| 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 | 44.3 | Very low | 51.1 | Low | 230 Ų | 230 | 163.3 Ų | 163.3 | 100% | 1.133 | 82% | 0.819 | S | S | * | * | 0 | 120.7 | 0 | -69.9 | 177.7 | 168.3 | 0 | 0 | 107.9 | V3 | M1-V3 PolarHBondContact O-N 3Š| |||
| 2 | P | 46.7 | Very low | 51.1 | Low | 128 Ų | 128 | 156.3 Ų | 156.3 | 83% | 0.831 | 80% | 0.797 | S | S | * | * | trans | -74.1 | 123.9 | 179.6 | 28.8 | -30.4 | 0 | 0 | 0 | 110.2 | I4 | P2-I4 PolarHBondContact O-N 3.3Š| ||
| 3 | V | 54.8 | Low | 51 | Low | 138 Ų | 138 | 159.5 Ų | 159.5 | 84% | 0.836 | 80% | 0.802 | S | S | * | * | trans | -78.6 | 110.4 | 177 | 175.8 | 0 | 0 | 0 | 0 | 108.2 | M1 P5 | M1-V3 PolarHBondContact O-N 3Å; V3-P5 WeakPolarHBondContact O-CD 3.4Å | ||
| 4 | I | 54.4 | Low | 51.1 | Low | 147 Ų | 147 | 157.9 Ų | 157.9 | 75% | 0.754 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 119.5 | 172.2 | -61.2 | 163.9 | 0 | 0 | 0 | 107.3 | P2 I6 | P2-I4 PolarHBondContact O-N 3.3Å; I4-I6 PolarHBondContact O-N 3.31Å |
| 5 | P | 57.9 | Low | 51.6 | Low | 112 Ų | 112 | 149.9 Ų | 149.9 | 73% | 0.727 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 120.6 | 175.9 | 27.4 | -30 | 0 | 0 | 0 | 109.9 | V3 | V3-P5 WeakPolarHBondContact O-CD 3.4Š|
| 6 | I | 49.6 | Very low | 51.3 | Low | 152 Ų | 152 | 149.1 Ų | 149.1 | 78% | 0.779 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 124.9 | 171.3 | -60.4 | 165.2 | 0 | 0 | 0 | 107.9 | I4 R8 | I4-I6 PolarHBondContact O-N 3.31Å; I6-R8 PolarHBondContact O-N 3.44Å |
| 7 | P | 48.1 | Very low | 51.1 | Low | 117 Ų | 117 | 146.6 Ų | 146.6 | 76% | 0.76 | 76% | 0.756 | S | S | * | * | trans | -65.5 | 107.8 | 176.9 | 24.4 | -30.5 | 0 | 0 | 0 | 109.3 | R9 | P7-R9 PolarHBondContact O-N 3.46Å; P7-R9 VanDerWaalsContact O-N 3.08Å | ||
| 8 | R | 53.3 | Low | 51.1 | Low | 231 Ų | 231 | 144.3 Ų | 144.3 | 87% | 0.872 | 75% | 0.754 | S | S | * | * | trans | -59.2 | 113.3 | 168.5 | -73.8 | -174.4 | -175.6 | -173.2 | 1.9 | 107.3 | I6 V10 | I6-R8 PolarHBondContact O-N 3.44Å; R8-V10 PolarHBondContact O-N 3.36Å | ||
| 9 | R | 51.8 | Low | 51.1 | Low | 214 Ų | 214 | 142.2 Ų | 142.2 | 81% | 0.808 | 75% | 0.748 | S | S | * | * | trans | -60 | 89 | 166.8 | -88 | -176.8 | 176.1 | 169.8 | 0.8 | 108.7 | P7 R11 | P7-R9 PolarHBondContact O-N 3.46Å; P7-R9 VanDerWaalsContact O-N 3.08Å; R9-R11 PolarHBondContact O-N 3.18Å | ||
| 10 | V | 48.9 | Very low | 51 | Low | 121 Ų | 121 | 139.8 Ų | 139.8 | 73% | 0.733 | 74% | 0.743 | S | S | * | * | trans | -74.4 | 86.2 | 157.4 | -175.7 | 0 | 0 | 0 | 0 | 105.4 | R8 S12 | R8-V10 PolarHBondContact O-N 3.36Å; V10-S12 PolarHBondContact O-N 2.84Å | ||
| 11 | R | 52.5 | Low | 50.7 | Low | 206 Ų | 206 | 141 Ų | 141 | 78% | 0.777 | 75% | 0.746 | S | S | * | * | trans | -75.2 | 82.3 | 158.6 | -83.3 | -173.7 | 174.2 | 172.3 | -2.7 | 106.2 | R9 F13 | R9-R11 PolarHBondContact O-N 3.18Å; R11-F13 PolarHBondContact O-N 3.26Å | ||
| 12 | S | 51.5 | Low | 50.9 | Low | 79 Ų | 79 | 137.8 Ų | 137.8 | 55% | 0.552 | 73% | 0.728 | S | S | * | * | trans | -60.9 | 107.9 | 158.4 | 39.3 | 0 | 0 | 0 | 0 | 106.6 | V10 H14 | V10-S12 PolarHBondContact O-N 2.84Å; S12-H14 VanDerWaalsContact C-N 3.26Å; S12-H14 PolarHBondContact O-N 3.45Å | ||
| 13 | F | 49.1 | Very low | 50.9 | Low | 198 Ų | 198 | 136.6 Ų | 136.6 | 87% | 0.868 | 72% | 0.723 | S | S | * | * | trans | -67 | 89.1 | 175.1 | -157.1 | -91.4 | 0 | 0 | 0 | 107.6 | R11 G15 | R11-F13 PolarHBondContact O-N 3.26Å; F13-G15 PolarHBondContact O-N 3.32Å | ||
| 14 | H | 52.4 | Low | 50.4 | Low | 138 Ų | 138 | 134.2 Ų | 134.2 | 64% | 0.639 | 72% | 0.717 | S | S | * | * | trans | -81.2 | 108.2 | 165.2 | -82.3 | -9.1 | 0 | 0 | 0 | 107.4 | S12 H17 | S12-H14 VanDerWaalsContact C-N 3.26Å; S12-H14 PolarHBondContact O-N 3.45Å; H14-H17 WeakPolarHBondContact CB-NE2 3.36Å; H14-H17 AromaticContact CD2-CE1 4Å; H14-H17 AromaticContact CD2-NE2 3.44Å; H14-H17 PolarHBondContact CD2-NE2 2.99Å; H14-H17 AromaticContact CG-NE2 3.57Å | ||
| 15 | G | 58 | Low | 49.9 | Very low | 37 Ų | 37 | 132.5 Ų | 132.5 | 38% | 0.381 | 72% | 0.717 | S | S | . | * | trans | -54.4 | 168.1 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | F13 H17 | F13-G15 PolarHBondContact O-N 3.32Å; G15-H17 PolarHBondContact O-N 3.29Å | ||
| 16 | P | 47.7 | Very low | 49.1 | Very low | 138 Ų | 138 | 130.1 Ų | 130.1 | 90% | 0.896 | 71% | 0.713 | S | S | * | * | trans | -59.5 | 109.9 | -169.5 | 24.9 | -32.6 | 0 | 0 | 0 | 110.2 | S18 | P16-S18 PolarHBondContact O-N 3.03Š| ||
| 17 | H | 47.9 | Very low | 48.9 | Very low | 107 Ų | 107 | 128.8 Ų | 128.8 | 50% | 0.495 | 72% | 0.717 | S | S | . | * | trans | -63.2 | 127.6 | 173 | -71 | -88 | 0 | 0 | 0 | 108.3 | H14 G15 T19 C20 | H14-H17 WeakPolarHBondContact CB-NE2 3.36Å; H14-H17 AromaticContact CD2-CE1 4Å; H14-H17 AromaticContact CD2-NE2 3.44Å; H14-H17 PolarHBondContact CD2-NE2 2.99Å; H14-H17 AromaticContact CG-NE2 3.57Å; G15-H17 PolarHBondContact O-N 3.29Å; H17-T19 WeakPolarHBondContact CB-OG1 3.47Å; H17-T19 PolarHBondContact O-N 2.72Å; H17-C20 PolarHBondContact O-N 3.07Å | ||
| 18 | S | 50.2 | Low | 48.5 | Very low | 105 Ų | 105 | 127.7 Ų | 127.7 | 73% | 0.734 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -56.2 | -5.1 | 175.1 | 46.6 | 0 | 0 | 0 | 0 | 114.2 | P16 | P16-S18 PolarHBondContact O-N 3.03Š|
| 19 | T | 51.6 | Low | 47.9 | Very low | 104 Ų | 104 | 124.6 Ų | 124.6 | 64% | 0.638 | 71% | 0.713 | S | S | * | * | G | 310 helix | trans | -83.4 | -13.8 | -176.3 | 53 | 0 | 0 | 0 | 0 | 114.3 | H17 | H17-T19 WeakPolarHBondContact CB-OG1 3.47Å; H17-T19 PolarHBondContact O-N 2.72Å |
| 20 | C | 49.3 | Very low | 47.6 | Very low | 94 Ų | 94 | 120.4 Ų | 120.4 | 64% | 0.635 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -87.2 | -8.5 | 178 | -63.4 | 0 | 0 | 0 | 0 | 114.7 | H17 S23 | H17-C20 PolarHBondContact O-N 3.07Å; C20-S23 PolarHBondContact O-OG 3.29Å; C20-S23 VanDerWaalsContact O-OG 3.13Å |
| 21 | M | 45.8 | Very low | 47.1 | Very low | 165 Ų | 165 | 120.2 Ų | 120.2 | 81% | 0.813 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -76.3 | -26.9 | 177.5 | -87.7 | -87.1 | -153.9 | 0 | 0 | 112.6 | ||
| 22 | H | 46.9 | Very low | 46.9 | Very low | 163 Ų | 163 | 120 Ų | 120 | 76% | 0.755 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -79.5 | -21.5 | -177.7 | -85.3 | -61.2 | 0 | 0 | 0 | 114 | A24 | H22-A24 VanDerWaalsContact C-N 3.33Å; H22-A24 PolarHBondContact O-N 3.38Å |
| 23 | S | 47.9 | Very low | 46.5 | Very low | 103 Ų | 103 | 123.6 Ų | 123.6 | 72% | 0.72 | 73% | 0.731 | S | S | * | * | G | 310 helix | trans | -80 | -8.5 | 179.6 | 41 | 0 | 0 | 0 | 0 | 114.6 | C20 | C20-S23 PolarHBondContact O-OG 3.29Å; C20-S23 VanDerWaalsContact O-OG 3.13Å |
| 24 | A | 44.2 | Very low | 46.3 | Very low | 88 Ų | 88 | 119.8 Ų | 119.8 | 73% | 0.727 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -96.5 | -2.5 | 176 | 0 | 0 | 0 | 0 | 0 | 113.8 | H22 G26 | H22-A24 VanDerWaalsContact C-N 3.33Å; H22-A24 PolarHBondContact O-N 3.38Å; A24-G26 VanDerWaalsContact C-N 3.31Å; A24-G26 PolarHBondContact O-N 3.37Å; A24-G26 VanDerWaalsContact O-N 3.13Å |
| 25 | C | 44.3 | Very low | 46.1 | Very low | 110 Ų | 110 | 124.8 Ų | 124.8 | 74% | 0.743 | 74% | 0.737 | S | S | * | * | trans | -90.4 | 68.5 | 179.1 | -139.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 26 | G | 39.5 | Very low | 45.6 | Very low | 63 Ų | 63 | 127.5 Ų | 127.5 | 65% | 0.649 | 75% | 0.746 | S | S | * | * | trans | -64 | 132.3 | 161.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | A24 A28 | A24-G26 VanDerWaalsContact C-N 3.31Å; A24-G26 PolarHBondContact O-N 3.37Å; A24-G26 VanDerWaalsContact O-N 3.13Å; G26-A28 PolarHBondContact O-N 3.4Å | ||
| 27 | S | 45.4 | Very low | 45.8 | Very low | 123 Ų | 123 | 130 Ų | 130 | 86% | 0.86 | 74% | 0.743 | S | S | * | * | trans | -52.4 | 105.4 | 175.6 | 161.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 28 | A | 40.1 | Very low | 46 | Very low | 95 Ų | 95 | 133.3 Ų | 133.3 | 79% | 0.785 | 75% | 0.752 | S | S | * | * | trans | -121.7 | 117 | 164.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | G26 T30 | G26-A28 PolarHBondContact O-N 3.4Å; A28-T30 PolarHBondContact O-N 3.01Å | ||
| 29 | H | 41.4 | Very low | 46.3 | Very low | 165 Ų | 165 | 132.6 Ų | 132.6 | 76% | 0.764 | 74% | 0.74 | S | S | * | * | trans | -34.6 | 127.3 | 175.5 | -91.3 | -94 | 0 | 0 | 0 | 115.1 | T31 | H29-T31 PolarHBondContact O-N 3.38Š| ||
| 30 | T | 45.4 | Very low | 46.6 | Very low | 126 Ų | 126 | 133 Ų | 133 | 77% | 0.773 | 74% | 0.739 | S | S | * | * | trans | 19.5 | 91.3 | 138.2 | 56.4 | 0 | 0 | 0 | 0 | 116.9 | A28 | A28-T30 PolarHBondContact O-N 3.01Š| ||
| 31 | T | 38.3 | Very low | 46.9 | Very low | 117 Ų | 117 | 137.2 Ų | 137.2 | 72% | 0.718 | 75% | 0.747 | S | S | * | * | trans | -130.7 | 125.9 | 142.2 | 38.2 | 0 | 0 | 0 | 0 | 107.9 | H29 L33 | H29-T31 PolarHBondContact O-N 3.38Å; T31-L33 VanDerWaalsContact C-N 3.25Å; T31-L33 PolarHBondContact O-N 2.85Å | ||
| 32 | Q | 47.3 | Very low | 47.4 | Very low | 201 Ų | 201 | 133.9 Ų | 133.9 | 94% | 0.939 | 73% | 0.732 | S | S | * | * | trans | -67.7 | 83.3 | -179.2 | -135.7 | -173.2 | 12.5 | 0 | 0 | 108.6 | V34 | Q32-V34 PolarHBondContact O-N 2.92Å; Q32-V34 VanDerWaalsContact O-N 3.15Å | ||
| 33 | L | 44.5 | Very low | 47.9 | Very low | 155 Ų | 155 | 131 Ų | 131 | 81% | 0.812 | 72% | 0.722 | S | S | * | * | trans | -76.7 | 104.3 | 172 | -94.7 | 158.2 | 0 | 0 | 0 | 107.9 | T31 R35 | T31-L33 VanDerWaalsContact C-N 3.25Å; T31-L33 PolarHBondContact O-N 2.85Å; L33-R35 PolarHBondContact O-N 2.81Å | ||
| 34 | V | 44.8 | Very low | 48.3 | Very low | 119 Ų | 119 | 135.1 Ų | 135.1 | 72% | 0.721 | 72% | 0.723 | S | S | * | * | trans | -33.4 | 112.3 | 163.6 | 173 | 0 | 0 | 0 | 0 | 108.6 | Q32 T36 | Q32-V34 PolarHBondContact O-N 2.92Å; Q32-V34 VanDerWaalsContact O-N 3.15Å; V34-T36 HydrophobicContact CG1-CG2 4.3Å; V34-T36 PolarHBondContact O-N 3.49Å | ||
| 35 | R | 47.5 | Very low | 49 | Very low | 242 Ų | 242 | 136.8 Ų | 136.8 | 91% | 0.913 | 72% | 0.719 | S | S | * | * | trans | -63 | 76.6 | 178.8 | -172.1 | -179.5 | -170.1 | 157.3 | 2.1 | 109.3 | L33 K37 | L33-R35 PolarHBondContact O-N 2.81Å; R35-K37 PolarHBondContact O-N 3.46Å | ||
| 36 | T | 48.6 | Very low | 49.8 | Very low | 94 Ų | 94 | 140.6 Ų | 140.6 | 58% | 0.577 | 72% | 0.718 | S | S | * | * | trans | -76.5 | 120.2 | 159.8 | 52.7 | 0 | 0 | 0 | 0 | 106 | V34 Y38 | V34-T36 HydrophobicContact CG1-CG2 4.3Å; V34-T36 PolarHBondContact O-N 3.49Å; T36-Y38 PolarHBondContact O-N 3.05Å | ||
| 37 | K | 50.1 | Low | 50.9 | Low | 192 Ų | 192 | 141.2 Ų | 141.2 | 84% | 0.835 | 71% | 0.712 | S | S | * | * | trans | -65.9 | 65.4 | 179.1 | -171.2 | -175.6 | -178.8 | -176.7 | 0 | 109.4 | R35 N39 | R35-K37 PolarHBondContact O-N 3.46Å; K37-N39 PolarHBondContact O-N 3.09Å | ||
| 38 | Y | 53.4 | Low | 52.1 | Low | 176 Ų | 176 | 145.1 Ų | 145.1 | 69% | 0.69 | 71% | 0.707 | S | S | * | * | trans | -82.5 | 110.4 | 174.5 | -101.2 | -86.9 | 0 | 0 | 0 | 108.3 | T36 N40 | T36-Y38 PolarHBondContact O-N 3.05Å; Y38-N40 PolarHBondContact O-N 3.19Å | ||
| 39 | N | 56.6 | Low | 53.3 | Low | 89 Ų | 89 | 144.9 Ų | 144.9 | 48% | 0.476 | 70% | 0.699 | S | S | . | * | trans | -65.4 | 95.4 | 174.7 | -73.4 | -18.8 | 0 | 0 | 0 | 109.1 | K37 F41 D42 | K37-N39 PolarHBondContact O-N 3.09Å; N39-F41 PolarHBondContact O-N 3.22Å; N39-F41 VanDerWaalsContact O-N 3.07Å; N39-D42 HydrophobicContact CB-CB 4.09Å; N39-D42 WeakPolarHBondContact CB-OD2 3.38Å; N39-D42 PolarHBondContact ND2-OD2 2.93Å; N39-D42 WeakPolarHBondContact O-CB 3.26Å; N39-D42 PolarHBondContact O-N 3.48Å | ||
| 40 | N | 56.3 | Low | 55 | Low | 113 Ų | 113 | 142.3 Ų | 142.3 | 60% | 0.604 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -56.6 | -24.5 | 174.8 | -69 | -50.9 | 0 | 0 | 0 | 112.7 | Y38 L43 Y44 | Y38-N40 PolarHBondContact O-N 3.19Å; N40-L43 PolarHBondContact O-N 3.47Å; N40-Y44 PolarHBondContact O-N 2.9Å |
| 41 | F | 56.3 | Low | 56.6 | Low | 183 Ų | 183 | 143.9 Ų | 143.9 | 80% | 0.803 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -67 | -34.8 | 173 | -74.8 | -78.8 | 0 | 0 | 0 | 113.6 | N39 L43 Y44 L45 | N39-F41 PolarHBondContact O-N 3.22Å; N39-F41 VanDerWaalsContact O-N 3.07Å; F41-L43 VanDerWaalsContact C-N 3.33Å; F41-Y44 PolarHBondContact O-N 3.1Å; F41-L45 WeakPolarHBondContact O-CB 3.41Å; F41-L45 PolarHBondContact O-N 3.16Å |
| 42 | D | 56.4 | Low | 58.6 | Low | 94 Ų | 94 | 140.1 Ų | 140.1 | 50% | 0.503 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -67 | -37 | 175.9 | -92.5 | -52.1 | 0 | 0 | 0 | 111.2 | N39 L45 R46 | N39-D42 HydrophobicContact CB-CB 4.09Å; N39-D42 WeakPolarHBondContact CB-OD2 3.38Å; N39-D42 PolarHBondContact ND2-OD2 2.93Å; N39-D42 WeakPolarHBondContact O-CB 3.26Å; N39-D42 PolarHBondContact O-N 3.48Å; D42-L45 PolarHBondContact O-N 3.42Å; D42-R46 WeakPolarHBondContact O-CB 3.33Å; D42-R46 PolarHBondContact O-N 3.22Å |
| 43 | L | 58.2 | Low | 60.1 | Low | 104 Ų | 104 | 136.4 Ų | 136.4 | 55% | 0.545 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -63.2 | -41.6 | 174.5 | -82 | 158.4 | 0 | 0 | 0 | 111.7 | N40 F41 S47 | N40-L43 PolarHBondContact O-N 3.47Å; F41-L43 VanDerWaalsContact C-N 3.33Å; L43-S47 WeakPolarHBondContact O-CB 3.45Å; L43-S47 PolarHBondContact O-N 3.32Å |
| 44 | Y | 55.4 | Low | 62 | Low | 189 Ų | 189 | 134.6 Ų | 134.6 | 74% | 0.741 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -70.4 | -41.7 | 175.8 | -92.6 | -89.4 | 0 | 0 | 0 | 113 | N40 F41 S47 R48 | N40-Y44 PolarHBondContact O-N 2.9Å; F41-Y44 PolarHBondContact O-N 3.1Å; Y44-S47 PolarHBondContact O-N 3.29Å; Y44-R48 WeakPolarHBondContact O-CB 3.46Å; Y44-R48 PolarHBondContact O-N 2.89Å |
| 45 | L | 60.1 | Low | 63.7 | Low | 123 Ų | 123 | 135.1 Ų | 135.1 | 64% | 0.644 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -66.1 | -42.7 | 177.8 | -152.5 | 84.3 | 0 | 0 | 0 | 110.8 | F41 D42 R48 C49 | F41-L45 WeakPolarHBondContact O-CB 3.41Å; F41-L45 PolarHBondContact O-N 3.16Å; D42-L45 PolarHBondContact O-N 3.42Å; L45-R48 PolarHBondContact O-N 3.1Å; L45-C49 VanDerWaalsContact O-CB 3.3Å; L45-C49 WeakPolarHBondContact O-CB 3.17Å; L45-C49 PolarHBondContact O-N 3.42Å |
| 46 | R | 60.2 | Low | 65.5 | Low | 190 Ų | 190 | 129.5 Ų | 129.5 | 72% | 0.717 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -67 | -38.2 | 175 | -170.3 | 163 | -178.2 | 161.6 | -1.1 | 111.9 | D42 C49 M50 | D42-R46 WeakPolarHBondContact O-CB 3.33Å; D42-R46 PolarHBondContact O-N 3.22Å; R46-C49 PolarHBondContact O-N 2.95Å; R46-M50 HydrophobicContact CG-CG 4.42Å; R46-M50 VanDerWaalsContact O-CB 3.25Å; R46-M50 WeakPolarHBondContact O-CB 3.33Å; R46-M50 WeakPolarHBondContact O-CG 3.36Å; R46-M50 PolarHBondContact O-N 2.93Å |
| 47 | S | 63.4 | Low | 67.3 | Low | 75 Ų | 75 | 129.5 Ų | 129.5 | 52% | 0.524 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -66.1 | -41.5 | 173.7 | -177.2 | 0 | 0 | 0 | 0 | 112.1 | L43 Y44 M50 Y51 | L43-S47 WeakPolarHBondContact O-CB 3.45Å; L43-S47 PolarHBondContact O-N 3.32Å; Y44-S47 PolarHBondContact O-N 3.29Å; S47-M50 PolarHBondContact O-N 2.79Å; S47-Y51 VanDerWaalsContact O-CB 3.3Å; S47-Y51 WeakPolarHBondContact O-CB 3.35Å; S47-Y51 PolarHBondContact O-N 3.35Å |
| 48 | R | 68.9 | Low | 69 | Low | 205 Ų | 205 | 125.7 Ų | 125.7 | 77% | 0.774 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -66.9 | -38.8 | 175.5 | -166.7 | 173.3 | -173.7 | 171.3 | 0.9 | 112.3 | Y44 L45 G52 | Y44-R48 WeakPolarHBondContact O-CB 3.46Å; Y44-R48 PolarHBondContact O-N 2.89Å; L45-R48 PolarHBondContact O-N 3.1Å; R48-G52 PolarHBondContact O-N 3.17Å |
| 49 | C | 67.2 | Low | 70.4 | Confident | 91 Ų | 91 | 121.5 Ų | 121.5 | 62% | 0.615 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -68.1 | -43.7 | 174.8 | -163.5 | 0 | 0 | 0 | 0 | 111.3 | L45 R46 Y51 G52 F53 | L45-C49 VanDerWaalsContact O-CB 3.3Å; L45-C49 WeakPolarHBondContact O-CB 3.17Å; L45-C49 PolarHBondContact O-N 3.42Å; R46-C49 PolarHBondContact O-N 2.95Å; C49-Y51 PolarHBondContact O-N 2.77Å; C49-G52 PolarHBondContact O-N 2.82Å; C49-F53 VanDerWaalsContact O-CB 3.32Å; C49-F53 WeakPolarHBondContact O-CB 3.5Å; C49-F53 PolarHBondContact O-N 3.42Å |
| 50 | M | 77.1 | Confident | 71.8 | Confident | 111 Ų | 111 | 122.2 Ų | 122.2 | 55% | 0.547 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -61.9 | -42.7 | 174 | -73.4 | -98.8 | 76.2 | 0 | 0 | 111.8 | R46 S47 F53 L54 | R46-M50 HydrophobicContact CG-CG 4.42Å; R46-M50 VanDerWaalsContact O-CB 3.25Å; R46-M50 WeakPolarHBondContact O-CB 3.33Å; R46-M50 WeakPolarHBondContact O-CG 3.36Å; R46-M50 PolarHBondContact O-N 2.93Å; S47-M50 PolarHBondContact O-N 2.79Å; M50-F53 PolarHBondContact O-N 3.29Å; M50-L54 VanDerWaalsContact O-CB 3.24Å; M50-L54 WeakPolarHBondContact O-CB 3.19Å; M50-L54 PolarHBondContact O-N 2.88Å |
| 51 | Y | 78.4 | Confident | 73.2 | Confident | 158 Ų | 158 | 118 Ų | 118 | 62% | 0.62 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -64.6 | -42.8 | 176.2 | -178.1 | -97.5 | 0 | 0 | 0 | 111.8 | S47 C49 L54 R55 | S47-Y51 VanDerWaalsContact O-CB 3.3Å; S47-Y51 WeakPolarHBondContact O-CB 3.35Å; S47-Y51 PolarHBondContact O-N 3.35Å; C49-Y51 PolarHBondContact O-N 2.77Å; Y51-L54 PolarHBondContact O-N 2.9Å; Y51-R55 VanDerWaalsContact O-CB 3.24Å; Y51-R55 WeakPolarHBondContact O-CB 3.34Å; Y51-R55 PolarHBondContact O-N 3.38Å |
| 52 | G | 79.3 | Confident | 74.5 | Confident | 38 Ų | 38 | 111 Ų | 111 | 39% | 0.392 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.9 | -43.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | R48 C49 R55 F56 | R48-G52 PolarHBondContact O-N 3.17Å; C49-G52 PolarHBondContact O-N 2.82Å; G52-R55 PolarHBondContact O-N 3.38Å; G52-F56 WeakPolarHBondContact O-CB 3.39Å; G52-F56 PolarHBondContact O-N 3.31Å |
| 53 | F | 80 | Confident | 75.9 | Confident | 124 Ų | 124 | 110 Ų | 110 | 54% | 0.544 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -66.3 | -42.6 | 177.3 | -172.1 | -94.7 | 0 | 0 | 0 | 112.2 | C49 M50 R55 F56 L57 | C49-F53 VanDerWaalsContact O-CB 3.32Å; C49-F53 WeakPolarHBondContact O-CB 3.5Å; C49-F53 PolarHBondContact O-N 3.42Å; M50-F53 PolarHBondContact O-N 3.29Å; F53-R55 VanDerWaalsContact C-N 3.33Å; F53-R55 PolarHBondContact O-N 3.01Å; F53-F56 PolarHBondContact O-N 3.5Å; F53-L57 WeakPolarHBondContact O-CB 3.49Å; F53-L57 PolarHBondContact O-N 2.81Å |
| 54 | L | 82.9 | Confident | 77.2 | Confident | 116 Ų | 116 | 108.7 Ų | 108.7 | 61% | 0.607 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.8 | -41.5 | 176.6 | -163.5 | 77.1 | 0 | 0 | 0 | 111 | M50 Y51 L57 L58 | M50-L54 VanDerWaalsContact O-CB 3.24Å; M50-L54 WeakPolarHBondContact O-CB 3.19Å; M50-L54 PolarHBondContact O-N 2.88Å; Y51-L54 PolarHBondContact O-N 2.9Å; L54-L57 PolarHBondContact O-N 3.33Å; L54-L58 WeakPolarHBondContact O-CB 3.37Å; L54-L58 PolarHBondContact O-N 2.73Å |
| 55 | R | 82.1 | Confident | 78.7 | Confident | 130 Ų | 130 | 104.9 Ų | 104.9 | 49% | 0.491 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.7 | -42.6 | 175.5 | -173.7 | 171.3 | -174.8 | -150.8 | -10.4 | 111.4 | Y51 G52 F53 L58 Y59 | Y51-R55 VanDerWaalsContact O-CB 3.24Å; Y51-R55 WeakPolarHBondContact O-CB 3.34Å; Y51-R55 PolarHBondContact O-N 3.38Å; G52-R55 PolarHBondContact O-N 3.38Å; F53-R55 VanDerWaalsContact C-N 3.33Å; F53-R55 PolarHBondContact O-N 3.01Å; R55-L58 PolarHBondContact O-N 3.29Å; R55-Y59 HydrophobicContact CG-CD2 3.74Å; R55-Y59 HydrophobicContact CG-CE2 3.29Å; R55-Y59 PolarHBondContact NE-OH 3.49Å; R55-Y59 PolarHBondContact NH2-OH 3.42Å; R55-Y59 WeakPolarHBondContact O-CD2 3.31Å; R55-Y59 PolarHBondContact O-N 2.89Å |
| 56 | F | 83.8 | Confident | 79.9 | Confident | 124 Ų | 124 | 99.9 Ų | 99.9 | 54% | 0.544 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.8 | -48.5 | 173.3 | 176.1 | -97.5 | 0 | 0 | 0 | 111.6 | G52 F53 L58 Y59 F60 | G52-F56 WeakPolarHBondContact O-CB 3.39Å; G52-F56 PolarHBondContact O-N 3.31Å; F53-F56 PolarHBondContact O-N 3.5Å; F56-L58 VanDerWaalsContact C-N 3.28Å; F56-L58 PolarHBondContact O-N 3.33Å; F56-Y59 PolarHBondContact O-N 3.43Å; F56-F60 HydrophobicContact CE1-CB 4.3Å; F56-F60 HydrophobicContact CE1-CG 4.43Å; F56-F60 HydrophobicContact CZ-CB 4.37Å; F56-F60 HydrophobicContact CZ-CD2 4.47Å; F56-F60 HydrophobicContact CZ-CG 4.41Å; F56-F60 WeakPolarHBondContact O-CB 3.5Å; F56-F60 PolarHBondContact O-N 2.98Å |
| 57 | L | 87.3 | Confident | 81.1 | Confident | 94 Ų | 94 | 93.2 Ų | 93.2 | 49% | 0.492 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.1 | -39 | 179.2 | -168.8 | 73.6 | 0 | 0 | 0 | 111.6 | F53 L54 G61 | F53-L57 WeakPolarHBondContact O-CB 3.49Å; F53-L57 PolarHBondContact O-N 2.81Å; L54-L57 PolarHBondContact O-N 3.33Å; L57-G61 WeakPolarHBondContact O-CA 3.25Å; L57-G61 PolarHBondContact O-N 2.93Å |
| 58 | L | 85.6 | Confident | 82.3 | Confident | 113 Ų | 113 | 94.8 Ų | 94.8 | 59% | 0.592 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -64.2 | -51.6 | 176.8 | -165.8 | 86.8 | 0 | 0 | 0 | 111.1 | L54 R55 F56 G61 C62 | L54-L58 WeakPolarHBondContact O-CB 3.37Å; L54-L58 PolarHBondContact O-N 2.73Å; R55-L58 PolarHBondContact O-N 3.29Å; F56-L58 VanDerWaalsContact C-N 3.28Å; F56-L58 PolarHBondContact O-N 3.33Å; L58-G61 PolarHBondContact O-N 3.48Å; L58-C62 WeakPolarHBondContact O-CB 3.45Å; L58-C62 PolarHBondContact O-N 3.25Å; L58-C62 PolarHBondContact O-SG 2.89Å; L58-C62 VanDerWaalsContact O-SG 3.39Å |
| 59 | Y | 83.8 | Confident | 83.3 | Confident | 87 Ų | 87 | 88.9 Ų | 88.9 | 34% | 0.341 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -66.4 | -41.9 | 179.8 | -69.4 | -55.2 | 0 | 0 | 0 | 112.5 | R55 F56 C62 S63 | R55-Y59 HydrophobicContact CG-CD2 3.74Å; R55-Y59 HydrophobicContact CG-CE2 3.29Å; R55-Y59 PolarHBondContact NE-OH 3.49Å; R55-Y59 PolarHBondContact NH2-OH 3.42Å; R55-Y59 WeakPolarHBondContact O-CD2 3.31Å; R55-Y59 PolarHBondContact O-N 2.89Å; F56-Y59 PolarHBondContact O-N 3.43Å; Y59-C62 PolarHBondContact O-N 3.09Å; Y59-S63 WeakPolarHBondContact O-CB 3.16Å; Y59-S63 PolarHBondContact O-N 3.05Å |
| 60 | F | 85.2 | Confident | 84.2 | Confident | 104 Ų | 104 | 89.3 Ų | 89.3 | 46% | 0.456 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -64.2 | -42.9 | 176.6 | -177 | -110.9 | 0 | 0 | 0 | 111.3 | F56 S63 L64 | F56-F60 HydrophobicContact CE1-CB 4.3Å; F56-F60 HydrophobicContact CE1-CG 4.43Å; F56-F60 HydrophobicContact CZ-CB 4.37Å; F56-F60 HydrophobicContact CZ-CD2 4.47Å; F56-F60 HydrophobicContact CZ-CG 4.41Å; F56-F60 WeakPolarHBondContact O-CB 3.5Å; F56-F60 PolarHBondContact O-N 2.98Å; F60-S63 PolarHBondContact O-N 2.95Å; F60-L64 HydrophobicContact CD1-CD1 3.71Å; F60-L64 HydrophobicContact CE1-CD1 3.24Å; F60-L64 HydrophobicContact CE1-CG 4.2Å; F60-L64 HydrophobicContact CE2-CD1 4.24Å; F60-L64 HydrophobicContact CE2-CG 4.37Å; F60-L64 HydrophobicContact CG-CD1 4.38Å; F60-L64 HydrophobicContact CZ-CD1 3.55Å; F60-L64 HydrophobicContact CZ-CG 4.11Å; F60-L64 WeakPolarHBondContact O-CB 3.27Å; F60-L64 WeakPolarHBondContact O-CG 3.48Å; F60-L64 PolarHBondContact O-N 2.95Å |
| 61 | G | 86 | Confident | 84.8 | Confident | 25 Ų | 25 | 88.7 Ų | 88.7 | 26% | 0.258 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -62.3 | -46.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | L57 L58 S63 L64 L65 | L57-G61 WeakPolarHBondContact O-CA 3.25Å; L57-G61 PolarHBondContact O-N 2.93Å; L58-G61 PolarHBondContact O-N 3.48Å; G61-S63 PolarHBondContact O-N 2.71Å; G61-L64 PolarHBondContact O-N 3.19Å; G61-L65 WeakPolarHBondContact O-CB 3.06Å; G61-L65 VanDerWaalsContact O-CG 3.27Å; G61-L65 WeakPolarHBondContact O-CG 3.38Å; G61-L65 PolarHBondContact O-N 3.37Å |
| 62 | C | 84.3 | Confident | 85.4 | Confident | 37 Ų | 37 | 83.5 Ų | 83.5 | 25% | 0.25 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -61.3 | -42.9 | 175.2 | -77.9 | 0 | 0 | 0 | 0 | 112.4 | L58 Y59 L65 T66 F136 | L58-C62 WeakPolarHBondContact O-CB 3.45Å; L58-C62 PolarHBondContact O-N 3.25Å; L58-C62 PolarHBondContact O-SG 2.89Å; L58-C62 VanDerWaalsContact O-SG 3.39Å; Y59-C62 PolarHBondContact O-N 3.09Å; C62-L65 PolarHBondContact O-N 3.04Å; C62-T66 WeakPolarHBondContact O-CB 3.31Å; C62-T66 VanDerWaalsContact O-CG2 3.27Å; C62-T66 WeakPolarHBondContact O-CG2 3.39Å; C62-T66 PolarHBondContact O-N 2.99Å; C62-T66 PolarHBondContact O-OG1 3.49Å; C62-F136 HydrophobicContact CB-CD1 4.15Å; C62-F136 HydrophobicContact CB-CE1 3.4Å; C62-F136 HydrophobicContact CB-CE2 4.47Å; C62-F136 HydrophobicContact CB-CZ 3.6Å |
| 63 | S | 84.1 | Confident | 85.9 | Confident | 71 Ų | 71 | 82 Ų | 82 | 50% | 0.497 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -64 | -43.4 | 176.1 | 177.2 | 0 | 0 | 0 | 0 | 111.8 | Y59 F60 G61 T66 S67 | Y59-S63 WeakPolarHBondContact O-CB 3.16Å; Y59-S63 PolarHBondContact O-N 3.05Å; F60-S63 PolarHBondContact O-N 2.95Å; G61-S63 PolarHBondContact O-N 2.71Å; S63-T66 WeakPolarHBondContact CA-OG1 3.38Å; S63-T66 PolarHBondContact O-OG1 2.92Å; S63-S67 WeakPolarHBondContact O-CB 3.42Å; S63-S67 PolarHBondContact O-N 3.27Å; S63-S67 PolarHBondContact O-OG 3.02Å |
| 64 | L | 87.3 | Confident | 86.2 | Confident | 78 Ų | 78 | 79.4 Ų | 79.4 | 41% | 0.408 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.5 | -49.8 | 174.7 | -81.4 | 171.9 | 0 | 0 | 0 | 112 | F60 G61 T66 S67 L68 | F60-L64 HydrophobicContact CD1-CD1 3.71Å; F60-L64 HydrophobicContact CE1-CD1 3.24Å; F60-L64 HydrophobicContact CE1-CG 4.2Å; F60-L64 HydrophobicContact CE2-CD1 4.24Å; F60-L64 HydrophobicContact CE2-CG 4.37Å; F60-L64 HydrophobicContact CG-CD1 4.38Å; F60-L64 HydrophobicContact CZ-CD1 3.55Å; F60-L64 HydrophobicContact CZ-CG 4.11Å; F60-L64 WeakPolarHBondContact O-CB 3.27Å; F60-L64 WeakPolarHBondContact O-CG 3.48Å; F60-L64 PolarHBondContact O-N 2.95Å; G61-L64 PolarHBondContact O-N 3.19Å; L64-T66 VanDerWaalsContact C-N 3.32Å; L64-T66 PolarHBondContact O-N 3.5Å; L64-S67 PolarHBondContact O-N 3.34Å; L64-S67 PolarHBondContact O-OG 3.38Å; L64-L68 WeakPolarHBondContact O-CB 3.44Å; L64-L68 WeakPolarHBondContact O-CG 3.39Å; L64-L68 PolarHBondContact O-N 3.24Å |
| 65 | L | 86.3 | Confident | 86.6 | Confident | 108 Ų | 108 | 76.1 Ų | 76.1 | 57% | 0.565 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -59.8 | -43.1 | -180 | -75.1 | 171.8 | 0 | 0 | 0 | 111.8 | G61 C62 L68 L69 | G61-L65 WeakPolarHBondContact O-CB 3.06Å; G61-L65 VanDerWaalsContact O-CG 3.27Å; G61-L65 WeakPolarHBondContact O-CG 3.38Å; G61-L65 PolarHBondContact O-N 3.37Å; C62-L65 PolarHBondContact O-N 3.04Å; L65-L68 PolarHBondContact O-N 3.3Å; L65-L69 WeakPolarHBondContact O-CB 3.25Å; L65-L69 VanDerWaalsContact O-CG 3.28Å; L65-L69 WeakPolarHBondContact O-CG 3.41Å; L65-L69 PolarHBondContact O-N 3.18Å |
| 66 | T | 85.1 | Confident | 87 | Confident | 18 Ų | 18 | 73.9 Ų | 73.9 | 11% | 0.11 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -64.8 | -41.8 | 177.3 | 48.5 | 0 | 0 | 0 | 0 | 111.8 | C62 S63 L64 L69 W70 F136 | C62-T66 WeakPolarHBondContact O-CB 3.31Å; C62-T66 VanDerWaalsContact O-CG2 3.27Å; C62-T66 WeakPolarHBondContact O-CG2 3.39Å; C62-T66 PolarHBondContact O-N 2.99Å; C62-T66 PolarHBondContact O-OG1 3.49Å; S63-T66 WeakPolarHBondContact CA-OG1 3.38Å; S63-T66 PolarHBondContact O-OG1 2.92Å; L64-T66 VanDerWaalsContact C-N 3.32Å; L64-T66 PolarHBondContact O-N 3.5Å; T66-L69 PolarHBondContact O-N 3.48Å; T66-W70 PolarHBondContact O-N 3.18Å; T66-F136 HydrophobicContact CG2-CD2 4.19Å; T66-F136 HydrophobicContact CG2-CE2 4.42Å |
| 67 | S | 85.3 | Confident | 87.2 | Confident | 50 Ų | 50 | 71.9 Ų | 71.9 | 35% | 0.35 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -62.5 | -42.7 | 174.5 | 75.8 | 0 | 0 | 0 | 0 | 112.4 | S63 L64 W70 V71 | S63-S67 WeakPolarHBondContact O-CB 3.42Å; S63-S67 PolarHBondContact O-N 3.27Å; S63-S67 PolarHBondContact O-OG 3.02Å; L64-S67 PolarHBondContact O-N 3.34Å; L64-S67 PolarHBondContact O-OG 3.38Å; S67-W70 WeakPolarHBondContact O-CB 3.33Å; S67-W70 PolarHBondContact O-N 3.4Å; S67-V71 WeakPolarHBondContact O-CG2 3.31Å; S67-V71 PolarHBondContact O-N 2.95Å |
| 68 | L | 89.6 | Confident | 87.2 | Confident | 109 Ų | 109 | 71 Ų | 71 | 57% | 0.571 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -65.5 | -40.5 | 177.3 | -74.3 | 173.8 | 0 | 0 | 0 | 111.8 | L64 L65 W70 V71 A72 | L64-L68 WeakPolarHBondContact O-CB 3.44Å; L64-L68 WeakPolarHBondContact O-CG 3.39Å; L64-L68 PolarHBondContact O-N 3.24Å; L65-L68 PolarHBondContact O-N 3.3Å; L68-W70 VanDerWaalsContact C-N 3.29Å; L68-W70 PolarHBondContact O-N 3.23Å; L68-V71 PolarHBondContact O-N 3.21Å; L68-A72 WeakPolarHBondContact O-CB 3.43Å; L68-A72 PolarHBondContact O-N 2.92Å |
| 69 | L | 88.6 | Confident | 87.4 | Confident | 80 Ų | 80 | 71.1 Ų | 71.1 | 42% | 0.419 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -60.4 | -40 | 174.8 | -79.4 | 164.3 | 0 | 0 | 0 | 111.4 | L65 T66 A72 L73 L129 | L65-L69 WeakPolarHBondContact O-CB 3.25Å; L65-L69 VanDerWaalsContact O-CG 3.28Å; L65-L69 WeakPolarHBondContact O-CG 3.41Å; L65-L69 PolarHBondContact O-N 3.18Å; T66-L69 PolarHBondContact O-N 3.48Å; L69-A72 PolarHBondContact O-N 2.85Å; L69-L73 WeakPolarHBondContact O-CB 3.43Å; L69-L73 WeakPolarHBondContact O-CG 3.33Å; L69-L73 PolarHBondContact O-N 3.43Å; L69-L129 HydrophobicContact CB-CD2 4.43Å; L69-L129 HydrophobicContact CD1-CD2 4.02Å |
| 70 | W | 86.5 | Confident | 87.7 | Confident | 100 Ų | 100 | 68 Ų | 68 | 38% | 0.379 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -64.5 | -44.4 | 174.9 | -97.9 | 97.8 | 0 | 0 | 0 | 112.9 | T66 S67 L68 A72 L73 S74 V126 F133 | T66-W70 PolarHBondContact O-N 3.18Å; S67-W70 WeakPolarHBondContact O-CB 3.33Å; S67-W70 PolarHBondContact O-N 3.4Å; L68-W70 VanDerWaalsContact C-N 3.29Å; L68-W70 PolarHBondContact O-N 3.23Å; W70-A72 VanDerWaalsContact C-N 3.35Å; W70-L73 WeakPolarHBondContact O-CB 3.45Å; W70-L73 PolarHBondContact O-N 3.24Å; W70-S74 PolarHBondContact O-N 3.44Å; W70-V126 HydrophobicContact CH2-CG1 4.43Å; W70-F133 AromaticContact CD1-CD2 3.53Å; W70-F133 AromaticContact CD1-CE2 3.91Å; W70-F133 AromaticContact NE1-CD2 3.5Å; W70-F133 AromaticContact NE1-CG 3.92Å |
| 71 | V | 90.1 | Very high | 87.8 | Confident | 99 Ų | 99 | 69.3 Ų | 69.3 | 60% | 0.6 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -62.7 | -44.3 | 175.3 | 174.1 | 0 | 0 | 0 | 0 | 110.7 | S67 L68 L73 S74 A75 | S67-V71 WeakPolarHBondContact O-CG2 3.31Å; S67-V71 PolarHBondContact O-N 2.95Å; L68-V71 PolarHBondContact O-N 3.21Å; V71-L73 VanDerWaalsContact C-N 3.33Å; V71-L73 PolarHBondContact O-N 3.06Å; V71-S74 PolarHBondContact O-N 2.94Å; V71-A75 PolarHBondContact O-N 3.29Å |
| 72 | A | 90.1 | Very high | 87.8 | Confident | 49 Ų | 49 | 73.4 Ų | 73.4 | 41% | 0.405 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -61 | -41.8 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | L68 L69 W70 A75 L76 | L68-A72 WeakPolarHBondContact O-CB 3.43Å; L68-A72 PolarHBondContact O-N 2.92Å; L69-A72 PolarHBondContact O-N 2.85Å; W70-A72 VanDerWaalsContact C-N 3.35Å; A72-A75 PolarHBondContact O-N 3.29Å; A72-L76 WeakPolarHBondContact O-CB 3.45Å; A72-L76 WeakPolarHBondContact O-CG 3.04Å; A72-L76 PolarHBondContact O-N 3.15Å |
| 73 | L | 89.4 | Confident | 87.8 | Confident | 5 Ų | 5 | 74 Ų | 74 | 3% | 0.026 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -60.7 | -48.2 | 173.4 | -85.3 | 172.9 | 0 | 0 | 0 | 112.3 | L69 W70 V71 A75 L76 F77 L125 V126 L129 | L69-L73 WeakPolarHBondContact O-CB 3.43Å; L69-L73 WeakPolarHBondContact O-CG 3.33Å; L69-L73 PolarHBondContact O-N 3.43Å; W70-L73 WeakPolarHBondContact O-CB 3.45Å; W70-L73 PolarHBondContact O-N 3.24Å; V71-L73 VanDerWaalsContact C-N 3.33Å; V71-L73 PolarHBondContact O-N 3.06Å; L73-A75 VanDerWaalsContact C-N 3.27Å; L73-A75 PolarHBondContact O-N 3.03Å; L73-L76 WeakPolarHBondContact O-CB 3.48Å; L73-L76 PolarHBondContact O-N 3.34Å; L73-L76 VanDerWaalsContact O-N 3.15Å; L73-F77 WeakPolarHBondContact O-CD2 3.44Å; L73-F77 PolarHBondContact O-N 3.37Å; L73-L125 HydrophobicContact CD2-CB 3.8Å; L73-L125 HydrophobicContact CD2-CD2 3.79Å; L73-L125 HydrophobicContact CD2-CG 4.44Å; L73-L125 HydrophobicContact CG-CD2 4.49Å; L73-V126 HydrophobicContact CD1-CG2 4.17Å; L73-V126 HydrophobicContact CD2-CG2 4.27Å; L73-L129 HydrophobicContact CD1-CB 4.13Å; L73-L129 HydrophobicContact CD1-CD1 3.36Å; L73-L129 HydrophobicContact CD1-CG 4.35Å; L73-L129 HydrophobicContact CG-CD1 4.11Å |
| 74 | S | 86.9 | Confident | 87.9 | Confident | 70 Ų | 70 | 71.7 Ų | 71.7 | 49% | 0.49 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -58.5 | -42.9 | 177.4 | -173.1 | 0 | 0 | 0 | 0 | 111.2 | W70 V71 F77 C78 | W70-S74 PolarHBondContact O-N 3.44Å; V71-S74 PolarHBondContact O-N 2.94Å; S74-F77 PolarHBondContact O-N 2.92Å; S74-C78 PolarHBondContact O-N 3.07Å; S74-C78 PolarHBondContact O-SG 3.22Å; S74-C78 VanDerWaalsContact O-SG 3.38Å |
| 75 | A | 91.4 | Very high | 87.9 | Confident | 48 Ų | 48 | 74.1 Ų | 74.1 | 40% | 0.397 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -63.5 | -41.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | V71 A72 L73 C78 L79 | V71-A75 PolarHBondContact O-N 3.29Å; A72-A75 PolarHBondContact O-N 3.29Å; L73-A75 VanDerWaalsContact C-N 3.27Å; L73-A75 PolarHBondContact O-N 3.03Å; A75-C78 PolarHBondContact O-N 2.94Å; A75-L79 WeakPolarHBondContact O-CB 3.48Å; A75-L79 WeakPolarHBondContact O-CG 3.44Å; A75-L79 PolarHBondContact O-N 2.88Å |
| 76 | L | 90.3 | Very high | 87.9 | Confident | 83 Ų | 83 | 72.8 Ų | 72.8 | 44% | 0.435 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -60.7 | -43.2 | 174.1 | -76.5 | 170 | 0 | 0 | 0 | 111.7 | A72 L73 C78 L79 Q80 | A72-L76 WeakPolarHBondContact O-CB 3.45Å; A72-L76 WeakPolarHBondContact O-CG 3.04Å; A72-L76 PolarHBondContact O-N 3.15Å; L73-L76 WeakPolarHBondContact O-CB 3.48Å; L73-L76 PolarHBondContact O-N 3.34Å; L73-L76 VanDerWaalsContact O-N 3.15Å; L76-C78 PolarHBondContact O-N 3.34Å; L76-L79 PolarHBondContact O-N 3.22Å; L76-Q80 WeakPolarHBondContact O-CB 3.28Å; L76-Q80 VanDerWaalsContact O-CG 3.31Å; L76-Q80 WeakPolarHBondContact O-CG 3.45Å; L76-Q80 PolarHBondContact O-N 2.94Å |
| 77 | F | 87.8 | Confident | 87.9 | Confident | 81 Ų | 81 | 74.9 Ų | 74.9 | 36% | 0.355 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -60.7 | -44.5 | 174.6 | -95.3 | -83.5 | 0 | 0 | 0 | 112.2 | L73 S74 Q80 Y81 V126 | L73-F77 WeakPolarHBondContact O-CD2 3.44Å; L73-F77 PolarHBondContact O-N 3.37Å; S74-F77 PolarHBondContact O-N 2.92Å; F77-Q80 PolarHBondContact O-N 3.42Å; F77-Y81 WeakPolarHBondContact O-CB 3.5Å; F77-Y81 PolarHBondContact O-N 2.83Å; F77-V126 HydrophobicContact CD2-CG2 4.21Å; F77-V126 HydrophobicContact CE2-CG2 3.32Å; F77-V126 HydrophobicContact CZ-CG2 3.97Å |
| 78 | C | 88.7 | Confident | 87.9 | Confident | 77 Ų | 77 | 78 Ų | 78 | 52% | 0.52 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -62.4 | -43.3 | 175.8 | -69 | 0 | 0 | 0 | 0 | 111.9 | S74 A75 L76 Y81 M82 | S74-C78 PolarHBondContact O-N 3.07Å; S74-C78 PolarHBondContact O-SG 3.22Å; S74-C78 VanDerWaalsContact O-SG 3.38Å; A75-C78 PolarHBondContact O-N 2.94Å; L76-C78 PolarHBondContact O-N 3.34Å; C78-Y81 PolarHBondContact O-N 2.88Å; C78-M82 WeakPolarHBondContact O-CG 3.43Å; C78-M82 PolarHBondContact O-N 3.49Å |
| 79 | L | 89 | Confident | 87.8 | Confident | 115 Ų | 115 | 80.7 Ų | 80.7 | 60% | 0.602 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -63.8 | -40.9 | 176 | -76.9 | 170.1 | 0 | 0 | 0 | 111.8 | A75 L76 M82 S83 | A75-L79 WeakPolarHBondContact O-CB 3.48Å; A75-L79 WeakPolarHBondContact O-CG 3.44Å; A75-L79 PolarHBondContact O-N 2.88Å; L76-L79 PolarHBondContact O-N 3.22Å; L79-M82 PolarHBondContact O-N 3.12Å; L79-S83 VanDerWaalsContact O-CB 3.27Å; L79-S83 WeakPolarHBondContact O-CB 3.45Å; L79-S83 PolarHBondContact O-N 3.42Å; L79-S83 PolarHBondContact O-OG 3.24Å |
| 80 | Q | 89 | Confident | 87.5 | Confident | 20 Ų | 20 | 81.6 Ų | 81.6 | 9% | 0.093 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -62.2 | -44.9 | 174.1 | -78 | -178.1 | -13.6 | 0 | 0 | 111.3 | L76 F77 M82 S83 A84 F115 S118 M119 T122 | L76-Q80 WeakPolarHBondContact O-CB 3.28Å; L76-Q80 VanDerWaalsContact O-CG 3.31Å; L76-Q80 WeakPolarHBondContact O-CG 3.45Å; L76-Q80 PolarHBondContact O-N 2.94Å; F77-Q80 PolarHBondContact O-N 3.42Å; Q80-M82 PolarHBondContact O-N 2.92Å; Q80-S83 VanDerWaalsContact CA-OG 3.25Å; Q80-S83 WeakPolarHBondContact CA-OG 3.33Å; Q80-S83 PolarHBondContact O-N 3.44Å; Q80-S83 PolarHBondContact O-OG 3.24Å; Q80-A84 WeakPolarHBondContact O-CB 3.39Å; Q80-A84 PolarHBondContact O-N 2.95Å; Q80-F115 VanDerWaalsContact O-CZ 3.31Å; Q80-F115 WeakPolarHBondContact O-CZ 3.21Å; Q80-S118 PolarHBondContact NE2-O 2.98Å; Q80-S118 PolarHBondContact NE2-OG 3.45Å; Q80-M119 HydrophobicContact CB-CE 3.84Å; Q80-M119 HydrophobicContact CB-SD 4.41Å; Q80-M119 PolarHBondContact OE1-SD 3.44Å; Q80-T122 PolarHBondContact OE1-OG1 2.94Å; Q80-T122 VanDerWaalsContact OE1-OG1 3.09Å |
| 81 | Y | 87.4 | Confident | 87.3 | Confident | 132 Ų | 132 | 79 Ų | 79 | 52% | 0.518 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -61 | -46.5 | 175.7 | 179.1 | -97.8 | 0 | 0 | 0 | 112.7 | F77 C78 A84 R85 | F77-Y81 WeakPolarHBondContact O-CB 3.5Å; F77-Y81 PolarHBondContact O-N 2.83Å; C78-Y81 PolarHBondContact O-N 2.88Å; Y81-A84 PolarHBondContact O-N 3.43Å; Y81-R85 PolarHBondContact O-N 3.28Å; Y81-R85 VanDerWaalsContact O-N 3.1Å; Y81-R85 PolarHBondContact OH-NE 2.96Å |
| 82 | M | 87.3 | Confident | 87 | Confident | 111 Ų | 111 | 82.3 Ų | 82.3 | 55% | 0.547 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -65.8 | -42.2 | 179.2 | -71.7 | -62.5 | -79.5 | 0 | 0 | 111.7 | C78 L79 Q80 R85 V86 | C78-M82 WeakPolarHBondContact O-CG 3.43Å; C78-M82 PolarHBondContact O-N 3.49Å; L79-M82 PolarHBondContact O-N 3.12Å; Q80-M82 PolarHBondContact O-N 2.92Å; M82-R85 PolarHBondContact O-N 3.32Å; M82-V86 WeakPolarHBondContact O-CG2 3.34Å; M82-V86 PolarHBondContact O-N 2.89Å |
| 83 | S | 84.4 | Confident | 86.7 | Confident | 49 Ų | 49 | 86.9 Ų | 86.9 | 34% | 0.343 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -62.8 | -45.2 | 175.8 | 53.1 | 0 | 0 | 0 | 0 | 111.2 | L79 Q80 R85 V86 F87 F115 | L79-S83 VanDerWaalsContact O-CB 3.27Å; L79-S83 WeakPolarHBondContact O-CB 3.45Å; L79-S83 PolarHBondContact O-N 3.42Å; L79-S83 PolarHBondContact O-OG 3.24Å; Q80-S83 VanDerWaalsContact CA-OG 3.25Å; Q80-S83 WeakPolarHBondContact CA-OG 3.33Å; Q80-S83 PolarHBondContact O-N 3.44Å; Q80-S83 PolarHBondContact O-OG 3.24Å; S83-R85 VanDerWaalsContact C-N 3.32Å; S83-R85 PolarHBondContact O-N 2.89Å; S83-V86 PolarHBondContact O-N 3.36Å; S83-F87 WeakPolarHBondContact O-CB 3.42Å; S83-F87 PolarHBondContact O-N 3.24Å; S83-F115 WeakPolarHBondContact OG-CE2 3.45Å |
| 84 | A | 86.3 | Confident | 86.3 | Confident | 24 Ų | 24 | 89.5 Ų | 89.5 | 20% | 0.198 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -52.7 | -48.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q80 Y81 F87 L88 F115 | Q80-A84 WeakPolarHBondContact O-CB 3.39Å; Q80-A84 PolarHBondContact O-N 2.95Å; Y81-A84 PolarHBondContact O-N 3.43Å; A84-F87 PolarHBondContact O-N 2.72Å; A84-L88 WeakPolarHBondContact O-CB 3.4Å; A84-L88 WeakPolarHBondContact O-CG 3.39Å; A84-L88 PolarHBondContact O-N 3.25Å; A84-F115 HydrophobicContact CB-CE1 3.89Å; A84-F115 HydrophobicContact CB-CE2 4.32Å; A84-F115 HydrophobicContact CB-CZ 3.51Å |
| 85 | R | 87.4 | Confident | 86 | Confident | 129 Ų | 129 | 88.9 Ų | 88.9 | 49% | 0.487 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -60.6 | -47.6 | 179.3 | -106.6 | -160.6 | -175.4 | -158.6 | 2.6 | 112.3 | Y81 M82 S83 F87 R89 | Y81-R85 PolarHBondContact O-N 3.28Å; Y81-R85 VanDerWaalsContact O-N 3.1Å; Y81-R85 PolarHBondContact OH-NE 2.96Å; M82-R85 PolarHBondContact O-N 3.32Å; S83-R85 VanDerWaalsContact C-N 3.32Å; S83-R85 PolarHBondContact O-N 2.89Å; R85-F87 VanDerWaalsContact C-N 3.33Å; R85-R89 WeakPolarHBondContact O-CG 3.39Å; R85-R89 PolarHBondContact O-N 3.38Å |
| 86 | V | 86.5 | Confident | 85.6 | Confident | 79 Ų | 79 | 89.4 Ų | 89.4 | 48% | 0.479 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -66.8 | -40.3 | -179.9 | 172.2 | 0 | 0 | 0 | 0 | 110.1 | M82 S83 R89 L90 | M82-V86 WeakPolarHBondContact O-CG2 3.34Å; M82-V86 PolarHBondContact O-N 2.89Å; S83-V86 PolarHBondContact O-N 3.36Å; V86-R89 PolarHBondContact O-N 3.4Å; V86-L90 HydrophobicContact CG1-CD1 3.8Å; V86-L90 HydrophobicContact CG1-CG 4.39Å; V86-L90 WeakPolarHBondContact O-CB 3.5Å; V86-L90 WeakPolarHBondContact O-CG 3.44Å; V86-L90 PolarHBondContact O-N 2.86Å |
| 87 | F | 85.1 | Confident | 85.3 | Confident | 63 Ų | 63 | 90.4 Ų | 90.4 | 28% | 0.276 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63.9 | -46.3 | -179.9 | -143.3 | -89.9 | 0 | 0 | 0 | 111.9 | S83 A84 R85 R89 L90 Q91 F108 L111 | S83-F87 WeakPolarHBondContact O-CB 3.42Å; S83-F87 PolarHBondContact O-N 3.24Å; A84-F87 PolarHBondContact O-N 2.72Å; R85-F87 VanDerWaalsContact C-N 3.33Å; F87-R89 VanDerWaalsContact C-N 3.34Å; F87-R89 PolarHBondContact O-N 3.44Å; F87-L90 PolarHBondContact O-N 2.78Å; F87-Q91 HydrophobicContact CD1-CG 3.92Å; F87-Q91 HydrophobicContact CE1-CG 4.05Å; F87-Q91 WeakPolarHBondContact O-CB 3.37Å; F87-Q91 WeakPolarHBondContact O-CG 3.27Å; F87-Q91 PolarHBondContact O-N 3.45Å; F87-F108 HydrophobicContact CE1-CD1 4.34Å; F87-L111 HydrophobicContact CE1-CB 3.9Å; F87-L111 HydrophobicContact CE1-CD1 4.5Å; F87-L111 HydrophobicContact CE2-CB 4.4Å; F87-L111 HydrophobicContact CE2-CD1 4.38Å; F87-L111 HydrophobicContact CE2-CD2 4.16Å; F87-L111 HydrophobicContact CZ-CB 3.47Å; F87-L111 VanDerWaalsContact CZ-CB 3.47Å; F87-L111 HydrophobicContact CZ-CD1 3.59Å; F87-L111 HydrophobicContact CZ-CD2 3.93Å; F87-L111 HydrophobicContact CZ-CG 3.81Å |
| 88 | L | 84 | Confident | 85 | Confident | 114 Ų | 114 | 87.8 Ų | 87.8 | 60% | 0.597 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -61.4 | -42.2 | 175.7 | -74 | 166.6 | 0 | 0 | 0 | 111.8 | A84 Y92 | A84-L88 WeakPolarHBondContact O-CB 3.4Å; A84-L88 WeakPolarHBondContact O-CG 3.39Å; A84-L88 PolarHBondContact O-N 3.25Å; L88-Y92 WeakPolarHBondContact O-CB 3.28Å; L88-Y92 PolarHBondContact O-N 3.22Å |
| 89 | R | 87 | Confident | 84.6 | Confident | 167 Ų | 167 | 90.8 Ų | 90.8 | 63% | 0.63 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -65.1 | -41 | 176 | -74.5 | -179.3 | 179.4 | -170.3 | -0.6 | 112.1 | R85 V86 F87 K93 | R85-R89 WeakPolarHBondContact O-CG 3.39Å; R85-R89 PolarHBondContact O-N 3.38Å; V86-R89 PolarHBondContact O-N 3.4Å; F87-R89 VanDerWaalsContact C-N 3.34Å; F87-R89 PolarHBondContact O-N 3.44Å; R89-K93 PolarHBondContact O-N 3.1Å |
| 90 | L | 82.8 | Confident | 84.1 | Confident | 98 Ų | 98 | 92 Ų | 92 | 51% | 0.513 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -65.8 | -47.9 | 176.5 | -85.9 | 168.3 | 0 | 0 | 0 | 111.1 | V86 F87 Y92 K93 L94 | V86-L90 HydrophobicContact CG1-CD1 3.8Å; V86-L90 HydrophobicContact CG1-CG 4.39Å; V86-L90 WeakPolarHBondContact O-CB 3.5Å; V86-L90 WeakPolarHBondContact O-CG 3.44Å; V86-L90 PolarHBondContact O-N 2.86Å; F87-L90 PolarHBondContact O-N 2.78Å; L90-Y92 VanDerWaalsContact C-N 3.3Å; L90-Y92 PolarHBondContact O-N 3.39Å; L90-K93 PolarHBondContact O-N 3.42Å; L90-L94 WeakPolarHBondContact O-CB 3.41Å; L90-L94 PolarHBondContact O-N 3.29Å |
| 91 | Q | 83.4 | Confident | 83.9 | Confident | 47 Ų | 47 | 97 Ų | 97 | 22% | 0.22 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -55.6 | -46.4 | 176 | -78.8 | -178 | -16.8 | 0 | 0 | 111.1 | F87 L94 S95 F108 | F87-Q91 HydrophobicContact CD1-CG 3.92Å; F87-Q91 HydrophobicContact CE1-CG 4.05Å; F87-Q91 WeakPolarHBondContact O-CB 3.37Å; F87-Q91 WeakPolarHBondContact O-CG 3.27Å; F87-Q91 PolarHBondContact O-N 3.45Å; Q91-L94 PolarHBondContact O-N 3.32Å; Q91-S95 WeakPolarHBondContact O-CB 3.48Å; Q91-S95 PolarHBondContact O-N 3.29Å; Q91-S95 PolarHBondContact O-OG 3Å; Q91-F108 HydrophobicContact CG-CD1 4.16Å; Q91-F108 HydrophobicContact CG-CD2 4.27Å; Q91-F108 HydrophobicContact CG-CE1 4.26Å; Q91-F108 HydrophobicContact CG-CE2 4.36Å; Q91-F108 HydrophobicContact CG-CG 4.15Å; Q91-F108 HydrophobicContact CG-CZ 4.34Å |
| 92 | Y | 82.8 | Confident | 83.5 | Confident | 167 Ų | 167 | 94.2 Ų | 94.2 | 66% | 0.655 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -60.6 | -53.7 | 177.5 | -177.6 | -98.7 | 0 | 0 | 0 | 111.7 | L88 L90 L94 S95 V96 | L88-Y92 WeakPolarHBondContact O-CB 3.28Å; L88-Y92 PolarHBondContact O-N 3.22Å; L90-Y92 VanDerWaalsContact C-N 3.3Å; L90-Y92 PolarHBondContact O-N 3.39Å; Y92-L94 VanDerWaalsContact C-N 3.34Å; Y92-L94 PolarHBondContact O-N 2.94Å; Y92-S95 PolarHBondContact O-N 2.88Å; Y92-S95 PolarHBondContact O-OG 3.23Å; Y92-V96 HydrophobicContact CE1-CG2 4.16Å; Y92-V96 HydrophobicContact CE2-CG2 4.44Å; Y92-V96 WeakPolarHBondContact O-CG2 3.4Å; Y92-V96 PolarHBondContact O-N 3.35Å |
| 93 | K | 84.8 | Confident | 82.8 | Confident | 146 Ų | 146 | 95.3 Ų | 95.3 | 64% | 0.635 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -59.7 | -44 | 179.5 | -76.5 | -166.8 | 174.8 | -162 | 0 | 112.5 | R89 L90 V96 I97 | R89-K93 PolarHBondContact O-N 3.1Å; L90-K93 PolarHBondContact O-N 3.42Å; K93-V96 PolarHBondContact O-N 3.45Å; K93-I97 WeakPolarHBondContact O-CD1 3.27Å; K93-I97 VanDerWaalsContact O-CG1 3.26Å; K93-I97 WeakPolarHBondContact O-CG1 3.37Å; K93-I97 PolarHBondContact O-N 3.06Å |
| 94 | L | 81.2 | Confident | 81.8 | Confident | 59 Ų | 59 | 103.8 Ų | 103.8 | 31% | 0.309 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68.7 | -38 | -177.8 | -153 | 146.8 | 0 | 0 | 0 | 110.7 | L90 Q91 Y92 I97 L98 L106 F108 | L90-L94 WeakPolarHBondContact O-CB 3.41Å; L90-L94 PolarHBondContact O-N 3.29Å; Q91-L94 PolarHBondContact O-N 3.32Å; Y92-L94 VanDerWaalsContact C-N 3.34Å; Y92-L94 PolarHBondContact O-N 2.94Å; L94-I97 PolarHBondContact O-N 3.4Å; L94-L98 HydrophobicContact CD2-CD1 3.98Å; L94-L98 WeakPolarHBondContact O-CB 3.43Å; L94-L98 PolarHBondContact O-N 3.44Å; L94-L106 HydrophobicContact CD2-CD1 3.61Å; L94-F108 HydrophobicContact CB-CZ 4.48Å; L94-F108 HydrophobicContact CD2-CZ 4Å |
| 95 | S | 78.7 | Confident | 80.8 | Confident | 58 Ų | 58 | 112.7 Ų | 112.7 | 41% | 0.406 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.3 | -40.6 | 175 | 73.3 | 0 | 0 | 0 | 0 | 112.8 | Q91 Y92 L99 | Q91-S95 WeakPolarHBondContact O-CB 3.48Å; Q91-S95 PolarHBondContact O-N 3.29Å; Q91-S95 PolarHBondContact O-OG 3Å; Y92-S95 PolarHBondContact O-N 2.88Å; Y92-S95 PolarHBondContact O-OG 3.23Å; S95-L99 WeakPolarHBondContact O-CB 3.35Å; S95-L99 PolarHBondContact O-N 2.86Å |
| 96 | V | 83.3 | Confident | 79.7 | Confident | 59 Ų | 59 | 111.4 Ų | 111.4 | 36% | 0.358 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -65.6 | -46.4 | 175.7 | 171.8 | 0 | 0 | 0 | 0 | 110.9 | Y92 K93 L98 L99 L100 | Y92-V96 HydrophobicContact CE1-CG2 4.16Å; Y92-V96 HydrophobicContact CE2-CG2 4.44Å; Y92-V96 WeakPolarHBondContact O-CG2 3.4Å; Y92-V96 PolarHBondContact O-N 3.35Å; K93-V96 PolarHBondContact O-N 3.45Å; V96-L98 VanDerWaalsContact C-N 3.34Å; V96-L98 PolarHBondContact O-N 3.27Å; V96-L99 PolarHBondContact O-N 3.48Å; V96-L100 HydrophobicContact CG1-CD1 3.88Å; V96-L100 PolarHBondContact O-N 3.48Å |
| 97 | I | 84 | Confident | 78.8 | Confident | 103 Ų | 103 | 114.9 Ų | 114.9 | 53% | 0.528 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -61.8 | -43.6 | 178.6 | -67.8 | 164 | 0 | 0 | 0 | 110.7 | K93 L94 L99 L100 L101 | K93-I97 WeakPolarHBondContact O-CD1 3.27Å; K93-I97 VanDerWaalsContact O-CG1 3.26Å; K93-I97 WeakPolarHBondContact O-CG1 3.37Å; K93-I97 PolarHBondContact O-N 3.06Å; L94-I97 PolarHBondContact O-N 3.4Å; I97-L99 VanDerWaalsContact C-N 3.33Å; I97-L99 PolarHBondContact O-N 3.39Å; I97-L100 PolarHBondContact O-N 2.84Å; I97-L101 WeakPolarHBondContact O-CB 3.36Å; I97-L101 PolarHBondContact O-N 3.46Å |
| 98 | L | 81.4 | Confident | 78.3 | Confident | 27 Ų | 27 | 114.6 Ų | 114.6 | 14% | 0.141 | 56% | 0.559 | C | S | . | * | H | α-helix | trans | -64.5 | -39.2 | 179 | -126.1 | 76.6 | 0 | 0 | 0 | 112.5 | L94 V96 L100 L101 G102 H103 R104 L106 | L94-L98 HydrophobicContact CD2-CD1 3.98Å; L94-L98 WeakPolarHBondContact O-CB 3.43Å; L94-L98 PolarHBondContact O-N 3.44Å; V96-L98 VanDerWaalsContact C-N 3.34Å; V96-L98 PolarHBondContact O-N 3.27Å; L98-L100 VanDerWaalsContact C-N 3.34Å; L98-L101 CarbonylContact O-C 3.57Å; L98-L101 PolarHBondContact O-N 2.87Å; L98-G102 PolarHBondContact O-N 3.35Å; L98-G102 VanDerWaalsContact O-N 3.09Å; L98-H103 HydrophobicContact CG-CB 4.28Å; L98-H103 PolarHBondContact O-N 3.4Å; L98-R104 WeakPolarHBondContact CD2-O 3.42Å; L98-L106 HydrophobicContact CD1-CD1 4.47Å; L98-L106 HydrophobicContact CD2-CG 4.45Å |
| 99 | L | 80.2 | Confident | 78.1 | Confident | 139 Ų | 139 | 111 Ų | 111 | 73% | 0.728 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -64.7 | -40.4 | 176.9 | -171.8 | 129.8 | 0 | 0 | 0 | 111.3 | S95 V96 I97 L101 G102 | S95-L99 WeakPolarHBondContact O-CB 3.35Å; S95-L99 PolarHBondContact O-N 2.86Å; V96-L99 PolarHBondContact O-N 3.48Å; I97-L99 VanDerWaalsContact C-N 3.33Å; I97-L99 PolarHBondContact O-N 3.39Å; L99-L101 VanDerWaalsContact C-N 3.34Å; L99-G102 PolarHBondContact O-N 3.49Å |
| 100 | L | 80 | Confident | 77.7 | Confident | 142 Ų | 142 | 108.8 Ų | 108.8 | 74% | 0.743 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -65.9 | -33.9 | 172 | -91.4 | 145.1 | 0 | 0 | 0 | 112.9 | V96 I97 L98 G102 | V96-L100 HydrophobicContact CG1-CD1 3.88Å; V96-L100 PolarHBondContact O-N 3.48Å; I97-L100 PolarHBondContact O-N 2.84Å; L98-L100 VanDerWaalsContact C-N 3.34Å; L100-G102 VanDerWaalsContact C-N 3.3Å |
| 101 | L | 84.1 | Confident | 77.5 | Confident | 125 Ų | 125 | 108.1 Ų | 108.1 | 65% | 0.654 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.2 | -1.2 | -178.7 | -154.1 | 66.2 | 0 | 0 | 0 | 113.2 | I97 L98 L99 H103 | I97-L101 WeakPolarHBondContact O-CB 3.36Å; I97-L101 PolarHBondContact O-N 3.46Å; L98-L101 CarbonylContact O-C 3.57Å; L98-L101 PolarHBondContact O-N 2.87Å; L99-L101 VanDerWaalsContact C-N 3.34Å; L101-H103 PolarHBondContact O-N 2.84Å; L101-H103 VanDerWaalsContact O-N 3.1Å |
| 102 | G | 79.4 | Confident | 77.5 | Confident | 73 Ų | 73 | 109.8 Ų | 109.8 | 75% | 0.753 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 62.1 | 15.4 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | L98 L99 L100 | L98-G102 PolarHBondContact O-N 3.35Å; L98-G102 VanDerWaalsContact O-N 3.09Å; L99-G102 PolarHBondContact O-N 3.49Å; L100-G102 VanDerWaalsContact C-N 3.3Å |
| 103 | H | 71.3 | Confident | 77.7 | Confident | 133 Ų | 133 | 106.1 Ų | 106.1 | 62% | 0.616 | 55% | 0.553 | S | S | * | * | P | Polyproline II helix | trans | -94.8 | 149.3 | -171.3 | -134.1 | 72.3 | 0 | 0 | 0 | 111.8 | L98 L101 R105 | L98-H103 HydrophobicContact CG-CB 4.28Å; L98-H103 PolarHBondContact O-N 3.4Å; L101-H103 PolarHBondContact O-N 2.84Å; L101-H103 VanDerWaalsContact O-N 3.1Å; H103-R105 PolarHBondContact O-N 2.97Å |
| 104 | R | 65.1 | Low | 77.7 | Confident | 227 Ų | 227 | 104.8 Ų | 104.8 | 86% | 0.857 | 55% | 0.552 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 132.9 | -175.5 | -172.3 | 174.1 | -178.8 | 162.2 | 0.2 | 111.6 | L98 L106 | L98-R104 WeakPolarHBondContact CD2-O 3.42Å; R104-L106 PolarHBondContact O-N 3.08Å |
| 105 | R | 63.6 | Low | 77.9 | Confident | 212 Ų | 212 | 104.4 Ų | 104.4 | 80% | 0.8 | 55% | 0.548 | S | S | * | . | P | Polyproline II helix | trans | -52.3 | 128.1 | 179.8 | -63 | -170 | -167.1 | -147.9 | 3.9 | 111.1 | H103 | H103-R105 PolarHBondContact O-N 2.97Š|
| 106 | L | 64.8 | Low | 78.2 | Confident | 102 Ų | 102 | 105.3 Ų | 105.3 | 53% | 0.534 | 55% | 0.547 | S | S | . | . | P | Polyproline II helix | trans | -74.2 | 125.2 | 169.9 | -82.3 | 164.5 | 0 | 0 | 0 | 109.6 | L94 L98 R104 F108 | L94-L106 HydrophobicContact CD2-CD1 3.61Å; L98-L106 HydrophobicContact CD1-CD1 4.47Å; L98-L106 HydrophobicContact CD2-CG 4.45Å; R104-L106 PolarHBondContact O-N 3.08Å; L106-F108 HydrophobicContact CB-CE2 4.25Å; L106-F108 HydrophobicContact CB-CZ 4.34Å; L106-F108 VanDerWaalsContact O-CD2 3.25Å; L106-F108 WeakPolarHBondContact O-CD2 3.14Å; L106-F108 PolarHBondContact O-N 3.29Å |
| 107 | D | 68.7 | Low | 78.5 | Confident | 152 Ų | 152 | 109.8 Ų | 109.8 | 81% | 0.813 | 56% | 0.559 | S | S | * | * | trans | -78.2 | 98.9 | 179.1 | -73.5 | -42.1 | 0 | 0 | 0 | 110.8 | G109 | D107-G109 PolarHBondContact O-N 2.83Š| ||
| 108 | F | 73.6 | Confident | 78.5 | Confident | 57 Ų | 57 | 106.7 Ų | 106.7 | 25% | 0.25 | 55% | 0.546 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77 | 7.7 | 175.8 | -65.4 | -77.6 | 0 | 0 | 0 | 114.2 | F87 Q91 L94 L106 V110 L111 N112 | F87-F108 HydrophobicContact CE1-CD1 4.34Å; Q91-F108 HydrophobicContact CG-CD1 4.16Å; Q91-F108 HydrophobicContact CG-CD2 4.27Å; Q91-F108 HydrophobicContact CG-CE1 4.26Å; Q91-F108 HydrophobicContact CG-CE2 4.36Å; Q91-F108 HydrophobicContact CG-CG 4.15Å; Q91-F108 HydrophobicContact CG-CZ 4.34Å; L94-F108 HydrophobicContact CB-CZ 4.48Å; L94-F108 HydrophobicContact CD2-CZ 4Å; L106-F108 HydrophobicContact CB-CE2 4.25Å; L106-F108 HydrophobicContact CB-CZ 4.34Å; L106-F108 VanDerWaalsContact O-CD2 3.25Å; L106-F108 WeakPolarHBondContact O-CD2 3.14Å; L106-F108 PolarHBondContact O-N 3.29Å; F108-V110 VanDerWaalsContact C-N 3.33Å; F108-V110 PolarHBondContact O-N 3.39Å; F108-L111 HydrophobicContact CD1-CD1 4.49Å; F108-L111 PolarHBondContact O-N 2.8Å; F108-N112 PolarHBondContact O-N 2.81Å |
| 109 | G | 80.3 | Confident | 78.7 | Confident | 39 Ų | 39 | 108.6 Ų | 108.6 | 40% | 0.402 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -57.8 | -40.8 | -173.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | D107 N112 N113 | D107-G109 PolarHBondContact O-N 2.83Å; G109-N112 PolarHBondContact O-N 3.32Å; G109-N113 WeakPolarHBondContact O-CB 3.36Å; G109-N113 VanDerWaalsContact O-CG 3.26Å; G109-N113 PolarHBondContact O-N 3.03Å; G109-N113 PolarHBondContact O-ND2 3.36Å |
| 110 | V | 78.8 | Confident | 79.1 | Confident | 119 Ų | 119 | 107.4 Ų | 107.4 | 72% | 0.721 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -64.1 | -45.1 | 179.6 | 179.7 | 0 | 0 | 0 | 0 | 111.5 | F108 N113 L114 | F108-V110 VanDerWaalsContact C-N 3.33Å; F108-V110 PolarHBondContact O-N 3.39Å; V110-N113 PolarHBondContact O-N 3.41Å; V110-L114 WeakPolarHBondContact O-CB 3.43Å; V110-L114 PolarHBondContact O-N 3.4Å |
| 111 | L | 78.8 | Confident | 79.5 | Confident | 84 Ų | 84 | 104.7 Ų | 104.7 | 44% | 0.44 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -67.9 | -37.6 | 179.8 | -76.9 | 155 | 0 | 0 | 0 | 111.5 | F87 F108 L114 F115 | F87-L111 HydrophobicContact CE1-CB 3.9Å; F87-L111 HydrophobicContact CE1-CD1 4.5Å; F87-L111 HydrophobicContact CE2-CB 4.4Å; F87-L111 HydrophobicContact CE2-CD1 4.38Å; F87-L111 HydrophobicContact CE2-CD2 4.16Å; F87-L111 HydrophobicContact CZ-CB 3.47Å; F87-L111 VanDerWaalsContact CZ-CB 3.47Å; F87-L111 HydrophobicContact CZ-CD1 3.59Å; F87-L111 HydrophobicContact CZ-CD2 3.93Å; F87-L111 HydrophobicContact CZ-CG 3.81Å; F108-L111 HydrophobicContact CD1-CD1 4.49Å; F108-L111 PolarHBondContact O-N 2.8Å; L111-L114 PolarHBondContact O-N 2.9Å; L111-F115 WeakPolarHBondContact O-CB 3.36Å; L111-F115 PolarHBondContact O-N 3.02Å |
| 112 | N | 82.9 | Confident | 79.6 | Confident | 82 Ų | 82 | 99.2 Ų | 99.2 | 44% | 0.439 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.9 | -45.3 | 174.3 | -170 | 42.6 | 0 | 0 | 0 | 111.9 | F108 G109 L114 F115 I116 | F108-N112 PolarHBondContact O-N 2.81Å; G109-N112 PolarHBondContact O-N 3.32Å; N112-L114 PolarHBondContact O-N 2.88Å; N112-F115 WeakPolarHBondContact O-CB 3.24Å; N112-F115 PolarHBondContact O-N 3.22Å; N112-I116 VanDerWaalsContact O-CG1 3.31Å; N112-I116 WeakPolarHBondContact O-CG1 3.09Å; N112-I116 PolarHBondContact O-N 3.49Å |
| 113 | N | 85.7 | Confident | 79.9 | Confident | 90 Ų | 90 | 102.7 Ų | 102.7 | 48% | 0.481 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.7 | -45.9 | 176.1 | -73.6 | -24.4 | 0 | 0 | 0 | 111.4 | G109 V110 F115 I116 Y117 | G109-N113 WeakPolarHBondContact O-CB 3.36Å; G109-N113 VanDerWaalsContact O-CG 3.26Å; G109-N113 PolarHBondContact O-N 3.03Å; G109-N113 PolarHBondContact O-ND2 3.36Å; V110-N113 PolarHBondContact O-N 3.41Å; N113-F115 VanDerWaalsContact C-N 3.26Å; N113-F115 PolarHBondContact O-N 3.07Å; N113-I116 PolarHBondContact O-N 3.31Å; N113-Y117 HydrophobicContact CB-CE2 4.43Å; N113-Y117 WeakPolarHBondContact O-CD2 3.32Å; N113-Y117 PolarHBondContact O-N 3.37Å |
| 114 | L | 85.3 | Confident | 80.7 | Confident | 119 Ų | 119 | 104.2 Ų | 104.2 | 62% | 0.623 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -57 | -42 | 175.3 | -170.2 | 78.8 | 0 | 0 | 0 | 111.4 | V110 L111 N112 Y117 S118 | V110-L114 WeakPolarHBondContact O-CB 3.43Å; V110-L114 PolarHBondContact O-N 3.4Å; L111-L114 PolarHBondContact O-N 2.9Å; N112-L114 PolarHBondContact O-N 2.88Å; L114-Y117 PolarHBondContact O-N 3.39Å; L114-S118 WeakPolarHBondContact O-CB 3.24Å; L114-S118 PolarHBondContact O-N 3.42Å |
| 115 | F | 85.3 | Confident | 81.7 | Confident | 51 Ų | 51 | 96.6 Ų | 96.6 | 22% | 0.224 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -64.8 | -45.6 | 179.2 | -160.7 | -92.8 | 0 | 0 | 0 | 112.1 | Q80 S83 A84 L111 N112 N113 Y117 S118 M119 | Q80-F115 VanDerWaalsContact O-CZ 3.31Å; Q80-F115 WeakPolarHBondContact O-CZ 3.21Å; S83-F115 WeakPolarHBondContact OG-CE2 3.45Å; A84-F115 HydrophobicContact CB-CE1 3.89Å; A84-F115 HydrophobicContact CB-CE2 4.32Å; A84-F115 HydrophobicContact CB-CZ 3.51Å; L111-F115 WeakPolarHBondContact O-CB 3.36Å; L111-F115 PolarHBondContact O-N 3.02Å; N112-F115 WeakPolarHBondContact O-CB 3.24Å; N112-F115 PolarHBondContact O-N 3.22Å; N113-F115 VanDerWaalsContact C-N 3.26Å; N113-F115 PolarHBondContact O-N 3.07Å; F115-Y117 PolarHBondContact O-N 2.78Å; F115-S118 PolarHBondContact O-N 3.04Å; F115-S118 PolarHBondContact O-OG 2.92Å; F115-M119 HydrophobicContact CD1-CG 4.31Å; F115-M119 HydrophobicContact CE1-CE 3.45Å; F115-M119 VanDerWaalsContact CE1-CE 3.45Å; F115-M119 HydrophobicContact CE1-CG 4.03Å; F115-M119 HydrophobicContact CZ-CE 3.61Å; F115-M119 PolarHBondContact O-N 3.47Å |
| 116 | I | 86.7 | Confident | 82.8 | Confident | 76 Ų | 76 | 88.7 Ų | 88.7 | 39% | 0.39 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -60.7 | -46 | 176.2 | -66.5 | 164.2 | 0 | 0 | 0 | 110.8 | N112 N113 S118 M119 Q120 | N112-I116 VanDerWaalsContact O-CG1 3.31Å; N112-I116 WeakPolarHBondContact O-CG1 3.09Å; N112-I116 PolarHBondContact O-N 3.49Å; N113-I116 PolarHBondContact O-N 3.31Å; I116-S118 VanDerWaalsContact C-N 3.32Å; I116-S118 PolarHBondContact O-N 2.96Å; I116-M119 PolarHBondContact O-N 2.81Å; I116-Q120 PolarHBondContact O-N 3.05Å |
| 117 | Y | 88.1 | Confident | 83.6 | Confident | 153 Ų | 153 | 86.2 Ų | 86.2 | 60% | 0.6 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -61.4 | -40.6 | 175.5 | -76.8 | -61.7 | 0 | 0 | 0 | 111.9 | N113 L114 F115 M119 Q120 V121 | N113-Y117 HydrophobicContact CB-CE2 4.43Å; N113-Y117 WeakPolarHBondContact O-CD2 3.32Å; N113-Y117 PolarHBondContact O-N 3.37Å; L114-Y117 PolarHBondContact O-N 3.39Å; F115-Y117 PolarHBondContact O-N 2.78Å; Y117-M119 VanDerWaalsContact C-N 3.29Å; Y117-M119 PolarHBondContact O-N 3.41Å; Y117-Q120 PolarHBondContact O-N 2.9Å; Y117-V121 WeakPolarHBondContact O-CG2 3.3Å; Y117-V121 PolarHBondContact O-N 2.81Å |
| 118 | S | 84.7 | Confident | 84.3 | Confident | 38 Ų | 38 | 80.6 Ų | 80.6 | 27% | 0.266 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63.8 | -34 | 178.1 | 80.9 | 0 | 0 | 0 | 0 | 113.1 | Q80 L114 F115 I116 T122 | Q80-S118 PolarHBondContact NE2-O 2.98Å; Q80-S118 PolarHBondContact NE2-OG 3.45Å; L114-S118 WeakPolarHBondContact O-CB 3.24Å; L114-S118 PolarHBondContact O-N 3.42Å; F115-S118 PolarHBondContact O-N 3.04Å; F115-S118 PolarHBondContact O-OG 2.92Å; I116-S118 VanDerWaalsContact C-N 3.32Å; I116-S118 PolarHBondContact O-N 2.96Å; S118-T122 WeakPolarHBondContact O-CG2 3.39Å; S118-T122 PolarHBondContact O-N 3.41Å; S118-T122 VanDerWaalsContact O-N 3.12Å; S118-T122 PolarHBondContact O-OG1 3.33Å |
| 119 | M | 86.2 | Confident | 84.6 | Confident | 67 Ų | 67 | 79.4 Ų | 79.4 | 33% | 0.33 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -70.1 | -40.3 | 174.3 | -75.2 | -69.9 | -171.2 | 0 | 0 | 111.5 | Q80 F115 I116 Y117 T122 M123 | Q80-M119 HydrophobicContact CB-CE 3.84Å; Q80-M119 HydrophobicContact CB-SD 4.41Å; Q80-M119 PolarHBondContact OE1-SD 3.44Å; F115-M119 HydrophobicContact CD1-CG 4.31Å; F115-M119 HydrophobicContact CE1-CE 3.45Å; F115-M119 VanDerWaalsContact CE1-CE 3.45Å; F115-M119 HydrophobicContact CE1-CG 4.03Å; F115-M119 HydrophobicContact CZ-CE 3.61Å; F115-M119 PolarHBondContact O-N 3.47Å; I116-M119 PolarHBondContact O-N 2.81Å; Y117-M119 VanDerWaalsContact C-N 3.29Å; Y117-M119 PolarHBondContact O-N 3.41Å; M119-T122 WeakPolarHBondContact CA-OG1 3.38Å; M119-T122 PolarHBondContact O-N 2.87Å; M119-T122 PolarHBondContact O-OG1 2.87Å; M119-M123 WeakPolarHBondContact O-CB 3.3Å; M119-M123 PolarHBondContact O-N 2.82Å |
| 120 | Q | 88.3 | Confident | 84.6 | Confident | 114 Ų | 114 | 78.6 Ų | 78.6 | 53% | 0.533 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -64.7 | -42.9 | 176.1 | -72.7 | 177.6 | -10.4 | 0 | 0 | 112 | I116 Y117 M123 F124 | I116-Q120 PolarHBondContact O-N 3.05Å; Y117-Q120 PolarHBondContact O-N 2.9Å; Q120-M123 PolarHBondContact O-N 3.44Å; Q120-F124 WeakPolarHBondContact O-CB 3.37Å; Q120-F124 PolarHBondContact O-N 3.4Å |
| 121 | V | 87.4 | Confident | 84.5 | Confident | 86 Ų | 86 | 82.1 Ų | 82.1 | 52% | 0.521 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -63.7 | -43.5 | 178.5 | 171.7 | 0 | 0 | 0 | 0 | 111.2 | Y117 F124 L125 | Y117-V121 WeakPolarHBondContact O-CG2 3.3Å; Y117-V121 PolarHBondContact O-N 2.81Å; V121-F124 PolarHBondContact O-N 3.46Å; V121-L125 HydrophobicContact CG1-CD1 3.98Å; V121-L125 WeakPolarHBondContact O-CB 3.03Å; V121-L125 PolarHBondContact O-N 3.48Å |
| 122 | T | 86.9 | Confident | 84.2 | Confident | 10 Ų | 10 | 80.7 Ų | 80.7 | 6% | 0.061 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -67.9 | -39.5 | 178.1 | 48.2 | 0 | 0 | 0 | 0 | 112.6 | Q80 S118 M119 F124 L125 V126 | Q80-T122 PolarHBondContact OE1-OG1 2.94Å; Q80-T122 VanDerWaalsContact OE1-OG1 3.09Å; S118-T122 WeakPolarHBondContact O-CG2 3.39Å; S118-T122 PolarHBondContact O-N 3.41Å; S118-T122 VanDerWaalsContact O-N 3.12Å; S118-T122 PolarHBondContact O-OG1 3.33Å; M119-T122 WeakPolarHBondContact CA-OG1 3.38Å; M119-T122 PolarHBondContact O-N 2.87Å; M119-T122 PolarHBondContact O-OG1 2.87Å; T122-F124 VanDerWaalsContact C-N 3.34Å; T122-F124 PolarHBondContact O-N 3.5Å; T122-L125 PolarHBondContact O-N 2.83Å; T122-V126 WeakPolarHBondContact O-CG2 3.25Å; T122-V126 PolarHBondContact O-N 3.4Å |
| 123 | M | 86.4 | Confident | 83.6 | Confident | 146 Ų | 146 | 80.8 Ų | 80.8 | 72% | 0.719 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -61.1 | -42.8 | 173.5 | -175.8 | 178.9 | 151.1 | 0 | 0 | 111.7 | M119 Q120 V126 G127 | M119-M123 WeakPolarHBondContact O-CB 3.3Å; M119-M123 PolarHBondContact O-N 2.82Å; Q120-M123 PolarHBondContact O-N 3.44Å; M123-V126 PolarHBondContact O-N 2.86Å; M123-G127 PolarHBondContact O-N 2.82Å |
| 124 | F | 87.5 | Confident | 83 | Confident | 164 Ų | 164 | 83.4 Ų | 83.4 | 72% | 0.719 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -63.9 | -43.4 | 174.6 | -176.3 | -97.3 | 0 | 0 | 0 | 112 | Q120 V121 T122 V126 G127 G128 | Q120-F124 WeakPolarHBondContact O-CB 3.37Å; Q120-F124 PolarHBondContact O-N 3.4Å; V121-F124 PolarHBondContact O-N 3.46Å; T122-F124 VanDerWaalsContact C-N 3.34Å; T122-F124 PolarHBondContact O-N 3.5Å; F124-V126 PolarHBondContact O-N 2.92Å; F124-G127 PolarHBondContact O-N 3.34Å; F124-G128 PolarHBondContact O-N 3.22Å |
| 125 | L | 86.7 | Confident | 82.4 | Confident | 68 Ų | 68 | 81.2 Ų | 81.2 | 36% | 0.356 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -61.1 | -42.1 | 177.3 | -112.6 | 93.3 | 0 | 0 | 0 | 112 | L73 V121 T122 G128 L129 | L73-L125 HydrophobicContact CD2-CB 3.8Å; L73-L125 HydrophobicContact CD2-CD2 3.79Å; L73-L125 HydrophobicContact CD2-CG 4.44Å; L73-L125 HydrophobicContact CG-CD2 4.49Å; V121-L125 HydrophobicContact CG1-CD1 3.98Å; V121-L125 WeakPolarHBondContact O-CB 3.03Å; V121-L125 PolarHBondContact O-N 3.48Å; T122-L125 PolarHBondContact O-N 2.83Å; L125-G128 PolarHBondContact O-N 3.33Å; L125-L129 HydrophobicContact CB-CD1 4.38Å; L125-L129 HydrophobicContact CD2-CD1 3.78Å; L125-L129 HydrophobicContact CG-CD1 4.14Å; L125-L129 WeakPolarHBondContact O-CB 3.1Å; L125-L129 WeakPolarHBondContact O-CG 3.06Å; L125-L129 PolarHBondContact O-N 2.87Å |
| 126 | V | 84.8 | Confident | 81.4 | Confident | 46 Ų | 46 | 82.8 Ų | 82.8 | 28% | 0.279 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -63 | -43.4 | 178.2 | 170.2 | 0 | 0 | 0 | 0 | 111.1 | W70 L73 F77 T122 M123 F124 G130 | W70-V126 HydrophobicContact CH2-CG1 4.43Å; L73-V126 HydrophobicContact CD1-CG2 4.17Å; L73-V126 HydrophobicContact CD2-CG2 4.27Å; F77-V126 HydrophobicContact CD2-CG2 4.21Å; F77-V126 HydrophobicContact CE2-CG2 3.32Å; F77-V126 HydrophobicContact CZ-CG2 3.97Å; T122-V126 WeakPolarHBondContact O-CG2 3.25Å; T122-V126 PolarHBondContact O-N 3.4Å; M123-V126 PolarHBondContact O-N 2.86Å; F124-V126 PolarHBondContact O-N 2.92Å; V126-G130 PolarHBondContact O-N 3.44Å |
| 127 | G | 82.8 | Confident | 80.2 | Confident | 50 Ų | 50 | 84.3 Ų | 84.3 | 52% | 0.515 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62.4 | -47.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | M123 F124 W131 | M123-G127 PolarHBondContact O-N 2.82Å; F124-G127 PolarHBondContact O-N 3.34Å; G127-W131 PolarHBondContact O-N 3.41Å |
| 128 | G | 82.8 | Confident | 78.7 | Confident | 34 Ų | 34 | 84.4 Ų | 84.4 | 35% | 0.351 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -66.7 | -46.4 | -180 | 0 | 0 | 0 | 0 | 0 | 113.3 | F124 L125 G130 W131 C132 | F124-G128 PolarHBondContact O-N 3.22Å; L125-G128 PolarHBondContact O-N 3.33Å; G128-G130 VanDerWaalsContact C-N 3.35Å; G128-W131 PolarHBondContact O-N 2.88Å; G128-C132 PolarHBondContact O-N 3.42Å; G128-C132 PolarHBondContact O-SG 3.47Å |
| 129 | L | 80.6 | Confident | 77.4 | Confident | 31 Ų | 31 | 91.4 Ų | 91.4 | 16% | 0.162 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -71.3 | -29.3 | 179.9 | -75.1 | 162.2 | 0 | 0 | 0 | 112.5 | L69 L73 L125 W131 C132 F133 | L69-L129 HydrophobicContact CB-CD2 4.43Å; L69-L129 HydrophobicContact CD1-CD2 4.02Å; L73-L129 HydrophobicContact CD1-CB 4.13Å; L73-L129 HydrophobicContact CD1-CD1 3.36Å; L73-L129 HydrophobicContact CD1-CG 4.35Å; L73-L129 HydrophobicContact CG-CD1 4.11Å; L125-L129 HydrophobicContact CB-CD1 4.38Å; L125-L129 HydrophobicContact CD2-CD1 3.78Å; L125-L129 HydrophobicContact CG-CD1 4.14Å; L125-L129 WeakPolarHBondContact O-CB 3.1Å; L125-L129 WeakPolarHBondContact O-CG 3.06Å; L125-L129 PolarHBondContact O-N 2.87Å; L129-W131 VanDerWaalsContact C-N 3.34Å; L129-C132 PolarHBondContact O-N 2.95Å; L129-F133 PolarHBondContact O-N 3.07Å |
| 130 | G | 79.7 | Confident | 76.9 | Confident | 23 Ų | 23 | 92.6 Ų | 92.6 | 24% | 0.237 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -62.8 | -40.3 | 169.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | V126 G128 F133 M134 | V126-G130 PolarHBondContact O-N 3.44Å; G128-G130 VanDerWaalsContact C-N 3.35Å; G130-F133 WeakPolarHBondContact O-CB 3.43Å; G130-F133 PolarHBondContact O-N 3.29Å; G130-M134 PolarHBondContact O-N 3.48Å |
| 131 | W | 77.6 | Confident | 76.3 | Confident | 192 Ų | 192 | 91.5 Ų | 91.5 | 73% | 0.727 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -67.5 | -41.8 | 175.1 | -165.5 | 58.9 | 0 | 0 | 0 | 112.2 | G127 G128 L129 F133 M134 V135 | G127-W131 PolarHBondContact O-N 3.41Å; G128-W131 PolarHBondContact O-N 2.88Å; L129-W131 VanDerWaalsContact C-N 3.34Å; W131-F133 PolarHBondContact O-N 3.13Å; W131-M134 PolarHBondContact O-N 3.13Å; W131-V135 PolarHBondContact O-N 2.71Å |
| 132 | C | 72.3 | Confident | 75.7 | Confident | 55 Ų | 55 | 91.8 Ų | 91.8 | 37% | 0.372 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -58.1 | -35.8 | 172 | -68.5 | 0 | 0 | 0 | 0 | 112.3 | G128 L129 V135 F136 | G128-C132 PolarHBondContact O-N 3.42Å; G128-C132 PolarHBondContact O-SG 3.47Å; L129-C132 PolarHBondContact O-N 2.95Å; C132-V135 PolarHBondContact O-N 2.95Å; C132-F136 WeakPolarHBondContact O-CD2 3.47Å; C132-F136 PolarHBondContact O-N 3.02Å |
| 133 | F | 70.9 | Confident | 75.1 | Confident | 83 Ų | 83 | 96.6 Ų | 96.6 | 36% | 0.364 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.8 | -41.9 | 178.1 | -151.6 | -91.4 | 0 | 0 | 0 | 112.3 | W70 L129 G130 W131 V135 F136 V137 | W70-F133 AromaticContact CD1-CD2 3.53Å; W70-F133 AromaticContact CD1-CE2 3.91Å; W70-F133 AromaticContact NE1-CD2 3.5Å; W70-F133 AromaticContact NE1-CG 3.92Å; L129-F133 PolarHBondContact O-N 3.07Å; G130-F133 WeakPolarHBondContact O-CB 3.43Å; G130-F133 PolarHBondContact O-N 3.29Å; W131-F133 PolarHBondContact O-N 3.13Å; F133-V135 VanDerWaalsContact C-N 3.33Å; F133-V135 PolarHBondContact O-N 2.73Å; F133-F136 PolarHBondContact O-N 3.02Å; F133-V137 HydrophobicContact CD1-CG2 3.85Å; F133-V137 HydrophobicContact CE1-CG2 3.88Å; F133-V137 VanDerWaalsContact O-CG2 3.28Å; F133-V137 WeakPolarHBondContact O-CG2 3.44Å; F133-V137 PolarHBondContact O-N 2.82Å; F133-V137 VanDerWaalsContact O-N 3.1Å |
| 134 | M | 72.6 | Confident | 74.4 | Confident | 145 Ų | 145 | 93.5 Ų | 93.5 | 71% | 0.714 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.9 | -39 | 177.1 | -76.1 | -148.1 | 141.7 | 0 | 0 | 112.6 | G130 W131 F136 V137 D138 | G130-M134 PolarHBondContact O-N 3.48Å; W131-M134 PolarHBondContact O-N 3.13Å; M134-F136 VanDerWaalsContact C-N 3.31Å; M134-F136 PolarHBondContact O-N 3.15Å; M134-V137 PolarHBondContact O-N 3.32Å; M134-D138 PolarHBondContact O-N 3.49Å |
| 135 | V | 72.3 | Confident | 73.5 | Confident | 73 Ų | 73 | 88.8 Ų | 88.8 | 44% | 0.442 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.9 | -35.3 | 178.1 | 175.9 | 0 | 0 | 0 | 0 | 112.1 | W131 C132 F133 | W131-V135 PolarHBondContact O-N 2.71Å; C132-V135 PolarHBondContact O-N 2.95Å; F133-V135 VanDerWaalsContact C-N 3.33Å; F133-V135 PolarHBondContact O-N 2.73Å |
| 136 | F | 63.4 | Low | 72.5 | Confident | 84 Ų | 84 | 90.3 Ų | 90.3 | 37% | 0.368 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -79.4 | -25.5 | 178.3 | -87.7 | -74.2 | 0 | 0 | 0 | 114 | C62 T66 C132 F133 M134 D138 | C62-F136 HydrophobicContact CB-CD1 4.15Å; C62-F136 HydrophobicContact CB-CE1 3.4Å; C62-F136 HydrophobicContact CB-CE2 4.47Å; C62-F136 HydrophobicContact CB-CZ 3.6Å; T66-F136 HydrophobicContact CG2-CD2 4.19Å; T66-F136 HydrophobicContact CG2-CE2 4.42Å; C132-F136 WeakPolarHBondContact O-CD2 3.47Å; C132-F136 PolarHBondContact O-N 3.02Å; F133-F136 PolarHBondContact O-N 3.02Å; M134-F136 VanDerWaalsContact C-N 3.31Å; M134-F136 PolarHBondContact O-N 3.15Å; F136-D138 VanDerWaalsContact C-N 3.35Å |
| 137 | V | 61.7 | Low | 71.6 | Confident | 109 Ų | 109 | 93.7 Ų | 93.7 | 66% | 0.661 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -75 | -27.9 | 174.7 | 171.3 | 0 | 0 | 0 | 0 | 111.6 | F133 M134 | F133-V137 HydrophobicContact CD1-CG2 3.85Å; F133-V137 HydrophobicContact CE1-CG2 3.88Å; F133-V137 VanDerWaalsContact O-CG2 3.28Å; F133-V137 WeakPolarHBondContact O-CG2 3.44Å; F133-V137 PolarHBondContact O-N 2.82Å; F133-V137 VanDerWaalsContact O-N 3.1Å; M134-V137 PolarHBondContact O-N 3.32Å |
| 138 | D | 57.4 | Low | 70.7 | Confident | 154 Ų | 154 | 97.3 Ų | 97.3 | 82% | 0.824 | 51% | 0.511 | S | S | * | . | trans | -87.2 | -10.5 | -177.5 | -148.1 | 6.9 | 0 | 0 | 0 | 113.8 | M134 F136 | M134-D138 PolarHBondContact O-N 3.49Å; F136-D138 VanDerWaalsContact C-N 3.35Å | ||
| 139 | M | 56.8 | Low | 69.6 | Low | 185 Ų | 185 | 103.1 Ų | 103.1 | 91% | 0.911 | 53% | 0.526 | S | S | * | . | trans | -93.9 | 0 | 179.4 | -91.3 | -93.5 | 174.3 | 0 | 0 | 112.9 |
Retrieved 139 of 139 residues in 479.3 ms
(Link to these results)