| 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 | 48.6 | Very low | 50.6 | Low | 250 Ų | 250 | 159 Ų | 159 | 100% | 1.232 | 86% | 0.861 | S | S | * | * | 0 | 104.5 | 0 | -169.8 | 161.4 | 115.2 | 0 | 0 | 107.6 | |||||
| 2 | L | 48.9 | Very low | 50.7 | Low | 166 Ų | 166 | 160.4 Ų | 160.4 | 87% | 0.869 | 86% | 0.858 | S | S | * | * | trans | -147.4 | 120.1 | 178.1 | -118.8 | 153.5 | 0 | 0 | 0 | 108.2 | ||||
| 3 | M | 51.3 | Low | 51 | Low | 176 Ų | 176 | 160.2 Ų | 160.2 | 87% | 0.867 | 84% | 0.838 | S | S | * | * | trans | 16.1 | 123.7 | 158.8 | -78.9 | 174.4 | 148 | 0 | 0 | 121.8 | ||||
| 4 | I | 52.8 | Low | 51.5 | Low | 171 Ų | 171 | 155.5 Ų | 155.5 | 88% | 0.877 | 83% | 0.825 | S | S | * | * | trans | -144.4 | 107.4 | 133.1 | -54.4 | -178.5 | 0 | 0 | 0 | 108.6 | ||||
| 5 | C | 51 | Low | 51.8 | Low | 123 Ų | 123 | 155.6 Ų | 155.6 | 83% | 0.831 | 83% | 0.825 | S | S | * | * | trans | -154 | 99.2 | 166.9 | -90.2 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 6 | H | 50 | Low | 51.9 | Low | 191 Ų | 191 | 154.7 Ų | 154.7 | 88% | 0.884 | 81% | 0.814 | S | S | * | * | trans | -159.5 | 109.1 | 167.8 | -102.2 | -85.3 | 0 | 0 | 0 | 108.5 | ||||
| 7 | S | 50.5 | Low | 52.5 | Low | 120 Ų | 120 | 153.4 Ų | 153.4 | 84% | 0.839 | 81% | 0.808 | S | S | * | * | trans | 154.7 | 87 | 149 | -78.4 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 8 | V | 51.4 | Low | 53 | Low | 144 Ų | 144 | 152.8 Ų | 152.8 | 87% | 0.873 | 80% | 0.804 | S | S | * | * | trans | -160.9 | 86 | 150.1 | -174.8 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 9 | E | 50.2 | Low | 53.1 | Low | 137 Ų | 137 | 153.2 Ų | 153.2 | 64% | 0.64 | 80% | 0.803 | S | S | * | * | trans | -154 | -0.3 | 176.6 | -104.6 | -156.2 | 95.6 | 0 | 0 | 119.6 | R13 | E9-R13 PolarHBondContact O-NH1 3.41Å; E9-R13 VanDerWaalsContact O-NH1 3.09Å; E9-R13 IonicContact OE1-CZ 2.83Å; E9-R13 IonicContact OE1-NH1 3.67Å; E9-R13 IonicContact OE1-NH2 3Å; E9-R13 PolarHBondContact OE1-NH2 3.09Å | ||
| 10 | P | 51.5 | Low | 53.4 | Low | 113 Ų | 113 | 149.6 Ų | 149.6 | 73% | 0.734 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -91.1 | -9.4 | -173.4 | 30.3 | -31.3 | 0 | 0 | 0 | 118 | ||
| 11 | L | 50.7 | Low | 53.7 | Low | 158 Ų | 158 | 146.2 Ų | 146.2 | 83% | 0.827 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -103.4 | -24.3 | -159.5 | -152.2 | 67.5 | 0 | 0 | 0 | 118.6 | ||
| 12 | E | 51.1 | Low | 54.1 | Low | 176 Ų | 176 | 141 Ų | 141 | 82% | 0.822 | 75% | 0.747 | S | S | * | * | G | 310 helix | trans | -88.3 | -4.2 | 177.5 | -89.2 | -78.7 | 104.4 | 0 | 0 | 113.5 | S14 | E12-S14 PolarHBondContact O-N 3.24Š|
| 13 | R | 55 | Low | 54.5 | Low | 157 Ų | 157 | 144.1 Ų | 144.1 | 59% | 0.592 | 75% | 0.747 | S | S | * | * | G | 310 helix | trans | -67.7 | -15.6 | -179.3 | -83.2 | -178.6 | 172.9 | 125.1 | 5.6 | 114.6 | E9 | E9-R13 PolarHBondContact O-NH1 3.41Å; E9-R13 VanDerWaalsContact O-NH1 3.09Å; E9-R13 IonicContact OE1-CZ 2.83Å; E9-R13 IonicContact OE1-NH1 3.67Å; E9-R13 IonicContact OE1-NH2 3Å; E9-R13 PolarHBondContact OE1-NH2 3.09Å |
| 14 | S | 57.5 | Low | 54.7 | Low | 95 Ų | 95 | 143.3 Ų | 143.3 | 66% | 0.664 | 74% | 0.741 | S | S | * | * | G | 310 helix | trans | -91.5 | -19.8 | -166.2 | -168.2 | 0 | 0 | 0 | 0 | 115.9 | E12 | E12-S14 PolarHBondContact O-N 3.24Š|
| 15 | L | 56.8 | Low | 54.8 | Low | 157 Ų | 157 | 140.4 Ų | 140.4 | 82% | 0.822 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -101.4 | -13.3 | -169.1 | -149.3 | 101.3 | 0 | 0 | 0 | 114.5 | ||
| 16 | H | 52.5 | Low | 54.9 | Low | 141 Ų | 141 | 142 Ų | 142 | 65% | 0.653 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -81.6 | -16.5 | 174.9 | -159.7 | -73.1 | 0 | 0 | 0 | 112.5 | I18 D20 | H16-I18 PolarHBondContact O-N 3.45Å; H16-D20 IonicContact CE1-OD2 3.9Å; H16-D20 PolarHBondContact CE1-OD2 2.83Å; H16-D20 IonicContact CG-OD2 3.67Å; H16-D20 IonicContact ND1-OD2 3.51Å; H16-D20 PolarHBondContact ND1-OD2 3.19Å; H16-D20 IonicContact NE2-OD2 2.72Å |
| 17 | D | 62.5 | Low | 55.2 | Low | 133 Ų | 133 | 142.3 Ų | 142.3 | 71% | 0.711 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | -17.3 | -164.4 | -117.2 | -21.7 | 0 | 0 | 0 | 114.8 | ||
| 18 | I | 61.1 | Low | 55.4 | Low | 143 Ų | 143 | 144.9 Ų | 144.9 | 73% | 0.733 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.7 | -31.1 | -166.5 | -59.8 | 176.9 | 0 | 0 | 0 | 113.6 | H16 | H16-I18 PolarHBondContact O-N 3.45Š|
| 19 | M | 55.4 | Low | 55.8 | Low | 160 Ų | 160 | 143.7 Ų | 143.7 | 79% | 0.788 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.7 | -16 | -162.9 | -159.2 | 165 | 64.5 | 0 | 0 | 115.5 | P21 | M19-P21 VanDerWaalsContact C-CD 3.49Š|
| 20 | D | 59.9 | Low | 56.1 | Low | 80 Ų | 80 | 147.4 Ų | 147.4 | 43% | 0.428 | 72% | 0.721 | S | S | . | * | S | Bend | trans | -75.6 | -30.5 | -179.1 | -71.7 | -43.7 | 0 | 0 | 0 | 117.6 | H16 I22 R23 | H16-D20 IonicContact CE1-OD2 3.9Å; H16-D20 PolarHBondContact CE1-OD2 2.83Å; H16-D20 IonicContact CG-OD2 3.67Å; H16-D20 IonicContact ND1-OD2 3.51Å; H16-D20 PolarHBondContact ND1-OD2 3.19Å; H16-D20 IonicContact NE2-OD2 2.72Å; D20-I22 VanDerWaalsContact C-N 3.27Å; D20-I22 PolarHBondContact O-N 3Å; D20-R23 PolarHBondContact O-N 2.72Å |
| 21 | P | 58.7 | Low | 56.5 | Low | 80 Ų | 80 | 150.9 Ų | 150.9 | 52% | 0.519 | 73% | 0.727 | S | S | . | * | G | 310 helix | trans | -70.5 | -22.2 | -169 | 23.5 | -30.3 | 0 | 0 | 0 | 113.9 | M19 | M19-P21 VanDerWaalsContact C-CD 3.49Š|
| 22 | I | 57.3 | Low | 56.9 | Low | 140 Ų | 140 | 152.1 Ų | 152.1 | 72% | 0.718 | 73% | 0.729 | S | S | * | * | G | 310 helix | trans | -74.5 | -29.3 | -174.6 | -56.6 | 173.1 | 0 | 0 | 0 | 111.6 | D20 | D20-I22 VanDerWaalsContact C-N 3.27Å; D20-I22 PolarHBondContact O-N 3Å |
| 23 | R | 56.6 | Low | 57.3 | Low | 231 Ų | 231 | 151.2 Ų | 151.2 | 87% | 0.872 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -81.9 | -14.2 | -174 | -117.9 | 177.3 | 172.8 | 168.4 | -1.8 | 114.4 | D20 | D20-R23 PolarHBondContact O-N 2.72Š|
| 24 | H | 56.3 | Low | 57.6 | Low | 159 Ų | 159 | 149.7 Ų | 149.7 | 74% | 0.736 | 73% | 0.728 | S | S | * | * | G | 310 helix | trans | -92.8 | -8.8 | -173.3 | -94.6 | -73.8 | 0 | 0 | 0 | 115.1 | D26 | H24-D26 VanDerWaalsContact C-N 3.28Å; H24-D26 PolarHBondContact O-N 3.36Å |
| 25 | L | 53.9 | Low | 58 | Low | 111 Ų | 111 | 148.9 Ų | 148.9 | 58% | 0.581 | 72% | 0.72 | S | S | * | * | G | 310 helix | trans | -73.1 | -14.3 | -179.1 | -93.9 | 100.4 | 0 | 0 | 0 | 114.8 | K27 | L25-K27 VanDerWaalsContact C-N 3.33Å; L25-K27 PolarHBondContact O-N 3.35Å |
| 26 | D | 54.3 | Low | 58.4 | Low | 156 Ų | 156 | 147.7 Ų | 147.7 | 83% | 0.834 | 72% | 0.719 | S | S | * | * | G | 310 helix | trans | -89.5 | 12 | -169.4 | -146.4 | 17.4 | 0 | 0 | 0 | 114.6 | H24 | H24-D26 VanDerWaalsContact C-N 3.28Å; H24-D26 PolarHBondContact O-N 3.36Å |
| 27 | K | 56 | Low | 58.9 | Low | 198 Ų | 198 | 148.8 Ų | 148.8 | 86% | 0.861 | 72% | 0.717 | S | S | * | * | G | 310 helix | trans | -126.8 | 39.3 | 179.3 | -72.1 | -174.5 | 179.3 | 179.7 | 0 | 113.5 | L25 | L25-K27 VanDerWaalsContact C-N 3.33Å; L25-K27 PolarHBondContact O-N 3.35Å |
| 28 | R | 55 | Low | 59.1 | Low | 173 Ų | 173 | 144.8 Ų | 144.8 | 65% | 0.653 | 70% | 0.7 | S | S | * | * | trans | -86 | 112.5 | 173.4 | -82.3 | -152 | -81.7 | -165.1 | -0.2 | 112.3 | ||||
| 29 | D | 60.4 | Low | 59.4 | Low | 119 Ų | 119 | 145.3 Ų | 145.3 | 64% | 0.636 | 70% | 0.699 | S | S | * | * | 92.3 | 67.9 | 122.9 | -52.4 | -21.6 | 0 | 0 | 0 | 122.5 | |||||
| 30 | F | 56.4 | Low | 60 | Low | 216 Ų | 216 | 147 Ų | 147 | 95% | 0.947 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -138.5 | 4 | 154 | -68.3 | -66.6 | 0 | 0 | 0 | 116.9 | ||
| 31 | Q | 58.4 | Low | 60.2 | Low | 186 Ų | 186 | 148.3 Ų | 148.3 | 87% | 0.869 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -102.9 | 78.1 | 159.7 | -152.3 | 169.8 | 46.7 | 0 | 0 | 105.5 | H33 | Q31-H33 VanDerWaalsContact C-N 3.29Å; Q31-H33 PolarHBondContact O-N 2.81Å |
| 32 | E | 59.2 | Low | 60.5 | Low | 184 Ų | 184 | 149.9 Ų | 149.9 | 86% | 0.86 | 70% | 0.702 | S | S | * | * | trans | -42.4 | 109.1 | 161.8 | -173.1 | 146.4 | -159.2 | 0 | 0 | 105.5 | N34 | E32-N34 PolarHBondContact O-N 2.7Š| ||
| 33 | H | 59.7 | Low | 60.9 | Low | 156 Ų | 156 | 150.5 Ų | 150.5 | 72% | 0.722 | 70% | 0.7 | S | S | * | * | trans | -65.1 | 95 | -171.2 | -167.8 | 68.9 | 0 | 0 | 0 | 103.8 | Q31 P35 | Q31-H33 VanDerWaalsContact C-N 3.29Å; Q31-H33 PolarHBondContact O-N 2.81Å; H33-P35 VanDerWaalsContact C-N 3.27Å; H33-P35 WeakPolarHBondContact O-CD 3.03Å | ||
| 34 | N | 62.2 | Low | 61.7 | Low | 126 Ų | 126 | 147.4 Ų | 147.4 | 67% | 0.674 | 70% | 0.696 | S | S | * | * | trans | -57 | 104.8 | 166.9 | 177.5 | 44.3 | 0 | 0 | 0 | 102.4 | E32 V36 | E32-N34 PolarHBondContact O-N 2.7Å; N34-V36 PolarHBondContact O-N 3.23Å | ||
| 35 | P | 66.1 | Low | 62.6 | Low | 77 Ų | 77 | 150.9 Ų | 150.9 | 50% | 0.5 | 70% | 0.702 | S | S | . | * | trans | -54.3 | 139.5 | -176.2 | 24.1 | -32.2 | 0 | 0 | 0 | 105.4 | H33 R37 | H33-P35 VanDerWaalsContact C-N 3.27Å; H33-P35 WeakPolarHBondContact O-CD 3.03Å; P35-R37 PolarHBondContact O-N 2.84Å | ||
| 36 | V | 64.9 | Low | 63.8 | Low | 133 Ų | 133 | 150.7 Ų | 150.7 | 81% | 0.806 | 70% | 0.695 | S | S | * | * | trans | -57.6 | 93.2 | 168.7 | 173.5 | 0 | 0 | 0 | 0 | 104.7 | N34 S38 | N34-V36 PolarHBondContact O-N 3.23Å; V36-S38 VanDerWaalsContact C-N 3.29Å; V36-S38 PolarHBondContact O-N 2.62Å | ||
| 37 | R | 62.7 | Low | 65.2 | Low | 163 Ų | 163 | 147.2 Ų | 147.2 | 62% | 0.615 | 68% | 0.676 | S | S | * | * | trans | -69.8 | 100.5 | -174 | -139.2 | 175.8 | -178 | 151.8 | 1.2 | 103.3 | P35 E39 | P35-R37 PolarHBondContact O-N 2.84Å; R37-E39 PolarHBondContact O-N 3.25Å | ||
| 38 | S | 67.1 | Low | 66.7 | Low | 50 Ų | 50 | 142.1 Ų | 142.1 | 35% | 0.35 | 66% | 0.663 | S | S | . | * | trans | -56.1 | 128.7 | -178.9 | 175.5 | 0 | 0 | 0 | 0 | 106.9 | V36 R40 E41 | V36-S38 VanDerWaalsContact C-N 3.29Å; V36-S38 PolarHBondContact O-N 2.62Å; S38-R40 PolarHBondContact O-N 2.86Å; S38-E41 PolarHBondContact O-N 2.99Å | ||
| 39 | E | 67 | Low | 68.3 | Low | 154 Ų | 154 | 141.9 Ų | 141.9 | 72% | 0.72 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -50 | -33.1 | 177.8 | -62.3 | -176.5 | 158.5 | 0 | 0 | 110.7 | R37 E41 M42 F43 | R37-E39 PolarHBondContact O-N 3.25Å; E39-E41 PolarHBondContact O-N 3.41Å; E39-M42 WeakPolarHBondContact O-CB 3.05Å; E39-M42 PolarHBondContact O-N 2.93Å; E39-M42 VanDerWaalsContact O-N 3.17Å; E39-F43 HydrophobicContact CB-CD2 4.44Å; E39-F43 HydrophobicContact CB-CE2 4.02Å; E39-F43 WeakPolarHBondContact O-CD2 2.95Å; E39-F43 PolarHBondContact O-N 3.15Å; E39-F43 VanDerWaalsContact O-N 3.15Å |
| 40 | R | 67.5 | Low | 69.8 | Low | 194 Ų | 194 | 139.1 Ų | 139.1 | 73% | 0.732 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -58.3 | -40.6 | 175.2 | -67.6 | -174.6 | 172.9 | -142.3 | -0.9 | 113.8 | S38 M42 F43 E44 | S38-R40 PolarHBondContact O-N 2.86Å; R40-M42 VanDerWaalsContact C-N 3.28Å; R40-M42 PolarHBondContact O-N 3.45Å; R40-F43 PolarHBondContact O-N 3.25Å; R40-E44 WeakPolarHBondContact O-CG 3.44Å; R40-E44 PolarHBondContact O-N 3.01Å |
| 41 | E | 65.2 | Low | 71.4 | Confident | 109 Ų | 109 | 130.4 Ų | 130.4 | 51% | 0.509 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -68.3 | -30 | 178.6 | -70.5 | -177.3 | 174.5 | 0 | 0 | 112.2 | S38 E39 | S38-E41 PolarHBondContact O-N 2.99Å; E39-E41 PolarHBondContact O-N 3.41Å |
| 42 | M | 64.5 | Low | 73 | Confident | 113 Ų | 113 | 125.3 Ų | 125.3 | 56% | 0.557 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -67.4 | -46.5 | 172 | -72.9 | -125.9 | -175.1 | 0 | 0 | 110.6 | E39 R40 E44 R45 Y46 | E39-M42 WeakPolarHBondContact O-CB 3.05Å; E39-M42 PolarHBondContact O-N 2.93Å; E39-M42 VanDerWaalsContact O-N 3.17Å; R40-M42 VanDerWaalsContact C-N 3.28Å; R40-M42 PolarHBondContact O-N 3.45Å; M42-E44 PolarHBondContact O-N 3.44Å; M42-R45 PolarHBondContact O-N 3.17Å; M42-Y46 WeakPolarHBondContact O-CB 3.43Å; M42-Y46 PolarHBondContact O-N 3.42Å |
| 43 | F | 66.4 | Low | 74.7 | Confident | 153 Ų | 153 | 120.3 Ų | 120.3 | 67% | 0.671 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -66.7 | -33.1 | -179.1 | -67.6 | -65.9 | 0 | 0 | 0 | 113.7 | E39 R40 | E39-F43 HydrophobicContact CB-CD2 4.44Å; E39-F43 HydrophobicContact CB-CE2 4.02Å; E39-F43 WeakPolarHBondContact O-CD2 2.95Å; E39-F43 PolarHBondContact O-N 3.15Å; E39-F43 VanDerWaalsContact O-N 3.15Å; R40-F43 PolarHBondContact O-N 3.25Å |
| 44 | E | 71.8 | Confident | 76.4 | Confident | 166 Ų | 166 | 116.7 Ų | 116.7 | 78% | 0.776 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -69.1 | -33.7 | 179.6 | -76.7 | -179.8 | -175.6 | 0 | 0 | 113.3 | R40 M42 | R40-E44 WeakPolarHBondContact O-CG 3.44Å; R40-E44 PolarHBondContact O-N 3.01Å; M42-E44 PolarHBondContact O-N 3.44Å |
| 45 | R | 76.3 | Confident | 78 | Confident | 232 Ų | 232 | 112.8 Ų | 112.8 | 88% | 0.875 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -95.7 | -18.7 | 179.3 | -67.5 | -176.2 | -172 | -156.4 | 3.1 | 113.6 | M42 D47 | M42-R45 PolarHBondContact O-N 3.17Å; R45-D47 PolarHBondContact O-N 3.42Å |
| 46 | Y | 77.9 | Confident | 79.5 | Confident | 107 Ų | 107 | 114 Ų | 114 | 42% | 0.42 | 56% | 0.557 | S | S | . | * | S | Bend | trans | -78.8 | 119.1 | -178.9 | -169.5 | -94.5 | 0 | 0 | 0 | 109.8 | M42 P48 V50 G51 | M42-Y46 WeakPolarHBondContact O-CB 3.43Å; M42-Y46 PolarHBondContact O-N 3.42Å; Y46-P48 WeakPolarHBondContact O-CD 3.34Å; Y46-V50 HydrophobicContact CE1-CB 3.96Å; Y46-V50 HydrophobicContact CE1-CG1 4.5Å; Y46-V50 HydrophobicContact CE2-CB 4.13Å; Y46-V50 HydrophobicContact CE2-CG1 3.99Å; Y46-V50 WeakPolarHBondContact OH-CB 3.48Å; Y46-V50 WeakPolarHBondContact OH-CG1 3.47Å; Y46-G51 PolarHBondContact OH-N 2.93Å |
| 47 | D | 85.6 | Confident | 81 | Confident | 83 Ų | 83 | 110.5 Ų | 110.5 | 44% | 0.444 | 54% | 0.538 | S | S | . | . | trans | -68.5 | 118.7 | 174.7 | -176.2 | -15.4 | 0 | 0 | 0 | 109 | R45 W49 V50 | R45-D47 PolarHBondContact O-N 3.42Å; D47-W49 PolarHBondContact O-N 3.49Å; D47-W49 WeakPolarHBondContact OD1-CB 3.3Å; D47-W49 PolarHBondContact OD1-N 3.03Å; D47-V50 HydrophobicContact CB-CG2 4.14Å; D47-V50 WeakPolarHBondContact O-CB 3.17Å; D47-V50 PolarHBondContact O-N 2.94Å | ||
| 48 | P | 85.8 | Confident | 82.6 | Confident | 90 Ų | 90 | 107.7 Ų | 107.7 | 58% | 0.584 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -55.1 | -25.6 | 179.2 | 21.1 | -32.6 | 0 | 0 | 0 | 113 | Y46 V50 G51 I52 | Y46-P48 WeakPolarHBondContact O-CD 3.34Å; P48-V50 VanDerWaalsContact C-N 3.26Å; P48-V50 PolarHBondContact O-N 3.03Å; P48-G51 PolarHBondContact O-N 2.93Å; P48-I52 WeakPolarHBondContact O-CG1 3.46Å; P48-I52 PolarHBondContact O-N 3.33Å |
| 49 | W | 90.3 | Very high | 84 | Confident | 168 Ų | 168 | 107.2 Ų | 107.2 | 64% | 0.636 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.9 | -29 | 174.9 | -68.7 | 110.5 | 0 | 0 | 0 | 113.4 | D47 G51 I52 T53 | D47-W49 PolarHBondContact O-N 3.49Å; D47-W49 WeakPolarHBondContact OD1-CB 3.3Å; D47-W49 PolarHBondContact OD1-N 3.03Å; W49-G51 VanDerWaalsContact C-N 3.35Å; W49-I52 HydrophobicContact CD2-CD1 4.32Å; W49-I52 HydrophobicContact CE3-CB 4.48Å; W49-I52 HydrophobicContact CE3-CD1 3.76Å; W49-I52 HydrophobicContact CE3-CG2 4.47Å; W49-I52 HydrophobicContact CZ3-CD1 4.02Å; W49-I52 PolarHBondContact O-N 2.91Å; W49-T53 VanDerWaalsContact O-CG2 3.3Å; W49-T53 WeakPolarHBondContact O-CG2 3.4Å; W49-T53 PolarHBondContact O-N 3.35Å; W49-T53 PolarHBondContact O-OG1 3.12Å |
| 50 | V | 90 | Very high | 85.4 | Confident | 61 Ų | 61 | 103.3 Ų | 103.3 | 37% | 0.37 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.8 | -40.5 | 175.2 | -175.6 | 0 | 0 | 0 | 0 | 110.3 | Y46 D47 P48 T53 I54 | Y46-V50 HydrophobicContact CE1-CB 3.96Å; Y46-V50 HydrophobicContact CE1-CG1 4.5Å; Y46-V50 HydrophobicContact CE2-CB 4.13Å; Y46-V50 HydrophobicContact CE2-CG1 3.99Å; Y46-V50 WeakPolarHBondContact OH-CB 3.48Å; Y46-V50 WeakPolarHBondContact OH-CG1 3.47Å; D47-V50 HydrophobicContact CB-CG2 4.14Å; D47-V50 WeakPolarHBondContact O-CB 3.17Å; D47-V50 PolarHBondContact O-N 2.94Å; P48-V50 VanDerWaalsContact C-N 3.26Å; P48-V50 PolarHBondContact O-N 3.03Å; V50-T53 WeakPolarHBondContact CA-OG1 3.22Å; V50-T53 PolarHBondContact O-N 2.91Å; V50-T53 PolarHBondContact O-OG1 3.17Å; V50-I54 HydrophobicContact CG1-CD1 3.9Å; V50-I54 WeakPolarHBondContact O-CB 3.34Å; V50-I54 WeakPolarHBondContact O-CD1 3.4Å; V50-I54 WeakPolarHBondContact O-CG1 3.48Å; V50-I54 PolarHBondContact O-N 3.18Å |
| 51 | G | 90.2 | Very high | 86.7 | Confident | 34 Ų | 34 | 99.7 Ų | 99.7 | 35% | 0.351 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.1 | -43.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y46 P48 W49 I54 G55 | Y46-G51 PolarHBondContact OH-N 2.93Å; P48-G51 PolarHBondContact O-N 2.93Å; W49-G51 VanDerWaalsContact C-N 3.35Å; G51-I54 PolarHBondContact O-N 2.84Å; G51-G55 PolarHBondContact O-N 2.96Å |
| 52 | I | 93.5 | Very high | 88.2 | Confident | 78 Ų | 78 | 99.9 Ų | 99.9 | 40% | 0.4 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.6 | -47.1 | 178.4 | -64.3 | 168 | 0 | 0 | 0 | 110.9 | P48 W49 I54 G55 I56 | P48-I52 WeakPolarHBondContact O-CG1 3.46Å; P48-I52 PolarHBondContact O-N 3.33Å; W49-I52 HydrophobicContact CD2-CD1 4.32Å; W49-I52 HydrophobicContact CE3-CB 4.48Å; W49-I52 HydrophobicContact CE3-CD1 3.76Å; W49-I52 HydrophobicContact CE3-CG2 4.47Å; W49-I52 HydrophobicContact CZ3-CD1 4.02Å; W49-I52 PolarHBondContact O-N 2.91Å; I52-I54 PolarHBondContact O-N 2.88Å; I52-G55 PolarHBondContact O-N 3.3Å; I52-I56 HydrophobicContact CG2-CD1 3.75Å; I52-I56 HydrophobicContact CG2-CG1 4.38Å; I52-I56 VanDerWaalsContact O-CG1 3.32Å; I52-I56 WeakPolarHBondContact O-CG1 3.43Å; I52-I56 PolarHBondContact O-N 3.49Å |
| 53 | T | 94.9 | Very high | 89.7 | Confident | 79 Ų | 79 | 96.3 Ų | 96.3 | 49% | 0.485 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.2 | -39 | 179.9 | 51.5 | 0 | 0 | 0 | 0 | 112.5 | W49 V50 I56 S57 | W49-T53 VanDerWaalsContact O-CG2 3.3Å; W49-T53 WeakPolarHBondContact O-CG2 3.4Å; W49-T53 PolarHBondContact O-N 3.35Å; W49-T53 PolarHBondContact O-OG1 3.12Å; V50-T53 WeakPolarHBondContact CA-OG1 3.22Å; V50-T53 PolarHBondContact O-N 2.91Å; V50-T53 PolarHBondContact O-OG1 3.17Å; T53-I56 PolarHBondContact O-N 3.05Å; T53-S57 WeakPolarHBondContact O-CB 3.44Å; T53-S57 PolarHBondContact O-N 3.42Å; T53-S57 PolarHBondContact O-OG 3.32Å; T53-S57 VanDerWaalsContact O-OG 3.12Å |
| 54 | I | 95.1 | Very high | 91 | Very high | 81 Ų | 81 | 93.6 Ų | 93.6 | 42% | 0.415 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.1 | -44.4 | 172.2 | -66.9 | 167.1 | 0 | 0 | 0 | 110 | V50 G51 I52 I56 S57 L58 | V50-I54 HydrophobicContact CG1-CD1 3.9Å; V50-I54 WeakPolarHBondContact O-CB 3.34Å; V50-I54 WeakPolarHBondContact O-CD1 3.4Å; V50-I54 WeakPolarHBondContact O-CG1 3.48Å; V50-I54 PolarHBondContact O-N 3.18Å; G51-I54 PolarHBondContact O-N 2.84Å; I52-I54 PolarHBondContact O-N 2.88Å; I54-I56 PolarHBondContact O-N 3.45Å; I54-S57 WeakPolarHBondContact CA-OG 3.4Å; I54-S57 PolarHBondContact O-N 2.98Å; I54-S57 PolarHBondContact O-OG 2.85Å; I54-L58 HydrophobicContact CG2-CD1 3.8Å; I54-L58 HydrophobicContact CG2-CG 4.3Å; I54-L58 WeakPolarHBondContact O-CB 3.39Å; I54-L58 VanDerWaalsContact O-CG 3.3Å; I54-L58 WeakPolarHBondContact O-CG 3.3Å; I54-L58 PolarHBondContact O-N 2.99Å |
| 55 | G | 96.1 | Very high | 92.1 | Very high | 43 Ų | 43 | 92 Ų | 92 | 44% | 0.443 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.4 | -44.7 | 176 | 0 | 0 | 0 | 0 | 0 | 113.2 | G51 I52 G59 | G51-G55 PolarHBondContact O-N 2.96Å; I52-G55 PolarHBondContact O-N 3.3Å; G55-G59 PolarHBondContact O-N 2.86Å |
| 56 | I | 96.7 | Very high | 93 | Very high | 103 Ų | 103 | 87 Ų | 87 | 53% | 0.528 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.8 | -43.8 | 176.7 | -66.5 | 167.3 | 0 | 0 | 0 | 110.9 | I52 T53 I54 G59 T60 | I52-I56 HydrophobicContact CG2-CD1 3.75Å; I52-I56 HydrophobicContact CG2-CG1 4.38Å; I52-I56 VanDerWaalsContact O-CG1 3.32Å; I52-I56 WeakPolarHBondContact O-CG1 3.43Å; I52-I56 PolarHBondContact O-N 3.49Å; T53-I56 PolarHBondContact O-N 3.05Å; I54-I56 PolarHBondContact O-N 3.45Å; I56-G59 PolarHBondContact O-N 3.19Å; I56-T60 HydrophobicContact CG2-CG2 4.17Å; I56-T60 WeakPolarHBondContact O-CB 3.41Å; I56-T60 VanDerWaalsContact O-CG2 3.27Å; I56-T60 WeakPolarHBondContact O-CG2 3.43Å; I56-T60 PolarHBondContact O-N 3.4Å; I56-T60 PolarHBondContact O-OG1 2.86Å |
| 57 | S | 96 | Very high | 93.7 | Very high | 59 Ų | 59 | 84.1 Ų | 84.1 | 41% | 0.413 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.4 | -43.3 | 179.7 | 63.1 | 0 | 0 | 0 | 0 | 111.9 | T53 I54 T60 M61 | T53-S57 WeakPolarHBondContact O-CB 3.44Å; T53-S57 PolarHBondContact O-N 3.42Å; T53-S57 PolarHBondContact O-OG 3.32Å; T53-S57 VanDerWaalsContact O-OG 3.12Å; I54-S57 WeakPolarHBondContact CA-OG 3.4Å; I54-S57 PolarHBondContact O-N 2.98Å; I54-S57 PolarHBondContact O-OG 2.85Å; S57-T60 PolarHBondContact O-OG1 2.9Å; S57-M61 WeakPolarHBondContact O-CB 3.32Å; S57-M61 WeakPolarHBondContact O-CG 3.45Å; S57-M61 PolarHBondContact O-N 3.33Å |
| 58 | L | 96.2 | Very high | 94 | Very high | 104 Ų | 104 | 84.8 Ų | 84.8 | 55% | 0.545 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.8 | -43.5 | 173.2 | -68 | 174 | 0 | 0 | 0 | 111.9 | I54 M61 L62 | I54-L58 HydrophobicContact CG2-CD1 3.8Å; I54-L58 HydrophobicContact CG2-CG 4.3Å; I54-L58 WeakPolarHBondContact O-CB 3.39Å; I54-L58 VanDerWaalsContact O-CG 3.3Å; I54-L58 WeakPolarHBondContact O-CG 3.3Å; I54-L58 PolarHBondContact O-N 2.99Å; L58-M61 PolarHBondContact O-N 3.45Å; L58-L62 WeakPolarHBondContact O-CG 3.43Å; L58-L62 PolarHBondContact O-N 3.45Å |
| 59 | G | 97.4 | Very high | 94.3 | Very high | 41 Ų | 41 | 85.2 Ų | 85.2 | 42% | 0.423 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.6 | -41.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113 | G55 I56 G63 | G55-G59 PolarHBondContact O-N 2.86Å; I56-G59 PolarHBondContact O-N 3.19Å; G59-G63 PolarHBondContact O-N 2.93Å |
| 60 | T | 96.3 | Very high | 94.4 | Very high | 72 Ų | 72 | 79.3 Ų | 79.3 | 44% | 0.442 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -68.4 | -41.5 | 176.3 | 51.9 | 0 | 0 | 0 | 0 | 111.8 | I56 S57 G63 L64 | I56-T60 HydrophobicContact CG2-CG2 4.17Å; I56-T60 WeakPolarHBondContact O-CB 3.41Å; I56-T60 VanDerWaalsContact O-CG2 3.27Å; I56-T60 WeakPolarHBondContact O-CG2 3.43Å; I56-T60 PolarHBondContact O-N 3.4Å; I56-T60 PolarHBondContact O-OG1 2.86Å; S57-T60 PolarHBondContact O-OG1 2.9Å; T60-G63 PolarHBondContact O-N 3.39Å; T60-L64 WeakPolarHBondContact O-CB 3.27Å; T60-L64 VanDerWaalsContact O-CG 3.24Å; T60-L64 WeakPolarHBondContact O-CG 3.41Å; T60-L64 PolarHBondContact O-N 3.28Å |
| 61 | M | 95.3 | Very high | 94.5 | Very high | 117 Ų | 117 | 80.4 Ų | 80.4 | 58% | 0.576 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -57.3 | -50.2 | 173.2 | -82.7 | -73 | 105.7 | 0 | 0 | 112.1 | S57 L58 L64 M65 | S57-M61 WeakPolarHBondContact O-CB 3.32Å; S57-M61 WeakPolarHBondContact O-CG 3.45Å; S57-M61 PolarHBondContact O-N 3.33Å; L58-M61 PolarHBondContact O-N 3.45Å; M61-L64 HydrophobicContact CE-CD1 4.22Å; M61-L64 PolarHBondContact O-N 3.07Å; M61-M65 WeakPolarHBondContact O-CG 3.24Å; M61-M65 PolarHBondContact O-N 3.47Å |
| 62 | L | 95.7 | Very high | 94.6 | Very high | 113 Ų | 113 | 87.8 Ų | 87.8 | 59% | 0.592 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -64.5 | -43 | 177.4 | -71.9 | 170.9 | 0 | 0 | 0 | 111.9 | L58 L64 M65 L66 | L58-L62 WeakPolarHBondContact O-CG 3.43Å; L58-L62 PolarHBondContact O-N 3.45Å; L62-L64 PolarHBondContact O-N 3.48Å; L62-M65 PolarHBondContact O-N 2.86Å; L62-L66 WeakPolarHBondContact O-CB 3.37Å; L62-L66 WeakPolarHBondContact O-CG 3.18Å; L62-L66 PolarHBondContact O-N 2.83Å |
| 63 | G | 95.8 | Very high | 94.5 | Very high | 38 Ų | 38 | 91.9 Ų | 91.9 | 39% | 0.392 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.2 | -44.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | G59 T60 L66 A67 | G59-G63 PolarHBondContact O-N 2.93Å; T60-G63 PolarHBondContact O-N 3.39Å; G63-L66 PolarHBondContact O-N 2.83Å; G63-A67 WeakPolarHBondContact O-CB 3.48Å; G63-A67 PolarHBondContact O-N 3.13Å |
| 64 | L | 95.1 | Very high | 94.3 | Very high | 96 Ų | 96 | 92 Ų | 92 | 50% | 0.503 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66 | -39.9 | 176.5 | -73.2 | 173 | 0 | 0 | 0 | 112.1 | T60 M61 L62 N68 | T60-L64 WeakPolarHBondContact O-CB 3.27Å; T60-L64 VanDerWaalsContact O-CG 3.24Å; T60-L64 WeakPolarHBondContact O-CG 3.41Å; T60-L64 PolarHBondContact O-N 3.28Å; M61-L64 HydrophobicContact CE-CD1 4.22Å; M61-L64 PolarHBondContact O-N 3.07Å; L62-L64 PolarHBondContact O-N 3.48Å; L64-N68 WeakPolarHBondContact O-CB 3.27Å; L64-N68 PolarHBondContact O-N 3.06Å; L64-N68 PolarHBondContact O-ND2 2.94Å; L64-N68 VanDerWaalsContact O-ND2 3.13Å |
| 65 | M | 93.7 | Very high | 94.1 | Very high | 134 Ų | 134 | 91.9 Ų | 91.9 | 66% | 0.66 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.2 | -49 | 174.9 | -76.7 | -156.9 | 161.2 | 0 | 0 | 111.7 | M61 L62 N68 V69 | M61-M65 WeakPolarHBondContact O-CG 3.24Å; M61-M65 PolarHBondContact O-N 3.47Å; L62-M65 PolarHBondContact O-N 2.86Å; M65-N68 PolarHBondContact O-N 2.83Å; M65-V69 WeakPolarHBondContact O-CG2 3.41Å; M65-V69 PolarHBondContact O-N 3.35Å; M65-V69 VanDerWaalsContact O-N 3.13Å |
| 66 | L | 94.5 | Very high | 93.8 | Very high | 126 Ų | 126 | 96.4 Ų | 96.4 | 66% | 0.66 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.4 | -42.9 | 178 | -74.1 | 166 | 0 | 0 | 0 | 111.9 | L62 G63 N68 V69 A70 | L62-L66 WeakPolarHBondContact O-CB 3.37Å; L62-L66 WeakPolarHBondContact O-CG 3.18Å; L62-L66 PolarHBondContact O-N 2.83Å; G63-L66 PolarHBondContact O-N 2.83Å; L66-N68 PolarHBondContact O-N 3.44Å; L66-V69 PolarHBondContact O-N 3.32Å; L66-A70 VanDerWaalsContact O-CB 3.26Å; L66-A70 WeakPolarHBondContact O-CB 3.38Å; L66-A70 PolarHBondContact O-N 3.48Å |
| 67 | A | 94 | Very high | 93.3 | Very high | 46 Ų | 46 | 97.2 Ų | 97.2 | 38% | 0.38 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.4 | -45.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | G63 V69 A70 V71 | G63-A67 WeakPolarHBondContact O-CB 3.48Å; G63-A67 PolarHBondContact O-N 3.13Å; A67-V69 PolarHBondContact O-N 3.44Å; A67-A70 PolarHBondContact O-N 3.13Å; A67-V71 WeakPolarHBondContact O-CB 3.36Å; A67-V71 WeakPolarHBondContact O-CG2 3.42Å; A67-V71 PolarHBondContact O-N 3.37Å |
| 68 | N | 92.1 | Very high | 92.9 | Very high | 98 Ų | 98 | 99 Ų | 99 | 52% | 0.524 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62 | -42.2 | 178 | -80.9 | -37 | 0 | 0 | 0 | 112.6 | L64 M65 L66 R72 | L64-N68 WeakPolarHBondContact O-CB 3.27Å; L64-N68 PolarHBondContact O-N 3.06Å; L64-N68 PolarHBondContact O-ND2 2.94Å; L64-N68 VanDerWaalsContact O-ND2 3.13Å; M65-N68 PolarHBondContact O-N 2.83Å; L66-N68 PolarHBondContact O-N 3.44Å; N68-R72 WeakPolarHBondContact O-CB 3.31Å; N68-R72 VanDerWaalsContact O-CG 3.27Å; N68-R72 WeakPolarHBondContact O-CG 3.31Å; N68-R72 PolarHBondContact O-N 2.83Å |
| 69 | V | 92.4 | Very high | 92.5 | Very high | 98 Ų | 98 | 100.4 Ų | 100.4 | 59% | 0.594 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -66.4 | -45.4 | 176.6 | 175.1 | 0 | 0 | 0 | 0 | 110.7 | M65 L66 A67 R72 W73 | M65-V69 WeakPolarHBondContact O-CG2 3.41Å; M65-V69 PolarHBondContact O-N 3.35Å; M65-V69 VanDerWaalsContact O-N 3.13Å; L66-V69 PolarHBondContact O-N 3.32Å; A67-V69 PolarHBondContact O-N 3.44Å; V69-R72 PolarHBondContact O-N 3.05Å; V69-W73 WeakPolarHBondContact O-CB 3.45Å; V69-W73 PolarHBondContact O-N 2.98Å |
| 70 | A | 92.1 | Very high | 91.9 | Very high | 44 Ų | 44 | 104 Ų | 104 | 36% | 0.364 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.8 | -48.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | L66 A67 R72 W73 I74 | L66-A70 VanDerWaalsContact O-CB 3.26Å; L66-A70 WeakPolarHBondContact O-CB 3.38Å; L66-A70 PolarHBondContact O-N 3.48Å; A67-A70 PolarHBondContact O-N 3.13Å; A70-R72 PolarHBondContact O-N 2.72Å; A70-W73 PolarHBondContact O-N 2.85Å; A70-W73 VanDerWaalsContact O-N 3.13Å; A70-I74 HydrophobicContact CB-CD1 4.4Å; A70-I74 VanDerWaalsContact O-CB 3.31Å; A70-I74 WeakPolarHBondContact O-CB 3.21Å; A70-I74 WeakPolarHBondContact O-CD1 3.44Å; A70-I74 WeakPolarHBondContact O-CG1 3.37Å; A70-I74 PolarHBondContact O-N 2.82Å |
| 71 | V | 92.1 | Very high | 91.2 | Very high | 84 Ų | 84 | 104.6 Ų | 104.6 | 51% | 0.509 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.4 | -45.2 | 177.9 | 170.5 | 0 | 0 | 0 | 0 | 111 | A67 W73 I74 T75 | A67-V71 WeakPolarHBondContact O-CB 3.36Å; A67-V71 WeakPolarHBondContact O-CG2 3.42Å; A67-V71 PolarHBondContact O-N 3.37Å; V71-W73 VanDerWaalsContact C-N 3.29Å; V71-W73 PolarHBondContact O-N 3.31Å; V71-I74 PolarHBondContact O-N 3.13Å; V71-T75 HydrophobicContact CG1-CG2 4.16Å; V71-T75 VanDerWaalsContact O-CB 3.31Å; V71-T75 WeakPolarHBondContact O-CB 3.48Å; V71-T75 WeakPolarHBondContact O-CG2 3.45Å; V71-T75 PolarHBondContact O-N 2.78Å; V71-T75 PolarHBondContact O-OG1 3.39Å |
| 72 | R | 91.9 | Very high | 90.4 | Very high | 190 Ų | 190 | 104.4 Ų | 104.4 | 72% | 0.717 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -60.6 | -39.4 | 175.5 | -76.1 | 175.1 | 176.3 | 176.5 | 0.4 | 112 | N68 V69 A70 T75 K76 | N68-R72 WeakPolarHBondContact O-CB 3.31Å; N68-R72 VanDerWaalsContact O-CG 3.27Å; N68-R72 WeakPolarHBondContact O-CG 3.31Å; N68-R72 PolarHBondContact O-N 2.83Å; V69-R72 PolarHBondContact O-N 3.05Å; A70-R72 PolarHBondContact O-N 2.72Å; R72-T75 WeakPolarHBondContact CA-OG1 3.17Å; R72-T75 PolarHBondContact O-OG1 3.19Å; R72-T75 VanDerWaalsContact O-OG1 3.05Å; R72-K76 VanDerWaalsContact O-CB 3.24Å; R72-K76 WeakPolarHBondContact O-CB 3.26Å; R72-K76 PolarHBondContact O-N 3.12Å; R72-K76 VanDerWaalsContact O-N 3.12Å |
| 73 | W | 91.1 | Very high | 89.6 | Confident | 163 Ų | 163 | 107 Ų | 107 | 62% | 0.617 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -71.6 | -46.3 | 179.6 | -167.5 | 85.6 | 0 | 0 | 0 | 112.3 | V69 A70 V71 K76 R77 | V69-W73 WeakPolarHBondContact O-CB 3.45Å; V69-W73 PolarHBondContact O-N 2.98Å; A70-W73 PolarHBondContact O-N 2.85Å; A70-W73 VanDerWaalsContact O-N 3.13Å; V71-W73 VanDerWaalsContact C-N 3.29Å; V71-W73 PolarHBondContact O-N 3.31Å; W73-K76 PolarHBondContact O-N 3.39Å; W73-R77 WeakPolarHBondContact O-CB 3.24Å; W73-R77 PolarHBondContact O-N 3.03Å |
| 74 | I | 91.4 | Very high | 88.6 | Confident | 82 Ų | 82 | 112.8 Ų | 112.8 | 42% | 0.421 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.3 | -51.8 | 176.9 | -69.9 | 164.3 | 0 | 0 | 0 | 109.7 | A70 V71 K76 R77 L78 | A70-I74 HydrophobicContact CB-CD1 4.4Å; A70-I74 VanDerWaalsContact O-CB 3.31Å; A70-I74 WeakPolarHBondContact O-CB 3.21Å; A70-I74 WeakPolarHBondContact O-CD1 3.44Å; A70-I74 WeakPolarHBondContact O-CG1 3.37Å; A70-I74 PolarHBondContact O-N 2.82Å; V71-I74 PolarHBondContact O-N 3.13Å; I74-K76 VanDerWaalsContact C-N 3.33Å; I74-K76 PolarHBondContact O-N 2.75Å; I74-R77 CarbonylContact O-C 3.56Å; I74-R77 WeakPolarHBondContact O-CA 3.29Å; I74-R77 WeakPolarHBondContact O-CB 3.21Å; I74-R77 PolarHBondContact O-N 2.86Å; I74-L78 HydrophobicContact CG2-CD1 3.69Å; I74-L78 HydrophobicContact CG2-CD2 4.49Å; I74-L78 WeakPolarHBondContact O-CB 3.39Å; I74-L78 VanDerWaalsContact O-CD1 3.29Å; I74-L78 WeakPolarHBondContact O-CD1 3.45Å; I74-L78 PolarHBondContact O-N 2.87Å |
| 75 | T | 90.9 | Very high | 87.6 | Confident | 79 Ų | 79 | 111.8 Ų | 111.8 | 49% | 0.485 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -59.6 | -41.6 | 178.4 | 52.7 | 0 | 0 | 0 | 0 | 112 | V71 R72 R77 K79 | V71-T75 HydrophobicContact CG1-CG2 4.16Å; V71-T75 VanDerWaalsContact O-CB 3.31Å; V71-T75 WeakPolarHBondContact O-CB 3.48Å; V71-T75 WeakPolarHBondContact O-CG2 3.45Å; V71-T75 PolarHBondContact O-N 2.78Å; V71-T75 PolarHBondContact O-OG1 3.39Å; R72-T75 WeakPolarHBondContact CA-OG1 3.17Å; R72-T75 PolarHBondContact O-OG1 3.19Å; R72-T75 VanDerWaalsContact O-OG1 3.05Å; T75-R77 VanDerWaalsContact C-N 3.33Å; T75-R77 PolarHBondContact O-N 3.34Å; T75-K79 VanDerWaalsContact O-CB 3.27Å; T75-K79 WeakPolarHBondContact O-CB 3.27Å; T75-K79 PolarHBondContact O-N 3.46Å |
| 76 | K | 88.3 | Confident | 86.6 | Confident | 137 Ų | 137 | 111.9 Ų | 111.9 | 60% | 0.596 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -65.8 | -32.9 | 174.4 | -170.9 | 174.4 | -177.9 | 176.9 | 0 | 112.5 | R72 W73 I74 R80 | R72-K76 VanDerWaalsContact O-CB 3.24Å; R72-K76 WeakPolarHBondContact O-CB 3.26Å; R72-K76 PolarHBondContact O-N 3.12Å; R72-K76 VanDerWaalsContact O-N 3.12Å; W73-K76 PolarHBondContact O-N 3.39Å; I74-K76 VanDerWaalsContact C-N 3.33Å; I74-K76 PolarHBondContact O-N 2.75Å; K76-R80 WeakPolarHBondContact O-CG 3.28Å; K76-R80 PolarHBondContact O-N 3.46Å; K76-R80 PolarHBondContact O-NE 3.15Å |
| 77 | R | 87.7 | Confident | 85.4 | Confident | 121 Ų | 121 | 111.3 Ų | 111.3 | 46% | 0.457 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -73.7 | -48.1 | 175.8 | -171 | 69.2 | 174.3 | 163 | -0.6 | 111 | W73 I74 T75 K79 R80 L81 | W73-R77 WeakPolarHBondContact O-CB 3.24Å; W73-R77 PolarHBondContact O-N 3.03Å; I74-R77 CarbonylContact O-C 3.56Å; I74-R77 WeakPolarHBondContact O-CA 3.29Å; I74-R77 WeakPolarHBondContact O-CB 3.21Å; I74-R77 PolarHBondContact O-N 2.86Å; T75-R77 VanDerWaalsContact C-N 3.33Å; T75-R77 PolarHBondContact O-N 3.34Å; R77-K79 PolarHBondContact O-N 3.14Å; R77-R80 WeakPolarHBondContact O-CB 3.3Å; R77-R80 PolarHBondContact O-N 3.47Å; R77-R80 VanDerWaalsContact O-N 3.14Å; R77-L81 HydrophobicContact CG-CD1 4.36Å; R77-L81 WeakPolarHBondContact O-CG 3.45Å; R77-L81 PolarHBondContact O-N 3.34Å |
| 78 | L | 87.5 | Confident | 84.1 | Confident | 96 Ų | 96 | 110.6 Ų | 110.6 | 50% | 0.503 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.1 | -44.5 | 176.6 | -94 | 66.5 | 0 | 0 | 0 | 111.4 | I74 R80 L81 M82 | I74-L78 HydrophobicContact CG2-CD1 3.69Å; I74-L78 HydrophobicContact CG2-CD2 4.49Å; I74-L78 WeakPolarHBondContact O-CB 3.39Å; I74-L78 VanDerWaalsContact O-CD1 3.29Å; I74-L78 WeakPolarHBondContact O-CD1 3.45Å; I74-L78 PolarHBondContact O-N 2.87Å; L78-R80 VanDerWaalsContact C-N 3.26Å; L78-R80 PolarHBondContact O-N 2.79Å; L78-L81 PolarHBondContact O-N 2.97Å; L78-L81 VanDerWaalsContact O-N 3.15Å; L78-M82 VanDerWaalsContact O-CB 3.3Å; L78-M82 WeakPolarHBondContact O-CB 3.36Å; L78-M82 VanDerWaalsContact O-CG 3.28Å; L78-M82 WeakPolarHBondContact O-CG 3.45Å; L78-M82 PolarHBondContact O-N 3.3Å |
| 79 | K | 87.2 | Confident | 83 | Confident | 134 Ų | 134 | 115.2 Ų | 115.2 | 58% | 0.583 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -60.1 | -36.9 | 176.6 | -168.5 | 171.4 | -174.8 | 172.7 | 0 | 111.9 | T75 R77 R83 | T75-K79 VanDerWaalsContact O-CB 3.27Å; T75-K79 WeakPolarHBondContact O-CB 3.27Å; T75-K79 PolarHBondContact O-N 3.46Å; R77-K79 PolarHBondContact O-N 3.14Å; K79-R83 VanDerWaalsContact O-CG 3.3Å; K79-R83 WeakPolarHBondContact O-CG 3.3Å; K79-R83 PolarHBondContact O-N 3.09Å; K79-R83 VanDerWaalsContact O-N 3.09Å |
| 80 | R | 84.3 | Confident | 82 | Confident | 117 Ų | 117 | 119.8 Ų | 119.8 | 44% | 0.442 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -68.8 | -42.2 | 174.7 | -77.6 | -175 | -81.7 | 175.4 | -4.3 | 112.1 | K76 R77 L78 R83 K84 | K76-R80 WeakPolarHBondContact O-CG 3.28Å; K76-R80 PolarHBondContact O-N 3.46Å; K76-R80 PolarHBondContact O-NE 3.15Å; R77-R80 WeakPolarHBondContact O-CB 3.3Å; R77-R80 PolarHBondContact O-N 3.47Å; R77-R80 VanDerWaalsContact O-N 3.14Å; L78-R80 VanDerWaalsContact C-N 3.26Å; L78-R80 PolarHBondContact O-N 2.79Å; R80-R83 PolarHBondContact O-N 3.38Å; R80-K84 PolarHBondContact O-N 3.35Å |
| 81 | L | 82 | Confident | 81.2 | Confident | 84 Ų | 84 | 122.3 Ų | 122.3 | 44% | 0.44 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -66.9 | -44.4 | 176.9 | -67.3 | 171.2 | 0 | 0 | 0 | 111.9 | R77 L78 R83 K84 T85 | R77-L81 HydrophobicContact CG-CD1 4.36Å; R77-L81 WeakPolarHBondContact O-CG 3.45Å; R77-L81 PolarHBondContact O-N 3.34Å; L78-L81 PolarHBondContact O-N 2.97Å; L78-L81 VanDerWaalsContact O-N 3.15Å; L81-R83 VanDerWaalsContact C-N 3.28Å; L81-R83 PolarHBondContact O-N 2.93Å; L81-K84 WeakPolarHBondContact O-CB 3.45Å; L81-K84 PolarHBondContact O-N 3.44Å; L81-T85 PolarHBondContact O-N 3.07Å; L81-T85 PolarHBondContact O-OG1 3.17Å |
| 82 | M | 78.9 | Confident | 80.3 | Confident | 113 Ų | 113 | 125.4 Ų | 125.4 | 56% | 0.557 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -60 | -36.2 | 175.4 | -76.5 | -88.1 | -86.6 | 0 | 0 | 112.6 | L78 T85 K86 | L78-M82 VanDerWaalsContact O-CB 3.3Å; L78-M82 WeakPolarHBondContact O-CB 3.36Å; L78-M82 VanDerWaalsContact O-CG 3.28Å; L78-M82 WeakPolarHBondContact O-CG 3.45Å; L78-M82 PolarHBondContact O-N 3.3Å; M82-T85 WeakPolarHBondContact CA-OG1 3.36Å; M82-T85 PolarHBondContact O-OG1 2.9Å; M82-T85 VanDerWaalsContact O-OG1 3.12Å; M82-K86 WeakPolarHBondContact O-CB 3.4Å; M82-K86 WeakPolarHBondContact O-CG 3.46Å; M82-K86 PolarHBondContact O-N 3.46Å |
| 83 | R | 79 | Confident | 79.4 | Confident | 167 Ų | 167 | 118.1 Ų | 118.1 | 63% | 0.63 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -65.3 | -43.9 | 172.6 | -78.5 | 178 | 178.8 | -165 | -1.7 | 111.4 | K79 R80 L81 L87 | K79-R83 VanDerWaalsContact O-CG 3.3Å; K79-R83 WeakPolarHBondContact O-CG 3.3Å; K79-R83 PolarHBondContact O-N 3.09Å; K79-R83 VanDerWaalsContact O-N 3.09Å; R80-R83 PolarHBondContact O-N 3.38Å; L81-R83 VanDerWaalsContact C-N 3.28Å; L81-R83 PolarHBondContact O-N 2.93Å; R83-L87 WeakPolarHBondContact O-CB 3.42Å; R83-L87 PolarHBondContact O-N 3.45Å |
| 84 | K | 74.3 | Confident | 78.6 | Confident | 160 Ų | 160 | 115.4 Ų | 115.4 | 70% | 0.696 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -62.5 | -43.7 | 177.1 | -71.5 | -173.5 | 173.7 | -164.6 | 0 | 112.2 | R80 L81 L87 G88 | R80-K84 PolarHBondContact O-N 3.35Å; L81-K84 WeakPolarHBondContact O-CB 3.45Å; L81-K84 PolarHBondContact O-N 3.44Å; K84-L87 PolarHBondContact O-N 2.95Å; K84-G88 PolarHBondContact O-N 3Å |
| 85 | T | 75.3 | Confident | 77.8 | Confident | 74 Ų | 74 | 116 Ų | 116 | 45% | 0.454 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -70.6 | -39 | 179.4 | 57.1 | 0 | 0 | 0 | 0 | 112.6 | L81 M82 G88 R89 | L81-T85 PolarHBondContact O-N 3.07Å; L81-T85 PolarHBondContact O-OG1 3.17Å; M82-T85 WeakPolarHBondContact CA-OG1 3.36Å; M82-T85 PolarHBondContact O-OG1 2.9Å; M82-T85 VanDerWaalsContact O-OG1 3.12Å; T85-G88 PolarHBondContact O-N 3.35Å; T85-R89 WeakPolarHBondContact O-CB 3.34Å; T85-R89 PolarHBondContact O-N 3.09Å |
| 86 | K | 72.2 | Confident | 76.9 | Confident | 137 Ų | 137 | 117.6 Ų | 117.6 | 60% | 0.596 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -64.1 | -41.1 | 173.3 | -79.8 | -172.4 | 179.9 | -174 | 0 | 112.1 | M82 R90 | M82-K86 WeakPolarHBondContact O-CB 3.4Å; M82-K86 WeakPolarHBondContact O-CG 3.46Å; M82-K86 PolarHBondContact O-N 3.46Å; K86-R90 PolarHBondContact O-N 3.15Å; K86-R90 VanDerWaalsContact O-N 3.16Å |
| 87 | L | 68.6 | Low | 76.2 | Confident | 113 Ų | 113 | 114.1 Ų | 114.1 | 59% | 0.592 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -65.1 | -46.3 | 176.3 | -138.4 | 92 | 0 | 0 | 0 | 110.7 | R83 K84 R89 R90 I91 | R83-L87 WeakPolarHBondContact O-CB 3.42Å; R83-L87 PolarHBondContact O-N 3.45Å; K84-L87 PolarHBondContact O-N 2.95Å; L87-R89 VanDerWaalsContact C-N 3.34Å; L87-R89 PolarHBondContact O-N 2.98Å; L87-R90 PolarHBondContact O-N 3.12Å; L87-R90 VanDerWaalsContact O-N 3.15Å; L87-I91 HydrophobicContact CD2-CD1 4.23Å; L87-I91 WeakPolarHBondContact O-CG1 3.47Å; L87-I91 PolarHBondContact O-N 2.96Å |
| 88 | G | 66.4 | Low | 75.6 | Confident | 31 Ų | 31 | 114.4 Ų | 114.4 | 32% | 0.32 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -59.3 | -41.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | K84 T85 R90 I91 F92 | K84-G88 PolarHBondContact O-N 3Å; T85-G88 PolarHBondContact O-N 3.35Å; G88-R90 PolarHBondContact O-N 3.4Å; G88-I91 PolarHBondContact O-N 2.92Å; G88-F92 WeakPolarHBondContact O-CB 3.48Å; G88-F92 PolarHBondContact O-N 3.14Å |
| 89 | R | 68.4 | Low | 75 | Confident | 195 Ų | 195 | 114.4 Ų | 114.4 | 74% | 0.736 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63.7 | -36.4 | 175.2 | -114.1 | -169.4 | -85.2 | -175.6 | -9.4 | 113.2 | T85 L87 G93 | T85-R89 WeakPolarHBondContact O-CB 3.34Å; T85-R89 PolarHBondContact O-N 3.09Å; L87-R89 VanDerWaalsContact C-N 3.34Å; L87-R89 PolarHBondContact O-N 2.98Å; R89-G93 PolarHBondContact O-N 3.44Å |
| 90 | R | 72.7 | Confident | 74.5 | Confident | 194 Ų | 194 | 115.1 Ų | 115.1 | 73% | 0.732 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -66.9 | -47.2 | 174.5 | -73 | -174.2 | -178.5 | -154.5 | -1.4 | 111.1 | K86 L87 G88 G93 D94 | K86-R90 PolarHBondContact O-N 3.15Å; K86-R90 VanDerWaalsContact O-N 3.16Å; L87-R90 PolarHBondContact O-N 3.12Å; L87-R90 VanDerWaalsContact O-N 3.15Å; G88-R90 PolarHBondContact O-N 3.4Å; R90-G93 PolarHBondContact O-N 3.16Å; R90-D94 PolarHBondContact O-N 3.46Å; R90-D94 VanDerWaalsContact O-N 3.09Å |
| 91 | I | 75.3 | Confident | 74.2 | Confident | 98 Ų | 98 | 117.2 Ų | 117.2 | 50% | 0.503 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -63.8 | -48.1 | -179.1 | -62.2 | 166.2 | 0 | 0 | 0 | 111 | L87 G88 D94 E95 | L87-I91 HydrophobicContact CD2-CD1 4.23Å; L87-I91 WeakPolarHBondContact O-CG1 3.47Å; L87-I91 PolarHBondContact O-N 2.96Å; G88-I91 PolarHBondContact O-N 2.92Å; I91-D94 PolarHBondContact O-N 2.89Å; I91-E95 WeakPolarHBondContact O-CG 3.46Å; I91-E95 PolarHBondContact O-N 3.49Å; I91-E95 VanDerWaalsContact O-N 3.14Å |
| 92 | F | 74 | Confident | 73.8 | Confident | 149 Ų | 149 | 119.1 Ų | 119.1 | 65% | 0.654 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -69.9 | -34.6 | 179.1 | -106.3 | -90.1 | 0 | 0 | 0 | 113.4 | G88 D94 E95 L96 | G88-F92 WeakPolarHBondContact O-CB 3.48Å; G88-F92 PolarHBondContact O-N 3.14Å; F92-D94 VanDerWaalsContact C-N 3.35Å; F92-E95 PolarHBondContact O-N 2.98Å; F92-L96 WeakPolarHBondContact O-CB 3.44Å; F92-L96 WeakPolarHBondContact O-CG 3.38Å; F92-L96 PolarHBondContact O-N 2.93Å |
| 93 | G | 72.9 | Confident | 73.6 | Confident | 37 Ų | 37 | 118.9 Ų | 118.9 | 38% | 0.381 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -63.5 | -41.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | R89 R90 S97 | R89-G93 PolarHBondContact O-N 3.44Å; R90-G93 PolarHBondContact O-N 3.16Å; G93-S97 WeakPolarHBondContact O-CB 3.46Å; G93-S97 PolarHBondContact O-N 3.46Å |
| 94 | D | 74.2 | Confident | 73.1 | Confident | 106 Ų | 106 | 119.3 Ų | 119.3 | 57% | 0.567 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -69.4 | -38.9 | 177.1 | -72.6 | -14.5 | 0 | 0 | 0 | 112 | R90 I91 F92 S97 K98 | R90-D94 PolarHBondContact O-N 3.46Å; R90-D94 VanDerWaalsContact O-N 3.09Å; I91-D94 PolarHBondContact O-N 2.89Å; F92-D94 VanDerWaalsContact C-N 3.35Å; D94-S97 PolarHBondContact O-N 2.99Å; D94-K98 WeakPolarHBondContact O-CG 3.41Å; D94-K98 PolarHBondContact O-N 3.41Å |
| 95 | E | 74.2 | Confident | 72.6 | Confident | 93 Ų | 93 | 119.4 Ų | 119.4 | 44% | 0.435 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -64.6 | -43.3 | 175.3 | -78.4 | -71.8 | 111.9 | 0 | 0 | 112.4 | I91 F92 S97 K98 N99 | I91-E95 WeakPolarHBondContact O-CG 3.46Å; I91-E95 PolarHBondContact O-N 3.49Å; I91-E95 VanDerWaalsContact O-N 3.14Å; F92-E95 PolarHBondContact O-N 2.98Å; E95-S97 PolarHBondContact O-N 3.34Å; E95-K98 PolarHBondContact O-N 3.5Å; E95-N99 WeakPolarHBondContact O-CB 3.41Å; E95-N99 PolarHBondContact O-N 3.05Å |
| 96 | L | 72.6 | Confident | 72.4 | Confident | 113 Ų | 113 | 121.7 Ų | 121.7 | 59% | 0.592 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -63.6 | -40.8 | 175.3 | -77.6 | 165.2 | 0 | 0 | 0 | 111.7 | F92 N99 Q100 | F92-L96 WeakPolarHBondContact O-CB 3.44Å; F92-L96 WeakPolarHBondContact O-CG 3.38Å; F92-L96 PolarHBondContact O-N 2.93Å; L96-N99 PolarHBondContact O-N 3.23Å; L96-Q100 WeakPolarHBondContact O-CB 3.48Å; L96-Q100 PolarHBondContact O-N 3.2Å |
| 97 | S | 72.3 | Confident | 72.4 | Confident | 65 Ų | 65 | 120.8 Ų | 120.8 | 46% | 0.455 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -65.4 | -37.6 | 177.1 | -172 | 0 | 0 | 0 | 0 | 112.4 | G93 D94 E95 K101 | G93-S97 WeakPolarHBondContact O-CB 3.46Å; G93-S97 PolarHBondContact O-N 3.46Å; D94-S97 PolarHBondContact O-N 2.99Å; E95-S97 PolarHBondContact O-N 3.34Å; S97-K101 PolarHBondContact O-N 3.23Å |
| 98 | K | 75.7 | Confident | 72.6 | Confident | 126 Ų | 126 | 121.3 Ų | 121.3 | 55% | 0.548 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -67.6 | -47.3 | 174.2 | -75.8 | 176.8 | -176.6 | 174.2 | 0 | 112.2 | D94 E95 Q100 K101 I102 | D94-K98 WeakPolarHBondContact O-CG 3.41Å; D94-K98 PolarHBondContact O-N 3.41Å; E95-K98 PolarHBondContact O-N 3.5Å; K98-Q100 VanDerWaalsContact C-N 3.31Å; K98-Q100 PolarHBondContact O-N 3.14Å; K98-K101 PolarHBondContact O-N 3.4Å; K98-I102 WeakPolarHBondContact O-CG1 3.4Å; K98-I102 PolarHBondContact O-N 2.98Å; K98-I102 VanDerWaalsContact O-N 3.14Å |
| 99 | N | 75.2 | Confident | 73 | Confident | 97 Ų | 97 | 126.6 Ų | 126.6 | 52% | 0.519 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -64.8 | -34.8 | -179.9 | -75.2 | -21.7 | 0 | 0 | 0 | 112.2 | E95 L96 I102 S103 | E95-N99 WeakPolarHBondContact O-CB 3.41Å; E95-N99 PolarHBondContact O-N 3.05Å; L96-N99 PolarHBondContact O-N 3.23Å; N99-I102 PolarHBondContact O-N 3.45Å; N99-S103 PolarHBondContact O-N 3.46Å |
| 100 | Q | 76.5 | Confident | 73.3 | Confident | 148 Ų | 148 | 122.3 Ų | 122.3 | 69% | 0.692 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -68.4 | -35.8 | 175 | -165.1 | -177.3 | 9.6 | 0 | 0 | 112.5 | L96 K98 | L96-Q100 WeakPolarHBondContact O-CB 3.48Å; L96-Q100 PolarHBondContact O-N 3.2Å; K98-Q100 VanDerWaalsContact C-N 3.31Å; K98-Q100 PolarHBondContact O-N 3.14Å |
| 101 | K | 76.9 | Confident | 73.3 | Confident | 162 Ų | 162 | 117.5 Ų | 117.5 | 70% | 0.704 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -67.2 | -36.9 | 175 | -85.1 | -170.2 | 177 | -165.8 | 0 | 113.1 | S97 K98 | S97-K101 PolarHBondContact O-N 3.23Å; K98-K101 PolarHBondContact O-N 3.4Å |
| 102 | I | 75.1 | Confident | 73.2 | Confident | 123 Ų | 123 | 118.9 Ų | 118.9 | 63% | 0.631 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -70.1 | -35.5 | 179.7 | -63.6 | 164.1 | 0 | 0 | 0 | 111 | K98 N99 H104 | K98-I102 WeakPolarHBondContact O-CG1 3.4Å; K98-I102 PolarHBondContact O-N 2.98Å; K98-I102 VanDerWaalsContact O-N 3.14Å; N99-I102 PolarHBondContact O-N 3.45Å; I102-H104 VanDerWaalsContact C-N 3.27Å; I102-H104 PolarHBondContact O-N 3.35Å |
| 103 | S | 73.2 | Confident | 73.1 | Confident | 108 Ų | 108 | 116.6 Ų | 116.6 | 76% | 0.755 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.1 | -9.5 | -177.4 | -158.2 | 0 | 0 | 0 | 0 | 114.7 | N99 | N99-S103 PolarHBondContact O-N 3.46Š|
| 104 | H | 68.8 | Low | 73.1 | Confident | 176 Ų | 176 | 123.3 Ų | 123.3 | 82% | 0.815 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.5 | 6.9 | -177.4 | -137.5 | -72.6 | 0 | 0 | 0 | 113.3 | I102 | I102-H104 VanDerWaalsContact C-N 3.27Å; I102-H104 PolarHBondContact O-N 3.35Å |
| 105 | S | 63.1 | Low | 73.1 | Confident | 162 Ų | 162 | 124.8 Ų | 124.8 | 100% | 1.133 | 66% | 0.662 | S | S | * | * | trans | -110 | 0 | 172.2 | -171.3 | 0 | 0 | 0 | 0 | 110.5 |
Retrieved 105 of 105 residues in 66.7 ms
(Link to these results)