| 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 | 43.8 | Very low | 39.7 | Very low | 244 Ų | 244 | 144 Ų | 144 | 100% | 1.202 | 79% | 0.793 | S | S | * | * | 0 | 110 | 0 | -78.5 | -122.1 | 173.6 | 0 | 0 | 109.4 | |||||
| 2 | P | 32.8 | Very low | 40 | Very low | 126 Ų | 126 | 150.1 Ų | 150.1 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -127.2 | 118.2 | 154.8 | 27.1 | -8.7 | 0 | 0 | 0 | 112.8 | ||||
| 3 | S | 31.9 | Very low | 40.2 | Very low | 120 Ų | 120 | 150.2 Ų | 150.2 | 84% | 0.839 | 79% | 0.788 | S | S | * | * | trans | 36 | 104.2 | 138.3 | -54.3 | 0 | 0 | 0 | 0 | 121.4 | N5 | S3-N5 PolarHBondContact O-N 3.06Š| ||
| 4 | A | 39.8 | Very low | 40.4 | Very low | 104 Ų | 104 | 155.6 Ų | 155.6 | 86% | 0.86 | 79% | 0.793 | S | S | * | * | trans | -90.3 | 44.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 5 | N | 43.9 | Very low | 40.5 | Very low | 155 Ų | 155 | 154.8 Ų | 154.8 | 83% | 0.829 | 79% | 0.791 | S | S | * | * | trans | -115.7 | 6.2 | -174 | -94.9 | -3 | 0 | 0 | 0 | 117.3 | S3 | S3-N5 PolarHBondContact O-N 3.06Š| ||
| 6 | N | 40.2 | Very low | 40.9 | Very low | 131 Ų | 131 | 148.3 Ų | 148.3 | 70% | 0.701 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -110.3 | 5.5 | -174.2 | -127.2 | -10.4 | 0 | 0 | 0 | 116.4 | ||
| 7 | V | 39.8 | Very low | 41.5 | Very low | 126 Ų | 126 | 145.8 Ų | 145.8 | 76% | 0.764 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -94.8 | -21.9 | -178 | -176.2 | 0 | 0 | 0 | 0 | 112.4 | ||
| 8 | R | 40.1 | Very low | 41.8 | Very low | 234 Ų | 234 | 146.6 Ų | 146.6 | 88% | 0.883 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.6 | -22.8 | -174.5 | -120.5 | 176.5 | -175.9 | 172.9 | 0.8 | 114.6 | ||
| 9 | S | 40.4 | Very low | 41.9 | Very low | 70 Ų | 70 | 142.7 Ų | 142.7 | 49% | 0.49 | 75% | 0.748 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.4 | -39.9 | 178.6 | 53.3 | 0 | 0 | 0 | 0 | 112.5 | A11 R12 | S9-A11 VanDerWaalsContact C-N 3.28Å; S9-A11 PolarHBondContact O-N 3.13Å; S9-R12 PolarHBondContact O-N 2.51Å |
| 10 | R | 42.4 | Very low | 42.6 | Very low | 207 Ų | 207 | 142.7 Ų | 142.7 | 78% | 0.781 | 74% | 0.737 | S | S | * | * | H | α-helix | trans | -67.3 | -22.7 | 178.5 | -79.9 | -175.4 | 171.8 | 173.1 | -1.3 | 114.6 | ||
| 11 | A | 41.8 | Very low | 43.1 | Very low | 67 Ų | 67 | 141 Ų | 141 | 55% | 0.554 | 74% | 0.735 | S | S | * | * | H | α-helix | trans | -77.5 | -22.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | S9 | S9-A11 VanDerWaalsContact C-N 3.28Å; S9-A11 PolarHBondContact O-N 3.13Å |
| 12 | R | 43.2 | Very low | 43.4 | Very low | 217 Ų | 217 | 135.2 Ų | 135.2 | 82% | 0.819 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -86.1 | -30.9 | -175.7 | -160.5 | 172 | -176.4 | 170.3 | -0 | 113.1 | S9 R14 | S9-R12 PolarHBondContact O-N 2.51Å; R12-R14 VanDerWaalsContact C-N 3.33Å |
| 13 | E | 42 | Very low | 44 | Very low | 151 Ų | 151 | 135.1 Ų | 135.1 | 71% | 0.706 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -71.5 | -25.9 | 175.4 | -84.4 | -178.9 | 154.7 | 0 | 0 | 113.5 | N15 S16 | E13-N15 PolarHBondContact O-N 2.79Å; E13-S16 PolarHBondContact O-N 2.63Å |
| 14 | R | 44.1 | Very low | 44.6 | Very low | 226 Ų | 226 | 135.7 Ų | 135.7 | 85% | 0.853 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | -9.7 | -176.2 | -155.6 | 173.3 | 153.7 | -171.9 | -7.4 | 114.2 | R12 | R12-R14 VanDerWaalsContact C-N 3.33Š|
| 15 | N | 41.3 | Very low | 45 | Very low | 144 Ų | 144 | 135.1 Ų | 135.1 | 77% | 0.77 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.5 | 11.8 | 178.7 | -95.8 | -14.5 | 0 | 0 | 0 | 113.7 | E13 V17 | E13-N15 PolarHBondContact O-N 2.79Å; N15-V17 PolarHBondContact O-N 3.27Å |
| 16 | S | 46.4 | Very low | 45.1 | Very low | 50 Ų | 50 | 134.4 Ų | 134.4 | 35% | 0.35 | 67% | 0.668 | S | S | . | * | trans | -71.7 | 109.5 | 166.6 | 150.1 | 0 | 0 | 0 | 0 | 108.9 | E13 L18 S19 | E13-S16 PolarHBondContact O-N 2.63Å; S16-L18 PolarHBondContact O-N 3.14Å; S16-S19 VanDerWaalsContact CB-OG 3.25Å; S16-S19 WeakPolarHBondContact CB-OG 3.47Å; S16-S19 PolarHBondContact O-N 3.39Å; S16-S19 PolarHBondContact O-OG 2.88Å; S16-S19 PolarHBondContact OG-N 2.96Å; S16-S19 PolarHBondContact OG-OG 3.47Å | ||
| 17 | V | 50.8 | Low | 45.3 | Very low | 106 Ų | 106 | 135.3 Ų | 135.3 | 64% | 0.642 | 67% | 0.673 | S | S | * | * | G | 310 helix | trans | -60 | -24.2 | 176.9 | 178.8 | 0 | 0 | 0 | 0 | 111.5 | N15 | N15-V17 PolarHBondContact O-N 3.27Š|
| 18 | L | 47.2 | Very low | 45.4 | Very low | 160 Ų | 160 | 136.4 Ų | 136.4 | 84% | 0.838 | 67% | 0.67 | S | S | * | * | G | 310 helix | trans | -76.9 | -16.8 | -177.6 | -69 | 166.6 | 0 | 0 | 0 | 114.4 | S16 | S16-L18 PolarHBondContact O-N 3.14Š|
| 19 | S | 44.9 | Very low | 45.3 | Very low | 73 Ų | 73 | 133.9 Ų | 133.9 | 51% | 0.51 | 67% | 0.668 | S | S | . | * | G | 310 helix | trans | -102.3 | 14.9 | -175.8 | 41.7 | 0 | 0 | 0 | 0 | 113.5 | S16 | S16-S19 VanDerWaalsContact CB-OG 3.25Å; S16-S19 WeakPolarHBondContact CB-OG 3.47Å; S16-S19 PolarHBondContact O-N 3.39Å; S16-S19 PolarHBondContact O-OG 2.88Å; S16-S19 PolarHBondContact OG-N 2.96Å; S16-S19 PolarHBondContact OG-OG 3.47Å |
| 20 | R | 56.2 | Low | 45.1 | Very low | 143 Ų | 143 | 136.5 Ų | 136.5 | 54% | 0.54 | 68% | 0.683 | S | S | . | * | trans | -75.1 | 135.4 | 171.4 | -85.6 | -166.2 | -178.6 | -137.8 | 4.9 | 110.3 | E22 F23 | R20-E22 IonicContact NH1-OE1 3.19Å; R20-E22 PolarHBondContact NH1-OE1 3.49Å; R20-E22 PolarHBondContact O-N 3.43Å; R20-F23 HydrophobicContact CB-CD2 4.15Å; R20-F23 PolarHBondContact O-N 3.24Å | ||
| 21 | P | 51.8 | Low | 44.7 | Very low | 107 Ų | 107 | 134.8 Ų | 134.8 | 70% | 0.695 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.8 | -21.2 | 177.7 | 22.3 | -31.6 | 0 | 0 | 0 | 113 | F23 M24 | P21-F23 VanDerWaalsContact C-N 3.34Å; P21-F23 PolarHBondContact O-N 3.37Å; P21-M24 PolarHBondContact O-N 3.09Å |
| 22 | E | 49.6 | Very low | 44.3 | Very low | 122 Ų | 122 | 143.7 Ų | 143.7 | 57% | 0.57 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.7 | -20.2 | 178 | -54.5 | 178.9 | -120.7 | 0 | 0 | 114.2 | R20 | R20-E22 IonicContact NH1-OE1 3.19Å; R20-E22 PolarHBondContact NH1-OE1 3.49Å; R20-E22 PolarHBondContact O-N 3.43Å |
| 23 | F | 46 | Very low | 43.7 | Very low | 124 Ų | 124 | 137 Ų | 137 | 54% | 0.544 | 71% | 0.706 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -103.3 | -6.8 | 177.5 | -75.7 | -87.4 | 0 | 0 | 0 | 113.1 | R20 P21 | R20-F23 HydrophobicContact CB-CD2 4.15Å; R20-F23 PolarHBondContact O-N 3.24Å; P21-F23 VanDerWaalsContact C-N 3.34Å; P21-F23 PolarHBondContact O-N 3.37Å |
| 24 | M | 44.8 | Very low | 43.1 | Very low | 132 Ų | 132 | 133.5 Ų | 133.5 | 65% | 0.65 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -82.9 | -15.2 | -177.8 | -145.3 | 159.1 | 171.2 | 0 | 0 | 112.4 | P21 | P21-M24 PolarHBondContact O-N 3.09Š|
| 25 | S | 48.1 | Very low | 42.6 | Very low | 92 Ų | 92 | 128.7 Ų | 128.7 | 64% | 0.643 | 71% | 0.712 | S | S | * | * | G | 310 helix | trans | -83 | -5.7 | 179.3 | 62.6 | 0 | 0 | 0 | 0 | 114.6 | N27 | S25-N27 VanDerWaalsContact C-N 3.35Š|
| 26 | L | 45.5 | Very low | 42.2 | Very low | 140 Ų | 140 | 125.2 Ų | 125.2 | 73% | 0.733 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -85.8 | -4.4 | 177.1 | -78.9 | 164.1 | 0 | 0 | 0 | 113.7 | ||
| 27 | N | 43.9 | Very low | 41.8 | Very low | 151 Ų | 151 | 128.7 Ų | 128.7 | 81% | 0.807 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -124.2 | 15 | -174.5 | -106.6 | 11.7 | 0 | 0 | 0 | 115.6 | S25 | S25-N27 VanDerWaalsContact C-N 3.35Š|
| 28 | H | 42 | Very low | 41.2 | Very low | 149 Ų | 149 | 129.9 Ų | 129.9 | 69% | 0.69 | 74% | 0.742 | S | S | * | * | trans | -121.1 | 106.7 | 174.9 | -81.6 | -80 | 0 | 0 | 0 | 111.7 | ||||
| 29 | Q | 38.7 | Very low | 40.4 | Very low | 180 Ų | 180 | 131.8 Ų | 131.8 | 84% | 0.841 | 75% | 0.746 | S | S | * | * | trans | -62.9 | 143.4 | 156.4 | -97.6 | 173.8 | -27.3 | 0 | 0 | 109.6 | L31 | Q29-L31 PolarHBondContact O-N 3.15Š| ||
| 30 | P | 36 | Very low | 39.7 | Very low | 125 Ų | 125 | 135.6 Ų | 135.6 | 81% | 0.812 | 76% | 0.761 | S | S | * | * | trans | -75.4 | 112.4 | -178.2 | 29 | -31 | 0 | 0 | 0 | 110.5 | R32 | P30-R32 PolarHBondContact O-N 3.28Š| ||
| 31 | L | 34.1 | Very low | 38.4 | Very low | 171 Ų | 171 | 140.2 Ų | 140.2 | 90% | 0.895 | 78% | 0.779 | S | S | * | * | trans | -66.3 | 119.1 | 161.8 | -92 | 133.9 | 0 | 0 | 0 | 109.1 | Q29 G33 | Q29-L31 PolarHBondContact O-N 3.15Å; L31-G33 PolarHBondContact O-N 3.08Å | ||
| 32 | R | 34 | Very low | 37.2 | Very low | 254 Ų | 254 | 141.5 Ų | 141.5 | 96% | 0.958 | 79% | 0.789 | S | S | * | * | trans | -70.9 | 115.4 | 172.2 | -167 | -178.8 | -172.1 | -175.3 | 2.1 | 108.7 | P30 | P30-R32 PolarHBondContact O-N 3.28Š| ||
| 33 | G | 30.6 | Very low | 35.9 | Very low | 76 Ų | 76 | 139 Ų | 139 | 78% | 0.784 | 80% | 0.796 | S | S | * | * | trans | -179.9 | 116.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | L31 | L31-G33 PolarHBondContact O-N 3.08Š| ||
| 34 | G | 29.9 | Very low | 35.7 | Very low | 79 Ų | 79 | 138.7 Ų | 138.7 | 81% | 0.814 | 81% | 0.806 | S | S | * | * | trans | -89.7 | 168.1 | -165.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 35 | S | 32.5 | Very low | 34.9 | Very low | 124 Ų | 124 | 141.1 Ų | 141.1 | 87% | 0.867 | 81% | 0.813 | S | S | * | * | trans | -179.3 | 133.9 | 148.2 | 49.2 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 36 | G | 32.9 | Very low | 33.9 | Very low | 71 Ų | 71 | 148.2 Ų | 148.2 | 73% | 0.732 | 83% | 0.826 | S | S | * | * | trans | -70.1 | -174.4 | -171 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 37 | P | 38.1 | Very low | 33 | Very low | 123 Ų | 123 | 145.9 Ų | 145.9 | 80% | 0.799 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -81.1 | 157.9 | -165.3 | 33.1 | -34.6 | 0 | 0 | 0 | 113.2 | ||
| 38 | P | 38 | Very low | 32.8 | Very low | 131 Ų | 131 | 144.1 Ų | 144.1 | 85% | 0.851 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 124.6 | 175.6 | 33.7 | -27.7 | 0 | 0 | 0 | 110.8 | ||
| 39 | E | 31.7 | Very low | 32.1 | Very low | 200 Ų | 200 | 145.9 Ų | 145.9 | 94% | 0.935 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -102.6 | 146.4 | 162.6 | -84.2 | -169.6 | 134.1 | 0 | 0 | 110.9 | ||
| 40 | N | 29.1 | Very low | 31.4 | Very low | 154 Ų | 154 | 142.6 Ų | 142.6 | 82% | 0.824 | 82% | 0.824 | S | S | * | * | trans | -119.8 | 118.4 | -170.8 | -161.5 | 14.9 | 0 | 0 | 0 | 107.4 | ||||
| 41 | R | 29 | Very low | 30.9 | Very low | 240 Ų | 240 | 145.2 Ų | 145.2 | 91% | 0.906 | 82% | 0.823 | S | S | * | * | trans | 166.5 | 134.5 | 146.4 | -96 | 167.1 | -173 | -164.2 | 2.6 | 115.7 | ||||
| 42 | C | 26 | Very low | 30.6 | Very low | 134 Ų | 134 | 144 Ų | 144 | 91% | 0.905 | 81% | 0.812 | S | S | * | * | trans | 62 | 125.1 | 145 | -97.8 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 43 | G | 24.1 | Very low | 30.4 | Very low | 70 Ų | 70 | 139.7 Ų | 139.7 | 72% | 0.722 | 80% | 0.803 | S | S | * | * | trans | -81.7 | -149.5 | 164.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 44 | P | 41.1 | Very low | 30.1 | Very low | 116 Ų | 116 | 140.1 Ų | 140.1 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | cis | -137.1 | 175.3 | -5.9 | 34 | -12.1 | 0 | 0 | 0 | 115.9 | ||||
| 45 | K | 26.9 | Very low | 30 | Very low | 183 Ų | 183 | 143.7 Ų | 143.7 | 80% | 0.796 | 80% | 0.798 | S | S | * | * | trans | 124.5 | 127.9 | 140.5 | -70.8 | 180 | -179.9 | 175.3 | 0 | 119.6 | ||||
| 46 | R | 28.2 | Very low | 29.7 | Very low | 242 Ų | 242 | 145.6 Ų | 145.6 | 91% | 0.913 | 79% | 0.793 | S | S | * | * | trans | 81.7 | 119.9 | 141.8 | -80.9 | 179.4 | 173.3 | 175 | -3.6 | 121.5 | ||||
| 47 | A | 26.6 | Very low | 29.3 | Very low | 90 Ų | 90 | 150.4 Ų | 150.4 | 74% | 0.744 | 79% | 0.794 | S | S | * | * | trans | -81 | -165.1 | 161.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 48 | P | 39.4 | Very low | 28.7 | Very low | 115 Ų | 115 | 149.7 Ų | 149.7 | 75% | 0.747 | 79% | 0.792 | S | S | * | * | cis | -134.2 | 173.7 | -16.1 | 35.7 | -17 | 0 | 0 | 0 | 114 | ||||
| 49 | Q | 26.6 | Very low | 28.2 | Very low | 185 Ų | 185 | 152.6 Ų | 152.6 | 86% | 0.864 | 79% | 0.794 | S | S | * | * | trans | 171.8 | 119.4 | 134.3 | -96.6 | 175.8 | -9 | 0 | 0 | 116 | ||||
| 50 | T | 25.1 | Very low | 27.9 | Very low | 112 Ų | 112 | 151.7 Ų | 151.7 | 69% | 0.687 | 79% | 0.79 | S | S | * | * | trans | 20.2 | 134.7 | 135.4 | 30.9 | 0 | 0 | 0 | 0 | 125.9 | ||||
| 51 | K | 26 | Very low | 28.4 | Very low | 180 Ų | 180 | 149.3 Ų | 149.3 | 78% | 0.783 | 78% | 0.783 | S | S | * | * | 86.2 | 115.6 | 129.5 | -79 | -178.2 | 180 | -176 | 0 | 121.7 | |||||
| 52 | H | 27.8 | Very low | 28.3 | Very low | 144 Ų | 144 | 143.7 Ų | 143.7 | 67% | 0.667 | 78% | 0.775 | S | S | * | * | 167.6 | 121.5 | 109.2 | -101.5 | 80.7 | 0 | 0 | 0 | 111.8 | |||||
| 53 | Q | 28.1 | Very low | 28.3 | Very low | 164 Ų | 164 | 146.6 Ų | 146.6 | 77% | 0.766 | 78% | 0.775 | S | S | * | * | 66.3 | 109 | 115.8 | -77.3 | -176.6 | 1.2 | 0 | 0 | 116.7 | |||||
| 54 | A | 25.5 | Very low | 28.5 | Very low | 86 Ų | 86 | 147.1 Ų | 147.1 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | 81.5 | 118.4 | 88.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 55 | I | 27.7 | Very low | 27.8 | Very low | 154 Ų | 154 | 145.5 Ų | 145.5 | 79% | 0.79 | 79% | 0.786 | S | S | * | * | 173.6 | 119.2 | 88.9 | -76.8 | 155.8 | 0 | 0 | 0 | 104.3 | |||||
| 56 | Q | 26.2 | Very low | 27.9 | Very low | 164 Ų | 164 | 142 Ų | 142 | 77% | 0.766 | 78% | 0.784 | S | S | * | * | 76.7 | 128.3 | 78.2 | -147.4 | 176.2 | 10.7 | 0 | 0 | 117.4 | |||||
| 57 | K | 25.2 | Very low | 28.2 | Very low | 171 Ų | 171 | 139.6 Ų | 139.6 | 74% | 0.743 | 78% | 0.78 | S | S | * | * | trans | 74.7 | 117.5 | 164.6 | -83 | 168.9 | 173.2 | -169.9 | 0 | 117.6 | ||||
| 58 | S | 24.9 | Very low | 28.6 | Very low | 108 Ų | 108 | 143.2 Ų | 143.2 | 76% | 0.755 | 79% | 0.787 | S | S | * | * | 62.9 | 107 | 55.4 | -57.7 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 59 | E | 27 | Very low | 28.4 | Very low | 193 Ų | 193 | 148 Ų | 148 | 90% | 0.902 | 79% | 0.791 | S | S | * | * | trans | 175.8 | 121.9 | 138.2 | -95.5 | 162.9 | -165.5 | 0 | 0 | 111.6 | ||||
| 60 | E | 25.6 | Very low | 28.8 | Very low | 181 Ų | 181 | 151.2 Ų | 151.2 | 85% | 0.846 | 80% | 0.795 | S | S | * | * | trans | -83.7 | -179.1 | 153.9 | -85.3 | -164.2 | 154.2 | 0 | 0 | 109.3 | ||||
| 61 | P | 40.4 | Very low | 29.2 | Very low | 104 Ų | 104 | 153.3 Ų | 153.3 | 68% | 0.675 | 80% | 0.796 | S | S | * | * | cis | -121.9 | -179.4 | -15 | 23.9 | 0.7 | 0 | 0 | 0 | 110.3 | ||||
| 62 | T | 26.3 | Very low | 29.6 | Very low | 121 Ų | 121 | 149.5 Ų | 149.5 | 74% | 0.742 | 79% | 0.792 | S | S | * | * | 168.9 | 148.6 | 72.4 | -17.4 | 0 | 0 | 0 | 0 | 109.6 | |||||
| 63 | E | 26.4 | Very low | 29.9 | Very low | 195 Ų | 195 | 149 Ų | 149 | 91% | 0.911 | 80% | 0.8 | S | S | * | * | trans | 54.1 | 131.1 | 151 | -59.6 | -132.6 | 141.9 | 0 | 0 | 124.1 | ||||
| 64 | G | 27 | Very low | 30.1 | Very low | 81 Ų | 81 | 150.1 Ų | 150.1 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | trans | 166.8 | 86.1 | 161 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 65 | G | 26.8 | Very low | 30.3 | Very low | 83 Ų | 83 | 153.1 Ų | 153.1 | 86% | 0.856 | 80% | 0.803 | S | S | * | * | trans | -67.6 | 156.3 | -170 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 66 | S | 29.4 | Very low | 30.8 | Very low | 109 Ų | 109 | 150.9 Ų | 150.9 | 76% | 0.762 | 80% | 0.799 | S | S | * | * | trans | -165.2 | 129.2 | 152.9 | -169.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 67 | K | 34.1 | Very low | 31.9 | Very low | 191 Ų | 191 | 152.5 Ų | 152.5 | 83% | 0.83 | 81% | 0.806 | S | S | * | * | trans | 73.5 | 100.8 | 154.4 | -82.7 | 175.6 | 171.1 | 175.6 | 0 | 119.9 | R69 | K67-R69 PolarHBondContact O-N 3.46Š| ||
| 68 | D | 34.3 | Very low | 33.1 | Very low | 167 Ų | 167 | 152.1 Ų | 152.1 | 89% | 0.893 | 81% | 0.807 | S | S | * | * | trans | -23.5 | 113.8 | 142.2 | -85.3 | -50.5 | 0 | 0 | 0 | 114 | ||||
| 69 | R | 35 | Very low | 34.1 | Very low | 216 Ų | 216 | 154 Ų | 154 | 82% | 0.815 | 81% | 0.809 | S | S | * | * | trans | -127.8 | 97.4 | 151 | -160.8 | 175.8 | -175.4 | -179.9 | -1.1 | 107.5 | K67 E71 | K67-R69 PolarHBondContact O-N 3.46Å; R69-E71 PolarHBondContact O-N 2.94Å | ||
| 70 | R | 36.7 | Very low | 35 | Very low | 252 Ų | 252 | 151.2 Ų | 151.2 | 95% | 0.951 | 81% | 0.809 | S | S | * | * | trans | -65 | 85.6 | 171.5 | -147.4 | 178.3 | -163.8 | -176 | 4.3 | 107.9 | S72 | R70-S72 PolarHBondContact O-N 3.1Š| ||
| 71 | E | 31.8 | Very low | 36.4 | Very low | 155 Ų | 155 | 149 Ų | 149 | 72% | 0.724 | 80% | 0.8 | S | S | * | * | trans | -78.4 | 109.6 | 170.5 | -122.9 | 171 | -165 | 0 | 0 | 107.4 | R69 T73 | R69-E71 PolarHBondContact O-N 2.94Å; E71-T73 PolarHBondContact O-N 3.25Å | ||
| 72 | S | 35.1 | Very low | 36.7 | Very low | 100 Ų | 100 | 152.9 Ų | 152.9 | 70% | 0.699 | 81% | 0.809 | S | S | * | * | trans | -63.2 | 111 | 172.7 | 90.9 | 0 | 0 | 0 | 0 | 107.2 | R70 K74 | R70-S72 PolarHBondContact O-N 3.1Å; S72-K74 PolarHBondContact O-N 2.92Å | ||
| 73 | T | 33.8 | Very low | 38.2 | Very low | 134 Ų | 134 | 153.8 Ų | 153.8 | 82% | 0.822 | 81% | 0.809 | S | S | * | * | trans | -65.8 | 83.7 | 167.2 | -45.5 | 0 | 0 | 0 | 0 | 107.7 | E71 M75 | E71-T73 PolarHBondContact O-N 3.25Å; T73-M75 PolarHBondContact O-N 3.44Å | ||
| 74 | K | 32.7 | Very low | 39.6 | Very low | 188 Ų | 188 | 151.2 Ų | 151.2 | 82% | 0.817 | 80% | 0.801 | S | S | * | * | trans | -79.5 | 96.2 | 167.7 | -132.2 | -178.8 | -177 | -173.9 | 0 | 105.4 | S72 | S72-K74 PolarHBondContact O-N 2.92Š| ||
| 75 | M | 29 | Very low | 41.3 | Very low | 149 Ų | 149 | 151 Ų | 151 | 73% | 0.734 | 79% | 0.785 | S | S | * | * | trans | -57.1 | 141.1 | 167.2 | -60.6 | -157 | -58.1 | 0 | 0 | 108.2 | T73 E77 | T73-M75 PolarHBondContact O-N 3.44Å; M75-E77 PolarHBondContact O-N 3.01Å | ||
| 76 | P | 38.6 | Very low | 43.9 | Very low | 107 Ų | 107 | 150.2 Ų | 150.2 | 70% | 0.695 | 77% | 0.767 | S | S | * | * | trans | -63.5 | 111.2 | 165 | -6.5 | 20.9 | 0 | 0 | 0 | 106.7 | E78 | P76-E78 HydrophobicContact CB-CB 4.33Å; P76-E78 HydrophobicContact CB-CG 4.41Å; P76-E78 PolarHBondContact O-N 2.99Å | ||
| 77 | E | 49.5 | Very low | 46.4 | Very low | 198 Ų | 198 | 153.4 Ų | 153.4 | 93% | 0.925 | 77% | 0.767 | S | S | * | * | trans | -70.3 | 66.8 | 162.1 | -71.9 | 179.5 | 151 | 0 | 0 | 108.1 | M75 | M75-E77 PolarHBondContact O-N 3.01Š| ||
| 78 | E | 51.3 | Low | 48.7 | Very low | 162 Ų | 162 | 152 Ų | 152 | 76% | 0.757 | 76% | 0.761 | S | S | * | * | trans | -131 | 57.2 | 176.2 | -70.5 | -178.3 | 162.3 | 0 | 0 | 108.1 | P76 | P76-E78 HydrophobicContact CB-CB 4.33Å; P76-E78 HydrophobicContact CB-CG 4.41Å; P76-E78 PolarHBondContact O-N 2.99Å | ||
| 79 | D | 45.7 | Very low | 51 | Low | 149 Ų | 149 | 145.2 Ų | 145.2 | 80% | 0.797 | 73% | 0.731 | S | S | * | * | trans | -169.4 | 42.9 | 158.7 | -106.3 | -17 | 0 | 0 | 0 | 113.2 | M81 | D79-M81 PolarHBondContact O-N 3.02Š| ||
| 80 | C | 44.6 | Very low | 53.4 | Low | 133 Ų | 133 | 138.9 Ų | 138.9 | 90% | 0.899 | 71% | 0.712 | S | S | * | * | trans | -75 | 82.8 | 150.9 | -77 | 0 | 0 | 0 | 0 | 107.1 | Q82 | C80-Q82 PolarHBondContact O-N 2.89Š| ||
| 81 | M | 55 | Low | 55.7 | Low | 134 Ų | 134 | 128.4 Ų | 128.4 | 66% | 0.66 | 68% | 0.68 | S | S | * | * | trans | -45.4 | 105.9 | 162.9 | -76 | 176.4 | 80.6 | 0 | 0 | 107.5 | D79 L83 | D79-M81 PolarHBondContact O-N 3.02Å; M81-L83 HydrophobicContact CB-CD2 4.4Å; M81-L83 HydrophobicContact CB-CG 4.04Å; M81-L83 HydrophobicContact CE-CD2 3.91Å; M81-L83 PolarHBondContact O-N 3.28Å | ||
| 82 | Q | 48.1 | Very low | 58.2 | Low | 186 Ų | 186 | 125.6 Ų | 125.6 | 87% | 0.869 | 67% | 0.668 | S | S | * | * | trans | -73 | 82 | 173.2 | -147.9 | 167.8 | 18.5 | 0 | 0 | 106.7 | C80 N84 | C80-Q82 PolarHBondContact O-N 2.89Å; Q82-N84 PolarHBondContact O-N 3.5Å | ||
| 83 | L | 57.8 | Low | 60.7 | Low | 141 Ų | 141 | 126.2 Ų | 126.2 | 74% | 0.738 | 66% | 0.663 | S | S | * | * | trans | -68.3 | 16.2 | -175.9 | -75.5 | 167.6 | 0 | 0 | 0 | 114 | M81 P85 | M81-L83 HydrophobicContact CB-CD2 4.4Å; M81-L83 HydrophobicContact CB-CG 4.04Å; M81-L83 HydrophobicContact CE-CD2 3.91Å; M81-L83 PolarHBondContact O-N 3.28Å; L83-P85 WeakPolarHBondContact O-CD 3.29Å | ||
| 84 | N | 54.4 | Low | 63.2 | Low | 140 Ų | 140 | 122.6 Ų | 122.6 | 75% | 0.749 | 64% | 0.644 | S | S | * | * | trans | -114.4 | 70.3 | 173.2 | -157.6 | -0.9 | 0 | 0 | 0 | 109.7 | Q82 S86 | Q82-N84 PolarHBondContact O-N 3.5Å; N84-S86 PolarHBondContact O-N 3.28Å | ||
| 85 | P | 64.3 | Low | 65.7 | Low | 76 Ų | 76 | 118.4 Ų | 118.4 | 49% | 0.494 | 63% | 0.63 | S | S | . | * | trans | -57.4 | 116.5 | 164.3 | 25.1 | -28.8 | 0 | 0 | 0 | 106.2 | L83 F87 I90 | L83-P85 WeakPolarHBondContact O-CD 3.29Å; P85-F87 PolarHBondContact O-N 3.48Å; P85-I90 HydrophobicContact CB-CD1 4.37Å; P85-I90 HydrophobicContact CB-CG1 3.87Å; P85-I90 HydrophobicContact CG-CD1 3.97Å; P85-I90 HydrophobicContact CG-CG1 3.95Å | ||
| 86 | S | 81.5 | Confident | 68.3 | Low | 68 Ų | 68 | 115.5 Ų | 115.5 | 48% | 0.476 | 62% | 0.616 | S | S | . | * | trans | -48.5 | 141 | 178.8 | 67.1 | 0 | 0 | 0 | 0 | 109.3 | N84 K88 G89 I90 | N84-S86 PolarHBondContact O-N 3.28Å; S86-K88 CarbonylContact O-C 3.57Å; S86-K88 PolarHBondContact O-N 2.86Å; S86-G89 WeakPolarHBondContact O-CA 3.5Å; S86-G89 PolarHBondContact O-N 3.13Å; S86-G89 PolarHBondContact OG-N 3.49Å; S86-I90 PolarHBondContact O-N 3.05Å | ||
| 87 | F | 80.1 | Confident | 70.6 | Confident | 176 Ų | 176 | 113.1 Ų | 113.1 | 77% | 0.772 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -47.8 | -35.5 | 175.4 | 176.4 | -100.6 | 0 | 0 | 0 | 111.5 | P85 I90 A91 | P85-F87 PolarHBondContact O-N 3.48Å; F87-I90 PolarHBondContact O-N 2.82Å; F87-A91 VanDerWaalsContact O-CB 3.29Å; F87-A91 WeakPolarHBondContact O-CB 3.44Å; F87-A91 PolarHBondContact O-N 3.3Å |
| 88 | K | 83.3 | Confident | 72.3 | Confident | 160 Ų | 160 | 108.5 Ų | 108.5 | 70% | 0.696 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -58.4 | -47.8 | 171.7 | -174.9 | 179.2 | 178.4 | -177.5 | 0 | 113.2 | S86 A91 M92 | S86-K88 CarbonylContact O-C 3.57Å; S86-K88 PolarHBondContact O-N 2.86Å; K88-A91 PolarHBondContact O-N 2.84Å; K88-M92 WeakPolarHBondContact O-CB 2.94Å; K88-M92 VanDerWaalsContact O-CG 3.25Å; K88-M92 WeakPolarHBondContact O-CG 3.49Å; K88-M92 PolarHBondContact O-N 3.46Å |
| 89 | G | 82.1 | Confident | 74.1 | Confident | 25 Ų | 25 | 101.3 Ų | 101.3 | 26% | 0.258 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.6 | -42.2 | 178 | 0 | 0 | 0 | 0 | 0 | 112.9 | S86 M92 N93 | S86-G89 WeakPolarHBondContact O-CA 3.5Å; S86-G89 PolarHBondContact O-N 3.13Å; S86-G89 PolarHBondContact OG-N 3.49Å; G89-M92 PolarHBondContact O-N 3.05Å; G89-N93 WeakPolarHBondContact O-CB 3.39Å; G89-N93 VanDerWaalsContact O-CG 3.29Å; G89-N93 PolarHBondContact O-N 3.45Å; G89-N93 PolarHBondContact O-ND2 2.95Å |
| 90 | I | 85.7 | Confident | 76 | Confident | 83 Ų | 83 | 97.4 Ų | 97.4 | 43% | 0.426 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.1 | -50.5 | 174.8 | -55.5 | 174 | 0 | 0 | 0 | 109.8 | P85 S86 F87 M92 N93 S94 | P85-I90 HydrophobicContact CB-CD1 4.37Å; P85-I90 HydrophobicContact CB-CG1 3.87Å; P85-I90 HydrophobicContact CG-CD1 3.97Å; P85-I90 HydrophobicContact CG-CG1 3.95Å; S86-I90 PolarHBondContact O-N 3.05Å; F87-I90 PolarHBondContact O-N 2.82Å; I90-M92 VanDerWaalsContact C-N 3.34Å; I90-M92 PolarHBondContact O-N 3.5Å; I90-N93 PolarHBondContact O-N 3.41Å; I90-S94 PolarHBondContact O-N 2.92Å; I90-S94 PolarHBondContact O-OG 3.13Å; I90-S94 VanDerWaalsContact O-OG 3.07Å |
| 91 | A | 86 | Confident | 77.9 | Confident | 32 Ų | 32 | 94.4 Ų | 94.4 | 26% | 0.264 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60 | -42 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | F87 K88 S94 L95 | F87-A91 VanDerWaalsContact O-CB 3.29Å; F87-A91 WeakPolarHBondContact O-CB 3.44Å; F87-A91 PolarHBondContact O-N 3.3Å; K88-A91 PolarHBondContact O-N 2.84Å; A91-S94 PolarHBondContact O-N 3.48Å; A91-L95 WeakPolarHBondContact O-CG 3.41Å; A91-L95 PolarHBondContact O-N 3.39Å |
| 92 | M | 84.8 | Confident | 79.3 | Confident | 96 Ų | 96 | 91 Ų | 91 | 47% | 0.473 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.2 | -45.8 | 176.3 | -72.8 | -60.1 | 99.5 | 0 | 0 | 112.1 | K88 G89 I90 S94 L95 L96 | K88-M92 WeakPolarHBondContact O-CB 2.94Å; K88-M92 VanDerWaalsContact O-CG 3.25Å; K88-M92 WeakPolarHBondContact O-CG 3.49Å; K88-M92 PolarHBondContact O-N 3.46Å; G89-M92 PolarHBondContact O-N 3.05Å; I90-M92 VanDerWaalsContact C-N 3.34Å; I90-M92 PolarHBondContact O-N 3.5Å; M92-S94 VanDerWaalsContact C-N 3.31Å; M92-S94 PolarHBondContact O-N 2.73Å; M92-L95 HydrophobicContact CE-CD1 3.64Å; M92-L95 PolarHBondContact O-N 3.16Å; M92-L96 WeakPolarHBondContact O-CG 3.45Å; M92-L96 PolarHBondContact O-N 3.2Å |
| 93 | N | 86.2 | Confident | 81.2 | Confident | 113 Ų | 113 | 82.2 Ų | 82.2 | 60% | 0.604 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -64.2 | -38.3 | 178.1 | -70.5 | -13.4 | 0 | 0 | 0 | 111.7 | G89 I90 A97 | G89-N93 WeakPolarHBondContact O-CB 3.39Å; G89-N93 VanDerWaalsContact O-CG 3.29Å; G89-N93 PolarHBondContact O-N 3.45Å; G89-N93 PolarHBondContact O-ND2 2.95Å; I90-N93 PolarHBondContact O-N 3.41Å; N93-A97 WeakPolarHBondContact O-CB 3.36Å; N93-A97 PolarHBondContact O-N 3.32Å |
| 94 | S | 86.6 | Confident | 82.3 | Confident | 59 Ų | 59 | 80.4 Ų | 80.4 | 41% | 0.413 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -64.6 | -44.5 | 174.2 | -60.9 | 0 | 0 | 0 | 0 | 112.3 | I90 A91 M92 L96 A97 I98 | I90-S94 PolarHBondContact O-N 2.92Å; I90-S94 PolarHBondContact O-OG 3.13Å; I90-S94 VanDerWaalsContact O-OG 3.07Å; A91-S94 PolarHBondContact O-N 3.48Å; M92-S94 VanDerWaalsContact C-N 3.31Å; M92-S94 PolarHBondContact O-N 2.73Å; S94-L96 PolarHBondContact O-N 3.34Å; S94-A97 PolarHBondContact O-N 3.25Å; S94-I98 WeakPolarHBondContact O-CD1 3.4Å; S94-I98 VanDerWaalsContact O-CG1 3.22Å; S94-I98 WeakPolarHBondContact O-CG1 3.25Å; S94-I98 PolarHBondContact O-N 3.2Å |
| 95 | L | 84.7 | Confident | 83.7 | Confident | 100 Ų | 100 | 82.9 Ų | 82.9 | 52% | 0.524 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63.1 | -41.8 | 177.1 | -74.5 | 174.7 | 0 | 0 | 0 | 112 | A91 M92 I98 D99 | A91-L95 WeakPolarHBondContact O-CG 3.41Å; A91-L95 PolarHBondContact O-N 3.39Å; M92-L95 HydrophobicContact CE-CD1 3.64Å; M92-L95 PolarHBondContact O-N 3.16Å; L95-I98 PolarHBondContact O-N 3.39Å; L95-D99 WeakPolarHBondContact O-CB 3.4Å; L95-D99 PolarHBondContact O-N 3.07Å |
| 96 | L | 85 | Confident | 84.6 | Confident | 87 Ų | 87 | 81.4 Ų | 81.4 | 46% | 0.455 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -62.4 | -42.8 | 174.8 | -73.3 | 171.7 | 0 | 0 | 0 | 111.7 | M92 S94 I98 D99 I100 | M92-L96 WeakPolarHBondContact O-CG 3.45Å; M92-L96 PolarHBondContact O-N 3.2Å; S94-L96 PolarHBondContact O-N 3.34Å; L96-I98 VanDerWaalsContact C-N 3.34Å; L96-I98 PolarHBondContact O-N 2.92Å; L96-D99 PolarHBondContact O-N 2.98Å; L96-I100 VanDerWaalsContact O-CG1 3.29Å; L96-I100 WeakPolarHBondContact O-CG1 3.38Å; L96-I100 PolarHBondContact O-N 3.28Å |
| 97 | A | 86.3 | Confident | 84.6 | Confident | 57 Ų | 57 | 78.3 Ų | 78.3 | 47% | 0.471 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -63.5 | -40.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | N93 S94 I100 C101 | N93-A97 WeakPolarHBondContact O-CB 3.36Å; N93-A97 PolarHBondContact O-N 3.32Å; S94-A97 PolarHBondContact O-N 3.25Å; A97-I100 PolarHBondContact O-N 3.46Å; A97-C101 VanDerWaalsContact O-CB 3.25Å; A97-C101 WeakPolarHBondContact O-CB 3.12Å; A97-C101 PolarHBondContact O-N 3.24Å |
| 98 | I | 86.1 | Confident | 84.8 | Confident | 102 Ų | 102 | 71.7 Ų | 71.7 | 52% | 0.523 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.5 | -46.5 | 175.2 | -68.6 | 163 | 0 | 0 | 0 | 110.5 | S94 L95 L96 I100 C101 L102 | S94-I98 WeakPolarHBondContact O-CD1 3.4Å; S94-I98 VanDerWaalsContact O-CG1 3.22Å; S94-I98 WeakPolarHBondContact O-CG1 3.25Å; S94-I98 PolarHBondContact O-N 3.2Å; L95-I98 PolarHBondContact O-N 3.39Å; L96-I98 VanDerWaalsContact C-N 3.34Å; L96-I98 PolarHBondContact O-N 2.92Å; I98-I100 PolarHBondContact O-N 2.91Å; I98-C101 PolarHBondContact O-N 3.36Å; I98-L102 VanDerWaalsContact O-CB 3.22Å; I98-L102 WeakPolarHBondContact O-CB 3.4Å; I98-L102 PolarHBondContact O-N 2.92Å |
| 99 | D | 89.1 | Confident | 84.8 | Confident | 11 Ų | 11 | 64.1 Ų | 64.1 | 6% | 0.059 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -58.6 | -46.6 | 177.4 | 177.9 | 47.9 | 0 | 0 | 0 | 111.5 | L95 L96 L102 S103 R178 H246 L247 T248 | L95-D99 WeakPolarHBondContact O-CB 3.4Å; L95-D99 PolarHBondContact O-N 3.07Å; L96-D99 PolarHBondContact O-N 2.98Å; D99-L102 PolarHBondContact O-N 2.93Å; D99-S103 WeakPolarHBondContact O-CB 3.1Å; D99-S103 PolarHBondContact O-N 2.73Å; D99-S103 PolarHBondContact O-OG 3.15Å; D99-S103 PolarHBondContact OD1-OG 2.99Å; D99-R178 IonicContact OD2-NH2 3.33Å; D99-R178 PolarHBondContact OD2-NH2 3.22Å; D99-H246 WeakPolarHBondContact OD2-CB 3.37Å; D99-L247 WeakPolarHBondContact OD1-CB 3.19Å; D99-L247 PolarHBondContact OD1-N 3.28Å; D99-T248 HydrophobicContact CB-CG2 3.96Å; D99-T248 WeakPolarHBondContact OD1-CG2 3.22Å; D99-T248 PolarHBondContact OD1-N 2.96Å; D99-T248 WeakPolarHBondContact OD2-CB 3.4Å; D99-T248 VanDerWaalsContact OD2-CG2 3.3Å; D99-T248 WeakPolarHBondContact OD2-CG2 3.5Å; D99-T248 PolarHBondContact OD2-OG1 2.83Å |
| 100 | I | 84.9 | Confident | 84.7 | Confident | 67 Ų | 67 | 63.1 Ų | 63.1 | 34% | 0.344 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.4 | -45.7 | 177.7 | -67.9 | 166.4 | 0 | 0 | 0 | 110.7 | L96 A97 I98 S103 K104 | L96-I100 VanDerWaalsContact O-CG1 3.29Å; L96-I100 WeakPolarHBondContact O-CG1 3.38Å; L96-I100 PolarHBondContact O-N 3.28Å; A97-I100 PolarHBondContact O-N 3.46Å; I98-I100 PolarHBondContact O-N 2.91Å; I100-S103 PolarHBondContact O-N 3.49Å; I100-K104 HydrophobicContact CG2-CD 4.27Å; I100-K104 WeakPolarHBondContact O-CB 3.38Å; I100-K104 WeakPolarHBondContact O-CG 3.46Å; I100-K104 PolarHBondContact O-N 2.89Å |
| 101 | C | 85.1 | Confident | 84.2 | Confident | 69 Ų | 69 | 61.1 Ų | 61.1 | 47% | 0.466 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -61.7 | -47.4 | 179.1 | -177.9 | 0 | 0 | 0 | 0 | 111.3 | A97 I98 K104 R105 | A97-C101 VanDerWaalsContact O-CB 3.25Å; A97-C101 WeakPolarHBondContact O-CB 3.12Å; A97-C101 PolarHBondContact O-N 3.24Å; I98-C101 PolarHBondContact O-N 3.36Å; C101-K104 PolarHBondContact O-N 2.95Å; C101-R105 WeakPolarHBondContact O-CB 3.45Å; C101-R105 VanDerWaalsContact O-CG 3.3Å; C101-R105 WeakPolarHBondContact O-CG 3.42Å; C101-R105 PolarHBondContact O-N 3.04Å |
| 102 | L | 83.9 | Confident | 83.6 | Confident | 64 Ų | 64 | 66 Ų | 66 | 34% | 0.335 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -65.1 | -45 | 179.6 | -174.6 | 61.4 | 0 | 0 | 0 | 111.2 | I98 D99 K104 R105 M106 L247 | I98-L102 VanDerWaalsContact O-CB 3.22Å; I98-L102 WeakPolarHBondContact O-CB 3.4Å; I98-L102 PolarHBondContact O-N 2.92Å; D99-L102 PolarHBondContact O-N 2.93Å; L102-K104 VanDerWaalsContact C-N 3.35Å; L102-K104 PolarHBondContact O-N 3.06Å; L102-R105 PolarHBondContact O-N 3.49Å; L102-M106 HydrophobicContact CD1-CG 4.31Å; L102-M106 HydrophobicContact CD1-SD 4.2Å; L102-M106 HydrophobicContact CG-CE 4.1Å; L102-M106 HydrophobicContact CG-SD 4.12Å; L102-M106 WeakPolarHBondContact O-CG 3.36Å; L102-M106 PolarHBondContact O-N 3.4Å; L102-L247 HydrophobicContact CD2-CD2 3.51Å; L102-L247 HydrophobicContact CG-CD2 4.44Å |
| 103 | S | 86.8 | Confident | 82.9 | Confident | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -61 | -42.5 | 178.1 | -60.1 | 0 | 0 | 0 | 0 | 111.8 | D99 I100 M106 G107 H246 L247 | D99-S103 WeakPolarHBondContact O-CB 3.1Å; D99-S103 PolarHBondContact O-N 2.73Å; D99-S103 PolarHBondContact O-OG 3.15Å; D99-S103 PolarHBondContact OD1-OG 2.99Å; I100-S103 PolarHBondContact O-N 3.49Å; S103-M106 PolarHBondContact O-N 3Å; S103-G107 PolarHBondContact O-N 3.17Å; S103-G107 VanDerWaalsContact O-N 3.15Å; S103-H246 WeakPolarHBondContact OG-CA 3.45Å; S103-L247 PolarHBondContact OG-N 2.97Å |
| 104 | K | 82.3 | Confident | 82.6 | Confident | 103 Ų | 103 | 62.9 Ų | 62.9 | 45% | 0.448 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -64.7 | -40.6 | 174.6 | -75.3 | -177.2 | 177 | -175 | 0 | 112.3 | I100 C101 L102 M106 G107 P181 | I100-K104 HydrophobicContact CG2-CD 4.27Å; I100-K104 WeakPolarHBondContact O-CB 3.38Å; I100-K104 WeakPolarHBondContact O-CG 3.46Å; I100-K104 PolarHBondContact O-N 2.89Å; C101-K104 PolarHBondContact O-N 2.95Å; L102-K104 VanDerWaalsContact C-N 3.35Å; L102-K104 PolarHBondContact O-N 3.06Å; K104-M106 VanDerWaalsContact C-N 3.34Å; K104-G107 PolarHBondContact O-N 2.87Å; K104-P181 HydrophobicContact CG-CB 4.4Å |
| 105 | R | 83.7 | Confident | 82.2 | Confident | 193 Ų | 193 | 64.8 Ų | 64.8 | 73% | 0.728 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -66.2 | -34.3 | 176.8 | -74.4 | 176.9 | 68.6 | -170.4 | 0.7 | 112.9 | C101 L102 G107 | C101-R105 WeakPolarHBondContact O-CB 3.45Å; C101-R105 VanDerWaalsContact O-CG 3.3Å; C101-R105 WeakPolarHBondContact O-CG 3.42Å; C101-R105 PolarHBondContact O-N 3.04Å; L102-R105 PolarHBondContact O-N 3.49Å; R105-G107 VanDerWaalsContact C-N 3.35Å |
| 106 | M | 83 | Confident | 82 | Confident | 44 Ų | 44 | 67.4 Ų | 67.4 | 22% | 0.217 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -81.3 | -13.1 | 179 | -67.3 | -171.9 | -44.3 | 0 | 0 | 113.4 | L102 S103 K104 V108 V240 L241 L247 | L102-M106 HydrophobicContact CD1-CG 4.31Å; L102-M106 HydrophobicContact CD1-SD 4.2Å; L102-M106 HydrophobicContact CG-CE 4.1Å; L102-M106 HydrophobicContact CG-SD 4.12Å; L102-M106 WeakPolarHBondContact O-CG 3.36Å; L102-M106 PolarHBondContact O-N 3.4Å; S103-M106 PolarHBondContact O-N 3Å; K104-M106 VanDerWaalsContact C-N 3.34Å; M106-V108 PolarHBondContact O-N 2.83Å; M106-V240 HydrophobicContact CB-CG1 4.26Å; M106-V240 HydrophobicContact CE-CG1 3.49Å; M106-V240 VanDerWaalsContact CE-CG1 3.49Å; M106-L241 WeakPolarHBondContact O-CA 3.25Å; M106-L241 WeakPolarHBondContact O-CD2 3.22Å; M106-L247 HydrophobicContact CE-CB 4.09Å; M106-L247 HydrophobicContact CE-CD1 3.99Å; M106-L247 HydrophobicContact CE-CD2 4.27Å; M106-L247 HydrophobicContact CE-CG 4.34Å |
| 107 | G | 81.4 | Confident | 81.7 | Confident | 4 Ų | 4 | 63.8 Ų | 63.8 | 4% | 0.041 | 35% | 0.353 | C | S | . | . | trans | -68.8 | 45.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | S103 K104 R105 C109 A110 L241 | S103-G107 PolarHBondContact O-N 3.17Å; S103-G107 VanDerWaalsContact O-N 3.15Å; K104-G107 PolarHBondContact O-N 2.87Å; R105-G107 VanDerWaalsContact C-N 3.35Å; G107-C109 PolarHBondContact O-N 3.35Å; G107-A110 WeakPolarHBondContact O-CB 3.47Å; G107-A110 PolarHBondContact O-N 3.41Å; G107-A110 VanDerWaalsContact O-N 3.16Å; G107-L241 CarbonylContact C-O 3.6Å; G107-L241 WeakPolarHBondContact CA-O 3.49Å | ||
| 108 | V | 85.1 | Confident | 81.6 | Confident | 37 Ų | 37 | 64.8 Ų | 64.8 | 22% | 0.224 | 37% | 0.369 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.2 | -12.1 | -174.4 | -62.9 | 0 | 0 | 0 | 0 | 114.1 | M106 S114 W116 L241 | M106-V108 PolarHBondContact O-N 2.83Å; V108-S114 WeakPolarHBondContact O-CB 3.35Å; V108-W116 HydrophobicContact CB-CB 4.25Å; V108-W116 HydrophobicContact CG2-CB 4.09Å; V108-W116 HydrophobicContact CG2-CD2 4.34Å; V108-W116 HydrophobicContact CG2-CE3 4.32Å; V108-W116 HydrophobicContact CG2-CG 4.26Å; V108-W116 PolarHBondContact O-N 3.5Å; V108-L241 HydrophobicContact CG2-CD2 4Å |
| 109 | C | 82 | Confident | 81.6 | Confident | 0 Ų | 0 | 62.4 Ų | 62.4 | 0% | 0 | 36% | 0.36 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -110.5 | 14.9 | 175.6 | -60.9 | 0 | 0 | 0 | 0 | 112.2 | G107 W116 R120 L241 L242 | G107-C109 PolarHBondContact O-N 3.35Å; C109-W116 PolarHBondContact SG-O 3.43Å; C109-R120 HydrophobicContact CB-CB 4.41Å; C109-R120 PolarHBondContact O-NH1 3.39Å; C109-L241 WeakPolarHBondContact CA-O 3.36Å; C109-L241 WeakPolarHBondContact CB-O 3.47Å; C109-L241 PolarHBondContact N-O 2.88Å; C109-L242 HydrophobicContact CB-CD2 4.3Å |
| 110 | A | 79.8 | Confident | 81.5 | Confident | 5 Ų | 5 | 65.6 Ų | 65.6 | 4% | 0.041 | 37% | 0.372 | C | S | . | . | S | Bend | trans | -66.5 | -44.1 | -174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | G107 R120 W182 M184 | G107-A110 WeakPolarHBondContact O-CB 3.47Å; G107-A110 PolarHBondContact O-N 3.41Å; G107-A110 VanDerWaalsContact O-N 3.16Å; A110-R120 PolarHBondContact O-NH1 3.44Å; A110-W182 HydrophobicContact CB-CD2 4.19Å; A110-W182 HydrophobicContact CB-CG 4.37Å; A110-M184 HydrophobicContact CB-CE 3.52Å; A110-M184 WeakPolarHBondContact O-CE 3.32Å |
| 111 | S | 76.3 | Confident | 81.7 | Confident | 41 Ų | 41 | 66.3 Ų | 66.3 | 29% | 0.287 | 38% | 0.383 | S | S | . | . | S | Bend | trans | -126 | 160.2 | 179.5 | 70.4 | 0 | 0 | 0 | 0 | 112.3 | S113 S114 | S111-S113 PolarHBondContact O-N 3.16Å; S111-S113 PolarHBondContact OG-N 2.92Å; S111-S113 PolarHBondContact OG-OG 3.24Å; S111-S114 PolarHBondContact N-OG 3.28Å; S111-S114 VanDerWaalsContact O-CB 3.26Å; S111-S114 WeakPolarHBondContact O-CB 3.21Å; S111-S114 PolarHBondContact O-N 2.92Å; S111-S114 PolarHBondContact O-OG 3.37Å; S111-S114 PolarHBondContact OG-N 2.81Å; S111-S114 PolarHBondContact OG-OG 3.07Å |
| 112 | T | 72.4 | Confident | 82 | Confident | 133 Ų | 133 | 69.5 Ų | 69.5 | 82% | 0.816 | 39% | 0.392 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.3 | -24.6 | 173.4 | -45.3 | 0 | 0 | 0 | 0 | 112.6 | ||
| 113 | S | 71.4 | Confident | 82.4 | Confident | 115 Ų | 115 | 67.2 Ų | 67.2 | 80% | 0.804 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.2 | -3.4 | 175.8 | 56 | 0 | 0 | 0 | 0 | 114.4 | S111 | S111-S113 PolarHBondContact O-N 3.16Å; S111-S113 PolarHBondContact OG-N 2.92Å; S111-S113 PolarHBondContact OG-OG 3.24Å |
| 114 | S | 79 | Confident | 82.5 | Confident | 29 Ų | 29 | 69.4 Ų | 69.4 | 20% | 0.203 | 40% | 0.399 | C | S | . | . | S | Bend | trans | -75.2 | 158.8 | 178 | -60.9 | 0 | 0 | 0 | 0 | 111.1 | V108 S111 W116 G117 | V108-S114 WeakPolarHBondContact O-CB 3.35Å; S111-S114 PolarHBondContact N-OG 3.28Å; S111-S114 VanDerWaalsContact O-CB 3.26Å; S111-S114 WeakPolarHBondContact O-CB 3.21Å; S111-S114 PolarHBondContact O-N 2.92Å; S111-S114 PolarHBondContact O-OG 3.37Å; S111-S114 PolarHBondContact OG-N 2.81Å; S111-S114 PolarHBondContact OG-OG 3.07Å; S114-W116 PolarHBondContact O-N 3.03Å; S114-G117 PolarHBondContact O-N 2.88Å |
| 115 | S | 77.5 | Confident | 83 | Confident | 100 Ų | 100 | 69.5 Ų | 69.5 | 70% | 0.699 | 40% | 0.404 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.7 | -35.4 | -176 | 54.4 | 0 | 0 | 0 | 0 | 113.4 | ||
| 116 | W | 81.9 | Confident | 83.5 | Confident | 154 Ų | 154 | 62.7 Ų | 62.7 | 58% | 0.583 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -113.3 | 27.8 | 179.7 | -74 | 21.8 | 0 | 0 | 0 | 112.3 | V108 C109 S114 G118 C119 | V108-W116 HydrophobicContact CB-CB 4.25Å; V108-W116 HydrophobicContact CG2-CB 4.09Å; V108-W116 HydrophobicContact CG2-CD2 4.34Å; V108-W116 HydrophobicContact CG2-CE3 4.32Å; V108-W116 HydrophobicContact CG2-CG 4.26Å; V108-W116 PolarHBondContact O-N 3.5Å; C109-W116 PolarHBondContact SG-O 3.43Å; S114-W116 PolarHBondContact O-N 3.03Å; W116-G118 PolarHBondContact O-N 2.89Å; W116-C119 PolarHBondContact O-N 2.9Å |
| 117 | G | 77.8 | Confident | 83.9 | Confident | 11 Ų | 11 | 60.7 Ų | 60.7 | 11% | 0.113 | 37% | 0.372 | C | S | . | . | G | 310 helix | trans | -55 | -34.3 | 179 | 0 | 0 | 0 | 0 | 0 | 113.7 | S114 C119 R120 | S114-G117 PolarHBondContact O-N 2.88Å; G117-C119 VanDerWaalsContact C-N 3.32Å; G117-C119 PolarHBondContact O-N 3Å; G117-R120 WeakPolarHBondContact O-CB 3.44Å; G117-R120 PolarHBondContact O-N 3.33Å |
| 118 | G | 84.3 | Confident | 84.4 | Confident | 79 Ų | 79 | 63.9 Ų | 63.9 | 81% | 0.814 | 39% | 0.388 | S | S | * | . | G | 310 helix | trans | -65.2 | -30.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | W116 R120 | W116-G118 PolarHBondContact O-N 2.89Å; G118-R120 VanDerWaalsContact C-N 3.27Å; G118-R120 PolarHBondContact O-N 2.8Å |
| 119 | C | 86.4 | Confident | 84.8 | Confident | 51 Ų | 51 | 64.9 Ų | 64.9 | 35% | 0.345 | 39% | 0.394 | S | S | . | . | G | 310 helix | trans | -81.8 | -5.2 | 177.9 | -62.9 | 0 | 0 | 0 | 0 | 112.9 | W116 G117 S121 M122 V123 | W116-C119 PolarHBondContact O-N 2.9Å; G117-C119 VanDerWaalsContact C-N 3.32Å; G117-C119 PolarHBondContact O-N 3Å; C119-S121 VanDerWaalsContact C-N 3.27Å; C119-S121 PolarHBondContact O-N 2.92Å; C119-M122 WeakPolarHBondContact O-CB 3.44Å; C119-M122 PolarHBondContact O-N 3.45Å; C119-M122 VanDerWaalsContact O-N 3.08Å; C119-V123 WeakPolarHBondContact O-CG2 3.5Å; C119-V123 PolarHBondContact O-N 3.39Å |
| 120 | R | 87.1 | Confident | 85.2 | Confident | 79 Ų | 79 | 64.9 Ų | 64.9 | 30% | 0.298 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -54.1 | -42.1 | -177.6 | -179.6 | -179 | 170.1 | 87.6 | -5.3 | 112.6 | C109 A110 G117 G118 V123 A124 L242 | C109-R120 HydrophobicContact CB-CB 4.41Å; C109-R120 PolarHBondContact O-NH1 3.39Å; A110-R120 PolarHBondContact O-NH1 3.44Å; G117-R120 WeakPolarHBondContact O-CB 3.44Å; G117-R120 PolarHBondContact O-N 3.33Å; G118-R120 VanDerWaalsContact C-N 3.27Å; G118-R120 PolarHBondContact O-N 2.8Å; R120-V123 PolarHBondContact O-N 2.91Å; R120-A124 VanDerWaalsContact O-CB 3.29Å; R120-A124 WeakPolarHBondContact O-CB 3.33Å; R120-A124 PolarHBondContact O-N 2.89Å; R120-L242 HydrophobicContact CG-CD2 3.88Å |
| 121 | S | 88.1 | Confident | 85.8 | Confident | 82 Ų | 82 | 65 Ų | 65 | 57% | 0.573 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -62.5 | -44.5 | 178.8 | -172.4 | 0 | 0 | 0 | 0 | 111.5 | C119 V123 A124 L125 | C119-S121 VanDerWaalsContact C-N 3.27Å; C119-S121 PolarHBondContact O-N 2.92Å; S121-V123 PolarHBondContact O-N 3.26Å; S121-A124 PolarHBondContact O-N 3.46Å; S121-L125 WeakPolarHBondContact O-CG 3.37Å; S121-L125 PolarHBondContact O-N 3Å |
| 122 | M | 91.7 | Very high | 86.5 | Confident | 135 Ų | 135 | 63.2 Ų | 63.2 | 67% | 0.665 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -62.3 | -43.8 | 176.8 | -62.9 | 174.1 | 66.4 | 0 | 0 | 111.8 | C119 A124 L125 L126 | C119-M122 WeakPolarHBondContact O-CB 3.44Å; C119-M122 PolarHBondContact O-N 3.45Å; C119-M122 VanDerWaalsContact O-N 3.08Å; M122-A124 VanDerWaalsContact C-N 3.33Å; M122-A124 PolarHBondContact O-N 3.33Å; M122-L125 PolarHBondContact O-N 2.97Å; M122-L126 PolarHBondContact O-N 3.38Å |
| 123 | V | 91.8 | Very high | 87.5 | Confident | 17 Ų | 17 | 59.9 Ų | 59.9 | 10% | 0.103 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -66.9 | -35.6 | 177.4 | -179.6 | 0 | 0 | 0 | 0 | 111.3 | C119 R120 S121 L126 A127 S238 L241 L242 | C119-V123 WeakPolarHBondContact O-CG2 3.5Å; C119-V123 PolarHBondContact O-N 3.39Å; R120-V123 PolarHBondContact O-N 2.91Å; S121-V123 PolarHBondContact O-N 3.26Å; V123-L126 PolarHBondContact O-N 3.17Å; V123-A127 PolarHBondContact O-N 2.96Å; V123-S238 WeakPolarHBondContact CG1-O 3.37Å; V123-L241 HydrophobicContact CG1-CB 4.25Å; V123-L242 HydrophobicContact CB-CD2 4.47Å; V123-L242 HydrophobicContact CG1-CD1 4.1Å; V123-L242 HydrophobicContact CG1-CD2 4.21Å; V123-L242 HydrophobicContact CG1-CG 3.79Å |
| 124 | A | 89.4 | Confident | 88.5 | Confident | 45 Ų | 45 | 57.5 Ų | 57.5 | 37% | 0.372 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -67.7 | -39.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | R120 S121 M122 A127 L128 | R120-A124 VanDerWaalsContact O-CB 3.29Å; R120-A124 WeakPolarHBondContact O-CB 3.33Å; R120-A124 PolarHBondContact O-N 2.89Å; S121-A124 PolarHBondContact O-N 3.46Å; M122-A124 VanDerWaalsContact C-N 3.33Å; M122-A124 PolarHBondContact O-N 3.33Å; A124-A127 WeakPolarHBondContact O-CB 3.38Å; A124-A127 PolarHBondContact O-N 3.36Å; A124-L128 PolarHBondContact O-N 2.77Å |
| 125 | L | 91.9 | Very high | 89.2 | Confident | 106 Ų | 106 | 58.9 Ų | 58.9 | 56% | 0.555 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -63.9 | -41.9 | 173.1 | -72.5 | 172.9 | 0 | 0 | 0 | 111.4 | S121 M122 A127 L128 T129 | S121-L125 WeakPolarHBondContact O-CG 3.37Å; S121-L125 PolarHBondContact O-N 3Å; M122-L125 PolarHBondContact O-N 2.97Å; L125-A127 VanDerWaalsContact C-N 3.33Å; L125-A127 PolarHBondContact O-N 3.34Å; L125-L128 WeakPolarHBondContact O-CB 3.44Å; L125-L128 PolarHBondContact O-N 2.93Å; L125-L128 VanDerWaalsContact O-N 3.15Å; L125-T129 PolarHBondContact O-N 3.1Å |
| 126 | L | 94.2 | Very high | 90.1 | Very high | 49 Ų | 49 | 56.1 Ų | 56.1 | 26% | 0.257 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -59.6 | -45 | 172.7 | 177 | 63.7 | 0 | 0 | 0 | 111.1 | M122 V123 L128 T129 L234 V235 | M122-L126 PolarHBondContact O-N 3.38Å; V123-L126 PolarHBondContact O-N 3.17Å; L126-L128 VanDerWaalsContact C-N 3.28Å; L126-L128 PolarHBondContact O-N 3.31Å; L126-T129 WeakPolarHBondContact O-CB 3.26Å; L126-T129 PolarHBondContact O-N 3.13Å; L126-T129 VanDerWaalsContact O-N 3.12Å; L126-T129 PolarHBondContact O-OG1 3.13Å; L126-L234 HydrophobicContact CD1-CB 4.37Å; L126-L234 HydrophobicContact CD2-CB 3.91Å; L126-V235 HydrophobicContact CD1-CG2 4.05Å; L126-V235 HydrophobicContact CG-CG2 4.41Å |
| 127 | A | 91.6 | Very high | 90.7 | Very high | 3 Ų | 3 | 53.4 Ų | 53.4 | 3% | 0.025 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -60.2 | -37.5 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | V123 A124 L125 T129 G130 H131 H203 L242 | V123-A127 PolarHBondContact O-N 2.96Å; A124-A127 WeakPolarHBondContact O-CB 3.38Å; A124-A127 PolarHBondContact O-N 3.36Å; L125-A127 VanDerWaalsContact C-N 3.33Å; L125-A127 PolarHBondContact O-N 3.34Å; A127-T129 PolarHBondContact O-N 2.97Å; A127-G130 PolarHBondContact O-N 3.36Å; A127-H131 PolarHBondContact O-N 3.06Å; A127-H203 PolarHBondContact O-CD2 3.47Å; A127-H203 VanDerWaalsContact O-CD2 3.22Å; A127-L242 HydrophobicContact CB-CD1 4.27Å |
| 128 | L | 91.8 | Very high | 91.6 | Very high | 71 Ų | 71 | 54.5 Ų | 54.5 | 37% | 0.372 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -60.8 | -31.2 | 176.2 | -176.6 | 64.7 | 0 | 0 | 0 | 112.7 | A124 L125 L126 G130 H131 T134 L189 | A124-L128 PolarHBondContact O-N 2.77Å; L125-L128 WeakPolarHBondContact O-CB 3.44Å; L125-L128 PolarHBondContact O-N 2.93Å; L125-L128 VanDerWaalsContact O-N 3.15Å; L126-L128 VanDerWaalsContact C-N 3.28Å; L126-L128 PolarHBondContact O-N 3.31Å; L128-G130 PolarHBondContact O-N 3.19Å; L128-H131 HydrophobicContact CD1-CB 4.27Å; L128-H131 WeakPolarHBondContact O-CB 3.27Å; L128-H131 PolarHBondContact O-N 3.46Å; L128-T134 PolarHBondContact O-OG1 3.34Å; L128-L189 HydrophobicContact CD1-CD1 4.06Å |
| 129 | T | 94.1 | Very high | 92.1 | Very high | 57 Ų | 57 | 50.9 Ų | 50.9 | 35% | 0.35 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -67.1 | -25.6 | 174.5 | 72.3 | 0 | 0 | 0 | 0 | 113 | L125 L126 A127 H131 W135 W231 | L125-T129 PolarHBondContact O-N 3.1Å; L126-T129 WeakPolarHBondContact O-CB 3.26Å; L126-T129 PolarHBondContact O-N 3.13Å; L126-T129 VanDerWaalsContact O-N 3.12Å; L126-T129 PolarHBondContact O-OG1 3.13Å; A127-T129 PolarHBondContact O-N 2.97Å; T129-H131 VanDerWaalsContact C-N 3.32Å; T129-W135 PolarHBondContact O-NE1 2.9Å; T129-W231 PolarHBondContact OG1-NE1 3.22Å |
| 130 | G | 91.4 | Very high | 92.5 | Very high | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89 | 6.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | A127 L128 R206 | A127-G130 PolarHBondContact O-N 3.36Å; L128-G130 PolarHBondContact O-N 3.19Å; G130-R206 PolarHBondContact O-NE 2.92Å |
| 131 | H | 92.6 | Very high | 92.9 | Very high | 8 Ų | 8 | 52.3 Ų | 52.3 | 4% | 0.037 | 30% | 0.298 | C | S | . | . | trans | -78.9 | 138.4 | -172.9 | -159.6 | -81.4 | 0 | 0 | 0 | 111.4 | A127 L128 T129 I133 T134 W135 L189 A193 H203 | A127-H131 PolarHBondContact O-N 3.06Å; L128-H131 HydrophobicContact CD1-CB 4.27Å; L128-H131 WeakPolarHBondContact O-CB 3.27Å; L128-H131 PolarHBondContact O-N 3.46Å; T129-H131 VanDerWaalsContact C-N 3.32Å; H131-I133 PolarHBondContact ND1-N 2.84Å; H131-I133 PolarHBondContact O-N 3.18Å; H131-T134 WeakPolarHBondContact O-CB 3.29Å; H131-T134 PolarHBondContact O-N 3.37Å; H131-W135 PolarHBondContact O-N 2.87Å; H131-L189 PolarHBondContact NE2-O 3Å; H131-A193 VanDerWaalsContact CE1-CB 3.45Å; H131-A193 WeakPolarHBondContact CE1-CB 3.12Å; H131-A193 WeakPolarHBondContact NE2-CB 3.35Å; H131-H203 AromaticContact CD2-NE2 3.97Å | ||
| 132 | G | 90.8 | Very high | 93.2 | Very high | 4 Ų | 4 | 51.7 Ų | 51.7 | 4% | 0.041 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -62.1 | -43.4 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113 | T134 W135 I136 | G132-T134 VanDerWaalsContact C-N 3.32Å; G132-T134 PolarHBondContact O-N 2.92Å; G132-W135 PolarHBondContact O-N 3.48Å; G132-I136 WeakPolarHBondContact O-CB 3.46Å; G132-I136 WeakPolarHBondContact O-CG1 3.4Å; G132-I136 PolarHBondContact O-N 3.48Å |
| 133 | I | 91.7 | Very high | 93.3 | Very high | 62 Ų | 62 | 46.8 Ų | 46.8 | 32% | 0.318 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -56.9 | -45 | 177.1 | -58.9 | 175.6 | 0 | 0 | 0 | 111.5 | H131 W135 I136 I137 V192 | H131-I133 PolarHBondContact ND1-N 2.84Å; H131-I133 PolarHBondContact O-N 3.18Å; I133-W135 VanDerWaalsContact C-N 3.33Å; I133-W135 PolarHBondContact O-N 3.4Å; I133-I136 PolarHBondContact O-N 3.39Å; I133-I137 HydrophobicContact CG2-CD1 3.5Å; I133-I137 VanDerWaalsContact CG2-CD1 3.5Å; I133-I137 HydrophobicContact CG2-CG1 4.15Å; I133-I137 WeakPolarHBondContact O-CB 3.42Å; I133-I137 VanDerWaalsContact O-CG1 3.32Å; I133-I137 WeakPolarHBondContact O-CG1 3.4Å; I133-I137 PolarHBondContact O-N 2.98Å; I133-V192 HydrophobicContact CD1-CB 4.35Å; I133-V192 HydrophobicContact CD1-CG1 3.54Å |
| 134 | T | 92.6 | Very high | 93.2 | Very high | 65 Ų | 65 | 51 Ų | 51 | 40% | 0.399 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -57.8 | -46.7 | 179.3 | -50.9 | 0 | 0 | 0 | 0 | 111.1 | L128 H131 G132 G138 | L128-T134 PolarHBondContact O-OG1 3.34Å; H131-T134 WeakPolarHBondContact O-CB 3.29Å; H131-T134 PolarHBondContact O-N 3.37Å; G132-T134 VanDerWaalsContact C-N 3.32Å; G132-T134 PolarHBondContact O-N 2.92Å; T134-G138 PolarHBondContact O-N 3.39Å |
| 135 | W | 95.1 | Very high | 93.4 | Very high | 58 Ų | 58 | 58.3 Ų | 58.3 | 22% | 0.22 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -71.8 | -40.2 | -179.7 | -80.7 | 96.6 | 0 | 0 | 0 | 113.4 | T129 H131 G132 I133 T139 L162 V210 L214 W231 | T129-W135 PolarHBondContact O-NE1 2.9Å; H131-W135 PolarHBondContact O-N 2.87Å; G132-W135 PolarHBondContact O-N 3.48Å; I133-W135 VanDerWaalsContact C-N 3.33Å; I133-W135 PolarHBondContact O-N 3.4Å; W135-T139 VanDerWaalsContact O-CB 3.29Å; W135-T139 WeakPolarHBondContact O-CB 3.42Å; W135-T139 PolarHBondContact O-N 3.47Å; W135-T139 PolarHBondContact O-OG1 3.43Å; W135-L162 HydrophobicContact CB-CD1 3.91Å; W135-L162 HydrophobicContact CB-CD2 3.71Å; W135-L162 HydrophobicContact CB-CG 4.5Å; W135-L162 HydrophobicContact CG-CD2 4.38Å; W135-V210 HydrophobicContact CD2-CG1 4.14Å; W135-V210 HydrophobicContact CD2-CG2 4.24Å; W135-V210 HydrophobicContact CE3-CG1 3.9Å; W135-V210 HydrophobicContact CE3-CG2 4.4Å; W135-V210 HydrophobicContact CH2-CG1 3.43Å; W135-V210 VanDerWaalsContact CH2-CG1 3.43Å; W135-V210 HydrophobicContact CZ2-CG1 3.67Å; W135-V210 HydrophobicContact CZ3-CG1 3.55Å; W135-L214 HydrophobicContact CH2-CD1 4.11Å; W135-L214 HydrophobicContact CZ3-CD1 4.43Å; W135-W231 AromaticContact CE2-CH2 3.87Å; W135-W231 AromaticContact CZ2-CH2 3.54Å; W135-W231 HydrophobicContact CZ2-CH2 3.54Å; W135-W231 AromaticContact CZ2-CZ2 3.84Å; W135-W231 HydrophobicContact CZ2-CZ2 3.84Å; W135-W231 HydrophobicContact CZ2-CZ3 4.33Å; W135-W231 AromaticContact NE1-CH2 3.78Å; W135-W231 AromaticContact NE1-CZ2 3.81Å |
| 136 | I | 95.4 | Very high | 93.3 | Very high | 43 Ų | 43 | 54.2 Ų | 54.2 | 22% | 0.221 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -64 | -50.9 | 177.8 | -70.2 | 169.4 | 0 | 0 | 0 | 110.2 | G132 I133 G138 T139 I140 L159 L162 V166 | G132-I136 WeakPolarHBondContact O-CB 3.46Å; G132-I136 WeakPolarHBondContact O-CG1 3.4Å; G132-I136 PolarHBondContact O-N 3.48Å; I133-I136 PolarHBondContact O-N 3.39Å; I136-G138 PolarHBondContact O-N 2.92Å; I136-T139 PolarHBondContact O-N 3.32Å; I136-I140 HydrophobicContact CG2-CD1 3.82Å; I136-I140 WeakPolarHBondContact O-CG1 3.37Å; I136-I140 PolarHBondContact O-N 3.26Å; I136-L159 HydrophobicContact CG2-CD1 4.19Å; I136-L162 HydrophobicContact CG1-CB 4.08Å; I136-L162 HydrophobicContact CG1-CD1 4.4Å; I136-V166 HydrophobicContact CD1-CG2 4.26Å |
| 137 | I | 95.1 | Very high | 93 | Very high | 97 Ų | 97 | 59 Ų | 59 | 50% | 0.497 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -61.2 | -46.9 | 178.5 | -66.3 | 176.6 | 0 | 0 | 0 | 110.2 | I133 T139 I140 V141 | I133-I137 HydrophobicContact CG2-CD1 3.5Å; I133-I137 VanDerWaalsContact CG2-CD1 3.5Å; I133-I137 HydrophobicContact CG2-CG1 4.15Å; I133-I137 WeakPolarHBondContact O-CB 3.42Å; I133-I137 VanDerWaalsContact O-CG1 3.32Å; I133-I137 WeakPolarHBondContact O-CG1 3.4Å; I133-I137 PolarHBondContact O-N 2.98Å; I137-T139 VanDerWaalsContact C-N 3.32Å; I137-T139 PolarHBondContact O-N 3.48Å; I137-I140 PolarHBondContact O-N 3.42Å; I137-V141 HydrophobicContact CG2-CG2 4.3Å; I137-V141 WeakPolarHBondContact O-CG2 3.47Å; I137-V141 PolarHBondContact O-N 3.46Å |
| 138 | G | 95.7 | Very high | 93.1 | Very high | 33 Ų | 33 | 63 Ų | 63 | 34% | 0.34 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -57.6 | -44.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | T134 I136 V141 C142 | T134-G138 PolarHBondContact O-N 3.39Å; I136-G138 PolarHBondContact O-N 2.92Å; G138-V141 PolarHBondContact O-N 3.29Å; G138-C142 WeakPolarHBondContact O-CB 3.39Å; G138-C142 PolarHBondContact O-N 3.5Å; G138-C142 PolarHBondContact O-SG 2.95Å; G138-C142 VanDerWaalsContact O-SG 3.32Å |
| 139 | T | 96.1 | Very high | 93.1 | Very high | 4 Ų | 4 | 64.6 Ų | 64.6 | 3% | 0.025 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -65.8 | -42.3 | 179.3 | -54.7 | 0 | 0 | 0 | 0 | 111.6 | W135 I136 I137 C142 L143 L155 L158 L159 L162 | W135-T139 VanDerWaalsContact O-CB 3.29Å; W135-T139 WeakPolarHBondContact O-CB 3.42Å; W135-T139 PolarHBondContact O-N 3.47Å; W135-T139 PolarHBondContact O-OG1 3.43Å; I136-T139 PolarHBondContact O-N 3.32Å; I137-T139 VanDerWaalsContact C-N 3.32Å; I137-T139 PolarHBondContact O-N 3.48Å; T139-C142 PolarHBondContact O-N 3.29Å; T139-L143 WeakPolarHBondContact O-CB 3.32Å; T139-L143 PolarHBondContact O-N 2.97Å; T139-L155 HydrophobicContact CG2-CB 4.46Å; T139-L155 HydrophobicContact CG2-CD2 4.1Å; T139-L155 WeakPolarHBondContact CG2-O 3.16Å; T139-L158 HydrophobicContact CG2-CB 4.32Å; T139-L158 HydrophobicContact CG2-CD2 4.17Å; T139-L158 HydrophobicContact CG2-CG 4.21Å; T139-L159 HydrophobicContact CG2-CB 3.93Å; T139-L162 WeakPolarHBondContact OG1-CD1 3.31Å |
| 140 | I | 95.1 | Very high | 92.9 | Very high | 77 Ų | 77 | 65.2 Ų | 65.2 | 40% | 0.395 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -63 | -45.4 | 176.2 | -68.4 | 167.7 | 0 | 0 | 0 | 110.7 | I136 I137 C142 L143 T144 L159 | I136-I140 HydrophobicContact CG2-CD1 3.82Å; I136-I140 WeakPolarHBondContact O-CG1 3.37Å; I136-I140 PolarHBondContact O-N 3.26Å; I137-I140 PolarHBondContact O-N 3.42Å; I140-C142 VanDerWaalsContact C-N 3.35Å; I140-C142 PolarHBondContact O-N 2.99Å; I140-L143 WeakPolarHBondContact O-CB 3.37Å; I140-L143 PolarHBondContact O-N 3.3Å; I140-L143 VanDerWaalsContact O-N 3.14Å; I140-T144 WeakPolarHBondContact O-CG2 3.45Å; I140-T144 PolarHBondContact O-N 2.93Å; I140-L159 HydrophobicContact CG1-CD1 4.17Å; I140-L159 HydrophobicContact CG1-CD2 4.23Å |
| 141 | V | 95.2 | Very high | 93 | Very high | 82 Ų | 82 | 66.2 Ų | 66.2 | 50% | 0.497 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -62.7 | -41.5 | 176.9 | 172 | 0 | 0 | 0 | 0 | 111.2 | I137 G138 L143 T144 R145 | I137-V141 HydrophobicContact CG2-CG2 4.3Å; I137-V141 WeakPolarHBondContact O-CG2 3.47Å; I137-V141 PolarHBondContact O-N 3.46Å; G138-V141 PolarHBondContact O-N 3.29Å; V141-L143 VanDerWaalsContact C-N 3.3Å; V141-L143 PolarHBondContact O-N 3.29Å; V141-T144 PolarHBondContact O-OG1 3.31Å; V141-R145 VanDerWaalsContact O-CG 3.25Å; V141-R145 WeakPolarHBondContact O-CG 3.32Å; V141-R145 PolarHBondContact O-N 3.37Å |
| 142 | C | 94.7 | Very high | 93 | Very high | 69 Ų | 69 | 67 Ų | 67 | 47% | 0.466 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -63.2 | -38.3 | 173.7 | -73.4 | 0 | 0 | 0 | 0 | 111.8 | G138 T139 I140 R145 S146 L155 | G138-C142 WeakPolarHBondContact O-CB 3.39Å; G138-C142 PolarHBondContact O-N 3.5Å; G138-C142 PolarHBondContact O-SG 2.95Å; G138-C142 VanDerWaalsContact O-SG 3.32Å; T139-C142 PolarHBondContact O-N 3.29Å; I140-C142 VanDerWaalsContact C-N 3.35Å; I140-C142 PolarHBondContact O-N 2.99Å; C142-R145 PolarHBondContact O-N 2.97Å; C142-S146 WeakPolarHBondContact O-CB 3.37Å; C142-S146 PolarHBondContact O-N 3.38Å; C142-L155 HydrophobicContact CB-CD1 3.88Å; C142-L155 HydrophobicContact CB-CD2 3.71Å; C142-L155 HydrophobicContact CB-CG 4.48Å |
| 143 | L | 93.6 | Very high | 93.2 | Very high | 33 Ų | 33 | 68.6 Ų | 68.6 | 17% | 0.173 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -65.5 | -42.4 | -179.6 | -174 | 64.4 | 0 | 0 | 0 | 111.6 | T139 I140 V141 R145 S146 Q152 L155 V156 I278 | T139-L143 WeakPolarHBondContact O-CB 3.32Å; T139-L143 PolarHBondContact O-N 2.97Å; I140-L143 WeakPolarHBondContact O-CB 3.37Å; I140-L143 PolarHBondContact O-N 3.3Å; I140-L143 VanDerWaalsContact O-N 3.14Å; V141-L143 VanDerWaalsContact C-N 3.3Å; V141-L143 PolarHBondContact O-N 3.29Å; L143-R145 PolarHBondContact O-N 3.41Å; L143-S146 PolarHBondContact O-N 3.46Å; L143-Q152 HydrophobicContact CD1-CB 4.21Å; L143-Q152 HydrophobicContact CD1-CG 4.18Å; L143-L155 HydrophobicContact CB-CB 4.41Å; L143-L155 HydrophobicContact CB-CD1 4.49Å; L143-L155 HydrophobicContact CD1-CB 3.85Å; L143-L155 HydrophobicContact CD1-CD1 4.49Å; L143-V156 HydrophobicContact CD1-CG2 3.86Å; L143-V156 HydrophobicContact CD2-CG2 4.08Å; L143-I278 HydrophobicContact CD1-CD1 4.17Å |
| 144 | T | 90.1 | Very high | 93.4 | Very high | 105 Ų | 105 | 67.2 Ų | 67.2 | 64% | 0.644 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -69.2 | -19.9 | 177.6 | 60 | 0 | 0 | 0 | 0 | 113.6 | I140 V141 | I140-T144 WeakPolarHBondContact O-CG2 3.45Å; I140-T144 PolarHBondContact O-N 2.93Å; V141-T144 PolarHBondContact O-OG1 3.31Å |
| 145 | R | 92.6 | Very high | 93.6 | Very high | 198 Ų | 198 | 65.5 Ų | 65.5 | 75% | 0.747 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -97.4 | -13.3 | 178.2 | -60 | -66.8 | -109.2 | 110.8 | -2.1 | 113.2 | V141 C142 L143 | V141-R145 VanDerWaalsContact O-CG 3.25Å; V141-R145 WeakPolarHBondContact O-CG 3.32Å; V141-R145 PolarHBondContact O-N 3.37Å; C142-R145 PolarHBondContact O-N 2.97Å; L143-R145 PolarHBondContact O-N 3.41Å |
| 146 | S | 90.8 | Very high | 93.7 | Very high | 20 Ų | 20 | 63.5 Ų | 63.5 | 14% | 0.14 | 36% | 0.36 | C | S | . | . | trans | -83.2 | 123.6 | -178.9 | -174.1 | 0 | 0 | 0 | 0 | 110.9 | C142 L143 Q152 | C142-S146 WeakPolarHBondContact O-CB 3.37Å; C142-S146 PolarHBondContact O-N 3.38Å; L143-S146 PolarHBondContact O-N 3.46Å; S146-Q152 PolarHBondContact O-NE2 2.68Å | ||
| 147 | N | 87.5 | Confident | 93.7 | Very high | 151 Ų | 151 | 61.5 Ų | 61.5 | 81% | 0.807 | 35% | 0.35 | S | S | * | . | trans | -105.1 | -2.4 | 174.1 | -66.8 | -40.8 | 0 | 0 | 0 | 112.9 | ||||
| 148 | T | 93.1 | Very high | 93.8 | Very high | 87 Ų | 87 | 57.2 Ų | 57.2 | 53% | 0.534 | 33% | 0.328 | S | S | . | . | trans | -94.5 | 135.5 | -178.4 | 63.5 | 0 | 0 | 0 | 0 | 110.4 | A150 G151 Q152 | T148-A150 VanDerWaalsContact C-N 3.32Å; T148-A150 PolarHBondContact O-N 3.08Å; T148-G151 PolarHBondContact O-N 2.92Å; T148-G151 PolarHBondContact OG1-N 2.83Å; T148-Q152 WeakPolarHBondContact O-CB 3.28Å; T148-Q152 WeakPolarHBondContact O-CG 3.25Å; T148-Q152 PolarHBondContact O-N 3.49Å | ||
| 149 | L | 91.2 | Very high | 93.9 | Very high | 104 Ų | 104 | 57.1 Ų | 57.1 | 55% | 0.545 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -58.4 | -44.7 | 179.5 | -62.1 | 178.1 | 0 | 0 | 0 | 111.6 | G151 Q152 E153 Q275 | L149-G151 PolarHBondContact O-N 3.43Å; L149-Q152 PolarHBondContact O-N 2.99Å; L149-E153 WeakPolarHBondContact O-CB 3.3Å; L149-E153 PolarHBondContact O-N 2.86Å; L149-Q275 HydrophobicContact CD2-CG 3.99Å; L149-Q275 VanDerWaalsContact CD2-NE2 3.34Å |
| 150 | A | 91.8 | Very high | 93.9 | Very high | 69 Ų | 69 | 60 Ų | 60 | 57% | 0.57 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -64.2 | -40.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | T148 E153 V154 | T148-A150 VanDerWaalsContact C-N 3.32Å; T148-A150 PolarHBondContact O-N 3.08Å; A150-E153 PolarHBondContact O-N 3.34Å; A150-V154 WeakPolarHBondContact O-CG2 3.4Å; A150-V154 PolarHBondContact O-N 3.34Å; A150-V154 VanDerWaalsContact O-N 3.13Å |
| 151 | G | 92.2 | Very high | 94 | Very high | 21 Ų | 21 | 56.4 Ų | 56.4 | 22% | 0.216 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -66.6 | -43 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | T148 L149 V154 L155 | T148-G151 PolarHBondContact O-N 2.92Å; T148-G151 PolarHBondContact OG1-N 2.83Å; L149-G151 PolarHBondContact O-N 3.43Å; G151-V154 PolarHBondContact O-N 3.06Å; G151-L155 WeakPolarHBondContact O-CB 3.48Å; G151-L155 WeakPolarHBondContact O-CD1 3.49Å; G151-L155 WeakPolarHBondContact O-CG 3.4Å; G151-L155 PolarHBondContact O-N 3.27Å |
| 152 | Q | 93.7 | Very high | 94.1 | Very high | 24 Ų | 24 | 52.5 Ų | 52.5 | 11% | 0.112 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -63.7 | -41.5 | 176 | -72.3 | 177.6 | -13 | 0 | 0 | 112.1 | L143 S146 T148 L149 L155 V156 I278 | L143-Q152 HydrophobicContact CD1-CB 4.21Å; L143-Q152 HydrophobicContact CD1-CG 4.18Å; S146-Q152 PolarHBondContact O-NE2 2.68Å; T148-Q152 WeakPolarHBondContact O-CB 3.28Å; T148-Q152 WeakPolarHBondContact O-CG 3.25Å; T148-Q152 PolarHBondContact O-N 3.49Å; L149-Q152 PolarHBondContact O-N 2.99Å; Q152-L155 PolarHBondContact O-N 3.49Å; Q152-V156 WeakPolarHBondContact O-CB 3.43Å; Q152-V156 VanDerWaalsContact O-CG2 3.29Å; Q152-V156 WeakPolarHBondContact O-CG2 3.4Å; Q152-V156 PolarHBondContact O-N 3.15Å; Q152-I278 HydrophobicContact CB-CD1 3.89Å; Q152-I278 HydrophobicContact CG-CD1 4.17Å |
| 153 | E | 95.1 | Very high | 94.2 | Very high | 38 Ų | 38 | 52.8 Ų | 52.8 | 18% | 0.178 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -57.9 | -51 | 175.2 | -179.2 | -178.7 | 155.4 | 0 | 0 | 111.7 | L149 A150 L155 V156 N157 W268 S271 | L149-E153 WeakPolarHBondContact O-CB 3.3Å; L149-E153 PolarHBondContact O-N 2.86Å; A150-E153 PolarHBondContact O-N 3.34Å; E153-L155 VanDerWaalsContact C-N 3.33Å; E153-L155 PolarHBondContact O-N 3.31Å; E153-V156 PolarHBondContact O-N 3.46Å; E153-N157 WeakPolarHBondContact O-CB 3.21Å; E153-N157 PolarHBondContact O-N 3.28Å; E153-N157 PolarHBondContact O-ND2 3.47Å; E153-W268 HydrophobicContact CG-CZ2 4.38Å; E153-W268 PolarHBondContact OE1-NE1 2.89Å; E153-S271 VanDerWaalsContact OE2-CB 3.29Å; E153-S271 WeakPolarHBondContact OE2-CB 3.42Å; E153-S271 PolarHBondContact OE2-OG 3Å |
| 154 | V | 95.8 | Very high | 94.3 | Very high | 34 Ų | 34 | 53.6 Ų | 53.6 | 21% | 0.206 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61.8 | -41.5 | 178.9 | 173.9 | 0 | 0 | 0 | 0 | 111.2 | A150 G151 L158 F213 H217 | A150-V154 WeakPolarHBondContact O-CG2 3.4Å; A150-V154 PolarHBondContact O-N 3.34Å; A150-V154 VanDerWaalsContact O-N 3.13Å; G151-V154 PolarHBondContact O-N 3.06Å; V154-L158 VanDerWaalsContact O-CB 3.32Å; V154-L158 WeakPolarHBondContact O-CB 3.3Å; V154-L158 PolarHBondContact O-N 2.92Å; V154-F213 HydrophobicContact CG1-CE1 3.66Å; V154-F213 HydrophobicContact CG1-CZ 4.01Å; V154-F213 WeakPolarHBondContact O-CZ 3.47Å; V154-H217 HydrophobicContact CG1-CB 4.36Å |
| 155 | L | 96.2 | Very high | 94.6 | Very high | 28 Ų | 28 | 48.6 Ų | 48.6 | 15% | 0.147 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -70.7 | -38.5 | -178.8 | -72.4 | 167.4 | 0 | 0 | 0 | 113.2 | T139 C142 L143 G151 Q152 E153 L158 L159 | T139-L155 HydrophobicContact CG2-CB 4.46Å; T139-L155 HydrophobicContact CG2-CD2 4.1Å; T139-L155 WeakPolarHBondContact CG2-O 3.16Å; C142-L155 HydrophobicContact CB-CD1 3.88Å; C142-L155 HydrophobicContact CB-CD2 3.71Å; C142-L155 HydrophobicContact CB-CG 4.48Å; L143-L155 HydrophobicContact CB-CB 4.41Å; L143-L155 HydrophobicContact CB-CD1 4.49Å; L143-L155 HydrophobicContact CD1-CB 3.85Å; L143-L155 HydrophobicContact CD1-CD1 4.49Å; G151-L155 WeakPolarHBondContact O-CB 3.48Å; G151-L155 WeakPolarHBondContact O-CD1 3.49Å; G151-L155 WeakPolarHBondContact O-CG 3.4Å; G151-L155 PolarHBondContact O-N 3.27Å; Q152-L155 PolarHBondContact O-N 3.49Å; E153-L155 VanDerWaalsContact C-N 3.33Å; E153-L155 PolarHBondContact O-N 3.31Å; L155-L158 PolarHBondContact O-N 3.29Å; L155-L159 WeakPolarHBondContact O-CB 3.38Å; L155-L159 PolarHBondContact O-N 3.3Å |
| 156 | V | 96.3 | Very high | 94.7 | Very high | 17 Ų | 17 | 40.9 Ų | 40.9 | 10% | 0.103 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -65.2 | -44.6 | 175 | 169.2 | 0 | 0 | 0 | 0 | 110.4 | L143 Q152 E153 L159 L160 L269 C274 L277 I278 | L143-V156 HydrophobicContact CD1-CG2 3.86Å; L143-V156 HydrophobicContact CD2-CG2 4.08Å; Q152-V156 WeakPolarHBondContact O-CB 3.43Å; Q152-V156 VanDerWaalsContact O-CG2 3.29Å; Q152-V156 WeakPolarHBondContact O-CG2 3.4Å; Q152-V156 PolarHBondContact O-N 3.15Å; E153-V156 PolarHBondContact O-N 3.46Å; V156-L159 PolarHBondContact O-N 3.02Å; V156-L160 PolarHBondContact O-N 3.07Å; V156-L269 HydrophobicContact CG1-CD1 4.34Å; V156-C274 HydrophobicContact CB-CB 4.3Å; V156-C274 HydrophobicContact CG1-CB 4.32Å; V156-C274 HydrophobicContact CG2-CB 4.31Å; V156-L277 HydrophobicContact CG1-CD1 4.36Å; V156-I278 HydrophobicContact CG2-CD1 4Å; V156-I278 HydrophobicContact CG2-CG1 4.13Å |
| 157 | N | 96.8 | Very high | 94.8 | Very high | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.9 | -38.5 | 176.8 | -80.3 | -64.8 | 0 | 0 | 0 | 112 | E153 L160 A161 F213 M264 W268 L269 | E153-N157 WeakPolarHBondContact O-CB 3.21Å; E153-N157 PolarHBondContact O-N 3.28Å; E153-N157 PolarHBondContact O-ND2 3.47Å; N157-L160 PolarHBondContact O-N 2.8Å; N157-A161 WeakPolarHBondContact O-CB 3.37Å; N157-A161 PolarHBondContact O-N 2.99Å; N157-F213 HydrophobicContact CB-CE2 4.35Å; N157-F213 HydrophobicContact CB-CZ 4.3Å; N157-M264 HydrophobicContact CB-CE 3.41Å; N157-M264 VanDerWaalsContact CB-CE 3.41Å; N157-M264 HydrophobicContact CB-SD 4.32Å; N157-M264 VanDerWaalsContact CG-CE 3.45Å; N157-M264 WeakPolarHBondContact OD1-CE 3.3Å; N157-W268 HydrophobicContact CB-CD2 4.46Å; N157-W268 HydrophobicContact CB-CE3 4.29Å; N157-W268 HydrophobicContact CB-CH2 3.77Å; N157-W268 HydrophobicContact CB-CZ2 3.99Å; N157-W268 HydrophobicContact CB-CZ3 3.93Å; N157-L269 PolarHBondContact ND2-O 3.16Å; N157-L269 WeakPolarHBondContact OD1-CB 3.39Å; N157-L269 PolarHBondContact OD1-N 2.94Å |
| 158 | L | 97.1 | Very high | 95.2 | Very high | 7 Ų | 7 | 41.1 Ų | 41.1 | 4% | 0.037 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -63 | -42.9 | 172 | 179.4 | 59 | 0 | 0 | 0 | 112 | T139 V154 L155 A161 L162 M209 F213 | T139-L158 HydrophobicContact CG2-CB 4.32Å; T139-L158 HydrophobicContact CG2-CD2 4.17Å; T139-L158 HydrophobicContact CG2-CG 4.21Å; V154-L158 VanDerWaalsContact O-CB 3.32Å; V154-L158 WeakPolarHBondContact O-CB 3.3Å; V154-L158 PolarHBondContact O-N 2.92Å; L155-L158 PolarHBondContact O-N 3.29Å; L158-A161 WeakPolarHBondContact O-CB 3.44Å; L158-A161 PolarHBondContact O-N 2.99Å; L158-L162 HydrophobicContact CD1-CD1 4.41Å; L158-L162 HydrophobicContact CD1-CG 4.42Å; L158-L162 HydrophobicContact CG-CD1 4.16Å; L158-L162 WeakPolarHBondContact O-CG 3.35Å; L158-L162 PolarHBondContact O-N 3.36Å; L158-M209 HydrophobicContact CD1-CE 4.44Å; L158-F213 HydrophobicContact CB-CD1 4.36Å; L158-F213 HydrophobicContact CB-CE1 3.72Å; L158-F213 HydrophobicContact CB-CE2 4.46Å; L158-F213 HydrophobicContact CB-CZ 3.78Å; L158-F213 HydrophobicContact CD1-CD1 3.83Å; L158-F213 HydrophobicContact CD1-CE1 4.08Å; L158-F213 HydrophobicContact CD1-CG 4.14Å; L158-F213 HydrophobicContact CG-CE1 4.31Å |
| 159 | L | 96.9 | Very high | 95.3 | Very high | 31 Ų | 31 | 37.1 Ų | 37.1 | 16% | 0.162 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -63.1 | -43.4 | 177.7 | -177.2 | 61.1 | 0 | 0 | 0 | 111.2 | I136 T139 I140 L155 V156 A161 L162 I163 | I136-L159 HydrophobicContact CG2-CD1 4.19Å; T139-L159 HydrophobicContact CG2-CB 3.93Å; I140-L159 HydrophobicContact CG1-CD1 4.17Å; I140-L159 HydrophobicContact CG1-CD2 4.23Å; L155-L159 WeakPolarHBondContact O-CB 3.38Å; L155-L159 PolarHBondContact O-N 3.3Å; V156-L159 PolarHBondContact O-N 3.02Å; L159-A161 VanDerWaalsContact C-N 3.34Å; L159-A161 PolarHBondContact O-N 3.07Å; L159-L162 PolarHBondContact O-N 2.75Å; L159-I163 HydrophobicContact CD1-CD1 4.32Å; L159-I163 HydrophobicContact CG-CD1 4.06Å; L159-I163 VanDerWaalsContact O-CG1 3.31Å; L159-I163 WeakPolarHBondContact O-CG1 3.46Å; L159-I163 PolarHBondContact O-N 3.46Å |
| 160 | L | 96.4 | Very high | 95.3 | Very high | 66 Ų | 66 | 32.6 Ų | 32.6 | 35% | 0.346 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -59.2 | -45.3 | 174.3 | -179.8 | 64 | 0 | 0 | 0 | 111.3 | V156 N157 L162 I163 L164 L269 | V156-L160 PolarHBondContact O-N 3.07Å; N157-L160 PolarHBondContact O-N 2.8Å; L160-L162 PolarHBondContact O-N 2.98Å; L160-I163 PolarHBondContact O-N 2.92Å; L160-L164 WeakPolarHBondContact O-CB 3.36Å; L160-L164 PolarHBondContact O-N 3.45Å; L160-L269 HydrophobicContact CD2-CD1 4.02Å; L160-L269 HydrophobicContact CD2-CG 4.28Å |
| 161 | A | 97.1 | Very high | 95.4 | Very high | 1 Ų | 1 | 30.8 Ų | 30.8 | 1% | 0.008 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -59.1 | -45.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | N157 L158 L159 L164 D165 M209 M264 | N157-A161 WeakPolarHBondContact O-CB 3.37Å; N157-A161 PolarHBondContact O-N 2.99Å; L158-A161 WeakPolarHBondContact O-CB 3.44Å; L158-A161 PolarHBondContact O-N 2.99Å; L159-A161 VanDerWaalsContact C-N 3.34Å; L159-A161 PolarHBondContact O-N 3.07Å; A161-L164 PolarHBondContact O-N 2.9Å; A161-D165 WeakPolarHBondContact O-CB 3.11Å; A161-D165 PolarHBondContact O-N 2.86Å; A161-M209 HydrophobicContact CB-CE 3.87Å; A161-M209 HydrophobicContact CB-SD 3.65Å; A161-M209 VanDerWaalsContact O-SD 3.41Å; A161-M264 HydrophobicContact CB-CG 3.81Å |
| 162 | L | 97.1 | Very high | 95.5 | Very high | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63.7 | -42.1 | 178.2 | -74.2 | 165.9 | 0 | 0 | 0 | 112.4 | W135 I136 T139 L158 L159 L160 D165 V166 M209 V210 | W135-L162 HydrophobicContact CB-CD1 3.91Å; W135-L162 HydrophobicContact CB-CD2 3.71Å; W135-L162 HydrophobicContact CB-CG 4.5Å; W135-L162 HydrophobicContact CG-CD2 4.38Å; I136-L162 HydrophobicContact CG1-CB 4.08Å; I136-L162 HydrophobicContact CG1-CD1 4.4Å; T139-L162 WeakPolarHBondContact OG1-CD1 3.31Å; L158-L162 HydrophobicContact CD1-CD1 4.41Å; L158-L162 HydrophobicContact CD1-CG 4.42Å; L158-L162 HydrophobicContact CG-CD1 4.16Å; L158-L162 WeakPolarHBondContact O-CG 3.35Å; L158-L162 PolarHBondContact O-N 3.36Å; L159-L162 PolarHBondContact O-N 2.75Å; L160-L162 PolarHBondContact O-N 2.98Å; L162-D165 PolarHBondContact O-N 3.27Å; L162-V166 VanDerWaalsContact O-CG2 3.29Å; L162-V166 WeakPolarHBondContact O-CG2 3.34Å; L162-V166 PolarHBondContact O-N 2.91Å; L162-M209 HydrophobicContact CD2-CE 3.92Å; L162-M209 HydrophobicContact CG-CE 4.13Å; L162-V210 HydrophobicContact CD2-CG2 3.93Å |
| 163 | I | 96 | Very high | 95.4 | Very high | 75 Ų | 75 | 30.7 Ų | 30.7 | 39% | 0.385 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -63.9 | -48.1 | 176.7 | -68.6 | 166.8 | 0 | 0 | 0 | 109.9 | L159 L160 D165 V166 M167 | L159-I163 HydrophobicContact CD1-CD1 4.32Å; L159-I163 HydrophobicContact CG-CD1 4.06Å; L159-I163 VanDerWaalsContact O-CG1 3.31Å; L159-I163 WeakPolarHBondContact O-CG1 3.46Å; L159-I163 PolarHBondContact O-N 3.46Å; L160-I163 PolarHBondContact O-N 2.92Å; I163-D165 VanDerWaalsContact C-N 3.33Å; I163-D165 PolarHBondContact O-N 3.07Å; I163-V166 PolarHBondContact O-N 2.94Å; I163-M167 HydrophobicContact CG2-CG 4.29Å; I163-M167 HydrophobicContact CG2-SD 3.74Å; I163-M167 WeakPolarHBondContact O-CB 3.29Å; I163-M167 VanDerWaalsContact O-CG 3.27Å; I163-M167 WeakPolarHBondContact O-CG 3.45Å; I163-M167 PolarHBondContact O-N 3.38Å |
| 164 | L | 96.1 | Very high | 95.1 | Very high | 49 Ų | 49 | 36 Ų | 36 | 26% | 0.257 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -57.5 | -45.1 | 177.5 | 176.1 | 66 | 0 | 0 | 0 | 111.8 | L160 A161 T168 L263 | L160-L164 WeakPolarHBondContact O-CB 3.36Å; L160-L164 PolarHBondContact O-N 3.45Å; A161-L164 PolarHBondContact O-N 2.9Å; L164-T168 VanDerWaalsContact O-CB 3.3Å; L164-T168 WeakPolarHBondContact O-CB 3.33Å; L164-T168 PolarHBondContact O-N 3.3Å; L164-T168 PolarHBondContact O-OG1 3.07Å; L164-L263 HydrophobicContact CD2-CD2 3.87Å; L164-L263 HydrophobicContact CD2-CG 4.32Å |
| 165 | D | 96.5 | Very high | 94.9 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.5 | -50.6 | 178 | 177.8 | 93.3 | 0 | 0 | 0 | 111.8 | A161 L162 I163 M167 T168 V169 S205 R206 M209 H260 | A161-D165 WeakPolarHBondContact O-CB 3.11Å; A161-D165 PolarHBondContact O-N 2.86Å; L162-D165 PolarHBondContact O-N 3.27Å; I163-D165 VanDerWaalsContact C-N 3.33Å; I163-D165 PolarHBondContact O-N 3.07Å; D165-M167 VanDerWaalsContact C-N 3.33Å; D165-M167 PolarHBondContact O-N 2.97Å; D165-T168 PolarHBondContact O-N 3.41Å; D165-V169 WeakPolarHBondContact O-CB 3.18Å; D165-V169 VanDerWaalsContact O-CG2 3.28Å; D165-V169 WeakPolarHBondContact O-CG2 3.34Å; D165-V169 PolarHBondContact O-N 3.47Å; D165-S205 WeakPolarHBondContact OD1-CB 3.27Å; D165-S205 PolarHBondContact OD1-OG 3.31Å; D165-R206 WeakPolarHBondContact OD2-CG 3.43Å; D165-M209 HydrophobicContact CB-SD 3.96Å; D165-H260 IonicContact OD1-CE1 3.39Å; D165-H260 PolarHBondContact OD1-CE1 3.46Å; D165-H260 IonicContact OD1-ND1 2.87Å; D165-H260 PolarHBondContact OD1-ND1 3.33Å |
| 166 | V | 94.5 | Very high | 94.7 | Very high | 36 Ų | 36 | 43.6 Ų | 43.6 | 22% | 0.218 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -59.3 | -44.8 | 179.4 | 170.2 | 0 | 0 | 0 | 0 | 111 | I136 L162 I163 A170 | I136-V166 HydrophobicContact CD1-CG2 4.26Å; L162-V166 VanDerWaalsContact O-CG2 3.29Å; L162-V166 WeakPolarHBondContact O-CG2 3.34Å; L162-V166 PolarHBondContact O-N 2.91Å; I163-V166 PolarHBondContact O-N 2.94Å; V166-A170 WeakPolarHBondContact O-CB 3.45Å; V166-A170 PolarHBondContact O-N 2.92Å |
| 167 | M | 94.6 | Very high | 94.3 | Very high | 131 Ų | 131 | 48.8 Ų | 48.8 | 65% | 0.645 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -64.3 | -46.4 | 179.3 | -72.5 | -178.4 | 68.3 | 0 | 0 | 111.9 | I163 D165 G171 | I163-M167 HydrophobicContact CG2-CG 4.29Å; I163-M167 HydrophobicContact CG2-SD 3.74Å; I163-M167 WeakPolarHBondContact O-CB 3.29Å; I163-M167 VanDerWaalsContact O-CG 3.27Å; I163-M167 WeakPolarHBondContact O-CG 3.45Å; I163-M167 PolarHBondContact O-N 3.38Å; D165-M167 VanDerWaalsContact C-N 3.33Å; D165-M167 PolarHBondContact O-N 2.97Å; M167-G171 PolarHBondContact O-N 3.33Å |
| 168 | T | 94.9 | Very high | 93.7 | Very high | 46 Ų | 46 | 51.7 Ų | 51.7 | 28% | 0.282 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -67.4 | -48 | -177.8 | -55.5 | 0 | 0 | 0 | 0 | 110.8 | L164 D165 G171 V172 L256 H260 | L164-T168 VanDerWaalsContact O-CB 3.3Å; L164-T168 WeakPolarHBondContact O-CB 3.33Å; L164-T168 PolarHBondContact O-N 3.3Å; L164-T168 PolarHBondContact O-OG1 3.07Å; D165-T168 PolarHBondContact O-N 3.41Å; T168-G171 PolarHBondContact O-N 3.04Å; T168-V172 HydrophobicContact CG2-CG2 4.48Å; T168-V172 VanDerWaalsContact O-CG2 3.32Å; T168-V172 WeakPolarHBondContact O-CG2 3.45Å; T168-V172 PolarHBondContact O-N 3.39Å; T168-L256 HydrophobicContact CG2-CD1 4.46Å; T168-H260 WeakPolarHBondContact CB-NE2 3.25Å; T168-H260 WeakPolarHBondContact CG2-NE2 3.46Å |
| 169 | V | 94.3 | Very high | 93.2 | Very high | 3 Ų | 3 | 60 Ų | 60 | 2% | 0.018 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -62 | -47.8 | 178.5 | 171.7 | 0 | 0 | 0 | 0 | 111 | D165 G171 V172 Q173 P200 A202 L256 | D165-V169 WeakPolarHBondContact O-CB 3.18Å; D165-V169 VanDerWaalsContact O-CG2 3.28Å; D165-V169 WeakPolarHBondContact O-CG2 3.34Å; D165-V169 PolarHBondContact O-N 3.47Å; V169-G171 VanDerWaalsContact C-N 3.29Å; V169-G171 PolarHBondContact O-N 3.16Å; V169-V172 PolarHBondContact O-N 3.39Å; V169-Q173 HydrophobicContact CG1-CG 4.19Å; V169-Q173 VanDerWaalsContact O-CB 3.27Å; V169-Q173 WeakPolarHBondContact O-CB 3.25Å; V169-Q173 VanDerWaalsContact O-CG 3.31Å; V169-Q173 WeakPolarHBondContact O-CG 3.28Å; V169-Q173 PolarHBondContact O-N 3.01Å; V169-P200 HydrophobicContact CG1-CG 4.28Å; V169-P200 HydrophobicContact CG2-CG 4.42Å; V169-A202 HydrophobicContact CG1-CB 3.57Å; V169-L256 HydrophobicContact CG2-CD2 3.82Å |
| 170 | A | 92.1 | Very high | 92.4 | Very high | 8 Ų | 8 | 59.7 Ų | 59.7 | 7% | 0.066 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.3 | -38.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112 | V166 R174 M194 | V166-A170 WeakPolarHBondContact O-CB 3.45Å; V166-A170 PolarHBondContact O-N 2.92Å; A170-R174 WeakPolarHBondContact O-CB 3.45Å; A170-R174 VanDerWaalsContact O-CG 3.23Å; A170-R174 WeakPolarHBondContact O-CG 3.34Å; A170-R174 PolarHBondContact O-N 3.21Å; A170-M194 HydrophobicContact CB-CE 3.61Å |
| 171 | G | 93.3 | Very high | 91.6 | Very high | 31 Ų | 31 | 57.3 Ų | 57.3 | 32% | 0.32 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -59.4 | -54.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | M167 T168 V169 Q173 R174 L175 | M167-G171 PolarHBondContact O-N 3.33Å; T168-G171 PolarHBondContact O-N 3.04Å; V169-G171 VanDerWaalsContact C-N 3.29Å; V169-G171 PolarHBondContact O-N 3.16Å; G171-Q173 PolarHBondContact O-N 3.38Å; G171-R174 PolarHBondContact O-N 2.92Å; G171-L175 VanDerWaalsContact O-CG 3.32Å; G171-L175 WeakPolarHBondContact O-CG 3.38Å; G171-L175 PolarHBondContact O-N 2.87Å |
| 172 | V | 94.1 | Very high | 90.5 | Very high | 41 Ų | 41 | 62.4 Ų | 62.4 | 25% | 0.248 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.6 | -42.2 | 179.8 | -179.7 | 0 | 0 | 0 | 0 | 111.3 | T168 V169 R174 L175 V176 F199 P200 | T168-V172 HydrophobicContact CG2-CG2 4.48Å; T168-V172 VanDerWaalsContact O-CG2 3.32Å; T168-V172 WeakPolarHBondContact O-CG2 3.45Å; T168-V172 PolarHBondContact O-N 3.39Å; V169-V172 PolarHBondContact O-N 3.39Å; V172-R174 VanDerWaalsContact C-N 3.32Å; V172-R174 PolarHBondContact O-N 2.61Å; V172-L175 PolarHBondContact O-N 3.38Å; V172-L175 VanDerWaalsContact O-N 3.11Å; V172-V176 HydrophobicContact CG1-CG2 3.96Å; V172-V176 WeakPolarHBondContact O-CG2 3.48Å; V172-V176 PolarHBondContact O-N 3.46Å; V172-F199 HydrophobicContact CG1-CD1 4.12Å; V172-F199 HydrophobicContact CG1-CE1 4.04Å; V172-P200 HydrophobicContact CB-CG 4.46Å; V172-P200 HydrophobicContact CG1-CG 4.33Å |
| 173 | Q | 92.3 | Very high | 89 | Confident | 3 Ų | 3 | 70.1 Ų | 70.1 | 1% | 0.014 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -58.2 | -43.4 | 176.2 | -81.9 | -176.9 | -10.7 | 0 | 0 | 111.9 | V169 G171 L175 K177 M194 D195 Y197 F199 P200 | V169-Q173 HydrophobicContact CG1-CG 4.19Å; V169-Q173 VanDerWaalsContact O-CB 3.27Å; V169-Q173 WeakPolarHBondContact O-CB 3.25Å; V169-Q173 VanDerWaalsContact O-CG 3.31Å; V169-Q173 WeakPolarHBondContact O-CG 3.28Å; V169-Q173 PolarHBondContact O-N 3.01Å; G171-Q173 PolarHBondContact O-N 3.38Å; Q173-L175 VanDerWaalsContact C-N 3.32Å; Q173-L175 PolarHBondContact O-N 3.23Å; Q173-K177 WeakPolarHBondContact O-CA 3.43Å; Q173-K177 PolarHBondContact O-N 2.92Å; Q173-M194 PolarHBondContact OE1-O 2.93Å; Q173-D195 PolarHBondContact NE2-OD1 3.3Å; Q173-Y197 HydrophobicContact CB-CD2 4.15Å; Q173-Y197 PolarHBondContact NE2-O 3.07Å; Q173-Y197 VanDerWaalsContact NE2-O 3.07Å; Q173-Y197 VanDerWaalsContact O-CD2 3.23Å; Q173-Y197 WeakPolarHBondContact O-CD2 3.31Å; Q173-F199 WeakPolarHBondContact CA-O 3.41Å; Q173-F199 WeakPolarHBondContact CG-O 3.29Å; Q173-P200 PolarHBondContact NE2-O 2.84Å; Q173-P200 VanDerWaalsContact NE2-O 3.09Å |
| 174 | R | 90 | Very high | 87.7 | Confident | 149 Ų | 149 | 69.5 Ų | 69.5 | 56% | 0.562 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -68.5 | -28.5 | 176.5 | -74.1 | 173.9 | 179 | -170.7 | -1.1 | 113.6 | A170 G171 V172 K177 M194 | A170-R174 WeakPolarHBondContact O-CB 3.45Å; A170-R174 VanDerWaalsContact O-CG 3.23Å; A170-R174 WeakPolarHBondContact O-CG 3.34Å; A170-R174 PolarHBondContact O-N 3.21Å; G171-R174 PolarHBondContact O-N 2.92Å; V172-R174 VanDerWaalsContact C-N 3.32Å; V172-R174 PolarHBondContact O-N 2.61Å; R174-K177 WeakPolarHBondContact O-CE 3.29Å; R174-K177 VanDerWaalsContact O-CG 3.24Å; R174-K177 WeakPolarHBondContact O-CG 3.4Å; R174-M194 PolarHBondContact NH2-SD 3.09Å |
| 175 | L | 91.4 | Very high | 86.5 | Confident | 147 Ų | 147 | 71.6 Ų | 71.6 | 77% | 0.77 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -77.8 | -47.4 | 177.2 | -68.6 | 172.4 | 0 | 0 | 0 | 111.7 | G171 V172 Q173 | G171-L175 VanDerWaalsContact O-CG 3.32Å; G171-L175 WeakPolarHBondContact O-CG 3.38Å; G171-L175 PolarHBondContact O-N 2.87Å; V172-L175 PolarHBondContact O-N 3.38Å; V172-L175 VanDerWaalsContact O-N 3.11Å; Q173-L175 VanDerWaalsContact C-N 3.32Å; Q173-L175 PolarHBondContact O-N 3.23Å |
| 176 | V | 90.4 | Very high | 85.2 | Confident | 75 Ų | 75 | 74.9 Ų | 74.9 | 46% | 0.455 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -82.1 | -35.8 | -173.2 | -179.2 | 0 | 0 | 0 | 0 | 112 | V172 R178 F199 | V172-V176 HydrophobicContact CG1-CG2 3.96Å; V172-V176 WeakPolarHBondContact O-CG2 3.48Å; V172-V176 PolarHBondContact O-N 3.46Å; V176-R178 HydrophobicContact CG1-CB 4.02Å; V176-R178 PolarHBondContact O-N 3.34Å; V176-F199 HydrophobicContact CB-CD1 4.15Å; V176-F199 HydrophobicContact CG1-CB 4.25Å; V176-F199 HydrophobicContact CG1-CD1 3.96Å; V176-F199 HydrophobicContact CG1-CG 4.36Å; V176-F199 HydrophobicContact CG2-CD1 3.9Å; V176-F199 HydrophobicContact CG2-CE1 4.27Å |
| 177 | K | 88.6 | Confident | 84.2 | Confident | 125 Ų | 125 | 74.6 Ų | 74.6 | 54% | 0.543 | 39% | 0.39 | S | S | . | . | trans | 50.8 | 29.7 | 179.6 | -56.3 | -174.8 | -178.7 | 173.9 | 0 | 115 | Q173 R174 R179 Y197 | Q173-K177 WeakPolarHBondContact O-CA 3.43Å; Q173-K177 PolarHBondContact O-N 2.92Å; R174-K177 WeakPolarHBondContact O-CE 3.29Å; R174-K177 VanDerWaalsContact O-CG 3.24Å; R174-K177 WeakPolarHBondContact O-CG 3.4Å; K177-R179 PolarHBondContact O-N 2.89Å; K177-Y197 HydrophobicContact CB-CD1 3.93Å; K177-Y197 HydrophobicContact CB-CE1 3.56Å; K177-Y197 HydrophobicContact CD-CE1 4.47Å; K177-Y197 HydrophobicContact CG-CD1 4.43Å; K177-Y197 HydrophobicContact CG-CE1 3.84Å; K177-Y197 HydrophobicContact CG-CE2 4.22Å | ||
| 178 | R | 85.1 | Confident | 83.2 | Confident | 61 Ų | 61 | 76.3 Ų | 76.3 | 23% | 0.23 | 39% | 0.394 | C | S | . | . | P | Polyproline II helix | trans | -64.4 | 132.2 | 177.9 | -169.7 | -176.9 | -179.6 | -176.3 | -0.8 | 109.7 | D99 V176 S198 F199 H246 T248 D249 | D99-R178 IonicContact OD2-NH2 3.33Å; D99-R178 PolarHBondContact OD2-NH2 3.22Å; V176-R178 HydrophobicContact CG1-CB 4.02Å; V176-R178 PolarHBondContact O-N 3.34Å; R178-S198 PolarHBondContact O-N 3.03Å; R178-F199 HydrophobicContact CB-CB 3.81Å; R178-F199 HydrophobicContact CG-CB 4.44Å; R178-H246 VanDerWaalsContact CZ-CD2 3.44Å; R178-H246 PolarHBondContact NE-CD2 3.2Å; R178-H246 PolarHBondContact NH2-CD2 3.4Å; R178-H246 VanDerWaalsContact NH2-CD2 3.34Å; R178-H246 VanDerWaalsContact NH2-CG 3.32Å; R178-T248 PolarHBondContact NH1-OG1 3.01Å; R178-D249 IonicContact CZ-OD1 3.42Å; R178-D249 IonicContact NE-OD1 2.83Å; R178-D249 IonicContact NH1-OD1 2.63Å; R178-D249 PolarHBondContact NH1-OD1 3.44Å; R178-D249 IonicContact NH1-OD2 3.97Å |
| 179 | R | 85.1 | Confident | 81.9 | Confident | 182 Ų | 182 | 78.2 Ų | 78.2 | 69% | 0.687 | 40% | 0.402 | S | S | * | . | P | Polyproline II helix | trans | -84.2 | 146.9 | 174.1 | -66.3 | -172 | -178.1 | -177 | 3.4 | 111.5 | K177 E183 S198 H246 | K177-R179 PolarHBondContact O-N 2.89Å; R179-E183 IonicContact NH1-OE1 3.75Å; R179-E183 PolarHBondContact NH1-OE1 2.98Å; R179-S198 PolarHBondContact O-OG 3.48Å; R179-H246 PolarHBondContact O-NE2 2.92Å |
| 180 | G | 81.1 | Confident | 80.9 | Confident | 24 Ų | 24 | 78.6 Ų | 78.6 | 25% | 0.247 | 40% | 0.404 | C | S | . | . | P | Polyproline II helix | trans | -65.7 | 166.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | W182 K244 | G180-W182 VanDerWaalsContact C-N 3.29Å; G180-W182 PolarHBondContact O-N 3.28Å; G180-K244 WeakPolarHBondContact CA-O 3.25Å |
| 181 | P | 79.3 | Confident | 79.8 | Confident | 16 Ų | 16 | 81.3 Ų | 81.3 | 10% | 0.104 | 42% | 0.422 | C | S | . | . | S | Bend | trans | -63 | -33.3 | -179.5 | -9.6 | 15.2 | 0 | 0 | 0 | 114 | K104 G243 H245 | K104-P181 HydrophobicContact CG-CB 4.4Å; P181-G243 WeakPolarHBondContact CD-O 3.47Å; P181-H245 WeakPolarHBondContact CG-O 3.49Å |
| 182 | W | 72.8 | Confident | 78.6 | Confident | 109 Ų | 109 | 83.5 Ų | 83.5 | 41% | 0.413 | 43% | 0.429 | S | S | . | . | S | Bend | trans | -113.6 | 127.8 | 174.6 | -67.2 | 82.4 | 0 | 0 | 0 | 109 | A110 G180 M184 G243 | A110-W182 HydrophobicContact CB-CD2 4.19Å; A110-W182 HydrophobicContact CB-CG 4.37Å; G180-W182 VanDerWaalsContact C-N 3.29Å; G180-W182 PolarHBondContact O-N 3.28Å; W182-M184 HydrophobicContact CB-CE 3.95Å; W182-M184 HydrophobicContact CB-CG 4.22Å; W182-M184 HydrophobicContact CG-CE 4.32Å; W182-M184 PolarHBondContact O-N 2.94Å; W182-G243 PolarHBondContact N-O 3.32Å |
| 183 | E | 66.9 | Low | 77.2 | Confident | 161 Ų | 161 | 82.4 Ų | 82.4 | 75% | 0.752 | 43% | 0.425 | S | S | * | . | trans | -73.8 | 82.2 | 173.6 | -64.5 | -162.5 | 147.7 | 0 | 0 | 109.4 | R179 | R179-E183 IonicContact NH1-OE1 3.75Å; R179-E183 PolarHBondContact NH1-OE1 2.98Å | ||
| 184 | M | 68.6 | Low | 76.1 | Confident | 63 Ų | 63 | 85.9 Ų | 85.9 | 31% | 0.31 | 44% | 0.442 | S | S | . | . | P | Polyproline II helix | trans | -97.8 | 140.3 | 171.7 | -64.8 | -169.6 | -170.6 | 0 | 0 | 110 | A110 W182 | A110-M184 HydrophobicContact CB-CE 3.52Å; A110-M184 WeakPolarHBondContact O-CE 3.32Å; W182-M184 HydrophobicContact CB-CE 3.95Å; W182-M184 HydrophobicContact CB-CG 4.22Å; W182-M184 HydrophobicContact CG-CE 4.32Å; W182-M184 PolarHBondContact O-N 2.94Å |
| 185 | A | 70.5 | Confident | 75.3 | Confident | 93 Ų | 93 | 79.2 Ų | 79.2 | 77% | 0.769 | 42% | 0.417 | S | S | * | . | P | Polyproline II helix | trans | -59 | 131.7 | 168 | 0 | 0 | 0 | 0 | 0 | 109.2 | G187 | A185-G187 PolarHBondContact O-N 3.29Š|
| 186 | P | 69.8 | Low | 74.5 | Confident | 68 Ų | 68 | 76 Ų | 76 | 44% | 0.442 | 40% | 0.403 | S | S | . | . | P | Polyproline II helix | trans | -62.2 | 134.1 | 178.9 | 26 | -33 | 0 | 0 | 0 | 109.5 | D190 | P186-D190 HydrophobicContact CB-CB 4.43Š|
| 187 | G | 72.3 | Confident | 74.3 | Confident | 31 Ų | 31 | 75.9 Ų | 75.9 | 32% | 0.32 | 40% | 0.395 | S | S | . | . | P | Polyproline II helix | trans | -73 | 164.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | A185 L189 D190 C191 | A185-G187 PolarHBondContact O-N 3.29Å; G187-L189 VanDerWaalsContact C-N 3.28Å; G187-L189 PolarHBondContact O-N 3.47Å; G187-D190 PolarHBondContact N-OD2 3.45Å; G187-D190 VanDerWaalsContact N-OD2 3.1Å; G187-D190 PolarHBondContact O-N 3.14Å; G187-C191 PolarHBondContact O-N 3Å |
| 188 | F | 73.6 | Confident | 74.1 | Confident | 166 Ų | 166 | 70 Ų | 70 | 73% | 0.728 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -50.8 | -47.7 | 177.2 | 175.8 | -103.2 | 0 | 0 | 0 | 112.4 | D190 C191 V192 | F188-D190 PolarHBondContact O-N 3.48Å; F188-C191 WeakPolarHBondContact O-CB 3.27Å; F188-C191 PolarHBondContact O-N 2.84Å; F188-V192 HydrophobicContact CD1-CG2 4.37Å; F188-V192 HydrophobicContact CD2-CG2 4.38Å; F188-V192 HydrophobicContact CE1-CG2 3.99Å; F188-V192 HydrophobicContact CE2-CG2 4Å; F188-V192 HydrophobicContact CZ-CG2 3.79Å; F188-V192 VanDerWaalsContact O-CG2 3.31Å; F188-V192 WeakPolarHBondContact O-CG2 3.4Å; F188-V192 PolarHBondContact O-N 2.88Å |
| 189 | L | 68.9 | Low | 74.3 | Confident | 86 Ų | 86 | 69.6 Ų | 69.6 | 45% | 0.45 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -65.9 | -35.9 | 179.3 | -66.7 | 178.2 | 0 | 0 | 0 | 113.1 | L128 H131 G187 C191 V192 A193 | L128-L189 HydrophobicContact CD1-CD1 4.06Å; H131-L189 PolarHBondContact NE2-O 3Å; G187-L189 VanDerWaalsContact C-N 3.28Å; G187-L189 PolarHBondContact O-N 3.47Å; L189-C191 VanDerWaalsContact C-N 3.33Å; L189-V192 PolarHBondContact O-N 3.32Å; L189-A193 WeakPolarHBondContact O-CB 3.44Å; L189-A193 PolarHBondContact O-N 2.97Å |
| 190 | D | 72.8 | Confident | 74.6 | Confident | 12 Ų | 12 | 61.1 Ų | 61.1 | 6% | 0.064 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -66.9 | -38.3 | 177.7 | -55.4 | -62.6 | 0 | 0 | 0 | 110.4 | P186 G187 F188 A193 M194 D195 R239 K244 | P186-D190 HydrophobicContact CB-CB 4.43Å; G187-D190 PolarHBondContact N-OD2 3.45Å; G187-D190 VanDerWaalsContact N-OD2 3.1Å; G187-D190 PolarHBondContact O-N 3.14Å; F188-D190 PolarHBondContact O-N 3.48Å; D190-A193 PolarHBondContact O-N 3.39Å; D190-M194 PolarHBondContact O-N 2.92Å; D190-D195 PolarHBondContact O-N 2.93Å; D190-R239 IonicContact OD1-CZ 3.22Å; D190-R239 IonicContact OD1-NH1 2.92Å; D190-R239 PolarHBondContact OD1-NH1 3.23Å; D190-R239 IonicContact OD1-NH2 3.72Å; D190-R239 PolarHBondContact OD1-NH2 3.28Å; D190-K244 VanDerWaalsContact CG-NZ 3.25Å; D190-K244 IonicContact OD1-NZ 2.66Å; D190-K244 PolarHBondContact OD1-NZ 3.04Å; D190-K244 IonicContact OD2-NZ 3.72Å; D190-K244 PolarHBondContact OD2-NZ 3.49Å |
| 191 | C | 69.8 | Low | 75.2 | Confident | 65 Ų | 65 | 60.1 Ų | 60.1 | 44% | 0.439 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -64.3 | -46.9 | 174.3 | -68.4 | 0 | 0 | 0 | 0 | 112.2 | G187 F188 L189 A193 M194 | G187-C191 PolarHBondContact O-N 3Å; F188-C191 WeakPolarHBondContact O-CB 3.27Å; F188-C191 PolarHBondContact O-N 2.84Å; L189-C191 VanDerWaalsContact C-N 3.33Å; C191-A193 VanDerWaalsContact C-N 3.3Å; C191-A193 PolarHBondContact O-N 3.32Å; C191-M194 PolarHBondContact O-N 2.85Å; C191-M194 VanDerWaalsContact O-N 3.12Å |
| 192 | V | 67.6 | Low | 75.9 | Confident | 77 Ų | 77 | 59.4 Ų | 59.4 | 47% | 0.467 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -65.8 | -36.2 | 179.7 | -179.9 | 0 | 0 | 0 | 0 | 110.9 | I133 F188 L189 M194 | I133-V192 HydrophobicContact CD1-CB 4.35Å; I133-V192 HydrophobicContact CD1-CG1 3.54Å; F188-V192 HydrophobicContact CD1-CG2 4.37Å; F188-V192 HydrophobicContact CD2-CG2 4.38Å; F188-V192 HydrophobicContact CE1-CG2 3.99Å; F188-V192 HydrophobicContact CE2-CG2 4Å; F188-V192 HydrophobicContact CZ-CG2 3.79Å; F188-V192 VanDerWaalsContact O-CG2 3.31Å; F188-V192 WeakPolarHBondContact O-CG2 3.4Å; F188-V192 PolarHBondContact O-N 2.88Å; L189-V192 PolarHBondContact O-N 3.32Å; V192-M194 PolarHBondContact O-N 3.24Å |
| 193 | A | 64.6 | Low | 76.9 | Confident | 18 Ų | 18 | 54.3 Ų | 54.3 | 15% | 0.149 | 30% | 0.304 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -76.7 | -3 | 176 | 0 | 0 | 0 | 0 | 0 | 114.4 | H131 L189 D190 C191 D195 | H131-A193 VanDerWaalsContact CE1-CB 3.45Å; H131-A193 WeakPolarHBondContact CE1-CB 3.12Å; H131-A193 WeakPolarHBondContact NE2-CB 3.35Å; L189-A193 WeakPolarHBondContact O-CB 3.44Å; L189-A193 PolarHBondContact O-N 2.97Å; D190-A193 PolarHBondContact O-N 3.39Å; C191-A193 VanDerWaalsContact C-N 3.3Å; C191-A193 PolarHBondContact O-N 3.32Å; A193-D195 HydrophobicContact CB-CB 4.25Å; A193-D195 PolarHBondContact O-N 3.38Å |
| 194 | M | 68.2 | Low | 78.3 | Confident | 76 Ų | 76 | 46.6 Ų | 46.6 | 37% | 0.374 | 27% | 0.268 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 55.3 | 23.2 | -169.9 | -54.4 | -153.7 | -66.2 | 0 | 0 | 114.6 | A170 Q173 R174 D190 C191 V192 V196 | A170-M194 HydrophobicContact CB-CE 3.61Å; Q173-M194 PolarHBondContact OE1-O 2.93Å; R174-M194 PolarHBondContact NH2-SD 3.09Å; D190-M194 PolarHBondContact O-N 2.92Å; C191-M194 PolarHBondContact O-N 2.85Å; C191-M194 VanDerWaalsContact O-N 3.12Å; V192-M194 PolarHBondContact O-N 3.24Å; M194-V196 PolarHBondContact O-N 3.48Å; M194-V196 VanDerWaalsContact O-N 3.12Å |
| 195 | D | 73.6 | Confident | 79.7 | Confident | 9 Ų | 9 | 43.6 Ų | 43.6 | 5% | 0.048 | 25% | 0.253 | C | S | . | . | trans | -89.6 | 51 | -179.2 | -165.7 | 35 | 0 | 0 | 0 | 110.5 | Q173 D190 A193 A202 H203 R239 H245 | Q173-D195 PolarHBondContact NE2-OD1 3.3Å; D190-D195 PolarHBondContact O-N 2.93Å; A193-D195 HydrophobicContact CB-CB 4.25Å; A193-D195 PolarHBondContact O-N 3.38Å; D195-A202 WeakPolarHBondContact OD1-CB 3.28Å; D195-H203 IonicContact OD2-CE1 3.26Å; D195-H203 PolarHBondContact OD2-CE1 3.05Å; D195-H203 IonicContact OD2-ND1 3.79Å; D195-H203 PolarHBondContact OD2-ND1 3.11Å; D195-R239 IonicContact OD2-CZ 3.19Å; D195-R239 IonicContact OD2-NH2 3.95Å; D195-R239 PolarHBondContact OD2-NH2 3.21Å; D195-H245 IonicContact OD1-CE1 3.4Å; D195-H245 IonicContact OD1-NE2 3.03Å; D195-H245 IonicContact OD2-NE2 3.76Å | ||
| 196 | V | 75.8 | Confident | 81 | Confident | 79 Ų | 79 | 39.5 Ų | 39.5 | 48% | 0.479 | 22% | 0.218 | S | C | . | . | trans | -82.7 | -30.7 | -176.8 | -179.9 | 0 | 0 | 0 | 0 | 111.5 | M194 | M194-V196 PolarHBondContact O-N 3.48Å; M194-V196 VanDerWaalsContact O-N 3.12Å | ||
| 197 | Y | 84.7 | Confident | 82.3 | Confident | 72 Ų | 72 | 36.2 Ų | 36.2 | 28% | 0.282 | 20% | 0.197 | S | C | . | . | S | Bend | trans | -104 | 153.9 | -177.6 | -58.4 | -72.5 | 0 | 0 | 0 | 111.2 | Q173 K177 | Q173-Y197 HydrophobicContact CB-CD2 4.15Å; Q173-Y197 PolarHBondContact NE2-O 3.07Å; Q173-Y197 VanDerWaalsContact NE2-O 3.07Å; Q173-Y197 VanDerWaalsContact O-CD2 3.23Å; Q173-Y197 WeakPolarHBondContact O-CD2 3.31Å; K177-Y197 HydrophobicContact CB-CD1 3.93Å; K177-Y197 HydrophobicContact CB-CE1 3.56Å; K177-Y197 HydrophobicContact CD-CE1 4.47Å; K177-Y197 HydrophobicContact CG-CD1 4.43Å; K177-Y197 HydrophobicContact CG-CE1 3.84Å; K177-Y197 HydrophobicContact CG-CE2 4.22Å |
| 198 | S | 84.8 | Confident | 83.5 | Confident | 2 Ų | 2 | 35.2 Ų | 35.2 | 1% | 0.014 | 19% | 0.186 | C | C | . | . | trans | -83.2 | -27.4 | -172.2 | 84 | 0 | 0 | 0 | 0 | 113.9 | R178 R179 P200 H245 D249 | R178-S198 PolarHBondContact O-N 3.03Å; R179-S198 PolarHBondContact O-OG 3.48Å; S198-P200 CarbonylContact O-C 3.34Å; S198-P200 VanDerWaalsContact O-C 3.3Å; S198-H245 PolarHBondContact O-CE1 3.42Å; S198-H245 PolarHBondContact O-ND1 3.27Å; S198-D249 WeakPolarHBondContact CB-OD2 3.42Å; S198-D249 WeakPolarHBondContact O-CB 3.33Å; S198-D249 VanDerWaalsContact O-CG 3.3Å; S198-D249 PolarHBondContact OG-OD2 2.83Å | ||
| 199 | F | 89.1 | Confident | 84.7 | Confident | 53 Ų | 53 | 27.3 Ų | 27.3 | 23% | 0.232 | 15% | 0.151 | C | C | . | . | S | Bend | trans | -110.5 | 129.2 | -173.8 | -175.6 | -87.4 | 0 | 0 | 0 | 112.6 | V172 Q173 V176 R178 D249 C252 | V172-F199 HydrophobicContact CG1-CD1 4.12Å; V172-F199 HydrophobicContact CG1-CE1 4.04Å; Q173-F199 WeakPolarHBondContact CA-O 3.41Å; Q173-F199 WeakPolarHBondContact CG-O 3.29Å; V176-F199 HydrophobicContact CB-CD1 4.15Å; V176-F199 HydrophobicContact CG1-CB 4.25Å; V176-F199 HydrophobicContact CG1-CD1 3.96Å; V176-F199 HydrophobicContact CG1-CG 4.36Å; V176-F199 HydrophobicContact CG2-CD1 3.9Å; V176-F199 HydrophobicContact CG2-CE1 4.27Å; R178-F199 HydrophobicContact CB-CB 3.81Å; R178-F199 HydrophobicContact CG-CB 4.44Å; F199-D249 WeakPolarHBondContact CB-OD1 3.3Å; F199-D249 VanDerWaalsContact CD2-OD1 3.25Å; F199-D249 WeakPolarHBondContact CD2-OD1 3.38Å; F199-C252 HydrophobicContact CE2-CB 3.68Å; F199-C252 HydrophobicContact CZ-CB 4.14Å |
| 200 | P | 92 | Very high | 86.1 | Confident | 4 Ų | 4 | 23.2 Ų | 23.2 | 3% | 0.026 | 13% | 0.129 | C | C | . | . | S | Bend | cis | -76.6 | 169 | -13.2 | 32.3 | -36.3 | 0 | 0 | 0 | 111.3 | V169 V172 Q173 S198 A202 L256 | V169-P200 HydrophobicContact CG1-CG 4.28Å; V169-P200 HydrophobicContact CG2-CG 4.42Å; V172-P200 HydrophobicContact CB-CG 4.46Å; V172-P200 HydrophobicContact CG1-CG 4.33Å; Q173-P200 PolarHBondContact NE2-O 2.84Å; Q173-P200 VanDerWaalsContact NE2-O 3.09Å; S198-P200 CarbonylContact O-C 3.34Å; S198-P200 VanDerWaalsContact O-C 3.3Å; P200-A202 PolarHBondContact O-N 3.43Å; P200-A202 VanDerWaalsContact O-N 3.09Å; P200-L256 HydrophobicContact CB-CD2 4.36Å; P200-L256 HydrophobicContact CG-CD2 3.72Å |
| 201 | A | 93.6 | Very high | 87.2 | Confident | 2 Ų | 2 | 22.9 Ų | 22.9 | 2% | 0.017 | 13% | 0.128 | C | C | . | . | trans | -71.9 | 104.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | H203 A204 S205 H245 D249 | A201-H203 VanDerWaalsContact C-N 3.34Å; A201-H203 PolarHBondContact O-N 2.94Å; A201-A204 HydrophobicContact CB-CB 3.92Å; A201-A204 PolarHBondContact O-N 2.91Å; A201-S205 PolarHBondContact O-N 2.88Å; A201-H245 HydrophobicContact CB-CB 4.47Å; A201-D249 HydrophobicContact CB-CB 4.31Å; A201-D249 VanDerWaalsContact CB-O 3.23Å; A201-D249 WeakPolarHBondContact CB-O 3.1Å; A201-D249 PolarHBondContact N-O 3.43Å; A201-D249 VanDerWaalsContact N-O 3.09Å | ||
| 202 | A | 93.6 | Very high | 88.6 | Confident | 2 Ų | 2 | 23.3 Ų | 23.3 | 2% | 0.017 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -57.9 | -42.4 | -177 | 0 | 0 | 0 | 0 | 0 | 113.6 | V169 D195 P200 S205 R206 | V169-A202 HydrophobicContact CG1-CB 3.57Å; D195-A202 WeakPolarHBondContact OD1-CB 3.28Å; P200-A202 PolarHBondContact O-N 3.43Å; P200-A202 VanDerWaalsContact O-N 3.09Å; A202-S205 PolarHBondContact O-N 3.22Å; A202-R206 PolarHBondContact O-N 3.03Å |
| 203 | H | 94.8 | Very high | 90 | Very high | 1 Ų | 1 | 19.7 Ų | 19.7 | 1% | 0.005 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -66.6 | -38.9 | -179.8 | -68.8 | 76.1 | 0 | 0 | 0 | 111.9 | A127 H131 D195 A201 A207 V235 R239 | A127-H203 PolarHBondContact O-CD2 3.47Å; A127-H203 VanDerWaalsContact O-CD2 3.22Å; H131-H203 AromaticContact CD2-NE2 3.97Å; D195-H203 IonicContact OD2-CE1 3.26Å; D195-H203 PolarHBondContact OD2-CE1 3.05Å; D195-H203 IonicContact OD2-ND1 3.79Å; D195-H203 PolarHBondContact OD2-ND1 3.11Å; A201-H203 VanDerWaalsContact C-N 3.34Å; A201-H203 PolarHBondContact O-N 2.94Å; H203-A207 WeakPolarHBondContact O-CB 3.3Å; H203-A207 PolarHBondContact O-N 2.83Å; H203-V235 HydrophobicContact CB-CG1 4Å; H203-R239 HydrophobicContact CB-CG 3.81Å |
| 204 | A | 96.9 | Very high | 91.5 | Very high | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -67.9 | -43.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | A201 A207 A208 M250 F254 | A201-A204 HydrophobicContact CB-CB 3.92Å; A201-A204 PolarHBondContact O-N 2.91Å; A204-A207 PolarHBondContact O-N 3.39Å; A204-A208 WeakPolarHBondContact O-CB 3.44Å; A204-A208 PolarHBondContact O-N 3.07Å; A204-M250 HydrophobicContact CB-CG 4.14Å; A204-F254 HydrophobicContact CB-CD1 3.78Å; A204-F254 HydrophobicContact CB-CD2 4.45Å; A204-F254 HydrophobicContact CB-CE1 3.77Å; A204-F254 HydrophobicContact CB-CE2 4.42Å; A204-F254 HydrophobicContact CB-CG 4.15Å; A204-F254 HydrophobicContact CB-CZ 4.1Å; A204-F254 VanDerWaalsContact O-CD1 3.25Å; A204-F254 WeakPolarHBondContact O-CD1 3.42Å |
| 205 | S | 97.5 | Very high | 92.8 | Very high | 0 Ų | 0 | 18.2 Ų | 18.2 | 0% | 0 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -57.5 | -55.4 | 175.6 | -170.5 | 0 | 0 | 0 | 0 | 112 | D165 A201 A202 A207 A208 M209 G253 G257 | D165-S205 WeakPolarHBondContact OD1-CB 3.27Å; D165-S205 PolarHBondContact OD1-OG 3.31Å; A201-S205 PolarHBondContact O-N 2.88Å; A202-S205 PolarHBondContact O-N 3.22Å; S205-A207 PolarHBondContact O-N 3.43Å; S205-A208 PolarHBondContact O-N 3.48Å; S205-M209 WeakPolarHBondContact O-CB 3.23Å; S205-M209 PolarHBondContact O-N 3.43Å; S205-G253 WeakPolarHBondContact CA-O 3.24Å; S205-G253 WeakPolarHBondContact CB-O 3.23Å; S205-G253 PolarHBondContact N-O 2.95Å; S205-G257 VanDerWaalsContact O-CA 3.27Å; S205-G257 WeakPolarHBondContact O-CA 3.44Å; S205-G257 PolarHBondContact OG-N 2.92Å |
| 206 | R | 96.9 | Very high | 93.8 | Very high | 6 Ų | 6 | 20 Ų | 20 | 2% | 0.023 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -57.8 | -48.6 | 177.3 | -80.9 | -172.2 | -74.6 | -96.3 | -1.5 | 112.6 | G130 D165 A202 A208 M209 V210 | G130-R206 PolarHBondContact O-NE 2.92Å; D165-R206 WeakPolarHBondContact OD2-CG 3.43Å; A202-R206 PolarHBondContact O-N 3.03Å; R206-A208 VanDerWaalsContact C-N 3.33Å; R206-A208 PolarHBondContact O-N 2.91Å; R206-M209 PolarHBondContact O-N 2.97Å; R206-V210 WeakPolarHBondContact O-CB 2.94Å; R206-V210 VanDerWaalsContact O-CG2 3.28Å; R206-V210 WeakPolarHBondContact O-CG2 3.13Å; R206-V210 PolarHBondContact O-N 3.45Å |
| 207 | A | 97.6 | Very high | 94.6 | Very high | 0 Ų | 0 | 19.2 Ų | 19.2 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -64.7 | -39.7 | -174.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | H203 A204 S205 S211 W231 A232 V235 | H203-A207 WeakPolarHBondContact O-CB 3.3Å; H203-A207 PolarHBondContact O-N 2.83Å; A204-A207 PolarHBondContact O-N 3.39Å; S205-A207 PolarHBondContact O-N 3.43Å; A207-S211 WeakPolarHBondContact O-CB 3.49Å; A207-S211 PolarHBondContact O-N 3.02Å; A207-S211 PolarHBondContact O-OG 3.39Å; A207-S211 VanDerWaalsContact O-OG 3.08Å; A207-W231 HydrophobicContact CB-CH2 4.03Å; A207-W231 HydrophobicContact CB-CZ3 4.03Å; A207-A232 HydrophobicContact CB-CB 3.95Å; A207-V235 HydrophobicContact CB-CB 4.07Å; A207-V235 HydrophobicContact CB-CG1 3.86Å |
| 208 | A | 98 | Very high | 94.9 | Very high | 10 Ų | 10 | 19.2 Ų | 19.2 | 8% | 0.083 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -63.4 | -49.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | A204 S205 R206 V210 S211 K212 F254 M258 | A204-A208 WeakPolarHBondContact O-CB 3.44Å; A204-A208 PolarHBondContact O-N 3.07Å; S205-A208 PolarHBondContact O-N 3.48Å; R206-A208 VanDerWaalsContact C-N 3.33Å; R206-A208 PolarHBondContact O-N 2.91Å; A208-V210 PolarHBondContact O-N 3.24Å; A208-S211 PolarHBondContact O-N 3.29Å; A208-K212 VanDerWaalsContact O-CB 3.28Å; A208-K212 WeakPolarHBondContact O-CB 3.5Å; A208-K212 PolarHBondContact O-N 2.95Å; A208-F254 HydrophobicContact CB-CD1 3.77Å; A208-M258 HydrophobicContact CB-SD 4.5Å |
| 209 | M | 98.1 | Very high | 95.2 | Very high | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -58.2 | -50.8 | 179.7 | -177 | -145.2 | 76.1 | 0 | 0 | 111 | L158 A161 L162 D165 S205 R206 K212 F213 G257 H260 F261 | L158-M209 HydrophobicContact CD1-CE 4.44Å; A161-M209 HydrophobicContact CB-CE 3.87Å; A161-M209 HydrophobicContact CB-SD 3.65Å; A161-M209 VanDerWaalsContact O-SD 3.41Å; L162-M209 HydrophobicContact CD2-CE 3.92Å; L162-M209 HydrophobicContact CG-CE 4.13Å; D165-M209 HydrophobicContact CB-SD 3.96Å; S205-M209 WeakPolarHBondContact O-CB 3.23Å; S205-M209 PolarHBondContact O-N 3.43Å; R206-M209 PolarHBondContact O-N 2.97Å; M209-K212 PolarHBondContact O-N 3.5Å; M209-F213 VanDerWaalsContact O-CB 3.25Å; M209-F213 WeakPolarHBondContact O-CB 3.33Å; M209-F213 PolarHBondContact O-N 2.63Å; M209-G257 WeakPolarHBondContact CB-O 3.25Å; M209-H260 HydrophobicContact CG-CB 4.05Å; M209-H260 HydrophobicContact SD-CB 4.37Å; M209-F261 HydrophobicContact CG-CB 4.46Å |
| 210 | V | 97.6 | Very high | 95.3 | Very high | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -64 | -48.5 | -179.4 | 171.8 | 0 | 0 | 0 | 0 | 110.7 | W135 L162 R206 A208 K212 F213 L214 W231 | W135-V210 HydrophobicContact CD2-CG1 4.14Å; W135-V210 HydrophobicContact CD2-CG2 4.24Å; W135-V210 HydrophobicContact CE3-CG1 3.9Å; W135-V210 HydrophobicContact CE3-CG2 4.4Å; W135-V210 HydrophobicContact CH2-CG1 3.43Å; W135-V210 VanDerWaalsContact CH2-CG1 3.43Å; W135-V210 HydrophobicContact CZ2-CG1 3.67Å; W135-V210 HydrophobicContact CZ3-CG1 3.55Å; L162-V210 HydrophobicContact CD2-CG2 3.93Å; R206-V210 WeakPolarHBondContact O-CB 2.94Å; R206-V210 VanDerWaalsContact O-CG2 3.28Å; R206-V210 WeakPolarHBondContact O-CG2 3.13Å; R206-V210 PolarHBondContact O-N 3.45Å; A208-V210 PolarHBondContact O-N 3.24Å; V210-K212 VanDerWaalsContact C-N 3.33Å; V210-K212 PolarHBondContact O-N 3.33Å; V210-F213 PolarHBondContact O-N 3.26Å; V210-L214 HydrophobicContact CG1-CD1 3.8Å; V210-L214 HydrophobicContact CG1-CG 4.18Å; V210-L214 VanDerWaalsContact O-CG 3.3Å; V210-L214 WeakPolarHBondContact O-CG 3.38Å; V210-L214 PolarHBondContact O-N 2.99Å; V210-W231 HydrophobicContact CG1-CH2 4.46Å; V210-W231 HydrophobicContact CG1-CZ3 4.46Å |
| 211 | S | 97.3 | Very high | 95.4 | Very high | 5 Ų | 5 | 28 Ų | 28 | 4% | 0.035 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59.3 | -45.8 | 179.2 | -74.2 | 0 | 0 | 0 | 0 | 111.5 | A207 A208 L214 L215 L228 W231 A232 | A207-S211 WeakPolarHBondContact O-CB 3.49Å; A207-S211 PolarHBondContact O-N 3.02Å; A207-S211 PolarHBondContact O-OG 3.39Å; A207-S211 VanDerWaalsContact O-OG 3.08Å; A208-S211 PolarHBondContact O-N 3.29Å; S211-L214 PolarHBondContact O-N 3.09Å; S211-L215 WeakPolarHBondContact O-CB 3.5Å; S211-L215 WeakPolarHBondContact O-CG 3.45Å; S211-L215 PolarHBondContact O-N 3.09Å; S211-L228 WeakPolarHBondContact OG-CG 3.48Å; S211-L228 PolarHBondContact OG-O 3.41Å; S211-W231 VanDerWaalsContact OG-CE3 3.28Å; S211-W231 VanDerWaalsContact OG-CZ3 3.31Å; S211-W231 WeakPolarHBondContact OG-CZ3 3.34Å; S211-A232 WeakPolarHBondContact OG-CB 3.47Å |
| 212 | K | 97.4 | Very high | 95.4 | Very high | 73 Ų | 73 | 32.9 Ų | 32.9 | 32% | 0.317 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -66.1 | -39.4 | 179.3 | -179.1 | 57.1 | -177 | 154.9 | 0 | 112.1 | A208 M209 V210 L215 S216 M258 F261 | A208-K212 VanDerWaalsContact O-CB 3.28Å; A208-K212 WeakPolarHBondContact O-CB 3.5Å; A208-K212 PolarHBondContact O-N 2.95Å; M209-K212 PolarHBondContact O-N 3.5Å; V210-K212 VanDerWaalsContact C-N 3.33Å; V210-K212 PolarHBondContact O-N 3.33Å; K212-L215 PolarHBondContact O-N 3.34Å; K212-S216 PolarHBondContact NZ-OG 3.02Å; K212-S216 WeakPolarHBondContact O-CB 3.2Å; K212-S216 PolarHBondContact O-N 3.38Å; K212-S216 VanDerWaalsContact O-N 3.16Å; K212-S216 PolarHBondContact O-OG 2.9Å; K212-M258 HydrophobicContact CB-CE 4.38Å; K212-M258 HydrophobicContact CB-SD 4.06Å; K212-M258 HydrophobicContact CD-CE 4.1Å; K212-M258 HydrophobicContact CG-CE 3.86Å; K212-M258 HydrophobicContact CG-SD 4.19Å; K212-F261 HydrophobicContact CB-CB 4.5Å; K212-F261 HydrophobicContact CB-CD1 4.41Å; K212-F261 HydrophobicContact CB-CD2 4.36Å; K212-F261 HydrophobicContact CB-CG 4.13Å; K212-F261 HydrophobicContact CD-CD1 4.31Å; K212-F261 HydrophobicContact CD-CE1 4.13Å; K212-F261 HydrophobicContact CD-CZ 4.47Å; K212-F261 VanDerWaalsContact CE-CE1 3.4Å; K212-F261 HydrophobicContact CG-CB 4.25Å; K212-F261 HydrophobicContact CG-CD1 3.35Å; K212-F261 HydrophobicContact CG-CD2 3.92Å; K212-F261 HydrophobicContact CG-CE1 3.58Å; K212-F261 HydrophobicContact CG-CE2 4.14Å; K212-F261 HydrophobicContact CG-CG 3.52Å; K212-F261 HydrophobicContact CG-CZ 3.96Å |
| 213 | F | 97.2 | Very high | 95.5 | Very high | 1 Ų | 1 | 37.2 Ų | 37.2 | 0% | 0.004 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -58.8 | -52.9 | 174.6 | -175.9 | -82.7 | 0 | 0 | 0 | 111.5 | V154 N157 L158 M209 V210 L215 S216 H217 F261 M264 W268 | V154-F213 HydrophobicContact CG1-CE1 3.66Å; V154-F213 HydrophobicContact CG1-CZ 4.01Å; V154-F213 WeakPolarHBondContact O-CZ 3.47Å; N157-F213 HydrophobicContact CB-CE2 4.35Å; N157-F213 HydrophobicContact CB-CZ 4.3Å; L158-F213 HydrophobicContact CB-CD1 4.36Å; L158-F213 HydrophobicContact CB-CE1 3.72Å; L158-F213 HydrophobicContact CB-CE2 4.46Å; L158-F213 HydrophobicContact CB-CZ 3.78Å; L158-F213 HydrophobicContact CD1-CD1 3.83Å; L158-F213 HydrophobicContact CD1-CE1 4.08Å; L158-F213 HydrophobicContact CD1-CG 4.14Å; L158-F213 HydrophobicContact CG-CE1 4.31Å; M209-F213 VanDerWaalsContact O-CB 3.25Å; M209-F213 WeakPolarHBondContact O-CB 3.33Å; M209-F213 PolarHBondContact O-N 2.63Å; V210-F213 PolarHBondContact O-N 3.26Å; F213-L215 VanDerWaalsContact C-N 3.34Å; F213-L215 PolarHBondContact O-N 2.71Å; F213-S216 PolarHBondContact O-N 2.7Å; F213-S216 VanDerWaalsContact O-N 3.13Å; F213-H217 AromaticContact CD2-CD2 3.85Å; F213-H217 HydrophobicContact CE1-CB 4.47Å; F213-H217 AromaticContact CE2-CD2 3.84Å; F213-H217 AromaticContact CZ-CD2 3.99Å; F213-H217 PolarHBondContact O-CD2 3.19Å; F213-H217 PolarHBondContact O-N 3.07Å; F213-F261 HydrophobicContact CB-CD2 4.06Å; F213-F261 HydrophobicContact CB-CE2 4.3Å; F213-F261 HydrophobicContact CD2-CD2 4.43Å; F213-F261 HydrophobicContact CD2-CE2 4.49Å; F213-M264 HydrophobicContact CD2-SD 4.15Å; F213-M264 HydrophobicContact CE2-SD 3.72Å; F213-W268 HydrophobicContact CD2-CZ3 4.43Å; F213-W268 AromaticContact CE2-CH2 3.83Å; F213-W268 HydrophobicContact CE2-CH2 3.83Å; F213-W268 AromaticContact CE2-CZ3 3.53Å; F213-W268 HydrophobicContact CE2-CZ3 3.53Å; F213-W268 AromaticContact CZ-CH2 3.75Å; F213-W268 HydrophobicContact CZ-CH2 3.75Å; F213-W268 AromaticContact CZ-CZ3 3.96Å; F213-W268 HydrophobicContact CZ-CZ3 3.96Å |
| 214 | L | 96.2 | Very high | 95.4 | Very high | 32 Ų | 32 | 41.5 Ų | 41.5 | 17% | 0.168 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -64.7 | -37.5 | -178.8 | -63.3 | 176.1 | 0 | 0 | 0 | 112.1 | W135 V210 S211 S216 L218 L228 | W135-L214 HydrophobicContact CH2-CD1 4.11Å; W135-L214 HydrophobicContact CZ3-CD1 4.43Å; V210-L214 HydrophobicContact CG1-CD1 3.8Å; V210-L214 HydrophobicContact CG1-CG 4.18Å; V210-L214 VanDerWaalsContact O-CG 3.3Å; V210-L214 WeakPolarHBondContact O-CG 3.38Å; V210-L214 PolarHBondContact O-N 2.99Å; S211-L214 PolarHBondContact O-N 3.09Å; L214-S216 PolarHBondContact O-N 3.04Å; L214-L218 HydrophobicContact CB-CD1 3.96Å; L214-L218 HydrophobicContact CD2-CD1 3.33Å; L214-L218 HydrophobicContact CG-CD1 4.23Å; L214-L218 WeakPolarHBondContact O-CB 3.35Å; L214-L218 PolarHBondContact O-N 2.9Å; L214-L228 HydrophobicContact CB-CD2 3.78Å; L214-L228 HydrophobicContact CD1-CD1 4.29Å; L214-L228 HydrophobicContact CD1-CD2 4.16Å |
| 215 | L | 95.9 | Very high | 95.3 | Very high | 32 Ų | 32 | 45.8 Ų | 45.8 | 17% | 0.168 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.6 | -29 | 175.8 | -75.1 | 172.7 | 0 | 0 | 0 | 113.6 | S211 K212 F213 R225 L228 V229 | S211-L215 WeakPolarHBondContact O-CB 3.5Å; S211-L215 WeakPolarHBondContact O-CG 3.45Å; S211-L215 PolarHBondContact O-N 3.09Å; K212-L215 PolarHBondContact O-N 3.34Å; F213-L215 VanDerWaalsContact C-N 3.34Å; F213-L215 PolarHBondContact O-N 2.71Å; L215-R225 HydrophobicContact CD2-CB 3.49Å; L215-R225 VanDerWaalsContact CD2-CB 3.49Å; L215-R225 HydrophobicContact CD2-CG 3.52Å; L215-R225 PolarHBondContact O-NH1 3.45Å; L215-L228 HydrophobicContact CD2-CD2 4.3Å; L215-L228 HydrophobicContact CG-CD2 4.08Å; L215-V229 HydrophobicContact CD1-CG2 3.88Å |
| 216 | S | 94.3 | Very high | 95.3 | Very high | 47 Ų | 47 | 51.1 Ų | 51.1 | 33% | 0.329 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -92.4 | -37.2 | -174.3 | -50.1 | 0 | 0 | 0 | 0 | 111.6 | K212 F213 L214 F261 | K212-S216 PolarHBondContact NZ-OG 3.02Å; K212-S216 WeakPolarHBondContact O-CB 3.2Å; K212-S216 PolarHBondContact O-N 3.38Å; K212-S216 VanDerWaalsContact O-N 3.16Å; K212-S216 PolarHBondContact O-OG 2.9Å; F213-S216 PolarHBondContact O-N 2.7Å; F213-S216 VanDerWaalsContact O-N 3.13Å; L214-S216 PolarHBondContact O-N 3.04Å; S216-F261 WeakPolarHBondContact OG-CZ 3.21Å |
| 217 | H | 92.6 | Very high | 95.2 | Very high | 62 Ų | 62 | 56 Ų | 56 | 29% | 0.287 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -102.4 | -13 | -176 | -62.3 | -69 | 0 | 0 | 0 | 115.1 | V154 F213 W268 | V154-H217 HydrophobicContact CG1-CB 4.36Å; F213-H217 AromaticContact CD2-CD2 3.85Å; F213-H217 HydrophobicContact CE1-CB 4.47Å; F213-H217 AromaticContact CE2-CD2 3.84Å; F213-H217 AromaticContact CZ-CD2 3.99Å; F213-H217 PolarHBondContact O-CD2 3.19Å; F213-H217 PolarHBondContact O-N 3.07Å; H217-W268 AromaticContact CD2-CH2 3.73Å; H217-W268 AromaticContact CD2-CZ3 3.65Å; H217-W268 AromaticContact CE1-CE3 3.78Å; H217-W268 AromaticContact CE1-CH2 3.38Å; H217-W268 WeakPolarHBondContact CE1-CH2 3.46Å; H217-W268 AromaticContact CE1-CZ3 3.19Å; H217-W268 WeakPolarHBondContact CE1-CZ3 3.24Å; H217-W268 AromaticContact CG-CH2 3.69Å; H217-W268 AromaticContact ND1-CH2 3.46Å; H217-W268 WeakPolarHBondContact ND1-CH2 3.33Å; H217-W268 AromaticContact ND1-CZ3 3.79Å; H217-W268 AromaticContact NE2-CE3 3.9Å; H217-W268 AromaticContact NE2-CH2 3.58Å; H217-W268 AromaticContact NE2-CZ3 3.1Å; H217-W268 WeakPolarHBondContact NE2-CZ3 3.33Å |
| 218 | L | 91.8 | Very high | 95.2 | Very high | 72 Ų | 72 | 57.1 Ų | 57.1 | 38% | 0.377 | 32% | 0.317 | S | S | . | . | S | Bend | trans | -112.8 | 141.8 | 173.4 | -65.7 | 98.2 | 0 | 0 | 0 | 112.2 | L214 L220 | L214-L218 HydrophobicContact CB-CD1 3.96Å; L214-L218 HydrophobicContact CD2-CD1 3.33Å; L214-L218 HydrophobicContact CG-CD1 4.23Å; L214-L218 WeakPolarHBondContact O-CB 3.35Å; L214-L218 PolarHBondContact O-N 2.9Å; L218-L220 HydrophobicContact CB-CD1 3.24Å; L218-L220 HydrophobicContact CD2-CD1 4.42Å; L218-L220 HydrophobicContact CG-CD1 4.38Å; L218-L220 PolarHBondContact O-N 3.49Å; L218-L220 VanDerWaalsContact O-N 3.07Å |
| 219 | V | 90.6 | Very high | 95.1 | Very high | 150 Ų | 150 | 60.6 Ų | 60.6 | 91% | 0.909 | 34% | 0.337 | S | S | * | . | trans | -81.7 | 87.1 | 173.6 | -174.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 220 | L | 91.3 | Very high | 95 | Very high | 36 Ų | 36 | 64.6 Ų | 64.6 | 19% | 0.188 | 36% | 0.358 | C | S | . | . | trans | -93.3 | 142.8 | 175.8 | -87.5 | 63.9 | 0 | 0 | 0 | 111.4 | L218 L224 R225 L228 | L218-L220 HydrophobicContact CB-CD1 3.24Å; L218-L220 HydrophobicContact CD2-CD1 4.42Å; L218-L220 HydrophobicContact CG-CD1 4.38Å; L218-L220 PolarHBondContact O-N 3.49Å; L218-L220 VanDerWaalsContact O-N 3.07Å; L220-L224 HydrophobicContact CB-CB 4.19Å; L220-L224 HydrophobicContact CD2-CB 3.99Å; L220-L224 HydrophobicContact CG-CB 4.18Å; L220-L224 HydrophobicContact CG-CD1 4.44Å; L220-R225 HydrophobicContact CB-CG 3.85Å; L220-R225 PolarHBondContact O-NE 2.92Å; L220-L228 HydrophobicContact CD2-CD2 4.22Å | ||
| 221 | A | 94 | Very high | 95.1 | Very high | 58 Ų | 58 | 66.6 Ų | 66.6 | 48% | 0.479 | 37% | 0.366 | S | S | . | . | trans | -59.7 | 146.8 | 166.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | P223 L224 R225 | A221-P223 VanDerWaalsContact C-CD 3.49Å; A221-P223 HydrophobicContact CB-CG 4.32Å; A221-L224 HydrophobicContact CB-CD1 4.41Å; A221-L224 WeakPolarHBondContact O-CB 3.47Å; A221-L224 PolarHBondContact O-N 2.88Å; A221-R225 PolarHBondContact O-N 3.06Å; A221-R225 VanDerWaalsContact O-N 3.13Å | ||
| 222 | V | 93.3 | Very high | 95 | Very high | 104 Ų | 104 | 66.7 Ų | 66.7 | 63% | 0.63 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -45.8 | -48.9 | 179.8 | 179.8 | 0 | 0 | 0 | 0 | 113.9 | L224 R225 I226 | V222-L224 VanDerWaalsContact C-N 3.31Å; V222-L224 PolarHBondContact O-N 3.31Å; V222-R225 WeakPolarHBondContact O-CB 3.28Å; V222-R225 PolarHBondContact O-N 3.41Å; V222-R225 VanDerWaalsContact O-N 3.13Å; V222-I226 HydrophobicContact CG1-CD1 4.22Å; V222-I226 PolarHBondContact O-N 3.17Å |
| 223 | P | 95.5 | Very high | 95 | Very high | 93 Ų | 93 | 68.3 Ų | 68.3 | 60% | 0.604 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -62.5 | -35.3 | 179.4 | 21.1 | -32.6 | 0 | 0 | 0 | 113.5 | A221 R225 I226 L227 | A221-P223 VanDerWaalsContact C-CD 3.49Å; A221-P223 HydrophobicContact CB-CG 4.32Å; P223-R225 VanDerWaalsContact C-N 3.33Å; P223-I226 PolarHBondContact O-N 3.15Å; P223-L227 WeakPolarHBondContact O-CB 3.22Å; P223-L227 PolarHBondContact O-N 3.19Å |
| 224 | L | 94.4 | Very high | 95 | Very high | 91 Ų | 91 | 71.4 Ų | 71.4 | 48% | 0.476 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -67.9 | -35.5 | 176.4 | -66.4 | 175.2 | 0 | 0 | 0 | 111.6 | L220 A221 V222 L227 L228 | L220-L224 HydrophobicContact CB-CB 4.19Å; L220-L224 HydrophobicContact CD2-CB 3.99Å; L220-L224 HydrophobicContact CG-CB 4.18Å; L220-L224 HydrophobicContact CG-CD1 4.44Å; A221-L224 HydrophobicContact CB-CD1 4.41Å; A221-L224 WeakPolarHBondContact O-CB 3.47Å; A221-L224 PolarHBondContact O-N 2.88Å; V222-L224 VanDerWaalsContact C-N 3.31Å; V222-L224 PolarHBondContact O-N 3.31Å; L224-L227 PolarHBondContact O-N 3.35Å; L224-L228 WeakPolarHBondContact O-CB 3.32Å; L224-L228 PolarHBondContact O-N 2.58Å |
| 225 | R | 94.8 | Very high | 95 | Very high | 90 Ų | 90 | 69.9 Ų | 69.9 | 34% | 0.34 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -61.6 | -45.8 | 175.4 | -61.1 | -177.8 | 176.1 | -99 | -3.5 | 111.2 | L215 L220 A221 V222 P223 L228 V229 | L215-R225 HydrophobicContact CD2-CB 3.49Å; L215-R225 VanDerWaalsContact CD2-CB 3.49Å; L215-R225 HydrophobicContact CD2-CG 3.52Å; L215-R225 PolarHBondContact O-NH1 3.45Å; L220-R225 HydrophobicContact CB-CG 3.85Å; L220-R225 PolarHBondContact O-NE 2.92Å; A221-R225 PolarHBondContact O-N 3.06Å; A221-R225 VanDerWaalsContact O-N 3.13Å; V222-R225 WeakPolarHBondContact O-CB 3.28Å; V222-R225 PolarHBondContact O-N 3.41Å; V222-R225 VanDerWaalsContact O-N 3.13Å; P223-R225 VanDerWaalsContact C-N 3.33Å; R225-L228 PolarHBondContact O-N 3.29Å; R225-V229 WeakPolarHBondContact O-CG2 3.16Å; R225-V229 PolarHBondContact O-N 3.37Å; R225-V229 VanDerWaalsContact O-N 3.15Å |
| 226 | I | 95.8 | Very high | 94.9 | Very high | 112 Ų | 112 | 68.4 Ų | 68.4 | 57% | 0.574 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -62.1 | -46.9 | 177.2 | -62.2 | 169 | 0 | 0 | 0 | 110.2 | V222 P223 L228 V229 L230 | V222-I226 HydrophobicContact CG1-CD1 4.22Å; V222-I226 PolarHBondContact O-N 3.17Å; P223-I226 PolarHBondContact O-N 3.15Å; I226-L228 PolarHBondContact O-N 3.39Å; I226-V229 PolarHBondContact O-N 3.22Å; I226-L230 WeakPolarHBondContact O-CB 3.32Å; I226-L230 PolarHBondContact O-N 3.43Å |
| 227 | L | 96.2 | Very high | 94.9 | Very high | 107 Ų | 107 | 67.5 Ų | 67.5 | 56% | 0.56 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -60.3 | -35.9 | 179.5 | -174.1 | 60.5 | 0 | 0 | 0 | 112 | P223 L224 L230 W231 | P223-L227 WeakPolarHBondContact O-CB 3.22Å; P223-L227 PolarHBondContact O-N 3.19Å; L224-L227 PolarHBondContact O-N 3.35Å; L227-L230 PolarHBondContact O-N 2.61Å; L227-W231 VanDerWaalsContact O-CB 3.28Å; L227-W231 WeakPolarHBondContact O-CB 3.41Å; L227-W231 PolarHBondContact O-N 3.22Å |
| 228 | L | 96.1 | Very high | 95 | Very high | 24 Ų | 24 | 64.6 Ų | 64.6 | 13% | 0.126 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -72.9 | -37.9 | -179.4 | -169.5 | 63.3 | 0 | 0 | 0 | 113 | S211 L214 L215 L220 L224 R225 I226 W231 A232 | S211-L228 WeakPolarHBondContact OG-CG 3.48Å; S211-L228 PolarHBondContact OG-O 3.41Å; L214-L228 HydrophobicContact CB-CD2 3.78Å; L214-L228 HydrophobicContact CD1-CD1 4.29Å; L214-L228 HydrophobicContact CD1-CD2 4.16Å; L215-L228 HydrophobicContact CD2-CD2 4.3Å; L215-L228 HydrophobicContact CG-CD2 4.08Å; L220-L228 HydrophobicContact CD2-CD2 4.22Å; L224-L228 WeakPolarHBondContact O-CB 3.32Å; L224-L228 PolarHBondContact O-N 2.58Å; R225-L228 PolarHBondContact O-N 3.29Å; I226-L228 PolarHBondContact O-N 3.39Å; L228-W231 HydrophobicContact CD1-CE3 3.83Å; L228-W231 HydrophobicContact CD1-CZ3 4.3Å; L228-A232 PolarHBondContact O-N 3.42Å |
| 229 | V | 96.6 | Very high | 95 | Very high | 84 Ų | 84 | 61.7 Ų | 61.7 | 51% | 0.509 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -66.3 | -43.7 | 171.9 | 175.5 | 0 | 0 | 0 | 0 | 110.3 | L215 R225 I226 W231 A232 F233 | L215-V229 HydrophobicContact CD1-CG2 3.88Å; R225-V229 WeakPolarHBondContact O-CG2 3.16Å; R225-V229 PolarHBondContact O-N 3.37Å; R225-V229 VanDerWaalsContact O-N 3.15Å; I226-V229 PolarHBondContact O-N 3.22Å; V229-W231 PolarHBondContact O-N 2.81Å; V229-A232 PolarHBondContact O-N 3.41Å; V229-F233 PolarHBondContact O-N 3.38Å |
| 230 | L | 97.2 | Very high | 95 | Very high | 84 Ų | 84 | 54.5 Ų | 54.5 | 44% | 0.44 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -61.2 | -45.1 | 176.3 | -179.2 | 61.9 | 0 | 0 | 0 | 111.1 | I226 L227 A232 F233 L234 | I226-L230 WeakPolarHBondContact O-CB 3.32Å; I226-L230 PolarHBondContact O-N 3.43Å; L227-L230 PolarHBondContact O-N 2.61Å; L230-A232 VanDerWaalsContact C-N 3.34Å; L230-A232 PolarHBondContact O-N 3.25Å; L230-F233 PolarHBondContact O-N 3.48Å; L230-L234 HydrophobicContact CD1-CD1 4.15Å; L230-L234 HydrophobicContact CD1-CG 4.08Å; L230-L234 HydrophobicContact CD2-CD1 4.44Å; L230-L234 HydrophobicContact CG-CD1 3.84Å; L230-L234 HydrophobicContact CG-CG 4.21Å; L230-L234 VanDerWaalsContact O-CB 3.32Å; L230-L234 WeakPolarHBondContact O-CB 3.44Å; L230-L234 WeakPolarHBondContact O-CG 3.37Å; L230-L234 PolarHBondContact O-N 3.29Å |
| 231 | W | 97.7 | Very high | 94.9 | Very high | 41 Ų | 41 | 54.7 Ų | 54.7 | 16% | 0.155 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -56.1 | -47.1 | 174.9 | 167.5 | 77.6 | 0 | 0 | 0 | 111.6 | T129 W135 A207 V210 S211 L227 L228 V229 F233 L234 V235 | T129-W231 PolarHBondContact OG1-NE1 3.22Å; W135-W231 AromaticContact CE2-CH2 3.87Å; W135-W231 AromaticContact CZ2-CH2 3.54Å; W135-W231 HydrophobicContact CZ2-CH2 3.54Å; W135-W231 AromaticContact CZ2-CZ2 3.84Å; W135-W231 HydrophobicContact CZ2-CZ2 3.84Å; W135-W231 HydrophobicContact CZ2-CZ3 4.33Å; W135-W231 AromaticContact NE1-CH2 3.78Å; W135-W231 AromaticContact NE1-CZ2 3.81Å; A207-W231 HydrophobicContact CB-CH2 4.03Å; A207-W231 HydrophobicContact CB-CZ3 4.03Å; V210-W231 HydrophobicContact CG1-CH2 4.46Å; V210-W231 HydrophobicContact CG1-CZ3 4.46Å; S211-W231 VanDerWaalsContact OG-CE3 3.28Å; S211-W231 VanDerWaalsContact OG-CZ3 3.31Å; S211-W231 WeakPolarHBondContact OG-CZ3 3.34Å; L227-W231 VanDerWaalsContact O-CB 3.28Å; L227-W231 WeakPolarHBondContact O-CB 3.41Å; L227-W231 PolarHBondContact O-N 3.22Å; L228-W231 HydrophobicContact CD1-CE3 3.83Å; L228-W231 HydrophobicContact CD1-CZ3 4.3Å; V229-W231 PolarHBondContact O-N 2.81Å; W231-F233 VanDerWaalsContact C-N 3.35Å; W231-F233 PolarHBondContact O-N 3.38Å; W231-L234 PolarHBondContact O-N 2.93Å; W231-V235 HydrophobicContact CD2-CG2 4.28Å; W231-V235 HydrophobicContact CG-CG2 4.4Å; W231-V235 HydrophobicContact CZ2-CG2 4.09Å; W231-V235 WeakPolarHBondContact O-CB 3.19Å; W231-V235 WeakPolarHBondContact O-CG2 3.45Å; W231-V235 PolarHBondContact O-N 2.91Å |
| 232 | A | 97.3 | Very high | 94.6 | Very high | 7 Ų | 7 | 52.1 Ų | 52.1 | 6% | 0.058 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -61.3 | -43.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | A207 S211 L228 V229 L230 V235 G236 F254 | A207-A232 HydrophobicContact CB-CB 3.95Å; S211-A232 WeakPolarHBondContact OG-CB 3.47Å; L228-A232 PolarHBondContact O-N 3.42Å; V229-A232 PolarHBondContact O-N 3.41Å; L230-A232 VanDerWaalsContact C-N 3.34Å; L230-A232 PolarHBondContact O-N 3.25Å; A232-V235 PolarHBondContact O-N 3.18Å; A232-G236 PolarHBondContact O-N 3.12Å; A232-F254 WeakPolarHBondContact O-CE1 3.49Å; A232-F254 WeakPolarHBondContact O-CZ 3.29Å |
| 233 | F | 96.8 | Very high | 94.2 | Very high | 107 Ų | 107 | 47.1 Ų | 47.1 | 47% | 0.469 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -61.9 | -46.4 | 175.3 | -178.5 | -103.7 | 0 | 0 | 0 | 111.8 | V229 L230 W231 V235 G236 I237 F254 | V229-F233 PolarHBondContact O-N 3.38Å; L230-F233 PolarHBondContact O-N 3.48Å; W231-F233 VanDerWaalsContact C-N 3.35Å; W231-F233 PolarHBondContact O-N 3.38Å; F233-V235 PolarHBondContact O-N 3.01Å; F233-G236 PolarHBondContact O-N 3.25Å; F233-I237 PolarHBondContact O-N 3.19Å; F233-F254 HydrophobicContact CD2-CE2 4.46Å |
| 234 | L | 96.7 | Very high | 93.7 | Very high | 67 Ų | 67 | 45 Ų | 45 | 35% | 0.351 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -62.7 | -41 | 179.4 | -74 | 179.2 | 0 | 0 | 0 | 112.1 | L126 L230 W231 I237 S238 | L126-L234 HydrophobicContact CD1-CB 4.37Å; L126-L234 HydrophobicContact CD2-CB 3.91Å; L230-L234 HydrophobicContact CD1-CD1 4.15Å; L230-L234 HydrophobicContact CD1-CG 4.08Å; L230-L234 HydrophobicContact CD2-CD1 4.44Å; L230-L234 HydrophobicContact CG-CD1 3.84Å; L230-L234 HydrophobicContact CG-CG 4.21Å; L230-L234 VanDerWaalsContact O-CB 3.32Å; L230-L234 WeakPolarHBondContact O-CB 3.44Å; L230-L234 WeakPolarHBondContact O-CG 3.37Å; L230-L234 PolarHBondContact O-N 3.29Å; W231-L234 PolarHBondContact O-N 2.93Å; L234-I237 WeakPolarHBondContact O-CG2 3.31Å; L234-S238 VanDerWaalsContact O-CB 3.3Å; L234-S238 WeakPolarHBondContact O-CB 3.39Å; L234-S238 PolarHBondContact O-N 3.05Å |
| 235 | V | 96.4 | Very high | 93.6 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -63.4 | -44.4 | 174.1 | 166.7 | 0 | 0 | 0 | 0 | 111.1 | L126 H203 A207 W231 A232 F233 S238 | L126-V235 HydrophobicContact CD1-CG2 4.05Å; L126-V235 HydrophobicContact CG-CG2 4.41Å; H203-V235 HydrophobicContact CB-CG1 4Å; A207-V235 HydrophobicContact CB-CB 4.07Å; A207-V235 HydrophobicContact CB-CG1 3.86Å; W231-V235 HydrophobicContact CD2-CG2 4.28Å; W231-V235 HydrophobicContact CG-CG2 4.4Å; W231-V235 HydrophobicContact CZ2-CG2 4.09Å; W231-V235 WeakPolarHBondContact O-CB 3.19Å; W231-V235 WeakPolarHBondContact O-CG2 3.45Å; W231-V235 PolarHBondContact O-N 2.91Å; A232-V235 PolarHBondContact O-N 3.18Å; F233-V235 PolarHBondContact O-N 3.01Å; V235-S238 WeakPolarHBondContact O-CB 3.23Å; V235-S238 PolarHBondContact O-N 3.36Å; V235-S238 PolarHBondContact O-OG 2.64Å |
| 236 | G | 94.3 | Very high | 93.4 | Very high | 1 Ų | 1 | 37 Ų | 37 | 1% | 0.01 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -61.2 | -50 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | A232 F233 S238 R239 | A232-G236 PolarHBondContact O-N 3.12Å; F233-G236 PolarHBondContact O-N 3.25Å; G236-S238 VanDerWaalsContact C-N 3.3Å; G236-S238 PolarHBondContact O-N 2.97Å; G236-R239 PolarHBondContact O-N 2.86Å |
| 237 | I | 93.8 | Very high | 93.2 | Very high | 28 Ų | 28 | 33.8 Ų | 33.8 | 14% | 0.144 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -68.3 | -29.9 | -178.6 | -158.8 | 67.1 | 0 | 0 | 0 | 112.1 | F233 L234 R239 V240 L241 M250 | F233-I237 PolarHBondContact O-N 3.19Å; L234-I237 WeakPolarHBondContact O-CG2 3.31Å; I237-R239 PolarHBondContact O-N 3Å; I237-R239 VanDerWaalsContact O-N 3.09Å; I237-V240 HydrophobicContact CD1-CB 4.3Å; I237-V240 HydrophobicContact CD1-CG2 4.45Å; I237-V240 PolarHBondContact O-N 3.47Å; I237-L241 HydrophobicContact CG1-CG 4.36Å; I237-L241 HydrophobicContact CG2-CD1 4.39Å; I237-L241 WeakPolarHBondContact O-CG 3.27Å; I237-L241 PolarHBondContact O-N 2.79Å; I237-M250 HydrophobicContact CB-SD 4.3Å; I237-M250 HydrophobicContact CD1-CE 4.46Å; I237-M250 HydrophobicContact CD1-SD 3.87Å |
| 238 | S | 94 | Very high | 93 | Very high | 0 Ų | 0 | 31.2 Ų | 31.2 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -52.2 | -36.9 | 178.7 | 76 | 0 | 0 | 0 | 0 | 112.5 | V123 L234 V235 G236 L241 L242 | V123-S238 WeakPolarHBondContact CG1-O 3.37Å; L234-S238 VanDerWaalsContact O-CB 3.3Å; L234-S238 WeakPolarHBondContact O-CB 3.39Å; L234-S238 PolarHBondContact O-N 3.05Å; V235-S238 WeakPolarHBondContact O-CB 3.23Å; V235-S238 PolarHBondContact O-N 3.36Å; V235-S238 PolarHBondContact O-OG 2.64Å; G236-S238 VanDerWaalsContact C-N 3.3Å; G236-S238 PolarHBondContact O-N 2.97Å; S238-L241 PolarHBondContact O-N 3.12Å; S238-L242 WeakPolarHBondContact O-CB 3.48Å; S238-L242 VanDerWaalsContact O-CG 3.24Å; S238-L242 WeakPolarHBondContact O-CG 3.45Å; S238-L242 PolarHBondContact O-N 3.12Å |
| 239 | R | 91.4 | Very high | 92.9 | Very high | 11 Ų | 11 | 30.1 Ų | 30.1 | 4% | 0.042 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -74.2 | -30.6 | -179.5 | -63.7 | -56.7 | -70.8 | -170.7 | -13.3 | 113.1 | D190 D195 H203 G236 I237 G243 K244 H245 | D190-R239 IonicContact OD1-CZ 3.22Å; D190-R239 IonicContact OD1-NH1 2.92Å; D190-R239 PolarHBondContact OD1-NH1 3.23Å; D190-R239 IonicContact OD1-NH2 3.72Å; D190-R239 PolarHBondContact OD1-NH2 3.28Å; D195-R239 IonicContact OD2-CZ 3.19Å; D195-R239 IonicContact OD2-NH2 3.95Å; D195-R239 PolarHBondContact OD2-NH2 3.21Å; H203-R239 HydrophobicContact CB-CG 3.81Å; G236-R239 PolarHBondContact O-N 2.86Å; I237-R239 PolarHBondContact O-N 3Å; I237-R239 VanDerWaalsContact O-N 3.09Å; R239-G243 PolarHBondContact O-N 3.47Å; R239-K244 PolarHBondContact O-N 3.45Å; R239-H245 HydrophobicContact CB-CB 4.5Å; R239-H245 PolarHBondContact O-N 2.89Å |
| 240 | V | 91.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -74.2 | -40.9 | 172.9 | -169.6 | 0 | 0 | 0 | 0 | 110.2 | M106 I237 L242 G243 M250 | M106-V240 HydrophobicContact CB-CG1 4.26Å; M106-V240 HydrophobicContact CE-CG1 3.49Å; M106-V240 VanDerWaalsContact CE-CG1 3.49Å; I237-V240 HydrophobicContact CD1-CB 4.3Å; I237-V240 HydrophobicContact CD1-CG2 4.45Å; I237-V240 PolarHBondContact O-N 3.47Å; V240-L242 VanDerWaalsContact C-N 3.3Å; V240-L242 PolarHBondContact O-N 3.46Å; V240-G243 WeakPolarHBondContact O-CA 3.19Å; V240-G243 PolarHBondContact O-N 2.91Å; V240-M250 HydrophobicContact CG2-CB 4.06Å; V240-M250 HydrophobicContact CG2-CG 4.48Å; V240-M250 HydrophobicContact CG2-SD 4.1Å |
| 241 | L | 89.3 | Confident | 92.7 | Very high | 39 Ų | 39 | 26.6 Ų | 26.6 | 20% | 0.204 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -61.4 | -37.1 | 174.8 | -65.4 | 176.8 | 0 | 0 | 0 | 112.7 | M106 G107 V108 C109 V123 I237 S238 G243 | M106-L241 WeakPolarHBondContact O-CA 3.25Å; M106-L241 WeakPolarHBondContact O-CD2 3.22Å; G107-L241 CarbonylContact C-O 3.6Å; G107-L241 WeakPolarHBondContact CA-O 3.49Å; V108-L241 HydrophobicContact CG2-CD2 4Å; C109-L241 WeakPolarHBondContact CA-O 3.36Å; C109-L241 WeakPolarHBondContact CB-O 3.47Å; C109-L241 PolarHBondContact N-O 2.88Å; V123-L241 HydrophobicContact CG1-CB 4.25Å; I237-L241 HydrophobicContact CG1-CG 4.36Å; I237-L241 HydrophobicContact CG2-CD1 4.39Å; I237-L241 WeakPolarHBondContact O-CG 3.27Å; I237-L241 PolarHBondContact O-N 2.79Å; S238-L241 PolarHBondContact O-N 3.12Å; L241-G243 PolarHBondContact O-N 3.18Å |
| 242 | L | 87.9 | Confident | 92.6 | Very high | 4 Ų | 4 | 27.1 Ų | 27.1 | 2% | 0.021 | 15% | 0.145 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.7 | -6.3 | 173.3 | -70.3 | 168.3 | 0 | 0 | 0 | 113.2 | C109 R120 V123 A127 S238 V240 K244 | C109-L242 HydrophobicContact CB-CD2 4.3Å; R120-L242 HydrophobicContact CG-CD2 3.88Å; V123-L242 HydrophobicContact CB-CD2 4.47Å; V123-L242 HydrophobicContact CG1-CD1 4.1Å; V123-L242 HydrophobicContact CG1-CD2 4.21Å; V123-L242 HydrophobicContact CG1-CG 3.79Å; A127-L242 HydrophobicContact CB-CD1 4.27Å; S238-L242 WeakPolarHBondContact O-CB 3.48Å; S238-L242 VanDerWaalsContact O-CG 3.24Å; S238-L242 WeakPolarHBondContact O-CG 3.45Å; S238-L242 PolarHBondContact O-N 3.12Å; V240-L242 VanDerWaalsContact C-N 3.3Å; V240-L242 PolarHBondContact O-N 3.46Å; L242-K244 HydrophobicContact CB-CG 4.45Å |
| 243 | G | 84.8 | Confident | 92.6 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 14% | 0.142 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 76.9 | 16 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | P181 W182 R239 V240 L241 | P181-G243 WeakPolarHBondContact CD-O 3.47Å; W182-G243 PolarHBondContact N-O 3.32Å; R239-G243 PolarHBondContact O-N 3.47Å; V240-G243 WeakPolarHBondContact O-CA 3.19Å; V240-G243 PolarHBondContact O-N 2.91Å; L241-G243 PolarHBondContact O-N 3.18Å |
| 244 | K | 85.6 | Confident | 92.7 | Very high | 47 Ų | 47 | 23.6 Ų | 23.6 | 20% | 0.204 | 13% | 0.128 | C | C | . | . | S | Bend | trans | -88.8 | -30.3 | -175 | -71.5 | -170.2 | 172.6 | 171.1 | 0 | 114.1 | G180 D190 R239 L242 | G180-K244 WeakPolarHBondContact CA-O 3.25Å; D190-K244 VanDerWaalsContact CG-NZ 3.25Å; D190-K244 IonicContact OD1-NZ 2.66Å; D190-K244 PolarHBondContact OD1-NZ 3.04Å; D190-K244 IonicContact OD2-NZ 3.72Å; D190-K244 PolarHBondContact OD2-NZ 3.49Å; R239-K244 PolarHBondContact O-N 3.45Å; L242-K244 HydrophobicContact CB-CG 4.45Å |
| 245 | H | 90.9 | Very high | 92.7 | Very high | 4 Ų | 4 | 23.4 Ų | 23.4 | 2% | 0.019 | 14% | 0.136 | C | C | . | . | S | Bend | trans | -127.9 | 151.8 | -178.3 | -64.4 | -99.7 | 0 | 0 | 0 | 110.9 | P181 D195 S198 A201 R239 D249 | P181-H245 WeakPolarHBondContact CG-O 3.49Å; D195-H245 IonicContact OD1-CE1 3.4Å; D195-H245 IonicContact OD1-NE2 3.03Å; D195-H245 IonicContact OD2-NE2 3.76Å; S198-H245 PolarHBondContact O-CE1 3.42Å; S198-H245 PolarHBondContact O-ND1 3.27Å; A201-H245 HydrophobicContact CB-CB 4.47Å; R239-H245 HydrophobicContact CB-CB 4.5Å; R239-H245 PolarHBondContact O-N 2.89Å; H245-D249 HydrophobicContact CB-CB 4.11Å |
| 246 | H | 91.4 | Very high | 92.8 | Very high | 11 Ų | 11 | 25 Ų | 25 | 5% | 0.051 | 14% | 0.144 | C | C | . | . | trans | -77 | 160.4 | 169.3 | -59.1 | -86.5 | 0 | 0 | 0 | 110.5 | D99 S103 R178 R179 T248 D249 M250 | D99-H246 WeakPolarHBondContact OD2-CB 3.37Å; S103-H246 WeakPolarHBondContact OG-CA 3.45Å; R178-H246 VanDerWaalsContact CZ-CD2 3.44Å; R178-H246 PolarHBondContact NE-CD2 3.2Å; R178-H246 PolarHBondContact NH2-CD2 3.4Å; R178-H246 VanDerWaalsContact NH2-CD2 3.34Å; R178-H246 VanDerWaalsContact NH2-CG 3.32Å; R179-H246 PolarHBondContact O-NE2 2.92Å; H246-T248 VanDerWaalsContact C-N 3.27Å; H246-T248 PolarHBondContact O-N 3.47Å; H246-D249 IonicContact CD2-OD2 3.59Å; H246-D249 PolarHBondContact CD2-OD2 3.4Å; H246-D249 VanDerWaalsContact CD2-OD2 3.26Å; H246-D249 IonicContact CG-OD2 2.94Å; H246-D249 PolarHBondContact N-OD2 3.03Å; H246-D249 WeakPolarHBondContact O-CB 3.47Å; H246-D249 PolarHBondContact O-N 3.45Å; H246-D249 VanDerWaalsContact O-N 3.15Å; H246-M250 PolarHBondContact O-N 3.49Å; H246-M250 VanDerWaalsContact O-N 3.17Å | ||
| 247 | L | 91.7 | Very high | 92.9 | Very high | 44 Ų | 44 | 25 Ų | 25 | 23% | 0.23 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -63.2 | -38 | 177.4 | -177 | 66.3 | 0 | 0 | 0 | 111 | D99 L102 S103 M106 D249 M250 V251 | D99-L247 WeakPolarHBondContact OD1-CB 3.19Å; D99-L247 PolarHBondContact OD1-N 3.28Å; L102-L247 HydrophobicContact CD2-CD2 3.51Å; L102-L247 HydrophobicContact CG-CD2 4.44Å; S103-L247 PolarHBondContact OG-N 2.97Å; M106-L247 HydrophobicContact CE-CB 4.09Å; M106-L247 HydrophobicContact CE-CD1 3.99Å; M106-L247 HydrophobicContact CE-CD2 4.27Å; M106-L247 HydrophobicContact CE-CG 4.34Å; L247-D249 VanDerWaalsContact C-N 3.33Å; L247-D249 PolarHBondContact O-N 3.49Å; L247-M250 HydrophobicContact CD1-CE 3.37Å; L247-M250 HydrophobicContact CD1-SD 4.22Å; L247-M250 WeakPolarHBondContact O-CB 3.33Å; L247-M250 PolarHBondContact O-N 3.49Å; L247-V251 WeakPolarHBondContact O-CG2 3.32Å; L247-V251 PolarHBondContact O-N 3.43Å |
| 248 | T | 92.1 | Very high | 93.1 | Very high | 53 Ų | 53 | 27.5 Ų | 27.5 | 33% | 0.325 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -60.5 | -40.1 | 172.5 | 54.2 | 0 | 0 | 0 | 0 | 112.8 | D99 R178 H246 M250 V251 C252 | D99-T248 HydrophobicContact CB-CG2 3.96Å; D99-T248 WeakPolarHBondContact OD1-CG2 3.22Å; D99-T248 PolarHBondContact OD1-N 2.96Å; D99-T248 WeakPolarHBondContact OD2-CB 3.4Å; D99-T248 VanDerWaalsContact OD2-CG2 3.3Å; D99-T248 WeakPolarHBondContact OD2-CG2 3.5Å; D99-T248 PolarHBondContact OD2-OG1 2.83Å; R178-T248 PolarHBondContact NH1-OG1 3.01Å; H246-T248 VanDerWaalsContact C-N 3.27Å; H246-T248 PolarHBondContact O-N 3.47Å; T248-M250 VanDerWaalsContact C-N 3.27Å; T248-M250 PolarHBondContact O-N 2.7Å; T248-V251 PolarHBondContact O-N 3.15Å; T248-C252 WeakPolarHBondContact O-CB 3.05Å; T248-C252 PolarHBondContact O-N 2.91Å; T248-C252 PolarHBondContact O-SG 2.95Å; T248-C252 VanDerWaalsContact O-SG 3.39Å |
| 249 | D | 93.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -60.8 | -39.8 | 176.6 | -62.9 | -26.2 | 0 | 0 | 0 | 111.1 | R178 S198 F199 A201 H245 H246 L247 G253 | R178-D249 IonicContact CZ-OD1 3.42Å; R178-D249 IonicContact NE-OD1 2.83Å; R178-D249 IonicContact NH1-OD1 2.63Å; R178-D249 PolarHBondContact NH1-OD1 3.44Å; R178-D249 IonicContact NH1-OD2 3.97Å; S198-D249 WeakPolarHBondContact CB-OD2 3.42Å; S198-D249 WeakPolarHBondContact O-CB 3.33Å; S198-D249 VanDerWaalsContact O-CG 3.3Å; S198-D249 PolarHBondContact OG-OD2 2.83Å; F199-D249 WeakPolarHBondContact CB-OD1 3.3Å; F199-D249 VanDerWaalsContact CD2-OD1 3.25Å; F199-D249 WeakPolarHBondContact CD2-OD1 3.38Å; A201-D249 HydrophobicContact CB-CB 4.31Å; A201-D249 VanDerWaalsContact CB-O 3.23Å; A201-D249 WeakPolarHBondContact CB-O 3.1Å; A201-D249 PolarHBondContact N-O 3.43Å; A201-D249 VanDerWaalsContact N-O 3.09Å; H245-D249 HydrophobicContact CB-CB 4.11Å; H246-D249 IonicContact CD2-OD2 3.59Å; H246-D249 PolarHBondContact CD2-OD2 3.4Å; H246-D249 VanDerWaalsContact CD2-OD2 3.26Å; H246-D249 IonicContact CG-OD2 2.94Å; H246-D249 PolarHBondContact N-OD2 3.03Å; H246-D249 WeakPolarHBondContact O-CB 3.47Å; H246-D249 PolarHBondContact O-N 3.45Å; H246-D249 VanDerWaalsContact O-N 3.15Å; L247-D249 VanDerWaalsContact C-N 3.33Å; L247-D249 PolarHBondContact O-N 3.49Å; D249-G253 PolarHBondContact O-N 2.94Å |
| 250 | M | 94.9 | Very high | 93.5 | Very high | 10 Ų | 10 | 32.8 Ų | 32.8 | 5% | 0.049 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -63.7 | -48.6 | 177 | -177.4 | -165 | 77.6 | 0 | 0 | 111.4 | A204 I237 V240 H246 L247 T248 G253 F254 | A204-M250 HydrophobicContact CB-CG 4.14Å; I237-M250 HydrophobicContact CB-SD 4.3Å; I237-M250 HydrophobicContact CD1-CE 4.46Å; I237-M250 HydrophobicContact CD1-SD 3.87Å; V240-M250 HydrophobicContact CG2-CB 4.06Å; V240-M250 HydrophobicContact CG2-CG 4.48Å; V240-M250 HydrophobicContact CG2-SD 4.1Å; H246-M250 PolarHBondContact O-N 3.49Å; H246-M250 VanDerWaalsContact O-N 3.17Å; L247-M250 HydrophobicContact CD1-CE 3.37Å; L247-M250 HydrophobicContact CD1-SD 4.22Å; L247-M250 WeakPolarHBondContact O-CB 3.33Å; L247-M250 PolarHBondContact O-N 3.49Å; T248-M250 VanDerWaalsContact C-N 3.27Å; T248-M250 PolarHBondContact O-N 2.7Å; M250-G253 PolarHBondContact O-N 3Å; M250-F254 HydrophobicContact CE-CD2 4.46Å; M250-F254 HydrophobicContact CE-CE2 3.96Å; M250-F254 HydrophobicContact CG-CD2 4.08Å; M250-F254 HydrophobicContact CG-CE2 3.62Å; M250-F254 HydrophobicContact CG-CZ 4.27Å; M250-F254 WeakPolarHBondContact O-CD2 3.48Å; M250-F254 PolarHBondContact O-N 3.44Å; M250-F254 HydrophobicContact SD-CE2 3.93Å |
| 251 | V | 95.5 | Very high | 93.8 | Very high | 84 Ų | 84 | 32.9 Ų | 32.9 | 51% | 0.509 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -63.3 | -45.6 | 179.4 | 174.8 | 0 | 0 | 0 | 0 | 111 | L247 T248 G253 F254 A255 | L247-V251 WeakPolarHBondContact O-CG2 3.32Å; L247-V251 PolarHBondContact O-N 3.43Å; T248-V251 PolarHBondContact O-N 3.15Å; V251-G253 VanDerWaalsContact C-N 3.28Å; V251-G253 PolarHBondContact O-N 3.37Å; V251-F254 PolarHBondContact O-N 3.17Å; V251-A255 PolarHBondContact O-N 2.89Å |
| 252 | C | 95.8 | Very high | 94.2 | Very high | 52 Ų | 52 | 33.9 Ų | 33.9 | 35% | 0.351 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -62.1 | -37.3 | 174.4 | -70.2 | 0 | 0 | 0 | 0 | 112 | F199 T248 A255 L256 | F199-C252 HydrophobicContact CE2-CB 3.68Å; F199-C252 HydrophobicContact CZ-CB 4.14Å; T248-C252 WeakPolarHBondContact O-CB 3.05Å; T248-C252 PolarHBondContact O-N 2.91Å; T248-C252 PolarHBondContact O-SG 2.95Å; T248-C252 VanDerWaalsContact O-SG 3.39Å; C252-A255 PolarHBondContact O-N 3.39Å; C252-L256 WeakPolarHBondContact O-CB 3.38Å; C252-L256 PolarHBondContact O-N 3.09Å |
| 253 | G | 96.7 | Very high | 94.5 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -58.5 | -51.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | S205 D249 M250 V251 A255 L256 G257 | S205-G253 WeakPolarHBondContact CA-O 3.24Å; S205-G253 WeakPolarHBondContact CB-O 3.23Å; S205-G253 PolarHBondContact N-O 2.95Å; D249-G253 PolarHBondContact O-N 2.94Å; M250-G253 PolarHBondContact O-N 3Å; V251-G253 VanDerWaalsContact C-N 3.28Å; V251-G253 PolarHBondContact O-N 3.37Å; G253-A255 VanDerWaalsContact C-N 3.33Å; G253-A255 PolarHBondContact O-N 3.39Å; G253-L256 PolarHBondContact O-N 3.43Å; G253-G257 PolarHBondContact O-N 3.47Å |
| 254 | F | 98 | Very high | 95 | Very high | 41 Ų | 41 | 36.7 Ų | 36.7 | 18% | 0.18 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -58.8 | -42.9 | 176.8 | -71.8 | -46 | 0 | 0 | 0 | 112.8 | A204 A208 A232 F233 M250 V251 L256 G257 M258 | A204-F254 HydrophobicContact CB-CD1 3.78Å; A204-F254 HydrophobicContact CB-CD2 4.45Å; A204-F254 HydrophobicContact CB-CE1 3.77Å; A204-F254 HydrophobicContact CB-CE2 4.42Å; A204-F254 HydrophobicContact CB-CG 4.15Å; A204-F254 HydrophobicContact CB-CZ 4.1Å; A204-F254 VanDerWaalsContact O-CD1 3.25Å; A204-F254 WeakPolarHBondContact O-CD1 3.42Å; A208-F254 HydrophobicContact CB-CD1 3.77Å; A232-F254 WeakPolarHBondContact O-CE1 3.49Å; A232-F254 WeakPolarHBondContact O-CZ 3.29Å; F233-F254 HydrophobicContact CD2-CE2 4.46Å; M250-F254 HydrophobicContact CE-CD2 4.46Å; M250-F254 HydrophobicContact CE-CE2 3.96Å; M250-F254 HydrophobicContact CG-CD2 4.08Å; M250-F254 HydrophobicContact CG-CE2 3.62Å; M250-F254 HydrophobicContact CG-CZ 4.27Å; M250-F254 WeakPolarHBondContact O-CD2 3.48Å; M250-F254 PolarHBondContact O-N 3.44Å; M250-F254 HydrophobicContact SD-CE2 3.93Å; V251-F254 PolarHBondContact O-N 3.17Å; F254-L256 VanDerWaalsContact C-N 3.34Å; F254-L256 PolarHBondContact O-N 2.77Å; F254-G257 PolarHBondContact O-N 3.27Å; F254-M258 WeakPolarHBondContact O-CG 3.17Å; F254-M258 PolarHBondContact O-N 3.42Å; F254-M258 VanDerWaalsContact O-N 3.07Å |
| 255 | A | 97.8 | Very high | 95.4 | Very high | 63 Ų | 63 | 39.1 Ų | 39.1 | 52% | 0.521 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -60.9 | -43.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | V251 C252 G253 M258 F259 | V251-A255 PolarHBondContact O-N 2.89Å; C252-A255 PolarHBondContact O-N 3.39Å; G253-A255 VanDerWaalsContact C-N 3.33Å; G253-A255 PolarHBondContact O-N 3.39Å; A255-M258 PolarHBondContact O-N 2.96Å; A255-F259 PolarHBondContact O-N 2.84Å |
| 256 | L | 97.4 | Very high | 95.5 | Very high | 33 Ų | 33 | 44.1 Ų | 44.1 | 17% | 0.173 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -63.8 | -40.3 | 176.7 | -176.2 | 64 | 0 | 0 | 0 | 112 | T168 V169 P200 C252 G253 F254 M258 F259 H260 | T168-L256 HydrophobicContact CG2-CD1 4.46Å; V169-L256 HydrophobicContact CG2-CD2 3.82Å; P200-L256 HydrophobicContact CB-CD2 4.36Å; P200-L256 HydrophobicContact CG-CD2 3.72Å; C252-L256 WeakPolarHBondContact O-CB 3.38Å; C252-L256 PolarHBondContact O-N 3.09Å; G253-L256 PolarHBondContact O-N 3.43Å; F254-L256 VanDerWaalsContact C-N 3.34Å; F254-L256 PolarHBondContact O-N 2.77Å; L256-M258 PolarHBondContact O-N 2.98Å; L256-F259 HydrophobicContact CD1-CD1 4.18Å; L256-F259 CarbonylContact O-C 3.57Å; L256-F259 WeakPolarHBondContact O-CB 3.38Å; L256-F259 PolarHBondContact O-N 3.23Å; L256-H260 PolarHBondContact O-N 3.15Å |
| 257 | G | 97.4 | Very high | 95.7 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.5 | -41.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | S205 M209 G253 F254 F259 H260 F261 | S205-G257 VanDerWaalsContact O-CA 3.27Å; S205-G257 WeakPolarHBondContact O-CA 3.44Å; S205-G257 PolarHBondContact OG-N 2.92Å; M209-G257 WeakPolarHBondContact CB-O 3.25Å; G253-G257 PolarHBondContact O-N 3.47Å; F254-G257 PolarHBondContact O-N 3.27Å; G257-F259 VanDerWaalsContact C-N 3.32Å; G257-H260 PolarHBondContact O-N 2.91Å; G257-F261 PolarHBondContact O-N 3Å |
| 258 | M | 97.6 | Very high | 95.8 | Very high | 82 Ų | 82 | 48.1 Ų | 48.1 | 40% | 0.404 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -65.2 | -37 | 173.7 | -66.7 | -57.7 | -59.7 | 0 | 0 | 112 | A208 K212 F254 A255 L256 F261 S262 | A208-M258 HydrophobicContact CB-SD 4.5Å; K212-M258 HydrophobicContact CB-CE 4.38Å; K212-M258 HydrophobicContact CB-SD 4.06Å; K212-M258 HydrophobicContact CD-CE 4.1Å; K212-M258 HydrophobicContact CG-CE 3.86Å; K212-M258 HydrophobicContact CG-SD 4.19Å; F254-M258 WeakPolarHBondContact O-CG 3.17Å; F254-M258 PolarHBondContact O-N 3.42Å; F254-M258 VanDerWaalsContact O-N 3.07Å; A255-M258 PolarHBondContact O-N 2.96Å; L256-M258 PolarHBondContact O-N 2.98Å; M258-F261 PolarHBondContact O-N 3.21Å; M258-S262 PolarHBondContact O-N 3.06Å; M258-S262 PolarHBondContact O-OG 3.29Å |
| 259 | F | 97.5 | Very high | 95.9 | Very high | 120 Ų | 120 | 47.5 Ų | 47.5 | 53% | 0.526 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -64.2 | -45.7 | 173.1 | 173.3 | -101.4 | 0 | 0 | 0 | 111.9 | A255 L256 G257 F261 S262 L263 | A255-F259 PolarHBondContact O-N 2.84Å; L256-F259 HydrophobicContact CD1-CD1 4.18Å; L256-F259 CarbonylContact O-C 3.57Å; L256-F259 WeakPolarHBondContact O-CB 3.38Å; L256-F259 PolarHBondContact O-N 3.23Å; G257-F259 VanDerWaalsContact C-N 3.32Å; F259-F261 VanDerWaalsContact C-N 3.33Å; F259-F261 PolarHBondContact O-N 3.49Å; F259-S262 PolarHBondContact O-N 2.83Å; F259-S262 VanDerWaalsContact O-N 3.15Å; F259-L263 HydrophobicContact CE1-CD2 4.41Å; F259-L263 PolarHBondContact O-N 3.04Å |
| 260 | H | 97.3 | Very high | 95.8 | Very high | 1 Ų | 1 | 50.2 Ų | 50.2 | 1% | 0.005 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -58.9 | -43 | 175.7 | -70.7 | 157.8 | 0 | 0 | 0 | 112.2 | D165 T168 M209 L256 G257 L263 M264 | D165-H260 IonicContact OD1-CE1 3.39Å; D165-H260 PolarHBondContact OD1-CE1 3.46Å; D165-H260 IonicContact OD1-ND1 2.87Å; D165-H260 PolarHBondContact OD1-ND1 3.33Å; T168-H260 WeakPolarHBondContact CB-NE2 3.25Å; T168-H260 WeakPolarHBondContact CG2-NE2 3.46Å; M209-H260 HydrophobicContact CG-CB 4.05Å; M209-H260 HydrophobicContact SD-CB 4.37Å; L256-H260 PolarHBondContact O-N 3.15Å; G257-H260 PolarHBondContact O-N 2.91Å; H260-L263 PolarHBondContact O-N 3.32Å; H260-M264 VanDerWaalsContact O-CB 3.26Å; H260-M264 WeakPolarHBondContact O-CB 3.4Å; H260-M264 PolarHBondContact O-N 2.89Å |
| 261 | F | 97.2 | Very high | 95.6 | Very high | 3 Ų | 3 | 51.8 Ų | 51.8 | 1% | 0.013 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -59.5 | -46.7 | 174.3 | 171.3 | -97.8 | 0 | 0 | 0 | 111.7 | M209 K212 F213 S216 G257 M258 F259 L263 M264 E265 | M209-F261 HydrophobicContact CG-CB 4.46Å; K212-F261 HydrophobicContact CB-CB 4.5Å; K212-F261 HydrophobicContact CB-CD1 4.41Å; K212-F261 HydrophobicContact CB-CD2 4.36Å; K212-F261 HydrophobicContact CB-CG 4.13Å; K212-F261 HydrophobicContact CD-CD1 4.31Å; K212-F261 HydrophobicContact CD-CE1 4.13Å; K212-F261 HydrophobicContact CD-CZ 4.47Å; K212-F261 VanDerWaalsContact CE-CE1 3.4Å; K212-F261 HydrophobicContact CG-CB 4.25Å; K212-F261 HydrophobicContact CG-CD1 3.35Å; K212-F261 HydrophobicContact CG-CD2 3.92Å; K212-F261 HydrophobicContact CG-CE1 3.58Å; K212-F261 HydrophobicContact CG-CE2 4.14Å; K212-F261 HydrophobicContact CG-CG 3.52Å; K212-F261 HydrophobicContact CG-CZ 3.96Å; F213-F261 HydrophobicContact CB-CD2 4.06Å; F213-F261 HydrophobicContact CB-CE2 4.3Å; F213-F261 HydrophobicContact CD2-CD2 4.43Å; F213-F261 HydrophobicContact CD2-CE2 4.49Å; S216-F261 WeakPolarHBondContact OG-CZ 3.21Å; G257-F261 PolarHBondContact O-N 3Å; M258-F261 PolarHBondContact O-N 3.21Å; F259-F261 VanDerWaalsContact C-N 3.33Å; F259-F261 PolarHBondContact O-N 3.49Å; F261-L263 VanDerWaalsContact C-N 3.34Å; F261-L263 PolarHBondContact O-N 2.87Å; F261-M264 WeakPolarHBondContact O-CB 3.41Å; F261-M264 PolarHBondContact O-N 2.66Å; F261-M264 VanDerWaalsContact O-N 3.16Å; F261-E265 HydrophobicContact CE1-CG 3.88Å; F261-E265 WeakPolarHBondContact CE1-OE2 3.32Å; F261-E265 HydrophobicContact CE2-CG 3.99Å; F261-E265 HydrophobicContact CZ-CG 3.6Å; F261-E265 VanDerWaalsContact CZ-OE1 3.25Å; F261-E265 WeakPolarHBondContact CZ-OE1 3.5Å; F261-E265 PolarHBondContact O-N 3.4Å |
| 262 | S | 96.4 | Very high | 95.4 | Very high | 59 Ų | 59 | 54 Ų | 54 | 41% | 0.413 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -62.2 | -42.7 | 179.6 | -52.3 | 0 | 0 | 0 | 0 | 111.5 | M258 F259 M264 E265 T266 | M258-S262 PolarHBondContact O-N 3.06Å; M258-S262 PolarHBondContact O-OG 3.29Å; F259-S262 PolarHBondContact O-N 2.83Å; F259-S262 VanDerWaalsContact O-N 3.15Å; S262-M264 VanDerWaalsContact C-N 3.33Å; S262-M264 PolarHBondContact O-N 3.39Å; S262-E265 PolarHBondContact O-N 3.02Å; S262-T266 WeakPolarHBondContact O-CG2 3.41Å; S262-T266 PolarHBondContact O-N 3.4Å |
| 263 | L | 95.5 | Very high | 95.2 | Very high | 61 Ų | 61 | 54.3 Ų | 54.3 | 32% | 0.319 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -61.5 | -43.8 | 174.9 | 178.9 | 57.7 | 0 | 0 | 0 | 110.9 | L164 F259 H260 F261 E265 T266 V267 | L164-L263 HydrophobicContact CD2-CD2 3.87Å; L164-L263 HydrophobicContact CD2-CG 4.32Å; F259-L263 HydrophobicContact CE1-CD2 4.41Å; F259-L263 PolarHBondContact O-N 3.04Å; H260-L263 PolarHBondContact O-N 3.32Å; F261-L263 VanDerWaalsContact C-N 3.34Å; F261-L263 PolarHBondContact O-N 2.87Å; L263-E265 PolarHBondContact O-N 3.45Å; L263-T266 PolarHBondContact O-N 3.05Å; L263-T266 VanDerWaalsContact O-N 3.08Å; L263-T266 PolarHBondContact O-OG1 3.37Å; L263-V267 HydrophobicContact CD1-CG1 4.49Å; L263-V267 WeakPolarHBondContact O-CG2 3.47Å; L263-V267 PolarHBondContact O-N 3.38Å; L263-V267 VanDerWaalsContact O-N 3.15Å |
| 264 | M | 95.3 | Very high | 95 | Very high | 2 Ų | 2 | 54.3 Ų | 54.3 | 1% | 0.01 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.6 | -44.3 | 177.6 | -166.5 | -75.7 | 125 | 0 | 0 | 111.7 | N157 A161 F213 H260 F261 S262 T266 V267 W268 | N157-M264 HydrophobicContact CB-CE 3.41Å; N157-M264 VanDerWaalsContact CB-CE 3.41Å; N157-M264 HydrophobicContact CB-SD 4.32Å; N157-M264 VanDerWaalsContact CG-CE 3.45Å; N157-M264 WeakPolarHBondContact OD1-CE 3.3Å; A161-M264 HydrophobicContact CB-CG 3.81Å; F213-M264 HydrophobicContact CD2-SD 4.15Å; F213-M264 HydrophobicContact CE2-SD 3.72Å; H260-M264 VanDerWaalsContact O-CB 3.26Å; H260-M264 WeakPolarHBondContact O-CB 3.4Å; H260-M264 PolarHBondContact O-N 2.89Å; F261-M264 WeakPolarHBondContact O-CB 3.41Å; F261-M264 PolarHBondContact O-N 2.66Å; F261-M264 VanDerWaalsContact O-N 3.16Å; S262-M264 VanDerWaalsContact C-N 3.33Å; S262-M264 PolarHBondContact O-N 3.39Å; M264-T266 PolarHBondContact O-N 3.25Å; M264-V267 CarbonylContact O-C 3.44Å; M264-V267 PolarHBondContact O-N 2.95Å; M264-V267 VanDerWaalsContact O-N 3.09Å; M264-W268 HydrophobicContact CE-CB 4.42Å; M264-W268 HydrophobicContact CE-CD2 3.93Å; M264-W268 HydrophobicContact CE-CE3 3.29Å; M264-W268 HydrophobicContact CE-CG 4.44Å; M264-W268 HydrophobicContact CE-CZ3 3.72Å; M264-W268 PolarHBondContact O-N 3.1Å; M264-W268 VanDerWaalsContact O-N 3.1Å; M264-W268 HydrophobicContact SD-CD2 4.48Å; M264-W268 HydrophobicContact SD-CE3 3.34Å; M264-W268 HydrophobicContact SD-CZ3 3.4Å; M264-W268 WeakPolarHBondContact SD-CZ3 3.45Å |
| 265 | E | 93.7 | Very high | 94.7 | Very high | 98 Ų | 98 | 55.2 Ų | 55.2 | 46% | 0.458 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -58.6 | -35.2 | 174.2 | -75 | -169 | 127.9 | 0 | 0 | 112.5 | F261 S262 L263 | F261-E265 HydrophobicContact CE1-CG 3.88Å; F261-E265 WeakPolarHBondContact CE1-OE2 3.32Å; F261-E265 HydrophobicContact CE2-CG 3.99Å; F261-E265 HydrophobicContact CZ-CG 3.6Å; F261-E265 VanDerWaalsContact CZ-OE1 3.25Å; F261-E265 WeakPolarHBondContact CZ-OE1 3.5Å; F261-E265 PolarHBondContact O-N 3.4Å; S262-E265 PolarHBondContact O-N 3.02Å; L263-E265 PolarHBondContact O-N 3.45Å |
| 266 | T | 93.6 | Very high | 94.3 | Very high | 110 Ų | 110 | 55.9 Ų | 55.9 | 68% | 0.675 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -73.1 | -26.2 | 177.1 | 65 | 0 | 0 | 0 | 0 | 114 | S262 L263 M264 | S262-T266 WeakPolarHBondContact O-CG2 3.41Å; S262-T266 PolarHBondContact O-N 3.4Å; L263-T266 PolarHBondContact O-N 3.05Å; L263-T266 VanDerWaalsContact O-N 3.08Å; L263-T266 PolarHBondContact O-OG1 3.37Å; M264-T266 PolarHBondContact O-N 3.25Å |
| 267 | V | 94.1 | Very high | 94 | Very high | 71 Ų | 71 | 57.9 Ų | 57.9 | 43% | 0.43 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109.3 | 23.8 | -178.7 | -56.8 | 0 | 0 | 0 | 0 | 112.6 | L263 M264 L269 | L263-V267 HydrophobicContact CD1-CG1 4.49Å; L263-V267 WeakPolarHBondContact O-CG2 3.47Å; L263-V267 PolarHBondContact O-N 3.38Å; L263-V267 VanDerWaalsContact O-N 3.15Å; M264-V267 CarbonylContact O-C 3.44Å; M264-V267 PolarHBondContact O-N 2.95Å; M264-V267 VanDerWaalsContact O-N 3.09Å; V267-L269 PolarHBondContact O-N 3.01Å |
| 268 | W | 94.9 | Very high | 93.6 | Very high | 67 Ų | 67 | 59.4 Ų | 59.4 | 25% | 0.254 | 32% | 0.323 | S | S | . | . | P | Polyproline II helix | trans | -55.8 | 124.6 | -174.8 | -170.2 | -86.3 | 0 | 0 | 0 | 112 | E153 N157 F213 H217 M264 | E153-W268 HydrophobicContact CG-CZ2 4.38Å; E153-W268 PolarHBondContact OE1-NE1 2.89Å; N157-W268 HydrophobicContact CB-CD2 4.46Å; N157-W268 HydrophobicContact CB-CE3 4.29Å; N157-W268 HydrophobicContact CB-CH2 3.77Å; N157-W268 HydrophobicContact CB-CZ2 3.99Å; N157-W268 HydrophobicContact CB-CZ3 3.93Å; F213-W268 HydrophobicContact CD2-CZ3 4.43Å; F213-W268 AromaticContact CE2-CH2 3.83Å; F213-W268 HydrophobicContact CE2-CH2 3.83Å; F213-W268 AromaticContact CE2-CZ3 3.53Å; F213-W268 HydrophobicContact CE2-CZ3 3.53Å; F213-W268 AromaticContact CZ-CH2 3.75Å; F213-W268 HydrophobicContact CZ-CH2 3.75Å; F213-W268 AromaticContact CZ-CZ3 3.96Å; F213-W268 HydrophobicContact CZ-CZ3 3.96Å; H217-W268 AromaticContact CD2-CH2 3.73Å; H217-W268 AromaticContact CD2-CZ3 3.65Å; H217-W268 AromaticContact CE1-CE3 3.78Å; H217-W268 AromaticContact CE1-CH2 3.38Å; H217-W268 WeakPolarHBondContact CE1-CH2 3.46Å; H217-W268 AromaticContact CE1-CZ3 3.19Å; H217-W268 WeakPolarHBondContact CE1-CZ3 3.24Å; H217-W268 AromaticContact CG-CH2 3.69Å; H217-W268 AromaticContact ND1-CH2 3.46Å; H217-W268 WeakPolarHBondContact ND1-CH2 3.33Å; H217-W268 AromaticContact ND1-CZ3 3.79Å; H217-W268 AromaticContact NE2-CE3 3.9Å; H217-W268 AromaticContact NE2-CH2 3.58Å; H217-W268 AromaticContact NE2-CZ3 3.1Å; H217-W268 WeakPolarHBondContact NE2-CZ3 3.33Å; M264-W268 HydrophobicContact CE-CB 4.42Å; M264-W268 HydrophobicContact CE-CD2 3.93Å; M264-W268 HydrophobicContact CE-CE3 3.29Å; M264-W268 HydrophobicContact CE-CG 4.44Å; M264-W268 HydrophobicContact CE-CZ3 3.72Å; M264-W268 PolarHBondContact O-N 3.1Å; M264-W268 VanDerWaalsContact O-N 3.1Å; M264-W268 HydrophobicContact SD-CD2 4.48Å; M264-W268 HydrophobicContact SD-CE3 3.34Å; M264-W268 HydrophobicContact SD-CZ3 3.4Å; M264-W268 WeakPolarHBondContact SD-CZ3 3.45Å |
| 269 | L | 92.8 | Very high | 93.1 | Very high | 41 Ų | 41 | 57.9 Ų | 57.9 | 22% | 0.215 | 32% | 0.321 | C | S | . | . | P | Polyproline II helix | trans | -82.5 | 126.5 | 178.8 | -60.8 | -178.9 | 0 | 0 | 0 | 110.1 | V156 N157 L160 V267 T273 L277 | V156-L269 HydrophobicContact CG1-CD1 4.34Å; N157-L269 PolarHBondContact ND2-O 3.16Å; N157-L269 WeakPolarHBondContact OD1-CB 3.39Å; N157-L269 PolarHBondContact OD1-N 2.94Å; L160-L269 HydrophobicContact CD2-CD1 4.02Å; L160-L269 HydrophobicContact CD2-CG 4.28Å; V267-L269 PolarHBondContact O-N 3.01Å; L269-T273 HydrophobicContact CD2-CG2 4.21Å; L269-L277 HydrophobicContact CD1-CD1 3.8Å |
| 270 | S | 92.8 | Very high | 92.6 | Very high | 57 Ų | 57 | 57 Ų | 57 | 40% | 0.399 | 32% | 0.321 | S | S | . | . | P | Polyproline II helix | trans | -66.9 | 156.2 | 174.5 | 63.9 | 0 | 0 | 0 | 0 | 112 | N272 T273 C274 | S270-N272 PolarHBondContact O-N 3.2Å; S270-N272 VanDerWaalsContact O-N 3.13Å; S270-T273 WeakPolarHBondContact O-CB 3.33Å; S270-T273 PolarHBondContact O-N 3.24Å; S270-T273 PolarHBondContact OG-OG1 3.48Å; S270-T273 VanDerWaalsContact OG-OG1 3.06Å; S270-C274 PolarHBondContact O-N 3.36Å; S270-C274 PolarHBondContact O-SG 3.23Å |
| 271 | S | 91 | Very high | 91.9 | Very high | 43 Ų | 43 | 60.1 Ų | 60.1 | 30% | 0.301 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -53.5 | -39.5 | -178.9 | -21.5 | 0 | 0 | 0 | 0 | 112.5 | E153 T273 C274 Q275 | E153-S271 VanDerWaalsContact OE2-CB 3.29Å; E153-S271 WeakPolarHBondContact OE2-CB 3.42Å; E153-S271 PolarHBondContact OE2-OG 3Å; S271-T273 PolarHBondContact O-N 3.21Å; S271-C274 WeakPolarHBondContact O-CB 3.47Å; S271-C274 PolarHBondContact O-N 3.18Å; S271-Q275 WeakPolarHBondContact O-CG 3.45Å; S271-Q275 PolarHBondContact O-N 3.36Å |
| 272 | N | 91.3 | Very high | 91.1 | Very high | 129 Ų | 129 | 64.1 Ų | 64.1 | 69% | 0.69 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -59.8 | -46.7 | 178 | -67 | -30.2 | 0 | 0 | 0 | 111.8 | S270 C274 Q275 T276 | S270-N272 PolarHBondContact O-N 3.2Å; S270-N272 VanDerWaalsContact O-N 3.13Å; N272-C274 VanDerWaalsContact C-N 3.34Å; N272-C274 PolarHBondContact O-N 3.08Å; N272-Q275 PolarHBondContact O-N 2.78Å; N272-T276 PolarHBondContact O-N 3.07Å; N272-T276 PolarHBondContact O-OG1 3.19Å; N272-T276 VanDerWaalsContact O-OG1 3.14Å |
| 273 | T | 91.4 | Very high | 89.9 | Confident | 60 Ų | 60 | 67.1 Ų | 67.1 | 37% | 0.368 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -64.8 | -41.7 | 178.4 | -48.6 | 0 | 0 | 0 | 0 | 110.7 | L269 S270 S271 Q275 T276 L277 | L269-T273 HydrophobicContact CD2-CG2 4.21Å; S270-T273 WeakPolarHBondContact O-CB 3.33Å; S270-T273 PolarHBondContact O-N 3.24Å; S270-T273 PolarHBondContact OG-OG1 3.48Å; S270-T273 VanDerWaalsContact OG-OG1 3.06Å; S271-T273 PolarHBondContact O-N 3.21Å; T273-Q275 VanDerWaalsContact C-N 3.35Å; T273-Q275 PolarHBondContact O-N 3.44Å; T273-T276 PolarHBondContact O-N 2.98Å; T273-L277 WeakPolarHBondContact O-CG 3.45Å; T273-L277 PolarHBondContact O-N 3.42Å |
| 274 | C | 91.5 | Very high | 88.3 | Confident | 0 Ų | 0 | 69 Ų | 69 | 0% | 0 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -60.4 | -43 | 175.3 | -64.1 | 0 | 0 | 0 | 0 | 111.9 | V156 S270 S271 N272 T276 L277 I278 | V156-C274 HydrophobicContact CB-CB 4.3Å; V156-C274 HydrophobicContact CG1-CB 4.32Å; V156-C274 HydrophobicContact CG2-CB 4.31Å; S270-C274 PolarHBondContact O-N 3.36Å; S270-C274 PolarHBondContact O-SG 3.23Å; S271-C274 WeakPolarHBondContact O-CB 3.47Å; S271-C274 PolarHBondContact O-N 3.18Å; N272-C274 VanDerWaalsContact C-N 3.34Å; N272-C274 PolarHBondContact O-N 3.08Å; C274-T276 PolarHBondContact O-N 3.47Å; C274-L277 PolarHBondContact O-N 3.23Å; C274-I278 VanDerWaalsContact O-CG1 3.27Å; C274-I278 WeakPolarHBondContact O-CG1 3.45Å; C274-I278 PolarHBondContact O-N 3.24Å |
| 275 | Q | 91.6 | Very high | 86.5 | Confident | 59 Ų | 59 | 79.1 Ų | 79.1 | 28% | 0.276 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -62 | -43 | 176 | -69.9 | -49 | -52.4 | 0 | 0 | 111.9 | L149 S271 N272 T273 L277 I278 S279 | L149-Q275 HydrophobicContact CD2-CG 3.99Å; L149-Q275 VanDerWaalsContact CD2-NE2 3.34Å; S271-Q275 WeakPolarHBondContact O-CG 3.45Å; S271-Q275 PolarHBondContact O-N 3.36Å; N272-Q275 PolarHBondContact O-N 2.78Å; T273-Q275 VanDerWaalsContact C-N 3.35Å; T273-Q275 PolarHBondContact O-N 3.44Å; Q275-L277 VanDerWaalsContact C-N 3.34Å; Q275-L277 PolarHBondContact O-N 2.77Å; Q275-I278 PolarHBondContact O-N 3.05Å; Q275-S279 WeakPolarHBondContact O-CB 3.42Å; Q275-S279 PolarHBondContact O-N 2.92Å; Q275-S279 PolarHBondContact O-OG 2.88Å |
| 276 | T | 90.2 | Very high | 84.5 | Confident | 77 Ų | 77 | 77.9 Ų | 77.9 | 47% | 0.472 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -61.2 | -42.9 | 175.8 | -54.8 | 0 | 0 | 0 | 0 | 111.8 | N272 T273 C274 S279 I280 | N272-T276 PolarHBondContact O-N 3.07Å; N272-T276 PolarHBondContact O-OG1 3.19Å; N272-T276 VanDerWaalsContact O-OG1 3.14Å; T273-T276 PolarHBondContact O-N 2.98Å; C274-T276 PolarHBondContact O-N 3.47Å; T276-S279 WeakPolarHBondContact CA-OG 3.38Å; T276-S279 PolarHBondContact O-N 3.02Å; T276-S279 PolarHBondContact O-OG 3.21Å; T276-I280 HydrophobicContact CG2-CD1 3.8Å; T276-I280 HydrophobicContact CG2-CG1 4.42Å; T276-I280 WeakPolarHBondContact O-CB 3.14Å; T276-I280 WeakPolarHBondContact O-CD1 3.04Å; T276-I280 WeakPolarHBondContact O-CG1 3.29Å; T276-I280 PolarHBondContact O-N 3.48Å |
| 277 | L | 90.1 | Very high | 82.6 | Confident | 76 Ų | 76 | 77.6 Ų | 77.6 | 40% | 0.398 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -63.7 | -42.5 | 176.7 | -71.3 | 174.5 | 0 | 0 | 0 | 112.1 | V156 L269 T273 C274 Q275 S281 | V156-L277 HydrophobicContact CG1-CD1 4.36Å; L269-L277 HydrophobicContact CD1-CD1 3.8Å; T273-L277 WeakPolarHBondContact O-CG 3.45Å; T273-L277 PolarHBondContact O-N 3.42Å; C274-L277 PolarHBondContact O-N 3.23Å; Q275-L277 VanDerWaalsContact C-N 3.34Å; Q275-L277 PolarHBondContact O-N 2.77Å; L277-S281 WeakPolarHBondContact O-CB 3.49Å; L277-S281 PolarHBondContact O-N 3.33Å; L277-S281 PolarHBondContact O-OG 3.21Å |
| 278 | I | 88.7 | Confident | 80.5 | Confident | 32 Ų | 32 | 83.6 Ų | 83.6 | 16% | 0.164 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -64.3 | -45.2 | 176.1 | -66.9 | 165.4 | 0 | 0 | 0 | 109.9 | L143 Q152 V156 C274 Q275 I280 S281 T282 | L143-I278 HydrophobicContact CD1-CD1 4.17Å; Q152-I278 HydrophobicContact CB-CD1 3.89Å; Q152-I278 HydrophobicContact CG-CD1 4.17Å; V156-I278 HydrophobicContact CG2-CD1 4Å; V156-I278 HydrophobicContact CG2-CG1 4.13Å; C274-I278 VanDerWaalsContact O-CG1 3.27Å; C274-I278 WeakPolarHBondContact O-CG1 3.45Å; C274-I278 PolarHBondContact O-N 3.24Å; Q275-I278 PolarHBondContact O-N 3.05Å; I278-I280 PolarHBondContact O-N 3Å; I278-S281 CarbonylContact O-C 3.54Å; I278-S281 WeakPolarHBondContact O-CB 3.31Å; I278-S281 PolarHBondContact O-N 3.44Å; I278-T282 HydrophobicContact CG2-CG2 4.34Å; I278-T282 WeakPolarHBondContact O-CG2 3.12Å; I278-T282 PolarHBondContact O-N 3.03Å; I278-T282 PolarHBondContact O-OG1 2.9Å |
| 279 | S | 87.3 | Confident | 77.7 | Confident | 50 Ų | 50 | 94.4 Ų | 94.4 | 35% | 0.35 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.5 | -39.8 | -179.7 | 64.8 | 0 | 0 | 0 | 0 | 112.8 | Q275 T276 S281 T282 L283 | Q275-S279 WeakPolarHBondContact O-CB 3.42Å; Q275-S279 PolarHBondContact O-N 2.92Å; Q275-S279 PolarHBondContact O-OG 2.88Å; T276-S279 WeakPolarHBondContact CA-OG 3.38Å; T276-S279 PolarHBondContact O-N 3.02Å; T276-S279 PolarHBondContact O-OG 3.21Å; S279-S281 VanDerWaalsContact C-N 3.28Å; S279-S281 PolarHBondContact O-N 3.5Å; S279-T282 WeakPolarHBondContact CA-OG1 3.39Å; S279-T282 PolarHBondContact O-N 3.22Å; S279-T282 PolarHBondContact O-OG1 2.94Å; S279-T282 VanDerWaalsContact O-OG1 3.04Å; S279-L283 WeakPolarHBondContact O-CB 3.47Å; S279-L283 WeakPolarHBondContact O-CD1 3.26Å; S279-L283 PolarHBondContact O-N 3.29Å |
| 280 | I | 88.4 | Confident | 77 | Confident | 102 Ų | 102 | 97.1 Ų | 97.1 | 52% | 0.523 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.9 | -42.5 | 174.3 | -70.6 | 165.7 | 0 | 0 | 0 | 109.7 | T276 I278 S284 | T276-I280 HydrophobicContact CG2-CD1 3.8Å; T276-I280 HydrophobicContact CG2-CG1 4.42Å; T276-I280 WeakPolarHBondContact O-CB 3.14Å; T276-I280 WeakPolarHBondContact O-CD1 3.04Å; T276-I280 WeakPolarHBondContact O-CG1 3.29Å; T276-I280 PolarHBondContact O-N 3.48Å; I278-I280 PolarHBondContact O-N 3Å; I280-S284 PolarHBondContact O-N 2.78Å |
| 281 | S | 82.5 | Confident | 76.2 | Confident | 66 Ų | 66 | 99.2 Ų | 99.2 | 46% | 0.462 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.3 | -50.4 | 176.6 | -56.8 | 0 | 0 | 0 | 0 | 110.3 | L277 I278 S279 L283 S284 W285 | L277-S281 WeakPolarHBondContact O-CB 3.49Å; L277-S281 PolarHBondContact O-N 3.33Å; L277-S281 PolarHBondContact O-OG 3.21Å; I278-S281 CarbonylContact O-C 3.54Å; I278-S281 WeakPolarHBondContact O-CB 3.31Å; I278-S281 PolarHBondContact O-N 3.44Å; S279-S281 VanDerWaalsContact C-N 3.28Å; S279-S281 PolarHBondContact O-N 3.5Å; S281-L283 VanDerWaalsContact C-N 3.35Å; S281-L283 PolarHBondContact O-N 2.96Å; S281-S284 WeakPolarHBondContact O-CB 3.01Å; S281-S284 PolarHBondContact O-N 3.28Å; S281-S284 VanDerWaalsContact O-N 3.1Å; S281-W285 PolarHBondContact O-N 3.19Å |
| 282 | T | 80.4 | Confident | 75.3 | Confident | 86 Ų | 86 | 102.3 Ų | 102.3 | 53% | 0.528 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.6 | -35.9 | -179.4 | 54.9 | 0 | 0 | 0 | 0 | 113.2 | I278 S279 S284 W285 S286 | I278-T282 HydrophobicContact CG2-CG2 4.34Å; I278-T282 WeakPolarHBondContact O-CG2 3.12Å; I278-T282 PolarHBondContact O-N 3.03Å; I278-T282 PolarHBondContact O-OG1 2.9Å; S279-T282 WeakPolarHBondContact CA-OG1 3.39Å; S279-T282 PolarHBondContact O-N 3.22Å; S279-T282 PolarHBondContact O-OG1 2.94Å; S279-T282 VanDerWaalsContact O-OG1 3.04Å; T282-S284 VanDerWaalsContact C-N 3.31Å; T282-S284 PolarHBondContact O-N 3.34Å; T282-W285 CarbonylContact O-C 3.3Å; T282-W285 PolarHBondContact O-N 3.46Å; T282-W285 VanDerWaalsContact O-N 3.07Å; T282-S286 PolarHBondContact O-N 3.24Å |
| 283 | L | 70.4 | Confident | 74.4 | Confident | 123 Ų | 123 | 100.8 Ų | 100.8 | 64% | 0.644 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -63.7 | -33.5 | 172.6 | -90.7 | 154.4 | 0 | 0 | 0 | 113 | S279 S281 W285 S286 | S279-L283 WeakPolarHBondContact O-CB 3.47Å; S279-L283 WeakPolarHBondContact O-CD1 3.26Å; S279-L283 PolarHBondContact O-N 3.29Å; S281-L283 VanDerWaalsContact C-N 3.35Å; S281-L283 PolarHBondContact O-N 2.96Å; L283-W285 PolarHBondContact O-N 3.37Å; L283-S286 PolarHBondContact O-OG 3.23Å |
| 284 | S | 62.5 | Low | 73.3 | Confident | 101 Ų | 101 | 103.3 Ų | 103.3 | 71% | 0.706 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -70.9 | -17.3 | 173.6 | -175.1 | 0 | 0 | 0 | 0 | 113 | I280 S281 T282 | I280-S284 PolarHBondContact O-N 2.78Å; S281-S284 WeakPolarHBondContact O-CB 3.01Å; S281-S284 PolarHBondContact O-N 3.28Å; S281-S284 VanDerWaalsContact O-N 3.1Å; T282-S284 VanDerWaalsContact C-N 3.31Å; T282-S284 PolarHBondContact O-N 3.34Å |
| 285 | W | 58.2 | Low | 72.1 | Confident | 214 Ų | 214 | 110.2 Ų | 110.2 | 81% | 0.811 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -104.4 | -9.6 | -178.9 | -74.2 | 70.1 | 0 | 0 | 0 | 113.4 | S281 T282 L283 P287 | S281-W285 PolarHBondContact O-N 3.19Å; T282-W285 CarbonylContact O-C 3.3Å; T282-W285 PolarHBondContact O-N 3.46Å; T282-W285 VanDerWaalsContact O-N 3.07Å; L283-W285 PolarHBondContact O-N 3.37Å; W285-P287 WeakPolarHBondContact O-CD 3.25Å; W285-P287 VanDerWaalsContact O-N 3.12Å |
| 286 | S | 49.7 | Very low | 70.7 | Confident | 71 Ų | 71 | 113.9 Ų | 113.9 | 50% | 0.497 | 59% | 0.589 | S | S | . | * | S | Bend | trans | -64.7 | 110.6 | 166.3 | 48.6 | 0 | 0 | 0 | 0 | 107.8 | T282 L283 F288 | T282-S286 PolarHBondContact O-N 3.24Å; L283-S286 PolarHBondContact O-OG 3.23Å; S286-F288 PolarHBondContact O-N 3.37Å |
| 287 | P | 53.7 | Low | 69.2 | Low | 104 Ų | 104 | 116.7 Ų | 116.7 | 68% | 0.675 | 60% | 0.598 | S | S | * | * | trans | -62.7 | 140.8 | 176 | -10.7 | 27 | 0 | 0 | 0 | 107.5 | W285 Y289 | W285-P287 WeakPolarHBondContact O-CD 3.25Å; W285-P287 VanDerWaalsContact O-N 3.12Å; P287-Y289 PolarHBondContact O-N 3.31Å; P287-Y289 VanDerWaalsContact O-N 3.16Å | ||
| 288 | F | 51.4 | Low | 67.5 | Low | 198 Ų | 198 | 120.1 Ų | 120.1 | 87% | 0.868 | 62% | 0.615 | S | S | * | * | trans | -55.3 | 119.5 | 145.7 | -70.2 | -89.2 | 0 | 0 | 0 | 105.6 | S286 | S286-F288 PolarHBondContact O-N 3.37Š| ||
| 289 | Y | 36.7 | Very low | 65.6 | Low | 294 Ų | 294 | 128.1 Ų | 128.1 | 100% | 1.153 | 66% | 0.656 | S | S | * | * | trans | 96.6 | 0 | -178.6 | -58.8 | -77.2 | 0 | 0 | 0 | 117.3 | P287 | P287-Y289 PolarHBondContact O-N 3.31Å; P287-Y289 VanDerWaalsContact O-N 3.16Å |
Retrieved 289 of 289 residues in 632.8 ms
(Link to these results)