| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 36.3 | Very low | 48 | Very low | 246 Ų | 246 | 156.6 Ų | 156.6 | 100% | 1.212 | 83% | 0.827 | S | S | * | * | 0 | 107.6 | 0 | -86.6 | 161.2 | 140.3 | 0 | 0 | 107.3 | |||||
| 2 | T | 38.9 | Very low | 48.7 | Very low | 146 Ų | 146 | 150.5 Ų | 150.5 | 90% | 0.896 | 79% | 0.794 | S | S | * | * | trans | -82.7 | 114.5 | 178.6 | 36.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 3 | E | 42.4 | Very low | 48.8 | Very low | 199 Ų | 199 | 148.2 Ų | 148.2 | 93% | 0.93 | 79% | 0.793 | S | S | * | * | trans | -81.7 | 116.1 | 167.9 | -81.2 | -174.3 | 133.3 | 0 | 0 | 109.7 | ||||
| 4 | Q | 43.6 | Very low | 49.4 | Very low | 193 Ų | 193 | 146.4 Ų | 146.4 | 90% | 0.902 | 78% | 0.781 | S | S | * | * | trans | -84.7 | 114.9 | 174.7 | -136.5 | 176.7 | -21.5 | 0 | 0 | 108.4 | ||||
| 5 | K | 44.6 | Very low | 49.7 | Very low | 190 Ų | 190 | 140.5 Ų | 140.5 | 83% | 0.826 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 128.3 | 174.9 | -174.2 | 175.4 | -177.3 | 178.2 | 0 | 109.5 | E7 | K5-E7 PolarHBondContact O-N 3.22Š|
| 6 | P | 49.1 | Very low | 50.1 | Low | 121 Ų | 121 | 137.4 Ų | 137.4 | 79% | 0.786 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 120.3 | -179.5 | 26.3 | -31.8 | 0 | 0 | 0 | 110.3 | ||
| 7 | E | 53 | Low | 50.7 | Low | 171 Ų | 171 | 141.5 Ų | 141.5 | 80% | 0.799 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 135.9 | 169 | -67.6 | -164.8 | 157.8 | 0 | 0 | 109.6 | K5 I9 | K5-E7 PolarHBondContact O-N 3.22Å; E7-I9 WeakPolarHBondContact O-CG1 3.34Å; E7-I9 PolarHBondContact O-N 3.02Å |
| 8 | N | 51.9 | Low | 51.3 | Low | 133 Ų | 133 | 137.1 Ų | 137.1 | 71% | 0.711 | 75% | 0.752 | S | S | * | * | trans | -74.6 | 92.2 | -173 | -167.4 | -6.7 | 0 | 0 | 0 | 110.2 | S10 | N8-S10 PolarHBondContact O-N 3.2Å; N8-S10 PolarHBondContact OD1-OG 3.18Å | ||
| 9 | I | 56.2 | Low | 51.2 | Low | 123 Ų | 123 | 136.8 Ų | 136.8 | 63% | 0.631 | 75% | 0.749 | S | S | * | * | trans | -83.7 | 8 | -176.1 | -61.1 | 157.6 | 0 | 0 | 0 | 112.3 | E7 | E7-I9 WeakPolarHBondContact O-CG1 3.34Å; E7-I9 PolarHBondContact O-N 3.02Å | ||
| 10 | S | 58 | Low | 51.5 | Low | 101 Ų | 101 | 136.1 Ų | 136.1 | 71% | 0.706 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88 | -2.3 | -164.7 | 70 | 0 | 0 | 0 | 0 | 117.2 | N8 | N8-S10 PolarHBondContact O-N 3.2Å; N8-S10 PolarHBondContact OD1-OG 3.18Å |
| 11 | S | 53.5 | Low | 51.3 | Low | 100 Ų | 100 | 134.9 Ų | 134.9 | 70% | 0.699 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.9 | 12.1 | -170.1 | 59.4 | 0 | 0 | 0 | 0 | 116.4 | ||
| 12 | I | 56.6 | Low | 52 | Low | 83 Ų | 83 | 130 Ų | 130 | 43% | 0.426 | 71% | 0.706 | S | S | . | * | S | Bend | trans | -111.5 | 112.6 | -179.2 | -50.5 | -178.9 | 0 | 0 | 0 | 109.6 | I14 R21 | I12-I14 PolarHBondContact O-N 3.31Å; I12-R21 HydrophobicContact CB-CG 4.25Å; I12-R21 HydrophobicContact CD1-CG 4.31Å; I12-R21 HydrophobicContact CG2-CG 3.49Å; I12-R21 VanDerWaalsContact CG2-CG 3.49Å |
| 13 | P | 50.2 | Low | 52.7 | Low | 121 Ų | 121 | 128.5 Ų | 128.5 | 79% | 0.786 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 134.5 | -179.6 | 24.6 | -30.9 | 0 | 0 | 0 | 110.9 | ||
| 14 | I | 56.9 | Low | 54 | Low | 123 Ų | 123 | 122.5 Ų | 122.5 | 63% | 0.631 | 68% | 0.676 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 131.9 | -176.1 | -56.8 | 173.9 | 0 | 0 | 0 | 108.5 | I12 | I12-I14 PolarHBondContact O-N 3.31Š|
| 15 | D | 54.1 | Low | 55.7 | Low | 58 Ų | 58 | 118 Ų | 118 | 31% | 0.31 | 66% | 0.657 | S | S | . | * | P | Polyproline II helix | trans | -78 | 128.3 | 176.1 | 68.2 | -44.5 | 0 | 0 | 0 | 110.9 | F17 S18 N19 L20 | D15-F17 PolarHBondContact O-N 3.45Å; D15-F17 VanDerWaalsContact O-N 3.1Å; D15-S18 VanDerWaalsContact OD2-CB 3.25Å; D15-S18 WeakPolarHBondContact OD2-CB 3.49Å; D15-S18 PolarHBondContact OD2-N 2.96Å; D15-S18 PolarHBondContact OD2-OG 3.44Å; D15-N19 PolarHBondContact O-N 2.77Å; D15-L20 PolarHBondContact OD1-N 3.37Å; D15-L20 VanDerWaalsContact OD1-O 3.13Å |
| 16 | G | 56.2 | Low | 57.3 | Low | 91 Ų | 91 | 117.4 Ų | 117.4 | 94% | 0.938 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72 | -0 | -173.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 17 | F | 60.5 | Low | 58.8 | Low | 206 Ų | 206 | 114.5 Ų | 114.5 | 90% | 0.904 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.4 | -31.8 | -178.5 | -167.6 | -103.6 | 0 | 0 | 0 | 113.2 | D15 | D15-F17 PolarHBondContact O-N 3.45Å; D15-F17 VanDerWaalsContact O-N 3.1Å |
| 18 | S | 60.4 | Low | 60.3 | Low | 63 Ų | 63 | 109.1 Ų | 109.1 | 44% | 0.441 | 60% | 0.604 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -125.2 | -11.5 | -170.7 | -5 | 0 | 0 | 0 | 0 | 115.8 | D15 L20 | D15-S18 VanDerWaalsContact OD2-CB 3.25Å; D15-S18 WeakPolarHBondContact OD2-CB 3.49Å; D15-S18 PolarHBondContact OD2-N 2.96Å; D15-S18 PolarHBondContact OD2-OG 3.44Å; S18-L20 PolarHBondContact O-N 3.25Å; S18-L20 VanDerWaalsContact O-N 3.13Å |
| 19 | N | 50.6 | Low | 61.9 | Low | 132 Ų | 132 | 104.7 Ų | 104.7 | 71% | 0.706 | 58% | 0.581 | S | S | * | * | trans | 50.2 | 33.3 | -172.6 | -97.4 | -75.3 | 0 | 0 | 0 | 113 | D15 | D15-N19 PolarHBondContact O-N 2.77Š| ||
| 20 | L | 56.5 | Low | 63.3 | Low | 122 Ų | 122 | 105.1 Ų | 105.1 | 64% | 0.639 | 58% | 0.581 | S | S | * | * | trans | -127.6 | 107.4 | -178.5 | -77.8 | 168.1 | 0 | 0 | 0 | 109.3 | D15 S18 I22 | D15-L20 PolarHBondContact OD1-N 3.37Å; D15-L20 VanDerWaalsContact OD1-O 3.13Å; S18-L20 PolarHBondContact O-N 3.25Å; S18-L20 VanDerWaalsContact O-N 3.13Å; L20-I22 PolarHBondContact O-N 3.23Å | ||
| 21 | R | 46.9 | Very low | 64.6 | Low | 111 Ų | 111 | 104.2 Ų | 104.2 | 42% | 0.419 | 58% | 0.575 | S | S | . | * | trans | -40.1 | 131.2 | 165.7 | -151.8 | -173.8 | -60.3 | -97.3 | 3.9 | 109 | I12 T23 | I12-R21 HydrophobicContact CB-CG 4.25Å; I12-R21 HydrophobicContact CD1-CG 4.31Å; I12-R21 HydrophobicContact CG2-CG 3.49Å; I12-R21 VanDerWaalsContact CG2-CG 3.49Å; R21-T23 HydrophobicContact CB-CG2 4.17Å; R21-T23 HydrophobicContact CG-CG2 4.4Å; R21-T23 PolarHBondContact O-N 2.98Å; R21-T23 PolarHBondContact O-OG1 2.96Å; R21-T23 VanDerWaalsContact O-OG1 3.13Å | ||
| 22 | I | 51.9 | Low | 66.3 | Low | 143 Ų | 143 | 99.8 Ų | 99.8 | 73% | 0.733 | 54% | 0.544 | S | S | * | . | S | Bend | trans | -56.6 | 101.7 | 175.2 | -60.3 | 172.4 | 0 | 0 | 0 | 108.7 | L20 T27 | L20-I22 PolarHBondContact O-N 3.23Å; I22-T27 WeakPolarHBondContact CG2-OG1 3.38Å |
| 23 | T | 53.6 | Low | 67.8 | Low | 114 Ų | 114 | 100 Ų | 100 | 70% | 0.699 | 54% | 0.543 | S | S | * | . | trans | -141.6 | 17.2 | -178.5 | 55.1 | 0 | 0 | 0 | 0 | 113 | R21 | R21-T23 HydrophobicContact CB-CG2 4.17Å; R21-T23 HydrophobicContact CG-CG2 4.4Å; R21-T23 PolarHBondContact O-N 2.98Å; R21-T23 PolarHBondContact O-OG1 2.96Å; R21-T23 VanDerWaalsContact O-OG1 3.13Å | ||
| 24 | S | 68.8 | Low | 69.6 | Low | 73 Ų | 73 | 98.7 Ų | 98.7 | 51% | 0.51 | 52% | 0.523 | S | S | . | . | S | Bend | trans | -130 | 142.4 | -168.7 | -164 | 0 | 0 | 0 | 0 | 114.5 | W26 T27 | S24-W26 PolarHBondContact O-N 3.17Å; S24-T27 PolarHBondContact O-N 3.39Å; S24-T27 VanDerWaalsContact O-N 3.09Å; S24-T27 PolarHBondContact O-OG1 3.17Å |
| 25 | I | 79.6 | Confident | 71.1 | Confident | 99 Ų | 99 | 97.1 Ų | 97.1 | 51% | 0.508 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -51.4 | -32.1 | 177.8 | -68.1 | 163.4 | 0 | 0 | 0 | 111.9 | F28 L29 L106 | I25-F28 WeakPolarHBondContact O-CB 3.29Å; I25-F28 PolarHBondContact O-N 3.05Å; I25-L29 HydrophobicContact CG2-CD1 4.08Å; I25-L29 HydrophobicContact CG2-CG 4.42Å; I25-L29 WeakPolarHBondContact O-CG 3.46Å; I25-L29 PolarHBondContact O-N 3.25Å; I25-L29 VanDerWaalsContact O-N 3.09Å; I25-L106 HydrophobicContact CD1-CD2 4.38Å; I25-L106 HydrophobicContact CG2-CD1 3.65Å; I25-L106 HydrophobicContact CG2-CD2 3.77Å; I25-L106 HydrophobicContact CG2-CG 4.35Å |
| 26 | W | 79.1 | Confident | 72.8 | Confident | 177 Ų | 177 | 94.8 Ų | 94.8 | 67% | 0.67 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.5 | -42.7 | 179.7 | -172.6 | -109.4 | 0 | 0 | 0 | 113.6 | S24 F28 L29 M30 | S24-W26 PolarHBondContact O-N 3.17Å; W26-F28 VanDerWaalsContact C-N 3.29Å; W26-F28 PolarHBondContact O-N 2.94Å; W26-L29 PolarHBondContact O-N 3.17Å; W26-M30 HydrophobicContact CZ2-SD 4.3Å; W26-M30 WeakPolarHBondContact O-CG 3.49Å; W26-M30 PolarHBondContact O-N 2.73Å |
| 27 | T | 81 | Confident | 74.5 | Confident | 61 Ų | 61 | 95.7 Ų | 95.7 | 37% | 0.374 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.6 | -33.8 | 179.1 | 46.9 | 0 | 0 | 0 | 0 | 111.7 | I22 S24 S31 | I22-T27 WeakPolarHBondContact CG2-OG1 3.38Å; S24-T27 PolarHBondContact O-N 3.39Å; S24-T27 VanDerWaalsContact O-N 3.09Å; S24-T27 PolarHBondContact O-OG1 3.17Å; T27-S31 PolarHBondContact O-N 3.44Å; T27-S31 VanDerWaalsContact O-N 3.14Å |
| 28 | F | 84.2 | Confident | 75.9 | Confident | 57 Ų | 57 | 88.6 Ų | 88.6 | 25% | 0.25 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -63.5 | -49.2 | 173.2 | 172 | -101.3 | 0 | 0 | 0 | 110.9 | I25 W26 M30 S31 V32 M102 F103 L106 | I25-F28 WeakPolarHBondContact O-CB 3.29Å; I25-F28 PolarHBondContact O-N 3.05Å; W26-F28 VanDerWaalsContact C-N 3.29Å; W26-F28 PolarHBondContact O-N 2.94Å; F28-M30 VanDerWaalsContact C-N 3.32Å; F28-M30 PolarHBondContact O-N 3.28Å; F28-S31 PolarHBondContact O-N 2.98Å; F28-S31 PolarHBondContact O-OG 3.41Å; F28-V32 PolarHBondContact O-N 2.87Å; F28-M102 HydrophobicContact CE1-CG 4.48Å; F28-M102 HydrophobicContact CG-SD 4.44Å; F28-F103 HydrophobicContact CE1-CB 4.37Å; F28-F103 HydrophobicContact CE1-CD2 4.24Å; F28-F103 HydrophobicContact CZ-CB 3.98Å; F28-F103 HydrophobicContact CZ-CD2 4.13Å; F28-L106 HydrophobicContact CD1-CD1 3.98Å; F28-L106 HydrophobicContact CE1-CD1 4.16Å |
| 29 | L | 85.7 | Confident | 77.4 | Confident | 41 Ų | 41 | 85.6 Ų | 85.6 | 22% | 0.215 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -63 | -36.1 | 178.9 | -68.5 | 174 | 0 | 0 | 0 | 113.1 | I25 W26 S31 V32 W34 V107 | I25-L29 HydrophobicContact CG2-CD1 4.08Å; I25-L29 HydrophobicContact CG2-CG 4.42Å; I25-L29 WeakPolarHBondContact O-CG 3.46Å; I25-L29 PolarHBondContact O-N 3.25Å; I25-L29 VanDerWaalsContact O-N 3.09Å; W26-L29 PolarHBondContact O-N 3.17Å; L29-S31 VanDerWaalsContact C-N 3.28Å; L29-S31 PolarHBondContact O-N 3.3Å; L29-V32 PolarHBondContact O-N 2.98Å; L29-W34 HydrophobicContact CD2-CH2 4.49Å; L29-W34 HydrophobicContact CD2-CZ2 4.18Å; L29-W34 PolarHBondContact O-NE1 2.89Å; L29-V107 HydrophobicContact CD2-CG2 3.81Å |
| 30 | M | 85.5 | Confident | 79.5 | Confident | 131 Ų | 131 | 83.3 Ų | 83.3 | 65% | 0.645 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -67.7 | -27.1 | 174.5 | -74.2 | -64.4 | -64.9 | 0 | 0 | 113.1 | W26 F28 V32 | W26-M30 HydrophobicContact CZ2-SD 4.3Å; W26-M30 WeakPolarHBondContact O-CG 3.49Å; W26-M30 PolarHBondContact O-N 2.73Å; F28-M30 VanDerWaalsContact C-N 3.32Å; F28-M30 PolarHBondContact O-N 3.28Å; M30-V32 VanDerWaalsContact C-N 3.34Å |
| 31 | S | 85.3 | Confident | 81.3 | Confident | 83 Ų | 83 | 79.5 Ų | 79.5 | 58% | 0.58 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -79.3 | -13.5 | 176 | 70.7 | 0 | 0 | 0 | 0 | 114.3 | T27 F28 L29 | T27-S31 PolarHBondContact O-N 3.44Å; T27-S31 VanDerWaalsContact O-N 3.14Å; F28-S31 PolarHBondContact O-N 2.98Å; F28-S31 PolarHBondContact O-OG 3.41Å; L29-S31 VanDerWaalsContact C-N 3.28Å; L29-S31 PolarHBondContact O-N 3.3Å |
| 32 | V | 88.4 | Confident | 83.5 | Confident | 6 Ų | 6 | 75.4 Ų | 75.4 | 4% | 0.036 | 41% | 0.409 | C | S | . | . | S | Bend | trans | -70.6 | 135.5 | 177.5 | 173.7 | 0 | 0 | 0 | 0 | 110 | F28 L29 M30 W34 L39 Y96 F103 | F28-V32 PolarHBondContact O-N 2.87Å; L29-V32 PolarHBondContact O-N 2.98Å; M30-V32 VanDerWaalsContact C-N 3.34Å; V32-W34 HydrophobicContact CB-CZ2 4.1Å; V32-W34 HydrophobicContact CG1-CD2 4.06Å; V32-W34 HydrophobicContact CG1-CE3 4.39Å; V32-W34 HydrophobicContact CG1-CH2 4.46Å; V32-W34 HydrophobicContact CG1-CZ2 4.11Å; V32-W34 PolarHBondContact O-N 3.49Å; V32-W34 VanDerWaalsContact O-N 3.1Å; V32-W34 PolarHBondContact O-NE1 3.33Å; V32-L39 HydrophobicContact CG1-CD1 3.73Å; V32-Y96 HydrophobicContact CB-CE1 4.28Å; V32-Y96 HydrophobicContact CG1-CD1 4.45Å; V32-Y96 HydrophobicContact CG1-CE1 3.98Å; V32-Y96 HydrophobicContact CG2-CD1 4.26Å; V32-Y96 HydrophobicContact CG2-CE1 4.16Å; V32-F103 HydrophobicContact CG1-CE2 4.11Å; V32-F103 HydrophobicContact CG2-CD2 4.27Å; V32-F103 HydrophobicContact CG2-CE2 4.14Å |
| 33 | Q | 88.1 | Confident | 85.5 | Confident | 88 Ų | 88 | 72.2 Ų | 72.2 | 41% | 0.411 | 39% | 0.392 | S | S | . | . | trans | -85.4 | 81.9 | 178.7 | -65 | -140.9 | 57.4 | 0 | 0 | 111.1 | S35 E36 L39 F94 Y96 | Q33-S35 PolarHBondContact O-N 3.47Å; Q33-E36 HydrophobicContact CB-CG 4.43Å; Q33-E36 PolarHBondContact O-N 3.33Å; Q33-E36 VanDerWaalsContact O-N 3.15Å; Q33-L39 WeakPolarHBondContact O-CD1 3.4Å; Q33-F94 HydrophobicContact CG-CD2 4.42Å; Q33-F94 HydrophobicContact CG-CE2 4.18Å; Q33-Y96 WeakPolarHBondContact CB-OH 3.45Å; Q33-Y96 PolarHBondContact N-OH 2.97Å | ||
| 34 | W | 88.2 | Confident | 87.5 | Confident | 94 Ų | 94 | 70.7 Ų | 70.7 | 36% | 0.356 | 38% | 0.383 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.3 | -11 | -177.7 | -60.1 | 99.2 | 0 | 0 | 0 | 115.7 | L29 V32 E36 I43 V107 | L29-W34 HydrophobicContact CD2-CH2 4.49Å; L29-W34 HydrophobicContact CD2-CZ2 4.18Å; L29-W34 PolarHBondContact O-NE1 2.89Å; V32-W34 HydrophobicContact CB-CZ2 4.1Å; V32-W34 HydrophobicContact CG1-CD2 4.06Å; V32-W34 HydrophobicContact CG1-CE3 4.39Å; V32-W34 HydrophobicContact CG1-CH2 4.46Å; V32-W34 HydrophobicContact CG1-CZ2 4.11Å; V32-W34 PolarHBondContact O-N 3.49Å; V32-W34 VanDerWaalsContact O-N 3.1Å; V32-W34 PolarHBondContact O-NE1 3.33Å; W34-E36 VanDerWaalsContact C-N 3.25Å; W34-E36 PolarHBondContact O-N 2.82Å; W34-I43 HydrophobicContact CE3-CD1 3.95Å; W34-I43 HydrophobicContact CZ3-CD1 4.36Å; W34-V107 HydrophobicContact CH2-CG1 3.91Å; W34-V107 HydrophobicContact CH2-CG2 4.02Å; W34-V107 HydrophobicContact CZ3-CG1 3.98Å |
| 35 | S | 88.9 | Confident | 88.8 | Confident | 90 Ų | 90 | 70.4 Ų | 70.4 | 63% | 0.629 | 37% | 0.372 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.4 | -10.1 | 175.4 | 49.5 | 0 | 0 | 0 | 0 | 114 | Q33 | Q33-S35 PolarHBondContact O-N 3.47Š|
| 36 | E | 89.1 | Confident | 89.5 | Confident | 9 Ų | 9 | 66.9 Ų | 66.9 | 4% | 0.042 | 35% | 0.354 | C | S | . | . | S | Bend | trans | -68 | 133.7 | 179 | -65.4 | -164.8 | 131.2 | 0 | 0 | 111.8 | Q33 W34 W38 L39 I40 S92 N93 Y96 | Q33-E36 HydrophobicContact CB-CG 4.43Å; Q33-E36 PolarHBondContact O-N 3.33Å; Q33-E36 VanDerWaalsContact O-N 3.15Å; W34-E36 VanDerWaalsContact C-N 3.25Å; W34-E36 PolarHBondContact O-N 2.82Å; E36-W38 VanDerWaalsContact C-N 3.27Å; E36-W38 PolarHBondContact O-N 3.21Å; E36-W38 VanDerWaalsContact O-N 3.14Å; E36-W38 PolarHBondContact OE2-NE1 3.31Å; E36-L39 HydrophobicContact CB-CD1 4.17Å; E36-L39 HydrophobicContact CB-CG 4.43Å; E36-L39 WeakPolarHBondContact O-CB 3.49Å; E36-L39 PolarHBondContact O-N 3.22Å; E36-I40 PolarHBondContact O-N 2.76Å; E36-I40 VanDerWaalsContact O-N 3.11Å; E36-S92 PolarHBondContact OE2-OG 3.46Å; E36-N93 WeakPolarHBondContact OE1-CB 3.47Å; E36-N93 PolarHBondContact OE1-N 2.96Å; E36-N93 PolarHBondContact OE1-ND2 3.47Å; E36-Y96 VanDerWaalsContact OE2-CE2 3.28Å; E36-Y96 WeakPolarHBondContact OE2-CE2 3.49Å |
| 37 | P | 91.5 | Very high | 90.3 | Very high | 110 Ų | 110 | 62.9 Ų | 62.9 | 71% | 0.714 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -56.2 | -36.1 | -174 | -28.2 | 34.9 | 0 | 0 | 0 | 114.7 | I40 G41 | P37-I40 PolarHBondContact O-N 2.9Å; P37-G41 PolarHBondContact O-N 2.84Å |
| 38 | W | 90.8 | Very high | 90.9 | Very high | 56 Ų | 56 | 63.3 Ų | 63.3 | 21% | 0.212 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -70.7 | -33.9 | 179.9 | 74.1 | -89.6 | 0 | 0 | 0 | 112.2 | E36 G41 L42 F91 Y96 F97 F103 | E36-W38 VanDerWaalsContact C-N 3.27Å; E36-W38 PolarHBondContact O-N 3.21Å; E36-W38 VanDerWaalsContact O-N 3.14Å; E36-W38 PolarHBondContact OE2-NE1 3.31Å; W38-G41 PolarHBondContact O-N 3.18Å; W38-L42 HydrophobicContact CZ3-CD2 4.44Å; W38-L42 PolarHBondContact O-N 2.92Å; W38-F91 AromaticContact CD1-CD2 4Å; W38-F91 AromaticContact CD2-CD2 3.9Å; W38-F91 HydrophobicContact CD2-CD2 3.9Å; W38-F91 HydrophobicContact CD2-CE2 4.05Å; W38-F91 AromaticContact CE2-CE2 3.99Å; W38-F91 HydrophobicContact CE3-CD2 4.48Å; W38-F91 HydrophobicContact CE3-CE2 4.32Å; W38-F91 AromaticContact CG-CD2 3.91Å; W38-F91 HydrophobicContact CG-CD2 3.91Å; W38-F91 HydrophobicContact CH2-CE2 4.47Å; W38-F91 HydrophobicContact CZ2-CE2 4.23Å; W38-Y96 HydrophobicContact CH2-CD2 4.18Å; W38-Y96 AromaticContact CZ2-CD2 3.54Å; W38-Y96 HydrophobicContact CZ2-CD2 3.54Å; W38-Y96 AromaticContact CZ2-CE2 3.88Å; W38-Y96 HydrophobicContact CZ2-CE2 3.88Å; W38-Y96 HydrophobicContact CZ2-CG 4.46Å; W38-F97 AromaticContact CH2-CE2 3.8Å; W38-F97 HydrophobicContact CH2-CE2 3.8Å; W38-F97 AromaticContact CH2-CZ 3.62Å; W38-F97 HydrophobicContact CH2-CZ 3.62Å; W38-F97 HydrophobicContact CZ2-CE2 4.36Å; W38-F97 HydrophobicContact CZ3-CE2 4.29Å; W38-F97 AromaticContact CZ3-CZ 3.78Å; W38-F97 HydrophobicContact CZ3-CZ 3.78Å; W38-F103 AromaticContact CH2-CE1 3.67Å; W38-F103 HydrophobicContact CH2-CE1 3.67Å; W38-F103 AromaticContact CH2-CZ 3.74Å; W38-F103 HydrophobicContact CH2-CZ 3.74Å; W38-F103 HydrophobicContact CZ3-CE1 4.14Å; W38-F103 HydrophobicContact CZ3-CZ 4.33Å |
| 39 | L | 92.7 | Very high | 91.3 | Very high | 0 Ų | 0 | 60.9 Ų | 60.9 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -68.8 | -39.5 | 173.4 | -74.8 | 172.2 | 0 | 0 | 0 | 111.5 | V32 Q33 E36 G41 L42 I43 F103 | V32-L39 HydrophobicContact CG1-CD1 3.73Å; Q33-L39 WeakPolarHBondContact O-CD1 3.4Å; E36-L39 HydrophobicContact CB-CD1 4.17Å; E36-L39 HydrophobicContact CB-CG 4.43Å; E36-L39 WeakPolarHBondContact O-CB 3.49Å; E36-L39 PolarHBondContact O-N 3.22Å; L39-G41 VanDerWaalsContact C-N 3.28Å; L39-G41 PolarHBondContact O-N 2.91Å; L39-L42 HydrophobicContact CD2-CD2 4.35Å; L39-L42 WeakPolarHBondContact O-CB 3.33Å; L39-L42 PolarHBondContact O-N 2.94Å; L39-L42 VanDerWaalsContact O-N 3.13Å; L39-I43 WeakPolarHBondContact O-CG1 3.45Å; L39-I43 PolarHBondContact O-N 2.71Å; L39-F103 HydrophobicContact CD2-CE1 4.46Å; L39-F103 HydrophobicContact CD2-CE2 4.22Å; L39-F103 HydrophobicContact CD2-CZ 3.52Å |
| 40 | I | 93 | Very high | 91.7 | Very high | 84 Ų | 84 | 63.1 Ų | 63.1 | 43% | 0.431 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -60.9 | -44.1 | 172.7 | -61.5 | 167.6 | 0 | 0 | 0 | 109.5 | E36 P37 L42 I43 V44 | E36-I40 PolarHBondContact O-N 2.76Å; E36-I40 VanDerWaalsContact O-N 3.11Å; P37-I40 PolarHBondContact O-N 2.9Å; I40-L42 VanDerWaalsContact C-N 3.28Å; I40-L42 PolarHBondContact O-N 3.37Å; I40-I43 PolarHBondContact O-N 2.94Å; I40-V44 WeakPolarHBondContact O-CG2 3.36Å; I40-V44 PolarHBondContact O-N 2.96Å |
| 41 | G | 94.1 | Very high | 92 | Very high | 42 Ų | 42 | 63.4 Ų | 63.4 | 43% | 0.433 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -56.1 | -41.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | P37 W38 L39 V44 F45 | P37-G41 PolarHBondContact O-N 2.84Å; W38-G41 PolarHBondContact O-N 3.18Å; L39-G41 VanDerWaalsContact C-N 3.28Å; L39-G41 PolarHBondContact O-N 2.91Å; G41-V44 PolarHBondContact O-N 3.19Å; G41-F45 WeakPolarHBondContact O-CB 3.45Å; G41-F45 PolarHBondContact O-N 3.37Å |
| 42 | L | 94 | Very high | 92.3 | Very high | 25 Ų | 25 | 62.9 Ų | 62.9 | 13% | 0.131 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -64.1 | -43.2 | 176 | -178.8 | 63.3 | 0 | 0 | 0 | 112.5 | W38 L39 I40 F45 H46 V107 Y108 | W38-L42 HydrophobicContact CZ3-CD2 4.44Å; W38-L42 PolarHBondContact O-N 2.92Å; L39-L42 HydrophobicContact CD2-CD2 4.35Å; L39-L42 WeakPolarHBondContact O-CB 3.33Å; L39-L42 PolarHBondContact O-N 2.94Å; L39-L42 VanDerWaalsContact O-N 3.13Å; I40-L42 VanDerWaalsContact C-N 3.28Å; I40-L42 PolarHBondContact O-N 3.37Å; L42-F45 HydrophobicContact CD1-CD1 4.23Å; L42-F45 WeakPolarHBondContact O-CB 3.31Å; L42-F45 PolarHBondContact O-N 2.96Å; L42-H46 PolarHBondContact O-CD2 3.37Å; L42-H46 PolarHBondContact O-N 2.92Å; L42-V107 HydrophobicContact CD2-CG1 3.66Å; L42-Y108 HydrophobicContact CD1-CD2 3.89Å |
| 43 | I | 94.1 | Very high | 92.4 | Very high | 76 Ų | 76 | 62.7 Ų | 62.7 | 39% | 0.39 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62.4 | -46.1 | 175.2 | -66.4 | 168.2 | 0 | 0 | 0 | 110.4 | W34 L39 I40 F45 H46 V47 | W34-I43 HydrophobicContact CE3-CD1 3.95Å; W34-I43 HydrophobicContact CZ3-CD1 4.36Å; L39-I43 WeakPolarHBondContact O-CG1 3.45Å; L39-I43 PolarHBondContact O-N 2.71Å; I40-I43 PolarHBondContact O-N 2.94Å; I43-F45 VanDerWaalsContact C-N 3.29Å; I43-F45 PolarHBondContact O-N 3.45Å; I43-H46 PolarHBondContact O-N 3.49Å; I43-H46 VanDerWaalsContact O-N 3.11Å; I43-V47 WeakPolarHBondContact O-CG2 3.29Å; I43-V47 PolarHBondContact O-N 3.48Å |
| 44 | V | 95.5 | Very high | 92.5 | Very high | 83 Ų | 83 | 63.2 Ų | 63.2 | 50% | 0.503 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -59.5 | -43.1 | 176.7 | 171.6 | 0 | 0 | 0 | 0 | 110.6 | I40 G41 H46 V47 V48 | I40-V44 WeakPolarHBondContact O-CG2 3.36Å; I40-V44 PolarHBondContact O-N 2.96Å; G41-V44 PolarHBondContact O-N 3.19Å; V44-H46 VanDerWaalsContact C-N 3.32Å; V44-H46 PolarHBondContact O-N 3.44Å; V44-V47 PolarHBondContact O-N 3.1Å; V44-V48 HydrophobicContact CG1-CG2 4.39Å; V44-V48 WeakPolarHBondContact O-CG2 3.45Å; V44-V48 PolarHBondContact O-N 3.38Å |
| 45 | F | 95.5 | Very high | 92.5 | Very high | 66 Ų | 66 | 61.8 Ų | 61.8 | 29% | 0.289 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -55.7 | -45.3 | 173.9 | 164.6 | -98.4 | 0 | 0 | 0 | 111.8 | G41 L42 I43 V47 V48 C49 L73 Y108 L112 | G41-F45 WeakPolarHBondContact O-CB 3.45Å; G41-F45 PolarHBondContact O-N 3.37Å; L42-F45 HydrophobicContact CD1-CD1 4.23Å; L42-F45 WeakPolarHBondContact O-CB 3.31Å; L42-F45 PolarHBondContact O-N 2.96Å; I43-F45 VanDerWaalsContact C-N 3.29Å; I43-F45 PolarHBondContact O-N 3.45Å; F45-V47 PolarHBondContact O-N 3.13Å; F45-V48 PolarHBondContact O-N 3.3Å; F45-C49 VanDerWaalsContact CE2-SG 3.55Å; F45-C49 WeakPolarHBondContact CZ-SG 3.45Å; F45-C49 PolarHBondContact O-N 3.39Å; F45-C49 PolarHBondContact O-SG 3.38Å; F45-C49 VanDerWaalsContact O-SG 3.35Å; F45-L73 HydrophobicContact CE2-CD1 4.49Å; F45-L73 HydrophobicContact CZ-CD1 3.96Å; F45-Y108 HydrophobicContact CE1-CD2 4.36Å; F45-Y108 AromaticContact CE1-CE2 3.97Å; F45-Y108 HydrophobicContact CE1-CE2 3.97Å; F45-Y108 HydrophobicContact CZ-CE2 4.49Å; F45-L112 HydrophobicContact CE1-CD1 4.45Å; F45-L112 HydrophobicContact CE1-CD2 3.97Å; F45-L112 HydrophobicContact CZ-CD2 4.17Å |
| 46 | H | 94.9 | Very high | 92.5 | Very high | 25 Ų | 25 | 58.2 Ų | 58.2 | 12% | 0.116 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.9 | -39.8 | 176 | -71.5 | -58 | 0 | 0 | 0 | 113.5 | L42 I43 V44 V48 C49 L50 V107 Y108 | L42-H46 PolarHBondContact O-CD2 3.37Å; L42-H46 PolarHBondContact O-N 2.92Å; I43-H46 PolarHBondContact O-N 3.49Å; I43-H46 VanDerWaalsContact O-N 3.11Å; V44-H46 VanDerWaalsContact C-N 3.32Å; V44-H46 PolarHBondContact O-N 3.44Å; H46-V48 VanDerWaalsContact C-N 3.32Å; H46-V48 PolarHBondContact O-N 2.87Å; H46-C49 PolarHBondContact O-N 3.22Å; H46-L50 WeakPolarHBondContact O-CB 3.26Å; H46-L50 PolarHBondContact O-N 2.9Å; H46-V107 PolarHBondContact NE2-O 3.37Å; H46-Y108 PolarHBondContact CE1-O 2.87Å |
| 47 | V | 94.9 | Very high | 92 | Very high | 93 Ų | 93 | 59.2 Ų | 59.2 | 56% | 0.564 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -61.8 | -43.1 | 174.9 | 173.8 | 0 | 0 | 0 | 0 | 110.6 | I43 V44 F45 L50 F51 | I43-V47 WeakPolarHBondContact O-CG2 3.29Å; I43-V47 PolarHBondContact O-N 3.48Å; V44-V47 PolarHBondContact O-N 3.1Å; F45-V47 PolarHBondContact O-N 3.13Å; V47-L50 PolarHBondContact O-N 3.37Å; V47-F51 WeakPolarHBondContact O-CB 3.21Å; V47-F51 PolarHBondContact O-N 3.16Å |
| 48 | V | 94.7 | Very high | 91.5 | Very high | 71 Ų | 71 | 64 Ų | 64 | 43% | 0.43 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -63.6 | -44.4 | 175.7 | 172.2 | 0 | 0 | 0 | 0 | 111 | V44 F45 H46 L50 F51 L52 | V44-V48 HydrophobicContact CG1-CG2 4.39Å; V44-V48 WeakPolarHBondContact O-CG2 3.45Å; V44-V48 PolarHBondContact O-N 3.38Å; F45-V48 PolarHBondContact O-N 3.3Å; H46-V48 VanDerWaalsContact C-N 3.32Å; H46-V48 PolarHBondContact O-N 2.87Å; V48-L50 VanDerWaalsContact C-N 3.33Å; V48-L50 PolarHBondContact O-N 2.9Å; V48-F51 PolarHBondContact O-N 3.4Å; V48-L52 HydrophobicContact CG1-CD1 4.03Å; V48-L52 HydrophobicContact CG1-CG 4.32Å; V48-L52 WeakPolarHBondContact O-CB 3.41Å; V48-L52 WeakPolarHBondContact O-CG 3.34Å; V48-L52 PolarHBondContact O-N 3.1Å |
| 49 | C | 93.4 | Very high | 91.3 | Very high | 6 Ų | 6 | 67.2 Ų | 67.2 | 4% | 0.041 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -58.6 | -44.3 | 175.4 | -73.5 | 0 | 0 | 0 | 0 | 111.9 | F45 H46 L52 T53 H66 I70 | F45-C49 VanDerWaalsContact CE2-SG 3.55Å; F45-C49 WeakPolarHBondContact CZ-SG 3.45Å; F45-C49 PolarHBondContact O-N 3.39Å; F45-C49 PolarHBondContact O-SG 3.38Å; F45-C49 VanDerWaalsContact O-SG 3.35Å; H46-C49 PolarHBondContact O-N 3.22Å; C49-L52 PolarHBondContact O-N 3.48Å; C49-T53 PolarHBondContact O-N 3.47Å; C49-T53 PolarHBondContact O-OG1 3.18Å; C49-H66 PolarHBondContact O-NE2 2.99Å; C49-I70 HydrophobicContact CB-CD1 4.26Å |
| 50 | L | 92.7 | Very high | 90.8 | Very high | 88 Ų | 88 | 74 Ų | 74 | 46% | 0.461 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -65.3 | -45 | 178 | -177.2 | 64.1 | 0 | 0 | 0 | 111.4 | H46 V47 V48 L52 T53 V54 N115 | H46-L50 WeakPolarHBondContact O-CB 3.26Å; H46-L50 PolarHBondContact O-N 2.9Å; V47-L50 PolarHBondContact O-N 3.37Å; V48-L50 VanDerWaalsContact C-N 3.33Å; V48-L50 PolarHBondContact O-N 2.9Å; L50-L52 VanDerWaalsContact C-N 3.34Å; L50-L52 PolarHBondContact O-N 3.41Å; L50-T53 WeakPolarHBondContact O-CB 3.41Å; L50-T53 PolarHBondContact O-N 3.41Å; L50-V54 WeakPolarHBondContact O-CG2 3.4Å; L50-V54 PolarHBondContact O-N 3.44Å; L50-N115 WeakPolarHBondContact CA-OD1 3.38Å; L50-N115 WeakPolarHBondContact CD1-OD1 2.96Å |
| 51 | F | 93.1 | Very high | 90.6 | Very high | 136 Ų | 136 | 80.5 Ų | 80.5 | 60% | 0.596 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -58.8 | -46.7 | 175.3 | 176.6 | -100.9 | 0 | 0 | 0 | 111.5 | V47 V48 T53 V54 V55 | V47-F51 WeakPolarHBondContact O-CB 3.21Å; V47-F51 PolarHBondContact O-N 3.16Å; V48-F51 PolarHBondContact O-N 3.4Å; F51-T53 VanDerWaalsContact C-N 3.33Å; F51-T53 PolarHBondContact O-N 3.13Å; F51-V54 PolarHBondContact O-N 3.32Å; F51-V54 VanDerWaalsContact O-N 3.16Å; F51-V55 HydrophobicContact CD1-CG2 4.17Å; F51-V55 HydrophobicContact CD2-CG2 4.32Å; F51-V55 HydrophobicContact CE1-CG2 3.69Å; F51-V55 HydrophobicContact CE2-CG2 3.87Å; F51-V55 HydrophobicContact CG-CG2 4.47Å; F51-V55 HydrophobicContact CZ-CG2 3.53Å; F51-V55 WeakPolarHBondContact O-CG2 3.25Å; F51-V55 PolarHBondContact O-N 3.26Å |
| 52 | L | 91.4 | Very high | 90.3 | Very high | 72 Ų | 72 | 80.7 Ų | 80.7 | 38% | 0.377 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -60.2 | -42.4 | 174.9 | -74.9 | 175.6 | 0 | 0 | 0 | 111.4 | V48 C49 L50 V54 V55 T56 | V48-L52 HydrophobicContact CG1-CD1 4.03Å; V48-L52 HydrophobicContact CG1-CG 4.32Å; V48-L52 WeakPolarHBondContact O-CB 3.41Å; V48-L52 WeakPolarHBondContact O-CG 3.34Å; V48-L52 PolarHBondContact O-N 3.1Å; C49-L52 PolarHBondContact O-N 3.48Å; L50-L52 VanDerWaalsContact C-N 3.34Å; L50-L52 PolarHBondContact O-N 3.41Å; L52-V54 VanDerWaalsContact C-N 3.31Å; L52-V54 PolarHBondContact O-N 3.48Å; L52-V55 PolarHBondContact O-N 3.06Å; L52-T56 WeakPolarHBondContact O-CB 3.34Å; L52-T56 PolarHBondContact O-N 2.87Å; L52-T56 PolarHBondContact O-OG1 3.44Å |
| 53 | T | 90.9 | Very high | 90.2 | Very high | 2 Ų | 2 | 79.6 Ų | 79.6 | 1% | 0.012 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -55.3 | -47.8 | 174 | -61 | 0 | 0 | 0 | 0 | 110.7 | C49 L50 F51 T56 C57 H66 N115 I118 I119 | C49-T53 PolarHBondContact O-N 3.47Å; C49-T53 PolarHBondContact O-OG1 3.18Å; L50-T53 WeakPolarHBondContact O-CB 3.41Å; L50-T53 PolarHBondContact O-N 3.41Å; F51-T53 VanDerWaalsContact C-N 3.33Å; F51-T53 PolarHBondContact O-N 3.13Å; T53-T56 PolarHBondContact O-N 2.94Å; T53-C57 PolarHBondContact O-N 2.86Å; T53-C57 VanDerWaalsContact O-N 3.1Å; T53-C57 PolarHBondContact O-SG 2.84Å; T53-H66 PolarHBondContact OG1-NE2 3.11Å; T53-N115 PolarHBondContact OG1-OD1 2.9Å; T53-I118 HydrophobicContact CG2-CG2 4.26Å; T53-I119 HydrophobicContact CG2-CD1 4.27Å; T53-I119 HydrophobicContact CG2-CG1 3.78Å |
| 54 | V | 89.1 | Confident | 90.1 | Very high | 100 Ų | 100 | 78.8 Ų | 78.8 | 61% | 0.606 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -64.9 | -48.2 | 180 | 174.5 | 0 | 0 | 0 | 0 | 112.3 | L50 F51 L52 T56 C57 | L50-V54 WeakPolarHBondContact O-CG2 3.4Å; L50-V54 PolarHBondContact O-N 3.44Å; F51-V54 PolarHBondContact O-N 3.32Å; F51-V54 VanDerWaalsContact O-N 3.16Å; L52-V54 VanDerWaalsContact C-N 3.31Å; L52-V54 PolarHBondContact O-N 3.48Å; V54-T56 VanDerWaalsContact C-N 3.3Å; V54-T56 PolarHBondContact O-N 2.99Å; V54-C57 WeakPolarHBondContact O-CB 3.49Å; V54-C57 PolarHBondContact O-N 3.4Å |
| 55 | V | 89.1 | Confident | 90 | Very high | 64 Ų | 64 | 78.5 Ų | 78.5 | 39% | 0.388 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -63.6 | -41.3 | 179.4 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | F51 L52 C57 R58 | F51-V55 HydrophobicContact CD1-CG2 4.17Å; F51-V55 HydrophobicContact CD2-CG2 4.32Å; F51-V55 HydrophobicContact CE1-CG2 3.69Å; F51-V55 HydrophobicContact CE2-CG2 3.87Å; F51-V55 HydrophobicContact CG-CG2 4.47Å; F51-V55 HydrophobicContact CZ-CG2 3.53Å; F51-V55 WeakPolarHBondContact O-CG2 3.25Å; F51-V55 PolarHBondContact O-N 3.26Å; L52-V55 PolarHBondContact O-N 3.06Å; V55-C57 VanDerWaalsContact C-N 3.28Å; V55-C57 PolarHBondContact O-N 3.48Å; V55-R58 PolarHBondContact O-N 3.28Å |
| 56 | T | 87.5 | Confident | 89.8 | Confident | 15 Ų | 15 | 76.3 Ų | 76.3 | 9% | 0.092 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -75.4 | -17.8 | -174.4 | -55.7 | 0 | 0 | 0 | 0 | 112.6 | L52 T53 V54 R58 F59 A62 Q63 H66 | L52-T56 WeakPolarHBondContact O-CB 3.34Å; L52-T56 PolarHBondContact O-N 2.87Å; L52-T56 PolarHBondContact O-OG1 3.44Å; T53-T56 PolarHBondContact O-N 2.94Å; V54-T56 VanDerWaalsContact C-N 3.3Å; V54-T56 PolarHBondContact O-N 2.99Å; T56-R58 PolarHBondContact O-N 3.43Å; T56-F59 CarbonylContact O-C 3.51Å; T56-F59 PolarHBondContact O-N 3.23Å; T56-A62 HydrophobicContact CG2-CB 3.65Å; T56-Q63 HydrophobicContact CG2-CB 3.69Å; T56-Q63 HydrophobicContact CG2-CG 4.12Å; T56-H66 HydrophobicContact CG2-CB 4.41Å |
| 57 | C | 79.6 | Confident | 89.8 | Confident | 30 Ų | 30 | 77.3 Ų | 77.3 | 20% | 0.203 | 38% | 0.381 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -53.4 | -20.3 | 170.7 | -78 | 0 | 0 | 0 | 0 | 113.7 | T53 V54 V55 R126 | T53-C57 PolarHBondContact O-N 2.86Å; T53-C57 VanDerWaalsContact O-N 3.1Å; T53-C57 PolarHBondContact O-SG 2.84Å; V54-C57 WeakPolarHBondContact O-CB 3.49Å; V54-C57 PolarHBondContact O-N 3.4Å; V55-C57 VanDerWaalsContact C-N 3.28Å; V55-C57 PolarHBondContact O-N 3.48Å; C57-R126 PolarHBondContact O-NH2 3.33Å |
| 58 | R | 79.9 | Confident | 89.8 | Confident | 210 Ų | 210 | 78.2 Ų | 78.2 | 79% | 0.792 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.4 | -22.6 | 175.3 | -169.2 | 166.2 | 171.3 | 85.6 | -0.8 | 113.8 | V55 T56 | V55-R58 PolarHBondContact O-N 3.28Å; T56-R58 PolarHBondContact O-N 3.43Å |
| 59 | F | 86.4 | Confident | 89.8 | Confident | 123 Ų | 123 | 78.4 Ų | 78.4 | 54% | 0.539 | 38% | 0.383 | S | S | . | . | trans | -121.4 | 95.1 | -172.2 | -60.9 | -75.4 | 0 | 0 | 0 | 111.6 | T56 R61 A62 Q63 | T56-F59 CarbonylContact O-C 3.51Å; T56-F59 PolarHBondContact O-N 3.23Å; F59-R61 VanDerWaalsContact C-N 3.33Å; F59-R61 PolarHBondContact O-N 2.99Å; F59-A62 HydrophobicContact CB-CB 3.99Å; F59-A62 PolarHBondContact O-N 3.32Å; F59-A62 VanDerWaalsContact O-N 3.1Å; F59-Q63 PolarHBondContact O-N 2.98Å | ||
| 60 | Y | 83.6 | Confident | 89.9 | Confident | 143 Ų | 143 | 78.2 Ų | 78.2 | 56% | 0.561 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -52 | -44.3 | -175 | -178.9 | -107.2 | 0 | 0 | 0 | 114.4 | Q63 I64 | Y60-Q63 WeakPolarHBondContact O-CB 3.41Å; Y60-Q63 PolarHBondContact O-N 2.96Å; Y60-Q63 VanDerWaalsContact O-N 3.15Å; Y60-I64 HydrophobicContact CD1-CD1 4Å; Y60-I64 HydrophobicContact CE1-CD1 3.47Å; Y60-I64 VanDerWaalsContact CE1-CD1 3.47Å; Y60-I64 HydrophobicContact CE1-CG1 4.41Å; Y60-I64 HydrophobicContact CE2-CD1 4.44Å; Y60-I64 PolarHBondContact O-N 3.24Å; Y60-I64 VanDerWaalsContact O-N 3.12Å |
| 61 | R | 87.6 | Confident | 90 | Very high | 221 Ų | 221 | 77.2 Ų | 77.2 | 83% | 0.834 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -64.5 | -42.6 | -180 | -66.5 | 177.8 | 67.4 | -175.9 | 1.2 | 112.6 | F59 Q63 I64 C65 | F59-R61 VanDerWaalsContact C-N 3.33Å; F59-R61 PolarHBondContact O-N 2.99Å; R61-Q63 VanDerWaalsContact C-N 3.25Å; R61-Q63 PolarHBondContact O-N 2.74Å; R61-I64 PolarHBondContact O-N 3.46Å; R61-C65 PolarHBondContact O-N 3.37Å |
| 62 | A | 89.4 | Confident | 90.1 | Very high | 46 Ų | 46 | 72.5 Ų | 72.5 | 38% | 0.38 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -67.8 | -31.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | T56 F59 I64 C65 H66 | T56-A62 HydrophobicContact CG2-CB 3.65Å; F59-A62 HydrophobicContact CB-CB 3.99Å; F59-A62 PolarHBondContact O-N 3.32Å; F59-A62 VanDerWaalsContact O-N 3.1Å; A62-I64 PolarHBondContact O-N 2.89Å; A62-C65 PolarHBondContact O-N 3.16Å; A62-H66 WeakPolarHBondContact O-CB 3.48Å; A62-H66 PolarHBondContact O-N 3.49Å |
| 63 | Q | 91.8 | Very high | 90.2 | Very high | 1 Ų | 1 | 71.2 Ų | 71.2 | 1% | 0.005 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -67 | -37.1 | 178.7 | -154.2 | 176.9 | 4.3 | 0 | 0 | 112.4 | T56 F59 Y60 R61 F67 I119 W123 | T56-Q63 HydrophobicContact CG2-CB 3.69Å; T56-Q63 HydrophobicContact CG2-CG 4.12Å; F59-Q63 PolarHBondContact O-N 2.98Å; Y60-Q63 WeakPolarHBondContact O-CB 3.41Å; Y60-Q63 PolarHBondContact O-N 2.96Å; Y60-Q63 VanDerWaalsContact O-N 3.15Å; R61-Q63 VanDerWaalsContact C-N 3.25Å; R61-Q63 PolarHBondContact O-N 2.74Å; Q63-F67 VanDerWaalsContact O-CB 3.28Å; Q63-F67 WeakPolarHBondContact O-CB 3.25Å; Q63-F67 PolarHBondContact O-N 2.54Å; Q63-I119 HydrophobicContact CG-CG2 3.87Å; Q63-W123 HydrophobicContact CB-CZ2 4.48Å; Q63-W123 HydrophobicContact CG-CZ2 4.38Å; Q63-W123 VanDerWaalsContact OE1-NE1 3.1Å |
| 64 | I | 90.9 | Very high | 90.4 | Very high | 59 Ų | 59 | 72.6 Ų | 72.6 | 30% | 0.303 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -63.9 | -47.4 | 173 | -64.6 | 166.2 | 0 | 0 | 0 | 110.3 | Y60 R61 A62 H66 F67 L68 W123 | Y60-I64 HydrophobicContact CD1-CD1 4Å; Y60-I64 HydrophobicContact CE1-CD1 3.47Å; Y60-I64 VanDerWaalsContact CE1-CD1 3.47Å; Y60-I64 HydrophobicContact CE1-CG1 4.41Å; Y60-I64 HydrophobicContact CE2-CD1 4.44Å; Y60-I64 PolarHBondContact O-N 3.24Å; Y60-I64 VanDerWaalsContact O-N 3.12Å; R61-I64 PolarHBondContact O-N 3.46Å; A62-I64 PolarHBondContact O-N 2.89Å; I64-H66 PolarHBondContact O-N 2.94Å; I64-F67 PolarHBondContact O-N 3.5Å; I64-L68 HydrophobicContact CG2-CD1 4.15Å; I64-L68 HydrophobicContact CG2-CG 4.49Å; I64-L68 WeakPolarHBondContact O-CG 3.35Å; I64-L68 PolarHBondContact O-N 3.35Å; I64-W123 HydrophobicContact CB-CZ2 4.43Å; I64-W123 HydrophobicContact CG1-CH2 4.04Å; I64-W123 HydrophobicContact CG1-CZ2 3.77Å |
| 65 | C | 92.9 | Very high | 90.7 | Very high | 78 Ų | 78 | 77.7 Ų | 77.7 | 53% | 0.527 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -58.9 | -48.9 | 177.9 | -172.3 | 0 | 0 | 0 | 0 | 111.2 | R61 A62 F67 L68 V69 | R61-C65 PolarHBondContact O-N 3.37Å; A62-C65 PolarHBondContact O-N 3.16Å; C65-F67 PolarHBondContact O-N 3.38Å; C65-L68 PolarHBondContact O-N 3.05Å; C65-V69 WeakPolarHBondContact O-CG2 3.43Å; C65-V69 PolarHBondContact O-N 3.39Å |
| 66 | H | 92.8 | Very high | 90.9 | Very high | 20 Ų | 20 | 76.3 Ų | 76.3 | 9% | 0.093 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -59.3 | -44.1 | 176.9 | -174 | 60.2 | 0 | 0 | 0 | 112.2 | C49 T53 T56 A62 I64 L68 V69 I70 | C49-H66 PolarHBondContact O-NE2 2.99Å; T53-H66 PolarHBondContact OG1-NE2 3.11Å; T56-H66 HydrophobicContact CG2-CB 4.41Å; A62-H66 WeakPolarHBondContact O-CB 3.48Å; A62-H66 PolarHBondContact O-N 3.49Å; I64-H66 PolarHBondContact O-N 2.94Å; H66-L68 PolarHBondContact O-N 3.41Å; H66-V69 PolarHBondContact O-N 3Å; H66-I70 VanDerWaalsContact O-CG1 3.28Å; H66-I70 WeakPolarHBondContact O-CG1 3.36Å; H66-I70 PolarHBondContact O-N 3.31Å |
| 67 | F | 94.1 | Very high | 91.2 | Very high | 46 Ų | 46 | 75.9 Ų | 75.9 | 20% | 0.202 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -59.1 | -46 | 175.7 | 177.4 | -99.1 | 0 | 0 | 0 | 112.2 | Q63 I64 C65 V69 I70 V71 A116 I119 V120 W123 | Q63-F67 VanDerWaalsContact O-CB 3.28Å; Q63-F67 WeakPolarHBondContact O-CB 3.25Å; Q63-F67 PolarHBondContact O-N 2.54Å; I64-F67 PolarHBondContact O-N 3.5Å; C65-F67 PolarHBondContact O-N 3.38Å; F67-V69 VanDerWaalsContact C-N 3.32Å; F67-V69 PolarHBondContact O-N 3.26Å; F67-I70 PolarHBondContact O-N 3.39Å; F67-V71 HydrophobicContact CD1-CG2 4.29Å; F67-V71 HydrophobicContact CD2-CG2 4.29Å; F67-V71 HydrophobicContact CE1-CG2 3.87Å; F67-V71 HydrophobicContact CE2-CG2 3.87Å; F67-V71 HydrophobicContact CG-CG2 4.49Å; F67-V71 HydrophobicContact CZ-CG2 3.64Å; F67-V71 WeakPolarHBondContact O-CG2 3.42Å; F67-V71 PolarHBondContact O-N 2.9Å; F67-A116 HydrophobicContact CD2-CB 4.42Å; F67-A116 HydrophobicContact CE2-CB 4.12Å; F67-I119 HydrophobicContact CB-CD1 4.45Å; F67-I119 HydrophobicContact CB-CG2 4.23Å; F67-I119 HydrophobicContact CD2-CB 4.42Å; F67-I119 HydrophobicContact CD2-CG2 4.05Å; F67-I119 HydrophobicContact CG-CG2 4.48Å; F67-V120 HydrophobicContact CE2-CG2 3.82Å; F67-V120 HydrophobicContact CZ-CG2 4.36Å; F67-W123 HydrophobicContact CB-CH2 3.88Å; F67-W123 HydrophobicContact CB-CZ2 4.22Å; F67-W123 AromaticContact CD1-CH2 3.91Å; F67-W123 HydrophobicContact CD1-CH2 3.91Å; F67-W123 HydrophobicContact CD1-CZ3 4.25Å; F67-W123 HydrophobicContact CD2-CH2 4.48Å; F67-W123 AromaticContact CG-CH2 3.83Å; F67-W123 HydrophobicContact CG-CH2 3.83Å; F67-W123 HydrophobicContact CG-CZ3 4.34Å |
| 68 | L | 94.8 | Very high | 91.8 | Very high | 112 Ų | 112 | 81.2 Ų | 81.2 | 59% | 0.586 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -62.3 | -40.1 | 177.5 | -68.8 | 173.4 | 0 | 0 | 0 | 111.9 | I64 C65 H66 G72 | I64-L68 HydrophobicContact CG2-CD1 4.15Å; I64-L68 HydrophobicContact CG2-CG 4.49Å; I64-L68 WeakPolarHBondContact O-CG 3.35Å; I64-L68 PolarHBondContact O-N 3.35Å; C65-L68 PolarHBondContact O-N 3.05Å; H66-L68 PolarHBondContact O-N 3.41Å; L68-G72 PolarHBondContact O-N 3.48Å |
| 69 | V | 94.8 | Very high | 92.5 | Very high | 75 Ų | 75 | 78.5 Ų | 78.5 | 46% | 0.455 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -62.2 | -50.1 | 174.7 | 170.7 | 0 | 0 | 0 | 0 | 110.7 | C65 H66 F67 V71 G72 L73 | C65-V69 WeakPolarHBondContact O-CG2 3.43Å; C65-V69 PolarHBondContact O-N 3.39Å; H66-V69 PolarHBondContact O-N 3Å; F67-V69 VanDerWaalsContact C-N 3.32Å; F67-V69 PolarHBondContact O-N 3.26Å; V69-V71 PolarHBondContact O-N 3.18Å; V69-G72 PolarHBondContact O-N 2.91Å; V69-L73 HydrophobicContact CG1-CD1 3.79Å; V69-L73 HydrophobicContact CG1-CG 4.34Å; V69-L73 WeakPolarHBondContact O-CB 3.37Å; V69-L73 VanDerWaalsContact O-CG 3.22Å; V69-L73 WeakPolarHBondContact O-CG 3.41Å; V69-L73 PolarHBondContact O-N 2.85Å |
| 70 | I | 94.7 | Very high | 92.8 | Very high | 2 Ų | 2 | 75.5 Ų | 75.5 | 1% | 0.01 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -59.6 | -46 | 179.7 | -67 | -69.9 | 0 | 0 | 0 | 111.4 | C49 H66 F67 L73 V74 L112 A116 | C49-I70 HydrophobicContact CB-CD1 4.26Å; H66-I70 VanDerWaalsContact O-CG1 3.28Å; H66-I70 WeakPolarHBondContact O-CG1 3.36Å; H66-I70 PolarHBondContact O-N 3.31Å; F67-I70 PolarHBondContact O-N 3.39Å; I70-L73 WeakPolarHBondContact O-CB 3.48Å; I70-L73 PolarHBondContact O-N 3.42Å; I70-V74 WeakPolarHBondContact O-CG2 3.39Å; I70-V74 PolarHBondContact O-N 3.03Å; I70-L112 HydrophobicContact CD1-CD2 3.57Å; I70-L112 HydrophobicContact CG2-CB 4.19Å; I70-L112 HydrophobicContact CG2-CD2 4.48Å; I70-L112 WeakPolarHBondContact CG2-O 3.46Å; I70-A116 HydrophobicContact CG2-CB 4.08Å |
| 71 | V | 94.9 | Very high | 93.3 | Very high | 67 Ų | 67 | 69 Ų | 69 | 41% | 0.406 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -66 | -41.4 | 178.7 | 173.1 | 0 | 0 | 0 | 0 | 111.3 | F67 V69 L73 V74 Y75 | F67-V71 HydrophobicContact CD1-CG2 4.29Å; F67-V71 HydrophobicContact CD2-CG2 4.29Å; F67-V71 HydrophobicContact CE1-CG2 3.87Å; F67-V71 HydrophobicContact CE2-CG2 3.87Å; F67-V71 HydrophobicContact CG-CG2 4.49Å; F67-V71 HydrophobicContact CZ-CG2 3.64Å; F67-V71 WeakPolarHBondContact O-CG2 3.42Å; F67-V71 PolarHBondContact O-N 2.9Å; V69-V71 PolarHBondContact O-N 3.18Å; V71-L73 VanDerWaalsContact C-N 3.31Å; V71-L73 PolarHBondContact O-N 2.82Å; V71-V74 PolarHBondContact O-N 3.49Å; V71-Y75 WeakPolarHBondContact O-CB 3.31Å; V71-Y75 PolarHBondContact O-N 2.64Å |
| 72 | G | 95.6 | Very high | 93.6 | Very high | 36 Ų | 36 | 63.7 Ų | 63.7 | 37% | 0.371 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.4 | -39.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L68 V69 Y75 S76 | L68-G72 PolarHBondContact O-N 3.48Å; V69-G72 PolarHBondContact O-N 2.91Å; G72-Y75 PolarHBondContact O-N 3.47Å; G72-S76 PolarHBondContact O-N 3.35Å; G72-S76 PolarHBondContact O-OG 3.15Å |
| 73 | L | 94.4 | Very high | 93.7 | Very high | 46 Ų | 46 | 65.1 Ų | 65.1 | 24% | 0.241 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -63.8 | -44.5 | 175.9 | -75.5 | 170.3 | 0 | 0 | 0 | 112.2 | F45 V69 I70 V71 S76 A77 Y108 L112 | F45-L73 HydrophobicContact CE2-CD1 4.49Å; F45-L73 HydrophobicContact CZ-CD1 3.96Å; V69-L73 HydrophobicContact CG1-CD1 3.79Å; V69-L73 HydrophobicContact CG1-CG 4.34Å; V69-L73 WeakPolarHBondContact O-CB 3.37Å; V69-L73 VanDerWaalsContact O-CG 3.22Å; V69-L73 WeakPolarHBondContact O-CG 3.41Å; V69-L73 PolarHBondContact O-N 2.85Å; I70-L73 WeakPolarHBondContact O-CB 3.48Å; I70-L73 PolarHBondContact O-N 3.42Å; V71-L73 VanDerWaalsContact C-N 3.31Å; V71-L73 PolarHBondContact O-N 2.82Å; L73-S76 WeakPolarHBondContact CA-OG 3.48Å; L73-S76 PolarHBondContact O-N 3.42Å; L73-S76 PolarHBondContact O-OG 2.95Å; L73-A77 PolarHBondContact O-N 2.93Å; L73-Y108 WeakPolarHBondContact CB-OH 3.36Å; L73-Y108 WeakPolarHBondContact CD2-OH 3.34Å; L73-Y108 WeakPolarHBondContact O-CE1 3.28Å; L73-Y108 PolarHBondContact O-OH 3.47Å; L73-L112 HydrophobicContact CB-CD1 4.24Å |
| 74 | V | 95.1 | Very high | 93.7 | Very high | 31 Ų | 31 | 65.8 Ų | 65.8 | 19% | 0.188 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -63.7 | -41.7 | 174.7 | 174.1 | 0 | 0 | 0 | 0 | 111.2 | I70 V71 S76 A77 L112 L113 | I70-V74 WeakPolarHBondContact O-CG2 3.39Å; I70-V74 PolarHBondContact O-N 3.03Å; V71-V74 PolarHBondContact O-N 3.49Å; V74-S76 VanDerWaalsContact C-N 3.28Å; V74-S76 PolarHBondContact O-N 2.87Å; V74-A77 WeakPolarHBondContact O-CB 3.29Å; V74-A77 PolarHBondContact O-N 3.02Å; V74-A77 VanDerWaalsContact O-N 3.09Å; V74-L112 HydrophobicContact CG2-CB 3.53Å; V74-L112 HydrophobicContact CG2-CD1 4.06Å; V74-L112 HydrophobicContact CG2-CG 4.46Å; V74-L113 HydrophobicContact CG1-CD1 4.49Å; V74-L113 HydrophobicContact CG1-CD2 4.06Å; V74-L113 HydrophobicContact CG1-CG 4.16Å; V74-L113 HydrophobicContact CG2-CD2 4.41Å; V74-L113 HydrophobicContact CG2-CG 4.26Å |
| 75 | Y | 94.1 | Very high | 93.8 | Very high | 207 Ų | 207 | 64.3 Ų | 64.3 | 81% | 0.812 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -60.7 | -39.7 | 176.1 | 177.2 | -103.1 | 0 | 0 | 0 | 111.8 | V71 G72 A77 | V71-Y75 WeakPolarHBondContact O-CB 3.31Å; V71-Y75 PolarHBondContact O-N 2.64Å; G72-Y75 PolarHBondContact O-N 3.47Å; Y75-A77 PolarHBondContact O-N 2.87Å |
| 76 | S | 93.8 | Very high | 93.7 | Very high | 34 Ų | 34 | 67.9 Ų | 67.9 | 24% | 0.238 | 35% | 0.347 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.2 | -2.4 | 176.8 | 68.8 | 0 | 0 | 0 | 0 | 114.7 | G72 L73 V74 E78 Y79 L80 | G72-S76 PolarHBondContact O-N 3.35Å; G72-S76 PolarHBondContact O-OG 3.15Å; L73-S76 WeakPolarHBondContact CA-OG 3.48Å; L73-S76 PolarHBondContact O-N 3.42Å; L73-S76 PolarHBondContact O-OG 2.95Å; V74-S76 VanDerWaalsContact C-N 3.28Å; V74-S76 PolarHBondContact O-N 2.87Å; S76-E78 VanDerWaalsContact C-N 3.32Å; S76-E78 PolarHBondContact O-N 3.26Å; S76-Y79 PolarHBondContact O-N 3.49Å; S76-L80 WeakPolarHBondContact O-CG 3.31Å; S76-L80 PolarHBondContact O-N 3.1Å |
| 77 | A | 93.6 | Very high | 93.6 | Very high | 6 Ų | 6 | 70.9 Ų | 70.9 | 5% | 0.05 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -59.8 | -39.3 | -173.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | L73 V74 Y75 L80 N81 I104 Y108 S109 | L73-A77 PolarHBondContact O-N 2.93Å; V74-A77 WeakPolarHBondContact O-CB 3.29Å; V74-A77 PolarHBondContact O-N 3.02Å; V74-A77 VanDerWaalsContact O-N 3.09Å; Y75-A77 PolarHBondContact O-N 2.87Å; A77-L80 PolarHBondContact O-N 3.19Å; A77-N81 VanDerWaalsContact O-CB 3.24Å; A77-N81 WeakPolarHBondContact O-CB 3.47Å; A77-N81 PolarHBondContact O-N 2.91Å; A77-I104 HydrophobicContact CB-CG1 4.16Å; A77-Y108 HydrophobicContact CB-CD1 3.92Å; A77-Y108 HydrophobicContact CB-CE1 3.86Å; A77-S109 WeakPolarHBondContact CB-OG 3.33Å |
| 78 | E | 93.6 | Very high | 93.4 | Very high | 142 Ų | 142 | 71.3 Ų | 71.3 | 66% | 0.664 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -63.3 | -48.1 | 177.2 | -175.4 | 173.9 | -171.7 | 0 | 0 | 111.2 | S76 L80 N81 E82 | S76-E78 VanDerWaalsContact C-N 3.32Å; S76-E78 PolarHBondContact O-N 3.26Å; E78-L80 PolarHBondContact O-N 3.12Å; E78-N81 WeakPolarHBondContact O-CB 3.34Å; E78-N81 PolarHBondContact O-N 2.88Å; E78-N81 VanDerWaalsContact O-N 3.15Å; E78-E82 PolarHBondContact O-N 3.05Å |
| 79 | Y | 93.2 | Very high | 93.2 | Very high | 153 Ų | 153 | 75.6 Ų | 75.6 | 60% | 0.6 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -61.4 | -43.5 | 176.6 | 179.9 | -102.6 | 0 | 0 | 0 | 112.4 | S76 N81 E82 L83 | S76-Y79 PolarHBondContact O-N 3.49Å; Y79-N81 VanDerWaalsContact C-N 3.29Å; Y79-N81 PolarHBondContact O-N 2.94Å; Y79-E82 PolarHBondContact O-N 3.14Å; Y79-L83 WeakPolarHBondContact O-CB 3.32Å; Y79-L83 PolarHBondContact O-N 3.36Å |
| 80 | L | 92.6 | Very high | 92.9 | Very high | 61 Ų | 61 | 77.2 Ų | 77.2 | 32% | 0.319 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -62.4 | -38.5 | 175.5 | -71.5 | 175.7 | 0 | 0 | 0 | 111.6 | S76 A77 E78 L83 A84 Y108 | S76-L80 WeakPolarHBondContact O-CG 3.31Å; S76-L80 PolarHBondContact O-N 3.1Å; A77-L80 PolarHBondContact O-N 3.19Å; E78-L80 PolarHBondContact O-N 3.12Å; L80-L83 PolarHBondContact O-N 2.98Å; L80-A84 WeakPolarHBondContact O-CB 3.45Å; L80-A84 PolarHBondContact O-N 3.32Å; L80-Y108 HydrophobicContact CD1-CE1 4.12Å; L80-Y108 WeakPolarHBondContact CD1-OH 3.45Å |
| 81 | N | 94.6 | Very high | 92.5 | Very high | 6 Ų | 6 | 80.6 Ų | 80.6 | 3% | 0.032 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -66.5 | -42.7 | 177.1 | 173.5 | 84.8 | 0 | 0 | 0 | 112.3 | A77 E78 Y79 A84 A85 F97 D98 I104 | A77-N81 VanDerWaalsContact O-CB 3.24Å; A77-N81 WeakPolarHBondContact O-CB 3.47Å; A77-N81 PolarHBondContact O-N 2.91Å; E78-N81 WeakPolarHBondContact O-CB 3.34Å; E78-N81 PolarHBondContact O-N 2.88Å; E78-N81 VanDerWaalsContact O-N 3.15Å; Y79-N81 VanDerWaalsContact C-N 3.29Å; Y79-N81 PolarHBondContact O-N 2.94Å; N81-A84 PolarHBondContact O-N 2.9Å; N81-A85 WeakPolarHBondContact O-CB 3.36Å; N81-A85 PolarHBondContact O-N 3.45Å; N81-F97 HydrophobicContact CB-CD1 4.3Å; N81-F97 WeakPolarHBondContact OD1-CB 3.37Å; N81-F97 WeakPolarHBondContact OD1-CD1 3.47Å; N81-D98 PolarHBondContact ND2-O 3.3Å; N81-I104 HydrophobicContact CB-CB 3.95Å; N81-I104 HydrophobicContact CB-CG1 4.21Å; N81-I104 HydrophobicContact CB-CG2 3.63Å |
| 82 | E | 93.6 | Very high | 92.1 | Very high | 110 Ų | 110 | 77.7 Ų | 77.7 | 51% | 0.514 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -62.1 | -47 | 173.5 | -70.2 | -175.4 | 161.6 | 0 | 0 | 111.6 | E78 Y79 A84 A85 M86 | E78-E82 PolarHBondContact O-N 3.05Å; Y79-E82 PolarHBondContact O-N 3.14Å; E82-A84 VanDerWaalsContact C-N 3.31Å; E82-A84 PolarHBondContact O-N 3.21Å; E82-A85 CarbonylContact O-C 3.57Å; E82-A85 PolarHBondContact O-N 3.31Å; E82-M86 WeakPolarHBondContact O-CG 3.36Å; E82-M86 PolarHBondContact O-N 3.44Å |
| 83 | L | 92.6 | Very high | 91.6 | Very high | 76 Ų | 76 | 82 Ų | 82 | 40% | 0.398 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -61.8 | -41.9 | 178.8 | -174.7 | 66 | 0 | 0 | 0 | 111.7 | Y79 L80 M86 N87 | Y79-L83 WeakPolarHBondContact O-CB 3.32Å; Y79-L83 PolarHBondContact O-N 3.36Å; L80-L83 PolarHBondContact O-N 2.98Å; L83-M86 PolarHBondContact O-N 2.98Å; L83-N87 WeakPolarHBondContact CD1-ND2 2.99Å; L83-N87 WeakPolarHBondContact O-CB 3.38Å; L83-N87 PolarHBondContact O-N 3.19Å; L83-N87 PolarHBondContact O-ND2 3.48Å |
| 84 | A | 90.9 | Very high | 91.2 | Very high | 14 Ų | 14 | 84.4 Ų | 84.4 | 12% | 0.116 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -68.2 | -36.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L80 N81 E82 M86 N87 W88 F91 F97 | L80-A84 WeakPolarHBondContact O-CB 3.45Å; L80-A84 PolarHBondContact O-N 3.32Å; N81-A84 PolarHBondContact O-N 2.9Å; E82-A84 VanDerWaalsContact C-N 3.31Å; E82-A84 PolarHBondContact O-N 3.21Å; A84-M86 VanDerWaalsContact C-N 3.33Å; A84-N87 CarbonylContact O-C 3.58Å; A84-N87 PolarHBondContact O-N 3.16Å; A84-W88 VanDerWaalsContact O-CA 3.24Å; A84-W88 WeakPolarHBondContact O-CA 3.42Å; A84-W88 WeakPolarHBondContact O-CB 3.37Å; A84-W88 PolarHBondContact O-N 2.84Å; A84-F91 HydrophobicContact CB-CE1 4.37Å; A84-F91 HydrophobicContact CB-CZ 3.89Å; A84-F97 HydrophobicContact CB-CB 4.38Å; A84-F97 HydrophobicContact CB-CD1 3.64Å; A84-F97 HydrophobicContact CB-CD2 3.54Å; A84-F97 HydrophobicContact CB-CE1 3.69Å; A84-F97 HydrophobicContact CB-CE2 3.63Å; A84-F97 HydrophobicContact CB-CG 3.56Å; A84-F97 HydrophobicContact CB-CZ 3.68Å |
| 85 | A | 92.4 | Very high | 90.9 | Very high | 29 Ų | 29 | 88.6 Ų | 88.6 | 24% | 0.24 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -69.3 | -27.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113 | N81 E82 W88 F97 | N81-A85 WeakPolarHBondContact O-CB 3.36Å; N81-A85 PolarHBondContact O-N 3.45Å; E82-A85 CarbonylContact O-C 3.57Å; E82-A85 PolarHBondContact O-N 3.31Å; A85-W88 VanDerWaalsContact O-CD1 3.22Å; A85-F97 HydrophobicContact CB-CB 3.75Å |
| 86 | M | 92.1 | Very high | 90.6 | Very high | 153 Ų | 153 | 79.8 Ų | 79.8 | 75% | 0.754 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -78 | -34.6 | 173.2 | -70.6 | 177.1 | 69.6 | 0 | 0 | 112.1 | E82 L83 A84 | E82-M86 WeakPolarHBondContact O-CG 3.36Å; E82-M86 PolarHBondContact O-N 3.44Å; L83-M86 PolarHBondContact O-N 2.98Å; A84-M86 VanDerWaalsContact C-N 3.33Å |
| 87 | N | 90.3 | Very high | 90.5 | Very high | 83 Ų | 83 | 78.6 Ų | 78.6 | 44% | 0.444 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -108.5 | 12.1 | -172.2 | -64.3 | -76.7 | 0 | 0 | 0 | 114.1 | L83 A84 R89 S90 F91 | L83-N87 WeakPolarHBondContact CD1-ND2 2.99Å; L83-N87 WeakPolarHBondContact O-CB 3.38Å; L83-N87 PolarHBondContact O-N 3.19Å; L83-N87 PolarHBondContact O-ND2 3.48Å; A84-N87 CarbonylContact O-C 3.58Å; A84-N87 PolarHBondContact O-N 3.16Å; N87-R89 PolarHBondContact O-N 3.14Å; N87-S90 VanDerWaalsContact O-CB 3.27Å; N87-S90 WeakPolarHBondContact O-CB 3.35Å; N87-S90 PolarHBondContact O-N 2.82Å; N87-F91 HydrophobicContact CB-CE1 4.44Å; N87-F91 VanDerWaalsContact O-CD1 3.3Å; N87-F91 WeakPolarHBondContact O-CD1 3.37Å; N87-F91 WeakPolarHBondContact O-CE1 3.5Å |
| 88 | W | 89.9 | Confident | 90.2 | Very high | 54 Ų | 54 | 80.9 Ų | 80.9 | 21% | 0.205 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -52.1 | -38.8 | -169.7 | 68.1 | -89.1 | 0 | 0 | 0 | 113.4 | A84 A85 S90 F91 S92 Q95 | A84-W88 VanDerWaalsContact O-CA 3.24Å; A84-W88 WeakPolarHBondContact O-CA 3.42Å; A84-W88 WeakPolarHBondContact O-CB 3.37Å; A84-W88 PolarHBondContact O-N 2.84Å; A85-W88 VanDerWaalsContact O-CD1 3.22Å; W88-S90 PolarHBondContact O-N 2.94Å; W88-S90 VanDerWaalsContact O-N 3.15Å; W88-F91 VanDerWaalsContact CA-CE1 3.47Å; W88-F91 PolarHBondContact O-N 3.24Å; W88-S92 WeakPolarHBondContact O-CA 3.28Å; W88-S92 WeakPolarHBondContact O-CB 3.5Å; W88-S92 PolarHBondContact O-N 3.5Å; W88-Q95 HydrophobicContact CD2-CB 3.98Å; W88-Q95 HydrophobicContact CD2-CG 4.27Å; W88-Q95 HydrophobicContact CE3-CB 4.26Å; W88-Q95 HydrophobicContact CG-CB 4.28Å; W88-Q95 HydrophobicContact CG-CG 4.1Å |
| 89 | R | 90.1 | Very high | 89.9 | Confident | 202 Ų | 202 | 80.2 Ų | 80.2 | 76% | 0.762 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -63.4 | -20.2 | -179.7 | -63.3 | -174.8 | 180 | -176.4 | 0.7 | 114.4 | N87 | N87-R89 PolarHBondContact O-N 3.14Å |
| 90 | S | 88.4 | Confident | 89.5 | Confident | 109 Ų | 109 | 81.1 Ų | 81.1 | 76% | 0.762 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -77.6 | -30.5 | -178.5 | -170.7 | 0 | 0 | 0 | 0 | 112.2 | N87 W88 | N87-S90 VanDerWaalsContact O-CB 3.27Å; N87-S90 WeakPolarHBondContact O-CB 3.35Å; N87-S90 PolarHBondContact O-N 2.82Å; W88-S90 PolarHBondContact O-N 2.94Å; W88-S90 VanDerWaalsContact O-N 3.15Å |
| 91 | F | 85.6 | Confident | 89.3 | Confident | 73 Ų | 73 | 78.6 Ų | 78.6 | 32% | 0.32 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -129.7 | -15.9 | -170.1 | 68.3 | -93 | 0 | 0 | 0 | 114.6 | W38 A84 N87 W88 F97 | W38-F91 AromaticContact CD1-CD2 4Å; W38-F91 AromaticContact CD2-CD2 3.9Å; W38-F91 HydrophobicContact CD2-CD2 3.9Å; W38-F91 HydrophobicContact CD2-CE2 4.05Å; W38-F91 AromaticContact CE2-CE2 3.99Å; W38-F91 HydrophobicContact CE3-CD2 4.48Å; W38-F91 HydrophobicContact CE3-CE2 4.32Å; W38-F91 AromaticContact CG-CD2 3.91Å; W38-F91 HydrophobicContact CG-CD2 3.91Å; W38-F91 HydrophobicContact CH2-CE2 4.47Å; W38-F91 HydrophobicContact CZ2-CE2 4.23Å; A84-F91 HydrophobicContact CB-CE1 4.37Å; A84-F91 HydrophobicContact CB-CZ 3.89Å; N87-F91 HydrophobicContact CB-CE1 4.44Å; N87-F91 VanDerWaalsContact O-CD1 3.3Å; N87-F91 WeakPolarHBondContact O-CD1 3.37Å; N87-F91 WeakPolarHBondContact O-CE1 3.5Å; W88-F91 VanDerWaalsContact CA-CE1 3.47Å; W88-F91 PolarHBondContact O-N 3.24Å; F91-F97 AromaticContact CE2-CE2 3.72Å; F91-F97 HydrophobicContact CE2-CE2 3.72Å; F91-F97 HydrophobicContact CE2-CZ 4.38Å; F91-F97 HydrophobicContact CZ-CD2 4.14Å; F91-F97 AromaticContact CZ-CE2 3.59Å; F91-F97 HydrophobicContact CZ-CE2 3.59Å; F91-F97 HydrophobicContact CZ-CZ 4.37Å |
| 92 | S | 87.4 | Confident | 89 | Confident | 7 Ų | 7 | 82.2 Ų | 82.2 | 5% | 0.049 | 42% | 0.417 | C | S | . | . | trans | -131.2 | 142.7 | -175.2 | 179.6 | 0 | 0 | 0 | 0 | 110.8 | E36 W88 F94 Y96 | E36-S92 PolarHBondContact OE2-OG 3.46Å; W88-S92 WeakPolarHBondContact O-CA 3.28Å; W88-S92 WeakPolarHBondContact O-CB 3.5Å; W88-S92 PolarHBondContact O-N 3.5Å; S92-F94 VanDerWaalsContact C-N 3.3Å; S92-F94 WeakPolarHBondContact CB-O 3.35Å; S92-F94 PolarHBondContact OG-N 3.43Å; S92-F94 PolarHBondContact OG-O 3.33Å; S92-Y96 WeakPolarHBondContact OG-CD2 3.46Å; S92-Y96 VanDerWaalsContact OG-CE2 3.3Å; S92-Y96 WeakPolarHBondContact OG-CE2 3.48Å | ||
| 93 | N | 84.3 | Confident | 88.9 | Confident | 126 Ų | 126 | 77 Ų | 77 | 67% | 0.674 | 39% | 0.393 | S | S | * | . | S | Bend | trans | -78.5 | -19.8 | 173.7 | -61.3 | -79.5 | 0 | 0 | 0 | 111.8 | E36 | E36-N93 WeakPolarHBondContact OE1-CB 3.47Å; E36-N93 PolarHBondContact OE1-N 2.96Å; E36-N93 PolarHBondContact OE1-ND2 3.47Å |
| 94 | F | 86.8 | Confident | 88.9 | Confident | 97 Ų | 97 | 74.1 Ų | 74.1 | 43% | 0.425 | 38% | 0.378 | S | S | . | . | S | Bend | trans | -125.5 | 150 | -177.5 | -58.6 | -91.2 | 0 | 0 | 0 | 111.7 | Q33 S92 Y96 | Q33-F94 HydrophobicContact CG-CD2 4.42Å; Q33-F94 HydrophobicContact CG-CE2 4.18Å; S92-F94 VanDerWaalsContact C-N 3.3Å; S92-F94 WeakPolarHBondContact CB-O 3.35Å; S92-F94 PolarHBondContact OG-N 3.43Å; S92-F94 PolarHBondContact OG-O 3.33Å; F94-Y96 HydrophobicContact CB-CD2 4.33Å; F94-Y96 HydrophobicContact CB-CE1 4.15Å; F94-Y96 HydrophobicContact CB-CE2 3.77Å; F94-Y96 WeakPolarHBondContact CD2-OH 3.36Å; F94-Y96 WeakPolarHBondContact O-CD2 3.44Å; F94-Y96 PolarHBondContact O-N 3.09Å |
| 95 | Q | 88.1 | Confident | 89 | Confident | 118 Ų | 118 | 75.7 Ų | 75.7 | 55% | 0.551 | 39% | 0.388 | S | S | * | . | trans | -86 | 90.1 | 176 | -170 | 178.9 | -35.2 | 0 | 0 | 110.3 | W88 | W88-Q95 HydrophobicContact CD2-CB 3.98Å; W88-Q95 HydrophobicContact CD2-CG 4.27Å; W88-Q95 HydrophobicContact CE3-CB 4.26Å; W88-Q95 HydrophobicContact CG-CB 4.28Å; W88-Q95 HydrophobicContact CG-CG 4.1Å | ||
| 96 | Y | 88.5 | Confident | 88.9 | Confident | 22 Ų | 22 | 75.8 Ų | 75.8 | 9% | 0.086 | 38% | 0.384 | C | S | . | . | trans | -80.7 | -26.7 | 176.9 | -62.8 | -70.2 | 0 | 0 | 0 | 113.7 | V32 Q33 E36 W38 S92 F94 F103 | V32-Y96 HydrophobicContact CB-CE1 4.28Å; V32-Y96 HydrophobicContact CG1-CD1 4.45Å; V32-Y96 HydrophobicContact CG1-CE1 3.98Å; V32-Y96 HydrophobicContact CG2-CD1 4.26Å; V32-Y96 HydrophobicContact CG2-CE1 4.16Å; Q33-Y96 WeakPolarHBondContact CB-OH 3.45Å; Q33-Y96 PolarHBondContact N-OH 2.97Å; E36-Y96 VanDerWaalsContact OE2-CE2 3.28Å; E36-Y96 WeakPolarHBondContact OE2-CE2 3.49Å; W38-Y96 HydrophobicContact CH2-CD2 4.18Å; W38-Y96 AromaticContact CZ2-CD2 3.54Å; W38-Y96 HydrophobicContact CZ2-CD2 3.54Å; W38-Y96 AromaticContact CZ2-CE2 3.88Å; W38-Y96 HydrophobicContact CZ2-CE2 3.88Å; W38-Y96 HydrophobicContact CZ2-CG 4.46Å; S92-Y96 WeakPolarHBondContact OG-CD2 3.46Å; S92-Y96 VanDerWaalsContact OG-CE2 3.3Å; S92-Y96 WeakPolarHBondContact OG-CE2 3.48Å; F94-Y96 HydrophobicContact CB-CD2 4.33Å; F94-Y96 HydrophobicContact CB-CE1 4.15Å; F94-Y96 HydrophobicContact CB-CE2 3.77Å; F94-Y96 WeakPolarHBondContact CD2-OH 3.36Å; F94-Y96 WeakPolarHBondContact O-CD2 3.44Å; F94-Y96 PolarHBondContact O-N 3.09Å; Y96-F103 HydrophobicContact CD1-CD2 4.29Å; Y96-F103 HydrophobicContact CD1-CE2 4.4Å; Y96-F103 HydrophobicContact CG-CD2 4.34Å; Y96-F103 HydrophobicContact CG-CE2 4.38Å; Y96-F103 WeakPolarHBondContact O-CB 3.46Å | ||
| 97 | F | 91.1 | Very high | 88.9 | Confident | 10 Ų | 10 | 69.1 Ų | 69.1 | 4% | 0.044 | 35% | 0.352 | C | S | . | . | trans | -90.4 | 127.7 | -173.9 | -55 | -87 | 0 | 0 | 0 | 110.3 | W38 N81 A84 A85 F91 F103 I104 | W38-F97 AromaticContact CH2-CE2 3.8Å; W38-F97 HydrophobicContact CH2-CE2 3.8Å; W38-F97 AromaticContact CH2-CZ 3.62Å; W38-F97 HydrophobicContact CH2-CZ 3.62Å; W38-F97 HydrophobicContact CZ2-CE2 4.36Å; W38-F97 HydrophobicContact CZ3-CE2 4.29Å; W38-F97 AromaticContact CZ3-CZ 3.78Å; W38-F97 HydrophobicContact CZ3-CZ 3.78Å; N81-F97 HydrophobicContact CB-CD1 4.3Å; N81-F97 WeakPolarHBondContact OD1-CB 3.37Å; N81-F97 WeakPolarHBondContact OD1-CD1 3.47Å; A84-F97 HydrophobicContact CB-CB 4.38Å; A84-F97 HydrophobicContact CB-CD1 3.64Å; A84-F97 HydrophobicContact CB-CD2 3.54Å; A84-F97 HydrophobicContact CB-CE1 3.69Å; A84-F97 HydrophobicContact CB-CE2 3.63Å; A84-F97 HydrophobicContact CB-CG 3.56Å; A84-F97 HydrophobicContact CB-CZ 3.68Å; A85-F97 HydrophobicContact CB-CB 3.75Å; F91-F97 AromaticContact CE2-CE2 3.72Å; F91-F97 HydrophobicContact CE2-CE2 3.72Å; F91-F97 HydrophobicContact CE2-CZ 4.38Å; F91-F97 HydrophobicContact CZ-CD2 4.14Å; F91-F97 AromaticContact CZ-CE2 3.59Å; F91-F97 HydrophobicContact CZ-CE2 3.59Å; F91-F97 HydrophobicContact CZ-CZ 4.37Å; F97-F103 HydrophobicContact CD1-CD1 4.09Å; F97-F103 AromaticContact CE1-CD1 3.7Å; F97-F103 HydrophobicContact CE1-CD1 3.7Å; F97-F103 AromaticContact CE1-CE1 3.93Å; F97-F103 HydrophobicContact CE1-CE1 3.93Å; F97-F103 HydrophobicContact CZ-CD1 4.03Å; F97-F103 AromaticContact CZ-CE1 3.89Å; F97-F103 HydrophobicContact CZ-CE1 3.89Å; F97-I104 HydrophobicContact CE1-CD1 3.97Å | ||
| 98 | D | 87.9 | Confident | 89.1 | Confident | 54 Ų | 54 | 65.9 Ų | 65.9 | 29% | 0.289 | 33% | 0.334 | S | S | . | . | trans | -131.3 | 165.7 | -177 | 74.5 | -22.5 | 0 | 0 | 0 | 111.2 | N81 K100 G101 M102 | N81-D98 PolarHBondContact ND2-O 3.3Å; D98-K100 PolarHBondContact O-N 3.09Å; D98-G101 PolarHBondContact O-N 3.48Å; D98-G101 WeakPolarHBondContact OD1-CA 3.34Å; D98-G101 PolarHBondContact OD1-N 3.05Å; D98-M102 PolarHBondContact OD1-N 2.74Å | ||
| 99 | S | 87.3 | Confident | 89.3 | Confident | 127 Ų | 127 | 63.9 Ų | 63.9 | 89% | 0.888 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.6 | -19.4 | 179.5 | 56.5 | 0 | 0 | 0 | 0 | 113.6 | G101 | S99-G101 VanDerWaalsContact C-N 3.35Š|
| 100 | K | 84.7 | Confident | 89.5 | Confident | 172 Ų | 172 | 58 Ų | 58 | 75% | 0.748 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.6 | -14.8 | 174.9 | -59.6 | -175.9 | 178.4 | 180 | 0 | 112.6 | D98 M102 | D98-K100 PolarHBondContact O-N 3.09Å; K100-M102 VanDerWaalsContact C-N 3.27Å; K100-M102 PolarHBondContact O-N 3.13Å |
| 101 | G | 87.9 | Confident | 89.7 | Confident | 9 Ų | 9 | 54.6 Ų | 54.6 | 9% | 0.093 | 29% | 0.286 | C | S | . | . | trans | 62.4 | 30.6 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | D98 S99 F103 I104 S105 | D98-G101 PolarHBondContact O-N 3.48Å; D98-G101 WeakPolarHBondContact OD1-CA 3.34Å; D98-G101 PolarHBondContact OD1-N 3.05Å; S99-G101 VanDerWaalsContact C-N 3.35Å; G101-F103 PolarHBondContact O-N 2.79Å; G101-I104 WeakPolarHBondContact O-CG2 3.37Å; G101-S105 WeakPolarHBondContact O-CB 3.39Å; G101-S105 PolarHBondContact O-N 3.44Å; G101-S105 PolarHBondContact O-OG 3.15Å | ||
| 102 | M | 89 | Confident | 90.2 | Very high | 81 Ų | 81 | 51.1 Ų | 51.1 | 40% | 0.399 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -63.4 | -44.5 | -175.5 | -174.4 | -179.1 | -61.6 | 0 | 0 | 111.1 | F28 D98 K100 S105 L106 | F28-M102 HydrophobicContact CE1-CG 4.48Å; F28-M102 HydrophobicContact CG-SD 4.44Å; D98-M102 PolarHBondContact OD1-N 2.74Å; K100-M102 VanDerWaalsContact C-N 3.27Å; K100-M102 PolarHBondContact O-N 3.13Å; M102-S105 PolarHBondContact O-OG 2.96Å; M102-L106 HydrophobicContact CG-CD1 3.93Å; M102-L106 WeakPolarHBondContact O-CB 3.42Å; M102-L106 WeakPolarHBondContact O-CD1 3.4Å; M102-L106 VanDerWaalsContact O-CG 3.24Å; M102-L106 WeakPolarHBondContact O-CG 3.2Å; M102-L106 PolarHBondContact O-N 3.11Å |
| 103 | F | 91.8 | Very high | 90.5 | Very high | 1 Ų | 1 | 55 Ų | 55 | 0% | 0.004 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.5 | -54.2 | 177.6 | 178.4 | -95.9 | 0 | 0 | 0 | 112.2 | F28 V32 W38 L39 Y96 F97 G101 S105 L106 V107 | F28-F103 HydrophobicContact CE1-CB 4.37Å; F28-F103 HydrophobicContact CE1-CD2 4.24Å; F28-F103 HydrophobicContact CZ-CB 3.98Å; F28-F103 HydrophobicContact CZ-CD2 4.13Å; V32-F103 HydrophobicContact CG1-CE2 4.11Å; V32-F103 HydrophobicContact CG2-CD2 4.27Å; V32-F103 HydrophobicContact CG2-CE2 4.14Å; W38-F103 AromaticContact CH2-CE1 3.67Å; W38-F103 HydrophobicContact CH2-CE1 3.67Å; W38-F103 AromaticContact CH2-CZ 3.74Å; W38-F103 HydrophobicContact CH2-CZ 3.74Å; W38-F103 HydrophobicContact CZ3-CE1 4.14Å; W38-F103 HydrophobicContact CZ3-CZ 4.33Å; L39-F103 HydrophobicContact CD2-CE1 4.46Å; L39-F103 HydrophobicContact CD2-CE2 4.22Å; L39-F103 HydrophobicContact CD2-CZ 3.52Å; Y96-F103 HydrophobicContact CD1-CD2 4.29Å; Y96-F103 HydrophobicContact CD1-CE2 4.4Å; Y96-F103 HydrophobicContact CG-CD2 4.34Å; Y96-F103 HydrophobicContact CG-CE2 4.38Å; Y96-F103 WeakPolarHBondContact O-CB 3.46Å; F97-F103 HydrophobicContact CD1-CD1 4.09Å; F97-F103 AromaticContact CE1-CD1 3.7Å; F97-F103 HydrophobicContact CE1-CD1 3.7Å; F97-F103 AromaticContact CE1-CE1 3.93Å; F97-F103 HydrophobicContact CE1-CE1 3.93Å; F97-F103 HydrophobicContact CZ-CD1 4.03Å; F97-F103 AromaticContact CZ-CE1 3.89Å; F97-F103 HydrophobicContact CZ-CE1 3.89Å; G101-F103 PolarHBondContact O-N 2.79Å; F103-S105 VanDerWaalsContact C-N 3.27Å; F103-S105 PolarHBondContact O-N 3.41Å; F103-L106 PolarHBondContact O-N 2.97Å; F103-V107 HydrophobicContact CD2-CG2 3.9Å; F103-V107 HydrophobicContact CE1-CB 4.37Å; F103-V107 HydrophobicContact CE2-CB 4.1Å; F103-V107 HydrophobicContact CE2-CG1 4.36Å; F103-V107 HydrophobicContact CE2-CG2 3.6Å; F103-V107 HydrophobicContact CZ-CB 3.95Å; F103-V107 HydrophobicContact CZ-CG1 3.99Å; F103-V107 HydrophobicContact CZ-CG2 3.99Å; F103-V107 WeakPolarHBondContact O-CB 3.4Å; F103-V107 PolarHBondContact O-N 2.93Å |
| 104 | I | 92.6 | Very high | 91 | Very high | 15 Ų | 15 | 54 Ų | 54 | 8% | 0.077 | 29% | 0.285 | C | S | . | . | I | π-helix | trans | -62.6 | -36.6 | -176.1 | -163.3 | 72.6 | 0 | 0 | 0 | 111.1 | A77 N81 F97 G101 Y108 S109 | A77-I104 HydrophobicContact CB-CG1 4.16Å; N81-I104 HydrophobicContact CB-CB 3.95Å; N81-I104 HydrophobicContact CB-CG1 4.21Å; N81-I104 HydrophobicContact CB-CG2 3.63Å; F97-I104 HydrophobicContact CE1-CD1 3.97Å; G101-I104 WeakPolarHBondContact O-CG2 3.37Å; I104-Y108 HydrophobicContact CD1-CD1 3.85Å; I104-Y108 HydrophobicContact CD1-CG 3.81Å; I104-Y108 HydrophobicContact CG1-CD1 3.9Å; I104-Y108 HydrophobicContact CG1-CG 4.27Å; I104-Y108 CarbonylContact O-C 3.59Å; I104-Y108 WeakPolarHBondContact O-CA 3.24Å; I104-Y108 WeakPolarHBondContact O-CB 3.33Å; I104-Y108 PolarHBondContact O-N 3.13Å; I104-S109 PolarHBondContact O-N 3.04Å |
| 105 | S | 92.1 | Very high | 91.3 | Very high | 47 Ų | 47 | 49.8 Ų | 49.8 | 33% | 0.329 | 27% | 0.267 | S | S | . | . | I | π-helix | trans | -67.2 | -47.1 | 179.9 | 58.9 | 0 | 0 | 0 | 0 | 111.1 | G101 M102 F103 S109 I110 | G101-S105 WeakPolarHBondContact O-CB 3.39Å; G101-S105 PolarHBondContact O-N 3.44Å; G101-S105 PolarHBondContact O-OG 3.15Å; M102-S105 PolarHBondContact O-OG 2.96Å; F103-S105 VanDerWaalsContact C-N 3.27Å; F103-S105 PolarHBondContact O-N 3.41Å; S105-S109 WeakPolarHBondContact O-CB 3.44Å; S105-S109 PolarHBondContact O-N 3.14Å; S105-I110 WeakPolarHBondContact O-CG1 3.41Å; S105-I110 PolarHBondContact O-N 3.21Å |
| 106 | L | 90.8 | Very high | 91.6 | Very high | 31 Ų | 31 | 44.6 Ų | 44.6 | 16% | 0.162 | 24% | 0.244 | C | C | . | . | I | π-helix | trans | -70.9 | -46.8 | -177.4 | -69.4 | 172.4 | 0 | 0 | 0 | 112.9 | I25 F28 M102 F103 I110 P111 | I25-L106 HydrophobicContact CD1-CD2 4.38Å; I25-L106 HydrophobicContact CG2-CD1 3.65Å; I25-L106 HydrophobicContact CG2-CD2 3.77Å; I25-L106 HydrophobicContact CG2-CG 4.35Å; F28-L106 HydrophobicContact CD1-CD1 3.98Å; F28-L106 HydrophobicContact CE1-CD1 4.16Å; M102-L106 HydrophobicContact CG-CD1 3.93Å; M102-L106 WeakPolarHBondContact O-CB 3.42Å; M102-L106 WeakPolarHBondContact O-CD1 3.4Å; M102-L106 VanDerWaalsContact O-CG 3.24Å; M102-L106 WeakPolarHBondContact O-CG 3.2Å; M102-L106 PolarHBondContact O-N 3.11Å; F103-L106 PolarHBondContact O-N 2.97Å; L106-I110 HydrophobicContact CD2-CD1 3.73Å; L106-P111 WeakPolarHBondContact O-CD 3.38Å |
| 107 | V | 93 | Very high | 91.9 | Very high | 13 Ų | 13 | 47.2 Ų | 47.2 | 8% | 0.079 | 26% | 0.262 | C | S | . | . | I | π-helix | trans | -90.4 | -33.3 | -169.4 | -175.2 | 0 | 0 | 0 | 0 | 111.6 | L29 W34 L42 H46 F103 P111 | L29-V107 HydrophobicContact CD2-CG2 3.81Å; W34-V107 HydrophobicContact CH2-CG1 3.91Å; W34-V107 HydrophobicContact CH2-CG2 4.02Å; W34-V107 HydrophobicContact CZ3-CG1 3.98Å; L42-V107 HydrophobicContact CD2-CG1 3.66Å; H46-V107 PolarHBondContact NE2-O 3.37Å; F103-V107 HydrophobicContact CD2-CG2 3.9Å; F103-V107 HydrophobicContact CE1-CB 4.37Å; F103-V107 HydrophobicContact CE2-CB 4.1Å; F103-V107 HydrophobicContact CE2-CG1 4.36Å; F103-V107 HydrophobicContact CE2-CG2 3.6Å; F103-V107 HydrophobicContact CZ-CB 3.95Å; F103-V107 HydrophobicContact CZ-CG1 3.99Å; F103-V107 HydrophobicContact CZ-CG2 3.99Å; F103-V107 WeakPolarHBondContact O-CB 3.4Å; F103-V107 PolarHBondContact O-N 2.93Å; V107-P111 WeakPolarHBondContact O-CG 3.39Å |
| 108 | Y | 94.1 | Very high | 91.9 | Very high | 15 Ų | 15 | 50.4 Ų | 50.4 | 6% | 0.059 | 28% | 0.279 | C | S | . | . | I | π-helix | trans | -103.5 | -54.7 | -178.4 | 172.8 | -99.5 | 0 | 0 | 0 | 112.5 | L42 F45 H46 L73 A77 L80 I104 L112 | L42-Y108 HydrophobicContact CD1-CD2 3.89Å; F45-Y108 HydrophobicContact CE1-CD2 4.36Å; F45-Y108 AromaticContact CE1-CE2 3.97Å; F45-Y108 HydrophobicContact CE1-CE2 3.97Å; F45-Y108 HydrophobicContact CZ-CE2 4.49Å; H46-Y108 PolarHBondContact CE1-O 2.87Å; L73-Y108 WeakPolarHBondContact CB-OH 3.36Å; L73-Y108 WeakPolarHBondContact CD2-OH 3.34Å; L73-Y108 WeakPolarHBondContact O-CE1 3.28Å; L73-Y108 PolarHBondContact O-OH 3.47Å; A77-Y108 HydrophobicContact CB-CD1 3.92Å; A77-Y108 HydrophobicContact CB-CE1 3.86Å; L80-Y108 HydrophobicContact CD1-CE1 4.12Å; L80-Y108 WeakPolarHBondContact CD1-OH 3.45Å; I104-Y108 HydrophobicContact CD1-CD1 3.85Å; I104-Y108 HydrophobicContact CD1-CG 3.81Å; I104-Y108 HydrophobicContact CG1-CD1 3.9Å; I104-Y108 HydrophobicContact CG1-CG 4.27Å; I104-Y108 CarbonylContact O-C 3.59Å; I104-Y108 WeakPolarHBondContact O-CA 3.24Å; I104-Y108 WeakPolarHBondContact O-CB 3.33Å; I104-Y108 PolarHBondContact O-N 3.13Å; Y108-L112 HydrophobicContact CD1-CD1 4.05Å; Y108-L112 HydrophobicContact CD2-CD1 3.93Å; Y108-L112 HydrophobicContact CE1-CD1 3.79Å; Y108-L112 HydrophobicContact CE2-CD1 3.68Å; Y108-L112 HydrophobicContact CG-CD1 4.13Å; Y108-L112 WeakPolarHBondContact O-CD1 3.24Å; Y108-L112 VanDerWaalsContact O-CG 3.24Å; Y108-L112 WeakPolarHBondContact O-CG 3.46Å; Y108-L112 PolarHBondContact O-N 2.93Å |
| 109 | S | 94.1 | Very high | 92.1 | Very high | 13 Ų | 13 | 47.9 Ų | 47.9 | 9% | 0.091 | 27% | 0.265 | C | S | . | . | I | π-helix | trans | -72.9 | -43.4 | -171.7 | -56.5 | 0 | 0 | 0 | 0 | 113.9 | A77 I104 S105 L112 L113 | A77-S109 WeakPolarHBondContact CB-OG 3.33Å; I104-S109 PolarHBondContact O-N 3.04Å; S105-S109 WeakPolarHBondContact O-CB 3.44Å; S105-S109 PolarHBondContact O-N 3.14Å; S109-L112 PolarHBondContact O-N 2.87Å; S109-L113 WeakPolarHBondContact O-CB 3.22Å; S109-L113 WeakPolarHBondContact O-CG 3.37Å; S109-L113 PolarHBondContact O-N 3.47Å |
| 110 | I | 93.8 | Very high | 92.4 | Very high | 78 Ų | 78 | 44.7 Ų | 44.7 | 40% | 0.4 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -60 | -50.4 | -177.7 | -74.1 | 177.2 | 0 | 0 | 0 | 112.1 | S105 L106 L112 L113 L114 | S105-I110 WeakPolarHBondContact O-CG1 3.41Å; S105-I110 PolarHBondContact O-N 3.21Å; L106-I110 HydrophobicContact CD2-CD1 3.73Å; I110-L112 VanDerWaalsContact C-N 3.26Å; I110-L112 PolarHBondContact O-N 3.06Å; I110-L113 PolarHBondContact O-N 3.29Å; I110-L114 HydrophobicContact CG2-CD1 4.22Å; I110-L114 HydrophobicContact CG2-CG 4.46Å; I110-L114 WeakPolarHBondContact O-CG 3.49Å; I110-L114 PolarHBondContact O-N 3.37Å |
| 111 | P | 93.8 | Very high | 92.8 | Very high | 38 Ų | 38 | 41.1 Ų | 41.1 | 25% | 0.247 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.4 | -35.2 | 176.9 | -26.4 | 36.2 | 0 | 0 | 0 | 113.5 | L106 V107 N115 | L106-P111 WeakPolarHBondContact O-CD 3.38Å; V107-P111 WeakPolarHBondContact O-CG 3.39Å; P111-N115 PolarHBondContact O-N 3.24Å; P111-N115 VanDerWaalsContact O-N 3.16Å; P111-N115 PolarHBondContact O-ND2 3.45Å |
| 112 | L | 94.5 | Very high | 92.9 | Very high | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -68.9 | -42.9 | 175.5 | -70.6 | 174.6 | 0 | 0 | 0 | 111.9 | F45 I70 L73 V74 Y108 S109 I110 L114 N115 A116 | F45-L112 HydrophobicContact CE1-CD1 4.45Å; F45-L112 HydrophobicContact CE1-CD2 3.97Å; F45-L112 HydrophobicContact CZ-CD2 4.17Å; I70-L112 HydrophobicContact CD1-CD2 3.57Å; I70-L112 HydrophobicContact CG2-CB 4.19Å; I70-L112 HydrophobicContact CG2-CD2 4.48Å; I70-L112 WeakPolarHBondContact CG2-O 3.46Å; L73-L112 HydrophobicContact CB-CD1 4.24Å; V74-L112 HydrophobicContact CG2-CB 3.53Å; V74-L112 HydrophobicContact CG2-CD1 4.06Å; V74-L112 HydrophobicContact CG2-CG 4.46Å; Y108-L112 HydrophobicContact CD1-CD1 4.05Å; Y108-L112 HydrophobicContact CD2-CD1 3.93Å; Y108-L112 HydrophobicContact CE1-CD1 3.79Å; Y108-L112 HydrophobicContact CE2-CD1 3.68Å; Y108-L112 HydrophobicContact CG-CD1 4.13Å; Y108-L112 WeakPolarHBondContact O-CD1 3.24Å; Y108-L112 VanDerWaalsContact O-CG 3.24Å; Y108-L112 WeakPolarHBondContact O-CG 3.46Å; Y108-L112 PolarHBondContact O-N 2.93Å; S109-L112 PolarHBondContact O-N 2.87Å; I110-L112 VanDerWaalsContact C-N 3.26Å; I110-L112 PolarHBondContact O-N 3.06Å; L112-L114 VanDerWaalsContact C-N 3.34Å; L112-L114 PolarHBondContact O-N 2.98Å; L112-N115 WeakPolarHBondContact O-CB 3.28Å; L112-N115 PolarHBondContact O-N 3.43Å; L112-A116 PolarHBondContact O-N 3.32Å |
| 113 | L | 94.5 | Very high | 93 | Very high | 87 Ų | 87 | 40.9 Ų | 40.9 | 46% | 0.455 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -62.9 | -40.2 | 175.2 | -76 | 170.7 | 0 | 0 | 0 | 111.7 | V74 S109 I110 N115 A116 V117 | V74-L113 HydrophobicContact CG1-CD1 4.49Å; V74-L113 HydrophobicContact CG1-CD2 4.06Å; V74-L113 HydrophobicContact CG1-CG 4.16Å; V74-L113 HydrophobicContact CG2-CD2 4.41Å; V74-L113 HydrophobicContact CG2-CG 4.26Å; S109-L113 WeakPolarHBondContact O-CB 3.22Å; S109-L113 WeakPolarHBondContact O-CG 3.37Å; S109-L113 PolarHBondContact O-N 3.47Å; I110-L113 PolarHBondContact O-N 3.29Å; L113-N115 VanDerWaalsContact C-N 3.31Å; L113-N115 PolarHBondContact O-N 3.02Å; L113-A116 WeakPolarHBondContact O-CB 3.43Å; L113-A116 PolarHBondContact O-N 3.23Å; L113-A116 VanDerWaalsContact O-N 3.14Å; L113-V117 WeakPolarHBondContact O-CG2 3.19Å; L113-V117 PolarHBondContact O-N 3.43Å |
| 114 | L | 94.4 | Very high | 93.1 | Very high | 106 Ų | 106 | 43.8 Ų | 43.8 | 56% | 0.555 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -60.3 | -42.4 | 173.8 | -70.6 | 174.6 | 0 | 0 | 0 | 111.4 | I110 L112 A116 V117 I118 | I110-L114 HydrophobicContact CG2-CD1 4.22Å; I110-L114 HydrophobicContact CG2-CG 4.46Å; I110-L114 WeakPolarHBondContact O-CG 3.49Å; I110-L114 PolarHBondContact O-N 3.37Å; L112-L114 VanDerWaalsContact C-N 3.34Å; L112-L114 PolarHBondContact O-N 2.98Å; L114-A116 VanDerWaalsContact C-N 3.35Å; L114-A116 PolarHBondContact O-N 3.34Å; L114-V117 PolarHBondContact O-N 3.46Å; L114-I118 VanDerWaalsContact O-CG1 3.31Å; L114-I118 WeakPolarHBondContact O-CG1 3.42Å; L114-I118 PolarHBondContact O-N 3.1Å |
| 115 | N | 93.3 | Very high | 92.9 | Very high | 9 Ų | 9 | 51.1 Ų | 51.1 | 5% | 0.048 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -59.4 | -45.2 | 172.3 | -84.2 | -73.6 | 0 | 0 | 0 | 111.9 | L50 T53 P111 L112 L113 V117 I118 I119 | L50-N115 WeakPolarHBondContact CA-OD1 3.38Å; L50-N115 WeakPolarHBondContact CD1-OD1 2.96Å; T53-N115 PolarHBondContact OG1-OD1 2.9Å; P111-N115 PolarHBondContact O-N 3.24Å; P111-N115 VanDerWaalsContact O-N 3.16Å; P111-N115 PolarHBondContact O-ND2 3.45Å; L112-N115 WeakPolarHBondContact O-CB 3.28Å; L112-N115 PolarHBondContact O-N 3.43Å; L113-N115 VanDerWaalsContact C-N 3.31Å; L113-N115 PolarHBondContact O-N 3.02Å; N115-V117 PolarHBondContact O-N 3.3Å; N115-I118 PolarHBondContact O-N 2.97Å; N115-I119 WeakPolarHBondContact O-CG1 3.35Å; N115-I119 PolarHBondContact O-N 2.92Å |
| 116 | A | 93.9 | Very high | 92.7 | Very high | 9 Ų | 9 | 54.7 Ų | 54.7 | 7% | 0.074 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.9 | -43.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | F67 I70 L112 L113 L114 I118 I119 V120 | F67-A116 HydrophobicContact CD2-CB 4.42Å; F67-A116 HydrophobicContact CE2-CB 4.12Å; I70-A116 HydrophobicContact CG2-CB 4.08Å; L112-A116 PolarHBondContact O-N 3.32Å; L113-A116 WeakPolarHBondContact O-CB 3.43Å; L113-A116 PolarHBondContact O-N 3.23Å; L113-A116 VanDerWaalsContact O-N 3.14Å; L114-A116 VanDerWaalsContact C-N 3.35Å; L114-A116 PolarHBondContact O-N 3.34Å; A116-I118 PolarHBondContact O-N 3.44Å; A116-I119 WeakPolarHBondContact O-CB 3.4Å; A116-I119 PolarHBondContact O-N 3.29Å; A116-V120 WeakPolarHBondContact O-CG2 3.3Å; A116-V120 PolarHBondContact O-N 2.9Å |
| 117 | V | 94.6 | Very high | 92.6 | Very high | 76 Ų | 76 | 57.6 Ų | 57.6 | 46% | 0.461 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -61.3 | -44.1 | 176.2 | 171 | 0 | 0 | 0 | 0 | 111 | L113 L114 N115 I119 V120 M121 | L113-V117 WeakPolarHBondContact O-CG2 3.19Å; L113-V117 PolarHBondContact O-N 3.43Å; L114-V117 PolarHBondContact O-N 3.46Å; N115-V117 PolarHBondContact O-N 3.3Å; V117-I119 VanDerWaalsContact C-N 3.32Å; V117-I119 PolarHBondContact O-N 3.37Å; V117-V120 PolarHBondContact O-N 3.25Å; V117-M121 HydrophobicContact CG1-CE 4.23Å; V117-M121 HydrophobicContact CG1-CG 4.29Å; V117-M121 VanDerWaalsContact O-CG 3.29Å; V117-M121 WeakPolarHBondContact O-CG 3.32Å; V117-M121 PolarHBondContact O-N 3.46Å |
| 118 | I | 91.8 | Very high | 92.5 | Very high | 78 Ų | 78 | 63.3 Ų | 63.3 | 40% | 0.4 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -58.6 | -45 | 176.5 | -68.5 | 164.4 | 0 | 0 | 0 | 110.8 | T53 L114 N115 A116 V120 M121 V122 | T53-I118 HydrophobicContact CG2-CG2 4.26Å; L114-I118 VanDerWaalsContact O-CG1 3.31Å; L114-I118 WeakPolarHBondContact O-CG1 3.42Å; L114-I118 PolarHBondContact O-N 3.1Å; N115-I118 PolarHBondContact O-N 2.97Å; A116-I118 PolarHBondContact O-N 3.44Å; I118-V120 PolarHBondContact O-N 3.31Å; I118-M121 PolarHBondContact O-N 2.92Å; I118-V122 WeakPolarHBondContact O-CG2 3.49Å; I118-V122 PolarHBondContact O-N 2.98Å |
| 119 | I | 92.4 | Very high | 92.2 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -59.6 | -48 | 177.3 | -67.5 | 164.8 | 0 | 0 | 0 | 110.9 | T53 Q63 F67 N115 A116 V117 M121 V122 W123 | T53-I119 HydrophobicContact CG2-CD1 4.27Å; T53-I119 HydrophobicContact CG2-CG1 3.78Å; Q63-I119 HydrophobicContact CG-CG2 3.87Å; F67-I119 HydrophobicContact CB-CD1 4.45Å; F67-I119 HydrophobicContact CB-CG2 4.23Å; F67-I119 HydrophobicContact CD2-CB 4.42Å; F67-I119 HydrophobicContact CD2-CG2 4.05Å; F67-I119 HydrophobicContact CG-CG2 4.48Å; N115-I119 WeakPolarHBondContact O-CG1 3.35Å; N115-I119 PolarHBondContact O-N 2.92Å; A116-I119 WeakPolarHBondContact O-CB 3.4Å; A116-I119 PolarHBondContact O-N 3.29Å; V117-I119 VanDerWaalsContact C-N 3.32Å; V117-I119 PolarHBondContact O-N 3.37Å; I119-M121 VanDerWaalsContact C-N 3.35Å; I119-M121 PolarHBondContact O-N 3.31Å; I119-V122 PolarHBondContact O-N 2.75Å; I119-W123 HydrophobicContact CG2-CD2 4.13Å; I119-W123 HydrophobicContact CG2-CH2 4.33Å; I119-W123 HydrophobicContact CG2-CZ2 3.78Å; I119-W123 PolarHBondContact O-N 2.99Å |
| 120 | V | 93.7 | Very high | 91.8 | Very high | 61 Ų | 61 | 68.9 Ų | 68.9 | 37% | 0.37 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -60.5 | -44.4 | 178.4 | 171.5 | 0 | 0 | 0 | 0 | 110.9 | F67 A116 V117 I118 V122 W123 V124 | F67-V120 HydrophobicContact CE2-CG2 3.82Å; F67-V120 HydrophobicContact CZ-CG2 4.36Å; A116-V120 WeakPolarHBondContact O-CG2 3.3Å; A116-V120 PolarHBondContact O-N 2.9Å; V117-V120 PolarHBondContact O-N 3.25Å; I118-V120 PolarHBondContact O-N 3.31Å; V120-V122 PolarHBondContact O-N 2.72Å; V120-W123 WeakPolarHBondContact O-CB 3.41Å; V120-W123 PolarHBondContact O-N 3.3Å; V120-W123 VanDerWaalsContact O-N 3.16Å; V120-V124 HydrophobicContact CG1-CG2 4.34Å; V120-V124 VanDerWaalsContact O-CG2 3.31Å; V120-V124 WeakPolarHBondContact O-CG2 3.22Å; V120-V124 PolarHBondContact O-N 2.87Å |
| 121 | M | 92.3 | Very high | 91.5 | Very high | 97 Ų | 97 | 70 Ų | 70 | 48% | 0.478 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -59.1 | -46.5 | 176.5 | -69.5 | -60.9 | 176 | 0 | 0 | 111.3 | V117 I118 I119 W123 V124 Y125 | V117-M121 HydrophobicContact CG1-CE 4.23Å; V117-M121 HydrophobicContact CG1-CG 4.29Å; V117-M121 VanDerWaalsContact O-CG 3.29Å; V117-M121 WeakPolarHBondContact O-CG 3.32Å; V117-M121 PolarHBondContact O-N 3.46Å; I118-M121 PolarHBondContact O-N 2.92Å; I119-M121 VanDerWaalsContact C-N 3.35Å; I119-M121 PolarHBondContact O-N 3.31Å; M121-W123 VanDerWaalsContact C-N 3.31Å; M121-W123 PolarHBondContact O-N 3.02Å; M121-V124 PolarHBondContact O-N 2.64Å; M121-Y125 HydrophobicContact CB-CD2 4.43Å; M121-Y125 HydrophobicContact CB-CE2 4.14Å; M121-Y125 WeakPolarHBondContact O-CD2 3.08Å; M121-Y125 PolarHBondContact O-N 3.22Å |
| 122 | V | 90.4 | Very high | 91.2 | Very high | 34 Ų | 34 | 72.1 Ų | 72.1 | 21% | 0.206 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -58.3 | -42.4 | 175.6 | 170.5 | 0 | 0 | 0 | 0 | 111.5 | I118 I119 V120 Y125 R126 | I118-V122 WeakPolarHBondContact O-CG2 3.49Å; I118-V122 PolarHBondContact O-N 2.98Å; I119-V122 PolarHBondContact O-N 2.75Å; V120-V122 PolarHBondContact O-N 2.72Å; V122-Y125 PolarHBondContact O-N 2.79Å; V122-R126 HydrophobicContact CG1-CG 4.42Å; V122-R126 WeakPolarHBondContact O-CB 3.34Å; V122-R126 VanDerWaalsContact O-CG 3.26Å; V122-R126 WeakPolarHBondContact O-CG 3.39Å; V122-R126 PolarHBondContact O-N 3.2Å |
| 123 | W | 92.1 | Very high | 91 | Very high | 51 Ų | 51 | 77.8 Ų | 77.8 | 19% | 0.193 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -63.9 | -42.3 | 176.4 | -71.5 | -2.4 | 0 | 0 | 0 | 112.6 | Q63 I64 F67 I119 V120 M121 R126 T127 | Q63-W123 HydrophobicContact CB-CZ2 4.48Å; Q63-W123 HydrophobicContact CG-CZ2 4.38Å; Q63-W123 VanDerWaalsContact OE1-NE1 3.1Å; I64-W123 HydrophobicContact CB-CZ2 4.43Å; I64-W123 HydrophobicContact CG1-CH2 4.04Å; I64-W123 HydrophobicContact CG1-CZ2 3.77Å; F67-W123 HydrophobicContact CB-CH2 3.88Å; F67-W123 HydrophobicContact CB-CZ2 4.22Å; F67-W123 AromaticContact CD1-CH2 3.91Å; F67-W123 HydrophobicContact CD1-CH2 3.91Å; F67-W123 HydrophobicContact CD1-CZ3 4.25Å; F67-W123 HydrophobicContact CD2-CH2 4.48Å; F67-W123 AromaticContact CG-CH2 3.83Å; F67-W123 HydrophobicContact CG-CH2 3.83Å; F67-W123 HydrophobicContact CG-CZ3 4.34Å; I119-W123 HydrophobicContact CG2-CD2 4.13Å; I119-W123 HydrophobicContact CG2-CH2 4.33Å; I119-W123 HydrophobicContact CG2-CZ2 3.78Å; I119-W123 PolarHBondContact O-N 2.99Å; V120-W123 WeakPolarHBondContact O-CB 3.41Å; V120-W123 PolarHBondContact O-N 3.3Å; V120-W123 VanDerWaalsContact O-N 3.16Å; M121-W123 VanDerWaalsContact C-N 3.31Å; M121-W123 PolarHBondContact O-N 3.02Å; W123-R126 PolarHBondContact O-N 2.89Å; W123-T127 WeakPolarHBondContact O-CB 3.4Å; W123-T127 PolarHBondContact O-N 3.28Å; W123-T127 PolarHBondContact O-OG1 3.37Å |
| 124 | V | 92.6 | Very high | 90.7 | Very high | 61 Ų | 61 | 78.2 Ų | 78.2 | 37% | 0.37 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -60.6 | -51.1 | 176.5 | 171.2 | 0 | 0 | 0 | 0 | 110 | V120 M121 R126 T127 F128 | V120-V124 HydrophobicContact CG1-CG2 4.34Å; V120-V124 VanDerWaalsContact O-CG2 3.31Å; V120-V124 WeakPolarHBondContact O-CG2 3.22Å; V120-V124 PolarHBondContact O-N 2.87Å; M121-V124 PolarHBondContact O-N 2.64Å; V124-R126 VanDerWaalsContact C-N 3.35Å; V124-R126 PolarHBondContact O-N 3.45Å; V124-T127 PolarHBondContact O-N 3.02Å; V124-F128 HydrophobicContact CG1-CD2 3.6Å; V124-F128 HydrophobicContact CG1-CE2 3.43Å; V124-F128 VanDerWaalsContact CG1-CE2 3.43Å; V124-F128 WeakPolarHBondContact O-CD2 3.48Å; V124-F128 PolarHBondContact O-N 3.3Å |
| 125 | Y | 89.5 | Confident | 90.5 | Very high | 170 Ų | 170 | 78.9 Ų | 78.9 | 67% | 0.667 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -58 | -44.3 | 177.1 | -71.6 | -62.3 | 0 | 0 | 0 | 112.5 | M121 V122 T127 F128 S129 | M121-Y125 HydrophobicContact CB-CD2 4.43Å; M121-Y125 HydrophobicContact CB-CE2 4.14Å; M121-Y125 WeakPolarHBondContact O-CD2 3.08Å; M121-Y125 PolarHBondContact O-N 3.22Å; V122-Y125 PolarHBondContact O-N 2.79Å; Y125-T127 PolarHBondContact O-N 3.24Å; Y125-F128 PolarHBondContact O-N 2.74Å; Y125-S129 WeakPolarHBondContact O-CB 3.37Å; Y125-S129 PolarHBondContact O-N 2.87Å |
| 126 | R | 87.3 | Confident | 90.3 | Very high | 121 Ų | 121 | 82.8 Ų | 82.8 | 46% | 0.457 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -63.9 | -40.4 | 177.5 | -74.8 | -178.4 | -178.6 | -70.6 | -0.5 | 112.3 | C57 V122 W123 V124 S129 T130 | C57-R126 PolarHBondContact O-NH2 3.33Å; V122-R126 HydrophobicContact CG1-CG 4.42Å; V122-R126 WeakPolarHBondContact O-CB 3.34Å; V122-R126 VanDerWaalsContact O-CG 3.26Å; V122-R126 WeakPolarHBondContact O-CG 3.39Å; V122-R126 PolarHBondContact O-N 3.2Å; W123-R126 PolarHBondContact O-N 2.89Å; V124-R126 VanDerWaalsContact C-N 3.35Å; V124-R126 PolarHBondContact O-N 3.45Å; R126-S129 PolarHBondContact O-N 3.33Å; R126-T130 WeakPolarHBondContact O-CB 3.4Å; R126-T130 PolarHBondContact O-N 3.33Å; R126-T130 PolarHBondContact O-OG1 2.94Å |
| 127 | T | 88.7 | Confident | 90.1 | Very high | 93 Ų | 93 | 85.8 Ų | 85.8 | 57% | 0.571 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -64.4 | -47.2 | 178.4 | -58.4 | 0 | 0 | 0 | 0 | 110.6 | W123 V124 Y125 T130 M131 | W123-T127 WeakPolarHBondContact O-CB 3.4Å; W123-T127 PolarHBondContact O-N 3.28Å; W123-T127 PolarHBondContact O-OG1 3.37Å; V124-T127 PolarHBondContact O-N 3.02Å; Y125-T127 PolarHBondContact O-N 3.24Å; T127-T130 PolarHBondContact O-N 3.29Å; T127-M131 WeakPolarHBondContact O-CB 3.1Å; T127-M131 PolarHBondContact O-N 3.43Å |
| 128 | F | 90.6 | Very high | 89.9 | Confident | 132 Ų | 132 | 87.6 Ų | 87.6 | 58% | 0.579 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -59.8 | -48.4 | 174.7 | -81.1 | -66.1 | 0 | 0 | 0 | 112 | V124 Y125 T130 M131 T132 | V124-F128 HydrophobicContact CG1-CD2 3.6Å; V124-F128 HydrophobicContact CG1-CE2 3.43Å; V124-F128 VanDerWaalsContact CG1-CE2 3.43Å; V124-F128 WeakPolarHBondContact O-CD2 3.48Å; V124-F128 PolarHBondContact O-N 3.3Å; Y125-F128 PolarHBondContact O-N 2.74Å; F128-T130 VanDerWaalsContact C-N 3.35Å; F128-T130 PolarHBondContact O-N 3.29Å; F128-M131 PolarHBondContact O-N 2.91Å; F128-T132 WeakPolarHBondContact O-CG2 3.42Å; F128-T132 PolarHBondContact O-N 2.83Å; F128-T132 PolarHBondContact O-OG1 3.45Å |
| 129 | S | 87.6 | Confident | 89.9 | Confident | 72 Ų | 72 | 89.5 Ų | 89.5 | 50% | 0.503 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -56.9 | -48.1 | 177.7 | -172.8 | 0 | 0 | 0 | 0 | 111.6 | Y125 R126 M131 T132 E133 | Y125-S129 WeakPolarHBondContact O-CB 3.37Å; Y125-S129 PolarHBondContact O-N 2.87Å; R126-S129 PolarHBondContact O-N 3.33Å; S129-M131 PolarHBondContact O-N 2.89Å; S129-T132 PolarHBondContact O-N 3.09Å; S129-T132 PolarHBondContact O-OG1 3.37Å; S129-E133 PolarHBondContact O-N 3.41Å |
| 130 | T | 87.1 | Confident | 89.9 | Confident | 74 Ų | 74 | 95.1 Ų | 95.1 | 45% | 0.454 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.9 | -42.5 | 179.2 | -53 | 0 | 0 | 0 | 0 | 111.4 | R126 T127 F128 T132 E133 L134 | R126-T130 WeakPolarHBondContact O-CB 3.4Å; R126-T130 PolarHBondContact O-N 3.33Å; R126-T130 PolarHBondContact O-OG1 2.94Å; T127-T130 PolarHBondContact O-N 3.29Å; F128-T130 VanDerWaalsContact C-N 3.35Å; F128-T130 PolarHBondContact O-N 3.29Å; T130-T132 PolarHBondContact O-N 2.93Å; T130-E133 PolarHBondContact O-N 2.85Å; T130-L134 HydrophobicContact CG2-CD1 4.09Å; T130-L134 HydrophobicContact CG2-CG 4.37Å; T130-L134 WeakPolarHBondContact O-CB 3.45Å; T130-L134 VanDerWaalsContact O-CG 3.25Å; T130-L134 WeakPolarHBondContact O-CG 3.41Å; T130-L134 PolarHBondContact O-N 3.26Å |
| 131 | M | 85.9 | Confident | 89.8 | Confident | 100 Ų | 100 | 100.8 Ų | 100.8 | 49% | 0.493 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.4 | -41.2 | 178 | -172.8 | 178.3 | -175.5 | 0 | 0 | 111.8 | T127 F128 S129 L134 K135 | T127-M131 WeakPolarHBondContact O-CB 3.1Å; T127-M131 PolarHBondContact O-N 3.43Å; F128-M131 PolarHBondContact O-N 2.91Å; S129-M131 PolarHBondContact O-N 2.89Å; M131-L134 PolarHBondContact O-N 2.63Å; M131-K135 WeakPolarHBondContact O-CG 3.42Å; M131-K135 PolarHBondContact O-N 3.19Å |
| 132 | T | 89 | Confident | 89.7 | Confident | 84 Ų | 84 | 104 Ų | 104 | 52% | 0.515 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.9 | -39.4 | 176 | 59.1 | 0 | 0 | 0 | 0 | 112.1 | F128 S129 T130 T136 | F128-T132 WeakPolarHBondContact O-CG2 3.42Å; F128-T132 PolarHBondContact O-N 2.83Å; F128-T132 PolarHBondContact O-OG1 3.45Å; S129-T132 PolarHBondContact O-N 3.09Å; S129-T132 PolarHBondContact O-OG1 3.37Å; T130-T132 PolarHBondContact O-N 2.93Å; T132-T136 WeakPolarHBondContact O-CB 3.3Å; T132-T136 PolarHBondContact O-N 2.92Å; T132-T136 PolarHBondContact O-OG1 3.15Å |
| 133 | E | 89.6 | Confident | 89.8 | Confident | 119 Ų | 119 | 104.5 Ų | 104.5 | 56% | 0.556 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.6 | -45.4 | 175 | -171.9 | 179.2 | 176.4 | 0 | 0 | 111.3 | S129 T130 K135 T136 L137 | S129-E133 PolarHBondContact O-N 3.41Å; T130-E133 PolarHBondContact O-N 2.85Å; E133-K135 PolarHBondContact O-N 2.77Å; E133-T136 WeakPolarHBondContact O-CB 3.35Å; E133-T136 PolarHBondContact O-N 2.94Å; E133-L137 HydrophobicContact CG-CD1 4.18Å; E133-L137 HydrophobicContact CG-CG 4.5Å; E133-L137 WeakPolarHBondContact O-CB 3.09Å; E133-L137 WeakPolarHBondContact O-CG 3.38Å; E133-L137 PolarHBondContact O-N 2.9Å |
| 134 | L | 87.9 | Confident | 89.7 | Confident | 95 Ų | 95 | 109.7 Ų | 109.7 | 50% | 0.497 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.1 | -42.8 | 177.1 | -72.3 | 175 | 0 | 0 | 0 | 112.1 | T130 M131 L137 Q138 | T130-L134 HydrophobicContact CG2-CD1 4.09Å; T130-L134 HydrophobicContact CG2-CG 4.37Å; T130-L134 WeakPolarHBondContact O-CB 3.45Å; T130-L134 VanDerWaalsContact O-CG 3.25Å; T130-L134 WeakPolarHBondContact O-CG 3.41Å; T130-L134 PolarHBondContact O-N 3.26Å; M131-L134 PolarHBondContact O-N 2.63Å; L134-L137 PolarHBondContact O-N 3.43Å; L134-Q138 WeakPolarHBondContact O-CB 3.44Å; L134-Q138 VanDerWaalsContact O-CG 3.29Å; L134-Q138 WeakPolarHBondContact O-CG 3.46Å; L134-Q138 PolarHBondContact O-N 3.2Å |
| 135 | K | 89.3 | Confident | 89.6 | Confident | 121 Ų | 121 | 115.4 Ų | 115.4 | 53% | 0.526 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -62.5 | -43.1 | 174.5 | -78.3 | -159.1 | 174.6 | -170.3 | 0 | 111.5 | M131 E133 L137 Q138 L139 | M131-K135 WeakPolarHBondContact O-CG 3.42Å; M131-K135 PolarHBondContact O-N 3.19Å; E133-K135 PolarHBondContact O-N 2.77Å; K135-L137 PolarHBondContact O-N 3.45Å; K135-Q138 PolarHBondContact O-N 3.33Å; K135-L139 WeakPolarHBondContact O-CG 3.4Å; K135-L139 PolarHBondContact O-N 3.37Å |
| 136 | T | 89.4 | Confident | 89.6 | Confident | 91 Ų | 91 | 112.7 Ų | 112.7 | 56% | 0.558 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -60.4 | -44.7 | 175.4 | -57.5 | 0 | 0 | 0 | 0 | 111.5 | T132 E133 L139 K140 | T132-T136 WeakPolarHBondContact O-CB 3.3Å; T132-T136 PolarHBondContact O-N 2.92Å; T132-T136 PolarHBondContact O-OG1 3.15Å; E133-T136 WeakPolarHBondContact O-CB 3.35Å; E133-T136 PolarHBondContact O-N 2.94Å; T136-L139 PolarHBondContact O-N 2.79Å; T136-K140 WeakPolarHBondContact O-CB 3.39Å; T136-K140 PolarHBondContact O-N 3.48Å |
| 137 | L | 91.1 | Very high | 89.6 | Confident | 72 Ų | 72 | 114.4 Ų | 114.4 | 38% | 0.377 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -66.3 | -39.2 | 177.1 | -72.8 | 174.1 | 0 | 0 | 0 | 112.5 | E133 L134 K135 K140 R141 | E133-L137 HydrophobicContact CG-CD1 4.18Å; E133-L137 HydrophobicContact CG-CG 4.5Å; E133-L137 WeakPolarHBondContact O-CB 3.09Å; E133-L137 WeakPolarHBondContact O-CG 3.38Å; E133-L137 PolarHBondContact O-N 2.9Å; L134-L137 PolarHBondContact O-N 3.43Å; K135-L137 PolarHBondContact O-N 3.45Å; L137-K140 PolarHBondContact O-N 3.28Å; L137-R141 WeakPolarHBondContact O-CB 3.19Å; L137-R141 VanDerWaalsContact O-CG 3.31Å; L137-R141 WeakPolarHBondContact O-CG 3.41Å; L137-R141 PolarHBondContact O-N 2.79Å |
| 138 | Q | 90.6 | Very high | 89.5 | Confident | 113 Ų | 113 | 119.1 Ų | 119.1 | 53% | 0.528 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63 | -46.4 | 175.2 | -77.7 | -178.6 | -5.7 | 0 | 0 | 111.6 | L134 K135 R141 R142 | L134-Q138 WeakPolarHBondContact O-CB 3.44Å; L134-Q138 VanDerWaalsContact O-CG 3.29Å; L134-Q138 WeakPolarHBondContact O-CG 3.46Å; L134-Q138 PolarHBondContact O-N 3.2Å; K135-Q138 PolarHBondContact O-N 3.33Å; Q138-R141 PolarHBondContact O-N 3.18Å; Q138-R142 WeakPolarHBondContact O-CG 3.45Å; Q138-R142 PolarHBondContact O-N 3.45Å |
| 139 | L | 91.5 | Very high | 89.2 | Confident | 119 Ų | 119 | 119.6 Ų | 119.6 | 62% | 0.623 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -61.4 | -44.6 | 176.2 | -71.3 | 170.8 | 0 | 0 | 0 | 111.3 | K135 T136 R141 R142 A143 | K135-L139 WeakPolarHBondContact O-CG 3.4Å; K135-L139 PolarHBondContact O-N 3.37Å; T136-L139 PolarHBondContact O-N 2.79Å; L139-R141 VanDerWaalsContact C-N 3.3Å; L139-R141 PolarHBondContact O-N 2.88Å; L139-R142 PolarHBondContact O-N 3.2Å; L139-A143 PolarHBondContact O-N 3.3Å |
| 140 | K | 91.3 | Very high | 88.7 | Confident | 118 Ų | 118 | 124.8 Ų | 124.8 | 51% | 0.513 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -61.6 | -36.7 | 175.8 | -170.4 | 173.6 | -176.2 | 174.7 | 0 | 112.4 | T136 L137 R144 | T136-K140 WeakPolarHBondContact O-CB 3.39Å; T136-K140 PolarHBondContact O-N 3.48Å; L137-K140 PolarHBondContact O-N 3.28Å; K140-R144 VanDerWaalsContact O-CG 3.29Å; K140-R144 WeakPolarHBondContact O-CG 3.27Å; K140-R144 PolarHBondContact O-N 3.01Å |
| 141 | R | 91.8 | Very high | 88 | Confident | 179 Ų | 179 | 128.2 Ų | 128.2 | 68% | 0.675 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -69.5 | -40.7 | 175 | -76.1 | 178 | -174.8 | -173.5 | 2.9 | 112.2 | L137 Q138 L139 R144 R145 | L137-R141 WeakPolarHBondContact O-CB 3.19Å; L137-R141 VanDerWaalsContact O-CG 3.31Å; L137-R141 WeakPolarHBondContact O-CG 3.41Å; L137-R141 PolarHBondContact O-N 2.79Å; Q138-R141 PolarHBondContact O-N 3.18Å; L139-R141 VanDerWaalsContact C-N 3.3Å; L139-R141 PolarHBondContact O-N 2.88Å; R141-R144 PolarHBondContact O-N 3.05Å; R141-R145 PolarHBondContact O-N 3.07Å |
| 142 | R | 90.6 | Very high | 86.6 | Confident | 165 Ų | 165 | 132.7 Ų | 132.7 | 62% | 0.623 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -63.3 | -50.4 | 176.6 | -72.9 | -178.4 | -177 | -153.7 | 0.7 | 111.7 | Q138 L139 R144 R145 E146 | Q138-R142 WeakPolarHBondContact O-CG 3.45Å; Q138-R142 PolarHBondContact O-N 3.45Å; L139-R142 PolarHBondContact O-N 3.2Å; R142-R144 PolarHBondContact O-N 2.87Å; R142-R145 WeakPolarHBondContact O-CB 3.24Å; R142-R145 PolarHBondContact O-N 2.87Å; R142-E146 PolarHBondContact O-N 3.15Å |
| 143 | A | 91.4 | Very high | 86.5 | Confident | 44 Ų | 44 | 135.2 Ų | 135.2 | 36% | 0.364 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -59.1 | -32.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | L139 K147 | L139-A143 PolarHBondContact O-N 3.3Å; A143-K147 WeakPolarHBondContact O-CB 3.48Å; A143-K147 WeakPolarHBondContact O-CG 3.5Å; A143-K147 PolarHBondContact O-N 2.9Å |
| 144 | R | 90.6 | Very high | 86.4 | Confident | 161 Ų | 161 | 136 Ų | 136 | 61% | 0.608 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -71.4 | -32.8 | 174.3 | -77.8 | 176.8 | 178.2 | -158.8 | -2.6 | 113.3 | K140 R141 R142 R148 | K140-R144 VanDerWaalsContact O-CG 3.29Å; K140-R144 WeakPolarHBondContact O-CG 3.27Å; K140-R144 PolarHBondContact O-N 3.01Å; R141-R144 PolarHBondContact O-N 3.05Å; R142-R144 PolarHBondContact O-N 2.87Å; R144-R148 PolarHBondContact O-N 3.38Å |
| 145 | R | 90.3 | Very high | 86.3 | Confident | 181 Ų | 181 | 138.3 Ų | 138.3 | 68% | 0.683 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -70.8 | -48 | 175.8 | -74.2 | -177.7 | 175.6 | -133.3 | 0.1 | 110.8 | R141 R142 K147 R148 E149 | R141-R145 PolarHBondContact O-N 3.07Å; R142-R145 WeakPolarHBondContact O-CB 3.24Å; R142-R145 PolarHBondContact O-N 2.87Å; R145-K147 PolarHBondContact O-N 3.44Å; R145-R148 WeakPolarHBondContact O-CA 3.42Å; R145-R148 WeakPolarHBondContact O-CB 3.35Å; R145-R148 PolarHBondContact O-N 2.85Å; R145-E149 PolarHBondContact O-N 3.4Å |
| 146 | E | 89.6 | Confident | 86.1 | Confident | 112 Ų | 112 | 139.3 Ų | 139.3 | 52% | 0.523 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -59.1 | -35.5 | 176.5 | -68.1 | 169.8 | -165.2 | 0 | 0 | 112.5 | R142 K150 | R142-E146 PolarHBondContact O-N 3.15Å; E146-K150 WeakPolarHBondContact O-CG 3.24Å; E146-K150 PolarHBondContact O-N 3.34Å |
| 147 | K | 88.1 | Confident | 85.9 | Confident | 158 Ų | 158 | 142.3 Ų | 142.3 | 69% | 0.687 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -69.1 | -29.4 | 173.6 | -79.1 | -174.3 | 179.6 | -166.5 | 0 | 113.9 | A143 R145 | A143-K147 WeakPolarHBondContact O-CB 3.48Å; A143-K147 WeakPolarHBondContact O-CG 3.5Å; A143-K147 PolarHBondContact O-N 2.9Å; R145-K147 PolarHBondContact O-N 3.44Å |
| 148 | R | 87.1 | Confident | 85.6 | Confident | 191 Ų | 191 | 147 Ų | 147 | 72% | 0.721 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -74.7 | -45.8 | 174.8 | -76.3 | -177.9 | 174.9 | -145.7 | -3 | 110.5 | R144 R145 K150 N151 D152 | R144-R148 PolarHBondContact O-N 3.38Å; R145-R148 WeakPolarHBondContact O-CA 3.42Å; R145-R148 WeakPolarHBondContact O-CB 3.35Å; R145-R148 PolarHBondContact O-N 2.85Å; R148-K150 PolarHBondContact O-N 2.87Å; R148-N151 PolarHBondContact O-N 3.17Å; R148-D152 PolarHBondContact O-N 2.97Å |
| 149 | E | 83.6 | Confident | 85.2 | Confident | 143 Ų | 143 | 149.4 Ų | 149.4 | 67% | 0.668 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -62.1 | -23.3 | 177.6 | -69.4 | 168.9 | -173.7 | 0 | 0 | 113.8 | R145 | R145-E149 PolarHBondContact O-N 3.4Å |
| 150 | K | 77.8 | Confident | 84.7 | Confident | 180 Ų | 180 | 151.8 Ų | 151.8 | 78% | 0.783 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87 | -14.8 | 174 | -77.7 | -176.9 | 177.1 | -177.7 | 0 | 114.7 | E146 R148 | E146-K150 WeakPolarHBondContact O-CG 3.24Å; E146-K150 PolarHBondContact O-N 3.34Å; R148-K150 PolarHBondContact O-N 2.87Å |
| 151 | N | 71.2 | Confident | 84.2 | Confident | 146 Ų | 146 | 154.6 Ų | 154.6 | 78% | 0.781 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.9 | -12.1 | -177.1 | -95.9 | 11.6 | 0 | 0 | 0 | 113.1 | R148 | R148-N151 PolarHBondContact O-N 3.17Š|
| 152 | D | 58.1 | Low | 83.5 | Confident | 195 Ų | 195 | 152.4 Ų | 152.4 | 100% | 1.043 | 68% | 0.68 | S | S | * | * | trans | -93.3 | 0 | 168.4 | -68.7 | -22.9 | 0 | 0 | 0 | 109.8 | R148 | R148-D152 PolarHBondContact O-N 2.97Š|
Retrieved 152 of 152 residues in 284.4 ms
(Link to these results)