1-N 2.78Å; D50-S52 VanDerWaalsContact OD1-N 3.1Å; D50-S52 PolarHBondContact OD1-OG 2.97Å | ||
| 53 | R | 42.8 | Very low | 38.9 | Very low | 241 Ų | 241 | 144.7 Ų | 144.7 | 91% | 0.909 | 79% | 0.791 | S | S | * | * | trans | -168.8 | 115.8 | 157.6 | -137.3 | 168 | 176.9 | 164.8 | -1.6 | 115 | ||||
| 54 | L | 41.6 | Very low | 38.8 | Very low | 169 Ų | 169 | 147.5 Ų | 147.5 | 89% | 0.885 | 79% | 0.793 | S | S | * | * | trans | 162.5 | 92.5 | 141.3 | -85.5 | 177.8 | 0 | 0 | 0 | 103.2 | ||||
| 55 | G | 33.9 | Very low | 38.6 | Very low | 74 Ų | 74 | 148.2 Ų | 148.2 | 76% | 0.763 | 79% | 0.792 | S | S | * | * | 58.3 | 78.2 | 75.2 | 0 | 0 | 0 | 0 | 0 | 106.8 | |||||
| 56 | G | 33.7 | Very low | 38.4 | Very low | 63 Ų | 63 | 150.7 Ų | 150.7 | 65% | 0.649 | 79% | 0.791 | S | S | * | * | 85.4 | 102.7 | 80.2 | 0 | 0 | 0 | 0 | 0 | 106.8 | |||||
| 57 | D | 36.7 | Very low | 38.4 | Very low | 171 Ų | 171 | 149 Ų | 149 | 91% | 0.914 | 79% | 0.79 | S | S | * | * | trans | -167 | 129.2 | 139.5 | -83.8 | -28.2 | 0 | 0 | 0 | 108.5 | ||||
| 58 | E | 42.3 | Very low | 38.1 | Very low | 197 Ų | 197 | 151.5 Ų | 151.5 | 92% | 0.921 | 79% | 0.788 | S | S | * | * | trans | -107.3 | 112.4 | -173.1 | 170.7 | -176.5 | 178.9 | 0 | 0 | 105.3 | ||||
| 59 | D | 38 | Very low | 38 | Very low | 146 Ų | 146 | 148.9 Ų | 148.9 | 78% | 0.781 | 79% | 0.789 | S | S | * | * | trans | -130.3 | 107.4 | 167.8 | 57.9 | -20.7 | 0 | 0 | 0 | 110.7 | ||||
| 60 | G | 36.7 | Very low | 38.1 | Very low | 77 Ų | 77 | 152.4 Ų | 152.4 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | trans | -64.5 | 131.9 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 61 | Y | 35.6 | Very low | 37.9 | Very low | 206 Ų | 206 | 154.8 Ų | 154.8 | 81% | 0.808 | 80% | 0.799 | S | S | * | * | trans | -96.1 | 115.1 | 165.4 | 50.7 | -83.1 | 0 | 0 | 0 | 107.1 | ||||
| 62 | E | 38.8 | Very low | 37.9 | Very low | 174 Ų | 174 | 150.8 Ų | 150.8 | 81% | 0.813 | 80% | 0.796 | S | S | * | * | trans | -74.5 | 131.4 | 169.6 | -65.3 | -156.9 | 170 | 0 | 0 | 109.4 | ||||
| 63 | E | 34.9 | Very low | 37.6 | Very low | 162 Ų | 162 | 152.9 Ų | 152.9 | 76% | 0.757 | 80% | 0.795 | S | S | * | * | trans | -78 | 115.4 | 166.4 | -78.9 | 176.7 | 152.6 | 0 | 0 | 108.4 | ||||
| 64 | E | 36.9 | Very low | 37.3 | Very low | 159 Ų | 159 | 149.1 Ų | 149.1 | 74% | 0.743 | 79% | 0.793 | S | S | * | * | trans | -92.5 | 102.5 | 163.9 | -68.9 | -75.6 | -168.5 | 0 | 0 | 108 | D66 | E64-D66 PolarHBondContact O-N 3.36Š| ||
| 65 | E | 37 | Very low | 37 | Very low | 156 Ų | 156 | 148.7 Ų | 148.7 | 73% | 0.729 | 79% | 0.792 | S | S | * | * | trans | -79.5 | 95.9 | 168 | -72.7 | -179 | 157 | 0 | 0 | 109.4 | E67 | E65-E67 PolarHBondContact O-N 3.4Š| ||
| 66 | D | 34.4 | Very low | 37.5 | Very low | 155 Ų | 155 | 152.1 Ų | 152.1 | 83% | 0.829 | 79% | 0.792 | S | S | * | * | trans | -87.8 | 81.1 | 167.1 | -91.2 | -38.6 | 0 | 0 | 0 | 110.8 | E64 N68 | E64-D66 PolarHBondContact O-N 3.36Å; D66-N68 PolarHBondContact O-N 3.29Å | ||
| 67 | E | 42.7 | Very low | 37.8 | Very low | 171 Ų | 171 | 153.8 Ų | 153.8 | 80% | 0.799 | 79% | 0.794 | S | S | * | * | trans | -71.2 | 101.3 | 159.4 | -71 | -99.4 | 164.4 | 0 | 0 | 109.3 | E65 | E65-E67 PolarHBondContact O-N 3.4Š| ||
| 68 | N | 31.9 | Very low | 38.1 | Very low | 122 Ų | 122 | 154.5 Ų | 154.5 | 65% | 0.652 | 79% | 0.792 | S | S | * | * | trans | -139.2 | 68.6 | 165.7 | -161.1 | 9.8 | 0 | 0 | 0 | 112.1 | D66 R70 | D66-N68 PolarHBondContact O-N 3.29Å; N68-R70 PolarHBondContact O-N 3.08Å | ||
| 69 | S | 40.6 | Very low | 37.8 | Very low | 122 Ų | 122 | 151.2 Ų | 151.2 | 85% | 0.853 | 79% | 0.785 | S | S | * | * | trans | -82.3 | 98.6 | 154.9 | -81 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 70 | R | 40.8 | Very low | 37.7 | Very low | 218 Ų | 218 | 153.1 Ų | 153.1 | 82% | 0.823 | 79% | 0.79 | S | S | * | * | trans | -118.4 | 108.4 | 161.4 | -84.3 | -171.4 | 169.7 | 132.9 | 0.7 | 110.4 | N68 | N68-R70 PolarHBondContact O-N 3.08Š| ||
| 71 | Q | 36.7 | Very low | 37.9 | Very low | 167 Ų | 167 | 158.2 Ų | 158.2 | 78% | 0.78 | 79% | 0.79 | S | S | * | * | trans | -29.3 | 127.4 | 153 | -103 | 151.4 | -60.6 | 0 | 0 | 113.6 | E73 | Q71-E73 PolarHBondContact NE2-OE1 3.1Š| ||
| 72 | S | 37.2 | Very low | 38.2 | Very low | 118 Ų | 118 | 154.5 Ų | 154.5 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | trans | -141.3 | 107.6 | 144 | 64.6 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 73 | E | 37.2 | Very low | 38.4 | Very low | 143 Ų | 143 | 154.7 Ų | 154.7 | 67% | 0.668 | 79% | 0.792 | S | S | * | * | trans | -72.9 | 159.5 | 166.1 | -61.1 | 163.8 | -170.3 | 0 | 0 | 108.4 | Q71 | Q71-E73 PolarHBondContact NE2-OE1 3.1Š| ||
| 74 | D | 35.4 | Very low | 38.7 | Very low | 161 Ų | 161 | 151.4 Ų | 151.4 | 86% | 0.861 | 79% | 0.793 | S | S | * | * | trans | 81.9 | 108.9 | 171.8 | -51.4 | -47.3 | 0 | 0 | 0 | 118.3 | ||||
| 75 | D | 36.1 | Very low | 38.9 | Very low | 161 Ų | 161 | 151.7 Ų | 151.7 | 86% | 0.861 | 80% | 0.799 | S | S | * | * | -165.1 | 123.4 | 109.6 | -161.8 | 41.9 | 0 | 0 | 0 | 110.2 | |||||
| 76 | D | 43.2 | Very low | 38.8 | Very low | 146 Ų | 146 | 149.1 Ų | 149.1 | 78% | 0.781 | 79% | 0.79 | S | S | * | * | trans | -89 | 115 | -176.7 | -176.1 | 16.6 | 0 | 0 | 0 | 108.7 | ||||
| 77 | S | 41 | Very low | 39.5 | Very low | 97 Ų | 97 | 147.4 Ų | 147.4 | 68% | 0.678 | 79% | 0.787 | S | S | * | * | trans | -141.1 | 101.8 | 163.8 | 91 | 0 | 0 | 0 | 0 | 110.9 | T79 | S77-T79 PolarHBondContact O-N 3.34Š| ||
| 78 | E | 42.8 | Very low | 39.7 | Very low | 186 Ų | 186 | 146.8 Ų | 146.8 | 87% | 0.869 | 78% | 0.782 | S | S | * | * | trans | -54.2 | 126.2 | 156.8 | -70.9 | -167.6 | 141.7 | 0 | 0 | 109.8 | ||||
| 79 | T | 35.6 | Very low | 40.2 | Very low | 128 Ų | 128 | 147.5 Ų | 147.5 | 79% | 0.785 | 79% | 0.786 | S | S | * | * | trans | -146.1 | 111.9 | 153.3 | -47 | 0 | 0 | 0 | 0 | 108.9 | S77 | S77-T79 PolarHBondContact O-N 3.34Š| ||
| 80 | E | 37.1 | Very low | 40.3 | Very low | 187 Ų | 187 | 147.9 Ų | 147.9 | 87% | 0.874 | 78% | 0.778 | S | S | * | * | trans | -59 | 130.1 | 171.7 | -73.9 | -167.2 | 129.6 | 0 | 0 | 111.9 | ||||
| 81 | K | 40.8 | Very low | 40.6 | Very low | 184 Ų | 184 | 142 Ų | 142 | 80% | 0.8 | 77% | 0.767 | S | S | * | * | trans | 25.2 | 140.4 | 139.3 | -91.4 | -171.1 | 177.7 | -166.6 | 0 | 120 | ||||
| 82 | P | 40.6 | Very low | 41.2 | Very low | 128 Ų | 128 | 140 Ų | 140 | 83% | 0.831 | 76% | 0.757 | S | S | * | * | -139.6 | 169.1 | 77.7 | 33.2 | -14.4 | 0 | 0 | 0 | 116.4 | |||||
| 83 | E | 44.5 | Very low | 42 | Very low | 178 Ų | 178 | 136.8 Ų | 136.8 | 83% | 0.832 | 74% | 0.738 | S | S | * | * | trans | -44.3 | 138.4 | -177 | -61.5 | 175.8 | 135 | 0 | 0 | 117 | ||||
| 84 | A | 41 | Very low | 42.8 | Very low | 93 Ų | 93 | 138.2 Ų | 138.2 | 77% | 0.769 | 75% | 0.745 | S | S | * | * | trans | -162.6 | 120.1 | 137.3 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 85 | D | 41.1 | Very low | 43.9 | Very low | 165 Ų | 165 | 139.1 Ų | 139.1 | 88% | 0.882 | 74% | 0.741 | S | S | * | * | trans | 35.2 | 102.3 | 160.3 | -68.7 | -46.9 | 0 | 0 | 0 | 119.5 | P87 | D85-P87 WeakPolarHBondContact O-CD 3.48Š| ||
| 86 | D | 35.2 | Very low | 45.4 | Very low | 102 Ų | 102 | 136.9 Ų | 136.9 | 55% | 0.545 | 72% | 0.721 | S | S | . | * | trans | -86.2 | 112.9 | 173.6 | -171.4 | 13.6 | 0 | 0 | 0 | 110.9 | K88 | D86-K88 PolarHBondContact O-N 3.42Å; D86-K88 WeakPolarHBondContact OD1-CB 3.35Å; D86-K88 WeakPolarHBondContact OD1-CG 3.45Å; D86-K88 PolarHBondContact OD1-N 3.15Å; D86-K88 WeakPolarHBondContact OD2-CB 3.37Å; D86-K88 WeakPolarHBondContact OD2-CD 3.35Å; D86-K88 WeakPolarHBondContact OD2-CE 3.41Å; D86-K88 WeakPolarHBondContact OD2-CG 3.15Å; D86-K88 IonicContact OD2-NZ 3.62Å; D86-K88 PolarHBondContact OD2-NZ 2.91Å | ||
| 87 | P | 47.5 | Very low | 47.3 | Very low | 118 Ų | 118 | 134 Ų | 134 | 77% | 0.766 | 71% | 0.705 | S | S | * | * | trans | -86.1 | 65.3 | 160 | 35.5 | -29.3 | 0 | 0 | 0 | 108.5 | D85 D89 | D85-P87 WeakPolarHBondContact O-CD 3.48Å; P87-D89 PolarHBondContact O-N 3.32Å | ||
| 88 | K | 46.7 | Very low | 49.3 | Very low | 159 Ų | 159 | 133.4 Ų | 133.4 | 69% | 0.691 | 70% | 0.699 | S | S | * | * | trans | -75.6 | 77 | 167.7 | -107.7 | 178.6 | -139.5 | 139.6 | 0 | 109.1 | D86 | D86-K88 PolarHBondContact O-N 3.42Å; D86-K88 WeakPolarHBondContact OD1-CB 3.35Å; D86-K88 WeakPolarHBondContact OD1-CG 3.45Å; D86-K88 PolarHBondContact OD1-N 3.15Å; D86-K88 WeakPolarHBondContact OD2-CB 3.37Å; D86-K88 WeakPolarHBondContact OD2-CD 3.35Å; D86-K88 WeakPolarHBondContact OD2-CE 3.41Å; D86-K88 WeakPolarHBondContact OD2-CG 3.15Å; D86-K88 IonicContact OD2-NZ 3.62Å; D86-K88 PolarHBondContact OD2-NZ 2.91Å | ||
| 89 | D | 43.9 | Very low | 51.1 | Low | 136 Ų | 136 | 128.7 Ų | 128.7 | 73% | 0.727 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -149.7 | 34.7 | 164.1 | -157.6 | 21.9 | 0 | 0 | 0 | 113 | P87 | P87-D89 PolarHBondContact O-N 3.32Š|
| 90 | N | 42.5 | Very low | 53.4 | Low | 130 Ų | 130 | 128.4 Ų | 128.4 | 70% | 0.695 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -132.1 | -15.3 | 170.2 | -88.2 | -44.4 | 0 | 0 | 0 | 113.9 | ||
| 91 | T | 47.6 | Very low | 55.8 | Low | 94 Ų | 94 | 122.3 Ų | 122.3 | 58% | 0.577 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | -15.5 | -177.4 | -29.4 | 0 | 0 | 0 | 0 | 113.5 | ||
| 92 | E | 49.5 | Very low | 57.9 | Low | 125 Ų | 125 | 116.4 Ų | 116.4 | 58% | 0.584 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.8 | -25.9 | 175.3 | -81.7 | -156.7 | 158.3 | 0 | 0 | 113.7 | E94 K95 R96 | E92-E94 VanDerWaalsContact C-N 3.3Å; E92-E94 PolarHBondContact O-N 3.41Å; E92-K95 PolarHBondContact O-N 2.85Å; E92-R96 IonicContact OE2-CZ 3.53Å; E92-R96 IonicContact OE2-NH2 2.76Å; E92-R96 PolarHBondContact OE2-NH2 3.44Å |
| 93 | A | 53.8 | Low | 60.1 | Low | 51 Ų | 51 | 111.5 Ų | 111.5 | 42% | 0.421 | 59% | 0.589 | S | S | . | * | G | 310 helix | trans | -70 | -27.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | K95 | A93-K95 VanDerWaalsContact C-N 3.31Å; A93-K95 PolarHBondContact O-N 3.43Å |
| 94 | E | 53.5 | Low | 62.1 | Low | 173 Ų | 173 | 105.9 Ų | 105.9 | 81% | 0.808 | 57% | 0.57 | S | S | * | * | G | 310 helix | trans | -76.8 | -11.9 | 179.7 | -71.6 | -168.4 | 154.2 | 0 | 0 | 114.3 | E92 | E92-E94 VanDerWaalsContact C-N 3.3Å; E92-E94 PolarHBondContact O-N 3.41Å |
| 95 | K | 58.5 | Low | 64.3 | Low | 180 Ų | 180 | 107.5 Ų | 107.5 | 78% | 0.783 | 56% | 0.56 | S | S | * | * | G | 310 helix | trans | -109 | -6.9 | -175.9 | -62.3 | -172.7 | -175.5 | -177.5 | 0 | 114.7 | E92 A93 | E92-K95 PolarHBondContact O-N 2.85Å; A93-K95 VanDerWaalsContact C-N 3.31Å; A93-K95 PolarHBondContact O-N 3.43Å |
| 96 | R | 66.8 | Low | 66.5 | Low | 115 Ų | 115 | 101 Ų | 101 | 43% | 0.434 | 53% | 0.527 | S | S | . | . | S | Bend | trans | -82.3 | 140.7 | 178.5 | -68 | -162.1 | -174.1 | 101.2 | 8.4 | 110.4 | E92 L101 | E92-R96 IonicContact OE2-CZ 3.53Å; E92-R96 IonicContact OE2-NH2 2.76Å; E92-R96 PolarHBondContact OE2-NH2 3.44Å; R96-L101 HydrophobicContact CB-CD1 4.4Å; R96-L101 HydrophobicContact CB-CD2 3.85Å; R96-L101 HydrophobicContact CB-CG 3.92Å; R96-L101 HydrophobicContact CG-CD2 4.46Å |
| 97 | D | 82.9 | Confident | 69 | Low | 86 Ų | 86 | 101.4 Ų | 101.4 | 46% | 0.46 | 53% | 0.526 | S | S | . | . | trans | -57.6 | 132.8 | 174.2 | 178.3 | 66.1 | 0 | 0 | 0 | 109.6 | Q99 E100 L101 | D97-Q99 PolarHBondContact O-N 2.94Å; D97-Q99 VanDerWaalsContact O-N 3.1Å; D97-Q99 WeakPolarHBondContact OD2-CB 3.29Å; D97-Q99 PolarHBondContact OD2-N 3.44Å; D97-E100 HydrophobicContact CB-CB 4.4Å; D97-E100 HydrophobicContact CB-CG 4.12Å; D97-E100 WeakPolarHBondContact O-CB 3.3Å; D97-E100 PolarHBondContact O-N 2.76Å; D97-L101 PolarHBondContact O-N 2.75Å; D97-L101 VanDerWaalsContact O-N 3.15Å | ||
| 98 | P | 82.7 | Confident | 70.9 | Confident | 84 Ų | 84 | 104.2 Ų | 104.2 | 55% | 0.545 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -53.1 | -33.7 | -178.9 | -29.7 | 36.1 | 0 | 0 | 0 | 113.6 | L101 V102 | P98-L101 PolarHBondContact O-N 3.02Å; P98-V102 WeakPolarHBondContact O-CG2 3.49Å; P98-V102 PolarHBondContact O-N 3.03Å; P98-V102 VanDerWaalsContact O-N 3.09Å |
| 99 | Q | 81.6 | Confident | 72.8 | Confident | 87 Ų | 87 | 98.8 Ų | 98.8 | 41% | 0.407 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -70.6 | -34.8 | 178.1 | -111.8 | 74.3 | 1.6 | 0 | 0 | 112.4 | D97 V102 A103 K183 | D97-Q99 PolarHBondContact O-N 2.94Å; D97-Q99 VanDerWaalsContact O-N 3.1Å; D97-Q99 WeakPolarHBondContact OD2-CB 3.29Å; D97-Q99 PolarHBondContact OD2-N 3.44Å; Q99-V102 PolarHBondContact O-N 2.82Å; Q99-A103 WeakPolarHBondContact O-CB 3.48Å; Q99-A103 PolarHBondContact O-N 3.28Å; Q99-K183 HydrophobicContact CG-CD 4.47Å; Q99-K183 HydrophobicContact CG-CG 4.47Å |
| 100 | E | 84.8 | Confident | 74.8 | Confident | 121 Ų | 121 | 98.4 Ų | 98.4 | 57% | 0.565 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -67.1 | -38.2 | 173.5 | -70.2 | -173 | 167.2 | 0 | 0 | 111.8 | D97 A103 S104 | D97-E100 HydrophobicContact CB-CB 4.4Å; D97-E100 HydrophobicContact CB-CG 4.12Å; D97-E100 WeakPolarHBondContact O-CB 3.3Å; D97-E100 PolarHBondContact O-N 2.76Å; E100-A103 PolarHBondContact O-N 2.84Å; E100-S104 WeakPolarHBondContact O-CB 3.41Å; E100-S104 PolarHBondContact O-N 3.06Å; E100-S104 PolarHBondContact O-OG 3.42Å |
| 101 | L | 85.8 | Confident | 77 | Confident | 60 Ų | 60 | 98.2 Ų | 98.2 | 31% | 0.314 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.1 | -46.2 | 174.8 | -68.6 | 176.5 | 0 | 0 | 0 | 111.1 | R96 D97 P98 A103 S104 F105 | R96-L101 HydrophobicContact CB-CD1 4.4Å; R96-L101 HydrophobicContact CB-CD2 3.85Å; R96-L101 HydrophobicContact CB-CG 3.92Å; R96-L101 HydrophobicContact CG-CD2 4.46Å; D97-L101 PolarHBondContact O-N 2.75Å; D97-L101 VanDerWaalsContact O-N 3.15Å; P98-L101 PolarHBondContact O-N 3.02Å; L101-A103 PolarHBondContact O-N 3.17Å; L101-S104 PolarHBondContact O-N 3.48Å; L101-S104 PolarHBondContact O-OG 3.28Å; L101-F105 WeakPolarHBondContact O-CB 3.31Å; L101-F105 PolarHBondContact O-N 3.44Å |
| 102 | V | 85.6 | Confident | 78.9 | Confident | 60 Ų | 60 | 97.7 Ų | 97.7 | 36% | 0.364 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.7 | -44.6 | 175.2 | 173.7 | 0 | 0 | 0 | 0 | 111.2 | P98 Q99 F105 S106 P182 | P98-V102 WeakPolarHBondContact O-CG2 3.49Å; P98-V102 PolarHBondContact O-N 3.03Å; P98-V102 VanDerWaalsContact O-N 3.09Å; Q99-V102 PolarHBondContact O-N 2.82Å; V102-F105 PolarHBondContact O-N 2.86Å; V102-S106 WeakPolarHBondContact O-CB 3.31Å; V102-S106 PolarHBondContact O-N 3.26Å; V102-S106 PolarHBondContact O-OG 3.48Å; V102-P182 HydrophobicContact CG1-CB 4.44Å |
| 103 | A | 87.1 | Confident | 80.8 | Confident | 24 Ų | 24 | 94 Ų | 94 | 20% | 0.198 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -60.9 | -47.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q99 E100 L101 F105 S106 E107 P182 | Q99-A103 WeakPolarHBondContact O-CB 3.48Å; Q99-A103 PolarHBondContact O-N 3.28Å; E100-A103 PolarHBondContact O-N 2.84Å; L101-A103 PolarHBondContact O-N 3.17Å; A103-F105 VanDerWaalsContact C-N 3.34Å; A103-F105 PolarHBondContact O-N 2.82Å; A103-S106 PolarHBondContact O-N 3.39Å; A103-E107 WeakPolarHBondContact O-CB 3.34Å; A103-E107 PolarHBondContact O-N 3.16Å; A103-P182 HydrophobicContact CB-CB 3.72Å |
| 104 | S | 86.3 | Confident | 82.3 | Confident | 61 Ų | 61 | 96.7 Ų | 96.7 | 43% | 0.427 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.4 | -38.8 | 178.5 | 69.7 | 0 | 0 | 0 | 0 | 112.6 | E100 L101 E107 R108 | E100-S104 WeakPolarHBondContact O-CB 3.41Å; E100-S104 PolarHBondContact O-N 3.06Å; E100-S104 PolarHBondContact O-OG 3.42Å; L101-S104 PolarHBondContact O-N 3.48Å; L101-S104 PolarHBondContact O-OG 3.28Å; S104-E107 PolarHBondContact O-N 3.46Å; S104-R108 WeakPolarHBondContact O-CB 3.29Å; S104-R108 PolarHBondContact O-N 3.38Å |
| 105 | F | 86.4 | Confident | 83.9 | Confident | 127 Ų | 127 | 95.7 Ų | 95.7 | 56% | 0.557 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -65.5 | -48.7 | 174.6 | 177.4 | -101.3 | 0 | 0 | 0 | 111.2 | L101 V102 A103 E107 R108 V109 | L101-F105 WeakPolarHBondContact O-CB 3.31Å; L101-F105 PolarHBondContact O-N 3.44Å; V102-F105 PolarHBondContact O-N 2.86Å; A103-F105 VanDerWaalsContact C-N 3.34Å; A103-F105 PolarHBondContact O-N 2.82Å; F105-E107 VanDerWaalsContact C-N 3.31Å; F105-E107 PolarHBondContact O-N 3.46Å; F105-R108 PolarHBondContact O-N 3.45Å; F105-V109 HydrophobicContact CD1-CG2 4.22Å; F105-V109 HydrophobicContact CD2-CG2 4.33Å; F105-V109 HydrophobicContact CE1-CG2 3.76Å; F105-V109 HydrophobicContact CE2-CG2 3.87Å; F105-V109 HydrophobicContact CG-CG2 4.49Å; F105-V109 HydrophobicContact CZ-CG2 3.57Å; F105-V109 WeakPolarHBondContact O-CG2 3.34Å; F105-V109 PolarHBondContact O-N 3.04Å |
| 106 | S | 87.3 | Confident | 85.2 | Confident | 29 Ų | 29 | 92.7 Ų | 92.7 | 20% | 0.203 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -60.5 | -38.5 | 176.5 | -77.4 | 0 | 0 | 0 | 0 | 112.3 | V102 A103 R110 | V102-S106 WeakPolarHBondContact O-CB 3.31Å; V102-S106 PolarHBondContact O-N 3.26Å; V102-S106 PolarHBondContact O-OG 3.48Å; A103-S106 PolarHBondContact O-N 3.39Å; S106-R110 WeakPolarHBondContact O-CB 3.29Å; S106-R110 WeakPolarHBondContact O-CG 3.49Å; S106-R110 PolarHBondContact O-N 3.27Å; S106-R110 PolarHBondContact O-NE 2.85Å |
| 107 | E | 88.2 | Confident | 86.2 | Confident | 110 Ų | 110 | 91.7 Ų | 91.7 | 51% | 0.514 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63.2 | -47.3 | 173.2 | -174 | 177.2 | -172.3 | 0 | 0 | 111.8 | A103 S104 F105 V109 R110 N111 | A103-E107 WeakPolarHBondContact O-CB 3.34Å; A103-E107 PolarHBondContact O-N 3.16Å; S104-E107 PolarHBondContact O-N 3.46Å; F105-E107 VanDerWaalsContact C-N 3.31Å; F105-E107 PolarHBondContact O-N 3.46Å; E107-V109 PolarHBondContact O-N 3.06Å; E107-R110 PolarHBondContact O-N 2.8Å; E107-N111 VanDerWaalsContact O-CG 3.28Å; E107-N111 PolarHBondContact O-N 3.19Å; E107-N111 VanDerWaalsContact O-N 3.13Å; E107-N111 PolarHBondContact O-ND2 3.31Å; E107-N111 VanDerWaalsContact O-ND2 3.16Å |
| 108 | R | 87.7 | Confident | 86.3 | Confident | 177 Ų | 177 | 95.9 Ų | 95.9 | 67% | 0.668 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -60.9 | -43.8 | 177.9 | 175.5 | 156.1 | -83.1 | -176.9 | -4.4 | 112.3 | S104 F105 N111 M112 | S104-R108 WeakPolarHBondContact O-CB 3.29Å; S104-R108 PolarHBondContact O-N 3.38Å; F105-R108 PolarHBondContact O-N 3.45Å; R108-N111 PolarHBondContact O-N 2.95Å; R108-M112 HydrophobicContact CG-CE 3.93Å; R108-M112 PolarHBondContact O-N 2.99Å |
| 109 | V | 87 | Confident | 86.5 | Confident | 45 Ų | 45 | 99.5 Ų | 99.5 | 27% | 0.273 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.1 | -40.6 | 177.5 | 174 | 0 | 0 | 0 | 0 | 111.3 | F105 E107 N111 M112 I117 | F105-V109 HydrophobicContact CD1-CG2 4.22Å; F105-V109 HydrophobicContact CD2-CG2 4.33Å; F105-V109 HydrophobicContact CE1-CG2 3.76Å; F105-V109 HydrophobicContact CE2-CG2 3.87Å; F105-V109 HydrophobicContact CG-CG2 4.49Å; F105-V109 HydrophobicContact CZ-CG2 3.57Å; F105-V109 WeakPolarHBondContact O-CG2 3.34Å; F105-V109 PolarHBondContact O-N 3.04Å; E107-V109 PolarHBondContact O-N 3.06Å; V109-N111 PolarHBondContact O-N 3.32Å; V109-M112 PolarHBondContact O-N 3.29Å; V109-I117 HydrophobicContact CG1-CD1 4.07Å; V109-I117 HydrophobicContact CG1-CG1 4.49Å |
| 110 | R | 85.6 | Confident | 86.6 | Confident | 128 Ų | 128 | 99.7 Ų | 99.7 | 48% | 0.483 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.2 | -28.2 | 176.7 | -78.4 | -177.5 | -68.6 | 175.4 | -3.3 | 113.4 | S106 E107 D184 M185 | S106-R110 WeakPolarHBondContact O-CB 3.29Å; S106-R110 WeakPolarHBondContact O-CG 3.49Å; S106-R110 PolarHBondContact O-N 3.27Å; S106-R110 PolarHBondContact O-NE 2.85Å; E107-R110 PolarHBondContact O-N 2.8Å; R110-D184 IonicContact NH2-OD2 2.66Å; R110-M185 VanDerWaalsContact NH1-CE 3.3Å |
| 111 | N | 88.4 | Confident | 86.6 | Confident | 126 Ų | 126 | 99.5 Ų | 99.5 | 67% | 0.674 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.5 | -4.4 | -179.2 | -65.8 | -27.4 | 0 | 0 | 0 | 113.5 | E107 R108 V109 | E107-N111 VanDerWaalsContact O-CG 3.28Å; E107-N111 PolarHBondContact O-N 3.19Å; E107-N111 VanDerWaalsContact O-N 3.13Å; E107-N111 PolarHBondContact O-ND2 3.31Å; E107-N111 VanDerWaalsContact O-ND2 3.16Å; R108-N111 PolarHBondContact O-N 2.95Å; V109-N111 PolarHBondContact O-N 3.32Å |
| 112 | M | 88.3 | Confident | 86.4 | Confident | 83 Ų | 83 | 105.4 Ų | 105.4 | 41% | 0.409 | 54% | 0.544 | S | S | . | . | S | Bend | trans | -90.7 | 152.6 | 174.7 | -76.6 | -177.9 | 178.4 | 0 | 0 | 111.6 | R108 V109 E116 I117 | R108-M112 HydrophobicContact CG-CE 3.93Å; R108-M112 PolarHBondContact O-N 2.99Å; V109-M112 PolarHBondContact O-N 3.29Å; M112-E116 HydrophobicContact CB-CB 4.39Å; M112-I117 HydrophobicContact CB-CG1 4.46Å |
| 113 | S | 87.6 | Confident | 86.4 | Confident | 48 Ų | 48 | 108.1 Ų | 108.1 | 34% | 0.336 | 56% | 0.563 | S | S | . | * | trans | -72.2 | 151.4 | 168.2 | 65.7 | 0 | 0 | 0 | 0 | 110.7 | D115 E116 | S113-D115 PolarHBondContact O-N 3.22Å; S113-D115 VanDerWaalsContact O-N 3.1Å; S113-E116 PolarHBondContact N-OE2 3.15Å; S113-E116 PolarHBondContact O-N 3.38Å; S113-E116 VanDerWaalsContact OG-CG 3.25Å; S113-E116 WeakPolarHBondContact OG-CG 3.47Å; S113-E116 PolarHBondContact OG-OE2 3.39Å | ||
| 114 | P | 85.3 | Confident | 86 | Confident | 107 Ų | 107 | 113.4 Ų | 113.4 | 70% | 0.695 | 60% | 0.595 | S | S | * | * | G | 310 helix | trans | -54.8 | -32.1 | -178.9 | -27.6 | 35.5 | 0 | 0 | 0 | 114.2 | E116 I117 | P114-E116 VanDerWaalsContact C-N 3.29Å; P114-E116 PolarHBondContact O-N 2.95Å; P114-I117 PolarHBondContact O-N 2.97Å |
| 115 | D | 87.3 | Confident | 85.8 | Confident | 152 Ų | 152 | 113.9 Ų | 113.9 | 81% | 0.813 | 61% | 0.61 | S | S | * | * | G | 310 helix | trans | -74.3 | -19.2 | -179.3 | -62.7 | -29 | 0 | 0 | 0 | 113.3 | S113 | S113-D115 PolarHBondContact O-N 3.22Å; S113-D115 VanDerWaalsContact O-N 3.1Å |
| 116 | E | 86 | Confident | 85.6 | Confident | 117 Ų | 117 | 119.4 Ų | 119.4 | 55% | 0.547 | 63% | 0.627 | S | S | . | * | G | 310 helix | trans | -88.7 | -14.5 | 177.4 | -69.5 | 166.8 | 153.1 | 0 | 0 | 112.4 | M112 S113 P114 K118 | M112-E116 HydrophobicContact CB-CB 4.39Å; S113-E116 PolarHBondContact N-OE2 3.15Å; S113-E116 PolarHBondContact O-N 3.38Å; S113-E116 VanDerWaalsContact OG-CG 3.25Å; S113-E116 WeakPolarHBondContact OG-CG 3.47Å; S113-E116 PolarHBondContact OG-OE2 3.39Å; P114-E116 VanDerWaalsContact C-N 3.29Å; P114-E116 PolarHBondContact O-N 2.95Å; E116-K118 PolarHBondContact O-N 2.95Å; E116-K118 VanDerWaalsContact O-N 3.16Å |
| 117 | I | 87.6 | Confident | 85.4 | Confident | 94 Ų | 94 | 122.2 Ų | 122.2 | 48% | 0.482 | 65% | 0.645 | S | S | . | * | trans | -71.7 | 110 | 178.5 | -57.6 | 175.8 | 0 | 0 | 0 | 108.9 | V109 M112 P114 | V109-I117 HydrophobicContact CG1-CD1 4.07Å; V109-I117 HydrophobicContact CG1-CG1 4.49Å; M112-I117 HydrophobicContact CB-CG1 4.46Å; P114-I117 PolarHBondContact O-N 2.97Å | ||
| 118 | K | 86.3 | Confident | 85.5 | Confident | 173 Ų | 173 | 120.5 Ų | 120.5 | 75% | 0.752 | 65% | 0.646 | S | S | * | * | trans | -121.8 | 152 | 177.4 | -66.8 | 177.1 | -176 | 171 | 0 | 110.3 | E116 | E116-K118 PolarHBondContact O-N 2.95Å; E116-K118 VanDerWaalsContact O-N 3.16Å | ||
| 119 | I | 86.7 | Confident | 85.7 | Confident | 160 Ų | 160 | 117.6 Ų | 117.6 | 82% | 0.821 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 132.2 | 170.4 | -58.1 | 176.8 | 0 | 0 | 0 | 107.6 | ||
| 120 | P | 82.8 | Confident | 86 | Confident | 91 Ų | 91 | 121.5 Ų | 121.5 | 59% | 0.591 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 146.8 | 176.2 | -26.4 | 34.2 | 0 | 0 | 0 | 112 | ||
| 121 | P | 84.5 | Confident | 86.3 | Confident | 118 Ų | 118 | 119.6 Ų | 119.6 | 77% | 0.766 | 66% | 0.657 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 158.3 | 172.3 | 29 | -34.8 | 0 | 0 | 0 | 110.5 | ||
| 122 | E | 83.2 | Confident | 86.5 | Confident | 184 Ų | 184 | 117.6 Ų | 117.6 | 86% | 0.86 | 64% | 0.644 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 134.4 | 177.3 | -67.7 | 179.8 | -178 | 0 | 0 | 110.4 | ||
| 123 | P | 83.8 | Confident | 86.8 | Confident | 117 Ų | 117 | 118.5 Ų | 118.5 | 76% | 0.76 | 65% | 0.65 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 136 | -177.6 | 24.4 | -33.1 | 0 | 0 | 0 | 110.1 | G125 | P123-G125 PolarHBondContact O-N 3.45Š|
| 124 | P | 79.9 | Confident | 87.2 | Confident | 135 Ų | 135 | 121.5 Ų | 121.5 | 88% | 0.877 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -68.8 | 126.1 | 177 | 28.2 | -32.9 | 0 | 0 | 0 | 109.9 | ||
| 125 | G | 81.8 | Confident | 87.6 | Confident | 71 Ų | 71 | 121.2 Ų | 121.2 | 73% | 0.732 | 65% | 0.649 | S | S | * | * | S | Bend | trans | 143.9 | 162.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | P123 | P123-G125 PolarHBondContact O-N 3.45Š|
| 126 | R | 81.4 | Confident | 87.9 | Confident | 243 Ų | 243 | 119 Ų | 119 | 92% | 0.917 | 63% | 0.634 | S | S | * | * | P | Polyproline II helix | trans | -92.5 | 132.3 | 167.5 | -68.1 | -176.9 | -179.2 | -114.6 | 1.1 | 108.3 | ||
| 127 | C | 83.2 | Confident | 88.3 | Confident | 87 Ų | 87 | 121 Ų | 121 | 59% | 0.588 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 153 | 170.9 | -59.6 | 0 | 0 | 0 | 0 | 110.2 | N129 Q132 | C127-N129 PolarHBondContact O-N 3.09Å; C127-Q132 HydrophobicContact CB-CG 3.77Å; C127-Q132 PolarHBondContact O-NE2 3.1Å |
| 128 | S | 90.4 | Very high | 88.4 | Confident | 74 Ų | 74 | 120.1 Ų | 120.1 | 52% | 0.517 | 64% | 0.637 | S | S | . | * | P | Polyproline II helix | trans | -52.7 | 127.5 | 172.9 | 169.1 | 0 | 0 | 0 | 0 | 111.2 | H130 L131 Q132 | S128-H130 VanDerWaalsContact C-N 3.29Å; S128-H130 PolarHBondContact O-N 3.33Å; S128-L131 PolarHBondContact O-N 3.37Å; S128-L131 VanDerWaalsContact O-N 3.08Å; S128-Q132 WeakPolarHBondContact O-CG 3.33Å; S128-Q132 PolarHBondContact O-N 2.99Å |
| 129 | N | 92.1 | Very high | 88.7 | Confident | 116 Ų | 116 | 118.8 Ų | 118.8 | 62% | 0.62 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -56.8 | -43.4 | -178.8 | -68.4 | -51.5 | 0 | 0 | 0 | 111.3 | C127 L131 Q132 D133 | C127-N129 PolarHBondContact O-N 3.09Å; N129-L131 VanDerWaalsContact C-N 3.29Å; N129-L131 PolarHBondContact O-N 2.88Å; N129-Q132 WeakPolarHBondContact O-CB 3.46Å; N129-Q132 PolarHBondContact O-N 2.89Å; N129-Q132 VanDerWaalsContact O-N 3.15Å; N129-D133 VanDerWaalsContact O-CG 3.31Å; N129-D133 PolarHBondContact O-N 3.42Å |
| 130 | H | 93.2 | Very high | 89.1 | Confident | 127 Ų | 127 | 114.4 Ų | 114.4 | 59% | 0.588 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -59.6 | -37.5 | 177.5 | 172.5 | -100.2 | 0 | 0 | 0 | 113 | S128 K134 | S128-H130 VanDerWaalsContact C-N 3.29Å; S128-H130 PolarHBondContact O-N 3.33Å; H130-K134 WeakPolarHBondContact O-CB 3.25Å; H130-K134 PolarHBondContact O-N 3.49Å; H130-K134 VanDerWaalsContact O-N 3.1Å |
| 131 | L | 92.5 | Very high | 89.5 | Confident | 88 Ų | 88 | 114 Ų | 114 | 46% | 0.461 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -71.7 | -41.2 | 177.2 | -173 | 66.2 | 0 | 0 | 0 | 111.3 | S128 N129 K134 I135 | S128-L131 PolarHBondContact O-N 3.37Å; S128-L131 VanDerWaalsContact O-N 3.08Å; N129-L131 VanDerWaalsContact C-N 3.29Å; N129-L131 PolarHBondContact O-N 2.88Å; L131-K134 PolarHBondContact O-N 2.84Å; L131-I135 HydrophobicContact CD1-CD1 4.4Å; L131-I135 HydrophobicContact CG-CD1 3.98Å; L131-I135 VanDerWaalsContact O-CG1 3.3Å; L131-I135 WeakPolarHBondContact O-CG1 3.44Å; L131-I135 PolarHBondContact O-N 3.36Å |
| 132 | Q | 92.9 | Very high | 89.9 | Confident | 85 Ų | 85 | 114.5 Ų | 114.5 | 40% | 0.397 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -59.3 | -47.3 | 175.6 | -68 | -176.3 | 53.9 | 0 | 0 | 111 | C127 S128 N129 K134 I135 Q136 | C127-Q132 HydrophobicContact CB-CG 3.77Å; C127-Q132 PolarHBondContact O-NE2 3.1Å; S128-Q132 WeakPolarHBondContact O-CG 3.33Å; S128-Q132 PolarHBondContact O-N 2.99Å; N129-Q132 WeakPolarHBondContact O-CB 3.46Å; N129-Q132 PolarHBondContact O-N 2.89Å; N129-Q132 VanDerWaalsContact O-N 3.15Å; Q132-K134 VanDerWaalsContact C-N 3.34Å; Q132-K134 PolarHBondContact O-N 3.39Å; Q132-I135 PolarHBondContact O-N 2.97Å; Q132-Q136 VanDerWaalsContact O-CB 3.31Å; Q132-Q136 WeakPolarHBondContact O-CB 3.32Å; Q132-Q136 PolarHBondContact O-N 3.16Å |
| 133 | D | 95.1 | Very high | 90.3 | Very high | 101 Ų | 101 | 110.8 Ų | 110.8 | 54% | 0.54 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -62.3 | -40.9 | 178.1 | -66.9 | -24.9 | 0 | 0 | 0 | 111.9 | N129 Q136 K137 | N129-D133 VanDerWaalsContact O-CG 3.31Å; N129-D133 PolarHBondContact O-N 3.42Å; D133-Q136 PolarHBondContact O-N 3.2Å; D133-K137 VanDerWaalsContact O-CB 3.29Å; D133-K137 WeakPolarHBondContact O-CB 3.25Å; D133-K137 PolarHBondContact O-N 3.49Å |
| 134 | K | 94.8 | Very high | 90.7 | Very high | 111 Ų | 111 | 112.7 Ų | 112.7 | 48% | 0.483 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -62.3 | -47.4 | 176.2 | -176.4 | 178.2 | -68 | -176.9 | 0 | 111.5 | H130 L131 Q132 K137 L138 | H130-K134 WeakPolarHBondContact O-CB 3.25Å; H130-K134 PolarHBondContact O-N 3.49Å; H130-K134 VanDerWaalsContact O-N 3.1Å; L131-K134 PolarHBondContact O-N 2.84Å; Q132-K134 VanDerWaalsContact C-N 3.34Å; Q132-K134 PolarHBondContact O-N 3.39Å; K134-K137 PolarHBondContact O-N 3.44Å; K134-L138 HydrophobicContact CG-CD1 4.46Å; K134-L138 VanDerWaalsContact O-CG 3.31Å; K134-L138 WeakPolarHBondContact O-CG 3.16Å; K134-L138 PolarHBondContact O-N 3.3Å |
| 135 | I | 93.9 | Very high | 91 | Very high | 101 Ų | 101 | 112.8 Ų | 112.8 | 52% | 0.518 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.8 | -44.7 | 178.1 | -68.4 | 168.8 | 0 | 0 | 0 | 110 | L131 Q132 K137 L138 Y139 | L131-I135 HydrophobicContact CD1-CD1 4.4Å; L131-I135 HydrophobicContact CG-CD1 3.98Å; L131-I135 VanDerWaalsContact O-CG1 3.3Å; L131-I135 WeakPolarHBondContact O-CG1 3.44Å; L131-I135 PolarHBondContact O-N 3.36Å; Q132-I135 PolarHBondContact O-N 2.97Å; I135-K137 PolarHBondContact O-N 3.01Å; I135-L138 PolarHBondContact O-N 3.24Å; I135-Y139 WeakPolarHBondContact O-CB 3.49Å; I135-Y139 PolarHBondContact O-N 2.9Å |
| 136 | Q | 93.9 | Very high | 91.2 | Very high | 107 Ų | 107 | 112.3 Ų | 112.3 | 50% | 0.5 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -59.6 | -47.8 | 177.8 | -179.7 | 173.1 | -14.4 | 0 | 0 | 111.1 | Q132 D133 L138 Y139 E140 | Q132-Q136 VanDerWaalsContact O-CB 3.31Å; Q132-Q136 WeakPolarHBondContact O-CB 3.32Å; Q132-Q136 PolarHBondContact O-N 3.16Å; D133-Q136 PolarHBondContact O-N 3.2Å; Q136-L138 VanDerWaalsContact C-N 3.33Å; Q136-L138 PolarHBondContact O-N 3.28Å; Q136-Y139 PolarHBondContact O-N 3.27Å; Q136-E140 HydrophobicContact CG-CG 4.38Å; Q136-E140 WeakPolarHBondContact CG-OE1 3.42Å; Q136-E140 PolarHBondContact NE2-OE1 3.29Å; Q136-E140 WeakPolarHBondContact O-CB 3.5Å; Q136-E140 WeakPolarHBondContact O-CG 3.42Å; Q136-E140 PolarHBondContact O-N 3.2Å |
| 137 | K | 93.6 | Very high | 91.4 | Very high | 157 Ų | 157 | 103.4 Ų | 103.4 | 68% | 0.683 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.3 | -42.6 | 177.1 | -173.1 | 174.8 | -177.4 | 174.7 | 0 | 112.1 | D133 K134 I135 R141 | D133-K137 VanDerWaalsContact O-CB 3.29Å; D133-K137 WeakPolarHBondContact O-CB 3.25Å; D133-K137 PolarHBondContact O-N 3.49Å; K134-K137 PolarHBondContact O-N 3.44Å; I135-K137 PolarHBondContact O-N 3.01Å; K137-R141 VanDerWaalsContact O-CB 3.29Å; K137-R141 WeakPolarHBondContact O-CB 3.45Å; K137-R141 PolarHBondContact O-N 3.13Å |
| 138 | L | 91.4 | Very high | 91.6 | Very high | 76 Ų | 76 | 102.9 Ų | 102.9 | 40% | 0.398 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65 | -40.8 | 175.9 | -71.9 | 176.7 | 0 | 0 | 0 | 112.3 | K134 I135 Q136 R141 K142 M149 | K134-L138 HydrophobicContact CG-CD1 4.46Å; K134-L138 VanDerWaalsContact O-CG 3.31Å; K134-L138 WeakPolarHBondContact O-CG 3.16Å; K134-L138 PolarHBondContact O-N 3.3Å; I135-L138 PolarHBondContact O-N 3.24Å; Q136-L138 VanDerWaalsContact C-N 3.33Å; Q136-L138 PolarHBondContact O-N 3.28Å; L138-R141 PolarHBondContact O-N 2.98Å; L138-K142 WeakPolarHBondContact O-CB 3.42Å; L138-K142 PolarHBondContact O-N 3.36Å; L138-M149 HydrophobicContact CD2-CE 4.03Å |
| 139 | Y | 92.6 | Very high | 91.5 | Very high | 146 Ų | 146 | 103.6 Ų | 103.6 | 57% | 0.573 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -67.5 | -46 | 179.3 | -176.5 | -102.8 | 0 | 0 | 0 | 112 | I135 Q136 R141 K142 I143 | I135-Y139 WeakPolarHBondContact O-CB 3.49Å; I135-Y139 PolarHBondContact O-N 2.9Å; Q136-Y139 PolarHBondContact O-N 3.27Å; Y139-R141 VanDerWaalsContact C-N 3.3Å; Y139-R141 PolarHBondContact O-N 3.28Å; Y139-K142 WeakPolarHBondContact O-CB 3.39Å; Y139-K142 PolarHBondContact O-N 3.5Å; Y139-I143 HydrophobicContact CD1-CD1 3.86Å; Y139-I143 HydrophobicContact CE1-CD1 3.23Å; Y139-I143 HydrophobicContact CE1-CG1 4.38Å; Y139-I143 HydrophobicContact CE2-CD1 4.08Å; Y139-I143 PolarHBondContact O-N 3.44Å |
| 140 | E | 94.1 | Very high | 91.4 | Very high | 68 Ų | 68 | 102.5 Ų | 102.5 | 32% | 0.318 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.8 | -42.9 | 175.1 | -74.5 | -172.5 | -153.8 | 0 | 0 | 111.5 | Q136 I143 K144 | Q136-E140 HydrophobicContact CG-CG 4.38Å; Q136-E140 WeakPolarHBondContact CG-OE1 3.42Å; Q136-E140 PolarHBondContact NE2-OE1 3.29Å; Q136-E140 WeakPolarHBondContact O-CB 3.5Å; Q136-E140 WeakPolarHBondContact O-CG 3.42Å; Q136-E140 PolarHBondContact O-N 3.2Å; E140-I143 PolarHBondContact O-N 3.26Å; E140-K144 HydrophobicContact CB-CD 4.47Å; E140-K144 VanDerWaalsContact O-CB 3.29Å; E140-K144 WeakPolarHBondContact O-CB 3.29Å; E140-K144 WeakPolarHBondContact O-CG 3.43Å; E140-K144 PolarHBondContact O-N 3.1Å; E140-K144 IonicContact OE2-NZ 2.69Å; E140-K144 PolarHBondContact OE2-NZ 3.5Å |
| 141 | R | 91.7 | Very high | 91.3 | Very high | 83 Ų | 83 | 101.8 Ų | 101.8 | 31% | 0.313 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.7 | -42.9 | 175.7 | -179.9 | 158.6 | 64.1 | 164.2 | 5.8 | 112.4 | K137 L138 Y139 I143 E145 M147 | K137-R141 VanDerWaalsContact O-CB 3.29Å; K137-R141 WeakPolarHBondContact O-CB 3.45Å; K137-R141 PolarHBondContact O-N 3.13Å; L138-R141 PolarHBondContact O-N 2.98Å; Y139-R141 VanDerWaalsContact C-N 3.3Å; Y139-R141 PolarHBondContact O-N 3.28Å; R141-I143 VanDerWaalsContact C-N 3.29Å; R141-I143 PolarHBondContact O-N 3.41Å; R141-E145 WeakPolarHBondContact CD-OE2 3.37Å; R141-E145 HydrophobicContact CG-CB 4.33Å; R141-E145 HydrophobicContact CG-CG 4.32Å; R141-E145 VanDerWaalsContact CG-OE2 3.25Å; R141-E145 WeakPolarHBondContact CG-OE2 3.35Å; R141-E145 WeakPolarHBondContact O-CA 3.41Å; R141-E145 WeakPolarHBondContact O-CB 3.18Å; R141-E145 PolarHBondContact O-N 3.05Å; R141-M147 WeakPolarHBondContact CD-SD 3.41Å; R141-M147 HydrophobicContact CG-CB 3.89Å; R141-M147 HydrophobicContact CG-CG 4.43Å; R141-M147 HydrophobicContact CG-SD 3.71Å; R141-M147 VanDerWaalsContact CZ-SD 3.52Å; R141-M147 PolarHBondContact NE-SD 3.39Å |
| 142 | K | 92.1 | Very high | 91.3 | Very high | 128 Ų | 128 | 100 Ų | 100 | 56% | 0.557 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -57.5 | -42.7 | 174.4 | 178.6 | -179.9 | 175.8 | 177.6 | 0 | 111.8 | L138 Y139 G146 | L138-K142 WeakPolarHBondContact O-CB 3.42Å; L138-K142 PolarHBondContact O-N 3.36Å; Y139-K142 WeakPolarHBondContact O-CB 3.39Å; Y139-K142 PolarHBondContact O-N 3.5Å; K142-G146 VanDerWaalsContact O-CA 3.29Å; K142-G146 WeakPolarHBondContact O-CA 3.29Å; K142-G146 PolarHBondContact O-N 3.1Å |
| 143 | I | 92.3 | Very high | 91.1 | Very high | 105 Ų | 105 | 99.6 Ų | 99.6 | 54% | 0.538 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -76.9 | -47 | -177.9 | -67.6 | 178.7 | 0 | 0 | 0 | 112.3 | Y139 E140 R141 | Y139-I143 HydrophobicContact CD1-CD1 3.86Å; Y139-I143 HydrophobicContact CE1-CD1 3.23Å; Y139-I143 HydrophobicContact CE1-CG1 4.38Å; Y139-I143 HydrophobicContact CE2-CD1 4.08Å; Y139-I143 PolarHBondContact O-N 3.44Å; E140-I143 PolarHBondContact O-N 3.26Å; R141-I143 VanDerWaalsContact C-N 3.29Å; R141-I143 PolarHBondContact O-N 3.41Å |
| 144 | K | 91.3 | Very high | 90.9 | Very high | 157 Ų | 157 | 100.3 Ų | 100.3 | 68% | 0.683 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -78.1 | -44.2 | -172.6 | -68.3 | 172.2 | 179.7 | 167.6 | 0 | 112.4 | E140 | E140-K144 HydrophobicContact CB-CD 4.47Å; E140-K144 VanDerWaalsContact O-CB 3.29Å; E140-K144 WeakPolarHBondContact O-CB 3.29Å; E140-K144 WeakPolarHBondContact O-CG 3.43Å; E140-K144 PolarHBondContact O-N 3.1Å; E140-K144 IonicContact OE2-NZ 2.69Å; E140-K144 PolarHBondContact OE2-NZ 3.5Å |
| 145 | E | 87.4 | Confident | 90.7 | Very high | 138 Ų | 138 | 102.3 Ų | 102.3 | 65% | 0.645 | 49% | 0.485 | S | S | * | . | S | Bend | trans | -96.7 | -4.9 | -175.1 | -60.3 | 170.4 | -153 | 0 | 0 | 112.3 | R141 M147 | R141-E145 WeakPolarHBondContact CD-OE2 3.37Å; R141-E145 HydrophobicContact CG-CB 4.33Å; R141-E145 HydrophobicContact CG-CG 4.32Å; R141-E145 VanDerWaalsContact CG-OE2 3.25Å; R141-E145 WeakPolarHBondContact CG-OE2 3.35Å; R141-E145 WeakPolarHBondContact O-CA 3.41Å; R141-E145 WeakPolarHBondContact O-CB 3.18Å; R141-E145 PolarHBondContact O-N 3.05Å; E145-M147 PolarHBondContact O-N 2.83Å |
| 146 | G | 86.1 | Confident | 90.7 | Very high | 61 Ų | 61 | 102.2 Ų | 102.2 | 63% | 0.629 | 48% | 0.481 | S | S | * | . | trans | 64.7 | 23.5 | -173.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | K142 D148 | K142-G146 VanDerWaalsContact O-CA 3.29Å; K142-G146 WeakPolarHBondContact O-CA 3.29Å; K142-G146 PolarHBondContact O-N 3.1Å; G146-D148 PolarHBondContact O-N 3.32Å | ||
| 147 | M | 84.3 | Confident | 90.6 | Very high | 56 Ų | 56 | 104.2 Ų | 104.2 | 28% | 0.276 | 49% | 0.488 | S | S | . | . | trans | -70.9 | 102.5 | -175.7 | -164.8 | -179.4 | -136.6 | 0 | 0 | 111 | R141 E145 M149 I152 | R141-M147 WeakPolarHBondContact CD-SD 3.41Å; R141-M147 HydrophobicContact CG-CB 3.89Å; R141-M147 HydrophobicContact CG-CG 4.43Å; R141-M147 HydrophobicContact CG-SD 3.71Å; R141-M147 VanDerWaalsContact CZ-SD 3.52Å; R141-M147 PolarHBondContact NE-SD 3.39Å; E145-M147 PolarHBondContact O-N 2.83Å; M147-M149 HydrophobicContact CG-CE 4.35Å; M147-M149 HydrophobicContact SD-CE 3.69Å; M147-I152 HydrophobicContact CE-CD1 3.68Å; M147-I152 HydrophobicContact CG-CD1 3.52Å; M147-I152 HydrophobicContact SD-CD1 4.23Å | ||
| 148 | D | 88.8 | Confident | 90.3 | Very high | 75 Ų | 75 | 101.5 Ų | 101.5 | 40% | 0.401 | 48% | 0.477 | S | S | . | . | trans | -96.1 | 112.2 | 171.9 | -178.3 | 7.2 | 0 | 0 | 0 | 110.9 | G146 N150 Y151 I152 | G146-D148 PolarHBondContact O-N 3.32Å; D148-N150 VanDerWaalsContact C-N 3.29Å; D148-N150 PolarHBondContact O-N 3.29Å; D148-N150 WeakPolarHBondContact OD1-CB 3.02Å; D148-N150 PolarHBondContact OD1-N 2.86Å; D148-Y151 WeakPolarHBondContact O-CB 3.42Å; D148-Y151 PolarHBondContact O-N 2.93Å; D148-I152 VanDerWaalsContact O-CG1 3.29Å; D148-I152 WeakPolarHBondContact O-CG1 3.08Å; D148-I152 PolarHBondContact O-N 3.03Å | ||
| 149 | M | 87.8 | Confident | 90.3 | Very high | 89 Ų | 89 | 101.6 Ų | 101.6 | 44% | 0.438 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.9 | -36.9 | 178 | -67.2 | -61.9 | 172.5 | 0 | 0 | 112.3 | L138 M147 Y151 I152 I153 | L138-M149 HydrophobicContact CD2-CE 4.03Å; M147-M149 HydrophobicContact CG-CE 4.35Å; M147-M149 HydrophobicContact SD-CE 3.69Å; M149-Y151 VanDerWaalsContact C-N 3.34Å; M149-I152 PolarHBondContact O-N 3.33Å; M149-I152 HydrophobicContact SD-CD1 4.35Å; M149-I153 WeakPolarHBondContact O-CB 3.22Å; M149-I153 WeakPolarHBondContact O-CD1 3.46Å; M149-I153 VanDerWaalsContact O-CG1 3.22Å; M149-I153 WeakPolarHBondContact O-CG1 3.4Å; M149-I153 PolarHBondContact O-N 2.93Å |
| 150 | N | 90.2 | Very high | 90.2 | Very high | 94 Ų | 94 | 102.1 Ų | 102.1 | 50% | 0.503 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64.2 | -45.2 | 178.4 | -170.9 | 7.7 | 0 | 0 | 0 | 109.9 | D148 I152 I153 Q154 | D148-N150 VanDerWaalsContact C-N 3.29Å; D148-N150 PolarHBondContact O-N 3.29Å; D148-N150 WeakPolarHBondContact OD1-CB 3.02Å; D148-N150 PolarHBondContact OD1-N 2.86Å; N150-I152 VanDerWaalsContact C-N 3.35Å; N150-I152 PolarHBondContact O-N 3.07Å; N150-I153 PolarHBondContact O-N 2.83Å; N150-Q154 VanDerWaalsContact CG-NE2 3.31Å; N150-Q154 PolarHBondContact ND2-NE2 3.15Å; N150-Q154 WeakPolarHBondContact O-CG 3.18Å; N150-Q154 PolarHBondContact O-N 3.49Å; N150-Q154 PolarHBondContact OD1-NE2 3.33Å |
| 151 | Y | 91.4 | Very high | 90.2 | Very high | 112 Ų | 112 | 103 Ų | 103 | 44% | 0.439 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.3 | -43.3 | 175.3 | -167.5 | -114.8 | 0 | 0 | 0 | 113.5 | D148 M149 Q154 R155 | D148-Y151 WeakPolarHBondContact O-CB 3.42Å; D148-Y151 PolarHBondContact O-N 2.93Å; M149-Y151 VanDerWaalsContact C-N 3.34Å; Y151-Q154 PolarHBondContact O-N 3.26Å; Y151-R155 HydrophobicContact CE1-CG 4.44Å; Y151-R155 PolarHBondContact O-N 2.94Å; Y151-R155 VanDerWaalsContact O-N 3.07Å; Y151-R155 PolarHBondContact OH-NE 2.94Å; Y151-R155 VanDerWaalsContact OH-NE 3.13Å; Y151-R155 PolarHBondContact OH-NH2 3.41Å |
| 152 | I | 90.6 | Very high | 90.1 | Very high | 51 Ų | 51 | 103.6 Ų | 103.6 | 26% | 0.262 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.7 | -44.1 | 177.5 | -68.9 | 164.5 | 0 | 0 | 0 | 110.7 | M147 D148 M149 N150 R155 K156 | M147-I152 HydrophobicContact CE-CD1 3.68Å; M147-I152 HydrophobicContact CG-CD1 3.52Å; M147-I152 HydrophobicContact SD-CD1 4.23Å; D148-I152 VanDerWaalsContact O-CG1 3.29Å; D148-I152 WeakPolarHBondContact O-CG1 3.08Å; D148-I152 PolarHBondContact O-N 3.03Å; M149-I152 PolarHBondContact O-N 3.33Å; M149-I152 HydrophobicContact SD-CD1 4.35Å; N150-I152 VanDerWaalsContact C-N 3.35Å; N150-I152 PolarHBondContact O-N 3.07Å; I152-R155 PolarHBondContact O-N 3.43Å; I152-K156 HydrophobicContact CG2-CD 4.43Å; I152-K156 WeakPolarHBondContact O-CG 3.44Å; I152-K156 PolarHBondContact O-N 2.97Å; I152-K156 VanDerWaalsContact O-N 3.15Å |
| 153 | I | 90.6 | Very high | 90.1 | Very high | 75 Ų | 75 | 100.2 Ų | 100.2 | 39% | 0.385 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.7 | -47.5 | 178 | -70 | 164.4 | 0 | 0 | 0 | 110.1 | M149 N150 R155 K156 F159 | M149-I153 WeakPolarHBondContact O-CB 3.22Å; M149-I153 WeakPolarHBondContact O-CD1 3.46Å; M149-I153 VanDerWaalsContact O-CG1 3.22Å; M149-I153 WeakPolarHBondContact O-CG1 3.4Å; M149-I153 PolarHBondContact O-N 2.93Å; N150-I153 PolarHBondContact O-N 2.83Å; I153-R155 VanDerWaalsContact C-N 3.3Å; I153-R155 PolarHBondContact O-N 3.49Å; I153-K156 PolarHBondContact O-N 3.18Å; I153-F159 HydrophobicContact CG2-CB 4.16Å; I153-F159 HydrophobicContact CG2-CD1 3.78Å; I153-F159 HydrophobicContact CG2-CD2 4.34Å; I153-F159 HydrophobicContact CG2-CE1 4.22Å; I153-F159 HydrophobicContact CG2-CG 3.84Å; I153-F159 WeakPolarHBondContact O-CB 3.5Å |
| 154 | Q | 90.1 | Very high | 90.2 | Very high | 117 Ų | 117 | 96.4 Ų | 96.4 | 55% | 0.547 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62.7 | -33.5 | 179.4 | -69.5 | 174.7 | 32 | 0 | 0 | 113.5 | N150 Y151 | N150-Q154 VanDerWaalsContact CG-NE2 3.31Å; N150-Q154 PolarHBondContact ND2-NE2 3.15Å; N150-Q154 WeakPolarHBondContact O-CG 3.18Å; N150-Q154 PolarHBondContact O-N 3.49Å; N150-Q154 PolarHBondContact OD1-NE2 3.33Å; Y151-Q154 PolarHBondContact O-N 3.26Å |
| 155 | R | 90.8 | Very high | 90.2 | Very high | 153 Ų | 153 | 96.1 Ų | 96.1 | 58% | 0.577 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -78.9 | -22.7 | 178.7 | -78.2 | -169.4 | 169.8 | -177 | -3.4 | 114 | Y151 I152 I153 R160 | Y151-R155 HydrophobicContact CE1-CG 4.44Å; Y151-R155 PolarHBondContact O-N 2.94Å; Y151-R155 VanDerWaalsContact O-N 3.07Å; Y151-R155 PolarHBondContact OH-NE 2.94Å; Y151-R155 VanDerWaalsContact OH-NE 3.13Å; Y151-R155 PolarHBondContact OH-NH2 3.41Å; I152-R155 PolarHBondContact O-N 3.43Å; I153-R155 VanDerWaalsContact C-N 3.3Å; I153-R155 PolarHBondContact O-N 3.49Å; R155-R160 VanDerWaalsContact O-CZ 3.25Å; R155-R160 PolarHBondContact O-NH1 3.09Å; R155-R160 PolarHBondContact O-NH2 3.46Å; R155-R160 VanDerWaalsContact O-NH2 3.07Å |
| 156 | K | 93.1 | Very high | 90.4 | Very high | 99 Ų | 99 | 95.4 Ų | 95.4 | 43% | 0.43 | 46% | 0.462 | S | S | . | . | trans | -69 | 131.2 | 179.2 | -81.3 | 179.7 | 176.5 | -175 | 0 | 110.5 | I152 I153 E158 F159 | I152-K156 HydrophobicContact CG2-CD 4.43Å; I152-K156 WeakPolarHBondContact O-CG 3.44Å; I152-K156 PolarHBondContact O-N 2.97Å; I152-K156 VanDerWaalsContact O-N 3.15Å; I153-K156 PolarHBondContact O-N 3.18Å; K156-E158 VanDerWaalsContact C-N 3.26Å; K156-E158 PolarHBondContact O-N 3.2Å; K156-F159 HydrophobicContact CB-CD2 3.75Å; K156-F159 HydrophobicContact CB-CE2 4.49Å; K156-F159 HydrophobicContact CD-CD2 4.07Å; K156-F159 HydrophobicContact CD-CE2 3.99Å; K156-F159 PolarHBondContact O-N 2.7Å | ||
| 157 | K | 91.6 | Very high | 90.8 | Very high | 149 Ų | 149 | 99 Ų | 99 | 65% | 0.648 | 46% | 0.461 | S | S | * | . | G | 310 helix | trans | -68 | -28.4 | -177.3 | 65.5 | -179 | -179 | -178.4 | 0 | 112.3 | F159 R160 | K157-F159 PolarHBondContact O-N 3.37Å; K157-R160 WeakPolarHBondContact O-CB 3.22Å; K157-R160 PolarHBondContact O-N 3.47Å |
| 158 | E | 88.6 | Confident | 91.1 | Very high | 100 Ų | 100 | 99 Ų | 99 | 47% | 0.467 | 46% | 0.461 | S | S | . | . | G | 310 helix | trans | -66 | -29.2 | 179.5 | -62.9 | 69.8 | -149.7 | 0 | 0 | 111.9 | K156 | K156-E158 VanDerWaalsContact C-N 3.26Å; K156-E158 PolarHBondContact O-N 3.2Å |
| 159 | F | 91.3 | Very high | 91.3 | Very high | 77 Ų | 77 | 97.2 Ų | 97.2 | 34% | 0.338 | 45% | 0.452 | S | S | . | . | G | 310 helix | trans | -90.8 | -5.5 | 177.9 | -70.3 | -89.6 | 0 | 0 | 0 | 113.4 | I153 K156 K157 I164 L168 | I153-F159 HydrophobicContact CG2-CB 4.16Å; I153-F159 HydrophobicContact CG2-CD1 3.78Å; I153-F159 HydrophobicContact CG2-CD2 4.34Å; I153-F159 HydrophobicContact CG2-CE1 4.22Å; I153-F159 HydrophobicContact CG2-CG 3.84Å; I153-F159 WeakPolarHBondContact O-CB 3.5Å; K156-F159 HydrophobicContact CB-CD2 3.75Å; K156-F159 HydrophobicContact CB-CE2 4.49Å; K156-F159 HydrophobicContact CD-CD2 4.07Å; K156-F159 HydrophobicContact CD-CE2 3.99Å; K156-F159 PolarHBondContact O-N 2.7Å; K157-F159 PolarHBondContact O-N 3.37Å; F159-I164 HydrophobicContact CD1-CG1 4.3Å; F159-L168 HydrophobicContact CE1-CD1 4.28Å |
| 160 | R | 90.8 | Very high | 91.6 | Very high | 158 Ų | 158 | 99.4 Ų | 99.4 | 60% | 0.596 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.6 | -25.7 | 175.1 | -70.2 | -177.5 | 174.1 | 98.5 | 4.4 | 112.8 | R155 K157 | R155-R160 VanDerWaalsContact O-CZ 3.25Å; R155-R160 PolarHBondContact O-NH1 3.09Å; R155-R160 PolarHBondContact O-NH2 3.46Å; R155-R160 VanDerWaalsContact O-NH2 3.07Å; K157-R160 WeakPolarHBondContact O-CB 3.22Å; K157-R160 PolarHBondContact O-N 3.47Å |
| 161 | N | 92.3 | Very high | 91.8 | Very high | 87 Ų | 87 | 103.2 Ų | 103.2 | 47% | 0.465 | 47% | 0.473 | S | S | . | . | S | Bend | trans | -84.8 | 118.5 | 178.6 | -173.1 | -13.9 | 0 | 0 | 0 | 109.4 | S163 I164 | N161-S163 PolarHBondContact ND2-OG 3.13Å; N161-S163 PolarHBondContact O-N 3.47Å; N161-S163 PolarHBondContact OD1-N 2.82Å; N161-S163 VanDerWaalsContact OD1-N 3.07Å; N161-S163 PolarHBondContact OD1-OG 3.08Å; N161-S163 VanDerWaalsContact OD1-OG 3.09Å; N161-I164 WeakPolarHBondContact O-CB 3.46Å; N161-I164 WeakPolarHBondContact O-CG2 3.23Å; N161-I164 PolarHBondContact O-N 2.94Å |
| 162 | P | 91.3 | Very high | 91.9 | Very high | 94 Ų | 94 | 101.4 Ų | 101.4 | 61% | 0.61 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.4 | -19.5 | 179.7 | 24 | -34.2 | 0 | 0 | 0 | 113.9 | I164 Y165 | P162-I164 PolarHBondContact O-N 3.35Å; P162-I164 VanDerWaalsContact O-N 3.14Å; P162-Y165 VanDerWaalsContact O-CD2 3.24Å; P162-Y165 WeakPolarHBondContact O-CD2 3.32Å; P162-Y165 PolarHBondContact O-N 3.35Å |
| 163 | S | 92.1 | Very high | 92 | Very high | 57 Ų | 57 | 103.3 Ų | 103.3 | 40% | 0.399 | 50% | 0.499 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -9.7 | 173.3 | 72.5 | 0 | 0 | 0 | 0 | 114.1 | N161 Y165 E166 | N161-S163 PolarHBondContact ND2-OG 3.13Å; N161-S163 PolarHBondContact O-N 3.47Å; N161-S163 PolarHBondContact OD1-N 2.82Å; N161-S163 VanDerWaalsContact OD1-N 3.07Å; N161-S163 PolarHBondContact OD1-OG 3.08Å; N161-S163 VanDerWaalsContact OD1-OG 3.09Å; S163-Y165 PolarHBondContact O-N 3.31Å; S163-E166 PolarHBondContact O-N 2.82Å |
| 164 | I | 93 | Very high | 92 | Very high | 26 Ų | 26 | 104.3 Ų | 104.3 | 13% | 0.133 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -61.7 | -30.6 | 171.8 | -165.7 | 58.4 | 0 | 0 | 0 | 112 | F159 N161 P162 E166 K167 L168 | F159-I164 HydrophobicContact CD1-CG1 4.3Å; N161-I164 WeakPolarHBondContact O-CB 3.46Å; N161-I164 WeakPolarHBondContact O-CG2 3.23Å; N161-I164 PolarHBondContact O-N 2.94Å; P162-I164 PolarHBondContact O-N 3.35Å; P162-I164 VanDerWaalsContact O-N 3.14Å; I164-E166 VanDerWaalsContact C-N 3.31Å; I164-E166 PolarHBondContact O-N 3.13Å; I164-K167 HydrophobicContact CD1-CB 4.48Å; I164-K167 HydrophobicContact CD1-CD 4.35Å; I164-K167 WeakPolarHBondContact O-CB 3.37Å; I164-K167 PolarHBondContact O-N 3.39Å; I164-K167 VanDerWaalsContact O-N 3.13Å; I164-L168 HydrophobicContact CG1-CD1 4.31Å; I164-L168 HydrophobicContact CG1-CG 4.31Å; I164-L168 WeakPolarHBondContact O-CG 3.26Å; I164-L168 PolarHBondContact O-N 3.21Å |
| 165 | Y | 91.1 | Very high | 92.1 | Very high | 151 Ų | 151 | 102.6 Ų | 102.6 | 59% | 0.592 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.3 | -39.1 | -178.5 | -68.3 | -58.3 | 0 | 0 | 0 | 112 | P162 S163 K167 L168 I169 | P162-Y165 VanDerWaalsContact O-CD2 3.24Å; P162-Y165 WeakPolarHBondContact O-CD2 3.32Å; P162-Y165 PolarHBondContact O-N 3.35Å; S163-Y165 PolarHBondContact O-N 3.31Å; Y165-K167 VanDerWaalsContact C-N 3.28Å; Y165-K167 PolarHBondContact O-N 3.24Å; Y165-L168 HydrophobicContact CD1-CD1 4.15Å; Y165-L168 PolarHBondContact O-N 2.79Å; Y165-L168 VanDerWaalsContact O-N 3.08Å; Y165-I169 WeakPolarHBondContact O-CB 3.48Å; Y165-I169 WeakPolarHBondContact O-CD1 3.47Å; Y165-I169 VanDerWaalsContact O-CG1 3.23Å; Y165-I169 WeakPolarHBondContact O-CG1 3.31Å; Y165-I169 PolarHBondContact O-N 3.16Å |
| 166 | E | 92.6 | Very high | 92 | Very high | 123 Ų | 123 | 102.4 Ų | 102.4 | 58% | 0.575 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60 | -40.2 | 175.9 | -171.4 | 172.4 | 177.5 | 0 | 0 | 111.6 | S163 I164 Q170 | S163-E166 PolarHBondContact O-N 2.82Å; I164-E166 VanDerWaalsContact C-N 3.31Å; I164-E166 PolarHBondContact O-N 3.13Å; E166-Q170 VanDerWaalsContact O-CG 3.31Å; E166-Q170 WeakPolarHBondContact O-CG 3.41Å; E166-Q170 PolarHBondContact O-N 3.47Å; E166-Q170 VanDerWaalsContact O-N 3.13Å |
| 167 | K | 93.4 | Very high | 91.8 | Very high | 137 Ų | 137 | 102.9 Ų | 102.9 | 60% | 0.596 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -69 | -37.1 | 174.3 | -64.1 | -177.7 | 179.5 | 178.9 | 0 | 112.4 | I164 Y165 Q170 F171 | I164-K167 HydrophobicContact CD1-CB 4.48Å; I164-K167 HydrophobicContact CD1-CD 4.35Å; I164-K167 WeakPolarHBondContact O-CB 3.37Å; I164-K167 PolarHBondContact O-N 3.39Å; I164-K167 VanDerWaalsContact O-N 3.13Å; Y165-K167 VanDerWaalsContact C-N 3.28Å; Y165-K167 PolarHBondContact O-N 3.24Å; K167-Q170 PolarHBondContact O-N 3.07Å; K167-F171 WeakPolarHBondContact O-CB 3.23Å; K167-F171 PolarHBondContact O-N 3.13Å |
| 168 | L | 92.5 | Very high | 91.6 | Very high | 54 Ų | 54 | 97.8 Ų | 97.8 | 28% | 0.283 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -68.3 | -39.7 | 177.9 | -69.4 | 173.2 | 0 | 0 | 0 | 111.6 | F159 I164 Y165 Q170 F171 C172 | F159-L168 HydrophobicContact CE1-CD1 4.28Å; I164-L168 HydrophobicContact CG1-CD1 4.31Å; I164-L168 HydrophobicContact CG1-CG 4.31Å; I164-L168 WeakPolarHBondContact O-CG 3.26Å; I164-L168 PolarHBondContact O-N 3.21Å; Y165-L168 HydrophobicContact CD1-CD1 4.15Å; Y165-L168 PolarHBondContact O-N 2.79Å; Y165-L168 VanDerWaalsContact O-N 3.08Å; L168-Q170 VanDerWaalsContact C-N 3.35Å; L168-F171 PolarHBondContact O-N 3.32Å; L168-C172 VanDerWaalsContact O-CB 3.22Å; L168-C172 WeakPolarHBondContact O-CB 3.39Å; L168-C172 PolarHBondContact O-N 3.28Å; L168-C172 PolarHBondContact O-SG 2.96Å |
| 169 | I | 93.2 | Very high | 91.6 | Very high | 39 Ų | 39 | 95.2 Ų | 95.2 | 20% | 0.2 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -58.5 | -49.9 | 173.9 | -71 | 159.4 | 0 | 0 | 0 | 109.4 | Y165 A173 I174 E176 | Y165-I169 WeakPolarHBondContact O-CB 3.48Å; Y165-I169 WeakPolarHBondContact O-CD1 3.47Å; Y165-I169 VanDerWaalsContact O-CG1 3.23Å; Y165-I169 WeakPolarHBondContact O-CG1 3.31Å; Y165-I169 PolarHBondContact O-N 3.16Å; I169-A173 WeakPolarHBondContact O-CA 3.45Å; I169-A173 PolarHBondContact O-N 3.33Å; I169-I174 HydrophobicContact CG2-CB 4.38Å; I169-I174 WeakPolarHBondContact CG2-O 3.3Å; I169-I174 PolarHBondContact O-N 3.13Å; I169-E176 HydrophobicContact CD1-CG 3.88Å; I169-E176 HydrophobicContact CG1-CG 4.33Å; I169-E176 HydrophobicContact CG2-CG 3.62Å |
| 170 | Q | 93.4 | Very high | 91.4 | Very high | 134 Ų | 134 | 99.1 Ų | 99.1 | 63% | 0.626 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.2 | -45.5 | 176.9 | -68.9 | 170.6 | 17.1 | 0 | 0 | 112.7 | E166 K167 L168 A173 | E166-Q170 VanDerWaalsContact O-CG 3.31Å; E166-Q170 WeakPolarHBondContact O-CG 3.41Å; E166-Q170 PolarHBondContact O-N 3.47Å; E166-Q170 VanDerWaalsContact O-N 3.13Å; K167-Q170 PolarHBondContact O-N 3.07Å; L168-Q170 VanDerWaalsContact C-N 3.35Å; Q170-A173 PolarHBondContact O-N 3.44Å |
| 171 | F | 94 | Very high | 91.3 | Very high | 175 Ų | 175 | 98.3 Ų | 98.3 | 77% | 0.768 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -67.2 | -39.9 | -177.4 | 178.3 | -99.3 | 0 | 0 | 0 | 112.8 | K167 L168 A173 | K167-F171 WeakPolarHBondContact O-CB 3.23Å; K167-F171 PolarHBondContact O-N 3.13Å; L168-F171 PolarHBondContact O-N 3.32Å; F171-A173 VanDerWaalsContact C-N 3.3Å |
| 172 | C | 92.8 | Very high | 91.1 | Very high | 74 Ų | 74 | 94.2 Ų | 94.2 | 50% | 0.5 | 49% | 0.493 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.7 | 1.6 | 178.6 | -65.2 | 0 | 0 | 0 | 0 | 112.9 | L168 I174 | L168-C172 VanDerWaalsContact O-CB 3.22Å; L168-C172 WeakPolarHBondContact O-CB 3.39Å; L168-C172 PolarHBondContact O-N 3.28Å; L168-C172 PolarHBondContact O-SG 2.96Å; C172-I174 HydrophobicContact CB-CD1 3.64Å; C172-I174 HydrophobicContact CB-CG1 3.63Å; C172-I174 PolarHBondContact O-N 2.64Å |
| 173 | A | 92.8 | Very high | 90.9 | Very high | 91 Ų | 91 | 95.9 Ų | 95.9 | 75% | 0.752 | 49% | 0.491 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.9 | 46.1 | -174.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | I169 Q170 F171 | I169-A173 WeakPolarHBondContact O-CA 3.45Å; I169-A173 PolarHBondContact O-N 3.33Å; Q170-A173 PolarHBondContact O-N 3.44Å; F171-A173 VanDerWaalsContact C-N 3.3Å |
| 174 | I | 91.5 | Very high | 90.5 | Very high | 95 Ų | 95 | 98.3 Ų | 98.3 | 49% | 0.487 | 50% | 0.499 | S | S | . | . | trans | -82.8 | 131.5 | -179.2 | -63.2 | 169 | 0 | 0 | 0 | 108.9 | I169 C172 E176 | I169-I174 HydrophobicContact CG2-CB 4.38Å; I169-I174 WeakPolarHBondContact CG2-O 3.3Å; I169-I174 PolarHBondContact O-N 3.13Å; C172-I174 HydrophobicContact CB-CD1 3.64Å; C172-I174 HydrophobicContact CB-CG1 3.63Å; C172-I174 PolarHBondContact O-N 2.64Å; I174-E176 PolarHBondContact O-N 3.5Å | ||
| 175 | D | 91.1 | Very high | 90.2 | Very high | 81 Ų | 81 | 101.1 Ų | 101.1 | 43% | 0.433 | 51% | 0.513 | S | S | . | . | trans | -79.6 | 111.9 | 166.1 | -179.1 | 4.5 | 0 | 0 | 0 | 109.4 | L177 G178 H189 | D175-L177 PolarHBondContact O-N 3.25Å; D175-L177 PolarHBondContact OD1-N 3.37Å; D175-L177 VanDerWaalsContact OD1-N 3.13Å; D175-G178 VanDerWaalsContact CG-CA 3.47Å; D175-G178 WeakPolarHBondContact O-CA 3.49Å; D175-G178 PolarHBondContact O-N 3.11Å; D175-G178 PolarHBondContact OD1-N 2.98Å; D175-G178 VanDerWaalsContact OD2-CA 3.3Å; D175-G178 WeakPolarHBondContact OD2-CA 2.97Å; D175-G178 PolarHBondContact OD2-N 3.18Å; D175-H189 VanDerWaalsContact CG-NE2 3.34Å; D175-H189 IonicContact OD1-CE1 2.79Å; D175-H189 PolarHBondContact OD1-CE1 3.18Å; D175-H189 IonicContact OD1-NE2 3.82Å; D175-H189 PolarHBondContact OD1-NE2 3.18Å; D175-H189 VanDerWaalsContact OD1-NE2 3.16Å; D175-H189 IonicContact OD2-CD2 3.16Å; D175-H189 IonicContact OD2-CE1 3.64Å; D175-H189 IonicContact OD2-NE2 2.75Å; D175-H189 PolarHBondContact OD2-NE2 3.09Å | ||
| 176 | E | 89.4 | Confident | 90 | Very high | 149 Ų | 149 | 99.3 Ų | 99.3 | 70% | 0.696 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.4 | -31 | -178.1 | -65.3 | -176.1 | -129.6 | 0 | 0 | 113.2 | I169 I174 | I169-E176 HydrophobicContact CD1-CG 3.88Å; I169-E176 HydrophobicContact CG1-CG 4.33Å; I169-E176 HydrophobicContact CG2-CG 3.62Å; I174-E176 PolarHBondContact O-N 3.5Å |
| 177 | L | 88.5 | Confident | 89.8 | Confident | 110 Ų | 110 | 96.3 Ų | 96.3 | 58% | 0.576 | 50% | 0.496 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.3 | 2.1 | 176 | -58.7 | 179.1 | 0 | 0 | 0 | 111.3 | D175 P188 | D175-L177 PolarHBondContact O-N 3.25Å; D175-L177 PolarHBondContact OD1-N 3.37Å; D175-L177 VanDerWaalsContact OD1-N 3.13Å; L177-P188 HydrophobicContact CB-CB 3.99Å; L177-P188 WeakPolarHBondContact O-CB 3.46Å; L177-P188 WeakPolarHBondContact O-CG 3.42Å |
| 178 | G | 88 | Confident | 89.6 | Confident | 42 Ų | 42 | 90.8 Ų | 90.8 | 43% | 0.433 | 47% | 0.474 | S | S | . | . | trans | -58.5 | 144.8 | -175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | D175 | D175-G178 VanDerWaalsContact CG-CA 3.47Å; D175-G178 WeakPolarHBondContact O-CA 3.49Å; D175-G178 PolarHBondContact O-N 3.11Å; D175-G178 PolarHBondContact OD1-N 2.98Å; D175-G178 VanDerWaalsContact OD2-CA 3.3Å; D175-G178 WeakPolarHBondContact OD2-CA 2.97Å; D175-G178 PolarHBondContact OD2-N 3.18Å | ||
| 179 | T | 88.5 | Confident | 89.3 | Confident | 45 Ų | 45 | 92.6 Ų | 92.6 | 28% | 0.276 | 48% | 0.481 | S | S | . | . | trans | -129.9 | 150.5 | 179.2 | -169.5 | 0 | 0 | 0 | 0 | 111.5 | Y181 F186 P188 | T179-Y181 VanDerWaalsContact C-N 3.26Å; T179-Y181 VanDerWaalsContact OG1-CD2 3.26Å; T179-Y181 WeakPolarHBondContact OG1-CD2 3.01Å; T179-Y181 PolarHBondContact OG1-N 3.46Å; T179-F186 HydrophobicContact CG2-CD1 4.03Å; T179-P188 HydrophobicContact CG2-CG 3.56Å | ||
| 180 | N | 88 | Confident | 88.9 | Confident | 160 Ų | 160 | 93.2 Ų | 93.2 | 86% | 0.856 | 50% | 0.497 | S | S | * | . | S | Bend | trans | -83.8 | -5 | 169.6 | -65 | -56.6 | 0 | 0 | 0 | 112.1 | ||
| 181 | Y | 87.4 | Confident | 88.6 | Confident | 140 Ų | 140 | 95.2 Ų | 95.2 | 55% | 0.549 | 50% | 0.499 | S | S | . | . | S | Bend | trans | -72.3 | 144.3 | 172.3 | -70 | -66.7 | 0 | 0 | 0 | 110.4 | T179 M185 | T179-Y181 VanDerWaalsContact C-N 3.26Å; T179-Y181 VanDerWaalsContact OG1-CD2 3.26Å; T179-Y181 WeakPolarHBondContact OG1-CD2 3.01Å; T179-Y181 PolarHBondContact OG1-N 3.46Å; Y181-M185 HydrophobicContact CD1-SD 3.56Å; Y181-M185 VanDerWaalsContact CD1-SD 3.56Å; Y181-M185 HydrophobicContact CE1-SD 4.03Å; Y181-M185 HydrophobicContact CG-SD 4.32Å |
| 182 | P | 88.3 | Confident | 88.2 | Confident | 1 Ų | 1 | 90 Ų | 90 | 1% | 0.006 | 48% | 0.484 | C | S | . | . | trans | -67.1 | 147.1 | 171.8 | 32.9 | -37.1 | 0 | 0 | 0 | 109.8 | V102 A103 D184 M185 F186 | V102-P182 HydrophobicContact CG1-CB 4.44Å; A103-P182 HydrophobicContact CB-CB 3.72Å; P182-D184 WeakPolarHBondContact CB-OD1 3.34Å; P182-D184 WeakPolarHBondContact CG-OD1 3.24Å; P182-D184 PolarHBondContact O-N 3.36Å; P182-M185 HydrophobicContact CG-CB 4.17Å; P182-M185 WeakPolarHBondContact O-CB 3.11Å; P182-M185 PolarHBondContact O-N 3.22Å; P182-F186 PolarHBondContact O-N 2.97Å; P182-F186 VanDerWaalsContact O-N 3.09Å | ||
| 183 | K | 86.6 | Confident | 87.8 | Confident | 130 Ų | 130 | 92.8 Ų | 92.8 | 57% | 0.565 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.3 | -22.9 | -172.8 | -66.5 | -179.4 | 179.1 | 178.8 | 0 | 113.4 | Q99 M185 | Q99-K183 HydrophobicContact CG-CD 4.47Å; Q99-K183 HydrophobicContact CG-CG 4.47Å; K183-M185 PolarHBondContact O-N 3.14Å |
| 184 | D | 84.9 | Confident | 87.5 | Confident | 108 Ų | 108 | 94.3 Ų | 94.3 | 58% | 0.578 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.6 | -29.8 | 172.5 | 68.8 | -43.6 | 0 | 0 | 0 | 112.3 | R110 P182 | R110-D184 IonicContact NH2-OD2 2.66Å; P182-D184 WeakPolarHBondContact CB-OD1 3.34Å; P182-D184 WeakPolarHBondContact CG-OD1 3.24Å; P182-D184 PolarHBondContact O-N 3.36Å |
| 185 | M | 86.6 | Confident | 87.3 | Confident | 85 Ų | 85 | 92.4 Ų | 92.4 | 42% | 0.419 | 48% | 0.481 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92 | -47.5 | -179.9 | -175.3 | -179.4 | -61.7 | 0 | 0 | 111.9 | R110 Y181 P182 K183 | R110-M185 VanDerWaalsContact NH1-CE 3.3Å; Y181-M185 HydrophobicContact CD1-SD 3.56Å; Y181-M185 VanDerWaalsContact CD1-SD 3.56Å; Y181-M185 HydrophobicContact CE1-SD 4.03Å; Y181-M185 HydrophobicContact CG-SD 4.32Å; P182-M185 HydrophobicContact CG-CB 4.17Å; P182-M185 WeakPolarHBondContact O-CB 3.11Å; P182-M185 PolarHBondContact O-N 3.22Å; K183-M185 PolarHBondContact O-N 3.14Å |
| 186 | F | 86.8 | Confident | 87.2 | Confident | 113 Ų | 113 | 93.6 Ų | 93.6 | 50% | 0.496 | 48% | 0.48 | S | S | . | . | trans | -151.4 | 117.8 | -179 | -177.4 | -113.8 | 0 | 0 | 0 | 109.9 | T179 P182 P188 | T179-F186 HydrophobicContact CG2-CD1 4.03Å; P182-F186 PolarHBondContact O-N 2.97Å; P182-F186 VanDerWaalsContact O-N 3.09Å; F186-P188 HydrophobicContact CD1-CG 4.06Å; F186-P188 HydrophobicContact CE1-CB 4.32Å; F186-P188 HydrophobicContact CE1-CG 3.73Å | ||
| 187 | D | 88.8 | Confident | 87.4 | Confident | 60 Ų | 60 | 95 Ų | 95 | 32% | 0.321 | 48% | 0.48 | S | S | . | . | trans | -111 | 104.5 | 172.5 | -170.7 | -2.7 | 0 | 0 | 0 | 109.7 | H189 G190 | D187-H189 PolarHBondContact O-N 3.05Å; D187-H189 PolarHBondContact OD1-N 3.17Å; D187-G190 PolarHBondContact O-N 3.07Å; D187-G190 VanDerWaalsContact O-N 3.11Å; D187-G190 PolarHBondContact OD1-N 3.15Å | ||
| 188 | P | 88.2 | Confident | 87.5 | Confident | 20 Ų | 20 | 96.1 Ų | 96.1 | 13% | 0.13 | 48% | 0.482 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.4 | -28.4 | 175.1 | -21.3 | 30.1 | 0 | 0 | 0 | 113.3 | L177 T179 F186 | L177-P188 HydrophobicContact CB-CB 3.99Å; L177-P188 WeakPolarHBondContact O-CB 3.46Å; L177-P188 WeakPolarHBondContact O-CG 3.42Å; T179-P188 HydrophobicContact CG2-CG 3.56Å; F186-P188 HydrophobicContact CD1-CG 4.06Å; F186-P188 HydrophobicContact CE1-CB 4.32Å; F186-P188 HydrophobicContact CE1-CG 3.73Å |
| 189 | H | 86.9 | Confident | 87.6 | Confident | 92 Ų | 92 | 95 Ų | 95 | 43% | 0.426 | 47% | 0.469 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -102.3 | 11.4 | -177.8 | -58.6 | -71.3 | 0 | 0 | 0 | 112.8 | D175 D187 W191 | D175-H189 VanDerWaalsContact CG-NE2 3.34Å; D175-H189 IonicContact OD1-CE1 2.79Å; D175-H189 PolarHBondContact OD1-CE1 3.18Å; D175-H189 IonicContact OD1-NE2 3.82Å; D175-H189 PolarHBondContact OD1-NE2 3.18Å; D175-H189 VanDerWaalsContact OD1-NE2 3.16Å; D175-H189 IonicContact OD2-CD2 3.16Å; D175-H189 IonicContact OD2-CE1 3.64Å; D175-H189 IonicContact OD2-NE2 2.75Å; D175-H189 PolarHBondContact OD2-NE2 3.09Å; D187-H189 PolarHBondContact O-N 3.05Å; D187-H189 PolarHBondContact OD1-N 3.17Å; H189-W191 PolarHBondContact O-N 3.23Å |
| 190 | G | 85.1 | Confident | 87.7 | Confident | 53 Ų | 53 | 97.5 Ų | 97.5 | 55% | 0.546 | 48% | 0.48 | S | S | . | . | trans | -73 | -6 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | D187 | D187-G190 PolarHBondContact O-N 3.07Å; D187-G190 VanDerWaalsContact O-N 3.11Å; D187-G190 PolarHBondContact OD1-N 3.15Å | ||
| 191 | W | 86.8 | Confident | 87.9 | Confident | 176 Ų | 176 | 91.5 Ų | 91.5 | 67% | 0.667 | 45% | 0.452 | S | S | * | . | trans | -76.8 | 126.8 | 178 | -63.1 | 98.2 | 0 | 0 | 0 | 110.7 | H189 Y196 | H189-W191 PolarHBondContact O-N 3.23Å; W191-Y196 HydrophobicContact CB-CE2 3.96Å; W191-Y196 WeakPolarHBondContact O-CE2 3.4Å | ||
| 192 | S | 86.3 | Confident | 88.1 | Confident | 65 Ų | 65 | 91.7 Ų | 91.7 | 46% | 0.455 | 46% | 0.456 | S | S | . | . | trans | -72.9 | 155 | 172.7 | 60.6 | 0 | 0 | 0 | 0 | 111.6 | D194 S195 Y196 | S192-D194 PolarHBondContact O-N 3.02Å; S192-S195 VanDerWaalsContact O-CB 3.29Å; S192-S195 WeakPolarHBondContact O-CB 3.07Å; S192-S195 PolarHBondContact O-N 3.32Å; S192-S195 PolarHBondContact OG-OG 2.85Å; S192-Y196 WeakPolarHBondContact O-CD2 3.49Å; S192-Y196 WeakPolarHBondContact O-CE2 3.29Å | ||
| 193 | E | 84.3 | Confident | 88.2 | Confident | 132 Ų | 132 | 94.3 Ų | 94.3 | 62% | 0.617 | 48% | 0.478 | S | S | * | . | G | 310 helix | trans | -48 | -38.5 | 176.5 | -170 | 61.9 | -149.2 | 0 | 0 | 112.8 | S195 Y196 A199 | E193-S195 PolarHBondContact O-N 3.49Å; E193-S195 VanDerWaalsContact O-N 3.15Å; E193-Y196 WeakPolarHBondContact O-CB 3.4Å; E193-Y196 PolarHBondContact O-N 3.05Å; E193-A199 WeakPolarHBondContact O-CB 3.21Å |
| 194 | D | 84.9 | Confident | 88.4 | Confident | 123 Ų | 123 | 94.4 Ų | 94.4 | 66% | 0.658 | 48% | 0.48 | S | S | * | . | G | 310 helix | trans | -64.4 | -18.7 | 179.7 | -66.6 | -26.3 | 0 | 0 | 0 | 114.3 | S192 L200 | S192-D194 PolarHBondContact O-N 3.02Å; D194-L200 VanDerWaalsContact O-CD2 3.31Å; D194-L200 WeakPolarHBondContact O-CD2 3.31Å; D194-L200 WeakPolarHBondContact O-CG 3.38Å |
| 195 | S | 88.6 | Confident | 88.8 | Confident | 56 Ų | 56 | 95.9 Ų | 95.9 | 39% | 0.392 | 48% | 0.482 | S | S | . | . | G | 310 helix | trans | -83.8 | -15.9 | 176 | -57.7 | 0 | 0 | 0 | 0 | 112.8 | S192 E193 | S192-S195 VanDerWaalsContact O-CB 3.29Å; S192-S195 WeakPolarHBondContact O-CB 3.07Å; S192-S195 PolarHBondContact O-N 3.32Å; S192-S195 PolarHBondContact OG-OG 2.85Å; E193-S195 PolarHBondContact O-N 3.49Å; E193-S195 VanDerWaalsContact O-N 3.15Å |
| 196 | Y | 89.3 | Confident | 89 | Confident | 105 Ų | 105 | 96.6 Ų | 96.6 | 41% | 0.412 | 49% | 0.486 | S | S | . | . | S | Bend | trans | -81.9 | 153.7 | -179 | -65.1 | -91.3 | 0 | 0 | 0 | 111.5 | W191 S192 E193 E198 A199 L200 | W191-Y196 HydrophobicContact CB-CE2 3.96Å; W191-Y196 WeakPolarHBondContact O-CE2 3.4Å; S192-Y196 WeakPolarHBondContact O-CD2 3.49Å; S192-Y196 WeakPolarHBondContact O-CE2 3.29Å; E193-Y196 WeakPolarHBondContact O-CB 3.4Å; E193-Y196 PolarHBondContact O-N 3.05Å; Y196-E198 VanDerWaalsContact C-N 3.29Å; Y196-E198 PolarHBondContact O-N 3.2Å; Y196-A199 PolarHBondContact O-N 3.4Å; Y196-L200 PolarHBondContact O-N 3.22Å; Y196-L200 VanDerWaalsContact O-N 3.12Å |
| 197 | Y | 92 | Very high | 89.1 | Confident | 179 Ų | 179 | 97 Ų | 97 | 70% | 0.702 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -51.9 | -44.7 | -174.6 | 173.8 | -97 | 0 | 0 | 0 | 113.3 | A199 L200 A201 | Y197-A199 PolarHBondContact O-N 3.12Å; Y197-L200 PolarHBondContact O-N 3.41Å; Y197-A201 WeakPolarHBondContact O-CB 3.31Å; Y197-A201 PolarHBondContact O-N 3.36Å |
| 198 | E | 91.1 | Very high | 89.1 | Confident | 133 Ų | 133 | 99 Ų | 99 | 62% | 0.621 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.6 | -42.9 | -177.1 | -69 | -61 | 146.2 | 0 | 0 | 112.4 | Y196 K202 | Y196-E198 VanDerWaalsContact C-N 3.29Å; Y196-E198 PolarHBondContact O-N 3.2Å; E198-K202 VanDerWaalsContact O-CB 3.31Å; E198-K202 WeakPolarHBondContact O-CB 3.39Å; E198-K202 PolarHBondContact O-N 3.32Å |
| 199 | A | 89.7 | Confident | 89.2 | Confident | 18 Ų | 18 | 101.9 Ų | 101.9 | 15% | 0.149 | 51% | 0.513 | C | S | . | . | H | α-helix | trans | -68.2 | -42.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | E193 Y196 Y197 K202 A203 | E193-A199 WeakPolarHBondContact O-CB 3.21Å; Y196-A199 PolarHBondContact O-N 3.4Å; Y197-A199 PolarHBondContact O-N 3.12Å; A199-K202 PolarHBondContact O-N 2.86Å; A199-A203 WeakPolarHBondContact O-CB 3.43Å; A199-A203 PolarHBondContact O-N 3.46Å |
| 200 | L | 92.2 | Very high | 89.3 | Confident | 98 Ų | 98 | 105 Ų | 105 | 51% | 0.513 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.9 | -45.4 | 175.7 | -69.2 | 174.3 | 0 | 0 | 0 | 111.9 | D194 Y196 Y197 K202 A203 Q204 | D194-L200 VanDerWaalsContact O-CD2 3.31Å; D194-L200 WeakPolarHBondContact O-CD2 3.31Å; D194-L200 WeakPolarHBondContact O-CG 3.38Å; Y196-L200 PolarHBondContact O-N 3.22Å; Y196-L200 VanDerWaalsContact O-N 3.12Å; Y197-L200 PolarHBondContact O-N 3.41Å; L200-K202 VanDerWaalsContact C-N 3.33Å; L200-K202 PolarHBondContact O-N 2.97Å; L200-A203 PolarHBondContact O-N 3.32Å; L200-Q204 WeakPolarHBondContact O-CB 3.25Å; L200-Q204 PolarHBondContact O-N 3.44Å |
| 201 | A | 91.2 | Very high | 89.3 | Confident | 34 Ų | 34 | 106.2 Ų | 106.2 | 28% | 0.281 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.4 | -41.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y197 K205 | Y197-A201 WeakPolarHBondContact O-CB 3.31Å; Y197-A201 PolarHBondContact O-N 3.36Å; A201-K205 WeakPolarHBondContact O-CB 3.28Å; A201-K205 PolarHBondContact O-N 3.34Å |
| 202 | K | 92.2 | Very high | 89.2 | Confident | 144 Ų | 144 | 102.4 Ų | 102.4 | 63% | 0.626 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.3 | -45.1 | 175.9 | -174.9 | 179 | 178.2 | -176.9 | 0 | 111.8 | E198 A199 L200 K205 I206 | E198-K202 VanDerWaalsContact O-CB 3.31Å; E198-K202 WeakPolarHBondContact O-CB 3.39Å; E198-K202 PolarHBondContact O-N 3.32Å; A199-K202 PolarHBondContact O-N 2.86Å; L200-K202 VanDerWaalsContact C-N 3.33Å; L200-K202 PolarHBondContact O-N 2.97Å; K202-K205 PolarHBondContact O-N 3.35Å; K202-I206 HydrophobicContact CG-CD1 3.94Å; K202-I206 VanDerWaalsContact O-CG1 3.25Å; K202-I206 WeakPolarHBondContact O-CG1 3.42Å; K202-I206 PolarHBondContact O-N 2.98Å |
| 203 | A | 90.1 | Very high | 89.1 | Confident | 57 Ų | 57 | 105.7 Ų | 105.7 | 47% | 0.471 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.3 | -46.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | A199 L200 K205 I206 E207 | A199-A203 WeakPolarHBondContact O-CB 3.43Å; A199-A203 PolarHBondContact O-N 3.46Å; L200-A203 PolarHBondContact O-N 3.32Å; A203-K205 VanDerWaalsContact C-N 3.35Å; A203-K205 PolarHBondContact O-N 2.92Å; A203-I206 PolarHBondContact O-N 2.93Å; A203-E207 PolarHBondContact O-N 2.96Å |
| 204 | Q | 91.6 | Very high | 88.9 | Confident | 131 Ų | 131 | 102 Ų | 102 | 61% | 0.612 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.4 | -42.7 | 177.2 | -172.7 | -178.7 | 38.2 | 0 | 0 | 112 | L200 E207 M208 | L200-Q204 WeakPolarHBondContact O-CB 3.25Å; L200-Q204 PolarHBondContact O-N 3.44Å; Q204-E207 PolarHBondContact O-N 3.33Å; Q204-M208 WeakPolarHBondContact O-CG 3.33Å; Q204-M208 PolarHBondContact O-N 3.5Å |
| 205 | K | 92 | Very high | 88.6 | Confident | 139 Ų | 139 | 103 Ų | 103 | 60% | 0.604 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.7 | -46.6 | 176.8 | -175.7 | 179.9 | 177.7 | -177.6 | 0 | 111.6 | A201 K202 A203 E207 M208 D209 | A201-K205 WeakPolarHBondContact O-CB 3.28Å; A201-K205 PolarHBondContact O-N 3.34Å; K202-K205 PolarHBondContact O-N 3.35Å; A203-K205 VanDerWaalsContact C-N 3.35Å; A203-K205 PolarHBondContact O-N 2.92Å; K205-E207 VanDerWaalsContact C-N 3.29Å; K205-E207 PolarHBondContact O-N 2.97Å; K205-M208 PolarHBondContact O-N 2.9Å; K205-D209 WeakPolarHBondContact O-CB 3.48Å; K205-D209 VanDerWaalsContact O-CG 3.28Å; K205-D209 PolarHBondContact O-N 3.44Å |
| 206 | I | 91.9 | Very high | 88 | Confident | 101 Ų | 101 | 106 Ų | 106 | 52% | 0.518 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60 | -41.8 | 177.9 | -70.3 | 166.3 | 0 | 0 | 0 | 110.8 | K202 A203 D209 K210 | K202-I206 HydrophobicContact CG-CD1 3.94Å; K202-I206 VanDerWaalsContact O-CG1 3.25Å; K202-I206 WeakPolarHBondContact O-CG1 3.42Å; K202-I206 PolarHBondContact O-N 2.98Å; A203-I206 PolarHBondContact O-N 2.93Å; I206-D209 PolarHBondContact O-N 3.45Å; I206-K210 VanDerWaalsContact O-CB 3.28Å; I206-K210 WeakPolarHBondContact O-CB 3.43Å; I206-K210 PolarHBondContact O-N 3.3Å |
| 207 | E | 88.6 | Confident | 87.1 | Confident | 120 Ų | 120 | 107 Ų | 107 | 56% | 0.561 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.7 | -44.4 | 177.5 | -171.4 | -179.5 | -157.1 | 0 | 0 | 112 | A203 Q204 K205 K210 L211 | A203-E207 PolarHBondContact O-N 2.96Å; Q204-E207 PolarHBondContact O-N 3.33Å; K205-E207 VanDerWaalsContact C-N 3.29Å; K205-E207 PolarHBondContact O-N 2.97Å; E207-K210 PolarHBondContact O-N 2.87Å; E207-L211 HydrophobicContact CG-CD1 4.47Å; E207-L211 WeakPolarHBondContact O-CG 3.37Å; E207-L211 PolarHBondContact O-N 3.4Å |
| 208 | M | 88.5 | Confident | 85.8 | Confident | 103 Ų | 103 | 109 Ų | 109 | 51% | 0.507 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.5 | -44.5 | 176 | -77.2 | -66.2 | 128.5 | 0 | 0 | 112.2 | Q204 K205 K210 L211 E212 | Q204-M208 WeakPolarHBondContact O-CG 3.33Å; Q204-M208 PolarHBondContact O-N 3.5Å; K205-M208 PolarHBondContact O-N 2.9Å; M208-K210 VanDerWaalsContact C-N 3.32Å; M208-K210 PolarHBondContact O-N 3.27Å; M208-L211 HydrophobicContact CE-CD1 4Å; M208-L211 PolarHBondContact O-N 2.96Å; M208-E212 WeakPolarHBondContact O-CB 3.32Å; M208-E212 PolarHBondContact O-N 3.38Å |
| 209 | D | 89.1 | Confident | 84.5 | Confident | 80 Ų | 80 | 108 Ų | 108 | 43% | 0.428 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.2 | -38.5 | 177.6 | -71.9 | -13 | 0 | 0 | 0 | 111.1 | K205 I206 E212 K213 | K205-D209 WeakPolarHBondContact O-CB 3.48Å; K205-D209 VanDerWaalsContact O-CG 3.28Å; K205-D209 PolarHBondContact O-N 3.44Å; I206-D209 PolarHBondContact O-N 3.45Å; D209-E212 PolarHBondContact O-N 2.93Å; D209-K213 VanDerWaalsContact O-CB 3.32Å; D209-K213 WeakPolarHBondContact O-CB 3.47Å; D209-K213 PolarHBondContact O-N 2.87Å |
| 210 | K | 90.2 | Very high | 83.4 | Confident | 157 Ų | 157 | 115.5 Ų | 115.5 | 68% | 0.683 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -65 | -42.6 | 175.2 | -171.7 | 178.1 | -179.4 | -178.8 | 0 | 111.5 | I206 E207 M208 A214 | I206-K210 VanDerWaalsContact O-CB 3.28Å; I206-K210 WeakPolarHBondContact O-CB 3.43Å; I206-K210 PolarHBondContact O-N 3.3Å; E207-K210 PolarHBondContact O-N 2.87Å; M208-K210 VanDerWaalsContact C-N 3.32Å; M208-K210 PolarHBondContact O-N 3.27Å; K210-A214 VanDerWaalsContact O-CB 3.31Å; K210-A214 WeakPolarHBondContact O-CB 3.26Å; K210-A214 PolarHBondContact O-N 3.38Å |
| 211 | L | 84 | Confident | 81.8 | Confident | 79 Ų | 79 | 117.3 Ų | 117.3 | 41% | 0.414 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -65.3 | -40.4 | 174.7 | -79 | 169.3 | 0 | 0 | 0 | 112 | E207 M208 K215 | E207-L211 HydrophobicContact CG-CD1 4.47Å; E207-L211 WeakPolarHBondContact O-CG 3.37Å; E207-L211 PolarHBondContact O-N 3.4Å; M208-L211 HydrophobicContact CE-CD1 4Å; M208-L211 PolarHBondContact O-N 2.96Å; L211-K215 WeakPolarHBondContact O-CB 3.29Å; L211-K215 VanDerWaalsContact O-CG 3.26Å; L211-K215 WeakPolarHBondContact O-CG 3.31Å; L211-K215 PolarHBondContact O-N 2.85Å |
| 212 | E | 84.7 | Confident | 80.3 | Confident | 97 Ų | 97 | 123.7 Ų | 123.7 | 45% | 0.453 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -67.7 | -42.2 | 178 | -160.5 | -167.6 | 170.4 | 0 | 0 | 111.3 | M208 D209 K215 K216 | M208-E212 WeakPolarHBondContact O-CB 3.32Å; M208-E212 PolarHBondContact O-N 3.38Å; D209-E212 PolarHBondContact O-N 2.93Å; E212-K215 PolarHBondContact O-N 3.26Å; E212-K216 HydrophobicContact CG-CD 4.39Å; E212-K216 WeakPolarHBondContact O-CB 3.38Å; E212-K216 VanDerWaalsContact O-CG 3.3Å; E212-K216 WeakPolarHBondContact O-CG 3.47Å; E212-K216 PolarHBondContact O-N 3.37Å; E212-K216 WeakPolarHBondContact OE1-CE 3.05Å; E212-K216 IonicContact OE1-NZ 3.47Å; E212-K216 PolarHBondContact OE1-NZ 3.43Å; E212-K216 IonicContact OE2-NZ 3.84Å |
| 213 | K | 84.4 | Confident | 78.3 | Confident | 134 Ų | 134 | 126.2 Ų | 126.2 | 58% | 0.583 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -63.1 | -45.1 | 175.1 | -170.5 | 177.7 | 178.2 | -176.4 | 0 | 111.5 | D209 K215 K216 E217 | D209-K213 VanDerWaalsContact O-CB 3.32Å; D209-K213 WeakPolarHBondContact O-CB 3.47Å; D209-K213 PolarHBondContact O-N 2.87Å; K213-K215 VanDerWaalsContact C-N 3.33Å; K213-K215 PolarHBondContact O-N 3.24Å; K213-K216 PolarHBondContact O-N 3.44Å; K213-E217 VanDerWaalsContact CE-OE1 3.29Å; K213-E217 WeakPolarHBondContact CE-OE1 3.45Å; K213-E217 WeakPolarHBondContact O-CG 3.3Å; K213-E217 PolarHBondContact O-N 2.87Å |
| 214 | A | 80.2 | Confident | 76.7 | Confident | 54 Ų | 54 | 129.4 Ų | 129.4 | 45% | 0.446 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -63.3 | -38 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | K210 E217 R218 | K210-A214 VanDerWaalsContact O-CB 3.31Å; K210-A214 WeakPolarHBondContact O-CB 3.26Å; K210-A214 PolarHBondContact O-N 3.38Å; A214-E217 PolarHBondContact O-N 2.89Å; A214-R218 VanDerWaalsContact O-CB 3.3Å; A214-R218 WeakPolarHBondContact O-CB 3.3Å; A214-R218 PolarHBondContact O-N 3.47Å |
| 215 | K | 78.6 | Confident | 74.9 | Confident | 143 Ų | 143 | 129 Ų | 129 | 62% | 0.622 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -64.9 | -43.3 | 173.6 | -77.4 | 174.8 | -178 | 175.2 | 0 | 111.9 | L211 E212 K213 R218 T219 | L211-K215 WeakPolarHBondContact O-CB 3.29Å; L211-K215 VanDerWaalsContact O-CG 3.26Å; L211-K215 WeakPolarHBondContact O-CG 3.31Å; L211-K215 PolarHBondContact O-N 2.85Å; E212-K215 PolarHBondContact O-N 3.26Å; K213-K215 VanDerWaalsContact C-N 3.33Å; K213-K215 PolarHBondContact O-N 3.24Å; K215-R218 PolarHBondContact O-N 3.34Å; K215-T219 PolarHBondContact O-N 2.93Å; K215-T219 VanDerWaalsContact O-N 3.11Å; K215-T219 PolarHBondContact O-OG1 3.41Å |
| 216 | K | 76.7 | Confident | 72.8 | Confident | 121 Ų | 121 | 126 Ų | 126 | 53% | 0.526 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -64.2 | -37.7 | 176.3 | -74.1 | 169.7 | -178.2 | 164.9 | 0 | 112.2 | E212 K213 T219 K220 | E212-K216 HydrophobicContact CG-CD 4.39Å; E212-K216 WeakPolarHBondContact O-CB 3.38Å; E212-K216 VanDerWaalsContact O-CG 3.3Å; E212-K216 WeakPolarHBondContact O-CG 3.47Å; E212-K216 PolarHBondContact O-N 3.37Å; E212-K216 WeakPolarHBondContact OE1-CE 3.05Å; E212-K216 IonicContact OE1-NZ 3.47Å; E212-K216 PolarHBondContact OE1-NZ 3.43Å; E212-K216 IonicContact OE2-NZ 3.84Å; K213-K216 PolarHBondContact O-N 3.44Å; K216-T219 PolarHBondContact O-OG1 3.43Å; K216-K220 PolarHBondContact O-N 2.66Å |
| 217 | E | 70.9 | Confident | 70.7 | Confident | 124 Ų | 124 | 128 Ų | 128 | 58% | 0.579 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -74 | -37.8 | 176.3 | -73.4 | -177.7 | -177.1 | 0 | 0 | 112.1 | K213 A214 T219 K220 | K213-E217 VanDerWaalsContact CE-OE1 3.29Å; K213-E217 WeakPolarHBondContact CE-OE1 3.45Å; K213-E217 WeakPolarHBondContact O-CG 3.3Å; K213-E217 PolarHBondContact O-N 2.87Å; A214-E217 PolarHBondContact O-N 2.89Å; E217-T219 PolarHBondContact O-N 3.25Å; E217-K220 PolarHBondContact O-N 3.44Å |
| 218 | R | 64 | Low | 68.4 | Low | 222 Ų | 222 | 132.2 Ų | 132.2 | 84% | 0.838 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -65.9 | -33.5 | 176 | -169.7 | -163.4 | 173.5 | -147.5 | -0.8 | 113.2 | A214 K215 K220 | A214-R218 VanDerWaalsContact O-CB 3.3Å; A214-R218 WeakPolarHBondContact O-CB 3.3Å; A214-R218 PolarHBondContact O-N 3.47Å; K215-R218 PolarHBondContact O-N 3.34Å; R218-K220 VanDerWaalsContact C-N 3.32Å |
| 219 | T | 64.9 | Low | 66.3 | Low | 111 Ų | 111 | 137.1 Ų | 137.1 | 68% | 0.681 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.3 | -6.3 | 177.7 | 47.2 | 0 | 0 | 0 | 0 | 113.6 | K215 K216 E217 I221 | K215-T219 PolarHBondContact O-N 2.93Å; K215-T219 VanDerWaalsContact O-N 3.11Å; K215-T219 PolarHBondContact O-OG1 3.41Å; K216-T219 PolarHBondContact O-OG1 3.43Å; E217-T219 PolarHBondContact O-N 3.25Å; T219-I221 VanDerWaalsContact C-N 3.29Å; T219-I221 PolarHBondContact O-N 3.46Å |
| 220 | K | 64.8 | Low | 63.8 | Low | 176 Ų | 176 | 136.5 Ų | 136.5 | 77% | 0.765 | 70% | 0.695 | S | S | * | * | trans | -81.7 | 75.1 | 170.9 | -168.3 | 178.6 | 179.9 | -175 | 0 | 109.9 | K216 E217 R218 | K216-K220 PolarHBondContact O-N 2.66Å; E217-K220 PolarHBondContact O-N 3.44Å; R218-K220 VanDerWaalsContact C-N 3.32Å | ||
| 221 | I | 59.4 | Low | 61.1 | Low | 136 Ų | 136 | 135.3 Ų | 135.3 | 70% | 0.697 | 70% | 0.701 | S | S | * | * | trans | -72.2 | 124.7 | 171.5 | -61.1 | 171 | 0 | 0 | 0 | 108.4 | T219 F223 | T219-I221 VanDerWaalsContact C-N 3.29Å; T219-I221 PolarHBondContact O-N 3.46Å; I221-F223 PolarHBondContact O-N 2.89Å | ||
| 222 | E | 59.6 | Low | 58.8 | Low | 169 Ų | 169 | 137.2 Ų | 137.2 | 79% | 0.79 | 72% | 0.716 | S | S | * | * | trans | -62.9 | 114.2 | 172.3 | -71.1 | -170.2 | 154.2 | 0 | 0 | 110.5 | V224 | E222-V224 VanDerWaalsContact C-N 3.29Å; E222-V224 PolarHBondContact O-N 2.92Å | ||
| 223 | F | 50.3 | Low | 56.5 | Low | 196 Ų | 196 | 138.2 Ų | 138.2 | 86% | 0.86 | 73% | 0.729 | S | S | * | * | trans | -71.9 | 86.4 | 165.6 | -79.6 | -89.9 | 0 | 0 | 0 | 109.1 | I221 T225 | I221-F223 PolarHBondContact O-N 2.89Å; F223-T225 PolarHBondContact O-N 2.91Å | ||
| 224 | V | 56.3 | Low | 54.3 | Low | 124 Ų | 124 | 139.3 Ų | 139.3 | 75% | 0.752 | 74% | 0.741 | S | S | * | * | trans | -65.9 | 102.4 | 161.2 | 176.8 | 0 | 0 | 0 | 0 | 107.2 | E222 G226 | E222-V224 VanDerWaalsContact C-N 3.29Å; E222-V224 PolarHBondContact O-N 2.92Å; V224-G226 PolarHBondContact O-N 3.11Å | ||
| 225 | T | 53.1 | Low | 52.2 | Low | 124 Ų | 124 | 141.8 Ų | 141.8 | 76% | 0.761 | 76% | 0.761 | S | S | * | * | trans | -66.5 | 94.9 | 173.2 | 35.7 | 0 | 0 | 0 | 0 | 109.3 | F223 T227 | F223-T225 PolarHBondContact O-N 2.91Å; T225-T227 PolarHBondContact O-N 3.49Å; T225-T227 VanDerWaalsContact O-N 3.12Å | ||
| 226 | G | 47.8 | Very low | 50 | Low | 75 Ų | 75 | 141 Ų | 141 | 77% | 0.773 | 77% | 0.769 | S | S | * | * | trans | -61.7 | 110.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111 | V224 K228 | V224-G226 PolarHBondContact O-N 3.11Å; G226-K228 PolarHBondContact O-N 3.32Å | ||
| 227 | T | 49 | Very low | 48.1 | Very low | 144 Ų | 144 | 140.2 Ų | 140.2 | 88% | 0.883 | 79% | 0.785 | S | S | * | * | trans | -85.6 | 103.1 | 170.2 | -52.6 | 0 | 0 | 0 | 0 | 108.6 | T225 | T225-T227 PolarHBondContact O-N 3.49Å; T225-T227 VanDerWaalsContact O-N 3.12Å | ||
| 228 | K | 40.5 | Very low | 46.6 | Very low | 208 Ų | 208 | 139.9 Ų | 139.9 | 90% | 0.904 | 79% | 0.791 | S | S | * | * | trans | -150.1 | 134.9 | 158.6 | -158.5 | 170 | -179.7 | -179.4 | 0 | 113.6 | G226 | G226-K228 PolarHBondContact O-N 3.32Š| ||
| 229 | K | 43.3 | Very low | 45.2 | Very low | 206 Ų | 206 | 134.5 Ų | 134.5 | 90% | 0.896 | 78% | 0.783 | S | S | * | * | trans | -89 | 150.1 | -166.8 | 169.9 | -178.8 | 177.8 | 179.9 | 0 | 113.9 | ||||
| 230 | G | 36.7 | Very low | 43.8 | Very low | 66 Ų | 66 | 135.5 Ų | 135.5 | 68% | 0.68 | 79% | 0.79 | S | S | * | * | trans | 129.8 | 96.4 | 157.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 231 | T | 35 | Very low | 42.7 | Very low | 133 Ų | 133 | 132.8 Ų | 132.8 | 82% | 0.816 | 79% | 0.788 | S | S | * | * | 84.6 | 109 | 80.1 | -61.1 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 232 | T | 35.2 | Very low | 41.4 | Very low | 118 Ų | 118 | 132.8 Ų | 132.8 | 72% | 0.724 | 79% | 0.794 | S | S | * | * | 157.7 | 112.2 | 125.4 | -75.6 | 0 | 0 | 0 | 0 | 115 | |||||
| 233 | T | 34.9 | Very low | 40.4 | Very low | 119 Ų | 119 | 128.7 Ų | 128.7 | 73% | 0.73 | 79% | 0.789 | S | S | * | * | trans | 57.2 | 112.2 | 142.4 | 66.6 | 0 | 0 | 0 | 0 | 124.7 | ||||
| 234 | N | 38.3 | Very low | 39.8 | Very low | 156 Ų | 156 | 124.8 Ų | 124.8 | 83% | 0.834 | 79% | 0.786 | S | S | * | * | 40.3 | 117.7 | 127.7 | -68 | 21.4 | 0 | 0 | 0 | 121.9 | |||||
| 235 | A | 36.2 | Very low | 38.8 | Very low | 106 Ų | 106 | 125.4 Ų | 125.4 | 88% | 0.876 | 79% | 0.791 | S | S | * | * | -147.6 | 137.5 | 124.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 236 | T | 33.5 | Very low | 37.9 | Very low | 126 Ų | 126 | 123.6 Ų | 123.6 | 77% | 0.773 | 79% | 0.788 | S | S | * | * | trans | -83.7 | 136.6 | -164.4 | -47.4 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 237 | A | 37.3 | Very low | 37.4 | Very low | 105 Ų | 105 | 126.8 Ų | 126.8 | 87% | 0.868 | 79% | 0.792 | S | S | * | * | trans | -145.3 | 114.3 | 151.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 238 | T | 37.9 | Very low | 37.1 | Very low | 117 Ų | 117 | 124.3 Ų | 124.3 | 72% | 0.718 | 79% | 0.786 | S | S | * | * | trans | -53 | 128.9 | -178 | -58 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 239 | T | 36.1 | Very low | 36.9 | Very low | 109 Ų | 109 | 121.7 Ų | 121.7 | 67% | 0.669 | 78% | 0.782 | S | S | * | * | trans | 32.1 | 133 | 137.5 | 8.1 | 0 | 0 | 0 | 0 | 120 | ||||
| 240 | T | 35.7 | Very low | 37.2 | Very low | 133 Ų | 133 | 116 Ų | 116 | 82% | 0.816 | 77% | 0.774 | S | S | * | * | -156.3 | 132.9 | 80.1 | -57.2 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 241 | T | 40.5 | Very low | 37.8 | Very low | 118 Ų | 118 | 121.6 Ų | 121.6 | 72% | 0.724 | 78% | 0.782 | S | S | * | * | trans | -101.6 | 140.5 | 175.2 | -33.8 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 242 | T | 31.8 | Very low | 38.4 | Very low | 136 Ų | 136 | 125.1 Ų | 125.1 | 83% | 0.834 | 79% | 0.786 | S | S | * | * | trans | -152.4 | 115.7 | 141.9 | -38.2 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 243 | A | 38.8 | Very low | 39.5 | Very low | 83 Ų | 83 | 131.1 Ų | 131.1 | 69% | 0.686 | 80% | 0.795 | S | S | * | * | trans | -100.2 | 138.6 | 157.6 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 244 | S | 37.2 | Very low | 40.5 | Very low | 114 Ų | 114 | 132.3 Ų | 132.3 | 80% | 0.797 | 79% | 0.791 | S | S | * | * | trans | -171.1 | 126.3 | 146.8 | -77 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 245 | T | 35.6 | Very low | 41.6 | Very low | 138 Ų | 138 | 128.6 Ų | 128.6 | 85% | 0.847 | 78% | 0.777 | S | S | * | * | trans | -23.9 | 136.3 | 154.9 | 41.1 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 246 | A | 35.2 | Very low | 42.5 | Very low | 85 Ų | 85 | 133.5 Ų | 133.5 | 70% | 0.702 | 78% | 0.779 | S | S | * | * | 147.4 | 137.2 | 110.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 247 | V | 37.7 | Very low | 43.7 | Very low | 142 Ų | 142 | 139 Ų | 139 | 86% | 0.861 | 79% | 0.785 | S | S | * | * | trans | 67.7 | 131.5 | 151.9 | -67.1 | 0 | 0 | 0 | 0 | 123 | ||||
| 248 | A | 41 | Very low | 44.4 | Very low | 92 Ų | 92 | 140 Ų | 140 | 76% | 0.76 | 78% | 0.776 | S | S | * | * | trans | 65.9 | 110.6 | 157.5 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 249 | D | 37.2 | Very low | 44.9 | Very low | 153 Ų | 153 | 139.2 Ų | 139.2 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | -172 | 147.2 | 89.7 | -133.7 | -69.8 | 0 | 0 | 0 | 111.6 | Q251 | D249-Q251 PolarHBondContact O-N 3.26Š| |||
| 250 | A | 50.1 | Low | 45.1 | Very low | 86 Ų | 86 | 138.4 Ų | 138.4 | 71% | 0.711 | 78% | 0.78 | S | S | * | * | trans | -81.9 | 109.5 | -172.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 251 | Q | 48.4 | Very low | 45.5 | Very low | 184 Ų | 184 | 139.4 Ų | 139.4 | 86% | 0.86 | 78% | 0.779 | S | S | * | * | trans | -126.2 | 97.4 | 160.9 | -69.4 | -164.3 | -63.2 | 0 | 0 | 111.2 | D249 R253 | D249-Q251 PolarHBondContact O-N 3.26Å; Q251-R253 PolarHBondContact O-N 3.25Å; Q251-R253 VanDerWaalsContact O-N 3.12Å | ||
| 252 | K | 48.8 | Very low | 45.5 | Very low | 207 Ų | 207 | 139.3 Ų | 139.3 | 90% | 0.9 | 78% | 0.78 | S | S | * | * | trans | -45.6 | 109.6 | 168.4 | -63.5 | 178.8 | 175.5 | -177.2 | 0 | 109.9 | K254 | K252-K254 VanDerWaalsContact C-N 3.34Å; K252-K254 PolarHBondContact O-N 3.41Å | ||
| 253 | R | 58.3 | Low | 46 | Very low | 244 Ų | 244 | 139.2 Ų | 139.2 | 92% | 0.921 | 78% | 0.779 | S | S | * | * | trans | -69.4 | 96.7 | 162.1 | -66.6 | 178.1 | 70.7 | -178.6 | 2 | 106.8 | Q251 S255 | Q251-R253 PolarHBondContact O-N 3.25Å; Q251-R253 VanDerWaalsContact O-N 3.12Å; R253-S255 PolarHBondContact O-N 3.06Å | ||
| 254 | K | 54.7 | Low | 46 | Very low | 144 Ų | 144 | 141 Ų | 141 | 63% | 0.626 | 78% | 0.781 | S | S | * | * | trans | -55.3 | 121.1 | 176.2 | 68.3 | 124.8 | 80.4 | -161.6 | 0 | 109.3 | K252 D258 S259 | K252-K254 VanDerWaalsContact C-N 3.34Å; K252-K254 PolarHBondContact O-N 3.41Å; K254-D258 PolarHBondContact NZ-O 2.98Å; K254-S259 PolarHBondContact NZ-OG 3.48Å | ||
| 255 | S | 62.3 | Low | 46.1 | Very low | 79 Ų | 79 | 141.9 Ų | 141.9 | 55% | 0.552 | 78% | 0.782 | S | S | * | * | trans | -68.1 | 151.6 | 171.4 | 67.7 | 0 | 0 | 0 | 0 | 108.8 | R253 W257 | R253-S255 PolarHBondContact O-N 3.06Å; S255-W257 PolarHBondContact O-N 3.04Å | ||
| 256 | K | 54.2 | Low | 46.4 | Very low | 209 Ų | 209 | 143.3 Ų | 143.3 | 91% | 0.909 | 78% | 0.783 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | 38.3 | -174 | -155.3 | 165.9 | 171.3 | 171 | 0 | 112.3 | ||
| 257 | W | 59.3 | Low | 46.8 | Very low | 241 Ų | 241 | 143.6 Ų | 143.6 | 91% | 0.913 | 79% | 0.785 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129 | -6.2 | -178.2 | -78.2 | 92.8 | 0 | 0 | 0 | 113.1 | S255 | S255-W257 PolarHBondContact O-N 3.04Š|
| 258 | D | 52.9 | Low | 47.5 | Very low | 126 Ų | 126 | 145.6 Ų | 145.6 | 67% | 0.674 | 79% | 0.785 | S | S | * | * | trans | -124.6 | 83.4 | 179.1 | -157.2 | 21.7 | 0 | 0 | 0 | 110.4 | K254 | K254-D258 PolarHBondContact NZ-O 2.98Š| ||
| 259 | S | 47.1 | Very low | 47.4 | Very low | 100 Ų | 100 | 146.9 Ų | 146.9 | 70% | 0.699 | 79% | 0.786 | S | S | * | * | trans | -135.5 | 97.8 | 159.4 | -86.9 | 0 | 0 | 0 | 0 | 106.9 | K254 | K254-S259 PolarHBondContact NZ-OG 3.48Š| ||
| 260 | A | 41.3 | Very low | 47.6 | Very low | 92 Ų | 92 | 145.9 Ų | 145.9 | 76% | 0.76 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 142.7 | 168 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||
| 261 | I | 44 | Very low | 47.2 | Very low | 155 Ų | 155 | 149.2 Ų | 149.2 | 80% | 0.795 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -84 | 131.2 | -176.8 | -53.5 | 168.2 | 0 | 0 | 0 | 109 | ||
| 262 | P | 39.3 | Very low | 46.7 | Very low | 115 Ų | 115 | 148 Ų | 148 | 75% | 0.747 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -91.8 | 128.2 | 153 | 31.3 | -26.9 | 0 | 0 | 0 | 110.6 | ||
| 263 | V | 42.1 | Very low | 46 | Very low | 135 Ų | 135 | 144.1 Ų | 144.1 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 125.7 | 172.7 | 170.3 | 0 | 0 | 0 | 0 | 110.8 | ||
| 264 | T | 38.9 | Very low | 45.2 | Very low | 120 Ų | 120 | 139 Ų | 139 | 74% | 0.736 | 78% | 0.778 | S | S | * | * | trans | -159.7 | 127 | 149.6 | 11.3 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 265 | T | 39 | Very low | 44.4 | Very low | 132 Ų | 132 | 137.8 Ų | 137.8 | 81% | 0.81 | 78% | 0.783 | S | S | * | * | trans | 62.5 | 102.2 | 153.1 | 53.6 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 266 | I | 42.9 | Very low | 43.2 | Very low | 168 Ų | 168 | 138.8 Ų | 138.8 | 86% | 0.862 | 80% | 0.796 | S | S | * | * | trans | -64.9 | 120.9 | 165.9 | -66 | 162.1 | 0 | 0 | 0 | 109.9 | ||||
| 267 | A | 43.7 | Very low | 42.7 | Very low | 92 Ų | 92 | 134.7 Ų | 134.7 | 76% | 0.76 | 79% | 0.788 | S | S | * | * | trans | -117.9 | 121.4 | 152.7 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 268 | Q | 52.3 | Low | 41.9 | Very low | 183 Ų | 183 | 131.3 Ų | 131.3 | 86% | 0.855 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 137.8 | 179.7 | -72.5 | 173.6 | -36 | 0 | 0 | 111.3 | ||
| 269 | P | 39.3 | Very low | 41.4 | Very low | 120 Ų | 120 | 131.3 Ų | 131.3 | 78% | 0.779 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -93.1 | 129 | 159.2 | 32.4 | -26.8 | 0 | 0 | 0 | 111.2 | ||
| 270 | T | 41.8 | Very low | 41 | Very low | 132 Ų | 132 | 130.8 Ų | 130.8 | 81% | 0.81 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 130.2 | 170.4 | -54.7 | 0 | 0 | 0 | 0 | 111.6 | ||
| 271 | I | 40.1 | Very low | 40.9 | Very low | 156 Ų | 156 | 132.8 Ų | 132.8 | 80% | 0.8 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -83 | 121 | 173.7 | -15.9 | 177.8 | 0 | 0 | 0 | 108.2 | ||
| 272 | L | 38.5 | Very low | 40.9 | Very low | 158 Ų | 158 | 131.7 Ų | 131.7 | 83% | 0.827 | 80% | 0.799 | S | S | * | * | trans | -89.8 | 105.7 | 167.5 | -73.1 | 169.5 | 0 | 0 | 0 | 108.6 | ||||
| 273 | T | 34.8 | Very low | 41 | Very low | 125 Ų | 125 | 131.5 Ų | 131.5 | 77% | 0.767 | 80% | 0.796 | S | S | * | * | trans | -74.3 | 117.7 | 168.2 | -63.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 274 | T | 40.3 | Very low | 40.5 | Very low | 136 Ų | 136 | 131.6 Ų | 131.6 | 83% | 0.834 | 80% | 0.797 | S | S | * | * | trans | -111.8 | 106.2 | 163.3 | 22.9 | 0 | 0 | 0 | 0 | 108.7 | A276 | T274-A276 PolarHBondContact O-N 2.96Š| ||
| 275 | T | 39 | Very low | 40.5 | Very low | 119 Ų | 119 | 131.2 Ų | 131.2 | 73% | 0.73 | 79% | 0.794 | S | S | * | * | trans | -64 | 117.5 | 163.9 | -79 | 0 | 0 | 0 | 0 | 108.4 | T277 | T275-T277 HydrophobicContact CG2-CG2 4.46Š| ||
| 276 | A | 36.1 | Very low | 40.8 | Very low | 100 Ų | 100 | 131.1 Ų | 131.1 | 83% | 0.826 | 79% | 0.794 | S | S | * | * | trans | -96.2 | 108 | 170.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | T274 | T274-A276 PolarHBondContact O-N 2.96Š| ||
| 277 | T | 43.1 | Very low | 40.5 | Very low | 123 Ų | 123 | 128.1 Ų | 128.1 | 76% | 0.755 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 141.8 | 165 | 36.2 | 0 | 0 | 0 | 0 | 110.1 | T275 | T275-T277 HydrophobicContact CG2-CG2 4.46Š|
| 278 | L | 42.5 | Very low | 40.4 | Very low | 170 Ų | 170 | 128.8 Ų | 128.8 | 89% | 0.89 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 135.2 | -178.3 | -60.5 | 166.4 | 0 | 0 | 0 | 111.6 | ||
| 279 | P | 43.3 | Very low | 39.5 | Very low | 126 Ų | 126 | 126.1 Ų | 126.1 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -82.1 | 136.9 | 169.3 | 31.2 | -31.2 | 0 | 0 | 0 | 111.9 | ||
| 280 | A | 38.2 | Very low | 39.5 | Very low | 90 Ų | 90 | 123.4 Ų | 123.4 | 74% | 0.744 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 158.3 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | V282 | A280-V282 PolarHBondContact O-N 3.47Š|
| 281 | V | 40.3 | Very low | 39.7 | Very low | 134 Ų | 134 | 122.5 Ų | 122.5 | 81% | 0.812 | 79% | 0.787 | S | S | * | * | trans | -41.8 | 122.1 | 170.1 | 171.8 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 282 | V | 44.1 | Very low | 40 | Very low | 131 Ų | 131 | 124.4 Ų | 124.4 | 79% | 0.794 | 79% | 0.79 | S | S | * | * | trans | -93.2 | 109.5 | 167.9 | -175.6 | 0 | 0 | 0 | 0 | 108.1 | A280 | A280-V282 PolarHBondContact O-N 3.47Š| ||
| 283 | T | 39.9 | Very low | 40.3 | Very low | 112 Ų | 112 | 123.1 Ų | 123.1 | 69% | 0.687 | 79% | 0.789 | S | S | * | * | trans | -69.7 | 128.8 | 170 | 36.5 | 0 | 0 | 0 | 0 | 110.3 | T285 | T283-T285 PolarHBondContact O-N 3.44Š| ||
| 284 | V | 33 | Very low | 41.1 | Very low | 137 Ų | 137 | 123 Ų | 123 | 83% | 0.83 | 79% | 0.788 | S | S | * | * | trans | -87.9 | 95.6 | 175.5 | -169.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 285 | T | 37.3 | Very low | 41.6 | Very low | 111 Ų | 111 | 122.1 Ų | 122.1 | 68% | 0.681 | 78% | 0.782 | S | S | * | * | trans | -97 | 115.5 | 167.8 | -57.4 | 0 | 0 | 0 | 0 | 109.2 | T283 S287 | T283-T285 PolarHBondContact O-N 3.44Å; T285-S287 PolarHBondContact O-N 3.12Å | ||
| 286 | T | 46.5 | Very low | 42.1 | Very low | 131 Ų | 131 | 123.9 Ų | 123.9 | 80% | 0.804 | 79% | 0.785 | S | S | * | * | trans | -72.1 | 110.1 | 172.1 | 48.6 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 287 | S | 35.4 | Very low | 43 | Very low | 105 Ų | 105 | 123.9 Ų | 123.9 | 73% | 0.734 | 78% | 0.779 | S | S | * | * | trans | -139.2 | 114.3 | 167.9 | -55.9 | 0 | 0 | 0 | 0 | 109.9 | T285 | T285-S287 PolarHBondContact O-N 3.12Š| ||
| 288 | A | 41.6 | Very low | 43.4 | Very low | 105 Ų | 105 | 123 Ų | 123 | 87% | 0.868 | 78% | 0.784 | S | S | * | * | trans | -65.4 | 144.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 289 | S | 35.3 | Very low | 43.5 | Very low | 127 Ų | 127 | 120.5 Ų | 120.5 | 89% | 0.888 | 78% | 0.776 | S | S | * | * | trans | 154.7 | 126.3 | 135.7 | -174.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 290 | G | 38.1 | Very low | 43.7 | Very low | 63 Ų | 63 | 118 Ų | 118 | 65% | 0.649 | 77% | 0.773 | S | S | * | * | trans | 89.3 | 98.6 | 142.6 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 291 | S | 46.6 | Very low | 44.1 | Very low | 113 Ų | 113 | 120.2 Ų | 120.2 | 79% | 0.79 | 78% | 0.777 | S | S | * | * | trans | 79.4 | 106 | 133.8 | -44.1 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 292 | K | 45.6 | Very low | 44.5 | Very low | 197 Ų | 197 | 121.8 Ų | 121.8 | 86% | 0.857 | 78% | 0.78 | S | S | * | * | trans | 119.6 | 104.8 | 148.9 | -65.5 | 176 | -173.2 | 177.4 | 0 | 113.6 | T294 | K292-T294 PolarHBondContact O-N 3.48Š| ||
| 293 | T | 45.3 | Very low | 44.8 | Very low | 131 Ų | 131 | 122 Ų | 122 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | trans | -71.2 | 118.8 | 171.6 | -150.2 | 0 | 0 | 0 | 0 | 109.1 | V295 | T293-V295 HydrophobicContact CG2-CG2 4.22Š| ||
| 294 | T | 52.6 | Low | 45.1 | Very low | 121 Ų | 121 | 126.1 Ų | 126.1 | 74% | 0.742 | 79% | 0.789 | S | S | * | * | trans | -100.3 | 99.3 | 168.1 | -63.2 | 0 | 0 | 0 | 0 | 107.4 | K292 I296 | K292-T294 PolarHBondContact O-N 3.48Å; T294-I296 PolarHBondContact O-N 3.21Å | ||
| 295 | V | 49.9 | Very low | 45.7 | Very low | 119 Ų | 119 | 129.6 Ų | 129.6 | 72% | 0.721 | 79% | 0.793 | S | S | * | * | trans | -72.4 | 114.1 | 170.3 | 179 | 0 | 0 | 0 | 0 | 107.5 | T293 S297 | T293-V295 HydrophobicContact CG2-CG2 4.22Å; V295-S297 PolarHBondContact O-N 2.83Å | ||
| 296 | I | 49.5 | Very low | 46.1 | Very low | 156 Ų | 156 | 128.9 Ų | 128.9 | 80% | 0.8 | 80% | 0.798 | S | S | * | * | trans | -81.3 | 110.7 | 173.2 | -57.6 | 170.2 | 0 | 0 | 0 | 107.1 | T294 | T294-I296 PolarHBondContact O-N 3.21Š| ||
| 297 | S | 55.2 | Low | 46 | Very low | 100 Ų | 100 | 132.4 Ų | 132.4 | 70% | 0.699 | 80% | 0.803 | S | S | * | * | trans | -76.2 | 122.5 | 178.3 | -171.7 | 0 | 0 | 0 | 0 | 110.8 | V295 V299 | V295-S297 PolarHBondContact O-N 2.83Å; S297-V299 PolarHBondContact O-N 2.8Å | ||
| 298 | A | 51.4 | Low | 46.3 | Very low | 103 Ų | 103 | 140 Ų | 140 | 85% | 0.851 | 83% | 0.827 | S | S | * | * | trans | -90.4 | 52.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 299 | V | 45 | Very low | 46.5 | Very low | 119 Ų | 119 | 141.8 Ų | 141.8 | 72% | 0.721 | 83% | 0.825 | S | S | * | * | S | Bend | trans | -137.6 | 114.3 | 171.8 | -177.4 | 0 | 0 | 0 | 0 | 109.4 | S297 T301 | S297-V299 PolarHBondContact O-N 2.8Å; V299-T301 PolarHBondContact O-N 3.37Å |
| 300 | G | 47.1 | Very low | 47.1 | Very low | 74 Ų | 74 | 142.6 Ų | 142.6 | 76% | 0.763 | 82% | 0.821 | S | S | * | * | trans | -64.7 | 126.6 | -173.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 301 | T | 47.3 | Very low | 47.6 | Very low | 135 Ų | 135 | 147 Ų | 147 | 83% | 0.828 | 83% | 0.831 | S | S | * | * | trans | -95.1 | 108.9 | 171.9 | 4.8 | 0 | 0 | 0 | 0 | 110.5 | V299 V303 | V299-T301 PolarHBondContact O-N 3.37Å; T301-V303 PolarHBondContact O-N 3.12Å | ||
| 302 | I | 48.1 | Very low | 47.6 | Very low | 168 Ų | 168 | 149 Ų | 149 | 86% | 0.862 | 83% | 0.833 | S | S | * | * | trans | -78.2 | 113.9 | 172.4 | -54.6 | 159.6 | 0 | 0 | 0 | 107.8 | K304 | I302-K304 PolarHBondContact O-N 3Š| ||
| 303 | V | 49.4 | Very low | 47.8 | Very low | 134 Ų | 134 | 146 Ų | 146 | 81% | 0.812 | 83% | 0.832 | S | S | * | * | trans | -80.4 | 115.2 | 176.9 | -178.6 | 0 | 0 | 0 | 0 | 109.7 | T301 K305 | T301-V303 PolarHBondContact O-N 3.12Å; V303-K305 PolarHBondContact O-N 3.2Å | ||
| 304 | K | 48 | Very low | 47.9 | Very low | 200 Ų | 200 | 147 Ų | 147 | 87% | 0.87 | 83% | 0.834 | S | S | * | * | trans | -75.9 | 115.7 | 168.4 | -109.6 | 176.3 | 178 | 166.4 | 0 | 109.2 | I302 A306 | I302-K304 PolarHBondContact O-N 3Å; K304-A306 PolarHBondContact O-N 3.4Å | ||
| 305 | K | 45.4 | Very low | 47.6 | Very low | 209 Ų | 209 | 148.9 Ų | 148.9 | 91% | 0.909 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 117.6 | 174 | -159.3 | 179.9 | -173.8 | 177.8 | 0 | 109.8 | V303 | V303-K305 PolarHBondContact O-N 3.2Š|
| 306 | A | 44.7 | Very low | 47.4 | Very low | 96 Ų | 96 | 151.2 Ų | 151.2 | 79% | 0.793 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -83.2 | 142.7 | 168.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | K304 | K304-A306 PolarHBondContact O-N 3.4Š|
| 307 | K | 44.3 | Very low | 47.3 | Very low | 206 Ų | 206 | 150.8 Ų | 150.8 | 90% | 0.896 | 85% | 0.854 | S | S | * | * | P | Polyproline II helix | trans | -81 | 125.6 | 179.8 | 179.8 | 177.3 | -179.6 | 178.8 | 0 | 109.5 | ||
| 308 | Q | 41.2 | Very low | 46.5 | Very low | 265 Ų | 265 | 155.4 Ų | 155.4 | 100% | 1.238 | 87% | 0.868 | S | S | * | * | trans | -143.1 | 0 | 150.9 | -123.7 | 179.7 | -11.5 | 0 | 0 | 108.3 |
Retrieved 308 of 308 residues in 57.9 ms
(Link to these results)