| 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 | 36.6 | Very low | 43.2 | Very low | 239 Ų | 239 | 150.5 Ų | 150.5 | 100% | 1.177 | 84% | 0.839 | S | S | * | * | 0 | 145.1 | 0 | -77.4 | -68.3 | 177.5 | 0 | 0 | 108.7 | |||||
| 2 | P | 39.7 | Very low | 42.5 | Very low | 117 Ų | 117 | 143.9 Ų | 143.9 | 76% | 0.76 | 83% | 0.83 | S | S | * | * | trans | -89.2 | 162.9 | -142.9 | 34.8 | -36 | 0 | 0 | 0 | 116.5 | ||||
| 3 | R | 44.6 | Very low | 42.8 | Very low | 240 Ų | 240 | 142.7 Ų | 142.7 | 91% | 0.906 | 83% | 0.83 | S | S | * | * | trans | -61.4 | 154.2 | 162.9 | -81 | -178.2 | 173 | 176.8 | -1.6 | 111.2 | ||||
| 4 | P | 52.3 | Low | 43.8 | Very low | 131 Ų | 131 | 139.6 Ų | 139.6 | 85% | 0.851 | 82% | 0.818 | S | S | * | * | -151.1 | 177.1 | 87.6 | 34.3 | -12.5 | 0 | 0 | 0 | 112.1 | |||||
| 5 | G | 37.3 | Very low | 43.2 | Very low | 69 Ų | 69 | 146.3 Ų | 146.3 | 71% | 0.711 | 82% | 0.823 | S | S | * | * | cis | 172.1 | 149.7 | 9.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 6 | H | 43.3 | Very low | 42.7 | Very low | 190 Ų | 190 | 148.4 Ų | 148.4 | 88% | 0.88 | 83% | 0.831 | S | S | * | * | trans | -40.2 | 169.4 | 174.4 | -78.6 | -56.8 | 0 | 0 | 0 | 118 | ||||
| 7 | P | 51.9 | Low | 42 | Very low | 127 Ų | 127 | 143.9 Ų | 143.9 | 83% | 0.825 | 83% | 0.825 | S | S | * | * | cis | -154.3 | 174.8 | 49.4 | 39.6 | -14.6 | 0 | 0 | 0 | 121.4 | ||||
| 8 | R | 43.6 | Very low | 42 | Very low | 223 Ų | 223 | 142.8 Ų | 142.8 | 84% | 0.842 | 83% | 0.825 | S | S | * | * | trans | -71.4 | 171 | 176.1 | -143.6 | -175.2 | -156.5 | 177.5 | 4.9 | 112.4 | ||||
| 9 | P | 50.1 | Low | 41.5 | Very low | 119 Ų | 119 | 148.4 Ų | 148.4 | 77% | 0.773 | 83% | 0.831 | S | S | * | * | -143.4 | 141 | 97.6 | 28.6 | -8.5 | 0 | 0 | 0 | 113.7 | |||||
| 10 | A | 38.3 | Very low | 40.9 | Very low | 82 Ų | 82 | 150.5 Ų | 150.5 | 68% | 0.678 | 83% | 0.833 | S | S | * | * | 70.8 | 133.5 | 96.7 | 0 | 0 | 0 | 0 | 0 | 112 | |||||
| 11 | S | 37.9 | Very low | 40.8 | Very low | 119 Ų | 119 | 154.5 Ų | 154.5 | 83% | 0.832 | 84% | 0.836 | S | S | * | * | cis | -175 | 133.3 | 38.5 | 43.7 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 12 | G | 34.9 | Very low | 41 | Very low | 71 Ų | 71 | 148.4 Ų | 148.4 | 73% | 0.732 | 81% | 0.814 | S | S | * | * | 112.5 | 156.7 | 99.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 13 | P | 46.5 | Very low | 40.5 | Very low | 128 Ų | 128 | 148.3 Ų | 148.3 | 83% | 0.831 | 81% | 0.812 | S | S | * | * | trans | -125.6 | -145.5 | -132.2 | 34.4 | -12.7 | 0 | 0 | 0 | 114.5 | ||||
| 14 | P | 55.8 | Low | 39.9 | Very low | 100 Ų | 100 | 144.2 Ų | 144.2 | 65% | 0.649 | 80% | 0.803 | S | S | * | * | -116.2 | -177.3 | -98.9 | 38.3 | -20.3 | 0 | 0 | 0 | 113.2 | |||||
| 15 | R | 35.4 | Very low | 38.9 | Very low | 240 Ų | 240 | 146.2 Ų | 146.2 | 91% | 0.906 | 81% | 0.805 | S | S | * | * | trans | 167 | 153 | 131.9 | -90 | 177.3 | -141.7 | -83.8 | 5.6 | 113.8 | ||||
| 16 | L | 34.9 | Very low | 38.5 | Very low | 179 Ų | 179 | 147.6 Ų | 147.6 | 94% | 0.937 | 80% | 0.803 | S | S | * | * | trans | -99.2 | 148.8 | -172.4 | -78.2 | 156.9 | 0 | 0 | 0 | 113.5 | ||||
| 17 | G | 31.7 | Very low | 38 | Very low | 72 Ų | 72 | 146.5 Ų | 146.5 | 74% | 0.742 | 80% | 0.803 | S | S | * | * | trans | 89.7 | 171.2 | 148.9 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 18 | P | 41.2 | Very low | 37 | Very low | 125 Ų | 125 | 147.9 Ų | 147.9 | 81% | 0.812 | 80% | 0.798 | S | S | * | * | cis | -135.6 | 175.9 | -28.8 | 32.8 | -11.8 | 0 | 0 | 0 | 113.9 | ||||
| 19 | W | 32.2 | Very low | 36.4 | Very low | 248 Ų | 248 | 143.6 Ų | 143.6 | 94% | 0.939 | 80% | 0.797 | S | S | * | * | trans | -1.7 | 130.7 | 165.2 | -66.3 | 82.7 | 0 | 0 | 0 | 121.5 | ||||
| 20 | E | 29.6 | Very low | 35.6 | Very low | 190 Ų | 190 | 147.5 Ų | 147.5 | 89% | 0.888 | 80% | 0.798 | S | S | * | * | 165.3 | 136.5 | 120.4 | -92.9 | -171.3 | 154.3 | 0 | 0 | 111.6 | |||||
| 21 | R | 39.4 | Very low | 35.4 | Very low | 236 Ų | 236 | 151.4 Ų | 151.4 | 89% | 0.891 | 81% | 0.808 | S | S | * | * | trans | -88.8 | 153.9 | 159.2 | -72.3 | -179.3 | 176.2 | 152.3 | -1.7 | 106.7 | ||||
| 22 | P | 39.5 | Very low | 35.2 | Very low | 110 Ų | 110 | 154.8 Ų | 154.8 | 71% | 0.714 | 81% | 0.807 | S | S | * | * | -162.8 | 164.9 | 84.8 | 42.8 | -21 | 0 | 0 | 0 | 118.4 | |||||
| 23 | T | 29.2 | Very low | 35.6 | Very low | 115 Ų | 115 | 156.9 Ų | 156.9 | 71% | 0.706 | 81% | 0.808 | S | S | * | * | trans | 74.4 | 136 | 141.1 | 22.6 | 0 | 0 | 0 | 0 | 125.3 | ||||
| 24 | E | 32 | Very low | 35.2 | Very low | 154 Ų | 154 | 156.9 Ų | 156.9 | 72% | 0.72 | 81% | 0.808 | S | S | * | * | trans | 76.8 | 112.1 | 140.8 | -57.5 | -82.8 | 142 | 0 | 0 | 120.2 | ||||
| 25 | L | 31.5 | Very low | 34.5 | Very low | 173 Ų | 173 | 161.1 Ų | 161.1 | 91% | 0.906 | 82% | 0.819 | S | S | * | * | -161.3 | 109 | 123.6 | -114.3 | 143.6 | 0 | 0 | 0 | 111.4 | |||||
| 26 | C | 28.9 | Very low | 34.9 | Very low | 99 Ų | 99 | 155 Ų | 155 | 67% | 0.669 | 81% | 0.81 | S | S | * | * | trans | -66.2 | 139.8 | 164.4 | -65.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 27 | L | 33.4 | Very low | 35.2 | Very low | 166 Ų | 166 | 152.2 Ų | 152.2 | 87% | 0.869 | 80% | 0.803 | S | S | * | * | trans | -132.2 | 113.7 | 153.8 | -107.1 | 166.1 | 0 | 0 | 0 | 107.9 | ||||
| 28 | E | 29.9 | Very low | 35.7 | Very low | 156 Ų | 156 | 154.6 Ų | 154.6 | 73% | 0.729 | 81% | 0.805 | S | S | * | * | trans | -97.8 | 122.3 | -178.9 | -167 | 168.6 | 175.6 | 0 | 0 | 107.8 | ||||
| 29 | T | 31 | Very low | 35.6 | Very low | 134 Ų | 134 | 154.1 Ų | 154.1 | 82% | 0.822 | 81% | 0.805 | S | S | * | * | trans | -137.7 | 117.3 | 163.1 | -34.4 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 30 | Y | 34.3 | Very low | 35.7 | Very low | 201 Ų | 201 | 152.7 Ų | 152.7 | 79% | 0.788 | 80% | 0.799 | S | S | * | * | trans | -60.7 | 132.2 | 176.5 | -99.7 | -106.9 | 0 | 0 | 0 | 111.8 | ||||
| 31 | D | 33.2 | Very low | 35.9 | Very low | 164 Ų | 164 | 154 Ų | 154 | 88% | 0.877 | 80% | 0.796 | S | S | * | * | trans | -150.8 | 141.6 | 143.4 | -117.2 | -39.6 | 0 | 0 | 0 | 112.1 | ||||
| 32 | K | 34.6 | Very low | 35.7 | Very low | 190 Ų | 190 | 149.9 Ų | 149.9 | 83% | 0.826 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -83.4 | 129 | -163.9 | 179.2 | 179.8 | -179.8 | 177.6 | 0 | 111.9 | ||
| 33 | P | 44 | Very low | 35.6 | Very low | 114 Ų | 114 | 156.4 Ų | 156.4 | 74% | 0.74 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -89.6 | 153.5 | 177.1 | 31.5 | -31.3 | 0 | 0 | 0 | 114.1 | ||
| 34 | P | 36.7 | Very low | 36 | Very low | 129 Ų | 129 | 162.5 Ų | 162.5 | 84% | 0.838 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 155.8 | 177.8 | 29.9 | -32.4 | 0 | 0 | 0 | 114 | ||
| 35 | Q | 40.9 | Very low | 36.1 | Very low | 188 Ų | 188 | 161 Ų | 161 | 88% | 0.879 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 150.9 | -170.7 | -73.8 | -168.2 | -24.1 | 0 | 0 | 116.2 | ||
| 36 | P | 45.2 | Very low | 36.1 | Very low | 111 Ų | 111 | 160.4 Ų | 160.4 | 72% | 0.721 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -88 | 158.7 | 161.3 | 34.1 | -31.4 | 0 | 0 | 0 | 113.4 | ||
| 37 | P | 41.8 | Very low | 37.2 | Very low | 122 Ų | 122 | 160.8 Ų | 160.8 | 79% | 0.792 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 157.1 | -175.7 | 28.5 | -34.8 | 0 | 0 | 0 | 114.5 | ||
| 38 | P | 41 | Very low | 37.4 | Very low | 121 Ų | 121 | 162.6 Ų | 162.6 | 79% | 0.786 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 131.2 | -162.4 | 30.2 | -35 | 0 | 0 | 0 | 115.3 | ||
| 39 | S | 39.9 | Very low | 37.8 | Very low | 116 Ų | 116 | 162.5 Ų | 162.5 | 81% | 0.811 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 137.3 | 158.9 | 59.6 | 0 | 0 | 0 | 0 | 112.1 | ||
| 40 | R | 34.3 | Very low | 38.4 | Very low | 217 Ų | 217 | 161.6 Ų | 161.6 | 82% | 0.819 | 82% | 0.822 | S | S | * | * | trans | -126.8 | 102 | 164.8 | -92.3 | -171.2 | 172.9 | -150.7 | 1.6 | 112.9 | ||||
| 41 | R | 33.5 | Very low | 38.3 | Very low | 218 Ų | 218 | 155.2 Ų | 155.2 | 82% | 0.823 | 82% | 0.818 | S | S | * | * | trans | 64.3 | 91 | 134.5 | -61.2 | -176.7 | -174.5 | -175.4 | 0.1 | 118.9 | ||||
| 42 | T | 35.7 | Very low | 39 | Very low | 149 Ų | 149 | 155.8 Ų | 155.8 | 91% | 0.914 | 82% | 0.815 | S | S | * | * | trans | -69.7 | 124.1 | 147.9 | -3.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 43 | R | 36.4 | Very low | 39.2 | Very low | 248 Ų | 248 | 155.6 Ų | 155.6 | 94% | 0.936 | 82% | 0.817 | S | S | * | * | trans | -107.2 | 121 | 165.4 | -122.5 | -174.2 | -161 | 175.2 | 4.7 | 107.4 | ||||
| 44 | R | 38.3 | Very low | 39 | Very low | 243 Ų | 243 | 152.9 Ų | 152.9 | 92% | 0.917 | 81% | 0.81 | S | S | * | * | trans | -106.1 | 132.3 | 169.4 | -150.9 | -172.1 | -154.3 | -175.7 | 6.6 | 108.3 | ||||
| 45 | P | 32.5 | Very low | 39.4 | Very low | 122 Ų | 122 | 152.9 Ų | 152.9 | 79% | 0.792 | 81% | 0.81 | S | S | * | * | trans | -106.4 | 164.4 | 150.9 | -3.8 | 24.4 | 0 | 0 | 0 | 112.4 | ||||
| 46 | D | 33.3 | Very low | 39.4 | Very low | 160 Ų | 160 | 153 Ų | 153 | 86% | 0.856 | 81% | 0.81 | S | S | * | * | trans | -72.7 | 164.6 | -150.7 | -141.1 | 22.8 | 0 | 0 | 0 | 118.2 | ||||
| 47 | P | 51.5 | Low | 39.3 | Very low | 108 Ų | 108 | 151.9 Ų | 151.9 | 70% | 0.701 | 81% | 0.805 | S | S | * | * | trans | -98.8 | 126.1 | -178.7 | 35.3 | -23.8 | 0 | 0 | 0 | 112.9 | ||||
| 48 | K | 37.2 | Very low | 39.4 | Very low | 204 Ų | 204 | 153.5 Ų | 153.5 | 89% | 0.887 | 81% | 0.805 | S | S | * | * | trans | -157.3 | 101 | 160.1 | -129.1 | 166.6 | -176.7 | 177.7 | 0 | 112.4 | ||||
| 49 | D | 38.6 | Very low | 39.2 | Very low | 153 Ų | 153 | 152.9 Ų | 152.9 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | 59.5 | 156.1 | 151 | -101.8 | -14.2 | 0 | 0 | 0 | 121.9 | ||||
| 50 | P | 44.4 | Very low | 39.4 | Very low | 115 Ų | 115 | 156.2 Ų | 156.2 | 75% | 0.747 | 80% | 0.799 | S | S | * | * | -114.6 | 119.8 | -118.1 | 29.3 | -11.3 | 0 | 0 | 0 | 112.5 | |||||
| 51 | G | 32.2 | Very low | 39.8 | Very low | 68 Ų | 68 | 153.9 Ų | 153.9 | 70% | 0.701 | 80% | 0.802 | S | S | * | * | trans | -95.7 | 88.7 | 167.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | H53 | G51-H53 PolarHBondContact O-N 2.83Å; G51-H53 VanDerWaalsContact O-N 3.12Å | ||
| 52 | H | 46.7 | Very low | 40.2 | Very low | 176 Ų | 176 | 148.7 Ų | 148.7 | 82% | 0.815 | 80% | 0.799 | S | S | * | * | trans | 23.2 | 72.8 | 132.3 | -153.5 | -33.3 | 0 | 0 | 0 | 118.9 | ||||
| 53 | H | 39.2 | Very low | 40.2 | Very low | 186 Ų | 186 | 145 Ų | 145 | 86% | 0.861 | 79% | 0.791 | S | S | * | * | trans | -145.2 | 100.9 | 156.5 | -75.7 | -70 | 0 | 0 | 0 | 110.5 | G51 | G51-H53 PolarHBondContact O-N 2.83Å; G51-H53 VanDerWaalsContact O-N 3.12Å | ||
| 54 | G | 39.4 | Very low | 40.5 | Very low | 57 Ų | 57 | 139.3 Ų | 139.3 | 59% | 0.588 | 79% | 0.789 | S | S | * | * | trans | -75.9 | 172.8 | 168 | 0 | 0 | 0 | 0 | 0 | 111.7 | E56 | G54-E56 PolarHBondContact O-N 3.47Š| ||
| 55 | P | 44.3 | Very low | 40.4 | Very low | 129 Ų | 129 | 132.3 Ų | 132.3 | 84% | 0.838 | 78% | 0.783 | S | S | * | * | trans | -61 | 128.4 | 179.7 | 25.6 | -32.7 | 0 | 0 | 0 | 110.3 | S57 | P55-S57 VanDerWaalsContact C-N 3.27Å; P55-S57 PolarHBondContact O-N 3.05Å | ||
| 56 | E | 42.6 | Very low | 40.6 | Very low | 191 Ų | 191 | 135.3 Ų | 135.3 | 89% | 0.893 | 79% | 0.786 | S | S | * | * | trans | -63.2 | 88 | 172.9 | -65.6 | 179.2 | 168.8 | 0 | 0 | 109.3 | G54 I58 | G54-E56 PolarHBondContact O-N 3.47Å; E56-I58 PolarHBondContact O-N 3Å | ||
| 57 | S | 41.9 | Very low | 41.1 | Very low | 87 Ų | 87 | 133.1 Ų | 133.1 | 61% | 0.608 | 78% | 0.78 | S | S | * | * | trans | -65.1 | 117.6 | 158.9 | 56.9 | 0 | 0 | 0 | 0 | 107.4 | P55 T59 | P55-S57 VanDerWaalsContact C-N 3.27Å; P55-S57 PolarHBondContact O-N 3.05Å; S57-T59 VanDerWaalsContact C-N 3.28Å; S57-T59 PolarHBondContact O-N 2.81Å | ||
| 58 | I | 45.3 | Very low | 40.1 | Very low | 155 Ų | 155 | 132.6 Ų | 132.6 | 80% | 0.795 | 79% | 0.786 | S | S | * | * | trans | -61 | 95.1 | 166.8 | -70.3 | 164.9 | 0 | 0 | 0 | 107.3 | E56 F60 | E56-I58 PolarHBondContact O-N 3Å; I58-F60 HydrophobicContact CG2-CE2 4.3Å | ||
| 59 | T | 36.9 | Very low | 40 | Very low | 109 Ų | 109 | 129.5 Ų | 129.5 | 67% | 0.669 | 78% | 0.784 | S | S | * | * | trans | -86.8 | 112.1 | 169.6 | 38.8 | 0 | 0 | 0 | 0 | 107.7 | S57 I61 | S57-T59 VanDerWaalsContact C-N 3.28Å; S57-T59 PolarHBondContact O-N 2.81Å; T59-I61 PolarHBondContact O-N 3.02Å | ||
| 60 | F | 42.8 | Very low | 40 | Very low | 185 Ų | 185 | 130.7 Ų | 130.7 | 81% | 0.811 | 78% | 0.784 | S | S | * | * | trans | -61 | 121.4 | 159.8 | -76.3 | -94.9 | 0 | 0 | 0 | 107.6 | I58 S62 | I58-F60 HydrophobicContact CG2-CE2 4.3Å; F60-S62 VanDerWaalsContact C-N 3.29Å; F60-S62 PolarHBondContact O-N 2.85Å | ||
| 61 | I | 42.2 | Very low | 39.5 | Very low | 169 Ų | 169 | 131.8 Ų | 131.8 | 87% | 0.867 | 79% | 0.789 | S | S | * | * | trans | -66.2 | 94.3 | 169.3 | -58.3 | 176.7 | 0 | 0 | 0 | 107 | T59 | T59-I61 PolarHBondContact O-N 3.02Š| ||
| 62 | S | 42 | Very low | 39.9 | Very low | 109 Ų | 109 | 134.4 Ų | 134.4 | 76% | 0.762 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 116 | 159.2 | -67.6 | 0 | 0 | 0 | 0 | 107.3 | F60 S64 | F60-S62 VanDerWaalsContact C-N 3.29Å; F60-S62 PolarHBondContact O-N 2.85Å; S62-S64 PolarHBondContact O-N 2.68Å |
| 63 | G | 36.5 | Very low | 39.5 | Very low | 72 Ų | 72 | 130.9 Ų | 130.9 | 74% | 0.742 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 133.2 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 64 | S | 42.7 | Very low | 39.3 | Very low | 128 Ų | 128 | 127.8 Ų | 127.8 | 90% | 0.895 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -55 | 127.6 | 177 | 178.9 | 0 | 0 | 0 | 0 | 112.9 | S62 | S62-S64 PolarHBondContact O-N 2.68Š|
| 65 | A | 36.2 | Very low | 39.3 | Very low | 96 Ų | 96 | 130.3 Ų | 130.3 | 79% | 0.793 | 80% | 0.801 | S | S | * | * | trans | -146.1 | 133.6 | 148.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 66 | E | 37.3 | Very low | 39.1 | Very low | 185 Ų | 185 | 132.5 Ų | 132.5 | 86% | 0.864 | 80% | 0.804 | S | S | * | * | trans | -58.2 | 162.7 | -175.5 | -105.6 | -133.5 | 133.8 | 0 | 0 | 115.4 | ||||
| 67 | P | 43.7 | Very low | 39 | Very low | 113 Ų | 113 | 131.3 Ų | 131.3 | 73% | 0.734 | 80% | 0.804 | S | S | * | * | trans | -85.5 | 134.6 | -166 | 34.4 | -31.2 | 0 | 0 | 0 | 112.5 | ||||
| 68 | A | 30.6 | Very low | 39 | Very low | 98 Ų | 98 | 137 Ų | 137 | 81% | 0.81 | 81% | 0.812 | S | S | * | * | trans | -131.7 | 120.5 | 157.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 69 | T | 35.6 | Very low | 39.3 | Very low | 139 Ų | 139 | 139.3 Ų | 139.3 | 85% | 0.853 | 81% | 0.811 | S | S | * | * | trans | -13.3 | 120 | 167.7 | -32.4 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 70 | E | 37 | Very low | 40.1 | Very low | 177 Ų | 177 | 139.2 Ų | 139.2 | 83% | 0.827 | 81% | 0.811 | S | S | * | * | trans | 4.7 | 127.7 | 151.7 | -59.3 | 178 | 166.9 | 0 | 0 | 120.3 | ||||
| 71 | T | 35 | Very low | 40.5 | Very low | 138 Ų | 138 | 139.5 Ų | 139.5 | 85% | 0.847 | 81% | 0.807 | S | S | * | * | -170.7 | 150 | 125.9 | 24.4 | 0 | 0 | 0 | 0 | 110.1 | A73 | T71-A73 PolarHBondContact O-N 3.36Š| |||
| 72 | P | 40.4 | Very low | 41.4 | Very low | 123 Ų | 123 | 134.6 Ų | 134.6 | 80% | 0.799 | 79% | 0.785 | S | S | * | * | trans | -80 | 124.5 | -159.2 | 30.8 | -33.5 | 0 | 0 | 0 | 113.4 | C74 | P72-C74 PolarHBondContact O-N 3.42Å; P72-C74 VanDerWaalsContact O-N 3.13Å | ||
| 73 | A | 38.1 | Very low | 42.4 | Very low | 103 Ų | 103 | 137.9 Ų | 137.9 | 85% | 0.851 | 78% | 0.781 | S | S | * | * | trans | -76.5 | 91.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | T71 | T71-A73 PolarHBondContact O-N 3.36Š| ||
| 74 | C | 35.5 | Very low | 43.5 | Very low | 120 Ų | 120 | 139.5 Ų | 139.5 | 81% | 0.811 | 77% | 0.769 | S | S | * | * | trans | -120.9 | 64.8 | 166.9 | -155.2 | 0 | 0 | 0 | 0 | 109.4 | P72 | P72-C74 PolarHBondContact O-N 3.42Å; P72-C74 VanDerWaalsContact O-N 3.13Å | ||
| 75 | C | 38.2 | Very low | 44.3 | Very low | 111 Ų | 111 | 142.3 Ų | 142.3 | 75% | 0.75 | 76% | 0.76 | S | S | * | * | trans | -169.7 | 72.3 | 173.3 | -95.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 76 | L | 40.4 | Very low | 45.8 | Very low | 174 Ų | 174 | 140.1 Ų | 140.1 | 91% | 0.911 | 74% | 0.739 | S | S | * | * | trans | -107.9 | 35.1 | 171.1 | -73.3 | 179.5 | 0 | 0 | 0 | 113.2 | ||||
| 77 | L | 40.2 | Very low | 47.2 | Very low | 167 Ų | 167 | 138.3 Ų | 138.3 | 87% | 0.874 | 72% | 0.724 | S | S | * | * | trans | -113.9 | 2.6 | 173.9 | -85.2 | 158.5 | 0 | 0 | 0 | 114.2 | ||||
| 78 | W | 43.4 | Very low | 48.3 | Very low | 205 Ų | 205 | 134.8 Ų | 134.8 | 78% | 0.777 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -107.5 | 112.5 | 179 | -74.7 | 29.9 | 0 | 0 | 0 | 109.8 | V82 | W78-V82 HydrophobicContact CE3-CG1 4.17Å; W78-V82 HydrophobicContact CZ3-CG1 4.37Å |
| 79 | R | 50.4 | Low | 50.2 | Low | 205 Ų | 205 | 132.9 Ų | 132.9 | 77% | 0.774 | 69% | 0.689 | S | S | * | * | trans | -50.3 | 145.5 | 177.6 | -78.5 | -178.6 | 173 | -167.1 | -0.5 | 110.9 | W81 V82 | R79-W81 PolarHBondContact O-N 2.88Å; R79-V82 PolarHBondContact O-N 2.86Å | ||
| 80 | P | 53.7 | Low | 51.9 | Low | 106 Ų | 106 | 133.5 Ų | 133.5 | 69% | 0.688 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -57 | -15.1 | -178.2 | -23.7 | 31.9 | 0 | 0 | 0 | 115.6 | ||
| 81 | W | 52.5 | Low | 53.4 | Low | 192 Ų | 192 | 128.4 Ų | 128.4 | 73% | 0.727 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -76.1 | -40.6 | -178 | -72.1 | 58 | 0 | 0 | 0 | 111.5 | R79 W83 E84 W85 | R79-W81 PolarHBondContact O-N 2.88Å; W81-W83 VanDerWaalsContact C-N 3.27Å; W81-W83 PolarHBondContact O-N 2.88Å; W81-E84 PolarHBondContact O-N 2.81Å; W81-E84 VanDerWaalsContact O-N 3.16Å; W81-W85 PolarHBondContact O-N 2.89Å; W81-W85 VanDerWaalsContact O-N 3.14Å |
| 82 | V | 59.2 | Low | 55 | Low | 66 Ų | 66 | 129.3 Ų | 129.3 | 40% | 0.4 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -63 | -36.6 | -175.1 | -178 | 0 | 0 | 0 | 0 | 111.5 | W78 R79 W85 C86 | W78-V82 HydrophobicContact CE3-CG1 4.17Å; W78-V82 HydrophobicContact CZ3-CG1 4.37Å; R79-V82 PolarHBondContact O-N 2.86Å; V82-W85 PolarHBondContact O-N 2.81Å; V82-C86 WeakPolarHBondContact O-CB 3.45Å; V82-C86 PolarHBondContact O-N 2.91Å; V82-C86 PolarHBondContact O-SG 2.81Å |
| 83 | W | 63.1 | Low | 56.6 | Low | 178 Ų | 178 | 132.1 Ų | 132.1 | 67% | 0.674 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -64.6 | -41.8 | 177 | -176.8 | -108.9 | 0 | 0 | 0 | 112.9 | W81 W85 C86 R87 | W81-W83 VanDerWaalsContact C-N 3.27Å; W81-W83 PolarHBondContact O-N 2.88Å; W83-W85 VanDerWaalsContact C-N 3.33Å; W83-W85 PolarHBondContact O-N 3.11Å; W83-C86 PolarHBondContact O-N 2.88Å; W83-R87 VanDerWaalsContact O-CB 3.26Å; W83-R87 WeakPolarHBondContact O-CB 3.46Å; W83-R87 PolarHBondContact O-N 2.84Å |
| 84 | E | 59.7 | Low | 58 | Low | 105 Ų | 105 | 136.8 Ų | 136.8 | 49% | 0.491 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -65.9 | -36.2 | 176.6 | -71.3 | -59.8 | 143.1 | 0 | 0 | 111.9 | W81 R87 A88 | W81-E84 PolarHBondContact O-N 2.81Å; W81-E84 VanDerWaalsContact O-N 3.16Å; E84-R87 PolarHBondContact O-N 3.31Å; E84-A88 VanDerWaalsContact O-CB 3.28Å; E84-A88 WeakPolarHBondContact O-CB 3.29Å; E84-A88 PolarHBondContact O-N 2.85Å |
| 85 | W | 61.3 | Low | 59.4 | Low | 187 Ų | 187 | 133 Ų | 133 | 71% | 0.708 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -69.5 | -41.2 | 173.8 | -77.7 | 77.1 | 0 | 0 | 0 | 112.4 | W81 V82 W83 A88 A89 | W81-W85 PolarHBondContact O-N 2.89Å; W81-W85 VanDerWaalsContact O-N 3.14Å; V82-W85 PolarHBondContact O-N 2.81Å; W83-W85 VanDerWaalsContact C-N 3.33Å; W83-W85 PolarHBondContact O-N 3.11Å; W85-A88 PolarHBondContact O-N 3.42Å; W85-A89 VanDerWaalsContact O-CB 3.31Å; W85-A89 WeakPolarHBondContact O-CB 3.39Å; W85-A89 PolarHBondContact O-N 3.14Å |
| 86 | C | 66.9 | Low | 60.9 | Low | 51 Ų | 51 | 135.7 Ų | 135.7 | 35% | 0.345 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -62.6 | -44.2 | 172.9 | -71 | 0 | 0 | 0 | 0 | 111.1 | V82 W83 A89 F90 | V82-C86 WeakPolarHBondContact O-CB 3.45Å; V82-C86 PolarHBondContact O-N 2.91Å; V82-C86 PolarHBondContact O-SG 2.81Å; W83-C86 PolarHBondContact O-N 2.88Å; C86-A89 PolarHBondContact O-N 2.94Å; C86-F90 VanDerWaalsContact O-CD2 3.26Å; C86-F90 WeakPolarHBondContact O-CD2 3.4Å; C86-F90 PolarHBondContact O-N 3.41Å |
| 87 | R | 66.8 | Low | 62.2 | Low | 146 Ų | 146 | 131 Ų | 131 | 55% | 0.551 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -61.6 | -45 | 176.9 | -164.7 | -179.3 | -155.3 | -175.4 | 5.5 | 111.4 | W83 E84 F90 C91 | W83-R87 VanDerWaalsContact O-CB 3.26Å; W83-R87 WeakPolarHBondContact O-CB 3.46Å; W83-R87 PolarHBondContact O-N 2.84Å; E84-R87 PolarHBondContact O-N 3.31Å; R87-F90 PolarHBondContact O-N 2.95Å; R87-C91 WeakPolarHBondContact O-CB 3.48Å; R87-C91 PolarHBondContact O-N 3.37Å; R87-C91 PolarHBondContact O-SG 3.04Å |
| 88 | A | 66.6 | Low | 63.2 | Low | 40 Ų | 40 | 124.6 Ų | 124.6 | 33% | 0.331 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -60.7 | -47 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111 | E84 W85 F90 C91 F92 | E84-A88 VanDerWaalsContact O-CB 3.28Å; E84-A88 WeakPolarHBondContact O-CB 3.29Å; E84-A88 PolarHBondContact O-N 2.85Å; W85-A88 PolarHBondContact O-N 3.42Å; A88-F90 PolarHBondContact O-N 3.15Å; A88-C91 PolarHBondContact O-N 2.95Å; A88-F92 HydrophobicContact CB-CD2 4.37Å; A88-F92 HydrophobicContact CB-CE2 4.35Å; A88-F92 WeakPolarHBondContact O-CB 3.27Å; A88-F92 WeakPolarHBondContact O-CD2 3.35Å; A88-F92 PolarHBondContact O-N 3.02Å |
| 89 | A | 71.3 | Confident | 64.1 | Low | 58 Ų | 58 | 119.1 Ų | 119.1 | 48% | 0.479 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.8 | -41.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | W85 C86 F92 R93 | W85-A89 VanDerWaalsContact O-CB 3.31Å; W85-A89 WeakPolarHBondContact O-CB 3.39Å; W85-A89 PolarHBondContact O-N 3.14Å; C86-A89 PolarHBondContact O-N 2.94Å; A89-F92 PolarHBondContact O-N 3.41Å; A89-R93 WeakPolarHBondContact O-CB 3.31Å; A89-R93 PolarHBondContact O-N 2.81Å |
| 90 | F | 71.1 | Confident | 64.7 | Low | 152 Ų | 152 | 116.1 Ų | 116.1 | 67% | 0.667 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -66.4 | -40.3 | 174.5 | -87.3 | -74.6 | 0 | 0 | 0 | 112 | C86 R87 A88 R93 R94 | C86-F90 VanDerWaalsContact O-CD2 3.26Å; C86-F90 WeakPolarHBondContact O-CD2 3.4Å; C86-F90 PolarHBondContact O-N 3.41Å; R87-F90 PolarHBondContact O-N 2.95Å; A88-F90 PolarHBondContact O-N 3.15Å; F90-R93 PolarHBondContact O-N 3.33Å; F90-R94 VanDerWaalsContact O-CB 3.27Å; F90-R94 WeakPolarHBondContact O-CB 3.27Å; F90-R94 PolarHBondContact O-N 3.36Å |
| 91 | C | 68.3 | Low | 64.9 | Low | 69 Ų | 69 | 121.4 Ų | 121.4 | 47% | 0.466 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.2 | -42 | 173.4 | -73.9 | 0 | 0 | 0 | 0 | 112.1 | R87 A88 R94 C95 | R87-C91 WeakPolarHBondContact O-CB 3.48Å; R87-C91 PolarHBondContact O-N 3.37Å; R87-C91 PolarHBondContact O-SG 3.04Å; A88-C91 PolarHBondContact O-N 2.95Å; C91-R94 PolarHBondContact O-N 2.86Å; C91-C95 VanDerWaalsContact O-CB 3.27Å; C91-C95 WeakPolarHBondContact O-CB 3.37Å; C91-C95 PolarHBondContact O-N 3.14Å; C91-C95 PolarHBondContact O-SG 3.42Å |
| 92 | F | 68.6 | Low | 64.9 | Low | 157 Ų | 157 | 116.4 Ų | 116.4 | 69% | 0.689 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -65 | -42.4 | 176.3 | -83.1 | -67 | 0 | 0 | 0 | 111.8 | A88 A89 R96 | A88-F92 HydrophobicContact CB-CD2 4.37Å; A88-F92 HydrophobicContact CB-CE2 4.35Å; A88-F92 WeakPolarHBondContact O-CB 3.27Å; A88-F92 WeakPolarHBondContact O-CD2 3.35Å; A88-F92 PolarHBondContact O-N 3.02Å; A89-F92 PolarHBondContact O-N 3.41Å; F92-R96 WeakPolarHBondContact O-CB 3.46Å; F92-R96 PolarHBondContact O-N 3.41Å |
| 93 | R | 73.5 | Confident | 64.6 | Low | 183 Ų | 183 | 116.5 Ų | 116.5 | 69% | 0.691 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -64.9 | -44.7 | 177.5 | -149 | 178.2 | -164.9 | 174.7 | 4.3 | 110.9 | A89 F90 R96 D97 | A89-R93 WeakPolarHBondContact O-CB 3.31Å; A89-R93 PolarHBondContact O-N 2.81Å; F90-R93 PolarHBondContact O-N 3.33Å; R93-R96 PolarHBondContact O-N 3.22Å; R93-D97 VanDerWaalsContact O-CG 3.3Å; R93-D97 PolarHBondContact O-N 3.24Å |
| 94 | R | 67.8 | Low | 64.1 | Low | 201 Ų | 201 | 111.6 Ų | 111.6 | 76% | 0.758 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -70.5 | -41.5 | -179.5 | -159.2 | -177.3 | -179.2 | 139.7 | 3.3 | 113 | F90 C91 R96 D97 C98 | F90-R94 VanDerWaalsContact O-CB 3.27Å; F90-R94 WeakPolarHBondContact O-CB 3.27Å; F90-R94 PolarHBondContact O-N 3.36Å; C91-R94 PolarHBondContact O-N 2.86Å; R94-R96 VanDerWaalsContact C-N 3.35Å; R94-D97 PolarHBondContact O-N 2.84Å; R94-C98 WeakPolarHBondContact O-CB 3.4Å; R94-C98 PolarHBondContact O-N 2.66Å |
| 95 | C | 65.3 | Low | 63.7 | Low | 40 Ų | 40 | 109.3 Ų | 109.3 | 27% | 0.27 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -75.2 | -24.8 | 176.7 | -56.9 | 0 | 0 | 0 | 0 | 110.9 | C91 C98 L99 C109 | C91-C95 VanDerWaalsContact O-CB 3.27Å; C91-C95 WeakPolarHBondContact O-CB 3.37Å; C91-C95 PolarHBondContact O-N 3.14Å; C91-C95 PolarHBondContact O-SG 3.42Å; C95-C98 PolarHBondContact O-N 3.14Å; C95-L99 VanDerWaalsContact O-CB 3.31Å; C95-L99 WeakPolarHBondContact O-CB 3.34Å; C95-L99 PolarHBondContact O-N 3.42Å; C95-C109 WeakPolarHBondContact CB-SG 3.32Å; C95-C109 WeakPolarHBondContact SG-CB 3.46Å; C95-C109 CovalentContact SG-SG 2.09Å; C95-C109 PolarHBondContact SG-SG 3.46Å |
| 96 | R | 69.3 | Low | 63.3 | Low | 168 Ų | 168 | 107.2 Ų | 107.2 | 63% | 0.634 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -67.4 | -45.2 | 167.8 | 178.5 | 179.1 | 169.4 | 156.2 | -1 | 112 | F92 R93 R94 C98 L99 Q100 | F92-R96 WeakPolarHBondContact O-CB 3.46Å; F92-R96 PolarHBondContact O-N 3.41Å; R93-R96 PolarHBondContact O-N 3.22Å; R94-R96 VanDerWaalsContact C-N 3.35Å; R96-C98 VanDerWaalsContact C-N 3.26Å; R96-C98 PolarHBondContact O-N 3.36Å; R96-L99 PolarHBondContact O-N 2.94Å; R96-Q100 WeakPolarHBondContact O-CG 3.31Å; R96-Q100 PolarHBondContact O-N 2.83Å |
| 97 | D | 66.6 | Low | 62.4 | Low | 75 Ų | 75 | 116.1 Ų | 116.1 | 40% | 0.401 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -65 | -34.4 | 175.1 | -68.6 | -20.2 | 0 | 0 | 0 | 111.4 | R93 R94 R101 | R93-D97 VanDerWaalsContact O-CG 3.3Å; R93-D97 PolarHBondContact O-N 3.24Å; R94-D97 PolarHBondContact O-N 2.84Å; D97-R101 PolarHBondContact O-N 3.26Å; D97-R101 VanDerWaalsContact O-N 3.08Å |
| 98 | C | 61.7 | Low | 61.4 | Low | 33 Ų | 33 | 112.2 Ų | 112.2 | 22% | 0.223 | 59% | 0.585 | C | S | . | * | H | α-helix | trans | -68.4 | -40.7 | 173 | -158.5 | 0 | 0 | 0 | 0 | 111.9 | R94 C95 R96 Q100 R101 C102 C105 | R94-C98 WeakPolarHBondContact O-CB 3.4Å; R94-C98 PolarHBondContact O-N 2.66Å; C95-C98 PolarHBondContact O-N 3.14Å; R96-C98 VanDerWaalsContact C-N 3.26Å; R96-C98 PolarHBondContact O-N 3.36Å; C98-Q100 VanDerWaalsContact C-N 3.34Å; C98-R101 PolarHBondContact O-N 3.36Å; C98-C102 WeakPolarHBondContact O-CB 3.26Å; C98-C102 PolarHBondContact O-N 3.43Å; C98-C105 PolarHBondContact SG-SG 3.37Å |
| 99 | L | 62.1 | Low | 60.5 | Low | 90 Ų | 90 | 114.5 Ų | 114.5 | 47% | 0.471 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -67.1 | -36.1 | 176.3 | -165.2 | 69.8 | 0 | 0 | 0 | 111.7 | C95 R96 G103 C105 | C95-L99 VanDerWaalsContact O-CB 3.31Å; C95-L99 WeakPolarHBondContact O-CB 3.34Å; C95-L99 PolarHBondContact O-N 3.42Å; R96-L99 PolarHBondContact O-N 2.94Å; L99-G103 WeakPolarHBondContact O-CA 3.26Å; L99-G103 PolarHBondContact O-N 2.72Å; L99-C105 HydrophobicContact CD1-CB 4.49Å |
| 100 | Q | 63.7 | Low | 59.5 | Low | 142 Ų | 142 | 116 Ų | 116 | 66% | 0.664 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -68.9 | -30.9 | 173.9 | -74.9 | -165.6 | -11.9 | 0 | 0 | 113.2 | R96 C98 | R96-Q100 WeakPolarHBondContact O-CG 3.31Å; R96-Q100 PolarHBondContact O-N 2.83Å; C98-Q100 VanDerWaalsContact C-N 3.34Å |
| 101 | R | 57.2 | Low | 58.2 | Low | 216 Ų | 216 | 113.9 Ų | 113.9 | 82% | 0.815 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -86.2 | -38.5 | 176.1 | -89.9 | -171.1 | -172.7 | 107.9 | 1.7 | 114.6 | D97 C98 | D97-R101 PolarHBondContact O-N 3.26Å; D97-R101 VanDerWaalsContact O-N 3.08Å; C98-R101 PolarHBondContact O-N 3.36Å |
| 102 | C | 53.1 | Low | 56.6 | Low | 88 Ų | 88 | 116.1 Ų | 116.1 | 60% | 0.595 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -111.9 | -2.6 | -168 | -72.9 | 0 | 0 | 0 | 0 | 114.3 | C98 A104 | C98-C102 WeakPolarHBondContact O-CB 3.26Å; C98-C102 PolarHBondContact O-N 3.43Å; C102-A104 PolarHBondContact O-N 2.86Å |
| 103 | G | 51.7 | Low | 55.2 | Low | 67 Ų | 67 | 115.9 Ų | 115.9 | 69% | 0.691 | 63% | 0.626 | S | S | * | * | S | Bend | trans | 65.4 | -12.5 | 171.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | L99 | L99-G103 WeakPolarHBondContact O-CA 3.26Å; L99-G103 PolarHBondContact O-N 2.72Å |
| 104 | A | 53.8 | Low | 53.2 | Low | 75 Ų | 75 | 113 Ų | 113 | 62% | 0.62 | 63% | 0.634 | S | S | * | * | trans | -159.2 | 93.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | C102 | C102-A104 PolarHBondContact O-N 2.86Š| ||
| 105 | C | 51.8 | Low | 51.4 | Low | 58 Ų | 58 | 109.7 Ų | 109.7 | 39% | 0.392 | 64% | 0.636 | S | S | . | * | trans | -113.3 | 86.2 | 165.1 | -84.6 | 0 | 0 | 0 | 0 | 109.7 | C98 L99 | C98-C105 PolarHBondContact SG-SG 3.37Å; L99-C105 HydrophobicContact CD1-CB 4.49Å | ||
| 106 | V | 51.8 | Low | 49.8 | Very low | 142 Ų | 142 | 115.8 Ų | 115.8 | 86% | 0.861 | 66% | 0.661 | S | S | * | * | trans | -107.3 | 6.9 | 175.4 | -176.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 107 | R | 49.1 | Very low | 48 | Very low | 238 Ų | 238 | 114.4 Ų | 114.4 | 90% | 0.898 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -145.9 | 97.3 | -179.1 | -162.7 | 169.1 | -87.2 | 173.7 | -7.7 | 111.6 | ||
| 108 | G | 45.2 | Very low | 46.2 | Very low | 65 Ų | 65 | 115.9 Ų | 115.9 | 67% | 0.67 | 68% | 0.682 | S | S | * | * | trans | 56.9 | 112.3 | 164 | 0 | 0 | 0 | 0 | 0 | 115.4 | S110 | G108-S110 PolarHBondContact O-N 2.86Š| ||
| 109 | C | 48.1 | Very low | 44.7 | Very low | 87 Ų | 87 | 120.9 Ų | 120.9 | 59% | 0.588 | 71% | 0.712 | S | S | * | * | trans | -67.4 | 80.1 | 169.3 | -78.7 | 0 | 0 | 0 | 0 | 109.1 | C95 | C95-C109 WeakPolarHBondContact CB-SG 3.32Å; C95-C109 WeakPolarHBondContact SG-CB 3.46Å; C95-C109 CovalentContact SG-SG 2.09Å; C95-C109 PolarHBondContact SG-SG 3.46Å | ||
| 110 | S | 49.5 | Very low | 43.4 | Very low | 90 Ų | 90 | 125.5 Ų | 125.5 | 63% | 0.629 | 73% | 0.731 | S | S | * | * | trans | -89 | 150.4 | 160.5 | 55.2 | 0 | 0 | 0 | 0 | 109.4 | G108 C112 | G108-S110 PolarHBondContact O-N 2.86Å; S110-C112 PolarHBondContact O-N 2.89Å | ||
| 111 | P | 44 | Very low | 41.7 | Very low | 108 Ų | 108 | 122.3 Ų | 122.3 | 70% | 0.701 | 74% | 0.736 | S | S | * | * | trans | -69.2 | 118.9 | -172 | -12.7 | 27.7 | 0 | 0 | 0 | 110.5 | L113 | P111-L113 VanDerWaalsContact C-N 3.28Å; P111-L113 HydrophobicContact CB-CG 4.26Å; P111-L113 PolarHBondContact O-N 3.42Å | ||
| 112 | C | 35.7 | Very low | 40.4 | Very low | 116 Ų | 116 | 116.9 Ų | 116.9 | 78% | 0.784 | 74% | 0.737 | S | S | * | * | trans | -69.6 | 90.9 | 161.7 | -45.4 | 0 | 0 | 0 | 0 | 107.3 | S110 | S110-C112 PolarHBondContact O-N 2.89Š| ||
| 113 | L | 38.3 | Very low | 39.5 | Very low | 152 Ų | 152 | 117.3 Ų | 117.3 | 80% | 0.796 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -101.1 | 119.7 | 164.7 | -69.6 | 175.8 | 0 | 0 | 0 | 107.3 | P111 | P111-L113 VanDerWaalsContact C-N 3.28Å; P111-L113 HydrophobicContact CB-CG 4.26Å; P111-L113 PolarHBondContact O-N 3.42Å |
| 114 | S | 32 | Very low | 38.6 | Very low | 123 Ų | 123 | 123.1 Ų | 123.1 | 86% | 0.86 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 133.1 | 172.5 | -56.7 | 0 | 0 | 0 | 0 | 110.1 | ||
| 115 | T | 29.8 | Very low | 37.7 | Very low | 130 Ų | 130 | 124 Ų | 124 | 80% | 0.798 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 161.2 | 168.8 | -53.4 | 0 | 0 | 0 | 0 | 112.8 | ||
| 116 | E | 30.3 | Very low | 36.7 | Very low | 169 Ų | 169 | 127.5 Ų | 127.5 | 79% | 0.79 | 78% | 0.779 | S | S | * | * | trans | 110.4 | 119.8 | 174.1 | -70.3 | -175.9 | 117.6 | 0 | 0 | 111.9 | ||||
| 117 | D | 32.4 | Very low | 35.6 | Very low | 139 Ų | 139 | 132 Ų | 132 | 74% | 0.743 | 78% | 0.781 | S | S | * | * | cis | -151.4 | 130.6 | 19.8 | -84.3 | -44.5 | 0 | 0 | 0 | 109.8 | ||||
| 118 | S | 29.2 | Very low | 34.7 | Very low | 105 Ų | 105 | 126 Ų | 126 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | 69.5 | 100.5 | 92 | -163.2 | 0 | 0 | 0 | 0 | 116.4 | |||||
| 119 | T | 29 | Very low | 34.5 | Very low | 138 Ų | 138 | 131.9 Ų | 131.9 | 85% | 0.847 | 78% | 0.777 | S | S | * | * | trans | -161.9 | 139.9 | 132.9 | -16.5 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 120 | E | 34.7 | Very low | 33.7 | Very low | 188 Ų | 188 | 137.3 Ų | 137.3 | 88% | 0.879 | 79% | 0.794 | S | S | * | * | trans | -64.6 | 167.1 | -175.1 | -57.2 | 146.8 | 142.5 | 0 | 0 | 113.6 | ||||
| 121 | G | 29.1 | Very low | 33.1 | Very low | 74 Ų | 74 | 140.5 Ų | 140.5 | 76% | 0.763 | 80% | 0.799 | S | S | * | * | cis | 173.2 | -170.8 | 10.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 122 | A | 28.9 | Very low | 32.7 | Very low | 102 Ų | 102 | 142.4 Ų | 142.4 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | trans | 90.1 | 98.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 123 | A | 35.2 | Very low | 32.4 | Very low | 97 Ų | 97 | 140.5 Ų | 140.5 | 80% | 0.802 | 80% | 0.803 | S | S | * | * | 69 | 125.9 | 80.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 124 | E | 32.2 | Very low | 32.4 | Very low | 189 Ų | 189 | 139.9 Ų | 139.9 | 88% | 0.883 | 81% | 0.805 | S | S | * | * | cis | -156 | 157.7 | 45.5 | -74.4 | -166.3 | 128.4 | 0 | 0 | 115.9 | ||||
| 125 | A | 35.2 | Very low | 33 | Very low | 95 Ų | 95 | 139.6 Ų | 139.6 | 79% | 0.785 | 80% | 0.801 | S | S | * | * | trans | -7 | 160.4 | 147.2 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 126 | N | 30.6 | Very low | 33.8 | Very low | 131 Ų | 131 | 138.9 Ų | 138.9 | 70% | 0.701 | 80% | 0.798 | S | S | * | * | cis | 174.2 | 150.7 | -3.6 | 176.2 | 3.8 | 0 | 0 | 0 | 103.4 | ||||
| 127 | W | 28.4 | Very low | 34 | Very low | 237 Ų | 237 | 136.6 Ų | 136.6 | 90% | 0.898 | 80% | 0.801 | S | S | * | * | trans | 170 | 148.4 | 135 | -95.7 | 49.4 | 0 | 0 | 0 | 113.2 | ||||
| 128 | T | 31.2 | Very low | 34.6 | Very low | 112 Ų | 112 | 136 Ų | 136 | 69% | 0.687 | 80% | 0.804 | S | S | * | * | trans | -78.4 | 138.3 | -164 | 26.9 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 129 | K | 40.5 | Very low | 34.8 | Very low | 188 Ų | 188 | 138.8 Ų | 138.8 | 82% | 0.817 | 81% | 0.811 | S | S | * | * | 27.9 | 124.9 | 125.4 | -164.7 | 176.3 | -172.1 | 179.7 | 0 | 119.6 | |||||
| 130 | E | 31.8 | Very low | 34.9 | Very low | 201 Ų | 201 | 144.4 Ų | 144.4 | 94% | 0.939 | 82% | 0.817 | S | S | * | * | trans | -167.8 | 158.3 | 132.5 | -107.3 | 176.3 | -176.6 | 0 | 0 | 113.7 | ||||
| 131 | H | 36.2 | Very low | 34.9 | Very low | 157 Ų | 157 | 139.9 Ų | 139.9 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | trans | -128.9 | 152 | -153.4 | -148.8 | -62.3 | 0 | 0 | 0 | 110.9 | ||||
| 132 | N | 36 | Very low | 35.6 | Very low | 148 Ų | 148 | 142 Ų | 142 | 79% | 0.791 | 81% | 0.812 | S | S | * | * | trans | 76.1 | 130.5 | 157.4 | -65.9 | -35.7 | 0 | 0 | 0 | 122.4 | ||||
| 133 | G | 29.5 | Very low | 36 | Very low | 76 Ų | 76 | 143.1 Ų | 143.1 | 78% | 0.784 | 81% | 0.811 | S | S | * | * | trans | -169.8 | 110.6 | 152.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 134 | V | 37.2 | Very low | 35.8 | Very low | 139 Ų | 139 | 144 Ų | 144 | 84% | 0.842 | 81% | 0.811 | S | S | * | * | trans | -124.1 | 143 | 166.8 | 170.1 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 135 | P | 45.8 | Very low | 35.9 | Very low | 117 Ų | 117 | 144.3 Ų | 144.3 | 76% | 0.76 | 80% | 0.804 | S | S | * | * | -156.1 | -166.9 | 108.1 | 41.9 | -20 | 0 | 0 | 0 | 113.8 | |||||
| 136 | P | 46.7 | Very low | 36.1 | Very low | 115 Ų | 115 | 151.7 Ų | 151.7 | 75% | 0.747 | 81% | 0.812 | S | S | * | * | -123.5 | 167.7 | -83.4 | 36.4 | -18.4 | 0 | 0 | 0 | 114.3 | |||||
| 137 | S | 34.4 | Very low | 36.4 | Very low | 121 Ų | 121 | 151.4 Ų | 151.4 | 85% | 0.846 | 81% | 0.81 | S | S | * | * | trans | -76.4 | 161.2 | 171.3 | -64.6 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 138 | P | 45.3 | Very low | 36.7 | Very low | 126 Ų | 126 | 143.3 Ų | 143.3 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | trans | -134.6 | 151.7 | 136.6 | 35.8 | -22.2 | 0 | 0 | 0 | 114.9 | ||||
| 139 | D | 33.2 | Very low | 37.1 | Very low | 164 Ų | 164 | 147.2 Ų | 147.2 | 88% | 0.877 | 81% | 0.811 | S | S | * | * | trans | -59.1 | 148.5 | -178.1 | -66.8 | -62.3 | 0 | 0 | 0 | 116.8 | ||||
| 140 | R | 31.3 | Very low | 36.9 | Very low | 255 Ų | 255 | 148.9 Ų | 148.9 | 96% | 0.962 | 81% | 0.812 | S | S | * | * | trans | -162.9 | 128.4 | 139.1 | -109.9 | 178.8 | -172 | -175 | 3.3 | 112.1 | ||||
| 141 | A | 34.7 | Very low | 37.7 | Very low | 94 Ų | 94 | 146.9 Ų | 146.9 | 78% | 0.777 | 81% | 0.807 | S | S | * | * | trans | -90.9 | -179.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 142 | P | 43.6 | Very low | 37.9 | Very low | 119 Ų | 119 | 148.7 Ų | 148.7 | 77% | 0.773 | 81% | 0.812 | S | S | * | * | -111.8 | -171.7 | -122.6 | 39.5 | -23.3 | 0 | 0 | 0 | 114.3 | |||||
| 143 | P | 37 | Very low | 38.1 | Very low | 125 Ų | 125 | 145.8 Ų | 145.8 | 81% | 0.812 | 80% | 0.804 | S | S | * | * | trans | -128.1 | 132.9 | 151.1 | 34.8 | -20.7 | 0 | 0 | 0 | 115.8 | ||||
| 144 | S | 30.3 | Very low | 38.8 | Very low | 114 Ų | 114 | 148.2 Ų | 148.2 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | trans | 72.8 | 110 | 131.3 | -167.8 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 145 | R | 35.3 | Very low | 39.1 | Very low | 197 Ų | 197 | 150.4 Ų | 150.4 | 74% | 0.743 | 81% | 0.807 | S | S | * | * | trans | -24.3 | 135.6 | 148.6 | -87.5 | -177.8 | 170.5 | -131.1 | 6.8 | 115.1 | D147 | R145-D147 IonicContact CZ-OD2 2.56Å; R145-D147 IonicContact NH1-OD1 3.72Å; R145-D147 IonicContact NH1-OD2 2.69Å; R145-D147 PolarHBondContact NH1-OD2 3.41Å | ||
| 146 | R | 39 | Very low | 39 | Very low | 250 Ų | 250 | 148.4 Ų | 148.4 | 94% | 0.943 | 81% | 0.807 | S | S | * | * | -131.6 | 127.6 | 120 | -78.1 | -163.2 | -158.7 | -155.5 | 5.8 | 109.9 | |||||
| 147 | D | 36.6 | Very low | 39.1 | Very low | 125 Ų | 125 | 147.2 Ų | 147.2 | 67% | 0.668 | 80% | 0.801 | S | S | * | * | trans | -61.7 | 129.2 | 167.8 | -73.9 | -67.8 | 0 | 0 | 0 | 110.6 | R145 | R145-D147 IonicContact CZ-OD2 2.56Å; R145-D147 IonicContact NH1-OD1 3.72Å; R145-D147 IonicContact NH1-OD2 2.69Å; R145-D147 PolarHBondContact NH1-OD2 3.41Å | ||
| 148 | G | 35.2 | Very low | 39.9 | Very low | 67 Ų | 67 | 146.7 Ų | 146.7 | 69% | 0.691 | 80% | 0.798 | S | S | * | * | trans | -149.3 | 101.5 | 161.2 | 0 | 0 | 0 | 0 | 0 | 106.2 | R150 | G148-R150 PolarHBondContact O-N 2.87Š| ||
| 149 | Q | 39.6 | Very low | 40.2 | Very low | 194 Ų | 194 | 148.4 Ų | 148.4 | 91% | 0.907 | 79% | 0.793 | S | S | * | * | trans | -56.6 | 98.6 | -178.3 | -71.3 | -180 | -9.3 | 0 | 0 | 110.4 | ||||
| 150 | R | 36.1 | Very low | 41.6 | Very low | 222 Ų | 222 | 144.1 Ų | 144.1 | 84% | 0.838 | 78% | 0.775 | S | S | * | * | trans | -96.4 | 96.7 | 164.3 | -155.1 | 176.1 | -169 | -104.5 | 3.8 | 106.7 | G148 K152 | G148-R150 PolarHBondContact O-N 2.87Å; R150-K152 PolarHBondContact O-N 2.88Å | ||
| 151 | L | 48.3 | Very low | 43.4 | Very low | 160 Ų | 160 | 138.7 Ų | 138.7 | 84% | 0.838 | 76% | 0.756 | S | S | * | * | trans | -47.6 | 127.9 | 171.1 | -80.2 | 152.4 | 0 | 0 | 0 | 109.2 | S153 | L151-S153 PolarHBondContact O-N 3.01Å; L151-S153 VanDerWaalsContact O-N 3.1Å | ||
| 152 | K | 41.6 | Very low | 44.7 | Very low | 195 Ų | 195 | 138.7 Ų | 138.7 | 85% | 0.848 | 75% | 0.748 | S | S | * | * | trans | -45.1 | 113.1 | 175.4 | -89.6 | 163.1 | 167.2 | 171.2 | 0 | 110.2 | R150 T154 | R150-K152 PolarHBondContact O-N 2.88Å; K152-T154 PolarHBondContact O-N 2.67Å | ||
| 153 | S | 40 | Very low | 45.9 | Very low | 87 Ų | 87 | 138.8 Ų | 138.8 | 61% | 0.608 | 74% | 0.742 | S | S | * | * | trans | -68.3 | 97.6 | 162.4 | 52 | 0 | 0 | 0 | 0 | 107.5 | L151 M155 | L151-S153 PolarHBondContact O-N 3.01Å; L151-S153 VanDerWaalsContact O-N 3.1Å; S153-M155 VanDerWaalsContact C-N 3.27Å; S153-M155 PolarHBondContact O-N 3.43Å | ||
| 154 | T | 43.3 | Very low | 47.6 | Very low | 127 Ų | 127 | 136.3 Ų | 136.3 | 78% | 0.779 | 73% | 0.725 | S | S | * | * | trans | -68 | 92.5 | 165.9 | -58 | 0 | 0 | 0 | 0 | 106.7 | K152 G156 | K152-T154 PolarHBondContact O-N 2.67Å; T154-G156 PolarHBondContact O-N 3.31Å; T154-G156 VanDerWaalsContact O-N 3.13Å | ||
| 155 | M | 43.4 | Very low | 50 | Low | 185 Ų | 185 | 137.1 Ų | 137.1 | 91% | 0.911 | 71% | 0.714 | S | S | * | * | trans | -59.8 | 109.4 | 163.6 | -81.5 | 155.7 | 105.5 | 0 | 0 | 106.9 | S153 | S153-M155 VanDerWaalsContact C-N 3.27Å; S153-M155 PolarHBondContact O-N 3.43Å | ||
| 156 | G | 44.7 | Very low | 51.3 | Low | 74 Ų | 74 | 133.8 Ų | 133.8 | 76% | 0.763 | 71% | 0.71 | S | S | * | * | trans | 161 | 12.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 118.8 | T154 | T154-G156 PolarHBondContact O-N 3.31Å; T154-G156 VanDerWaalsContact O-N 3.13Å | ||
| 157 | S | 47.3 | Very low | 52.7 | Low | 90 Ų | 90 | 132 Ų | 132 | 63% | 0.629 | 71% | 0.709 | S | S | * | * | trans | -139.2 | 101.2 | 171.1 | 176.8 | 0 | 0 | 0 | 0 | 110.4 | F159 | S157-F159 PolarHBondContact O-N 3.21Š| ||
| 158 | S | 51.7 | Low | 54.3 | Low | 110 Ų | 110 | 128.7 Ų | 128.7 | 77% | 0.769 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | 12.7 | -177.8 | -63.6 | 0 | 0 | 0 | 0 | 115 | ||
| 159 | F | 52.7 | Low | 55.8 | Low | 162 Ų | 162 | 131.2 Ų | 131.2 | 71% | 0.711 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -140.3 | 38.1 | -175.7 | -67.1 | -79.3 | 0 | 0 | 0 | 113.4 | S157 | S157-F159 PolarHBondContact O-N 3.21Š|
| 160 | S | 62.2 | Low | 57.3 | Low | 74 Ų | 74 | 124.2 Ų | 124.2 | 52% | 0.517 | 67% | 0.673 | S | S | . | * | trans | -102.5 | 112.4 | 169.3 | -172.9 | 0 | 0 | 0 | 0 | 109.5 | P162 | S160-P162 WeakPolarHBondContact O-CD 3.21Š| ||
| 161 | Y | 69.2 | Low | 58.5 | Low | 142 Ų | 142 | 117.4 Ų | 117.4 | 56% | 0.557 | 66% | 0.655 | S | S | * | * | trans | -107.6 | 85.6 | 174.6 | -65.4 | -81.6 | 0 | 0 | 0 | 109.5 | D163 V164 | Y161-D163 VanDerWaalsContact C-OD1 3.27Å; Y161-D163 WeakPolarHBondContact CA-OD1 3.4Å; Y161-D163 PolarHBondContact O-N 3.36Å; Y161-D163 VanDerWaalsContact O-N 3.11Å; Y161-V164 HydrophobicContact CG-CG2 4.41Å; Y161-V164 PolarHBondContact O-N 3.46Å | ||
| 162 | P | 62.8 | Low | 59.5 | Low | 93 Ų | 93 | 117.3 Ų | 117.3 | 60% | 0.604 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.9 | -12.6 | -176.6 | 28.5 | -35.6 | 0 | 0 | 0 | 113.4 | S160 | S160-P162 WeakPolarHBondContact O-CD 3.21Š|
| 163 | D | 67.8 | Low | 60.1 | Low | 121 Ų | 121 | 112.5 Ų | 112.5 | 65% | 0.647 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.3 | -12.8 | -178 | 53.2 | -35.5 | 0 | 0 | 0 | 113.9 | Y161 | Y161-D163 VanDerWaalsContact C-OD1 3.27Å; Y161-D163 WeakPolarHBondContact CA-OD1 3.4Å; Y161-D163 PolarHBondContact O-N 3.36Å; Y161-D163 VanDerWaalsContact O-N 3.11Å |
| 164 | V | 71.7 | Confident | 60.5 | Low | 74 Ų | 74 | 119 Ų | 119 | 45% | 0.448 | 65% | 0.646 | S | S | . | * | trans | -88.5 | 115.8 | -178.5 | 179.7 | 0 | 0 | 0 | 0 | 111.1 | Y161 V171 | Y161-V164 HydrophobicContact CG-CG2 4.41Å; Y161-V164 PolarHBondContact O-N 3.46Å; V164-V171 PolarHBondContact O-N 3.2Å | ||
| 165 | K | 81.6 | Confident | 60.8 | Low | 131 Ų | 131 | 118.4 Ų | 118.4 | 57% | 0.57 | 65% | 0.645 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -124.5 | 126.2 | 176.9 | -59.9 | -177.9 | -179.2 | 178.5 | 0 | 110.7 | I169 P170 | K165-I169 VanDerWaalsContact CA-O 3.31Å; K165-I169 WeakPolarHBondContact CA-O 3.4Å; K165-P170 HydrophobicContact CG-CB 4.36Å |
| 166 | L | 62 | Low | 60.4 | Low | 127 Ų | 127 | 121.4 Ų | 121.4 | 67% | 0.665 | 65% | 0.646 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -93.9 | 117.7 | 169.5 | -86.5 | 154.6 | 0 | 0 | 0 | 108.2 | G168 I169 V171 | L166-G168 PolarHBondContact O-N 2.68Å; L166-I169 PolarHBondContact N-O 3.23Å; L166-I169 PolarHBondContact O-N 2.71Å; L166-V171 HydrophobicContact CB-CG2 4.32Å; L166-V171 HydrophobicContact CD1-CG2 3.85Å; L166-V171 HydrophobicContact CG-CG2 4.36Å |
| 167 | K | 69.6 | Low | 59.9 | Low | 211 Ų | 211 | 122.5 Ų | 122.5 | 92% | 0.917 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 50.8 | 39.7 | -175.1 | -67.2 | -178.6 | 172.6 | -179.4 | 0 | 113.5 | I169 | K167-I169 PolarHBondContact O-N 3.14Š|
| 168 | G | 70.1 | Confident | 59.2 | Low | 57 Ų | 57 | 124.5 Ų | 124.5 | 59% | 0.588 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 77.7 | -3.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | L166 | L166-G168 PolarHBondContact O-N 2.68Š|
| 169 | I | 66.4 | Low | 58.3 | Low | 120 Ų | 120 | 123.9 Ų | 123.9 | 62% | 0.615 | 65% | 0.652 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -92.9 | 120.4 | 177.1 | -54.3 | 175.6 | 0 | 0 | 0 | 108.6 | K165 L166 K167 V171 | K165-I169 VanDerWaalsContact CA-O 3.31Å; K165-I169 WeakPolarHBondContact CA-O 3.4Å; L166-I169 PolarHBondContact N-O 3.23Å; L166-I169 PolarHBondContact O-N 2.71Å; K167-I169 PolarHBondContact O-N 3.14Å; I169-V171 PolarHBondContact O-N 2.77Å |
| 170 | P | 70.6 | Confident | 57.4 | Low | 47 Ų | 47 | 124.3 Ų | 124.3 | 31% | 0.305 | 66% | 0.661 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -65.8 | 131.3 | 177.1 | 25.5 | -31.6 | 0 | 0 | 0 | 111.1 | K165 Y172 | K165-P170 HydrophobicContact CG-CB 4.36Å; P170-Y172 HydrophobicContact CB-CD2 4.17Å; P170-Y172 HydrophobicContact CB-CE2 3.61Å; P170-Y172 HydrophobicContact CG-CD2 4.2Å; P170-Y172 HydrophobicContact CG-CE2 3.51Å; P170-Y172 PolarHBondContact O-N 3.35Å |
| 171 | V | 60.6 | Low | 56.2 | Low | 78 Ų | 78 | 125.2 Ų | 125.2 | 47% | 0.473 | 67% | 0.673 | S | S | . | * | trans | -86.3 | 94.8 | 179.2 | -176.2 | 0 | 0 | 0 | 0 | 108 | V164 L166 I169 | V164-V171 PolarHBondContact O-N 3.2Å; L166-V171 HydrophobicContact CB-CG2 4.32Å; L166-V171 HydrophobicContact CD1-CG2 3.85Å; L166-V171 HydrophobicContact CG-CG2 4.36Å; I169-V171 PolarHBondContact O-N 2.77Å | ||
| 172 | Y | 70.6 | Confident | 55 | Low | 159 Ų | 159 | 124.5 Ų | 124.5 | 62% | 0.624 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -90.6 | 133.6 | 171 | -65.8 | -72.2 | 0 | 0 | 0 | 110.1 | P170 Y174 | P170-Y172 HydrophobicContact CB-CD2 4.17Å; P170-Y172 HydrophobicContact CB-CE2 3.61Å; P170-Y172 HydrophobicContact CG-CD2 4.2Å; P170-Y172 HydrophobicContact CG-CE2 3.51Å; P170-Y172 PolarHBondContact O-N 3.35Å; Y172-Y174 PolarHBondContact O-N 3.36Å |
| 173 | P | 54.3 | Low | 53.6 | Low | 94 Ų | 94 | 128.1 Ų | 128.1 | 61% | 0.61 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 122 | 163.7 | -14.4 | 27.1 | 0 | 0 | 0 | 108.3 | P175 | P173-P175 WeakPolarHBondContact O-CD 3.49Š|
| 174 | Y | 47.7 | Very low | 52.2 | Low | 222 Ų | 222 | 127 Ų | 127 | 87% | 0.871 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 125.1 | 174.5 | -83.6 | -92.5 | 0 | 0 | 0 | 109.9 | Y172 R176 | Y172-Y174 PolarHBondContact O-N 3.36Å; Y174-R176 PolarHBondContact O-N 3.28Å |
| 175 | P | 49 | Very low | 50.4 | Low | 116 Ų | 116 | 131.6 Ų | 131.6 | 75% | 0.753 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 123.7 | 167.1 | -12.1 | 26.6 | 0 | 0 | 0 | 108 | P173 A177 | P173-P175 WeakPolarHBondContact O-CD 3.49Å; P175-A177 VanDerWaalsContact C-N 3.31Å; P175-A177 PolarHBondContact O-N 3.03Å |
| 176 | R | 35.3 | Very low | 48.2 | Very low | 248 Ų | 248 | 131.3 Ų | 131.3 | 94% | 0.936 | 74% | 0.744 | S | S | * | * | trans | -59.2 | 99 | 162.1 | -84 | -177.4 | -166 | 152.7 | 5 | 107.6 | Y174 T178 | Y174-R176 PolarHBondContact O-N 3.28Å; R176-T178 PolarHBondContact O-N 3.41Å | ||
| 177 | A | 34.1 | Very low | 46.6 | Very low | 96 Ų | 96 | 130.6 Ų | 130.6 | 79% | 0.793 | 75% | 0.748 | S | S | * | * | trans | -80.4 | 112.4 | 163.8 | 0 | 0 | 0 | 0 | 0 | 108 | P175 S179 | P175-A177 VanDerWaalsContact C-N 3.31Å; P175-A177 PolarHBondContact O-N 3.03Å; A177-S179 PolarHBondContact O-N 2.91Å | ||
| 178 | T | 34.2 | Very low | 45 | Very low | 133 Ų | 133 | 126.7 Ų | 126.7 | 82% | 0.816 | 75% | 0.746 | S | S | * | * | trans | -64.4 | 117.9 | 165.3 | -30.7 | 0 | 0 | 0 | 0 | 108.6 | R176 | R176-T178 PolarHBondContact O-N 3.41Š| ||
| 179 | S | 32.5 | Very low | 43.4 | Very low | 97 Ų | 97 | 133.1 Ų | 133.1 | 68% | 0.678 | 76% | 0.758 | S | S | * | * | trans | 10.7 | 126.6 | 155.8 | 61.5 | 0 | 0 | 0 | 0 | 120.6 | A177 | A177-S179 PolarHBondContact O-N 2.91Š| ||
| 180 | L | 32.4 | Very low | 41.6 | Very low | 171 Ų | 171 | 135.7 Ų | 135.7 | 90% | 0.895 | 77% | 0.767 | S | S | * | * | -167.4 | 139.1 | 113.1 | -145.1 | 73.8 | 0 | 0 | 0 | 112.3 | |||||
| 181 | A | 38.8 | Very low | 40.3 | Very low | 92 Ų | 92 | 138.4 Ų | 138.4 | 76% | 0.76 | 79% | 0.785 | S | S | * | * | trans | 81.6 | 128.6 | 167.4 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 182 | P | 42.4 | Very low | 38.9 | Very low | 128 Ų | 128 | 143 Ų | 143 | 83% | 0.831 | 81% | 0.806 | S | S | * | * | -134.2 | 133.1 | 106.4 | 35.2 | -23.1 | 0 | 0 | 0 | 113.6 | |||||
| 183 | D | 34.2 | Very low | 37.1 | Very low | 169 Ų | 169 | 140 Ų | 140 | 90% | 0.904 | 81% | 0.814 | S | S | * | * | trans | -88.5 | 124.5 | 150 | -88.1 | -41 | 0 | 0 | 0 | 107.6 | ||||
| 184 | A | 38.2 | Very low | 36.3 | Very low | 96 Ų | 96 | 143.1 Ų | 143.1 | 79% | 0.793 | 83% | 0.825 | S | S | * | * | trans | -170.3 | 117.3 | 150 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 185 | D | 34.5 | Very low | 36.3 | Very low | 171 Ų | 171 | 137.5 Ų | 137.5 | 91% | 0.914 | 82% | 0.816 | S | S | * | * | trans | -48.9 | 136.3 | 173.3 | -58.2 | -70.3 | 0 | 0 | 0 | 114 | ||||
| 186 | S | 34.2 | Very low | 36.2 | Very low | 125 Ų | 125 | 137.6 Ų | 137.6 | 87% | 0.874 | 82% | 0.817 | S | S | * | * | trans | -149.2 | 110 | 147.9 | -162.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 187 | C | 29.3 | Very low | 36.6 | Very low | 112 Ų | 112 | 131.6 Ų | 131.6 | 76% | 0.757 | 81% | 0.81 | S | S | * | * | trans | -74.9 | 131.6 | 178.4 | 174.2 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 188 | C | 35.3 | Very low | 36.5 | Very low | 130 Ų | 130 | 135 Ų | 135 | 88% | 0.878 | 81% | 0.811 | S | S | * | * | trans | -157.1 | 115.5 | 137.8 | -93.4 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 189 | K | 35.9 | Very low | 36.6 | Very low | 192 Ų | 192 | 138.9 Ų | 138.9 | 84% | 0.835 | 81% | 0.811 | S | S | * | * | trans | -64.1 | 146.3 | 166.5 | -96.9 | 172.9 | 165.1 | 179.1 | 0 | 111.3 | ||||
| 190 | E | 30.1 | Very low | 36.7 | Very low | 173 Ų | 173 | 141.8 Ų | 141.8 | 81% | 0.808 | 81% | 0.813 | S | S | * | * | -172.3 | 139.4 | 114 | -160.2 | 75.4 | 162.9 | 0 | 0 | 110.7 | |||||
| 191 | P | 42.5 | Very low | 36.7 | Very low | 104 Ų | 104 | 139 Ų | 139 | 68% | 0.675 | 81% | 0.809 | S | S | * | * | trans | -114.7 | 177.9 | -167.8 | 25 | -3.2 | 0 | 0 | 0 | 116.1 | ||||
| 192 | L | 32.4 | Very low | 36.7 | Very low | 176 Ų | 176 | 142.7 Ų | 142.7 | 92% | 0.921 | 81% | 0.814 | S | S | * | * | trans | 97.1 | 131 | 165.6 | -134.5 | 71.3 | 0 | 0 | 0 | 115 | ||||
| 193 | A | 32.6 | Very low | 36.7 | Very low | 95 Ų | 95 | 142.9 Ų | 142.9 | 79% | 0.785 | 82% | 0.816 | S | S | * | * | cis | -157.5 | 172.5 | 36.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 194 | D | 36.8 | Very low | 36.7 | Very low | 159 Ų | 159 | 139.6 Ų | 139.6 | 85% | 0.85 | 81% | 0.806 | S | S | * | * | trans | -91.1 | -169.1 | -161.4 | -133 | -13.1 | 0 | 0 | 0 | 114.2 | ||||
| 195 | P | 47.5 | Very low | 36.5 | Very low | 104 Ų | 104 | 141.8 Ų | 141.8 | 68% | 0.675 | 81% | 0.81 | S | S | * | * | -112.3 | -171.5 | -128.7 | 42.8 | -24.6 | 0 | 0 | 0 | 115.2 | |||||
| 196 | P | 46 | Very low | 36.9 | Very low | 119 Ų | 119 | 141.4 Ų | 141.4 | 77% | 0.773 | 81% | 0.807 | S | S | * | * | trans | -99.9 | 165.9 | -165.4 | 39.1 | -32.4 | 0 | 0 | 0 | 115.4 | ||||
| 197 | P | 45.3 | Very low | 37.1 | Very low | 121 Ų | 121 | 142.1 Ų | 142.1 | 79% | 0.786 | 81% | 0.806 | S | S | * | * | trans | -119.9 | 162.2 | 152.6 | 40.4 | -27.8 | 0 | 0 | 0 | 109.5 | ||||
| 198 | M | 32 | Very low | 37.4 | Very low | 167 Ų | 167 | 142 Ų | 142 | 82% | 0.823 | 81% | 0.806 | S | S | * | * | cis | -166.5 | 174.1 | 17.8 | -151.3 | 167.5 | 160.6 | 0 | 0 | 108.1 | ||||
| 199 | R | 36.8 | Very low | 37.3 | Very low | 215 Ų | 215 | 141.4 Ų | 141.4 | 81% | 0.811 | 80% | 0.803 | S | S | * | * | trans | -66.3 | 171.4 | -169 | -61.4 | -178.9 | 168.7 | 145.2 | -1.6 | 116.8 | ||||
| 200 | H | 32.9 | Very low | 38.3 | Very low | 158 Ų | 158 | 137.4 Ų | 137.4 | 73% | 0.731 | 80% | 0.797 | S | S | * | * | 158.7 | 102.9 | 126.4 | -73.5 | -55.7 | 0 | 0 | 0 | 109.9 | |||||
| 201 | S | 32.4 | Very low | 38.7 | Very low | 114 Ų | 114 | 141.2 Ų | 141.2 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | 75.2 | 114.7 | 94.4 | -57.3 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 202 | L | 39.3 | Very low | 38.1 | Very low | 168 Ų | 168 | 139.5 Ų | 139.5 | 88% | 0.88 | 81% | 0.805 | S | S | * | * | trans | -65.2 | 169.9 | 172.3 | -61.1 | 167.1 | 0 | 0 | 0 | 112.9 | ||||
| 203 | P | 43.6 | Very low | 38.7 | Very low | 132 Ų | 132 | 136.3 Ų | 136.3 | 86% | 0.857 | 80% | 0.798 | S | S | * | * | -144.6 | 161.3 | 94.1 | 33.9 | -15.2 | 0 | 0 | 0 | 116.6 | |||||
| 204 | S | 33.3 | Very low | 38.8 | Very low | 100 Ų | 100 | 141.2 Ų | 141.2 | 70% | 0.699 | 81% | 0.805 | S | S | * | * | trans | -79.1 | 148.1 | -179.2 | -176.9 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 205 | T | 34.9 | Very low | 39.3 | Very low | 142 Ų | 142 | 142.6 Ų | 142.6 | 87% | 0.871 | 81% | 0.806 | S | S | * | * | trans | -143.7 | 116.8 | 154.2 | 49.9 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 206 | L | 42 | Very low | 39.3 | Very low | 164 Ų | 164 | 146.9 Ų | 146.9 | 86% | 0.859 | 81% | 0.81 | S | S | * | * | trans | -79 | 139.7 | 166.2 | -66.9 | 164.4 | 0 | 0 | 0 | 110 | ||||
| 207 | V | 37.8 | Very low | 38.9 | Very low | 140 Ų | 140 | 150.8 Ų | 150.8 | 85% | 0.848 | 81% | 0.811 | S | S | * | * | trans | -136.7 | 128.1 | 158.1 | 168.1 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 208 | S | 35.2 | Very low | 38.7 | Very low | 109 Ų | 109 | 150.1 Ų | 150.1 | 76% | 0.762 | 81% | 0.809 | S | S | * | * | trans | -56.1 | 168.2 | 173.2 | -36.5 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 209 | S | 34.7 | Very low | 39.1 | Very low | 117 Ų | 117 | 150.5 Ų | 150.5 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | cis | 180 | 173.5 | 25.2 | -148.4 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 210 | P | 56.3 | Low | 39.5 | Very low | 108 Ų | 108 | 147.2 Ų | 147.2 | 70% | 0.701 | 80% | 0.8 | S | S | * | * | trans | -108 | 165.4 | -155.8 | 41.1 | -34.5 | 0 | 0 | 0 | 116.8 | ||||
| 211 | R | 38.7 | Very low | 40.1 | Very low | 253 Ų | 253 | 145.7 Ų | 145.7 | 96% | 0.955 | 79% | 0.793 | S | S | * | * | trans | 134.6 | 127.2 | 143.5 | -77.5 | -144.7 | 175.1 | -175.8 | -0.2 | 113.9 | ||||
| 212 | G | 30.5 | Very low | 40.8 | Very low | 69 Ų | 69 | 144.8 Ų | 144.8 | 71% | 0.711 | 79% | 0.786 | S | S | * | * | trans | 152 | 66.4 | 157.1 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 213 | S | 44.6 | Very low | 41 | Very low | 109 Ų | 109 | 143.3 Ų | 143.3 | 76% | 0.762 | 78% | 0.779 | S | S | * | * | trans | 43.5 | 103.2 | 145.6 | 60.3 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 214 | E | 34.5 | Very low | 41.1 | Very low | 198 Ų | 198 | 144 Ų | 144 | 93% | 0.925 | 78% | 0.775 | S | S | * | * | trans | -135.5 | 102.9 | 141.8 | -69.3 | -159.8 | -173.2 | 0 | 0 | 109.4 | ||||
| 215 | E | 46.2 | Very low | 41.7 | Very low | 187 Ų | 187 | 146.1 Ų | 146.1 | 87% | 0.874 | 78% | 0.778 | S | S | * | * | trans | -92.2 | 91.9 | 167.8 | -79.2 | 156 | 163 | 0 | 0 | 108.1 | ||||
| 216 | Y | 48.6 | Very low | 42.4 | Very low | 195 Ų | 195 | 145.2 Ų | 145.2 | 77% | 0.765 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -156.8 | 108.3 | 156.8 | -137.4 | -116.7 | 0 | 0 | 0 | 109 | ||
| 217 | Y | 36.8 | Very low | 42.6 | Very low | 201 Ų | 201 | 142.5 Ų | 142.5 | 79% | 0.788 | 76% | 0.76 | S | S | * | * | trans | 62.5 | 66.4 | 178.1 | -61.9 | -78.7 | 0 | 0 | 0 | 117.1 | F219 | Y217-F219 VanDerWaalsContact C-N 3.26Å; Y217-F219 PolarHBondContact O-N 3.45Å | ||
| 218 | S | 41.7 | Very low | 43.3 | Very low | 106 Ų | 106 | 145 Ų | 145 | 74% | 0.741 | 76% | 0.762 | S | S | * | * | trans | -73.5 | 88.7 | 152.2 | -173.8 | 0 | 0 | 0 | 0 | 108.5 | H220 | S218-H220 PolarHBondContact O-N 2.61Š| ||
| 219 | F | 39.8 | Very low | 44.2 | Very low | 176 Ų | 176 | 146 Ų | 146 | 77% | 0.772 | 76% | 0.757 | S | S | * | * | trans | -64.1 | 77.4 | 155.6 | -168.6 | -97.3 | 0 | 0 | 0 | 106.5 | Y217 E221 | Y217-F219 VanDerWaalsContact C-N 3.26Å; Y217-F219 PolarHBondContact O-N 3.45Å; F219-E221 HydrophobicContact CD1-CB 3.92Å; F219-E221 HydrophobicContact CE1-CB 3.81Å; F219-E221 HydrophobicContact CE1-CG 3.95Å; F219-E221 PolarHBondContact O-N 3.16Å | ||
| 220 | H | 45.8 | Very low | 44.9 | Very low | 146 Ų | 146 | 143.1 Ų | 143.1 | 68% | 0.676 | 75% | 0.745 | S | S | * | * | trans | -72.4 | 83 | 165.7 | -145.7 | -72.8 | 0 | 0 | 0 | 104.4 | S218 S222 | S218-H220 PolarHBondContact O-N 2.61Å; H220-S222 VanDerWaalsContact C-N 3.3Å; H220-S222 PolarHBondContact O-N 3.11Å | ||
| 221 | E | 44.5 | Very low | 44.9 | Very low | 126 Ų | 126 | 144.8 Ų | 144.8 | 59% | 0.589 | 76% | 0.76 | S | S | * | * | trans | -46.5 | 104.5 | 165.1 | -166.2 | -176.4 | -178.7 | 0 | 0 | 105.5 | F219 D223 | F219-E221 HydrophobicContact CD1-CB 3.92Å; F219-E221 HydrophobicContact CE1-CB 3.81Å; F219-E221 HydrophobicContact CE1-CG 3.95Å; F219-E221 PolarHBondContact O-N 3.16Å; E221-D223 VanDerWaalsContact C-N 3.27Å; E221-D223 PolarHBondContact O-N 3.31Å | ||
| 222 | S | 47.1 | Very low | 45.8 | Very low | 94 Ų | 94 | 135.6 Ų | 135.6 | 66% | 0.657 | 74% | 0.743 | S | S | * | * | trans | -62 | 93.1 | 178 | 37.3 | 0 | 0 | 0 | 0 | 107.9 | H220 L224 | H220-S222 VanDerWaalsContact C-N 3.3Å; H220-S222 PolarHBondContact O-N 3.11Å; S222-L224 PolarHBondContact O-N 2.68Å | ||
| 223 | D | 44.8 | Very low | 47.2 | Very low | 137 Ų | 137 | 138.2 Ų | 138.2 | 73% | 0.733 | 75% | 0.75 | S | S | * | * | 44.6 | 42.4 | 102.2 | -127 | 9.5 | 0 | 0 | 0 | 114.7 | E221 | E221-D223 VanDerWaalsContact C-N 3.27Å; E221-D223 PolarHBondContact O-N 3.31Å | |||
| 224 | L | 45.2 | Very low | 48.6 | Very low | 147 Ų | 147 | 137 Ų | 137 | 77% | 0.77 | 73% | 0.734 | S | S | * | * | trans | -109 | 78.5 | 160.2 | -67.9 | -179.6 | 0 | 0 | 0 | 108.2 | S222 L226 | S222-L224 PolarHBondContact O-N 2.68Å; L224-L226 PolarHBondContact O-N 3Å; L224-L226 VanDerWaalsContact O-N 3.11Å | ||
| 225 | D | 45 | Very low | 51 | Low | 144 Ų | 144 | 130.2 Ų | 130.2 | 77% | 0.77 | 71% | 0.708 | S | S | * | * | trans | 37.3 | 65.6 | 150.2 | -61.8 | -43.4 | 0 | 0 | 0 | 114.7 | P227 | D225-P227 VanDerWaalsContact O-CD 3.32Å; D225-P227 WeakPolarHBondContact O-CD 3.32Å | ||
| 226 | L | 50 | Low | 52.9 | Low | 124 Ų | 124 | 125.5 Ų | 125.5 | 65% | 0.649 | 70% | 0.696 | S | S | * | * | trans | -69.5 | 112.9 | 144.7 | -89.2 | 121.9 | 0 | 0 | 0 | 104.7 | L224 E228 | L224-L226 PolarHBondContact O-N 3Å; L224-L226 VanDerWaalsContact O-N 3.11Å; L226-E228 PolarHBondContact O-N 3.04Å | ||
| 227 | P | 47.3 | Very low | 54.9 | Low | 106 Ų | 106 | 125.8 Ų | 125.8 | 69% | 0.688 | 70% | 0.696 | S | S | * | * | trans | -58.4 | 116.9 | 171.4 | 26.3 | -30.8 | 0 | 0 | 0 | 105.4 | D225 M229 | D225-P227 VanDerWaalsContact O-CD 3.32Å; D225-P227 WeakPolarHBondContact O-CD 3.32Å; P227-M229 PolarHBondContact O-N 3.39Å | ||
| 228 | E | 51.6 | Low | 57.5 | Low | 193 Ų | 193 | 120 Ų | 120 | 90% | 0.902 | 68% | 0.676 | S | S | * | * | trans | -11 | 78.5 | 147.1 | -169.5 | 178.6 | -179.5 | 0 | 0 | 112.6 | L226 | L226-E228 PolarHBondContact O-N 3.04Š| ||
| 229 | M | 55.4 | Low | 59.9 | Low | 131 Ų | 131 | 118.9 Ų | 118.9 | 65% | 0.645 | 66% | 0.661 | S | S | * | * | trans | -111.5 | 76.4 | 172.1 | -147.4 | 73.4 | 132.7 | 0 | 0 | 105.2 | P227 M234 | P227-M229 PolarHBondContact O-N 3.39Å; M229-M234 HydrophobicContact CB-CE 4.43Å | ||
| 230 | G | 49.1 | Very low | 62.4 | Low | 56 Ų | 56 | 114.9 Ų | 114.9 | 58% | 0.577 | 65% | 0.648 | S | S | * | * | trans | -55.4 | 142.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | G232 | G230-G232 VanDerWaalsContact C-N 3.28Å; G230-G232 PolarHBondContact O-N 2.9Å | ||
| 231 | S | 54.8 | Low | 64.6 | Low | 143 Ų | 143 | 112.3 Ų | 112.3 | 100% | 1 | 64% | 0.642 | S | S | * | * | S | Bend | trans | 47.9 | 33.4 | 135.8 | -55.9 | 0 | 0 | 0 | 0 | 119 | ||
| 232 | G | 58.6 | Low | 66.9 | Low | 59 Ų | 59 | 110.1 Ų | 110.1 | 61% | 0.608 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -161 | 106.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | G230 M234 | G230-G232 VanDerWaalsContact C-N 3.28Å; G230-G232 PolarHBondContact O-N 2.9Å; G232-M234 PolarHBondContact O-N 3.36Å |
| 233 | S | 60.6 | Low | 69.1 | Low | 124 Ų | 124 | 109.6 Ų | 109.6 | 87% | 0.867 | 62% | 0.623 | S | S | * | * | trans | 10.2 | 97.7 | 168.2 | -170.5 | 0 | 0 | 0 | 0 | 115.9 | S235 | S233-S235 PolarHBondContact O-N 3.34Š| ||
| 234 | M | 73.2 | Confident | 71.3 | Confident | 84 Ų | 84 | 110 Ų | 110 | 41% | 0.414 | 62% | 0.618 | S | S | . | * | trans | -56.8 | 137.2 | 167.4 | -69.6 | -154.2 | 165.3 | 0 | 0 | 110.1 | M229 G232 E238 I239 | M229-M234 HydrophobicContact CB-CE 4.43Å; G232-M234 PolarHBondContact O-N 3.36Å; M234-E238 HydrophobicContact CB-CB 4.48Å; M234-I239 HydrophobicContact CB-CG1 4.23Å | ||
| 235 | S | 85.3 | Confident | 73.5 | Confident | 56 Ų | 56 | 108.9 Ų | 108.9 | 39% | 0.392 | 61% | 0.607 | S | S | . | * | trans | -69 | 150.7 | 175.4 | 71.8 | 0 | 0 | 0 | 0 | 110.1 | S233 R237 E238 I239 | S233-S235 PolarHBondContact O-N 3.34Å; S235-R237 PolarHBondContact O-N 2.76Å; S235-E238 WeakPolarHBondContact CB-OE2 3.36Å; S235-E238 PolarHBondContact N-OE2 2.92Å; S235-E238 PolarHBondContact O-N 3.11Å; S235-E238 PolarHBondContact OG-N 3.47Å; S235-E238 PolarHBondContact OG-OE2 3Å; S235-I239 PolarHBondContact O-N 3.35Å; S235-I239 VanDerWaalsContact O-N 3.15Å | ||
| 236 | S | 86.7 | Confident | 75.9 | Confident | 88 Ų | 88 | 106.3 Ų | 106.3 | 62% | 0.615 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -49.8 | -34.4 | 176 | -172 | 0 | 0 | 0 | 0 | 112.7 | I239 D240 | S236-I239 WeakPolarHBondContact O-CB 3.04Å; S236-I239 PolarHBondContact O-N 2.76Å; S236-D240 VanDerWaalsContact O-CG 3.26Å; S236-D240 PolarHBondContact O-N 3.46Å |
| 237 | R | 89.3 | Confident | 77.7 | Confident | 201 Ų | 201 | 105.4 Ų | 105.4 | 76% | 0.758 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -69.1 | -37.9 | 179.3 | -176.1 | 175 | -179.4 | 159.3 | 0.1 | 112.9 | S235 I239 D240 V241 | S235-R237 PolarHBondContact O-N 2.76Å; R237-I239 VanDerWaalsContact C-N 3.31Å; R237-D240 PolarHBondContact O-N 3.24Å; R237-V241 VanDerWaalsContact O-CG2 3.31Å; R237-V241 WeakPolarHBondContact O-CG2 3.46Å; R237-V241 PolarHBondContact O-N 3.49Å |
| 238 | E | 91.3 | Very high | 79.5 | Confident | 80 Ų | 80 | 103.5 Ų | 103.5 | 37% | 0.374 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -68 | -37 | 175.2 | -73.3 | 157.4 | 151.6 | 0 | 0 | 110.6 | M234 S235 V241 L242 | M234-E238 HydrophobicContact CB-CB 4.48Å; S235-E238 WeakPolarHBondContact CB-OE2 3.36Å; S235-E238 PolarHBondContact N-OE2 2.92Å; S235-E238 PolarHBondContact O-N 3.11Å; S235-E238 PolarHBondContact OG-N 3.47Å; S235-E238 PolarHBondContact OG-OE2 3Å; E238-V241 PolarHBondContact O-N 2.94Å; E238-L242 WeakPolarHBondContact O-CB 3.46Å; E238-L242 PolarHBondContact O-N 3.39Å |
| 239 | I | 92.8 | Very high | 81.4 | Confident | 81 Ų | 81 | 98.6 Ų | 98.6 | 42% | 0.415 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -61.3 | -47.1 | 172.8 | -60.4 | 169.7 | 0 | 0 | 0 | 110.3 | M234 S235 S236 R237 V241 L242 I243 | M234-I239 HydrophobicContact CB-CG1 4.23Å; S235-I239 PolarHBondContact O-N 3.35Å; S235-I239 VanDerWaalsContact O-N 3.15Å; S236-I239 WeakPolarHBondContact O-CB 3.04Å; S236-I239 PolarHBondContact O-N 2.76Å; R237-I239 VanDerWaalsContact C-N 3.31Å; I239-V241 VanDerWaalsContact C-N 3.34Å; I239-V241 PolarHBondContact O-N 3.42Å; I239-L242 WeakPolarHBondContact O-CB 3.29Å; I239-L242 PolarHBondContact O-N 2.56Å; I239-L242 VanDerWaalsContact O-N 3.14Å; I239-I243 HydrophobicContact CG2-CD1 3.78Å; I239-I243 HydrophobicContact CG2-CG1 4.37Å; I239-I243 VanDerWaalsContact O-CG1 3.27Å; I239-I243 WeakPolarHBondContact O-CG1 3.42Å; I239-I243 PolarHBondContact O-N 3.18Å |
| 240 | D | 92.3 | Very high | 82.9 | Confident | 93 Ų | 93 | 98 Ų | 98 | 50% | 0.497 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.1 | -39.1 | 178 | -68.4 | -32.9 | 0 | 0 | 0 | 112.7 | S236 R237 L242 I243 F244 | S236-D240 VanDerWaalsContact O-CG 3.26Å; S236-D240 PolarHBondContact O-N 3.46Å; R237-D240 PolarHBondContact O-N 3.24Å; D240-L242 VanDerWaalsContact C-N 3.34Å; D240-I243 PolarHBondContact O-N 3.19Å; D240-F244 WeakPolarHBondContact O-CB 3.3Å; D240-F244 PolarHBondContact O-N 2.75Å |
| 241 | V | 92.8 | Very high | 84.5 | Confident | 91 Ų | 91 | 101.4 Ų | 101.4 | 55% | 0.552 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -65.4 | -40.4 | 174.7 | 171.2 | 0 | 0 | 0 | 0 | 110.8 | R237 E238 I239 F244 K245 | R237-V241 VanDerWaalsContact O-CG2 3.31Å; R237-V241 WeakPolarHBondContact O-CG2 3.46Å; R237-V241 PolarHBondContact O-N 3.49Å; E238-V241 PolarHBondContact O-N 2.94Å; I239-V241 VanDerWaalsContact C-N 3.34Å; I239-V241 PolarHBondContact O-N 3.42Å; V241-F244 PolarHBondContact O-N 3Å; V241-K245 VanDerWaalsContact O-CB 3.31Å; V241-K245 WeakPolarHBondContact O-CB 3.24Å; V241-K245 PolarHBondContact O-N 2.85Å |
| 242 | L | 92.9 | Very high | 86 | Confident | 81 Ų | 81 | 97 Ų | 97 | 42% | 0.424 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.5 | -43.9 | 176.2 | -135.2 | 85.3 | 0 | 0 | 0 | 111.4 | E238 I239 D240 K245 K246 | E238-L242 WeakPolarHBondContact O-CB 3.46Å; E238-L242 PolarHBondContact O-N 3.39Å; I239-L242 WeakPolarHBondContact O-CB 3.29Å; I239-L242 PolarHBondContact O-N 2.56Å; I239-L242 VanDerWaalsContact O-N 3.14Å; D240-L242 VanDerWaalsContact C-N 3.34Å; L242-K245 PolarHBondContact O-N 3.07Å; L242-K246 WeakPolarHBondContact O-CB 3.38Å; L242-K246 WeakPolarHBondContact O-CG 3.34Å; L242-K246 PolarHBondContact O-N 2.87Å |
| 243 | I | 92.1 | Very high | 87.3 | Confident | 83 Ų | 83 | 98.2 Ų | 98.2 | 43% | 0.426 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.5 | -48.7 | 176 | -69.7 | 166.3 | 0 | 0 | 0 | 109.6 | I239 D240 K245 K246 L247 | I239-I243 HydrophobicContact CG2-CD1 3.78Å; I239-I243 HydrophobicContact CG2-CG1 4.37Å; I239-I243 VanDerWaalsContact O-CG1 3.27Å; I239-I243 WeakPolarHBondContact O-CG1 3.42Å; I239-I243 PolarHBondContact O-N 3.18Å; D240-I243 PolarHBondContact O-N 3.19Å; I243-K245 VanDerWaalsContact C-N 3.34Å; I243-K245 PolarHBondContact O-N 3.34Å; I243-K246 PolarHBondContact O-N 2.77Å; I243-L247 HydrophobicContact CG2-CD1 3.75Å; I243-L247 HydrophobicContact CG2-CG 4.21Å; I243-L247 WeakPolarHBondContact O-CB 3.34Å; I243-L247 VanDerWaalsContact O-CG 3.27Å; I243-L247 WeakPolarHBondContact O-CG 3.44Å; I243-L247 PolarHBondContact O-N 3.1Å |
| 244 | F | 91.6 | Very high | 88.5 | Confident | 145 Ų | 145 | 97.4 Ų | 97.4 | 64% | 0.636 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -61.1 | -43.2 | 177.5 | -179.6 | -97.5 | 0 | 0 | 0 | 111.9 | D240 V241 L247 T248 | D240-F244 WeakPolarHBondContact O-CB 3.3Å; D240-F244 PolarHBondContact O-N 2.75Å; V241-F244 PolarHBondContact O-N 3Å; F244-L247 PolarHBondContact O-N 3.4Å; F244-T248 VanDerWaalsContact O-CB 3.26Å; F244-T248 WeakPolarHBondContact O-CB 3.39Å; F244-T248 PolarHBondContact O-N 2.93Å; F244-T248 PolarHBondContact O-OG1 2.86Å |
| 245 | K | 92 | Very high | 89.1 | Confident | 124 Ų | 124 | 98 Ų | 98 | 54% | 0.539 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.9 | -47.1 | 176 | -178.6 | -178.9 | 168.6 | 179.2 | 0 | 110.7 | V241 L242 I243 T248 E249 | V241-K245 VanDerWaalsContact O-CB 3.31Å; V241-K245 WeakPolarHBondContact O-CB 3.24Å; V241-K245 PolarHBondContact O-N 2.85Å; L242-K245 PolarHBondContact O-N 3.07Å; I243-K245 VanDerWaalsContact C-N 3.34Å; I243-K245 PolarHBondContact O-N 3.34Å; K245-T248 PolarHBondContact O-N 3.5Å; K245-E249 VanDerWaalsContact O-CB 3.26Å; K245-E249 WeakPolarHBondContact O-CB 3.24Å; K245-E249 PolarHBondContact O-N 2.73Å |
| 246 | K | 93.5 | Very high | 88.9 | Confident | 90 Ų | 90 | 100.7 Ų | 100.7 | 39% | 0.391 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -68.1 | -39.8 | 180 | -74.1 | -73 | 168.3 | -159.7 | 0 | 112.8 | L242 I243 E249 L250 | L242-K246 WeakPolarHBondContact O-CB 3.38Å; L242-K246 WeakPolarHBondContact O-CG 3.34Å; L242-K246 PolarHBondContact O-N 2.87Å; I243-K246 PolarHBondContact O-N 2.77Å; K246-E249 WeakPolarHBondContact CD-OE2 3.42Å; K246-E249 IonicContact NZ-OE2 2.91Å; K246-E249 PolarHBondContact NZ-OE2 2.92Å; K246-E249 PolarHBondContact O-N 2.87Å; K246-L250 WeakPolarHBondContact O-CB 3.49Å; K246-L250 VanDerWaalsContact O-CG 3.29Å; K246-L250 WeakPolarHBondContact O-CG 3.39Å; K246-L250 PolarHBondContact O-N 3.17Å |
| 247 | L | 88.4 | Confident | 88.7 | Confident | 105 Ų | 105 | 101.2 Ų | 101.2 | 55% | 0.55 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.2 | -40.8 | 173.7 | -71.5 | 175.4 | 0 | 0 | 0 | 111.5 | I243 F244 F251 | I243-L247 HydrophobicContact CG2-CD1 3.75Å; I243-L247 HydrophobicContact CG2-CG 4.21Å; I243-L247 WeakPolarHBondContact O-CB 3.34Å; I243-L247 VanDerWaalsContact O-CG 3.27Å; I243-L247 WeakPolarHBondContact O-CG 3.44Å; I243-L247 PolarHBondContact O-N 3.1Å; F244-L247 PolarHBondContact O-N 3.4Å; L247-F251 WeakPolarHBondContact O-CB 3.46Å; L247-F251 PolarHBondContact O-N 3.04Å |
| 248 | T | 86.3 | Confident | 88.5 | Confident | 66 Ų | 66 | 95.5 Ų | 95.5 | 41% | 0.405 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65.5 | -43 | 176.1 | -57.5 | 0 | 0 | 0 | 0 | 111 | F244 K245 F251 S252 | F244-T248 VanDerWaalsContact O-CB 3.26Å; F244-T248 WeakPolarHBondContact O-CB 3.39Å; F244-T248 PolarHBondContact O-N 2.93Å; F244-T248 PolarHBondContact O-OG1 2.86Å; K245-T248 PolarHBondContact O-N 3.5Å; T248-F251 PolarHBondContact O-N 3.43Å; T248-S252 WeakPolarHBondContact O-CB 3.28Å; T248-S252 PolarHBondContact O-N 3.33Å; T248-S252 PolarHBondContact O-OG 2.96Å |
| 249 | E | 90.9 | Very high | 87.8 | Confident | 89 Ų | 89 | 97.1 Ų | 97.1 | 42% | 0.416 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.1 | -53 | 174.8 | -175.7 | 178 | -167.4 | 0 | 0 | 110.7 | K245 K246 F251 S252 V253 | K245-E249 VanDerWaalsContact O-CB 3.26Å; K245-E249 WeakPolarHBondContact O-CB 3.24Å; K245-E249 PolarHBondContact O-N 2.73Å; K246-E249 WeakPolarHBondContact CD-OE2 3.42Å; K246-E249 IonicContact NZ-OE2 2.91Å; K246-E249 PolarHBondContact NZ-OE2 2.92Å; K246-E249 PolarHBondContact O-N 2.87Å; E249-F251 VanDerWaalsContact C-N 3.34Å; E249-F251 PolarHBondContact O-N 2.96Å; E249-S252 PolarHBondContact O-N 3.39Å; E249-S252 VanDerWaalsContact O-N 3.14Å; E249-S252 PolarHBondContact O-OG 3.06Å; E249-V253 WeakPolarHBondContact O-CG2 3.33Å; E249-V253 PolarHBondContact O-N 2.86Å |
| 250 | L | 85.8 | Confident | 87.2 | Confident | 118 Ų | 118 | 95.2 Ų | 95.2 | 62% | 0.618 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -58.6 | -42.9 | 177 | -76.6 | 172 | 0 | 0 | 0 | 112.6 | K246 S252 V253 H254 | K246-L250 WeakPolarHBondContact O-CB 3.49Å; K246-L250 VanDerWaalsContact O-CG 3.29Å; K246-L250 WeakPolarHBondContact O-CG 3.39Å; K246-L250 PolarHBondContact O-N 3.17Å; L250-S252 VanDerWaalsContact C-N 3.33Å; L250-V253 PolarHBondContact O-N 3.48Å; L250-H254 WeakPolarHBondContact O-CB 3.5Å; L250-H254 PolarHBondContact O-N 3.13Å |
| 251 | F | 84.5 | Confident | 86.6 | Confident | 128 Ų | 128 | 97.2 Ų | 97.2 | 56% | 0.561 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -65.8 | -38 | 177.8 | -176.3 | -110.9 | 0 | 0 | 0 | 111.8 | L247 T248 E249 H254 Q255 | L247-F251 WeakPolarHBondContact O-CB 3.46Å; L247-F251 PolarHBondContact O-N 3.04Å; T248-F251 PolarHBondContact O-N 3.43Å; E249-F251 VanDerWaalsContact C-N 3.34Å; E249-F251 PolarHBondContact O-N 2.96Å; F251-H254 PolarHBondContact O-N 3.3Å; F251-Q255 HydrophobicContact CE1-CG 4.43Å; F251-Q255 HydrophobicContact CZ-CG 4.48Å; F251-Q255 WeakPolarHBondContact O-CG 3.1Å; F251-Q255 PolarHBondContact O-N 3.21Å |
| 252 | S | 86.4 | Confident | 85.2 | Confident | 52 Ų | 52 | 97.6 Ų | 97.6 | 36% | 0.364 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66.1 | -40.9 | 175.1 | 73.7 | 0 | 0 | 0 | 0 | 112.3 | T248 E249 L250 Q255 I256 | T248-S252 WeakPolarHBondContact O-CB 3.28Å; T248-S252 PolarHBondContact O-N 3.33Å; T248-S252 PolarHBondContact O-OG 2.96Å; E249-S252 PolarHBondContact O-N 3.39Å; E249-S252 VanDerWaalsContact O-N 3.14Å; E249-S252 PolarHBondContact O-OG 3.06Å; L250-S252 VanDerWaalsContact C-N 3.33Å; S252-Q255 PolarHBondContact O-N 3.44Å; S252-I256 VanDerWaalsContact O-CG1 3.3Å; S252-I256 WeakPolarHBondContact O-CG1 3.43Å; S252-I256 PolarHBondContact O-N 2.92Å |
| 253 | V | 85.1 | Confident | 84.1 | Confident | 83 Ų | 83 | 98.9 Ų | 98.9 | 50% | 0.503 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.4 | -42.3 | 174.8 | 173.3 | 0 | 0 | 0 | 0 | 110.7 | E249 L250 Q255 I256 D257 | E249-V253 WeakPolarHBondContact O-CG2 3.33Å; E249-V253 PolarHBondContact O-N 2.86Å; L250-V253 PolarHBondContact O-N 3.48Å; V253-Q255 VanDerWaalsContact C-N 3.32Å; V253-Q255 PolarHBondContact O-N 3.04Å; V253-I256 WeakPolarHBondContact O-CB 3.48Å; V253-I256 PolarHBondContact O-N 3.31Å; V253-I256 VanDerWaalsContact O-N 3.14Å; V253-D257 PolarHBondContact O-N 3.47Å |
| 254 | H | 86.1 | Confident | 83 | Confident | 107 Ų | 107 | 98.4 Ų | 98.4 | 50% | 0.495 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.8 | -39.9 | 175.3 | 179.5 | -78.8 | 0 | 0 | 0 | 112.2 | L250 F251 I256 D257 E258 | L250-H254 WeakPolarHBondContact O-CB 3.5Å; L250-H254 PolarHBondContact O-N 3.13Å; F251-H254 PolarHBondContact O-N 3.3Å; H254-I256 VanDerWaalsContact C-N 3.34Å; H254-D257 PolarHBondContact O-N 2.96Å; H254-E258 PolarHBondContact O-N 3.17Å |
| 255 | Q | 85.5 | Confident | 82.4 | Confident | 98 Ų | 98 | 95.4 Ų | 95.4 | 46% | 0.458 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.8 | -39.1 | 174.1 | -73.3 | -174.5 | 3.9 | 0 | 0 | 112.3 | F251 S252 V253 D257 L259 | F251-Q255 HydrophobicContact CE1-CG 4.43Å; F251-Q255 HydrophobicContact CZ-CG 4.48Å; F251-Q255 WeakPolarHBondContact O-CG 3.1Å; F251-Q255 PolarHBondContact O-N 3.21Å; S252-Q255 PolarHBondContact O-N 3.44Å; V253-Q255 VanDerWaalsContact C-N 3.32Å; V253-Q255 PolarHBondContact O-N 3.04Å; Q255-D257 VanDerWaalsContact C-N 3.33Å; Q255-L259 WeakPolarHBondContact O-CB 3.35Å; Q255-L259 VanDerWaalsContact O-CG 3.24Å; Q255-L259 WeakPolarHBondContact O-CG 3.4Å; Q255-L259 PolarHBondContact O-N 2.88Å |
| 256 | I | 80.4 | Confident | 81.9 | Confident | 111 Ų | 111 | 94.6 Ų | 94.6 | 57% | 0.569 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.9 | -42.1 | 175.3 | -66.3 | 163.6 | 0 | 0 | 0 | 110.2 | S252 V253 H254 L259 A260 | S252-I256 VanDerWaalsContact O-CG1 3.3Å; S252-I256 WeakPolarHBondContact O-CG1 3.43Å; S252-I256 PolarHBondContact O-N 2.92Å; V253-I256 WeakPolarHBondContact O-CB 3.48Å; V253-I256 PolarHBondContact O-N 3.31Å; V253-I256 VanDerWaalsContact O-N 3.14Å; H254-I256 VanDerWaalsContact C-N 3.34Å; I256-L259 PolarHBondContact O-N 3.17Å; I256-A260 VanDerWaalsContact O-CB 3.29Å; I256-A260 WeakPolarHBondContact O-CB 3.26Å; I256-A260 PolarHBondContact O-N 3.31Å |
| 257 | D | 83.3 | Confident | 81.4 | Confident | 100 Ų | 100 | 93.4 Ų | 93.4 | 54% | 0.535 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -67.4 | -42.6 | 179.4 | -165.8 | 52.9 | 0 | 0 | 0 | 112 | V253 H254 Q255 L259 A260 K261 | V253-D257 PolarHBondContact O-N 3.47Å; H254-D257 PolarHBondContact O-N 2.96Å; Q255-D257 VanDerWaalsContact C-N 3.33Å; D257-L259 PolarHBondContact O-N 3.49Å; D257-A260 CarbonylContact O-C 3.55Å; D257-A260 WeakPolarHBondContact O-CB 3.47Å; D257-A260 PolarHBondContact O-N 3.2Å; D257-K261 WeakPolarHBondContact O-CB 3.38Å; D257-K261 PolarHBondContact O-N 3.29Å |
| 258 | E | 84.3 | Confident | 81.3 | Confident | 80 Ų | 80 | 95 Ų | 95 | 37% | 0.374 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.6 | -37.5 | 174.1 | -75.3 | -70.6 | 107.7 | 0 | 0 | 111.9 | H254 K261 C262 | H254-E258 PolarHBondContact O-N 3.17Å; E258-K261 PolarHBondContact O-N 3.28Å; E258-C262 WeakPolarHBondContact O-CB 3.33Å; E258-C262 PolarHBondContact O-N 3.04Å; E258-C262 PolarHBondContact O-SG 3.3Å |
| 259 | L | 76.6 | Confident | 81.3 | Confident | 115 Ų | 115 | 97.4 Ų | 97.4 | 60% | 0.602 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -64.6 | -41.8 | 171 | -76.3 | 170.9 | 0 | 0 | 0 | 111.7 | Q255 I256 D257 K261 C262 T263 | Q255-L259 WeakPolarHBondContact O-CB 3.35Å; Q255-L259 VanDerWaalsContact O-CG 3.24Å; Q255-L259 WeakPolarHBondContact O-CG 3.4Å; Q255-L259 PolarHBondContact O-N 2.88Å; I256-L259 PolarHBondContact O-N 3.17Å; D257-L259 PolarHBondContact O-N 3.49Å; L259-K261 VanDerWaalsContact C-N 3.31Å; L259-K261 PolarHBondContact O-N 3.34Å; L259-C262 PolarHBondContact O-N 3.21Å; L259-T263 WeakPolarHBondContact O-CB 3.42Å; L259-T263 WeakPolarHBondContact O-CG2 3.39Å; L259-T263 PolarHBondContact O-N 2.99Å; L259-T263 PolarHBondContact O-OG1 3.26Å |
| 260 | A | 80.4 | Confident | 81.4 | Confident | 41 Ų | 41 | 97.9 Ų | 97.9 | 34% | 0.339 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.9 | -40 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | I256 D257 T263 S264 | I256-A260 VanDerWaalsContact O-CB 3.29Å; I256-A260 WeakPolarHBondContact O-CB 3.26Å; I256-A260 PolarHBondContact O-N 3.31Å; D257-A260 CarbonylContact O-C 3.55Å; D257-A260 WeakPolarHBondContact O-CB 3.47Å; D257-A260 PolarHBondContact O-N 3.2Å; A260-T263 WeakPolarHBondContact CA-OG1 3.21Å; A260-T263 CarbonylContact O-C 3.53Å; A260-T263 PolarHBondContact O-N 3.23Å; A260-T263 PolarHBondContact O-OG1 3.08Å; A260-T263 VanDerWaalsContact O-OG1 3.14Å; A260-S264 WeakPolarHBondContact O-CA 3.47Å; A260-S264 WeakPolarHBondContact O-CB 3.31Å; A260-S264 PolarHBondContact O-N 3.09Å; A260-S264 PolarHBondContact O-OG 2.86Å |
| 261 | K | 79.4 | Confident | 81.7 | Confident | 135 Ų | 135 | 98.2 Ų | 98.2 | 59% | 0.587 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66.4 | -41.1 | 175.5 | -164 | 174.6 | -178 | 179.6 | 0 | 112.5 | D257 E258 L259 T263 S264 | D257-K261 WeakPolarHBondContact O-CB 3.38Å; D257-K261 PolarHBondContact O-N 3.29Å; E258-K261 PolarHBondContact O-N 3.28Å; L259-K261 VanDerWaalsContact C-N 3.31Å; L259-K261 PolarHBondContact O-N 3.34Å; K261-T263 VanDerWaalsContact C-N 3.25Å; K261-T263 PolarHBondContact O-N 3.48Å; K261-S264 WeakPolarHBondContact CA-OG 3.24Å; K261-S264 PolarHBondContact O-OG 3.48Å |
| 262 | C | 63.7 | Low | 82.1 | Confident | 99 Ų | 99 | 94.7 Ų | 94.7 | 67% | 0.669 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -67.8 | -23.6 | 173.9 | -65.4 | 0 | 0 | 0 | 0 | 113.2 | E258 L259 | E258-C262 WeakPolarHBondContact O-CB 3.33Å; E258-C262 PolarHBondContact O-N 3.04Å; E258-C262 PolarHBondContact O-SG 3.3Å; L259-C262 PolarHBondContact O-N 3.21Å |
| 263 | T | 69.8 | Low | 82.5 | Confident | 108 Ų | 108 | 95.1 Ų | 95.1 | 66% | 0.663 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -101.7 | -15.9 | 179.3 | 53.1 | 0 | 0 | 0 | 0 | 113.8 | L259 A260 K261 | L259-T263 WeakPolarHBondContact O-CB 3.42Å; L259-T263 WeakPolarHBondContact O-CG2 3.39Å; L259-T263 PolarHBondContact O-N 2.99Å; L259-T263 PolarHBondContact O-OG1 3.26Å; A260-T263 WeakPolarHBondContact CA-OG1 3.21Å; A260-T263 CarbonylContact O-C 3.53Å; A260-T263 PolarHBondContact O-N 3.23Å; A260-T263 PolarHBondContact O-OG1 3.08Å; A260-T263 VanDerWaalsContact O-OG1 3.14Å; K261-T263 VanDerWaalsContact C-N 3.25Å; K261-T263 PolarHBondContact O-N 3.48Å |
| 264 | S | 69.1 | Low | 83 | Confident | 73 Ų | 73 | 96.8 Ų | 96.8 | 51% | 0.51 | 51% | 0.513 | S | S | . | . | trans | -96.1 | 12.9 | 177.9 | 63.5 | 0 | 0 | 0 | 0 | 113 | A260 K261 T266 | A260-S264 WeakPolarHBondContact O-CA 3.47Å; A260-S264 WeakPolarHBondContact O-CB 3.31Å; A260-S264 PolarHBondContact O-N 3.09Å; A260-S264 PolarHBondContact O-OG 2.86Å; K261-S264 WeakPolarHBondContact CA-OG 3.24Å; K261-S264 PolarHBondContact O-OG 3.48Å; S264-T266 WeakPolarHBondContact O-CG2 3.43Å; S264-T266 PolarHBondContact O-N 3.33Å | ||
| 265 | D | 79.1 | Confident | 83.4 | Confident | 82 Ų | 82 | 95.9 Ų | 95.9 | 44% | 0.439 | 51% | 0.511 | S | S | . | . | trans | -60.8 | 90.7 | 167.9 | -174.2 | -3.9 | 0 | 0 | 0 | 108.7 | V267 F268 L269 | D265-V267 PolarHBondContact O-N 2.85Å; D265-V267 VanDerWaalsContact O-N 3.16Å; D265-V267 WeakPolarHBondContact OD1-CB 3.31Å; D265-V267 PolarHBondContact OD1-N 3.44Å; D265-V267 VanDerWaalsContact OD1-N 3.11Å; D265-F268 HydrophobicContact CB-CB 3.95Å; D265-F268 WeakPolarHBondContact O-CB 3.49Å; D265-F268 PolarHBondContact O-N 3.29Å; D265-F268 PolarHBondContact OD1-N 3.21Å; D265-L269 PolarHBondContact O-N 3.5Å | ||
| 266 | T | 80.9 | Confident | 84 | Confident | 107 Ų | 107 | 93.9 Ų | 93.9 | 66% | 0.656 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -57.5 | -29.5 | -178 | 52.9 | 0 | 0 | 0 | 0 | 110.9 | S264 E270 | S264-T266 WeakPolarHBondContact O-CG2 3.43Å; S264-T266 PolarHBondContact O-N 3.33Å; T266-E270 WeakPolarHBondContact O-CB 3.29Å; T266-E270 PolarHBondContact O-N 3.49Å |
| 267 | V | 84.4 | Confident | 84.8 | Confident | 64 Ų | 64 | 93.3 Ų | 93.3 | 39% | 0.388 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -74.1 | -41.2 | 178.1 | -178.4 | 0 | 0 | 0 | 0 | 110.7 | D265 K271 | D265-V267 PolarHBondContact O-N 2.85Å; D265-V267 VanDerWaalsContact O-N 3.16Å; D265-V267 WeakPolarHBondContact OD1-CB 3.31Å; D265-V267 PolarHBondContact OD1-N 3.44Å; D265-V267 VanDerWaalsContact OD1-N 3.11Å; V267-K271 HydrophobicContact CG1-CD 3.95Å; V267-K271 HydrophobicContact CG1-CG 4.42Å; V267-K271 VanDerWaalsContact O-CB 3.26Å; V267-K271 WeakPolarHBondContact O-CB 3.45Å; V267-K271 WeakPolarHBondContact O-CG 3.48Å; V267-K271 PolarHBondContact O-N 2.93Å |
| 268 | F | 86.1 | Confident | 85.5 | Confident | 138 Ų | 138 | 92.3 Ų | 92.3 | 61% | 0.605 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.1 | -46 | 174.2 | 178.8 | -97.8 | 0 | 0 | 0 | 111 | D265 K271 T272 | D265-F268 HydrophobicContact CB-CB 3.95Å; D265-F268 WeakPolarHBondContact O-CB 3.49Å; D265-F268 PolarHBondContact O-N 3.29Å; D265-F268 PolarHBondContact OD1-N 3.21Å; F268-K271 PolarHBondContact O-N 3.49Å; F268-T272 VanDerWaalsContact O-CB 3.31Å; F268-T272 WeakPolarHBondContact O-CB 3.3Å; F268-T272 PolarHBondContact O-N 2.93Å; F268-T272 PolarHBondContact O-OG1 3.41Å |
| 269 | L | 86.2 | Confident | 86.1 | Confident | 118 Ų | 118 | 89.4 Ų | 89.4 | 62% | 0.618 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -65.1 | -45 | 179.4 | -157.7 | 79.8 | 0 | 0 | 0 | 111.5 | D265 K271 T272 S273 | D265-L269 PolarHBondContact O-N 3.5Å; L269-K271 PolarHBondContact O-N 2.87Å; L269-T272 PolarHBondContact O-N 3Å; L269-S273 WeakPolarHBondContact O-CB 3.47Å; L269-S273 PolarHBondContact O-N 2.95Å |
| 270 | E | 91.4 | Very high | 87.1 | Confident | 98 Ų | 98 | 86.5 Ų | 86.5 | 46% | 0.458 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61.2 | -45.4 | 176.5 | -176 | -170.4 | 176.5 | 0 | 0 | 111.4 | T266 S273 K274 | T266-E270 WeakPolarHBondContact O-CB 3.29Å; T266-E270 PolarHBondContact O-N 3.49Å; E270-S273 WeakPolarHBondContact O-CB 3.36Å; E270-S273 PolarHBondContact O-N 3.36Å; E270-K274 HydrophobicContact CG-CD 4.37Å; E270-K274 WeakPolarHBondContact O-CG 3.36Å; E270-K274 PolarHBondContact O-N 2.95Å; E270-K274 VanDerWaalsContact OE1-CE 3.24Å; E270-K274 WeakPolarHBondContact OE1-CE 3.46Å; E270-K274 IonicContact OE1-NZ 2.75Å; E270-K274 PolarHBondContact OE1-NZ 3.36Å |
| 271 | K | 93.3 | Very high | 87.9 | Confident | 126 Ų | 126 | 86.8 Ų | 86.8 | 55% | 0.548 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.6 | -41.4 | 177.6 | -75.6 | 175.2 | -179.4 | 170.9 | 0 | 111.8 | V267 F268 L269 S273 K274 I275 | V267-K271 HydrophobicContact CG1-CD 3.95Å; V267-K271 HydrophobicContact CG1-CG 4.42Å; V267-K271 VanDerWaalsContact O-CB 3.26Å; V267-K271 WeakPolarHBondContact O-CB 3.45Å; V267-K271 WeakPolarHBondContact O-CG 3.48Å; V267-K271 PolarHBondContact O-N 2.93Å; F268-K271 PolarHBondContact O-N 3.49Å; L269-K271 PolarHBondContact O-N 2.87Å; K271-S273 VanDerWaalsContact C-N 3.34Å; K271-K274 PolarHBondContact O-N 3.05Å; K271-I275 WeakPolarHBondContact O-CD1 3.09Å; K271-I275 VanDerWaalsContact O-CG1 3.24Å; K271-I275 WeakPolarHBondContact O-CG1 3.29Å; K271-I275 PolarHBondContact O-N 3.16Å |
| 272 | T | 92.2 | Very high | 88.7 | Confident | 54 Ų | 54 | 82 Ų | 82 | 33% | 0.331 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63.4 | -43.6 | 177 | -56 | 0 | 0 | 0 | 0 | 110.3 | F268 L269 K274 I275 S276 | F268-T272 VanDerWaalsContact O-CB 3.31Å; F268-T272 WeakPolarHBondContact O-CB 3.3Å; F268-T272 PolarHBondContact O-N 2.93Å; F268-T272 PolarHBondContact O-OG1 3.41Å; L269-T272 PolarHBondContact O-N 3Å; T272-K274 PolarHBondContact O-N 3.36Å; T272-I275 PolarHBondContact O-N 3.21Å; T272-S276 PolarHBondContact O-N 3.42Å; T272-S276 PolarHBondContact O-OG 3.02Å |
| 273 | S | 94.4 | Very high | 90.3 | Very high | 61 Ų | 61 | 79.2 Ų | 79.2 | 43% | 0.427 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -57.4 | -48.9 | 173.2 | -170.5 | 0 | 0 | 0 | 0 | 111.7 | L269 E270 K271 I275 S276 D277 | L269-S273 WeakPolarHBondContact O-CB 3.47Å; L269-S273 PolarHBondContact O-N 2.95Å; E270-S273 WeakPolarHBondContact O-CB 3.36Å; E270-S273 PolarHBondContact O-N 3.36Å; K271-S273 VanDerWaalsContact C-N 3.34Å; S273-I275 VanDerWaalsContact C-N 3.26Å; S273-I275 PolarHBondContact O-N 2.78Å; S273-S276 WeakPolarHBondContact O-CB 3.34Å; S273-S276 PolarHBondContact O-N 3.18Å; S273-S276 VanDerWaalsContact O-N 3.13Å; S273-D277 VanDerWaalsContact O-CG 3.27Å; S273-D277 PolarHBondContact O-N 3.35Å |
| 274 | K | 96.5 | Very high | 91.7 | Very high | 117 Ų | 117 | 80.6 Ų | 80.6 | 51% | 0.509 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -60.6 | -34.9 | 177.7 | -73.4 | 173.4 | -176.8 | 172.7 | 0 | 112.8 | E270 K271 T272 L278 | E270-K274 HydrophobicContact CG-CD 4.37Å; E270-K274 WeakPolarHBondContact O-CG 3.36Å; E270-K274 PolarHBondContact O-N 2.95Å; E270-K274 VanDerWaalsContact OE1-CE 3.24Å; E270-K274 WeakPolarHBondContact OE1-CE 3.46Å; E270-K274 IonicContact OE1-NZ 2.75Å; E270-K274 PolarHBondContact OE1-NZ 3.36Å; K271-K274 PolarHBondContact O-N 3.05Å; T272-K274 PolarHBondContact O-N 3.36Å; K274-L278 WeakPolarHBondContact O-CB 3.26Å; K274-L278 PolarHBondContact O-N 2.89Å |
| 275 | I | 95.4 | Very high | 93 | Very high | 88 Ų | 88 | 82.2 Ų | 82.2 | 45% | 0.451 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -69.1 | -44.6 | 175.6 | -69 | 163.6 | 0 | 0 | 0 | 110.1 | K271 T272 S273 D277 L278 I279 L297 | K271-I275 WeakPolarHBondContact O-CD1 3.09Å; K271-I275 VanDerWaalsContact O-CG1 3.24Å; K271-I275 WeakPolarHBondContact O-CG1 3.29Å; K271-I275 PolarHBondContact O-N 3.16Å; T272-I275 PolarHBondContact O-N 3.21Å; S273-I275 VanDerWaalsContact C-N 3.26Å; S273-I275 PolarHBondContact O-N 2.78Å; I275-D277 VanDerWaalsContact C-N 3.34Å; I275-D277 PolarHBondContact O-N 2.83Å; I275-L278 WeakPolarHBondContact O-CB 3.36Å; I275-L278 PolarHBondContact O-N 3.22Å; I275-I279 HydrophobicContact CG2-CD1 4.02Å; I275-I279 WeakPolarHBondContact O-CG1 3.45Å; I275-I279 PolarHBondContact O-N 2.9Å; I275-L297 HydrophobicContact CG2-CD2 4.15Å |
| 276 | S | 96.3 | Very high | 93.8 | Very high | 57 Ų | 57 | 86.1 Ų | 86.1 | 40% | 0.399 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -61 | -41.3 | 175.3 | -62.9 | 0 | 0 | 0 | 0 | 112.4 | T272 S273 L278 I279 S280 | T272-S276 PolarHBondContact O-N 3.42Å; T272-S276 PolarHBondContact O-OG 3.02Å; S273-S276 WeakPolarHBondContact O-CB 3.34Å; S273-S276 PolarHBondContact O-N 3.18Å; S273-S276 VanDerWaalsContact O-N 3.13Å; S276-L278 VanDerWaalsContact C-N 3.33Å; S276-L278 PolarHBondContact O-N 3.26Å; S276-I279 PolarHBondContact O-N 3.23Å; S276-S280 WeakPolarHBondContact O-CB 3.07Å; S276-S280 PolarHBondContact O-N 3.44Å; S276-S280 PolarHBondContact O-OG 2.91Å |
| 277 | D | 97.6 | Very high | 94.5 | Very high | 98 Ų | 98 | 89.4 Ų | 89.4 | 52% | 0.524 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -63.6 | -40.1 | 175.1 | -66.6 | -27.2 | 0 | 0 | 0 | 111.2 | S273 I275 S280 S281 | S273-D277 VanDerWaalsContact O-CG 3.27Å; S273-D277 PolarHBondContact O-N 3.35Å; I275-D277 VanDerWaalsContact C-N 3.34Å; I275-D277 PolarHBondContact O-N 2.83Å; D277-S280 PolarHBondContact O-N 3.15Å; D277-S281 WeakPolarHBondContact O-CB 3.31Å; D277-S281 PolarHBondContact O-N 3.46Å |
| 278 | L | 97.6 | Very high | 95 | Very high | 80 Ų | 80 | 88 Ų | 88 | 42% | 0.419 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -65 | -43.4 | 175.8 | 177 | 62.4 | 0 | 0 | 0 | 112.2 | K274 I275 S276 S280 S281 I282 L297 | K274-L278 WeakPolarHBondContact O-CB 3.26Å; K274-L278 PolarHBondContact O-N 2.89Å; I275-L278 WeakPolarHBondContact O-CB 3.36Å; I275-L278 PolarHBondContact O-N 3.22Å; S276-L278 VanDerWaalsContact C-N 3.33Å; S276-L278 PolarHBondContact O-N 3.26Å; L278-S280 VanDerWaalsContact C-N 3.3Å; L278-S280 PolarHBondContact O-N 3.11Å; L278-S281 PolarHBondContact O-N 3.41Å; L278-I282 HydrophobicContact CD1-CD1 4.06Å; L278-I282 HydrophobicContact CD1-CG1 4.3Å; L278-I282 HydrophobicContact CG-CD1 4.01Å; L278-I282 VanDerWaalsContact O-CG1 3.3Å; L278-I282 WeakPolarHBondContact O-CG1 3.45Å; L278-I282 PolarHBondContact O-N 2.86Å; L278-L297 HydrophobicContact CD2-CD1 3.69Å; L278-L297 HydrophobicContact CD2-CD2 4.1Å; L278-L297 HydrophobicContact CG-CD1 4.49Å; L278-L297 HydrophobicContact CG-CD2 4.5Å |
| 279 | I | 97.2 | Very high | 95.5 | Very high | 19 Ų | 19 | 87.3 Ų | 87.3 | 10% | 0.097 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -60.1 | -46 | 175.4 | -67.5 | 166.8 | 0 | 0 | 0 | 109.4 | I275 S276 S281 I282 T283 E290 A293 E294 L297 | I275-I279 HydrophobicContact CG2-CD1 4.02Å; I275-I279 WeakPolarHBondContact O-CG1 3.45Å; I275-I279 PolarHBondContact O-N 2.9Å; S276-I279 PolarHBondContact O-N 3.23Å; I279-S281 PolarHBondContact O-N 2.88Å; I279-I282 PolarHBondContact O-N 3.44Å; I279-T283 WeakPolarHBondContact O-CB 3.28Å; I279-T283 PolarHBondContact O-N 3.44Å; I279-T283 PolarHBondContact O-OG1 2.9Å; I279-E290 HydrophobicContact CG2-CG 4.05Å; I279-A293 HydrophobicContact CG2-CB 4.05Å; I279-E294 HydrophobicContact CD1-CB 4.28Å; I279-E294 HydrophobicContact CD1-CG 4.2Å; I279-L297 HydrophobicContact CD1-CD2 4.23Å; I279-L297 HydrophobicContact CG1-CD2 3.67Å |
| 280 | S | 97.6 | Very high | 95.9 | Very high | 53 Ų | 53 | 88.5 Ų | 88.5 | 37% | 0.371 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -60.4 | -43.2 | 177.5 | -58.3 | 0 | 0 | 0 | 0 | 112.2 | S276 D277 L278 T283 Q284 | S276-S280 WeakPolarHBondContact O-CB 3.07Å; S276-S280 PolarHBondContact O-N 3.44Å; S276-S280 PolarHBondContact O-OG 2.91Å; D277-S280 PolarHBondContact O-N 3.15Å; L278-S280 VanDerWaalsContact C-N 3.3Å; L278-S280 PolarHBondContact O-N 3.11Å; S280-T283 PolarHBondContact O-N 2.95Å; S280-Q284 WeakPolarHBondContact O-CB 3.4Å; S280-Q284 VanDerWaalsContact O-CG 3.29Å; S280-Q284 WeakPolarHBondContact O-CG 3.48Å; S280-Q284 PolarHBondContact O-N 3.38Å |
| 281 | S | 98.1 | Very high | 96.2 | Very high | 48 Ų | 48 | 90.1 Ų | 90.1 | 34% | 0.336 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -59.5 | -48.9 | 174.1 | -172.2 | 0 | 0 | 0 | 0 | 111 | D277 L278 I279 T283 Q284 D285 | D277-S281 WeakPolarHBondContact O-CB 3.31Å; D277-S281 PolarHBondContact O-N 3.46Å; L278-S281 PolarHBondContact O-N 3.41Å; I279-S281 PolarHBondContact O-N 2.88Å; S281-T283 VanDerWaalsContact C-N 3.34Å; S281-T283 PolarHBondContact O-N 2.86Å; S281-Q284 PolarHBondContact O-N 3.34Å; S281-Q284 VanDerWaalsContact O-N 3.16Å; S281-D285 VanDerWaalsContact O-CB 3.27Å; S281-D285 WeakPolarHBondContact O-CB 3.45Å; S281-D285 PolarHBondContact O-N 3.25Å; S281-D285 VanDerWaalsContact O-OD2 3.09Å; S281-D285 PolarHBondContact OG-OD2 3.18Å |
| 282 | I | 96.5 | Very high | 96.4 | Very high | 35 Ų | 35 | 87.9 Ų | 87.9 | 18% | 0.179 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -62.7 | -42.3 | 179.9 | -67.6 | 166 | 0 | 0 | 0 | 111.1 | L278 I279 Q284 Y286 L288 A293 | L278-I282 HydrophobicContact CD1-CD1 4.06Å; L278-I282 HydrophobicContact CD1-CG1 4.3Å; L278-I282 HydrophobicContact CG-CD1 4.01Å; L278-I282 VanDerWaalsContact O-CG1 3.3Å; L278-I282 WeakPolarHBondContact O-CG1 3.45Å; L278-I282 PolarHBondContact O-N 2.86Å; I279-I282 PolarHBondContact O-N 3.44Å; I282-Q284 VanDerWaalsContact C-N 3.32Å; I282-Q284 PolarHBondContact O-N 3.48Å; I282-Y286 HydrophobicContact CG2-CD2 4.21Å; I282-Y286 WeakPolarHBondContact O-CB 3.06Å; I282-Y286 WeakPolarHBondContact O-CD2 3.36Å; I282-Y286 PolarHBondContact O-N 3.16Å; I282-Y286 VanDerWaalsContact O-N 3.07Å; I282-L288 HydrophobicContact CG2-CD1 4.29Å; I282-A293 HydrophobicContact CB-CB 4.3Å; I282-A293 HydrophobicContact CG2-CB 3.88Å |
| 283 | T | 97.8 | Very high | 96.6 | Very high | 39 Ų | 39 | 85.3 Ų | 85.3 | 24% | 0.239 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -59.2 | -43.7 | 174.8 | -80.1 | 0 | 0 | 0 | 0 | 111.3 | I279 S280 S281 H287 L288 A293 | I279-T283 WeakPolarHBondContact O-CB 3.28Å; I279-T283 PolarHBondContact O-N 3.44Å; I279-T283 PolarHBondContact O-OG1 2.9Å; S280-T283 PolarHBondContact O-N 2.95Å; S281-T283 VanDerWaalsContact C-N 3.34Å; S281-T283 PolarHBondContact O-N 2.86Å; T283-H287 WeakPolarHBondContact O-CA 3.09Å; T283-H287 PolarHBondContact O-N 3.25Å; T283-L288 WeakPolarHBondContact CB-O 3.49Å; T283-L288 WeakPolarHBondContact CG2-O 3.13Å; T283-L288 PolarHBondContact O-N 3.29Å; T283-L288 VanDerWaalsContact O-N 3.15Å; T283-L288 PolarHBondContact OG1-O 3.34Å; T283-L288 VanDerWaalsContact OG1-O 3.05Å; T283-A293 WeakPolarHBondContact OG1-CB 3.38Å |
| 284 | Q | 97.4 | Very high | 96.7 | Very high | 138 Ų | 138 | 86.3 Ų | 86.3 | 65% | 0.645 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -71.2 | -45.9 | 178.5 | -71.8 | 174.9 | 14.7 | 0 | 0 | 112.6 | S280 S281 I282 Y286 | S280-Q284 WeakPolarHBondContact O-CB 3.4Å; S280-Q284 VanDerWaalsContact O-CG 3.29Å; S280-Q284 WeakPolarHBondContact O-CG 3.48Å; S280-Q284 PolarHBondContact O-N 3.38Å; S281-Q284 PolarHBondContact O-N 3.34Å; S281-Q284 VanDerWaalsContact O-N 3.16Å; I282-Q284 VanDerWaalsContact C-N 3.32Å; I282-Q284 PolarHBondContact O-N 3.48Å; Q284-Y286 VanDerWaalsContact C-N 3.31Å; Q284-Y286 PolarHBondContact O-N 3.14Å |
| 285 | D | 97.5 | Very high | 96.7 | Very high | 106 Ų | 106 | 81.5 Ų | 81.5 | 57% | 0.567 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -66.7 | -32.4 | -175.3 | -68.1 | -28.4 | 0 | 0 | 0 | 112.5 | S281 | S281-D285 VanDerWaalsContact O-CB 3.27Å; S281-D285 WeakPolarHBondContact O-CB 3.45Å; S281-D285 PolarHBondContact O-N 3.25Å; S281-D285 VanDerWaalsContact O-OD2 3.09Å; S281-D285 PolarHBondContact OG-OD2 3.18Å |
| 286 | Y | 95.6 | Very high | 96.8 | Very high | 165 Ų | 165 | 84.3 Ų | 84.3 | 65% | 0.647 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -117.6 | 3.6 | -174.8 | -63.3 | -85.9 | 0 | 0 | 0 | 114 | I282 Q284 L288 | I282-Y286 HydrophobicContact CG2-CD2 4.21Å; I282-Y286 WeakPolarHBondContact O-CB 3.06Å; I282-Y286 WeakPolarHBondContact O-CD2 3.36Å; I282-Y286 PolarHBondContact O-N 3.16Å; I282-Y286 VanDerWaalsContact O-N 3.07Å; Q284-Y286 VanDerWaalsContact C-N 3.31Å; Q284-Y286 PolarHBondContact O-N 3.14Å; Y286-L288 VanDerWaalsContact C-N 3.32Å; Y286-L288 PolarHBondContact O-N 2.87Å |
| 287 | H | 94.9 | Very high | 96.8 | Very high | 176 Ų | 176 | 83 Ų | 83 | 82% | 0.815 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.6 | 50.3 | -175.7 | -60.3 | -61 | 0 | 0 | 0 | 112.8 | T283 | T283-H287 WeakPolarHBondContact O-CA 3.09Å; T283-H287 PolarHBondContact O-N 3.25Å |
| 288 | L | 94.8 | Very high | 96.8 | Very high | 34 Ų | 34 | 81.6 Ų | 81.6 | 18% | 0.178 | 41% | 0.406 | C | S | . | . | trans | -105.8 | 147.7 | -178.9 | -63.3 | 174.9 | 0 | 0 | 0 | 111.3 | I282 T283 Y286 | I282-L288 HydrophobicContact CG2-CD1 4.29Å; T283-L288 WeakPolarHBondContact CB-O 3.49Å; T283-L288 WeakPolarHBondContact CG2-O 3.13Å; T283-L288 PolarHBondContact O-N 3.29Å; T283-L288 VanDerWaalsContact O-N 3.15Å; T283-L288 PolarHBondContact OG1-O 3.34Å; T283-L288 VanDerWaalsContact OG1-O 3.05Å; Y286-L288 VanDerWaalsContact C-N 3.32Å; Y286-L288 PolarHBondContact O-N 2.87Å | ||
| 289 | D | 96.6 | Very high | 96.7 | Very high | 124 Ų | 124 | 84.9 Ų | 84.9 | 66% | 0.663 | 41% | 0.413 | S | S | * | . | trans | -61.3 | 148.7 | 169.5 | -63.8 | -34.3 | 0 | 0 | 0 | 111 | Q291 D292 A293 | D289-Q291 VanDerWaalsContact C-N 3.3Å; D289-Q291 PolarHBondContact O-N 2.77Å; D289-D292 HydrophobicContact CB-CB 4.46Å; D289-D292 WeakPolarHBondContact O-CB 3.27Å; D289-D292 PolarHBondContact O-N 3.15Å; D289-A293 PolarHBondContact O-N 2.94Å | ||
| 290 | E | 96 | Very high | 96.7 | Very high | 143 Ų | 143 | 85.3 Ų | 85.3 | 67% | 0.668 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -57.2 | -42.7 | -175.1 | -172.6 | 177.4 | 177.3 | 0 | 0 | 112.2 | I279 D292 A293 E294 | I279-E290 HydrophobicContact CG2-CG 4.05Å; E290-D292 VanDerWaalsContact C-N 3.28Å; E290-D292 PolarHBondContact O-N 3.4Å; E290-A293 PolarHBondContact O-N 3.48Å; E290-E294 WeakPolarHBondContact O-CB 3.47Å; E290-E294 PolarHBondContact O-N 3.16Å |
| 291 | Q | 97.3 | Very high | 96.5 | Very high | 132 Ų | 132 | 87.5 Ų | 87.5 | 62% | 0.617 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -64.9 | -32.2 | 178.4 | -164.2 | 64 | 70.2 | 0 | 0 | 112.6 | D289 E294 G295 | D289-Q291 VanDerWaalsContact C-N 3.3Å; D289-Q291 PolarHBondContact O-N 2.77Å; Q291-E294 PolarHBondContact NE2-OE2 3.41Å; Q291-G295 PolarHBondContact O-N 2.88Å |
| 292 | D | 96.9 | Very high | 96.4 | Very high | 79 Ų | 79 | 89.5 Ų | 89.5 | 42% | 0.422 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -76.7 | -38.9 | 178.1 | -95.8 | 4 | 0 | 0 | 0 | 111.7 | D289 E290 R296 | D289-D292 HydrophobicContact CB-CB 4.46Å; D289-D292 WeakPolarHBondContact O-CB 3.27Å; D289-D292 PolarHBondContact O-N 3.15Å; E290-D292 VanDerWaalsContact C-N 3.28Å; E290-D292 PolarHBondContact O-N 3.4Å; D292-R296 WeakPolarHBondContact O-CB 3.41Å; D292-R296 VanDerWaalsContact O-CG 3.25Å; D292-R296 WeakPolarHBondContact O-CG 3.46Å; D292-R296 PolarHBondContact O-N 3.22Å |
| 293 | A | 97.6 | Very high | 96.3 | Very high | 0 Ų | 0 | 97.4 Ų | 97.4 | 0% | 0 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -63.8 | -47.6 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | I279 I282 T283 D289 E290 R296 L297 | I279-A293 HydrophobicContact CG2-CB 4.05Å; I282-A293 HydrophobicContact CB-CB 4.3Å; I282-A293 HydrophobicContact CG2-CB 3.88Å; T283-A293 WeakPolarHBondContact OG1-CB 3.38Å; D289-A293 PolarHBondContact O-N 2.94Å; E290-A293 PolarHBondContact O-N 3.48Å; A293-R296 PolarHBondContact O-N 3.41Å; A293-L297 WeakPolarHBondContact O-CB 3.39Å; A293-L297 PolarHBondContact O-N 3.32Å |
| 294 | E | 96.7 | Very high | 96.1 | Very high | 82 Ų | 82 | 100.1 Ų | 100.1 | 38% | 0.383 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -58.1 | -50.2 | 174.1 | -172.5 | -164.3 | 171.4 | 0 | 0 | 110.8 | I279 E290 Q291 R296 L297 V298 | I279-E294 HydrophobicContact CD1-CB 4.28Å; I279-E294 HydrophobicContact CD1-CG 4.2Å; E290-E294 WeakPolarHBondContact O-CB 3.47Å; E290-E294 PolarHBondContact O-N 3.16Å; Q291-E294 PolarHBondContact NE2-OE2 3.41Å; E294-R296 VanDerWaalsContact C-N 3.31Å; E294-R296 PolarHBondContact O-N 3.05Å; E294-L297 WeakPolarHBondContact O-CB 3.37Å; E294-L297 PolarHBondContact O-N 3.35Å; E294-L297 VanDerWaalsContact O-N 3.12Å; E294-V298 HydrophobicContact CG-CG2 4.44Å; E294-V298 WeakPolarHBondContact O-CG2 3.48Å; E294-V298 PolarHBondContact O-N 3.07Å |
| 295 | G | 96.5 | Very high | 95.7 | Very high | 15 Ų | 15 | 97.6 Ų | 97.6 | 16% | 0.155 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -60.1 | -39.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q291 R299 | Q291-G295 PolarHBondContact O-N 2.88Å; G295-R299 VanDerWaalsContact C-CZ 3.46Å; G295-R299 WeakPolarHBondContact O-CB 3.33Å; G295-R299 VanDerWaalsContact O-CG 3.27Å; G295-R299 WeakPolarHBondContact O-CG 3.5Å; G295-R299 VanDerWaalsContact O-CZ 3.23Å; G295-R299 PolarHBondContact O-N 3.12Å; G295-R299 PolarHBondContact O-NE 2.88Å |
| 296 | R | 96.1 | Very high | 95.1 | Very high | 148 Ų | 148 | 97.4 Ų | 97.4 | 56% | 0.558 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -68.1 | -41.1 | 174.6 | -76 | 174.7 | -178.9 | -121.1 | 1.9 | 111.9 | D292 A293 E294 R299 G300 | D292-R296 WeakPolarHBondContact O-CB 3.41Å; D292-R296 VanDerWaalsContact O-CG 3.25Å; D292-R296 WeakPolarHBondContact O-CG 3.46Å; D292-R296 PolarHBondContact O-N 3.22Å; A293-R296 PolarHBondContact O-N 3.41Å; E294-R296 VanDerWaalsContact C-N 3.31Å; E294-R296 PolarHBondContact O-N 3.05Å; R296-R299 PolarHBondContact O-N 2.91Å; R296-G300 PolarHBondContact O-N 3.33Å |
| 297 | L | 96.6 | Very high | 94.6 | Very high | 30 Ų | 30 | 97.5 Ų | 97.5 | 16% | 0.157 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -61.3 | -50 | 176.9 | -179.5 | 61.3 | 0 | 0 | 0 | 110.9 | I275 L278 I279 A293 E294 R299 G300 I301 | I275-L297 HydrophobicContact CG2-CD2 4.15Å; L278-L297 HydrophobicContact CD2-CD1 3.69Å; L278-L297 HydrophobicContact CD2-CD2 4.1Å; L278-L297 HydrophobicContact CG-CD1 4.49Å; L278-L297 HydrophobicContact CG-CD2 4.5Å; I279-L297 HydrophobicContact CD1-CD2 4.23Å; I279-L297 HydrophobicContact CG1-CD2 3.67Å; A293-L297 WeakPolarHBondContact O-CB 3.39Å; A293-L297 PolarHBondContact O-N 3.32Å; E294-L297 WeakPolarHBondContact O-CB 3.37Å; E294-L297 PolarHBondContact O-N 3.35Å; E294-L297 VanDerWaalsContact O-N 3.12Å; L297-R299 PolarHBondContact O-N 3.32Å; L297-G300 PolarHBondContact O-N 2.85Å; L297-G300 VanDerWaalsContact O-N 3.17Å; L297-I301 HydrophobicContact CD1-CD1 4.27Å; L297-I301 HydrophobicContact CG-CD1 4.09Å; L297-I301 WeakPolarHBondContact O-CG1 3.26Å; L297-I301 PolarHBondContact O-N 3.39Å |
| 298 | V | 97.1 | Very high | 93.6 | Very high | 68 Ų | 68 | 99 Ų | 99 | 41% | 0.412 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -59.3 | -48 | 177.8 | 172.8 | 0 | 0 | 0 | 0 | 111.2 | E294 G300 I301 I302 | E294-V298 HydrophobicContact CG-CG2 4.44Å; E294-V298 WeakPolarHBondContact O-CG2 3.48Å; E294-V298 PolarHBondContact O-N 3.07Å; V298-G300 VanDerWaalsContact C-N 3.3Å; V298-G300 PolarHBondContact O-N 3.27Å; V298-I301 PolarHBondContact O-N 3.17Å; V298-I302 HydrophobicContact CG1-CD1 3.91Å; V298-I302 WeakPolarHBondContact O-CG1 3.36Å; V298-I302 PolarHBondContact O-N 2.88Å |
| 299 | R | 96.3 | Very high | 92.1 | Very high | 148 Ų | 148 | 102.5 Ų | 102.5 | 56% | 0.558 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.9 | -39.5 | 176.4 | -75 | -175.2 | -68.9 | -93.8 | 4.1 | 112.1 | G295 R296 L297 I302 R303 | G295-R299 VanDerWaalsContact C-CZ 3.46Å; G295-R299 WeakPolarHBondContact O-CB 3.33Å; G295-R299 VanDerWaalsContact O-CG 3.27Å; G295-R299 WeakPolarHBondContact O-CG 3.5Å; G295-R299 VanDerWaalsContact O-CZ 3.23Å; G295-R299 PolarHBondContact O-N 3.12Å; G295-R299 PolarHBondContact O-NE 2.88Å; R296-R299 PolarHBondContact O-N 2.91Å; L297-R299 PolarHBondContact O-N 3.32Å; R299-I302 PolarHBondContact O-N 2.96Å; R299-R303 WeakPolarHBondContact O-CB 3.21Å; R299-R303 PolarHBondContact O-N 2.92Å |
| 300 | G | 96.1 | Very high | 90.6 | Very high | 28 Ų | 28 | 108.3 Ų | 108.3 | 29% | 0.289 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.5 | -47.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | R296 L297 V298 R303 I304 | R296-G300 PolarHBondContact O-N 3.33Å; L297-G300 PolarHBondContact O-N 2.85Å; L297-G300 VanDerWaalsContact O-N 3.17Å; V298-G300 VanDerWaalsContact C-N 3.3Å; V298-G300 PolarHBondContact O-N 3.27Å; G300-R303 PolarHBondContact O-N 2.9Å; G300-I304 WeakPolarHBondContact O-CB 3.46Å; G300-I304 VanDerWaalsContact O-CG1 3.26Å; G300-I304 WeakPolarHBondContact O-CG1 3.38Å; G300-I304 PolarHBondContact O-N 3.33Å |
| 301 | I | 95.3 | Very high | 88.7 | Confident | 99 Ų | 99 | 105.9 Ų | 105.9 | 51% | 0.508 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -58.9 | -50.6 | 176.3 | -67.6 | 165.6 | 0 | 0 | 0 | 110.2 | L297 V298 R303 I304 S305 | L297-I301 HydrophobicContact CD1-CD1 4.27Å; L297-I301 HydrophobicContact CG-CD1 4.09Å; L297-I301 WeakPolarHBondContact O-CG1 3.26Å; L297-I301 PolarHBondContact O-N 3.39Å; V298-I301 PolarHBondContact O-N 3.17Å; I301-R303 VanDerWaalsContact C-N 3.35Å; I301-R303 PolarHBondContact O-N 2.87Å; I301-I304 PolarHBondContact O-N 3.46Å; I301-S305 VanDerWaalsContact O-CB 3.29Å; I301-S305 WeakPolarHBondContact O-CB 3.42Å; I301-S305 PolarHBondContact O-N 3.48Å; I301-S305 PolarHBondContact O-OG 3.07Å |
| 302 | I | 95.6 | Very high | 86.6 | Confident | 91 Ų | 91 | 109.1 Ų | 109.1 | 47% | 0.467 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -58.3 | -47.8 | 178.8 | -66.8 | 167.7 | 0 | 0 | 0 | 110.4 | V298 R299 I304 S305 T306 | V298-I302 HydrophobicContact CG1-CD1 3.91Å; V298-I302 WeakPolarHBondContact O-CG1 3.36Å; V298-I302 PolarHBondContact O-N 2.88Å; R299-I302 PolarHBondContact O-N 2.96Å; I302-I304 VanDerWaalsContact C-N 3.28Å; I302-I304 PolarHBondContact O-N 3.32Å; I302-S305 WeakPolarHBondContact CA-OG 3.27Å; I302-S305 PolarHBondContact O-N 2.93Å; I302-S305 PolarHBondContact O-OG 3.49Å; I302-T306 HydrophobicContact CG2-CG2 4.07Å; I302-T306 VanDerWaalsContact O-CB 3.27Å; I302-T306 WeakPolarHBondContact O-CB 3.31Å; I302-T306 VanDerWaalsContact O-CG2 3.26Å; I302-T306 WeakPolarHBondContact O-CG2 3.35Å; I302-T306 PolarHBondContact O-N 3.27Å; I302-T306 PolarHBondContact O-OG1 2.6Å |
| 303 | R | 94.8 | Very high | 84.5 | Confident | 200 Ų | 200 | 110.4 Ų | 110.4 | 76% | 0.755 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -62 | -36.1 | 179.8 | -172.9 | -179.4 | 176.9 | 107.1 | -1.5 | 112.2 | R299 G300 I301 R307 | R299-R303 WeakPolarHBondContact O-CB 3.21Å; R299-R303 PolarHBondContact O-N 2.92Å; G300-R303 PolarHBondContact O-N 2.9Å; I301-R303 VanDerWaalsContact C-N 3.35Å; I301-R303 PolarHBondContact O-N 2.87Å; R303-R307 WeakPolarHBondContact O-CB 3.3Å; R303-R307 WeakPolarHBondContact O-CG 3.27Å; R303-R307 PolarHBondContact O-N 3.11Å |
| 304 | I | 92.5 | Very high | 82.2 | Confident | 96 Ų | 96 | 117 Ų | 117 | 49% | 0.492 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -79.2 | -34.5 | 179.8 | -71 | 169.5 | 0 | 0 | 0 | 112.5 | G300 I301 I302 R307 | G300-I304 WeakPolarHBondContact O-CB 3.46Å; G300-I304 VanDerWaalsContact O-CG1 3.26Å; G300-I304 WeakPolarHBondContact O-CG1 3.38Å; G300-I304 PolarHBondContact O-N 3.33Å; I301-I304 PolarHBondContact O-N 3.46Å; I302-I304 VanDerWaalsContact C-N 3.28Å; I302-I304 PolarHBondContact O-N 3.32Å; I304-R307 WeakPolarHBondContact O-CG 3.27Å; I304-R307 PolarHBondContact O-NE 2.79Å |
| 305 | S | 88.8 | Confident | 79.7 | Confident | 85 Ų | 85 | 119.5 Ų | 119.5 | 59% | 0.594 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -80.3 | -31.8 | -179.8 | 66.9 | 0 | 0 | 0 | 0 | 112.1 | I301 I302 | I301-S305 VanDerWaalsContact O-CB 3.29Å; I301-S305 WeakPolarHBondContact O-CB 3.42Å; I301-S305 PolarHBondContact O-N 3.48Å; I301-S305 PolarHBondContact O-OG 3.07Å; I302-S305 WeakPolarHBondContact CA-OG 3.27Å; I302-S305 PolarHBondContact O-N 2.93Å; I302-S305 PolarHBondContact O-OG 3.49Å |
| 306 | T | 86.1 | Confident | 77.2 | Confident | 103 Ų | 103 | 123.5 Ų | 123.5 | 63% | 0.632 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -90.4 | -14.3 | -179.7 | 61.5 | 0 | 0 | 0 | 0 | 113.8 | I302 K308 | I302-T306 HydrophobicContact CG2-CG2 4.07Å; I302-T306 VanDerWaalsContact O-CB 3.27Å; I302-T306 WeakPolarHBondContact O-CB 3.31Å; I302-T306 VanDerWaalsContact O-CG2 3.26Å; I302-T306 WeakPolarHBondContact O-CG2 3.35Å; I302-T306 PolarHBondContact O-N 3.27Å; I302-T306 PolarHBondContact O-OG1 2.6Å; T306-K308 PolarHBondContact O-N 3.03Å |
| 307 | R | 84 | Confident | 74.6 | Confident | 166 Ų | 166 | 125.9 Ų | 125.9 | 63% | 0.626 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -66 | 120.6 | 169.3 | 60.1 | -178.5 | -175.2 | -176.7 | 3.8 | 109 | R303 I304 S309 | R303-R307 WeakPolarHBondContact O-CB 3.3Å; R303-R307 WeakPolarHBondContact O-CG 3.27Å; R303-R307 PolarHBondContact O-N 3.11Å; I304-R307 WeakPolarHBondContact O-CG 3.27Å; I304-R307 PolarHBondContact O-NE 2.79Å; R307-S309 PolarHBondContact O-N 2.79Å; R307-S309 VanDerWaalsContact O-N 3.15Å |
| 308 | K | 73.7 | Confident | 72 | Confident | 207 Ų | 207 | 128.3 Ų | 128.3 | 90% | 0.9 | 67% | 0.669 | S | S | * | * | trans | -60.9 | 118.4 | 170 | -166.7 | 161.9 | -179.2 | -177.5 | 0 | 108.1 | T306 R310 | T306-K308 PolarHBondContact O-N 3.03Å; K308-R310 PolarHBondContact O-N 3.27Å | ||
| 309 | S | 63.9 | Low | 68.9 | Low | 108 Ų | 108 | 136.7 Ų | 136.7 | 76% | 0.755 | 69% | 0.693 | S | S | * | * | trans | -67.1 | 89.1 | -174.8 | 61.6 | 0 | 0 | 0 | 0 | 111.6 | R307 A311 | R307-S309 PolarHBondContact O-N 2.79Å; R307-S309 VanDerWaalsContact O-N 3.15Å; S309-A311 PolarHBondContact O-N 3.08Å | ||
| 310 | R | 65.6 | Low | 66.4 | Low | 247 Ų | 247 | 134.4 Ų | 134.4 | 93% | 0.932 | 70% | 0.7 | S | S | * | * | trans | -83.3 | 77.4 | 150.9 | -91.1 | -172.3 | -179.1 | -102.6 | 4.1 | 107.2 | K308 R312 | K308-R310 PolarHBondContact O-N 3.27Å; R310-R312 PolarHBondContact O-N 2.84Å; R310-R312 VanDerWaalsContact O-N 3.08Å | ||
| 311 | A | 55.6 | Low | 63.6 | Low | 92 Ų | 92 | 138.6 Ų | 138.6 | 76% | 0.76 | 72% | 0.72 | S | S | * | * | trans | -74.3 | 96.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | S309 | S309-A311 PolarHBondContact O-N 3.08Š| ||
| 312 | R | 53.7 | Low | 61 | Low | 199 Ų | 199 | 145.6 Ų | 145.6 | 75% | 0.751 | 74% | 0.74 | S | S | * | * | trans | -104.4 | 114.9 | 148.3 | 179.7 | 173.4 | -177.5 | 166.3 | 2.1 | 106.4 | R310 Q314 | R310-R312 PolarHBondContact O-N 2.84Å; R310-R312 VanDerWaalsContact O-N 3.08Å; R312-Q314 PolarHBondContact O-N 3.49Å | ||
| 313 | P | 51.7 | Low | 58.1 | Low | 107 Ų | 107 | 146.4 Ų | 146.4 | 70% | 0.695 | 76% | 0.76 | S | S | * | * | trans | -69.3 | 111.5 | 167 | -10.8 | 26.2 | 0 | 0 | 0 | 107.9 | T315 | P313-T315 VanDerWaalsContact C-N 3.29Å; P313-T315 PolarHBondContact O-N 2.96Å | ||
| 314 | Q | 48.8 | Very low | 55.5 | Low | 139 Ų | 139 | 141.6 Ų | 141.6 | 65% | 0.65 | 76% | 0.764 | S | S | * | * | trans | -82.7 | 86.6 | 156.7 | -73.9 | -80.5 | -6.6 | 0 | 0 | 105.7 | R312 S316 | R312-Q314 PolarHBondContact O-N 3.49Å; Q314-S316 VanDerWaalsContact C-N 3.31Å; Q314-S316 PolarHBondContact O-N 3.47Å; Q314-S316 VanDerWaalsContact O-N 3.17Å | ||
| 315 | T | 45.3 | Very low | 52.8 | Low | 133 Ų | 133 | 141.6 Ų | 141.6 | 82% | 0.816 | 78% | 0.778 | S | S | * | * | trans | -71.5 | 95.6 | 156.8 | 49.8 | 0 | 0 | 0 | 0 | 106.4 | P313 | P313-T315 VanDerWaalsContact C-N 3.29Å; P313-T315 PolarHBondContact O-N 2.96Å | ||
| 316 | S | 42.8 | Very low | 50.9 | Low | 100 Ų | 100 | 143.4 Ų | 143.4 | 70% | 0.699 | 79% | 0.787 | S | S | * | * | trans | -125.5 | 67.5 | 162.9 | 70.8 | 0 | 0 | 0 | 0 | 108.8 | Q314 | Q314-S316 VanDerWaalsContact C-N 3.31Å; Q314-S316 PolarHBondContact O-N 3.47Å; Q314-S316 VanDerWaalsContact O-N 3.17Å | ||
| 317 | E | 42.8 | Very low | 48.7 | Very low | 197 Ų | 197 | 144.7 Ų | 144.7 | 92% | 0.921 | 80% | 0.795 | S | S | * | * | trans | -94.5 | 121.3 | 151.5 | -70.7 | -159.2 | 153.9 | 0 | 0 | 108.5 | ||||
| 318 | G | 40.6 | Very low | 46.8 | Very low | 81 Ų | 81 | 143.5 Ų | 143.5 | 84% | 0.835 | 81% | 0.807 | S | S | * | * | trans | 68.7 | 88.4 | 147.7 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 319 | R | 33.8 | Very low | 44.9 | Very low | 245 Ų | 245 | 138.4 Ų | 138.4 | 93% | 0.925 | 80% | 0.803 | S | S | * | * | trans | -144.5 | 100.9 | 138.9 | -160.9 | 162.6 | -169.4 | 154.1 | 2.5 | 112.1 | ||||
| 320 | S | 43.6 | Very low | 44.1 | Very low | 100 Ų | 100 | 137.5 Ų | 137.5 | 70% | 0.699 | 80% | 0.803 | S | S | * | * | trans | -66 | 155.8 | 158.8 | -178.5 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 321 | T | 37.6 | Very low | 43.2 | Very low | 116 Ų | 116 | 132.2 Ų | 132.2 | 71% | 0.712 | 80% | 0.8 | S | S | * | * | trans | 92.1 | 103.6 | 169.1 | 67.5 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 322 | R | 40.1 | Very low | 42.3 | Very low | 245 Ų | 245 | 134.9 Ų | 134.9 | 93% | 0.925 | 80% | 0.801 | S | S | * | * | trans | 39.9 | 118.9 | 135.4 | -76.1 | 179 | 171 | 170.5 | -2.9 | 119.3 | ||||
| 323 | A | 34.9 | Very low | 41.7 | Very low | 108 Ų | 108 | 130.5 Ų | 130.5 | 89% | 0.893 | 80% | 0.802 | S | S | * | * | 173.2 | 161 | 110.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 324 | A | 38.7 | Very low | 41.3 | Very low | 100 Ų | 100 | 128 Ų | 128 | 83% | 0.826 | 80% | 0.796 | S | S | * | * | trans | -82.4 | 168.9 | -160.2 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 325 | A | 35.6 | Very low | 41.4 | Very low | 96 Ų | 96 | 128.8 Ų | 128.8 | 79% | 0.793 | 80% | 0.799 | S | S | * | * | trans | 96.3 | 130.3 | 153.1 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 326 | P | 50.6 | Low | 41.5 | Very low | 122 Ų | 122 | 131.1 Ų | 131.1 | 79% | 0.792 | 80% | 0.8 | S | S | * | * | trans | -103.7 | 128.2 | 176.6 | 36.5 | -25.4 | 0 | 0 | 0 | 111.7 | ||||
| 327 | T | 39 | Very low | 42 | Very low | 130 Ų | 130 | 130.9 Ų | 130.9 | 80% | 0.798 | 80% | 0.795 | S | S | * | * | trans | -153.2 | 112 | 162.1 | 42.2 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 328 | T | 43.8 | Very low | 42.4 | Very low | 142 Ų | 142 | 130.6 Ų | 130.6 | 87% | 0.871 | 80% | 0.796 | S | S | * | * | trans | 15.9 | 111.7 | 140.2 | 49.9 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 329 | A | 35.1 | Very low | 42.5 | Very low | 99 Ų | 99 | 133.3 Ų | 133.3 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | -147 | 116.6 | 146.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 330 | A | 46.3 | Very low | 42.9 | Very low | 90 Ų | 90 | 124.7 Ų | 124.7 | 74% | 0.744 | 78% | 0.783 | S | S | * | * | trans | -60.3 | 147.8 | 169.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | D332 | A330-D332 PolarHBondContact O-N 2.85Š| ||
| 331 | P | 46.2 | Very low | 42.7 | Very low | 135 Ų | 135 | 126.3 Ų | 126.3 | 88% | 0.877 | 80% | 0.795 | S | S | * | * | trans | -75 | 102.5 | 166.2 | 29.4 | -27.6 | 0 | 0 | 0 | 108 | ||||
| 332 | D | 38.3 | Very low | 43 | Very low | 148 Ų | 148 | 124.1 Ų | 124.1 | 79% | 0.791 | 80% | 0.795 | S | S | * | * | trans | -61.1 | 143.6 | 161.2 | -172.1 | 12.6 | 0 | 0 | 0 | 109.7 | A330 | A330-D332 PolarHBondContact O-N 2.85Š| ||
| 333 | S | 39.2 | Very low | 43 | Very low | 108 Ų | 108 | 120.8 Ų | 120.8 | 76% | 0.755 | 79% | 0.794 | S | S | * | * | trans | -3.1 | 145.3 | 158.8 | -170.6 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 334 | G | 43.9 | Very low | 43.3 | Very low | 55 Ų | 55 | 121.1 Ų | 121.1 | 57% | 0.567 | 79% | 0.79 | S | S | * | * | 123.9 | 101.7 | 129.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | E336 | G334-E336 PolarHBondContact O-N 2.81Š| |||
| 335 | H | 50.8 | Low | 43.9 | Very low | 154 Ų | 154 | 125.8 Ų | 125.8 | 71% | 0.713 | 80% | 0.795 | S | S | * | * | trans | 9.4 | 102.9 | 133.5 | 175.2 | 81.2 | 0 | 0 | 0 | 116.6 | T337 | H335-T337 WeakPolarHBondContact CE1-CG2 3.31Å; H335-T337 PolarHBondContact NE2-OG1 2.93Å | ||
| 336 | E | 47.2 | Very low | 44.4 | Very low | 183 Ų | 183 | 127.9 Ų | 127.9 | 86% | 0.855 | 79% | 0.793 | S | S | * | * | trans | -124.6 | 101 | 159.3 | -72.5 | -82.4 | 138.5 | 0 | 0 | 106.4 | G334 | G334-E336 PolarHBondContact O-N 2.81Š| ||
| 337 | T | 54.1 | Low | 44.6 | Very low | 94 Ų | 94 | 130 Ų | 130 | 58% | 0.577 | 79% | 0.792 | S | S | * | * | trans | -69.6 | 150.7 | 172.8 | 26.3 | 0 | 0 | 0 | 0 | 110 | H335 V339 | H335-T337 WeakPolarHBondContact CE1-CG2 3.31Å; H335-T337 PolarHBondContact NE2-OG1 2.93Å; T337-V339 PolarHBondContact O-N 3.45Å | ||
| 338 | M | 50.2 | Low | 45.3 | Very low | 191 Ų | 191 | 131.1 Ų | 131.1 | 94% | 0.941 | 79% | 0.793 | S | S | * | * | trans | -37.2 | 125.3 | 179.6 | -71.4 | -179 | -57 | 0 | 0 | 113.6 | ||||
| 339 | V | 43.5 | Very low | 46 | Very low | 138 Ų | 138 | 129.2 Ų | 129.2 | 84% | 0.836 | 78% | 0.781 | S | S | * | * | trans | -119.3 | 116.1 | 159.1 | -167.8 | 0 | 0 | 0 | 0 | 107.8 | T337 | T337-V339 PolarHBondContact O-N 3.45Š| ||
| 340 | G | 43.1 | Very low | 47.2 | Very low | 64 Ų | 64 | 130.1 Ų | 130.1 | 66% | 0.66 | 78% | 0.776 | S | S | * | * | trans | -87 | 174.5 | -168.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 341 | S | 39 | Very low | 47.9 | Very low | 135 Ų | 135 | 133.9 Ų | 133.9 | 94% | 0.944 | 78% | 0.778 | S | S | * | * | trans | -170.2 | 129.4 | 156.8 | -73.3 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 342 | G | 44.1 | Very low | 49 | Very low | 70 Ų | 70 | 134.8 Ų | 134.8 | 72% | 0.722 | 77% | 0.774 | S | S | * | * | cis | 171.9 | 108.3 | -0.6 | 0 | 0 | 0 | 0 | 0 | 104.6 | ||||
| 343 | L | 40.1 | Very low | 50.8 | Low | 174 Ų | 174 | 132.6 Ų | 132.6 | 91% | 0.911 | 77% | 0.771 | S | S | * | * | trans | -142.8 | 120.4 | 165.8 | -73 | -179.7 | 0 | 0 | 0 | 107.8 | Q345 | L343-Q345 PolarHBondContact O-N 3.27Š| ||
| 344 | S | 41.2 | Very low | 52.8 | Low | 115 Ų | 115 | 136.4 Ų | 136.4 | 80% | 0.804 | 78% | 0.776 | S | S | * | * | trans | 13.2 | 101.1 | 158.2 | -165.2 | 0 | 0 | 0 | 0 | 116.4 | D346 | S344-D346 VanDerWaalsContact C-N 3.34Å; S344-D346 PolarHBondContact O-N 2.79Å | ||
| 345 | Q | 50.1 | Low | 54.6 | Low | 199 Ų | 199 | 139.1 Ų | 139.1 | 93% | 0.93 | 77% | 0.774 | S | S | * | * | trans | -70.5 | 88.6 | 164.6 | -174.6 | 178.6 | 3.8 | 0 | 0 | 108.6 | L343 | L343-Q345 PolarHBondContact O-N 3.27Š| ||
| 346 | D | 47.6 | Very low | 56.2 | Low | 140 Ų | 140 | 135.3 Ų | 135.3 | 75% | 0.749 | 76% | 0.762 | S | S | * | * | trans | -125.9 | 93.7 | 155 | -148.2 | 25.3 | 0 | 0 | 0 | 107.4 | S344 L348 | S344-D346 VanDerWaalsContact C-N 3.34Å; S344-D346 PolarHBondContact O-N 2.79Å; D346-L348 PolarHBondContact O-N 2.93Å | ||
| 347 | E | 54.6 | Low | 58 | Low | 165 Ų | 165 | 132.3 Ų | 132.3 | 77% | 0.771 | 76% | 0.756 | S | S | * | * | trans | 27.6 | 62.3 | 152.4 | -155.2 | 164.9 | 176.4 | 0 | 0 | 118.5 | ||||
| 348 | L | 53.8 | Low | 59.5 | Low | 155 Ų | 155 | 130.6 Ų | 130.6 | 81% | 0.812 | 75% | 0.751 | S | S | * | * | trans | -98.1 | 85.1 | 157.7 | -134.6 | 82.9 | 0 | 0 | 0 | 108.9 | D346 V350 | D346-L348 PolarHBondContact O-N 2.93Å; L348-V350 VanDerWaalsContact C-N 3.28Å; L348-V350 PolarHBondContact O-N 3.3Å | ||
| 349 | T | 57.9 | Low | 61.2 | Low | 101 Ų | 101 | 125 Ų | 125 | 62% | 0.62 | 73% | 0.725 | S | S | * | * | trans | -65.1 | 93.6 | 165.4 | 54.3 | 0 | 0 | 0 | 0 | 107.9 | Q351 | T349-Q351 PolarHBondContact O-N 3.21Š| ||
| 350 | V | 60.2 | Low | 63.1 | Low | 118 Ų | 118 | 119.6 Ų | 119.6 | 72% | 0.715 | 70% | 0.696 | S | S | * | * | trans | -66.3 | 89.9 | 171.1 | -178.2 | 0 | 0 | 0 | 0 | 107.3 | L348 I352 | L348-V350 VanDerWaalsContact C-N 3.28Å; L348-V350 PolarHBondContact O-N 3.3Å; V350-I352 PolarHBondContact O-N 2.86Å | ||
| 351 | Q | 60.3 | Low | 65 | Low | 169 Ų | 169 | 121.3 Ų | 121.3 | 79% | 0.79 | 69% | 0.689 | S | S | * | * | trans | -76.1 | 103.6 | 170.4 | -69.8 | -174.8 | 10.7 | 0 | 0 | 107.4 | T349 S353 | T349-Q351 PolarHBondContact O-N 3.21Å; Q351-S353 PolarHBondContact O-N 3.43Å | ||
| 352 | I | 69.8 | Low | 67.1 | Low | 154 Ų | 154 | 117.3 Ų | 117.3 | 79% | 0.79 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 122 | 165 | -58.3 | 170.9 | 0 | 0 | 0 | 105.9 | V350 | V350-I352 PolarHBondContact O-N 2.86Š|
| 353 | S | 75.9 | Confident | 69 | Low | 103 Ų | 103 | 118.5 Ų | 118.5 | 72% | 0.72 | 65% | 0.646 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 141.9 | 178.9 | 48.2 | 0 | 0 | 0 | 0 | 110.6 | Q351 E355 | Q351-S353 PolarHBondContact O-N 3.43Å; S353-E355 PolarHBondContact O-N 3.47Å |
| 354 | Q | 81.7 | Confident | 70.9 | Confident | 187 Ų | 187 | 118.5 Ų | 118.5 | 87% | 0.874 | 64% | 0.639 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 131.9 | 173.5 | -113.4 | -174.3 | 72 | 0 | 0 | 109.4 | T356 | Q354-T356 PolarHBondContact O-N 3.39Š|
| 355 | E | 81.8 | Confident | 72.7 | Confident | 113 Ų | 113 | 119.6 Ų | 119.6 | 53% | 0.528 | 64% | 0.635 | S | S | . | * | P | Polyproline II helix | trans | -56.5 | 123 | 178.8 | 167.5 | 154 | -123 | 0 | 0 | 110.6 | S353 D359 R363 | S353-E355 PolarHBondContact O-N 3.47Å; E355-D359 HydrophobicContact CG-CB 4.1Å; E355-R363 IonicContact OE1-CZ 2.61Å; E355-R363 IonicContact OE1-NE 3.55Å; E355-R363 PolarHBondContact OE1-NE 3.27Å; E355-R363 IonicContact OE1-NH2 3.68Å; E355-R363 PolarHBondContact OE1-NH2 2.81Å; E355-R363 IonicContact OE2-CZ 2.94Å; E355-R363 IonicContact OE2-NH2 2.76Å; E355-R363 PolarHBondContact OE2-NH2 2.87Å |
| 356 | T | 84.6 | Confident | 74.1 | Confident | 73 Ų | 73 | 118.6 Ų | 118.6 | 45% | 0.448 | 62% | 0.623 | S | S | . | * | P | Polyproline II helix | trans | -81.3 | 157.8 | 177 | 68.8 | 0 | 0 | 0 | 0 | 110.8 | Q354 A358 D359 A360 | Q354-T356 PolarHBondContact O-N 3.39Å; T356-A358 PolarHBondContact O-N 3.29Å; T356-D359 WeakPolarHBondContact CB-OD2 3.25Å; T356-D359 PolarHBondContact N-OD2 3.01Å; T356-D359 WeakPolarHBondContact O-CB 3.26Å; T356-D359 PolarHBondContact O-N 3.31Å; T356-D359 PolarHBondContact OG1-N 2.96Å; T356-D359 PolarHBondContact OG1-OD2 3.27Å; T356-A360 PolarHBondContact O-N 3.43Å |
| 357 | T | 84.9 | Confident | 74.9 | Confident | 120 Ų | 120 | 117.6 Ų | 117.6 | 74% | 0.736 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -59.4 | -29.1 | 174.8 | 51.7 | 0 | 0 | 0 | 0 | 112.2 | A360 I361 | T357-A360 PolarHBondContact O-N 3.21Å; T357-I361 WeakPolarHBondContact O-CD1 3.39Å; T357-I361 VanDerWaalsContact O-CG1 3.28Å; T357-I361 WeakPolarHBondContact O-CG1 3.26Å; T357-I361 PolarHBondContact O-N 3.02Å; T357-I361 VanDerWaalsContact O-N 3.1Å |
| 358 | A | 84.7 | Confident | 75.2 | Confident | 58 Ų | 58 | 120.2 Ų | 120.2 | 48% | 0.479 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -65.7 | -42.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | T356 A360 I361 A362 | T356-A358 PolarHBondContact O-N 3.29Å; A358-A360 VanDerWaalsContact C-N 3.3Å; A358-A360 PolarHBondContact O-N 3.45Å; A358-I361 PolarHBondContact O-N 2.95Å; A358-A362 WeakPolarHBondContact O-CB 3.39Å; A358-A362 PolarHBondContact O-N 2.93Å |
| 359 | D | 87 | Confident | 75.3 | Confident | 73 Ų | 73 | 114.2 Ų | 114.2 | 39% | 0.39 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -63.1 | -39.4 | 177.3 | -59.8 | -43.5 | 0 | 0 | 0 | 111.2 | E355 T356 A362 R363 | E355-D359 HydrophobicContact CG-CB 4.1Å; T356-D359 WeakPolarHBondContact CB-OD2 3.25Å; T356-D359 PolarHBondContact N-OD2 3.01Å; T356-D359 WeakPolarHBondContact O-CB 3.26Å; T356-D359 PolarHBondContact O-N 3.31Å; T356-D359 PolarHBondContact OG1-N 2.96Å; T356-D359 PolarHBondContact OG1-OD2 3.27Å; D359-A362 PolarHBondContact O-N 3.13Å; D359-R363 WeakPolarHBondContact O-CG 3.43Å; D359-R363 PolarHBondContact O-N 2.95Å |
| 360 | A | 83.6 | Confident | 75.2 | Confident | 26 Ų | 26 | 112.4 Ų | 112.4 | 22% | 0.215 | 60% | 0.599 | C | S | . | * | H | α-helix | trans | -64.5 | -39.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | T356 T357 A358 K364 | T356-A360 PolarHBondContact O-N 3.43Å; T357-A360 PolarHBondContact O-N 3.21Å; A358-A360 VanDerWaalsContact C-N 3.3Å; A358-A360 PolarHBondContact O-N 3.45Å; A360-K364 WeakPolarHBondContact O-CG 3.39Å; A360-K364 PolarHBondContact O-N 3.4Å |
| 361 | I | 83.3 | Confident | 75 | Confident | 100 Ų | 100 | 112.9 Ų | 112.9 | 51% | 0.513 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -67.2 | -45.5 | 175.4 | -66.6 | 163.2 | 0 | 0 | 0 | 110.1 | T357 A358 R363 K364 L365 | T357-I361 WeakPolarHBondContact O-CD1 3.39Å; T357-I361 VanDerWaalsContact O-CG1 3.28Å; T357-I361 WeakPolarHBondContact O-CG1 3.26Å; T357-I361 PolarHBondContact O-N 3.02Å; T357-I361 VanDerWaalsContact O-N 3.1Å; A358-I361 PolarHBondContact O-N 2.95Å; I361-R363 VanDerWaalsContact C-N 3.28Å; I361-R363 PolarHBondContact O-N 3.13Å; I361-K364 PolarHBondContact O-N 3.1Å; I361-L365 HydrophobicContact CG2-CD1 4.23Å; I361-L365 HydrophobicContact CG2-CG 4.37Å; I361-L365 WeakPolarHBondContact O-CG 3.27Å; I361-L365 PolarHBondContact O-N 2.09Å |
| 362 | A | 82.5 | Confident | 74.7 | Confident | 51 Ų | 51 | 108.3 Ų | 108.3 | 42% | 0.421 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -59.9 | -38.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | A358 D359 L365 | A358-A362 WeakPolarHBondContact O-CB 3.39Å; A358-A362 PolarHBondContact O-N 2.93Å; D359-A362 PolarHBondContact O-N 3.13Å; A362-L365 PolarHBondContact O-N 2.75Å |
| 363 | R | 82.6 | Confident | 73.6 | Confident | 95 Ų | 95 | 111 Ų | 111 | 36% | 0.358 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -65.2 | -39.9 | 173.3 | -73 | -175.9 | -64 | 113 | 4.1 | 112.1 | E355 D359 I361 L365 R366 | E355-R363 IonicContact OE1-CZ 2.61Å; E355-R363 IonicContact OE1-NE 3.55Å; E355-R363 PolarHBondContact OE1-NE 3.27Å; E355-R363 IonicContact OE1-NH2 3.68Å; E355-R363 PolarHBondContact OE1-NH2 2.81Å; E355-R363 IonicContact OE2-CZ 2.94Å; E355-R363 IonicContact OE2-NH2 2.76Å; E355-R363 PolarHBondContact OE2-NH2 2.87Å; D359-R363 WeakPolarHBondContact O-CG 3.43Å; D359-R363 PolarHBondContact O-N 2.95Å; I361-R363 VanDerWaalsContact C-N 3.28Å; I361-R363 PolarHBondContact O-N 3.13Å; R363-L365 VanDerWaalsContact C-N 3.35Å; R363-L365 PolarHBondContact O-N 3.1Å; R363-R366 PolarHBondContact O-N 3.2Å |
| 364 | K | 80.3 | Confident | 72.3 | Confident | 173 Ų | 173 | 111.4 Ų | 111.4 | 75% | 0.752 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -70.2 | -25.7 | 177.3 | -73.1 | 178.6 | -179.1 | -177.1 | 0 | 114.1 | A360 I361 R366 | A360-K364 WeakPolarHBondContact O-CG 3.39Å; A360-K364 PolarHBondContact O-N 3.4Å; I361-K364 PolarHBondContact O-N 3.1Å; K364-R366 VanDerWaalsContact C-N 3.25Å; K364-R366 PolarHBondContact O-N 2.98Å |
| 365 | L | 79.9 | Confident | 70.8 | Confident | 139 Ų | 139 | 107.5 Ų | 107.5 | 73% | 0.728 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -74.1 | -15.5 | 174.6 | -68.5 | 175.7 | 0 | 0 | 0 | 113 | I361 A362 R363 | I361-L365 HydrophobicContact CG2-CD1 4.23Å; I361-L365 HydrophobicContact CG2-CG 4.37Å; I361-L365 WeakPolarHBondContact O-CG 3.27Å; I361-L365 PolarHBondContact O-N 2.09Å; A362-L365 PolarHBondContact O-N 2.75Å; R363-L365 VanDerWaalsContact C-N 3.35Å; R363-L365 PolarHBondContact O-N 3.1Å |
| 366 | R | 78.6 | Confident | 68.8 | Low | 177 Ų | 177 | 107.9 Ų | 107.9 | 67% | 0.668 | 62% | 0.62 | S | S | * | * | S | Bend | trans | -78.3 | 132.1 | 173.2 | -59.2 | -160.3 | -146.4 | 176.5 | 8.1 | 109.6 | R363 K364 Y368 G369 | R363-R366 PolarHBondContact O-N 3.2Å; K364-R366 VanDerWaalsContact C-N 3.25Å; K364-R366 PolarHBondContact O-N 2.98Å; R366-Y368 PolarHBondContact O-N 3.49Å; R366-G369 PolarHBondContact O-N 3.49Å; R366-G369 VanDerWaalsContact O-N 3.09Å |
| 367 | P | 65.3 | Low | 66.9 | Low | 119 Ų | 119 | 112.1 Ų | 112.1 | 77% | 0.773 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.3 | -14.6 | 179.6 | -26.6 | 33.5 | 0 | 0 | 0 | 115.9 | ||
| 368 | Y | 59.8 | Low | 65.2 | Low | 220 Ų | 220 | 113.4 Ų | 113.4 | 86% | 0.863 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.3 | 17.1 | -176.9 | -54.8 | -76.1 | 0 | 0 | 0 | 113.8 | R366 | R366-Y368 PolarHBondContact O-N 3.49Š|
| 369 | G | 57.2 | Low | 63 | Low | 29 Ų | 29 | 116.1 Ų | 116.1 | 30% | 0.299 | 65% | 0.652 | S | S | . | * | trans | -88.5 | 3.4 | -171.6 | 0 | 0 | 0 | 0 | 0 | 116.8 | R366 | R366-G369 PolarHBondContact O-N 3.49Å; R366-G369 VanDerWaalsContact O-N 3.09Å | ||
| 370 | A | 55.9 | Low | 60.8 | Low | 64 Ų | 64 | 117.8 Ų | 117.8 | 53% | 0.529 | 67% | 0.669 | S | S | . | * | trans | -82.9 | 127.5 | -178.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | G372 | A370-G372 PolarHBondContact O-N 2.69Š| ||
| 371 | P | 54.8 | Low | 58.7 | Low | 127 Ų | 127 | 126 Ų | 126 | 83% | 0.825 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.9 | 115.8 | 170.2 | -8.9 | 23.9 | 0 | 0 | 0 | 108.8 | ||
| 372 | G | 55.2 | Low | 56.7 | Low | 74 Ų | 74 | 130.1 Ų | 130.1 | 76% | 0.763 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 128.4 | 6.8 | 167.2 | 0 | 0 | 0 | 0 | 0 | 118.2 | A370 | A370-G372 PolarHBondContact O-N 2.69Š|
| 373 | Y | 45.5 | Very low | 54.6 | Low | 211 Ų | 211 | 130.6 Ų | 130.6 | 83% | 0.827 | 73% | 0.727 | S | S | * | * | trans | -95.2 | 128.2 | 170.8 | -86.3 | -87.2 | 0 | 0 | 0 | 111.8 | ||||
| 374 | P | 48.4 | Very low | 52.7 | Low | 111 Ų | 111 | 132.2 Ų | 132.2 | 72% | 0.721 | 75% | 0.748 | S | S | * | * | trans | -63.5 | 138.8 | 171.9 | 26.3 | -31.3 | 0 | 0 | 0 | 109.3 | S376 | P374-S376 PolarHBondContact O-N 2.9Š| ||
| 375 | A | 51.4 | Low | 50.9 | Low | 104 Ų | 104 | 131.8 Ų | 131.8 | 86% | 0.86 | 75% | 0.754 | S | S | * | * | trans | -54.2 | 102.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | H377 | A375-H377 PolarHBondContact O-N 3.33Å; A375-H377 VanDerWaalsContact O-N 3.11Å | ||
| 376 | S | 39.4 | Very low | 49.4 | Very low | 121 Ų | 121 | 130.9 Ų | 130.9 | 85% | 0.846 | 75% | 0.754 | S | S | * | * | trans | -64.2 | 115.9 | 172.8 | 179.7 | 0 | 0 | 0 | 0 | 107.7 | P374 | P374-S376 PolarHBondContact O-N 2.9Š| ||
| 377 | H | 44.5 | Very low | 47.9 | Very low | 163 Ų | 163 | 130.2 Ų | 130.2 | 76% | 0.755 | 76% | 0.764 | S | S | * | * | trans | -36.4 | 145.4 | 172.4 | -146.1 | -93.7 | 0 | 0 | 0 | 113.8 | A375 S379 | A375-H377 PolarHBondContact O-N 3.33Å; A375-H377 VanDerWaalsContact O-N 3.11Å; H377-S379 PolarHBondContact O-N 3.1Å | ||
| 378 | D | 50 | Low | 47 | Very low | 147 Ų | 147 | 129.3 Ų | 129.3 | 79% | 0.786 | 76% | 0.76 | S | S | * | * | trans | -36.6 | 111 | 178.9 | -61.6 | -65.9 | 0 | 0 | 0 | 114.6 | S380 | D378-S380 PolarHBondContact O-N 2.88Š| ||
| 379 | S | 38 | Very low | 46.4 | Very low | 115 Ų | 115 | 124.1 Ų | 124.1 | 80% | 0.804 | 76% | 0.756 | S | S | * | * | trans | -91.4 | 89.1 | 156.7 | 74.4 | 0 | 0 | 0 | 0 | 108.7 | H377 F381 | H377-S379 PolarHBondContact O-N 3.1Å; S379-F381 PolarHBondContact O-N 3.49Å | ||
| 380 | S | 40.3 | Very low | 45.9 | Very low | 107 Ų | 107 | 126.3 Ų | 126.3 | 75% | 0.748 | 78% | 0.779 | S | S | * | * | trans | -37.6 | 121.4 | 158.1 | 179 | 0 | 0 | 0 | 0 | 110.2 | D378 Q382 | D378-S380 PolarHBondContact O-N 2.88Å; S380-Q382 PolarHBondContact O-N 2.83Å; S380-Q382 VanDerWaalsContact O-N 3.1Å | ||
| 381 | F | 39.5 | Very low | 45.6 | Very low | 200 Ų | 200 | 127.7 Ų | 127.7 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -50.5 | 117.9 | 166.1 | -91.6 | -101.9 | 0 | 0 | 0 | 108.5 | S379 G383 | S379-F381 PolarHBondContact O-N 3.49Å; F381-G383 PolarHBondContact O-N 3.28Å |
| 382 | Q | 41.9 | Very low | 45.5 | Very low | 186 Ų | 186 | 127.5 Ų | 127.5 | 87% | 0.869 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 126.6 | 164 | -83.7 | -179.7 | -20.4 | 0 | 0 | 107.6 | S380 T384 | S380-Q382 PolarHBondContact O-N 2.83Å; S380-Q382 VanDerWaalsContact O-N 3.1Å; Q382-T384 PolarHBondContact O-N 3.35Å |
| 383 | G | 39.3 | Very low | 45.3 | Very low | 60 Ų | 60 | 132.2 Ų | 132.2 | 62% | 0.619 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -57 | 134.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | F381 D385 | F381-G383 PolarHBondContact O-N 3.28Å; G383-D385 PolarHBondContact O-N 2.89Å; G383-D385 VanDerWaalsContact O-N 3.1Å |
| 384 | T | 42.1 | Very low | 45.7 | Very low | 129 Ų | 129 | 130.2 Ų | 130.2 | 79% | 0.791 | 80% | 0.799 | S | S | * | * | trans | -66.7 | 102.5 | 158 | 47.5 | 0 | 0 | 0 | 0 | 106.7 | Q382 T386 | Q382-T384 PolarHBondContact O-N 3.35Å; T384-T386 VanDerWaalsContact C-N 3.29Å; T384-T386 PolarHBondContact O-N 3.02Å | ||
| 385 | D | 41.7 | Very low | 45.8 | Very low | 164 Ų | 164 | 133.1 Ų | 133.1 | 88% | 0.877 | 80% | 0.802 | S | S | * | * | trans | -62.2 | 93.9 | 167.6 | -67.5 | -38.8 | 0 | 0 | 0 | 108.1 | G383 D387 | G383-D385 PolarHBondContact O-N 2.89Å; G383-D385 VanDerWaalsContact O-N 3.1Å; D385-D387 PolarHBondContact O-N 2.9Å | ||
| 386 | T | 47.8 | Very low | 45.9 | Very low | 120 Ų | 120 | 134.5 Ų | 134.5 | 74% | 0.736 | 80% | 0.8 | S | S | * | * | trans | -74.2 | 107.2 | 162.7 | 41.6 | 0 | 0 | 0 | 0 | 107.7 | T384 S388 | T384-T386 VanDerWaalsContact C-N 3.29Å; T384-T386 PolarHBondContact O-N 3.02Å; T386-S388 PolarHBondContact O-N 2.81Å | ||
| 387 | D | 47.3 | Very low | 46.1 | Very low | 164 Ų | 164 | 138.8 Ų | 138.8 | 88% | 0.877 | 80% | 0.799 | S | S | * | * | trans | -61.6 | 88.7 | 162.3 | -174.4 | 2.9 | 0 | 0 | 0 | 108.4 | D385 | D385-D387 PolarHBondContact O-N 2.9Š| ||
| 388 | S | 46.7 | Very low | 46.2 | Very low | 99 Ų | 99 | 140.3 Ų | 140.3 | 69% | 0.692 | 83% | 0.826 | S | S | * | * | trans | -113.5 | 115.5 | 172.3 | -162.9 | 0 | 0 | 0 | 0 | 107.2 | T386 G390 | T386-S388 PolarHBondContact O-N 2.81Å; S388-G390 PolarHBondContact O-N 3.35Å | ||
| 389 | S | 47.7 | Very low | 46 | Very low | 111 Ų | 111 | 140 Ų | 140 | 78% | 0.776 | 83% | 0.828 | S | S | * | * | trans | -55.2 | 97.4 | -176.8 | 44.8 | 0 | 0 | 0 | 0 | 111.7 | A391 | S389-A391 PolarHBondContact O-N 3.38Š| ||
| 390 | G | 46.7 | Very low | 46.4 | Very low | 76 Ų | 76 | 141.3 Ų | 141.3 | 78% | 0.784 | 83% | 0.829 | S | S | * | * | trans | -66.3 | 97.4 | 168.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | S388 P392 | S388-G390 PolarHBondContact O-N 3.35Å; G390-P392 WeakPolarHBondContact O-CD 3.42Å | ||
| 391 | A | 49.9 | Very low | 46.7 | Very low | 92 Ų | 92 | 143.2 Ų | 143.2 | 76% | 0.76 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -83.5 | 117.4 | 163.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | S389 | S389-A391 PolarHBondContact O-N 3.38Š|
| 392 | P | 53.4 | Low | 47.1 | Very low | 123 Ų | 123 | 139.9 Ų | 139.9 | 80% | 0.799 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 130.1 | 175.4 | 29.4 | -31.5 | 0 | 0 | 0 | 110.7 | G390 L394 | G390-P392 WeakPolarHBondContact O-CD 3.42Å; P392-L394 PolarHBondContact O-N 3.45Å |
| 393 | L | 49.6 | Very low | 47.5 | Very low | 174 Ų | 174 | 137 Ų | 137 | 91% | 0.911 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 125.7 | 171.2 | -70.3 | 171.4 | 0 | 0 | 0 | 109.9 | Q395 | L393-Q395 PolarHBondContact O-N 3.49Š|
| 394 | L | 55.1 | Low | 48 | Very low | 169 Ų | 169 | 142.1 Ų | 142.1 | 89% | 0.885 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -59 | 121.5 | 173.6 | -77.9 | 163.9 | 0 | 0 | 0 | 110.7 | P392 V396 | P392-L394 PolarHBondContact O-N 3.45Å; L394-V396 PolarHBondContact O-N 3.33Å |
| 395 | Q | 49.5 | Very low | 48.4 | Very low | 171 Ų | 171 | 143.1 Ų | 143.1 | 80% | 0.799 | 85% | 0.847 | S | S | * | * | trans | -81 | 109.7 | 169.4 | -156.4 | 167.2 | 18.5 | 0 | 0 | 108.1 | L393 Y397 | L393-Q395 PolarHBondContact O-N 3.49Å; Q395-Y397 PolarHBondContact O-N 3.12Å | ||
| 396 | V | 52.7 | Low | 49 | Very low | 133 Ų | 133 | 141.5 Ų | 141.5 | 81% | 0.806 | 84% | 0.844 | S | S | * | * | trans | -72 | 117.2 | 169.9 | -175.6 | 0 | 0 | 0 | 0 | 107.2 | L394 | L394-V396 PolarHBondContact O-N 3.33Š| ||
| 397 | Y | 45.6 | Very low | 49.1 | Very low | 211 Ų | 211 | 143.3 Ų | 143.3 | 83% | 0.827 | 85% | 0.853 | S | S | * | * | trans | -69.7 | 134 | 171.2 | -94.1 | -98.8 | 0 | 0 | 0 | 110 | Q395 | Q395-Y397 PolarHBondContact O-N 3.12Š| ||
| 398 | C | 44.6 | Very low | 49.2 | Very low | 196 Ų | 196 | 141.4 Ų | 141.4 | 100% | 1.324 | 85% | 0.851 | S | S | * | * | trans | -109.8 | 0 | 151.8 | -73.6 | 0 | 0 | 0 | 0 | 108 |
Retrieved 398 of 398 residues in 265.2 ms
(Link to these results)