| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.3 | Very low | 48.6 | Very low | 71 Ų | 71 | 130.1 Ų | 130.1 | 35% | 0.35 | 65% | 0.649 | S | S | . | * | 0 | 101.5 | 0 | -72.2 | -133.2 | 110.9 | 0 | 0 | 107.6 | I42 S43 E44 D46 | M1-I42 VanDerWaalsContact C-C 3.49Å; M1-I42 VanDerWaalsContact CA-CA 3.44Å; M1-I42 HydrophobicContact CB-CB 3.16Å; M1-I42 HydrophobicContact CB-CD1 4.05Å; M1-I42 HydrophobicContact CB-CG1 3.69Å; M1-I42 HydrophobicContact CB-CG2 4.42Å; M1-I42 WeakPolarHBondContact CB-O 3.17Å; M1-I42 WeakPolarHBondContact CE-O 3.48Å; M1-I42 HydrophobicContact CG-CB 4.42Å; M1-I42 WeakPolarHBondContact O-CA 3.4Å; M1-I42 WeakPolarHBondContact O-CB 3.49Å; M1-I42 WeakPolarHBondContact O-CG2 3.39Å; M1-S43 WeakPolarHBondContact CA-O 3.42Å; M1-S43 VanDerWaalsContact CE-CA 3.42Å; M1-S43 WeakPolarHBondContact CG-O 3.28Å; M1-S43 PolarHBondContact N-O 3.27Å; M1-E44 HydrophobicContact CE-CB 3.92Å; M1-E44 HydrophobicContact CE-CG 3.46Å; M1-E44 VanDerWaalsContact CE-CG 3.46Å; M1-E44 HydrophobicContact CG-CB 4.4Å; M1-E44 HydrophobicContact CG-CG 4.19Å; M1-E44 VanDerWaalsContact CG-N 3.32Å; M1-E44 HydrophobicContact SD-CG 3.85Å; M1-D46 VanDerWaalsContact CA-OD2 3.27Å; M1-D46 WeakPolarHBondContact CA-OD2 3.25Å; M1-D46 VanDerWaalsContact N-CB 3.26Å; M1-D46 PolarHBondContact N-OD2 3.17Å | |||
| 2 | P | 48.5 | Very low | 48.9 | Very low | 21 Ų | 21 | 134 Ų | 134 | 14% | 0.136 | 66% | 0.663 | C | S | . | * | -102.7 | 140.7 | -126.6 | 6.9 | 21.3 | 0 | 0 | 0 | 115.4 | F4 S43 D46 | P2-F4 HydrophobicContact CB-CE2 4.38Å; P2-F4 HydrophobicContact CB-CZ 4.23Å; P2-F4 HydrophobicContact CG-CE2 4.34Å; P2-F4 HydrophobicContact CG-CZ 4.03Å; P2-S43 VanDerWaalsContact CD-CB 3.41Å; P2-D46 WeakPolarHBondContact CA-OD2 3.47Å; P2-D46 WeakPolarHBondContact CB-OD2 3.37Å; P2-D46 WeakPolarHBondContact CG-OD2 3.23Å | |||
| 3 | C | 43 | Very low | 48.7 | Very low | 118 Ų | 118 | 137.2 Ų | 137.2 | 80% | 0.797 | 68% | 0.675 | S | S | * | * | trans | -87.7 | 117.5 | 157.9 | -75.2 | 0 | 0 | 0 | 0 | 108.2 | V5 | C3-V5 PolarHBondContact O-N 2.83Š| ||
| 4 | F | 52.4 | Low | 48.6 | Very low | 170 Ų | 170 | 138.4 Ų | 138.4 | 75% | 0.746 | 68% | 0.684 | S | S | * | * | trans | -82.1 | 112.9 | 168.9 | -57.7 | -82.6 | 0 | 0 | 0 | 108.7 | P2 I6 | P2-F4 HydrophobicContact CB-CE2 4.38Å; P2-F4 HydrophobicContact CB-CZ 4.23Å; P2-F4 HydrophobicContact CG-CE2 4.34Å; P2-F4 HydrophobicContact CG-CZ 4.03Å; F4-I6 PolarHBondContact O-N 2.99Å | ||
| 5 | V | 53.8 | Low | 48.5 | Very low | 136 Ų | 136 | 141.5 Ų | 141.5 | 82% | 0.824 | 69% | 0.693 | S | S | * | * | trans | -75.1 | 103.5 | 162.3 | 176.4 | 0 | 0 | 0 | 0 | 105.9 | C3 E7 | C3-V5 PolarHBondContact O-N 2.83Å; V5-E7 PolarHBondContact O-N 3.05Å | ||
| 6 | I | 52.8 | Low | 47.8 | Very low | 129 Ų | 129 | 136.3 Ų | 136.3 | 66% | 0.662 | 69% | 0.687 | S | S | * | * | trans | -83.2 | 102.1 | 164.3 | -59.3 | 175.7 | 0 | 0 | 0 | 105.6 | F4 Y8 | F4-I6 PolarHBondContact O-N 2.99Å; I6-Y8 PolarHBondContact O-N 2.99Å | ||
| 7 | E | 44.6 | Very low | 47.3 | Very low | 143 Ų | 143 | 139.5 Ų | 139.5 | 67% | 0.668 | 70% | 0.699 | S | S | * | * | trans | -53.3 | 118.2 | 164.6 | -166.5 | 170.2 | 142.3 | 0 | 0 | 108.4 | V5 D9 | V5-E7 PolarHBondContact O-N 3.05Å; E7-D9 HydrophobicContact CG-CB 4.18Å; E7-D9 PolarHBondContact O-N 3.5Å | ||
| 8 | Y | 52.6 | Low | 46.8 | Very low | 224 Ų | 224 | 142.2 Ų | 142.2 | 88% | 0.878 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | 5.3 | -176.5 | -96 | -97.4 | 0 | 0 | 0 | 114 | I6 | I6-Y8 PolarHBondContact O-N 2.99Š|
| 9 | D | 52 | Low | 46.4 | Very low | 134 Ų | 134 | 142.4 Ų | 142.4 | 72% | 0.717 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.9 | -14.8 | -173.8 | -152.8 | 58.7 | 0 | 0 | 0 | 113.5 | E7 | E7-D9 HydrophobicContact CG-CB 4.18Å; E7-D9 PolarHBondContact O-N 3.5Å |
| 10 | Q | 51.5 | Low | 46.1 | Very low | 167 Ų | 167 | 142.2 Ų | 142.2 | 78% | 0.78 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -100.9 | -5.4 | -173.8 | -139.2 | 174.9 | 86.2 | 0 | 0 | 115.3 | ||
| 11 | M | 45 | Very low | 45.9 | Very low | 118 Ų | 118 | 140.7 Ų | 140.7 | 58% | 0.581 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -80.1 | -14.4 | 179.7 | -71.1 | -75.1 | -98.4 | 0 | 0 | 113.4 | H13 F15 | M11-H13 VanDerWaalsContact C-N 3.34Å; M11-H13 PolarHBondContact O-N 3Å; M11-F15 WeakPolarHBondContact O-CD2 3.42Å |
| 12 | H | 52 | Low | 46 | Very low | 177 Ų | 177 | 143.8 Ų | 143.8 | 82% | 0.819 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -81.6 | -7 | -179.1 | -108.5 | -106 | 0 | 0 | 0 | 114.7 | ||
| 13 | H | 47.1 | Very low | 45.8 | Very low | 175 Ų | 175 | 150.7 Ų | 150.7 | 81% | 0.81 | 77% | 0.766 | S | S | * | * | G | 310 helix | trans | -99.8 | -9.2 | -177.7 | -155.9 | 70 | 0 | 0 | 0 | 114.3 | M11 | M11-H13 VanDerWaalsContact C-N 3.34Å; M11-H13 PolarHBondContact O-N 3Å |
| 14 | L | 46.7 | Very low | 45.6 | Very low | 155 Ų | 155 | 152.1 Ų | 152.1 | 81% | 0.812 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -100.7 | -7.4 | 176.7 | -89.8 | 151.5 | 0 | 0 | 0 | 113.9 | G16 | L14-G16 PolarHBondContact O-N 3.28Š|
| 15 | F | 47.7 | Very low | 45.1 | Very low | 185 Ų | 185 | 152 Ų | 152 | 81% | 0.811 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -89.8 | 27.1 | 171.5 | -79.2 | -80.3 | 0 | 0 | 0 | 113.1 | M11 | M11-F15 WeakPolarHBondContact O-CD2 3.42Š|
| 16 | G | 36.5 | Very low | 44.4 | Very low | 58 Ų | 58 | 152.1 Ų | 152.1 | 60% | 0.598 | 76% | 0.763 | S | S | * | * | trans | -116 | 43.6 | -171.6 | 0 | 0 | 0 | 0 | 0 | 115 | L14 | L14-G16 PolarHBondContact O-N 3.28Š| ||
| 17 | Q | 40.2 | Very low | 43.8 | Very low | 191 Ų | 191 | 153.4 Ų | 153.4 | 89% | 0.893 | 77% | 0.771 | S | S | * | * | S | Bend | trans | 178.3 | 107.7 | 169.5 | -111.4 | 172.3 | -19.2 | 0 | 0 | 104.4 | ||
| 18 | E | 37.6 | Very low | 43.3 | Very low | 187 Ų | 187 | 150.4 Ų | 150.4 | 87% | 0.874 | 78% | 0.779 | S | S | * | * | -164 | 131 | 55.6 | 178.4 | -169.7 | 138.6 | 0 | 0 | 107 | |||||
| 19 | N | 39.8 | Very low | 42.7 | Very low | 147 Ų | 147 | 144 Ų | 144 | 79% | 0.786 | 77% | 0.767 | S | S | * | * | trans | -93.6 | 113.1 | -177.8 | -179.9 | 20.9 | 0 | 0 | 0 | 109.1 | ||||
| 20 | N | 41 | Very low | 42.2 | Very low | 137 Ų | 137 | 144.9 Ų | 144.9 | 73% | 0.733 | 78% | 0.777 | S | S | * | * | trans | -160.5 | 101.9 | 150.2 | -166 | -2.1 | 0 | 0 | 0 | 112 | ||||
| 21 | P | 41.7 | Very low | 42.1 | Very low | 112 Ų | 112 | 143.2 Ų | 143.2 | 73% | 0.727 | 77% | 0.772 | S | S | * | * | trans | -102.4 | 90.1 | 172.6 | 35.1 | -23.8 | 0 | 0 | 0 | 109.7 | ||||
| 22 | N | 39.3 | Very low | 42.3 | Very low | 135 Ų | 135 | 142.1 Ų | 142.1 | 72% | 0.722 | 77% | 0.772 | S | S | * | * | trans | -168.3 | 79.7 | 159.8 | -176.7 | 21.2 | 0 | 0 | 0 | 112.1 | ||||
| 23 | I | 44.1 | Very low | 42.1 | Very low | 167 Ų | 167 | 142 Ų | 142 | 86% | 0.856 | 77% | 0.772 | S | S | * | * | trans | -157.9 | 105.3 | 142.2 | -20.1 | 165.1 | 0 | 0 | 0 | 109.3 | ||||
| 24 | N | 39.3 | Very low | 41.9 | Very low | 147 Ų | 147 | 141.5 Ų | 141.5 | 79% | 0.786 | 77% | 0.77 | S | S | * | * | trans | -53.6 | 133.3 | 152.2 | -91.7 | -2.1 | 0 | 0 | 0 | 107.9 | ||||
| 25 | E | 42.1 | Very low | 41.7 | Very low | 169 Ų | 169 | 139 Ų | 139 | 79% | 0.79 | 77% | 0.771 | S | S | * | * | trans | 154.2 | 131.1 | 134.9 | -90.7 | -179.5 | 142.2 | 0 | 0 | 112.6 | ||||
| 26 | L | 39.8 | Very low | 41.6 | Very low | 137 Ų | 137 | 135.2 Ų | 135.2 | 72% | 0.717 | 76% | 0.763 | S | S | * | * | trans | 77.4 | 125.5 | 140.4 | -66.6 | 159.3 | 0 | 0 | 0 | 119.2 | ||||
| 27 | N | 40.3 | Very low | 41.8 | Very low | 156 Ų | 156 | 138.6 Ų | 138.6 | 83% | 0.834 | 77% | 0.773 | S | S | * | * | trans | 68.6 | 110 | 159 | -68.6 | -21.3 | 0 | 0 | 0 | 115.7 | ||||
| 28 | G | 34.1 | Very low | 42.4 | Very low | 80 Ų | 80 | 135.4 Ų | 135.4 | 83% | 0.825 | 77% | 0.767 | S | S | * | * | 80.3 | 69.1 | 57.5 | 0 | 0 | 0 | 0 | 0 | 110 | |||||
| 29 | S | 38.5 | Very low | 43.2 | Very low | 90 Ų | 90 | 132.2 Ų | 132.2 | 63% | 0.629 | 76% | 0.76 | S | S | * | * | trans | -178.8 | 86.8 | 159.5 | -172.6 | 0 | 0 | 0 | 0 | 109 | I31 | S29-I31 WeakPolarHBondContact OG-CD1 3.28Å; S29-I31 WeakPolarHBondContact OG-CG1 3.37Å | ||
| 30 | T | 42 | Very low | 43.8 | Very low | 152 Ų | 152 | 130.9 Ų | 130.9 | 93% | 0.933 | 76% | 0.759 | S | S | * | * | trans | -100.9 | 87.1 | 163.4 | -48 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 31 | I | 48.5 | Very low | 44.6 | Very low | 132 Ų | 132 | 129.1 Ų | 129.1 | 68% | 0.677 | 76% | 0.757 | S | S | * | * | trans | -85.3 | 109.3 | 172.8 | -74.6 | 174.9 | 0 | 0 | 0 | 107.5 | S29 | S29-I31 WeakPolarHBondContact OG-CD1 3.28Å; S29-I31 WeakPolarHBondContact OG-CG1 3.37Å | ||
| 32 | V | 51.3 | Low | 45.3 | Very low | 96 Ų | 96 | 128.8 Ų | 128.8 | 58% | 0.582 | 75% | 0.749 | S | S | * | * | 71 | 127.7 | 124.5 | 178.8 | 0 | 0 | 0 | 0 | 119.3 | |||||
| 33 | E | 47.7 | Very low | 45.7 | Very low | 174 Ų | 174 | 125.3 Ų | 125.3 | 81% | 0.813 | 74% | 0.735 | S | S | * | * | trans | 70.9 | 135.6 | 148.9 | -73.7 | 166.8 | 154.1 | 0 | 0 | 117.7 | ||||
| 34 | Q | 41.8 | Very low | 46 | Very low | 165 Ų | 165 | 124.5 Ų | 124.5 | 77% | 0.771 | 73% | 0.728 | S | S | * | * | cis | -147.7 | 144 | 24.6 | -66.7 | 179 | -49.1 | 0 | 0 | 110.1 | T36 | Q34-T36 PolarHBondContact O-N 3.42Š| ||
| 35 | A | 42.4 | Very low | 46.8 | Very low | 101 Ų | 101 | 121.6 Ų | 121.6 | 84% | 0.835 | 72% | 0.718 | S | S | * | * | trans | -74.5 | 100 | 161.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | T37 | A35-T37 PolarHBondContact O-N 3.4Š| ||
| 36 | T | 45.7 | Very low | 47.3 | Very low | 106 Ų | 106 | 117.9 Ų | 117.9 | 65% | 0.65 | 70% | 0.704 | S | S | * | * | trans | -86.5 | 95.1 | 173.6 | -47.7 | 0 | 0 | 0 | 0 | 109.5 | Q34 T38 | Q34-T36 PolarHBondContact O-N 3.42Å; T36-T38 PolarHBondContact O-N 2.68Å; T36-T38 VanDerWaalsContact O-N 3.09Å; T36-T38 PolarHBondContact O-OG1 2.88Å | ||
| 37 | T | 40.5 | Very low | 48.1 | Very low | 130 Ų | 130 | 118.5 Ų | 118.5 | 80% | 0.798 | 71% | 0.708 | S | S | * | * | trans | -65.6 | 101.9 | 165.8 | -41.7 | 0 | 0 | 0 | 0 | 108.6 | A35 | A35-T37 PolarHBondContact O-N 3.4Š| ||
| 38 | T | 52.3 | Low | 48.7 | Very low | 124 Ų | 124 | 121.2 Ų | 121.2 | 76% | 0.761 | 71% | 0.706 | S | S | * | * | trans | -93.9 | 101.1 | 177.9 | -14.6 | 0 | 0 | 0 | 0 | 109.6 | T36 | T36-T38 PolarHBondContact O-N 2.68Å; T36-T38 VanDerWaalsContact O-N 3.09Å; T36-T38 PolarHBondContact O-OG1 2.88Å | ||
| 39 | T | 55.3 | Low | 49.4 | Very low | 120 Ų | 120 | 124.2 Ų | 124.2 | 74% | 0.736 | 70% | 0.703 | S | S | * | * | trans | -72.3 | 131.3 | 162 | 24.1 | 0 | 0 | 0 | 0 | 108.8 | S41 | T39-S41 PolarHBondContact O-N 3.17Š| ||
| 40 | P | 53.1 | Low | 49.9 | Very low | 118 Ų | 118 | 127.8 Ų | 127.8 | 77% | 0.766 | 72% | 0.715 | S | S | * | * | trans | -73 | 104 | 177.3 | 27.9 | -30.1 | 0 | 0 | 0 | 109.1 | I42 | P40-I42 PolarHBondContact O-N 3.09Š| ||
| 41 | S | 56.9 | Low | 50.2 | Low | 100 Ų | 100 | 128.8 Ų | 128.8 | 70% | 0.699 | 71% | 0.709 | S | S | * | * | trans | -75.1 | 104.4 | 165.7 | 75.5 | 0 | 0 | 0 | 0 | 108.1 | T39 S43 | T39-S41 PolarHBondContact O-N 3.17Å; S41-S43 PolarHBondContact O-N 3.47Å | ||
| 42 | I | 55.6 | Low | 50.2 | Low | 105 Ų | 105 | 129.9 Ų | 129.9 | 54% | 0.538 | 71% | 0.711 | S | S | . | * | trans | -64.8 | 130.1 | 160.8 | 55.9 | 163.6 | 0 | 0 | 0 | 105.4 | M1 P40 | M1-I42 VanDerWaalsContact C-C 3.49Å; M1-I42 VanDerWaalsContact CA-CA 3.44Å; M1-I42 HydrophobicContact CB-CB 3.16Å; M1-I42 HydrophobicContact CB-CD1 4.05Å; M1-I42 HydrophobicContact CB-CG1 3.69Å; M1-I42 HydrophobicContact CB-CG2 4.42Å; M1-I42 WeakPolarHBondContact CB-O 3.17Å; M1-I42 WeakPolarHBondContact CE-O 3.48Å; M1-I42 HydrophobicContact CG-CB 4.42Å; M1-I42 WeakPolarHBondContact O-CA 3.4Å; M1-I42 WeakPolarHBondContact O-CB 3.49Å; M1-I42 WeakPolarHBondContact O-CG2 3.39Å; P40-I42 PolarHBondContact O-N 3.09Å | ||
| 43 | S | 47.8 | Very low | 50 | Low | 62 Ų | 62 | 131.4 Ų | 131.4 | 43% | 0.434 | 72% | 0.724 | S | S | . | * | trans | -111.3 | 128.1 | -179.8 | -175.6 | 0 | 0 | 0 | 0 | 118.1 | M1 P2 S41 S45 | M1-S43 WeakPolarHBondContact CA-O 3.42Å; M1-S43 VanDerWaalsContact CE-CA 3.42Å; M1-S43 WeakPolarHBondContact CG-O 3.28Å; M1-S43 PolarHBondContact N-O 3.27Å; P2-S43 VanDerWaalsContact CD-CB 3.41Å; S41-S43 PolarHBondContact O-N 3.47Å; S43-S45 PolarHBondContact O-N 3.39Å; S43-S45 PolarHBondContact O-OG 3.49Å | ||
| 44 | E | 50.2 | Low | 50 | Low | 151 Ų | 151 | 128.3 Ų | 128.3 | 71% | 0.706 | 72% | 0.716 | S | S | * | * | G | 310 helix | trans | -53.6 | -10.1 | -152 | -99 | 146.7 | -175.3 | 0 | 0 | 118.2 | M1 | M1-E44 HydrophobicContact CE-CB 3.92Å; M1-E44 HydrophobicContact CE-CG 3.46Å; M1-E44 VanDerWaalsContact CE-CG 3.46Å; M1-E44 HydrophobicContact CG-CB 4.4Å; M1-E44 HydrophobicContact CG-CG 4.19Å; M1-E44 VanDerWaalsContact CG-N 3.32Å; M1-E44 HydrophobicContact SD-CG 3.85Å |
| 45 | S | 56.8 | Low | 50 | Low | 85 Ų | 85 | 125.9 Ų | 125.9 | 59% | 0.594 | 72% | 0.717 | S | S | * | * | G | 310 helix | trans | -72.9 | -23.8 | -176.3 | 47.5 | 0 | 0 | 0 | 0 | 116.9 | S43 L47 | S43-S45 PolarHBondContact O-N 3.39Å; S43-S45 PolarHBondContact O-OG 3.49Å; S45-L47 PolarHBondContact O-N 2.72Å |
| 46 | D | 53.6 | Low | 50.1 | Low | 92 Ų | 92 | 130.1 Ų | 130.1 | 49% | 0.492 | 72% | 0.72 | S | S | . | * | G | 310 helix | trans | -78.9 | 6.7 | 178.6 | -46.4 | -83.4 | 0 | 0 | 0 | 115.3 | M1 P2 R48 | M1-D46 VanDerWaalsContact CA-OD2 3.27Å; M1-D46 WeakPolarHBondContact CA-OD2 3.25Å; M1-D46 VanDerWaalsContact N-CB 3.26Å; M1-D46 PolarHBondContact N-OD2 3.17Å; P2-D46 WeakPolarHBondContact CA-OD2 3.47Å; P2-D46 WeakPolarHBondContact CB-OD2 3.37Å; P2-D46 WeakPolarHBondContact CG-OD2 3.23Å; D46-R48 VanDerWaalsContact C-N 3.31Å |
| 47 | L | 56.3 | Low | 49.6 | Very low | 150 Ų | 150 | 130.9 Ų | 130.9 | 79% | 0.785 | 73% | 0.729 | S | S | * | * | G | 310 helix | trans | -89.8 | 5.1 | 174.8 | -70.8 | 171.2 | 0 | 0 | 0 | 112.9 | S45 | S45-L47 PolarHBondContact O-N 2.72Š|
| 48 | R | 52.6 | Low | 50.1 | Low | 212 Ų | 212 | 131.3 Ų | 131.3 | 80% | 0.8 | 73% | 0.727 | S | S | * | * | trans | -126.8 | 34.4 | -164.5 | -152 | -174.7 | 138.5 | 161.5 | -3.7 | 115.4 | D46 | D46-R48 VanDerWaalsContact C-N 3.31Š| ||
| 49 | N | 49.4 | Very low | 49.4 | Very low | 144 Ų | 144 | 134.4 Ų | 134.4 | 77% | 0.77 | 74% | 0.735 | S | S | * | * | trans | -110 | 1.2 | 179.7 | -161.9 | 47.9 | 0 | 0 | 0 | 117 | ||||
| 50 | D | 47.7 | Very low | 49 | Very low | 164 Ų | 164 | 133.8 Ų | 133.8 | 88% | 0.877 | 73% | 0.731 | S | S | * | * | trans | -102.7 | 30.8 | -178.8 | -66.7 | -37.6 | 0 | 0 | 0 | 114.3 | Q52 | D50-Q52 PolarHBondContact O-N 3.36Š| ||
| 51 | Q | 49 | Very low | 48.8 | Very low | 173 Ų | 173 | 134.6 Ų | 134.6 | 81% | 0.808 | 73% | 0.734 | S | S | * | * | trans | -95.3 | 79.3 | 164.9 | -75.9 | -170.8 | -19.7 | 0 | 0 | 110.2 | ||||
| 52 | Q | 47.9 | Very low | 48.4 | Very low | 155 Ų | 155 | 138 Ų | 138 | 72% | 0.724 | 74% | 0.738 | S | S | * | * | trans | -139.4 | 105.6 | 159.2 | -154.7 | -177.2 | -28.6 | 0 | 0 | 109.9 | D50 V54 | D50-Q52 PolarHBondContact O-N 3.36Å; Q52-V54 HydrophobicContact CG-CG2 3.99Å; Q52-V54 PolarHBondContact O-N 2.99Å | ||
| 53 | P | 47 | Very low | 48.1 | Very low | 129 Ų | 129 | 141 Ų | 141 | 84% | 0.838 | 76% | 0.755 | S | S | * | * | trans | -86.1 | 98.3 | 171.4 | 32.4 | -25.7 | 0 | 0 | 0 | 108 | ||||
| 54 | V | 48.9 | Very low | 48.2 | Very low | 109 Ų | 109 | 144.1 Ų | 144.1 | 66% | 0.661 | 77% | 0.772 | S | S | * | * | trans | -126.3 | 102.6 | 163.7 | -98.8 | 0 | 0 | 0 | 0 | 108.4 | Q52 H56 | Q52-V54 HydrophobicContact CG-CG2 3.99Å; Q52-V54 PolarHBondContact O-N 2.99Å; V54-H56 PolarHBondContact O-N 2.94Å | ||
| 55 | S | 40.5 | Very low | 48.2 | Very low | 113 Ų | 113 | 139.2 Ų | 139.2 | 79% | 0.79 | 76% | 0.762 | S | S | * | * | trans | -34 | 124.4 | 160.6 | -172.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 56 | H | 44.4 | Very low | 48.3 | Very low | 191 Ų | 191 | 137.2 Ų | 137.2 | 88% | 0.884 | 75% | 0.754 | S | S | * | * | trans | -157.3 | 112.7 | 151.2 | -101.9 | -156.3 | 0 | 0 | 0 | 107.7 | V54 N58 | V54-H56 PolarHBondContact O-N 2.94Å; H56-N58 PolarHBondContact O-N 3.29Å | ||
| 57 | S | 36.3 | Very low | 48.6 | Very low | 121 Ų | 121 | 139.2 Ų | 139.2 | 85% | 0.846 | 77% | 0.765 | S | S | * | * | trans | -59.5 | 115.1 | 171.5 | 53.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 58 | N | 50.7 | Low | 48.8 | Very low | 140 Ų | 140 | 134.2 Ų | 134.2 | 75% | 0.749 | 75% | 0.75 | S | S | * | * | trans | -145.6 | 113.2 | 152.2 | -149.8 | 2.2 | 0 | 0 | 0 | 109.3 | H56 T60 | H56-N58 PolarHBondContact O-N 3.29Å; N58-T60 PolarHBondContact O-N 3.39Å | ||
| 59 | M | 38.3 | Very low | 49.4 | Very low | 189 Ų | 189 | 129.1 Ų | 129.1 | 93% | 0.931 | 74% | 0.738 | S | S | * | * | trans | -72.4 | 89.1 | 176.9 | 179 | -176.4 | -76.5 | 0 | 0 | 108 | ||||
| 60 | T | 45.4 | Very low | 50.1 | Low | 107 Ų | 107 | 129.9 Ų | 129.9 | 66% | 0.656 | 73% | 0.73 | S | S | * | * | trans | -115.9 | 113.8 | 166.4 | 47.1 | 0 | 0 | 0 | 0 | 108.3 | N58 E62 | N58-T60 PolarHBondContact O-N 3.39Å; T60-E62 PolarHBondContact O-N 2.88Å; T60-E62 VanDerWaalsContact O-N 3.08Å | ||
| 61 | T | 50.5 | Low | 51.2 | Low | 134 Ų | 134 | 127.3 Ų | 127.3 | 82% | 0.822 | 71% | 0.713 | S | S | * | * | trans | -35.2 | 110.9 | 174.3 | -45.2 | 0 | 0 | 0 | 0 | 111 | L63 | T61-L63 PolarHBondContact O-N 3.47Š| ||
| 62 | E | 46.9 | Very low | 52.7 | Low | 171 Ų | 171 | 122.8 Ų | 122.8 | 80% | 0.799 | 70% | 0.7 | S | S | * | * | trans | -58 | 110.7 | 175.3 | -63.2 | -171.7 | 121.1 | 0 | 0 | 108.2 | T60 T64 | T60-E62 PolarHBondContact O-N 2.88Å; T60-E62 VanDerWaalsContact O-N 3.08Å; E62-T64 PolarHBondContact O-N 2.82Å; E62-T64 PolarHBondContact O-OG1 3.21Å | ||
| 63 | L | 50.6 | Low | 54.2 | Low | 169 Ų | 169 | 123.8 Ų | 123.8 | 89% | 0.885 | 70% | 0.697 | S | S | * | * | trans | -66.1 | 86.4 | 157.6 | -69.4 | 174.9 | 0 | 0 | 0 | 106 | T61 G65 | T61-L63 PolarHBondContact O-N 3.47Å; L63-G65 PolarHBondContact O-N 3.35Å | ||
| 64 | T | 48.6 | Very low | 56 | Low | 128 Ų | 128 | 124.3 Ų | 124.3 | 79% | 0.785 | 68% | 0.682 | S | S | * | * | trans | -59.8 | 79.6 | 171.2 | -58.3 | 0 | 0 | 0 | 0 | 108.8 | E62 | E62-T64 PolarHBondContact O-N 2.82Å; E62-T64 PolarHBondContact O-OG1 3.21Å | ||
| 65 | G | 51.7 | Low | 57.8 | Low | 48 Ų | 48 | 122.2 Ų | 122.2 | 50% | 0.495 | 67% | 0.672 | S | S | . | * | trans | -147.8 | 2.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | L63 N67 | L63-G65 PolarHBondContact O-N 3.35Å; G65-N67 VanDerWaalsContact C-N 3.34Å; G65-N67 PolarHBondContact O-N 3.49Å | ||
| 66 | G | 58.9 | Low | 60.3 | Low | 43 Ų | 43 | 121.7 Ų | 121.7 | 44% | 0.443 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -73.5 | -18.7 | -172.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | R70 | G66-R70 WeakPolarHBondContact O-CD 3.49Å; G66-R70 WeakPolarHBondContact O-CG 3.44Å |
| 67 | N | 59.5 | Low | 62.5 | Low | 134 Ų | 134 | 119.2 Ų | 119.2 | 72% | 0.717 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -84.9 | -44.6 | -173.1 | -34.8 | 22.8 | 0 | 0 | 0 | 110.1 | G65 E71 | G65-N67 VanDerWaalsContact C-N 3.34Å; G65-N67 PolarHBondContact O-N 3.49Å; N67-E71 PolarHBondContact O-N 3.46Å |
| 68 | G | 60.8 | Low | 65.2 | Low | 45 Ų | 45 | 119.1 Ų | 119.1 | 46% | 0.464 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -69.3 | -42.1 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | R70 E71 S72 | G68-R70 VanDerWaalsContact C-N 3.34Å; G68-R70 PolarHBondContact O-N 2.95Å; G68-E71 PolarHBondContact O-N 3.23Å; G68-S72 WeakPolarHBondContact O-CB 3.26Å; G68-S72 PolarHBondContact O-N 2.84Å; G68-S72 PolarHBondContact O-OG 3.47Å; G68-S72 VanDerWaalsContact O-OG 3.04Å |
| 69 | L | 63.6 | Low | 67.2 | Low | 104 Ų | 104 | 116.9 Ų | 116.9 | 55% | 0.545 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -65.5 | -37.2 | -178.5 | -161.4 | 94.2 | 0 | 0 | 0 | 112.3 | R73 | L69-R73 WeakPolarHBondContact O-CB 3.47Å; L69-R73 VanDerWaalsContact O-CG 3.24Å; L69-R73 WeakPolarHBondContact O-CG 3.3Å; L69-R73 PolarHBondContact O-N 3.28Å |
| 70 | R | 65.4 | Low | 69.8 | Low | 160 Ų | 160 | 111.8 Ų | 111.8 | 60% | 0.604 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -66.5 | -41 | 178.3 | -72.2 | 174.5 | 70 | -157.4 | 5.1 | 111.3 | G66 G68 R73 R74 | G66-R70 WeakPolarHBondContact O-CD 3.49Å; G66-R70 WeakPolarHBondContact O-CG 3.44Å; G68-R70 VanDerWaalsContact C-N 3.34Å; G68-R70 PolarHBondContact O-N 2.95Å; R70-R73 PolarHBondContact O-N 2.95Å; R70-R74 WeakPolarHBondContact O-CG 3.37Å; R70-R74 PolarHBondContact O-N 3.43Å |
| 71 | E | 71.1 | Confident | 72.1 | Confident | 111 Ų | 111 | 109.8 Ų | 109.8 | 52% | 0.519 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -71.7 | -40.5 | 177 | -162.9 | 56.5 | -150.7 | 0 | 0 | 111.8 | N67 G68 R73 R74 S75 | N67-E71 PolarHBondContact O-N 3.46Å; G68-E71 PolarHBondContact O-N 3.23Å; E71-R73 VanDerWaalsContact C-N 3.31Å; E71-R73 PolarHBondContact O-N 3.43Å; E71-R74 PolarHBondContact O-N 3.4Å; E71-R74 IonicContact OE2-NH1 3.87Å; E71-S75 VanDerWaalsContact O-CB 3.3Å; E71-S75 WeakPolarHBondContact O-CB 3.24Å; E71-S75 PolarHBondContact O-N 2.92Å |
| 72 | S | 79 | Confident | 74.1 | Confident | 78 Ų | 78 | 109.1 Ų | 109.1 | 55% | 0.545 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -60.3 | -39.1 | 172.2 | -61.7 | 0 | 0 | 0 | 0 | 112.3 | G68 L76 | G68-S72 WeakPolarHBondContact O-CB 3.26Å; G68-S72 PolarHBondContact O-N 2.84Å; G68-S72 PolarHBondContact O-OG 3.47Å; G68-S72 VanDerWaalsContact O-OG 3.04Å; S72-L76 VanDerWaalsContact O-CB 3.29Å; S72-L76 WeakPolarHBondContact O-CB 3.27Å; S72-L76 PolarHBondContact O-N 3.36Å |
| 73 | R | 80.8 | Confident | 76.4 | Confident | 176 Ų | 176 | 106.5 Ų | 106.5 | 66% | 0.664 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -66.4 | -42.7 | 175.6 | -78.2 | 178.2 | 176.8 | -144.9 | 0.4 | 112.2 | L69 R70 E71 H77 | L69-R73 WeakPolarHBondContact O-CB 3.47Å; L69-R73 VanDerWaalsContact O-CG 3.24Å; L69-R73 WeakPolarHBondContact O-CG 3.3Å; L69-R73 PolarHBondContact O-N 3.28Å; R70-R73 PolarHBondContact O-N 2.95Å; E71-R73 VanDerWaalsContact C-N 3.31Å; E71-R73 PolarHBondContact O-N 3.43Å; R73-H77 WeakPolarHBondContact O-CB 3.44Å; R73-H77 PolarHBondContact O-N 2.87Å |
| 74 | R | 83.4 | Confident | 78.3 | Confident | 140 Ų | 140 | 103.1 Ų | 103.1 | 53% | 0.528 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.8 | -45.3 | 175 | -74.7 | 176.7 | 177.5 | 165.7 | -4.7 | 111.5 | R70 E71 H77 L78 | R70-R74 WeakPolarHBondContact O-CG 3.37Å; R70-R74 PolarHBondContact O-N 3.43Å; E71-R74 PolarHBondContact O-N 3.4Å; E71-R74 IonicContact OE2-NH1 3.87Å; R74-H77 PolarHBondContact O-N 3.4Å; R74-L78 WeakPolarHBondContact O-CG 3.31Å; R74-L78 PolarHBondContact O-N 2.92Å |
| 75 | S | 88.5 | Confident | 80.3 | Confident | 64 Ų | 64 | 103.2 Ų | 103.2 | 45% | 0.448 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -59.2 | -48.7 | 176.1 | 179.2 | 0 | 0 | 0 | 0 | 111.7 | E71 H77 L78 V79 | E71-S75 VanDerWaalsContact O-CB 3.3Å; E71-S75 WeakPolarHBondContact O-CB 3.24Å; E71-S75 PolarHBondContact O-N 2.92Å; S75-H77 VanDerWaalsContact C-N 3.32Å; S75-H77 PolarHBondContact O-N 3.41Å; S75-L78 WeakPolarHBondContact O-CB 3.14Å; S75-L78 PolarHBondContact O-N 2.94Å; S75-V79 WeakPolarHBondContact O-CG2 3.36Å; S75-V79 PolarHBondContact O-N 3.26Å |
| 76 | L | 91.9 | Very high | 82.3 | Confident | 103 Ų | 103 | 107 Ų | 107 | 54% | 0.539 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -59.3 | -42.9 | 176.4 | -179.5 | 63.9 | 0 | 0 | 0 | 111.8 | S72 L78 V79 I80 | S72-L76 VanDerWaalsContact O-CB 3.29Å; S72-L76 WeakPolarHBondContact O-CB 3.27Å; S72-L76 PolarHBondContact O-N 3.36Å; L76-L78 VanDerWaalsContact C-N 3.33Å; L76-L78 PolarHBondContact O-N 3.09Å; L76-V79 PolarHBondContact O-N 3.31Å; L76-I80 HydrophobicContact CD1-CD1 4Å; L76-I80 HydrophobicContact CD1-CG1 4.27Å; L76-I80 HydrophobicContact CD2-CD1 4.39Å; L76-I80 HydrophobicContact CG-CD1 3.77Å; L76-I80 HydrophobicContact CG-CG1 4.43Å; L76-I80 VanDerWaalsContact O-CG1 3.29Å; L76-I80 WeakPolarHBondContact O-CG1 3.49Å; L76-I80 PolarHBondContact O-N 3.33Å |
| 77 | H | 91 | Very high | 83.8 | Confident | 138 Ų | 138 | 110.2 Ų | 110.2 | 64% | 0.639 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64 | -38.2 | 178.3 | -165.3 | -88.2 | 0 | 0 | 0 | 112.2 | R73 R74 S75 S81 | R73-H77 WeakPolarHBondContact O-CB 3.44Å; R73-H77 PolarHBondContact O-N 2.87Å; R74-H77 PolarHBondContact O-N 3.4Å; S75-H77 VanDerWaalsContact C-N 3.32Å; S75-H77 PolarHBondContact O-N 3.41Å; H77-S81 WeakPolarHBondContact O-CB 3.29Å; H77-S81 PolarHBondContact O-N 2.99Å |
| 78 | L | 92.2 | Very high | 85.2 | Confident | 120 Ų | 120 | 105.7 Ų | 105.7 | 63% | 0.628 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64.4 | -43.1 | 173.5 | -71.7 | 171.4 | 0 | 0 | 0 | 111.7 | R74 S75 L76 S81 L82 | R74-L78 WeakPolarHBondContact O-CG 3.31Å; R74-L78 PolarHBondContact O-N 2.92Å; S75-L78 WeakPolarHBondContact O-CB 3.14Å; S75-L78 PolarHBondContact O-N 2.94Å; L76-L78 VanDerWaalsContact C-N 3.33Å; L76-L78 PolarHBondContact O-N 3.09Å; L78-S81 PolarHBondContact O-N 3.19Å; L78-L82 VanDerWaalsContact O-CB 3.31Å; L78-L82 WeakPolarHBondContact O-CB 3.3Å; L78-L82 PolarHBondContact O-N 3.38Å |
| 79 | V | 92.8 | Very high | 86.7 | Confident | 92 Ų | 92 | 106.2 Ų | 106.2 | 56% | 0.558 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -62.7 | -46.5 | 177.2 | 173.5 | 0 | 0 | 0 | 0 | 111.1 | S75 L76 L82 F83 | S75-V79 WeakPolarHBondContact O-CG2 3.36Å; S75-V79 PolarHBondContact O-N 3.26Å; L76-V79 PolarHBondContact O-N 3.31Å; V79-L82 PolarHBondContact O-N 3.27Å; V79-F83 WeakPolarHBondContact O-CB 3.33Å; V79-F83 PolarHBondContact O-N 2.85Å |
| 80 | I | 93.8 | Very high | 88 | Confident | 82 Ų | 82 | 103.7 Ų | 103.7 | 42% | 0.421 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.6 | -43.2 | 177.6 | -67.1 | 166.7 | 0 | 0 | 0 | 110.7 | L76 F83 N84 | L76-I80 HydrophobicContact CD1-CD1 4Å; L76-I80 HydrophobicContact CD1-CG1 4.27Å; L76-I80 HydrophobicContact CD2-CD1 4.39Å; L76-I80 HydrophobicContact CG-CD1 3.77Å; L76-I80 HydrophobicContact CG-CG1 4.43Å; L76-I80 VanDerWaalsContact O-CG1 3.29Å; L76-I80 WeakPolarHBondContact O-CG1 3.49Å; L76-I80 PolarHBondContact O-N 3.33Å; I80-F83 PolarHBondContact O-N 2.9Å; I80-N84 WeakPolarHBondContact O-CB 3.29Å; I80-N84 PolarHBondContact O-N 3.48Å; I80-N84 PolarHBondContact O-ND2 3.33Å |
| 81 | S | 92.6 | Very high | 89.2 | Confident | 65 Ų | 65 | 102.3 Ų | 102.3 | 46% | 0.455 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.4 | -45.9 | 177.2 | -175.2 | 0 | 0 | 0 | 0 | 111.6 | H77 L78 F83 N84 H85 | H77-S81 WeakPolarHBondContact O-CB 3.29Å; H77-S81 PolarHBondContact O-N 2.99Å; L78-S81 PolarHBondContact O-N 3.19Å; S81-F83 VanDerWaalsContact C-N 3.34Å; S81-F83 PolarHBondContact O-N 2.88Å; S81-N84 PolarHBondContact O-N 2.84Å; S81-H85 VanDerWaalsContact O-CB 3.29Å; S81-H85 WeakPolarHBondContact O-CB 3.33Å; S81-H85 PolarHBondContact O-N 3.29Å |
| 82 | L | 93.6 | Very high | 90.1 | Very high | 121 Ų | 121 | 104.2 Ų | 104.2 | 63% | 0.634 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62.9 | -41.8 | 176.9 | -177.9 | 61.9 | 0 | 0 | 0 | 111.5 | L78 V79 H85 F86 | L78-L82 VanDerWaalsContact O-CB 3.31Å; L78-L82 WeakPolarHBondContact O-CB 3.3Å; L78-L82 PolarHBondContact O-N 3.38Å; V79-L82 PolarHBondContact O-N 3.27Å; L82-H85 PolarHBondContact O-N 2.89Å; L82-F86 VanDerWaalsContact O-CB 3.31Å; L82-F86 WeakPolarHBondContact O-CB 3.36Å; L82-F86 PolarHBondContact O-N 3.48Å |
| 83 | F | 94.3 | Very high | 90.7 | Very high | 115 Ų | 115 | 106.2 Ų | 106.2 | 50% | 0.504 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.3 | -51.5 | 175.9 | -173.5 | -90 | 0 | 0 | 0 | 111 | V79 I80 S81 H85 F86 F87 | V79-F83 WeakPolarHBondContact O-CB 3.33Å; V79-F83 PolarHBondContact O-N 2.85Å; I80-F83 PolarHBondContact O-N 2.9Å; S81-F83 VanDerWaalsContact C-N 3.34Å; S81-F83 PolarHBondContact O-N 2.88Å; F83-H85 VanDerWaalsContact C-N 3.31Å; F83-H85 PolarHBondContact O-N 2.97Å; F83-F86 PolarHBondContact O-N 3.24Å; F83-F87 AromaticContact CD1-CD2 3.74Å; F83-F87 HydrophobicContact CD1-CD2 3.74Å; F83-F87 HydrophobicContact CD1-CE2 4.05Å; F83-F87 HydrophobicContact CD2-CD2 4.01Å; F83-F87 AromaticContact CD2-CE2 3.66Å; F83-F87 HydrophobicContact CD2-CE2 3.66Å; F83-F87 AromaticContact CE1-CD2 3.52Å; F83-F87 HydrophobicContact CE1-CD2 3.52Å; F83-F87 AromaticContact CE1-CE2 3.53Å; F83-F87 HydrophobicContact CE1-CE2 3.53Å; F83-F87 HydrophobicContact CE1-CG 4.17Å; F83-F87 HydrophobicContact CE1-CZ 4.13Å; F83-F87 AromaticContact CE2-CD2 3.84Å; F83-F87 HydrophobicContact CE2-CD2 3.84Å; F83-F87 AromaticContact CE2-CE2 3.12Å; F83-F87 HydrophobicContact CE2-CE2 3.12Å; F83-F87 AromaticContact CE2-CZ 3.82Å; F83-F87 HydrophobicContact CE2-CZ 3.82Å; F83-F87 AromaticContact CG-CD2 3.99Å; F83-F87 HydrophobicContact CG-CD2 3.99Å; F83-F87 HydrophobicContact CG-CE2 4.11Å; F83-F87 AromaticContact CZ-CD2 3.58Å; F83-F87 HydrophobicContact CZ-CD2 3.58Å; F83-F87 HydrophobicContact CZ-CE1 4.34Å; F83-F87 AromaticContact CZ-CE2 3.04Å; F83-F87 HydrophobicContact CZ-CE2 3.04Å; F83-F87 HydrophobicContact CZ-CG 4.44Å; F83-F87 AromaticContact CZ-CZ 3.47Å; F83-F87 HydrophobicContact CZ-CZ 3.47Å; F83-F87 VanDerWaalsContact CZ-CZ 3.47Å; F83-F87 VanDerWaalsContact O-CD2 3.31Å; F83-F87 WeakPolarHBondContact O-CD2 3.31Å; F83-F87 PolarHBondContact O-N 3.46Å |
| 84 | N | 91.3 | Very high | 91.1 | Very high | 99 Ų | 99 | 104.2 Ų | 104.2 | 53% | 0.529 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.9 | -40.6 | 178.4 | -72.5 | -28.4 | 0 | 0 | 0 | 112.2 | I80 S81 G88 | I80-N84 WeakPolarHBondContact O-CB 3.29Å; I80-N84 PolarHBondContact O-N 3.48Å; I80-N84 PolarHBondContact O-ND2 3.33Å; S81-N84 PolarHBondContact O-N 2.84Å; N84-G88 PolarHBondContact O-N 3.31Å |
| 85 | H | 91.1 | Very high | 91.3 | Very high | 129 Ų | 129 | 102.2 Ų | 102.2 | 60% | 0.597 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64 | -42.9 | 176.3 | -177.6 | 71.8 | 0 | 0 | 0 | 112.1 | S81 L82 F83 S89 | S81-H85 VanDerWaalsContact O-CB 3.29Å; S81-H85 WeakPolarHBondContact O-CB 3.33Å; S81-H85 PolarHBondContact O-N 3.29Å; L82-H85 PolarHBondContact O-N 2.89Å; F83-H85 VanDerWaalsContact C-N 3.31Å; F83-H85 PolarHBondContact O-N 2.97Å; H85-S89 WeakPolarHBondContact O-CB 2.96Å; H85-S89 PolarHBondContact O-N 2.92Å; H85-S89 PolarHBondContact O-OG 3.03Å |
| 86 | F | 92.5 | Very high | 91.1 | Very high | 127 Ų | 127 | 102.3 Ų | 102.3 | 56% | 0.557 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.1 | -49.8 | 177.7 | -178.4 | -101.3 | 0 | 0 | 0 | 111.5 | L82 F83 G88 S89 V90 | L82-F86 VanDerWaalsContact O-CB 3.31Å; L82-F86 WeakPolarHBondContact O-CB 3.36Å; L82-F86 PolarHBondContact O-N 3.48Å; F83-F86 PolarHBondContact O-N 3.24Å; F86-G88 PolarHBondContact O-N 3.48Å; F86-S89 PolarHBondContact O-N 2.91Å; F86-V90 HydrophobicContact CD1-CG2 4.29Å; F86-V90 HydrophobicContact CD2-CG2 4.43Å; F86-V90 HydrophobicContact CE1-CG2 3.92Å; F86-V90 HydrophobicContact CE2-CG2 4.07Å; F86-V90 HydrophobicContact CZ-CG2 3.81Å; F86-V90 WeakPolarHBondContact O-CB 2.84Å; F86-V90 WeakPolarHBondContact O-CG2 3.27Å; F86-V90 PolarHBondContact O-N 2.88Å |
| 87 | F | 90.4 | Very high | 90.9 | Very high | 111 Ų | 111 | 99.4 Ų | 99.4 | 49% | 0.487 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.3 | -41 | 178.4 | -86.6 | -95.9 | 0 | 0 | 0 | 112 | F83 S89 V90 H91 | F83-F87 AromaticContact CD1-CD2 3.74Å; F83-F87 HydrophobicContact CD1-CD2 3.74Å; F83-F87 HydrophobicContact CD1-CE2 4.05Å; F83-F87 HydrophobicContact CD2-CD2 4.01Å; F83-F87 AromaticContact CD2-CE2 3.66Å; F83-F87 HydrophobicContact CD2-CE2 3.66Å; F83-F87 AromaticContact CE1-CD2 3.52Å; F83-F87 HydrophobicContact CE1-CD2 3.52Å; F83-F87 AromaticContact CE1-CE2 3.53Å; F83-F87 HydrophobicContact CE1-CE2 3.53Å; F83-F87 HydrophobicContact CE1-CG 4.17Å; F83-F87 HydrophobicContact CE1-CZ 4.13Å; F83-F87 AromaticContact CE2-CD2 3.84Å; F83-F87 HydrophobicContact CE2-CD2 3.84Å; F83-F87 AromaticContact CE2-CE2 3.12Å; F83-F87 HydrophobicContact CE2-CE2 3.12Å; F83-F87 AromaticContact CE2-CZ 3.82Å; F83-F87 HydrophobicContact CE2-CZ 3.82Å; F83-F87 AromaticContact CG-CD2 3.99Å; F83-F87 HydrophobicContact CG-CD2 3.99Å; F83-F87 HydrophobicContact CG-CE2 4.11Å; F83-F87 AromaticContact CZ-CD2 3.58Å; F83-F87 HydrophobicContact CZ-CD2 3.58Å; F83-F87 HydrophobicContact CZ-CE1 4.34Å; F83-F87 AromaticContact CZ-CE2 3.04Å; F83-F87 HydrophobicContact CZ-CE2 3.04Å; F83-F87 HydrophobicContact CZ-CG 4.44Å; F83-F87 AromaticContact CZ-CZ 3.47Å; F83-F87 HydrophobicContact CZ-CZ 3.47Å; F83-F87 VanDerWaalsContact CZ-CZ 3.47Å; F83-F87 VanDerWaalsContact O-CD2 3.31Å; F83-F87 WeakPolarHBondContact O-CD2 3.31Å; F83-F87 PolarHBondContact O-N 3.46Å; F87-S89 PolarHBondContact O-N 3.47Å; F87-V90 PolarHBondContact O-N 3.38Å; F87-H91 WeakPolarHBondContact O-CB 3.08Å; F87-H91 PolarHBondContact O-N 2.87Å |
| 88 | G | 89.5 | Confident | 90.6 | Very high | 40 Ų | 40 | 97.5 Ų | 97.5 | 41% | 0.412 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.7 | -43.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | N84 F86 Y92 | N84-G88 PolarHBondContact O-N 3.31Å; F86-G88 PolarHBondContact O-N 3.48Å; G88-Y92 VanDerWaalsContact O-CB 3.3Å; G88-Y92 WeakPolarHBondContact O-CB 3.33Å; G88-Y92 PolarHBondContact O-N 3.36Å |
| 89 | S | 92 | Very high | 90.2 | Very high | 56 Ų | 56 | 95.6 Ų | 95.6 | 39% | 0.392 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -67.7 | -43.8 | 179.6 | -59.3 | 0 | 0 | 0 | 0 | 112.3 | H85 F86 F87 Y92 L93 | H85-S89 WeakPolarHBondContact O-CB 2.96Å; H85-S89 PolarHBondContact O-N 2.92Å; H85-S89 PolarHBondContact O-OG 3.03Å; F86-S89 PolarHBondContact O-N 2.91Å; F87-S89 PolarHBondContact O-N 3.47Å; S89-Y92 PolarHBondContact O-N 3.44Å; S89-L93 PolarHBondContact O-N 3.47Å |
| 90 | V | 91.2 | Very high | 89.5 | Confident | 51 Ų | 51 | 97.3 Ų | 97.3 | 31% | 0.309 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.5 | -47.1 | 176.5 | 171.7 | 0 | 0 | 0 | 0 | 110.2 | F86 F87 Y92 L93 F94 | F86-V90 HydrophobicContact CD1-CG2 4.29Å; F86-V90 HydrophobicContact CD2-CG2 4.43Å; F86-V90 HydrophobicContact CE1-CG2 3.92Å; F86-V90 HydrophobicContact CE2-CG2 4.07Å; F86-V90 HydrophobicContact CZ-CG2 3.81Å; F86-V90 WeakPolarHBondContact O-CB 2.84Å; F86-V90 WeakPolarHBondContact O-CG2 3.27Å; F86-V90 PolarHBondContact O-N 2.88Å; F87-V90 PolarHBondContact O-N 3.38Å; V90-Y92 VanDerWaalsContact C-N 3.33Å; V90-Y92 PolarHBondContact O-N 3.37Å; V90-L93 PolarHBondContact O-N 2.79Å; V90-F94 HydrophobicContact CG1-CD2 3.59Å; V90-F94 HydrophobicContact CG1-CE2 3.56Å; V90-F94 VanDerWaalsContact O-CD2 3.27Å; V90-F94 WeakPolarHBondContact O-CD2 3.05Å; V90-F94 PolarHBondContact O-N 3.33Å |
| 91 | H | 90.8 | Very high | 88.9 | Confident | 130 Ų | 130 | 98.5 Ų | 98.5 | 60% | 0.602 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59 | -43 | 176.2 | -176.7 | -100.1 | 0 | 0 | 0 | 111.9 | F87 L93 F94 H95 | F87-H91 WeakPolarHBondContact O-CB 3.08Å; F87-H91 PolarHBondContact O-N 2.87Å; H91-L93 PolarHBondContact O-N 2.88Å; H91-F94 PolarHBondContact O-N 2.9Å; H91-H95 WeakPolarHBondContact O-CB 3.47Å; H91-H95 PolarHBondContact O-N 2.89Å |
| 92 | Y | 90.5 | Very high | 88 | Confident | 151 Ų | 151 | 98 Ų | 98 | 59% | 0.592 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -60 | -45.4 | 175.1 | 179.4 | -99 | 0 | 0 | 0 | 112 | G88 S89 V90 H95 M96 | G88-Y92 VanDerWaalsContact O-CB 3.3Å; G88-Y92 WeakPolarHBondContact O-CB 3.33Å; G88-Y92 PolarHBondContact O-N 3.36Å; S89-Y92 PolarHBondContact O-N 3.44Å; V90-Y92 VanDerWaalsContact C-N 3.33Å; V90-Y92 PolarHBondContact O-N 3.37Å; Y92-H95 PolarHBondContact O-N 2.64Å; Y92-M96 HydrophobicContact CD1-CG 4.24Å; Y92-M96 HydrophobicContact CE1-CG 3.81Å; Y92-M96 HydrophobicContact CE2-CE 4Å; Y92-M96 HydrophobicContact CE2-CG 4.24Å; Y92-M96 HydrophobicContact CE2-SD 4.39Å; Y92-M96 WeakPolarHBondContact O-CG 3.2Å; Y92-M96 PolarHBondContact O-N 2.99Å |
| 93 | L | 90.2 | Very high | 86.8 | Confident | 121 Ų | 121 | 95.2 Ų | 95.2 | 63% | 0.634 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -63.8 | -42.4 | 177.8 | -175.2 | 61.9 | 0 | 0 | 0 | 111.9 | S89 V90 H91 M96 A97 | S89-L93 PolarHBondContact O-N 3.47Å; V90-L93 PolarHBondContact O-N 2.79Å; H91-L93 PolarHBondContact O-N 2.88Å; L93-M96 PolarHBondContact O-N 3.27Å; L93-A97 WeakPolarHBondContact O-CB 3.24Å; L93-A97 PolarHBondContact O-N 3.25Å |
| 94 | F | 90.3 | Very high | 85.5 | Confident | 133 Ų | 133 | 94.2 Ų | 94.2 | 58% | 0.583 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -60.7 | -45 | 173.7 | -89.7 | -74.3 | 0 | 0 | 0 | 111.6 | V90 H91 M96 A97 I98 | V90-F94 HydrophobicContact CG1-CD2 3.59Å; V90-F94 HydrophobicContact CG1-CE2 3.56Å; V90-F94 VanDerWaalsContact O-CD2 3.27Å; V90-F94 WeakPolarHBondContact O-CD2 3.05Å; V90-F94 PolarHBondContact O-N 3.33Å; H91-F94 PolarHBondContact O-N 2.9Å; F94-M96 PolarHBondContact O-N 3.38Å; F94-A97 PolarHBondContact O-N 2.89Å; F94-I98 WeakPolarHBondContact O-CB 3.46Å; F94-I98 VanDerWaalsContact O-CG1 3.23Å; F94-I98 WeakPolarHBondContact O-CG1 3.1Å; F94-I98 PolarHBondContact O-N 3.19Å |
| 95 | H | 87.4 | Confident | 83.8 | Confident | 99 Ų | 99 | 97.9 Ų | 97.9 | 46% | 0.458 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.9 | -45.1 | 178 | -164.3 | -95.7 | 0 | 0 | 0 | 111.2 | H91 Y92 A97 I98 I99 | H91-H95 WeakPolarHBondContact O-CB 3.47Å; H91-H95 PolarHBondContact O-N 2.89Å; Y92-H95 PolarHBondContact O-N 2.64Å; H95-A97 PolarHBondContact O-N 3.49Å; H95-I98 PolarHBondContact O-N 3.19Å; H95-I99 VanDerWaalsContact CE1-CD1 3.42Å; H95-I99 WeakPolarHBondContact CE1-CD1 2.76Å; H95-I99 VanDerWaalsContact ND1-CD1 3.28Å; H95-I99 WeakPolarHBondContact ND1-CD1 3.31Å; H95-I99 WeakPolarHBondContact O-CB 3.49Å; H95-I99 VanDerWaalsContact O-CG1 3.25Å; H95-I99 WeakPolarHBondContact O-CG1 3.39Å; H95-I99 PolarHBondContact O-N 3.37Å |
| 96 | M | 84.7 | Confident | 81.8 | Confident | 65 Ų | 65 | 96.2 Ų | 96.2 | 32% | 0.32 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63 | -41.7 | 175.3 | -68.9 | -56.4 | 104.9 | 0 | 0 | 112.2 | Y92 L93 F94 I99 Q100 | Y92-M96 HydrophobicContact CD1-CG 4.24Å; Y92-M96 HydrophobicContact CE1-CG 3.81Å; Y92-M96 HydrophobicContact CE2-CE 4Å; Y92-M96 HydrophobicContact CE2-CG 4.24Å; Y92-M96 HydrophobicContact CE2-SD 4.39Å; Y92-M96 WeakPolarHBondContact O-CG 3.2Å; Y92-M96 PolarHBondContact O-N 2.99Å; L93-M96 PolarHBondContact O-N 3.27Å; F94-M96 PolarHBondContact O-N 3.38Å; M96-I99 HydrophobicContact CE-CD1 3.74Å; M96-I99 PolarHBondContact O-N 2.97Å; M96-Q100 WeakPolarHBondContact O-CB 3.38Å; M96-Q100 VanDerWaalsContact O-CG 3.24Å; M96-Q100 WeakPolarHBondContact O-CG 3.35Å; M96-Q100 PolarHBondContact O-N 2.97Å |
| 97 | A | 86.9 | Confident | 79.8 | Confident | 43 Ų | 43 | 98 Ų | 98 | 36% | 0.355 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.1 | -44 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | L93 F94 H95 Q100 I101 | L93-A97 WeakPolarHBondContact O-CB 3.24Å; L93-A97 PolarHBondContact O-N 3.25Å; F94-A97 PolarHBondContact O-N 2.89Å; H95-A97 PolarHBondContact O-N 3.49Å; A97-Q100 PolarHBondContact O-N 3.43Å; A97-I101 WeakPolarHBondContact O-CD1 3.29Å; A97-I101 VanDerWaalsContact O-CG1 3.26Å; A97-I101 WeakPolarHBondContact O-CG1 3.35Å; A97-I101 PolarHBondContact O-N 3.46Å |
| 98 | I | 84.2 | Confident | 77.7 | Confident | 98 Ų | 98 | 97 Ų | 97 | 50% | 0.503 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.4 | -44.3 | 176.7 | -68.5 | 165.3 | 0 | 0 | 0 | 110.3 | F94 H95 Q100 I101 T102 | F94-I98 WeakPolarHBondContact O-CB 3.46Å; F94-I98 VanDerWaalsContact O-CG1 3.23Å; F94-I98 WeakPolarHBondContact O-CG1 3.1Å; F94-I98 PolarHBondContact O-N 3.19Å; H95-I98 PolarHBondContact O-N 3.19Å; I98-Q100 VanDerWaalsContact C-N 3.35Å; I98-Q100 PolarHBondContact O-N 3.21Å; I98-I101 PolarHBondContact O-N 2.87Å; I98-T102 WeakPolarHBondContact O-CB 3.41Å; I98-T102 PolarHBondContact O-N 2.71Å; I98-T102 PolarHBondContact O-OG1 3.45Å |
| 99 | I | 83.4 | Confident | 75.9 | Confident | 80 Ų | 80 | 98.7 Ų | 98.7 | 41% | 0.41 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.4 | -45.8 | 175.3 | -72 | 166.7 | 0 | 0 | 0 | 110.9 | H95 M96 T102 S103 | H95-I99 VanDerWaalsContact CE1-CD1 3.42Å; H95-I99 WeakPolarHBondContact CE1-CD1 2.76Å; H95-I99 VanDerWaalsContact ND1-CD1 3.28Å; H95-I99 WeakPolarHBondContact ND1-CD1 3.31Å; H95-I99 WeakPolarHBondContact O-CB 3.49Å; H95-I99 VanDerWaalsContact O-CG1 3.25Å; H95-I99 WeakPolarHBondContact O-CG1 3.39Å; H95-I99 PolarHBondContact O-N 3.37Å; M96-I99 HydrophobicContact CE-CD1 3.74Å; M96-I99 PolarHBondContact O-N 2.97Å; I99-T102 PolarHBondContact O-N 3.18Å; I99-S103 VanDerWaalsContact O-CB 3.28Å; I99-S103 WeakPolarHBondContact O-CB 3.4Å; I99-S103 PolarHBondContact O-N 2.86Å |
| 100 | Q | 79.9 | Confident | 73.6 | Confident | 128 Ų | 128 | 102.8 Ų | 102.8 | 60% | 0.598 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.4 | -48.5 | 178.5 | -74.4 | -74.4 | -15 | 0 | 0 | 111.7 | M96 A97 I98 T102 S103 V104 | M96-Q100 WeakPolarHBondContact O-CB 3.38Å; M96-Q100 VanDerWaalsContact O-CG 3.24Å; M96-Q100 WeakPolarHBondContact O-CG 3.35Å; M96-Q100 PolarHBondContact O-N 2.97Å; A97-Q100 PolarHBondContact O-N 3.43Å; I98-Q100 VanDerWaalsContact C-N 3.35Å; I98-Q100 PolarHBondContact O-N 3.21Å; Q100-T102 VanDerWaalsContact C-N 3.3Å; Q100-T102 PolarHBondContact O-N 2.87Å; Q100-S103 PolarHBondContact O-N 2.89Å; Q100-V104 VanDerWaalsContact O-CG2 3.3Å; Q100-V104 WeakPolarHBondContact O-CG2 3.46Å; Q100-V104 PolarHBondContact O-N 3.03Å |
| 101 | I | 81 | Confident | 71.6 | Confident | 107 Ų | 107 | 105 Ų | 105 | 55% | 0.549 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.9 | -42 | 177.9 | -66.6 | 163.2 | 0 | 0 | 0 | 110.9 | A97 I98 R105 | A97-I101 WeakPolarHBondContact O-CD1 3.29Å; A97-I101 VanDerWaalsContact O-CG1 3.26Å; A97-I101 WeakPolarHBondContact O-CG1 3.35Å; A97-I101 PolarHBondContact O-N 3.46Å; I98-I101 PolarHBondContact O-N 2.87Å; I101-R105 WeakPolarHBondContact O-CB 3.3Å; I101-R105 PolarHBondContact O-N 3.4Å |
| 102 | T | 73.3 | Confident | 69.4 | Low | 54 Ų | 54 | 105.2 Ų | 105.2 | 33% | 0.331 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.9 | -46.3 | 178.2 | -63.6 | 0 | 0 | 0 | 0 | 110.8 | I98 I99 Q100 R105 F106 F117 | I98-T102 WeakPolarHBondContact O-CB 3.41Å; I98-T102 PolarHBondContact O-N 2.71Å; I98-T102 PolarHBondContact O-OG1 3.45Å; I99-T102 PolarHBondContact O-N 3.18Å; Q100-T102 VanDerWaalsContact C-N 3.3Å; Q100-T102 PolarHBondContact O-N 2.87Å; T102-R105 PolarHBondContact O-N 2.82Å; T102-F106 WeakPolarHBondContact O-CB 3.45Å; T102-F106 PolarHBondContact O-N 3.25Å; T102-F117 HydrophobicContact CG2-CE1 3.5Å; T102-F117 HydrophobicContact CG2-CZ 3.39Å |
| 103 | S | 68.5 | Low | 67.4 | Low | 62 Ų | 62 | 103 Ų | 103 | 43% | 0.434 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63 | -44.9 | 178.1 | -176.1 | 0 | 0 | 0 | 0 | 112.2 | I99 Q100 R105 F106 Q107 | I99-S103 VanDerWaalsContact O-CB 3.28Å; I99-S103 WeakPolarHBondContact O-CB 3.4Å; I99-S103 PolarHBondContact O-N 2.86Å; Q100-S103 PolarHBondContact O-N 2.89Å; S103-R105 PolarHBondContact O-N 3.39Å; S103-F106 PolarHBondContact O-N 2.88Å; S103-F106 VanDerWaalsContact O-N 3.17Å; S103-Q107 PolarHBondContact O-N 3.39Å |
| 104 | V | 65.8 | Low | 65.4 | Low | 95 Ų | 95 | 103.6 Ų | 103.6 | 58% | 0.576 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -63.7 | -41.8 | 176.8 | 173.7 | 0 | 0 | 0 | 0 | 111.3 | Q100 F106 Q107 S108 | Q100-V104 VanDerWaalsContact O-CG2 3.3Å; Q100-V104 WeakPolarHBondContact O-CG2 3.46Å; Q100-V104 PolarHBondContact O-N 3.03Å; V104-F106 VanDerWaalsContact C-N 3.33Å; V104-Q107 PolarHBondContact O-N 3.41Å; V104-S108 PolarHBondContact O-N 3.31Å |
| 105 | R | 56 | Low | 63.6 | Low | 176 Ų | 176 | 101 Ų | 101 | 66% | 0.664 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -66.9 | -32.2 | 173.7 | -83.1 | -149.8 | -178.1 | 154.2 | 0.6 | 113.1 | I101 T102 S103 S108 T109 | I101-R105 WeakPolarHBondContact O-CB 3.3Å; I101-R105 PolarHBondContact O-N 3.4Å; T102-R105 PolarHBondContact O-N 2.82Å; S103-R105 PolarHBondContact O-N 3.39Å; R105-S108 PolarHBondContact O-N 3.01Å; R105-S108 PolarHBondContact O-OG 2.72Å; R105-S108 VanDerWaalsContact O-OG 3.09Å; R105-T109 PolarHBondContact O-N 2.83Å; R105-T109 VanDerWaalsContact O-N 3.17Å; R105-T109 PolarHBondContact O-OG1 3.38Å |
| 106 | F | 50.4 | Low | 61.9 | Low | 94 Ų | 94 | 104.8 Ų | 104.8 | 41% | 0.412 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -70.1 | -40 | 177.9 | -163.4 | -96.9 | 0 | 0 | 0 | 111.4 | T102 S103 V104 S108 T109 H110 F117 | T102-F106 WeakPolarHBondContact O-CB 3.45Å; T102-F106 PolarHBondContact O-N 3.25Å; S103-F106 PolarHBondContact O-N 2.88Å; S103-F106 VanDerWaalsContact O-N 3.17Å; V104-F106 VanDerWaalsContact C-N 3.33Å; F106-S108 VanDerWaalsContact C-N 3.33Å; F106-S108 PolarHBondContact O-N 3.04Å; F106-T109 PolarHBondContact O-N 3.5Å; F106-T109 PolarHBondContact O-OG1 3.08Å; F106-H110 AromaticContact CE1-CD2 3.55Å; F106-H110 AromaticContact CZ-CD2 3.77Å; F106-H110 WeakPolarHBondContact O-CB 3.34Å; F106-H110 PolarHBondContact O-N 3.32Å; F106-F117 HydrophobicContact CD2-CD1 4.36Å; F106-F117 HydrophobicContact CD2-CD2 4.07Å; F106-F117 HydrophobicContact CD2-CE2 4.28Å; F106-F117 HydrophobicContact CD2-CG 4.13Å; F106-F117 HydrophobicContact CE2-CB 4.46Å; F106-F117 HydrophobicContact CE2-CG 4.26Å |
| 107 | Q | 48.6 | Very low | 60.3 | Low | 165 Ų | 165 | 106.5 Ų | 106.5 | 77% | 0.771 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -63.3 | -35.9 | 173.5 | -95.2 | -174.6 | 21.8 | 0 | 0 | 113.3 | S103 V104 | S103-Q107 PolarHBondContact O-N 3.39Å; V104-Q107 PolarHBondContact O-N 3.41Å |
| 108 | S | 48.2 | Very low | 58.9 | Low | 89 Ų | 89 | 112 Ų | 112 | 62% | 0.622 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -76.9 | -21.1 | 178 | 70.6 | 0 | 0 | 0 | 0 | 113.8 | V104 R105 F106 | V104-S108 PolarHBondContact O-N 3.31Å; R105-S108 PolarHBondContact O-N 3.01Å; R105-S108 PolarHBondContact O-OG 2.72Å; R105-S108 VanDerWaalsContact O-OG 3.09Å; F106-S108 VanDerWaalsContact C-N 3.33Å; F106-S108 PolarHBondContact O-N 3.04Å |
| 109 | T | 49.7 | Very low | 57.3 | Low | 75 Ų | 75 | 116.1 Ų | 116.1 | 46% | 0.46 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -100.1 | -13.5 | -179.3 | 48.5 | 0 | 0 | 0 | 0 | 114.2 | R105 F106 S111 N112 | R105-T109 PolarHBondContact O-N 2.83Å; R105-T109 VanDerWaalsContact O-N 3.17Å; R105-T109 PolarHBondContact O-OG1 3.38Å; F106-T109 PolarHBondContact O-N 3.5Å; F106-T109 PolarHBondContact O-OG1 3.08Å; T109-S111 PolarHBondContact O-N 3.29Å; T109-N112 CarbonylContact O-C 3.52Å; T109-N112 PolarHBondContact O-N 3.01Å |
| 110 | H | 45.7 | Very low | 55.9 | Low | 143 Ų | 143 | 119.6 Ų | 119.6 | 66% | 0.662 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | 7.4 | 177.2 | -150.6 | -83.3 | 0 | 0 | 0 | 114.8 | F106 | F106-H110 AromaticContact CE1-CD2 3.55Å; F106-H110 AromaticContact CZ-CD2 3.77Å; F106-H110 WeakPolarHBondContact O-CB 3.34Å; F106-H110 PolarHBondContact O-N 3.32Å |
| 111 | S | 48.1 | Very low | 54.7 | Low | 98 Ų | 98 | 119.2 Ų | 119.2 | 69% | 0.685 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.1 | -17.3 | 162.3 | -176.1 | 0 | 0 | 0 | 0 | 112.9 | T109 | T109-S111 PolarHBondContact O-N 3.29Š|
| 112 | N | 45.3 | Very low | 53.5 | Low | 133 Ų | 133 | 122.9 Ų | 122.9 | 71% | 0.711 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -151.3 | 110.9 | -178.6 | -69.5 | -58.1 | 0 | 0 | 0 | 111.9 | T109 | T109-N112 CarbonylContact O-C 3.52Å; T109-N112 PolarHBondContact O-N 3.01Å |
| 113 | S | 47.3 | Very low | 52.7 | Low | 104 Ų | 104 | 127.5 Ų | 127.5 | 73% | 0.727 | 69% | 0.685 | S | S | * | * | trans | 81.4 | 83.1 | 155.4 | -151.8 | 0 | 0 | 0 | 0 | 119.1 | A115 | S113-A115 PolarHBondContact O-N 3.49Š| ||
| 114 | S | 48 | Very low | 51.6 | Low | 134 Ų | 134 | 135.7 Ų | 135.7 | 94% | 0.937 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -25.8 | 10 | 158.2 | -168.9 | 0 | 0 | 0 | 0 | 122.7 | ||
| 115 | A | 52.9 | Low | 50.9 | Low | 80 Ų | 80 | 137.7 Ų | 137.7 | 66% | 0.661 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.9 | -10.4 | -162.9 | 0 | 0 | 0 | 0 | 0 | 119 | S113 | S113-A115 PolarHBondContact O-N 3.49Š|
| 116 | H | 52 | Low | 50.6 | Low | 177 Ų | 177 | 135.7 Ų | 135.7 | 82% | 0.819 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -100.7 | -2.7 | -167.6 | -90.6 | -87.2 | 0 | 0 | 0 | 117 | ||
| 117 | F | 51.5 | Low | 50.7 | Low | 102 Ų | 102 | 138 Ų | 138 | 45% | 0.447 | 75% | 0.752 | S | S | . | * | S | Bend | trans | -91.7 | -10.6 | -161.5 | -141.6 | -95.5 | 0 | 0 | 0 | 116.5 | T102 F106 | T102-F117 HydrophobicContact CG2-CE1 3.5Å; T102-F117 HydrophobicContact CG2-CZ 3.39Å; F106-F117 HydrophobicContact CD2-CD1 4.36Å; F106-F117 HydrophobicContact CD2-CD2 4.07Å; F106-F117 HydrophobicContact CD2-CE2 4.28Å; F106-F117 HydrophobicContact CD2-CG 4.13Å; F106-F117 HydrophobicContact CE2-CB 4.46Å; F106-F117 HydrophobicContact CE2-CG 4.26Å |
| 118 | I | 57.9 | Low | 50.8 | Low | 158 Ų | 158 | 136.4 Ų | 136.4 | 81% | 0.81 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -86.2 | -14.8 | -172.7 | -63.7 | 174.1 | 0 | 0 | 0 | 113 | ||
| 119 | F | 49.6 | Very low | 50.9 | Low | 184 Ų | 184 | 139.4 Ų | 139.4 | 81% | 0.807 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -86.2 | -13.6 | -168 | -149.2 | -96.7 | 0 | 0 | 0 | 115.6 | ||
| 120 | L | 55 | Low | 51 | Low | 153 Ų | 153 | 143.7 Ų | 143.7 | 80% | 0.801 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -92.7 | -13.1 | -172.3 | -126.2 | 79.8 | 0 | 0 | 0 | 115 | ||
| 121 | T | 53 | Low | 51.4 | Low | 120 Ų | 120 | 143.7 Ų | 143.7 | 74% | 0.736 | 79% | 0.787 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | -2.7 | -175.4 | -31.5 | 0 | 0 | 0 | 0 | 113.5 | ||
| 122 | Q | 56.8 | Low | 51.7 | Low | 184 Ų | 184 | 147.2 Ų | 147.2 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.7 | 3.4 | 178.1 | -69.5 | -161.6 | 12.5 | 0 | 0 | 114.8 | ||
| 123 | L | 55.6 | Low | 52.2 | Low | 151 Ų | 151 | 148.4 Ų | 148.4 | 79% | 0.791 | 80% | 0.802 | S | S | * | * | trans | -114 | 8.7 | -173 | -156.7 | 70.8 | 0 | 0 | 0 | 115.3 | ||||
| 124 | L | 46.6 | Very low | 52.6 | Low | 234 Ų | 234 | 152.5 Ų | 152.5 | 100% | 1.225 | 81% | 0.809 | S | S | * | * | trans | -125.8 | 0 | 172.3 | -121.6 | 93.7 | 0 | 0 | 0 | 110.1 |
Retrieved 124 of 124 residues in 124.1 ms
(Link to these results)