| 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 | 62.1 | Low | 79.5 | Confident | 232 Ų | 232 | 126.5 Ų | 126.5 | 100% | 1.143 | 64% | 0.644 | S | S | * | * | 0 | -9 | 0 | -71.3 | 171.4 | 159.7 | 0 | 0 | 114.4 | R3 | M1-R3 PolarHBondContact O-N 3.4Š| |||
| 2 | V | 65.6 | Low | 80.4 | Confident | 120 Ų | 120 | 120.4 Ų | 120.4 | 73% | 0.727 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.4 | -15 | -174.7 | -169.9 | 0 | 0 | 0 | 0 | 114.9 | P5 | V2-P5 WeakPolarHBondContact O-CD 3.4Å; V2-P5 WeakPolarHBondContact O-CG 3.32Å |
| 3 | R | 71.6 | Confident | 81 | Confident | 220 Ų | 220 | 120.7 Ų | 120.7 | 83% | 0.83 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -75.6 | -25.5 | -176 | -73.2 | -175.6 | 169.1 | 138.6 | -1.2 | 114.7 | M1 L7 | M1-R3 PolarHBondContact O-N 3.4Å; R3-L7 PolarHBondContact O-N 3.47Å |
| 4 | L | 77.9 | Confident | 81.5 | Confident | 143 Ų | 143 | 119.9 Ų | 119.9 | 75% | 0.749 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -66.9 | -47.6 | -176.6 | -142.4 | 103.8 | 0 | 0 | 0 | 113.9 | V6 L7 F8 | L4-V6 VanDerWaalsContact C-N 3.33Å; L4-V6 PolarHBondContact O-N 3.42Å; L4-L7 PolarHBondContact O-N 3.23Å; L4-F8 PolarHBondContact O-N 2.83Å; L4-F8 VanDerWaalsContact O-N 3.11Å |
| 5 | P | 80.5 | Confident | 82 | Confident | 72 Ų | 72 | 120.9 Ų | 120.9 | 47% | 0.468 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -65.3 | -35 | -178.7 | 23.9 | -35 | 0 | 0 | 0 | 112.9 | V2 F8 T9 | V2-P5 WeakPolarHBondContact O-CD 3.4Å; V2-P5 WeakPolarHBondContact O-CG 3.32Å; P5-F8 PolarHBondContact O-N 3.47Å; P5-T9 WeakPolarHBondContact O-CG2 3.49Å; P5-T9 PolarHBondContact O-N 3.37Å; P5-T9 PolarHBondContact O-OG1 3.47Å |
| 6 | V | 82.9 | Confident | 82.1 | Confident | 81 Ų | 81 | 121.6 Ų | 121.6 | 49% | 0.491 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -64.8 | -45.3 | 179.8 | -178.7 | 0 | 0 | 0 | 0 | 111 | L4 F8 T9 L10 | L4-V6 VanDerWaalsContact C-N 3.33Å; L4-V6 PolarHBondContact O-N 3.42Å; V6-F8 VanDerWaalsContact C-N 3.32Å; V6-F8 PolarHBondContact O-N 3.42Å; V6-T9 PolarHBondContact O-N 3.29Å; V6-T9 PolarHBondContact O-OG1 3.06Å; V6-L10 HydrophobicContact CG1-CD1 4.3Å; V6-L10 WeakPolarHBondContact O-CG 3.33Å; V6-L10 PolarHBondContact O-N 3.07Å; V6-L10 VanDerWaalsContact O-N 3.07Å |
| 7 | L | 84.3 | Confident | 82.2 | Confident | 108 Ų | 108 | 116.7 Ų | 116.7 | 57% | 0.565 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -62.8 | -40.7 | 176 | -70.4 | 174.4 | 0 | 0 | 0 | 111.5 | R3 L4 L10 I11 | R3-L7 PolarHBondContact O-N 3.47Å; L4-L7 PolarHBondContact O-N 3.23Å; L7-L10 PolarHBondContact O-N 3.39Å; L7-I11 VanDerWaalsContact O-CG1 3.29Å; L7-I11 WeakPolarHBondContact O-CG1 3.48Å; L7-I11 PolarHBondContact O-N 3.01Å |
| 8 | F | 85.9 | Confident | 82.3 | Confident | 138 Ų | 138 | 115.2 Ų | 115.2 | 61% | 0.605 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -61.1 | -47 | 176.7 | -175.7 | -101.2 | 0 | 0 | 0 | 111.9 | L4 P5 V6 L10 I11 C12 | L4-F8 PolarHBondContact O-N 2.83Å; L4-F8 VanDerWaalsContact O-N 3.11Å; P5-F8 PolarHBondContact O-N 3.47Å; V6-F8 VanDerWaalsContact C-N 3.32Å; V6-F8 PolarHBondContact O-N 3.42Å; F8-L10 VanDerWaalsContact C-N 3.32Å; F8-L10 PolarHBondContact O-N 3.26Å; F8-I11 PolarHBondContact O-N 3.11Å; F8-C12 PolarHBondContact O-N 2.96Å; F8-C12 PolarHBondContact O-SG 3.42Å; F8-C12 VanDerWaalsContact O-SG 3.39Å |
| 9 | T | 84.9 | Confident | 82.3 | Confident | 76 Ų | 76 | 112.9 Ų | 112.9 | 47% | 0.466 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -63.7 | -36.4 | 178.4 | 51.4 | 0 | 0 | 0 | 0 | 113 | P5 V6 C12 L13 | P5-T9 WeakPolarHBondContact O-CG2 3.49Å; P5-T9 PolarHBondContact O-N 3.37Å; P5-T9 PolarHBondContact O-OG1 3.47Å; V6-T9 PolarHBondContact O-N 3.29Å; V6-T9 PolarHBondContact O-OG1 3.06Å; T9-C12 PolarHBondContact O-N 3.03Å; T9-L13 WeakPolarHBondContact O-CG 3.38Å; T9-L13 PolarHBondContact O-N 3.29Å |
| 10 | L | 87.8 | Confident | 82.1 | Confident | 90 Ų | 90 | 114.8 Ų | 114.8 | 47% | 0.471 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -65.5 | -43 | 175.9 | -77.9 | 168 | 0 | 0 | 0 | 111.7 | V6 L7 F8 C12 L13 I14 | V6-L10 HydrophobicContact CG1-CD1 4.3Å; V6-L10 WeakPolarHBondContact O-CG 3.33Å; V6-L10 PolarHBondContact O-N 3.07Å; V6-L10 VanDerWaalsContact O-N 3.07Å; L7-L10 PolarHBondContact O-N 3.39Å; F8-L10 VanDerWaalsContact C-N 3.32Å; F8-L10 PolarHBondContact O-N 3.26Å; L10-C12 VanDerWaalsContact C-N 3.33Å; L10-C12 PolarHBondContact O-N 3.04Å; L10-L13 PolarHBondContact O-N 3.39Å; L10-I14 WeakPolarHBondContact O-CG1 3.43Å; L10-I14 PolarHBondContact O-N 3.35Å |
| 11 | I | 90.6 | Very high | 81.7 | Confident | 111 Ų | 111 | 113.1 Ų | 113.1 | 57% | 0.569 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -62.7 | -41.4 | 176.6 | -66.7 | 165.1 | 0 | 0 | 0 | 110.6 | L7 F8 L13 I14 F15 | L7-I11 VanDerWaalsContact O-CG1 3.29Å; L7-I11 WeakPolarHBondContact O-CG1 3.48Å; L7-I11 PolarHBondContact O-N 3.01Å; F8-I11 PolarHBondContact O-N 3.11Å; I11-L13 PolarHBondContact O-N 3.35Å; I11-I14 PolarHBondContact O-N 2.94Å; I11-F15 WeakPolarHBondContact O-CB 3.29Å; I11-F15 PolarHBondContact O-N 3.39Å |
| 12 | C | 90.5 | Very high | 82.3 | Confident | 54 Ų | 54 | 110.7 Ų | 110.7 | 37% | 0.365 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -61.8 | -41.6 | 175.9 | -69.8 | 0 | 0 | 0 | 0 | 112.7 | F8 T9 L10 F15 M16 | F8-C12 PolarHBondContact O-N 2.96Å; F8-C12 PolarHBondContact O-SG 3.42Å; F8-C12 VanDerWaalsContact O-SG 3.39Å; T9-C12 PolarHBondContact O-N 3.03Å; L10-C12 VanDerWaalsContact C-N 3.33Å; L10-C12 PolarHBondContact O-N 3.04Å; C12-F15 PolarHBondContact O-N 2.97Å; C12-M16 WeakPolarHBondContact O-CG 3.3Å; C12-M16 PolarHBondContact O-N 2.95Å |
| 13 | L | 88.5 | Confident | 82.6 | Confident | 124 Ų | 124 | 109.5 Ų | 109.5 | 65% | 0.649 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -64.5 | -42.9 | 176.9 | -73.7 | 170.1 | 0 | 0 | 0 | 112 | T9 L10 I11 F15 M16 G17 | T9-L13 WeakPolarHBondContact O-CG 3.38Å; T9-L13 PolarHBondContact O-N 3.29Å; L10-L13 PolarHBondContact O-N 3.39Å; I11-L13 PolarHBondContact O-N 3.35Å; L13-F15 VanDerWaalsContact C-N 3.31Å; L13-F15 PolarHBondContact O-N 3.46Å; L13-M16 PolarHBondContact O-N 3.44Å; L13-G17 PolarHBondContact O-N 2.94Å |
| 14 | I | 88.6 | Confident | 82.4 | Confident | 110 Ų | 110 | 104.4 Ų | 104.4 | 56% | 0.564 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -60.5 | -44.5 | 175.3 | -67 | 165.8 | 0 | 0 | 0 | 110.1 | L10 I11 G17 I18 | L10-I14 WeakPolarHBondContact O-CG1 3.43Å; L10-I14 PolarHBondContact O-N 3.35Å; I11-I14 PolarHBondContact O-N 2.94Å; I14-G17 PolarHBondContact O-N 3.5Å; I14-I18 HydrophobicContact CG2-CD1 3.86Å; I14-I18 VanDerWaalsContact O-CG1 3.3Å; I14-I18 WeakPolarHBondContact O-CG1 3.47Å; I14-I18 PolarHBondContact O-N 3.35Å |
| 15 | F | 88.1 | Confident | 81.7 | Confident | 134 Ų | 134 | 102.4 Ų | 102.4 | 59% | 0.588 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -64.6 | -45.9 | 180 | -167.6 | -96.1 | 0 | 0 | 0 | 112.4 | I11 C12 L13 G17 I18 V19 | I11-F15 WeakPolarHBondContact O-CB 3.29Å; I11-F15 PolarHBondContact O-N 3.39Å; C12-F15 PolarHBondContact O-N 2.97Å; L13-F15 VanDerWaalsContact C-N 3.31Å; L13-F15 PolarHBondContact O-N 3.46Å; F15-G17 VanDerWaalsContact C-N 3.31Å; F15-G17 PolarHBondContact O-N 3.36Å; F15-I18 PolarHBondContact O-N 3.48Å; F15-V19 HydrophobicContact CD1-CG2 4.11Å; F15-V19 HydrophobicContact CE1-CG2 3.8Å; F15-V19 HydrophobicContact CZ-CG2 4.27Å; F15-V19 WeakPolarHBondContact O-CG2 3.42Å; F15-V19 PolarHBondContact O-N 3.33Å |
| 16 | M | 84.3 | Confident | 80.8 | Confident | 133 Ų | 133 | 103.2 Ų | 103.2 | 66% | 0.655 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -61.1 | -40.1 | 175.9 | -72.1 | -62.8 | -160.8 | 0 | 0 | 111.9 | C12 L13 V19 Q20 | C12-M16 WeakPolarHBondContact O-CG 3.3Å; C12-M16 PolarHBondContact O-N 2.95Å; L13-M16 PolarHBondContact O-N 3.44Å; M16-V19 PolarHBondContact O-N 3.02Å; M16-Q20 WeakPolarHBondContact O-CB 3.48Å; M16-Q20 PolarHBondContact O-N 3.23Å |
| 17 | G | 83.3 | Confident | 79.7 | Confident | 38 Ų | 38 | 103 Ų | 103 | 39% | 0.392 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.3 | -41.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L13 I14 F15 Q20 S21 | L13-G17 PolarHBondContact O-N 2.94Å; I14-G17 PolarHBondContact O-N 3.5Å; F15-G17 VanDerWaalsContact C-N 3.31Å; F15-G17 PolarHBondContact O-N 3.36Å; G17-Q20 PolarHBondContact O-N 3.35Å; G17-S21 VanDerWaalsContact O-CB 3.3Å; G17-S21 WeakPolarHBondContact O-CB 3.35Å; G17-S21 PolarHBondContact O-N 3.46Å |
| 18 | I | 84.1 | Confident | 78.6 | Confident | 90 Ų | 90 | 101.7 Ų | 101.7 | 46% | 0.462 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.3 | -42.6 | 176.3 | -67.2 | 164 | 0 | 0 | 0 | 111.2 | I14 F15 S21 R22 | I14-I18 HydrophobicContact CG2-CD1 3.86Å; I14-I18 VanDerWaalsContact O-CG1 3.3Å; I14-I18 WeakPolarHBondContact O-CG1 3.47Å; I14-I18 PolarHBondContact O-N 3.35Å; F15-I18 PolarHBondContact O-N 3.48Å; I18-S21 PolarHBondContact O-N 2.92Å; I18-R22 WeakPolarHBondContact O-CB 3.43Å; I18-R22 PolarHBondContact O-N 3.4Å |
| 19 | V | 81.3 | Confident | 77.3 | Confident | 72 Ų | 72 | 99.4 Ų | 99.4 | 44% | 0.436 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.8 | -44.5 | 178.2 | 173 | 0 | 0 | 0 | 0 | 111 | F15 M16 R22 N23 | F15-V19 HydrophobicContact CD1-CG2 4.11Å; F15-V19 HydrophobicContact CE1-CG2 3.8Å; F15-V19 HydrophobicContact CZ-CG2 4.27Å; F15-V19 WeakPolarHBondContact O-CG2 3.42Å; F15-V19 PolarHBondContact O-N 3.33Å; M16-V19 PolarHBondContact O-N 3.02Å; V19-R22 PolarHBondContact O-N 2.91Å; V19-N23 WeakPolarHBondContact O-CB 3.48Å; V19-N23 PolarHBondContact O-N 3.02Å |
| 20 | Q | 78.3 | Confident | 76 | Confident | 149 Ų | 149 | 101.1 Ų | 101.1 | 70% | 0.696 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65.8 | -40 | 178.1 | -170.1 | 173.7 | 8.4 | 0 | 0 | 111.9 | M16 G17 N23 H24 | M16-Q20 WeakPolarHBondContact O-CB 3.48Å; M16-Q20 PolarHBondContact O-N 3.23Å; G17-Q20 PolarHBondContact O-N 3.35Å; Q20-N23 PolarHBondContact O-N 2.95Å; Q20-H24 WeakPolarHBondContact O-CB 3.49Å; Q20-H24 PolarHBondContact O-N 3.03Å |
| 21 | S | 74.1 | Confident | 74.8 | Confident | 81 Ų | 81 | 101.7 Ų | 101.7 | 57% | 0.566 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64.6 | -40 | 176 | -178.6 | 0 | 0 | 0 | 0 | 112 | G17 I18 N25 | G17-S21 VanDerWaalsContact O-CB 3.3Å; G17-S21 WeakPolarHBondContact O-CB 3.35Å; G17-S21 PolarHBondContact O-N 3.46Å; I18-S21 PolarHBondContact O-N 2.92Å; S21-N25 WeakPolarHBondContact O-CB 3.3Å; S21-N25 PolarHBondContact O-N 2.97Å |
| 22 | R | 75.8 | Confident | 73.6 | Confident | 180 Ų | 180 | 102.8 Ų | 102.8 | 68% | 0.679 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65.1 | -46.4 | 173.8 | -82.7 | -173.3 | 162.6 | -166.7 | -5.9 | 112.1 | I18 V19 H24 N25 D26 | I18-R22 WeakPolarHBondContact O-CB 3.43Å; I18-R22 PolarHBondContact O-N 3.4Å; V19-R22 PolarHBondContact O-N 2.91Å; R22-H24 VanDerWaalsContact C-N 3.29Å; R22-H24 PolarHBondContact O-N 3.05Å; R22-N25 PolarHBondContact O-N 2.96Å; R22-N25 VanDerWaalsContact O-N 3.16Å; R22-D26 PolarHBondContact O-N 2.95Å |
| 23 | N | 72 | Confident | 72.3 | Confident | 95 Ų | 95 | 105.1 Ų | 105.1 | 51% | 0.508 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -59.2 | -43.2 | 178.4 | -165.5 | 89.2 | 0 | 0 | 0 | 111.4 | V19 Q20 D26 D27 | V19-N23 WeakPolarHBondContact O-CB 3.48Å; V19-N23 PolarHBondContact O-N 3.02Å; Q20-N23 PolarHBondContact O-N 2.95Å; N23-D26 PolarHBondContact O-N 3.45Å; N23-D27 PolarHBondContact ND2-OD2 3.35Å; N23-D27 PolarHBondContact O-N 3.16Å |
| 24 | H | 66 | Low | 71.1 | Confident | 114 Ų | 114 | 104 Ų | 104 | 53% | 0.528 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.5 | -39.8 | 177.8 | -164.8 | 38.3 | 0 | 0 | 0 | 112.3 | Q20 R22 D26 D27 D28 | Q20-H24 WeakPolarHBondContact O-CB 3.49Å; Q20-H24 PolarHBondContact O-N 3.03Å; R22-H24 VanDerWaalsContact C-N 3.29Å; R22-H24 PolarHBondContact O-N 3.05Å; H24-D26 VanDerWaalsContact C-N 3.3Å; H24-D26 PolarHBondContact O-N 3.26Å; H24-D27 PolarHBondContact O-N 3.36Å; H24-D28 IonicContact CE1-OD1 3.89Å; H24-D28 PolarHBondContact O-N 3.43Å |
| 25 | N | 63.8 | Low | 70 | Confident | 101 Ų | 101 | 102.1 Ų | 102.1 | 54% | 0.54 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66 | -32.8 | 175.5 | -172.1 | 77.9 | 0 | 0 | 0 | 112.5 | S21 R22 L29 | S21-N25 WeakPolarHBondContact O-CB 3.3Å; S21-N25 PolarHBondContact O-N 2.97Å; R22-N25 PolarHBondContact O-N 2.96Å; R22-N25 VanDerWaalsContact O-N 3.16Å; N25-L29 WeakPolarHBondContact O-CB 3.34Å; N25-L29 PolarHBondContact O-N 3.25Å; N25-L29 VanDerWaalsContact O-N 3.08Å |
| 26 | D | 61.7 | Low | 68.9 | Low | 88 Ų | 88 | 98.7 Ų | 98.7 | 47% | 0.471 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -71.4 | -37.4 | 173.9 | -64.2 | -24.7 | 0 | 0 | 0 | 111.2 | R22 N23 H24 L30 | R22-D26 PolarHBondContact O-N 2.95Å; N23-D26 PolarHBondContact O-N 3.45Å; H24-D26 VanDerWaalsContact C-N 3.3Å; H24-D26 PolarHBondContact O-N 3.26Å; D26-L30 VanDerWaalsContact O-CG 3.28Å; D26-L30 WeakPolarHBondContact O-CG 3.42Å; D26-L30 PolarHBondContact O-N 2.88Å; D26-L30 VanDerWaalsContact O-N 3.08Å |
| 27 | D | 59.4 | Low | 67.9 | Low | 76 Ų | 76 | 97.4 Ų | 97.4 | 41% | 0.406 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.5 | -42.6 | 174.5 | -65.7 | -38.1 | 0 | 0 | 0 | 111.6 | N23 H24 L30 V31 | N23-D27 PolarHBondContact ND2-OD2 3.35Å; N23-D27 PolarHBondContact O-N 3.16Å; H24-D27 PolarHBondContact O-N 3.36Å; D27-L30 PolarHBondContact O-N 3.08Å; D27-V31 WeakPolarHBondContact O-CG2 3.28Å; D27-V31 PolarHBondContact O-N 3.45Å |
| 28 | D | 61.1 | Low | 66.8 | Low | 82 Ų | 82 | 102.9 Ų | 102.9 | 44% | 0.439 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.6 | -42.5 | 177.5 | -72 | -21 | 0 | 0 | 0 | 111.7 | H24 L30 V31 E32 | H24-D28 IonicContact CE1-OD1 3.89Å; H24-D28 PolarHBondContact O-N 3.43Å; D28-L30 VanDerWaalsContact C-N 3.31Å; D28-L30 PolarHBondContact O-N 3.2Å; D28-V31 PolarHBondContact O-N 3.08Å; D28-E32 PolarHBondContact O-N 3.07Å |
| 29 | L | 60.1 | Low | 65.7 | Low | 89 Ų | 89 | 105.6 Ų | 105.6 | 47% | 0.466 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.7 | -38 | 177.5 | -171.9 | 72.2 | 0 | 0 | 0 | 111.8 | N25 V31 E32 D33 | N25-L29 WeakPolarHBondContact O-CB 3.34Å; N25-L29 PolarHBondContact O-N 3.25Å; N25-L29 VanDerWaalsContact O-N 3.08Å; L29-V31 VanDerWaalsContact C-N 3.32Å; L29-V31 PolarHBondContact O-N 2.67Å; L29-E32 PolarHBondContact O-N 3.37Å; L29-D33 PolarHBondContact O-N 3.22Å |
| 30 | L | 57.5 | Low | 64.9 | Low | 113 Ų | 113 | 105 Ų | 105 | 59% | 0.592 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -64.5 | -34.6 | 176.8 | -77.2 | 168.3 | 0 | 0 | 0 | 112.5 | D26 D27 D28 L34 | D26-L30 VanDerWaalsContact O-CG 3.28Å; D26-L30 WeakPolarHBondContact O-CG 3.42Å; D26-L30 PolarHBondContact O-N 2.88Å; D26-L30 VanDerWaalsContact O-N 3.08Å; D27-L30 PolarHBondContact O-N 3.08Å; D28-L30 VanDerWaalsContact C-N 3.31Å; D28-L30 PolarHBondContact O-N 3.2Å; L30-L34 WeakPolarHBondContact O-CB 3.49Å; L30-L34 PolarHBondContact O-N 3.09Å; L30-L34 VanDerWaalsContact O-N 3.09Å |
| 31 | V | 61.7 | Low | 64.2 | Low | 102 Ų | 102 | 102.7 Ų | 102.7 | 62% | 0.618 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -70.3 | -41.1 | 177.8 | 176 | 0 | 0 | 0 | 0 | 111.1 | D27 D28 L29 L34 S35 | D27-V31 WeakPolarHBondContact O-CG2 3.28Å; D27-V31 PolarHBondContact O-N 3.45Å; D28-V31 PolarHBondContact O-N 3.08Å; L29-V31 VanDerWaalsContact C-N 3.32Å; L29-V31 PolarHBondContact O-N 2.67Å; V31-L34 PolarHBondContact O-N 3.06Å; V31-S35 PolarHBondContact O-N 3.4Å |
| 32 | E | 65.1 | Low | 63.7 | Low | 133 Ų | 133 | 101.8 Ų | 101.8 | 62% | 0.621 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -62.4 | -47.6 | 176.1 | -71.8 | -171.9 | 170.2 | 0 | 0 | 111.6 | D28 L29 L34 S35 A36 | D28-E32 PolarHBondContact O-N 3.07Å; L29-E32 PolarHBondContact O-N 3.37Å; E32-L34 VanDerWaalsContact C-N 3.31Å; E32-L34 PolarHBondContact O-N 3.05Å; E32-S35 PolarHBondContact O-N 3.17Å; E32-S35 PolarHBondContact O-OG 3.33Å; E32-A36 PolarHBondContact O-N 3.38Å |
| 33 | D | 62.5 | Low | 63.3 | Low | 104 Ų | 104 | 97.3 Ų | 97.3 | 56% | 0.556 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.9 | -38.4 | 177.8 | -89.4 | -10.2 | 0 | 0 | 0 | 112.2 | L29 A36 L37 | L29-D33 PolarHBondContact O-N 3.22Å; D33-A36 PolarHBondContact O-N 3.19Å; D33-L37 PolarHBondContact O-N 3.5Å; D33-L37 VanDerWaalsContact O-N 3.07Å |
| 34 | L | 63.8 | Low | 63.2 | Low | 101 Ų | 101 | 99.1 Ų | 99.1 | 53% | 0.529 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.7 | -42.5 | 176.6 | -144.2 | 81 | 0 | 0 | 0 | 111.1 | L30 V31 E32 A36 L37 Y38 | L30-L34 WeakPolarHBondContact O-CB 3.49Å; L30-L34 PolarHBondContact O-N 3.09Å; L30-L34 VanDerWaalsContact O-N 3.09Å; V31-L34 PolarHBondContact O-N 3.06Å; E32-L34 VanDerWaalsContact C-N 3.31Å; E32-L34 PolarHBondContact O-N 3.05Å; L34-A36 PolarHBondContact O-N 3.07Å; L34-L37 PolarHBondContact O-N 3.45Å; L34-Y38 HydrophobicContact CD2-CD2 4.4Å; L34-Y38 HydrophobicContact CD2-CE2 4.03Å; L34-Y38 HydrophobicContact CG-CD2 4.09Å; L34-Y38 HydrophobicContact CG-CE2 4.02Å; L34-Y38 WeakPolarHBondContact O-CD2 3.35Å; L34-Y38 PolarHBondContact O-N 3.41Å |
| 35 | S | 65.1 | Low | 63.4 | Low | 70 Ų | 70 | 102.6 Ų | 102.6 | 49% | 0.49 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.4 | -43.1 | 178.6 | 76.2 | 0 | 0 | 0 | 0 | 111.8 | V31 E32 L37 Y38 E39 | V31-S35 PolarHBondContact O-N 3.4Å; E32-S35 PolarHBondContact O-N 3.17Å; E32-S35 PolarHBondContact O-OG 3.33Å; S35-L37 VanDerWaalsContact C-N 3.26Å; S35-L37 PolarHBondContact O-N 3.2Å; S35-Y38 PolarHBondContact O-N 3.16Å; S35-E39 PolarHBondContact O-N 2.99Å; S35-E39 VanDerWaalsContact O-N 3.16Å |
| 36 | A | 65.8 | Low | 63.9 | Low | 62 Ų | 62 | 103.3 Ų | 103.3 | 51% | 0.512 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64 | -30.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | E32 D33 L34 P40 | E32-A36 PolarHBondContact O-N 3.38Å; D33-A36 PolarHBondContact O-N 3.19Å; L34-A36 PolarHBondContact O-N 3.07Å; A36-P40 WeakPolarHBondContact O-CD 3.46Å; A36-P40 WeakPolarHBondContact O-CG 3.34Å |
| 37 | L | 64.3 | Low | 64.5 | Low | 105 Ų | 105 | 103.4 Ų | 103.4 | 55% | 0.55 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -78.8 | -32.2 | 175.7 | -162.2 | 72.9 | 0 | 0 | 0 | 112.9 | D33 L34 S35 P40 | D33-L37 PolarHBondContact O-N 3.5Å; D33-L37 VanDerWaalsContact O-N 3.07Å; L34-L37 PolarHBondContact O-N 3.45Å; S35-L37 VanDerWaalsContact C-N 3.26Å; S35-L37 PolarHBondContact O-N 3.2Å; L37-P40 WeakPolarHBondContact O-CD 3.31Å; L37-P40 VanDerWaalsContact O-CG 3.31Å; L37-P40 WeakPolarHBondContact O-CG 2.95Å |
| 38 | Y | 59.3 | Low | 65 | Low | 154 Ų | 154 | 107.7 Ų | 107.7 | 60% | 0.604 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -76.3 | -37.3 | -178.8 | -96 | -82.2 | 0 | 0 | 0 | 113.6 | L34 S35 M41 A42 | L34-Y38 HydrophobicContact CD2-CD2 4.4Å; L34-Y38 HydrophobicContact CD2-CE2 4.03Å; L34-Y38 HydrophobicContact CG-CD2 4.09Å; L34-Y38 HydrophobicContact CG-CE2 4.02Å; L34-Y38 WeakPolarHBondContact O-CD2 3.35Å; L34-Y38 PolarHBondContact O-N 3.41Å; S35-Y38 PolarHBondContact O-N 3.16Å; Y38-M41 PolarHBondContact O-N 3.04Å; Y38-M41 VanDerWaalsContact O-N 3.16Å; Y38-A42 PolarHBondContact O-N 3.23Å |
| 39 | E | 60.2 | Low | 65.6 | Low | 146 Ų | 146 | 108.5 Ų | 108.5 | 68% | 0.682 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -52.5 | -51.5 | 176.6 | -75.2 | -162.7 | 159.7 | 0 | 0 | 114 | S35 M41 A42 V43 | S35-E39 PolarHBondContact O-N 2.99Å; S35-E39 VanDerWaalsContact O-N 3.16Å; E39-M41 VanDerWaalsContact C-N 3.28Å; E39-M41 PolarHBondContact O-N 3.34Å; E39-A42 PolarHBondContact O-N 3.16Å; E39-V43 WeakPolarHBondContact O-CG2 3.42Å; E39-V43 PolarHBondContact O-N 2.93Å; E39-V43 VanDerWaalsContact O-N 3.07Å |
| 40 | P | 64.7 | Low | 66.3 | Low | 60 Ų | 60 | 111.5 Ų | 111.5 | 39% | 0.39 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -67.9 | -26.8 | -179.9 | 25.9 | -34.5 | 0 | 0 | 0 | 112.6 | A36 L37 K44 | A36-P40 WeakPolarHBondContact O-CD 3.46Å; A36-P40 WeakPolarHBondContact O-CG 3.34Å; L37-P40 WeakPolarHBondContact O-CD 3.31Å; L37-P40 VanDerWaalsContact O-CG 3.31Å; L37-P40 WeakPolarHBondContact O-CG 2.95Å; P40-K44 WeakPolarHBondContact O-CB 3.44Å; P40-K44 VanDerWaalsContact O-CG 3.27Å; P40-K44 WeakPolarHBondContact O-CG 3.48Å; P40-K44 PolarHBondContact O-N 3.4Å |
| 41 | M | 63.5 | Low | 67.2 | Low | 100 Ų | 100 | 109.8 Ų | 109.8 | 49% | 0.493 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -69.6 | -40.8 | 174.1 | -70.2 | -159.7 | -168.6 | 0 | 0 | 111.9 | Y38 E39 K44 R45 | Y38-M41 PolarHBondContact O-N 3.04Å; Y38-M41 VanDerWaalsContact O-N 3.16Å; E39-M41 VanDerWaalsContact C-N 3.28Å; E39-M41 PolarHBondContact O-N 3.34Å; M41-K44 PolarHBondContact O-N 3.05Å; M41-R45 WeakPolarHBondContact O-CG 3.33Å; M41-R45 PolarHBondContact O-N 3.24Å |
| 42 | A | 64.7 | Low | 67.8 | Low | 63 Ų | 63 | 108.4 Ų | 108.4 | 52% | 0.521 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.7 | -44.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y38 E39 R45 N46 | Y38-A42 PolarHBondContact O-N 3.23Å; E39-A42 PolarHBondContact O-N 3.16Å; A42-R45 PolarHBondContact O-N 3.31Å; A42-N46 PolarHBondContact O-N 3.07Å |
| 43 | V | 66.8 | Low | 68.1 | Low | 86 Ų | 86 | 107.9 Ų | 107.9 | 52% | 0.521 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.4 | -45.4 | 175.5 | 176.4 | 0 | 0 | 0 | 0 | 111.2 | E39 R45 N46 I47 | E39-V43 WeakPolarHBondContact O-CG2 3.42Å; E39-V43 PolarHBondContact O-N 2.93Å; E39-V43 VanDerWaalsContact O-N 3.07Å; V43-R45 PolarHBondContact O-N 3.45Å; V43-N46 PolarHBondContact O-N 3.26Å; V43-I47 HydrophobicContact CG1-CD1 3.92Å; V43-I47 WeakPolarHBondContact O-CG1 3.4Å; V43-I47 PolarHBondContact O-N 2.94Å |
| 44 | K | 70 | Confident | 68.7 | Low | 132 Ų | 132 | 110.2 Ų | 110.2 | 57% | 0.574 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -58.2 | -46.9 | 175.6 | -79.5 | 175.9 | -177.7 | 177.7 | 0 | 111.5 | P40 M41 N46 I47 Y48 | P40-K44 WeakPolarHBondContact O-CB 3.44Å; P40-K44 VanDerWaalsContact O-CG 3.27Å; P40-K44 WeakPolarHBondContact O-CG 3.48Å; P40-K44 PolarHBondContact O-N 3.4Å; M41-K44 PolarHBondContact O-N 3.05Å; K44-N46 VanDerWaalsContact C-N 3.33Å; K44-N46 PolarHBondContact O-N 3.01Å; K44-I47 PolarHBondContact O-N 2.93Å; K44-Y48 WeakPolarHBondContact O-CD2 3.27Å; K44-Y48 PolarHBondContact O-N 3.41Å |
| 45 | R | 69.8 | Low | 69.3 | Low | 188 Ų | 188 | 111.7 Ų | 111.7 | 71% | 0.709 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -58.2 | -42.9 | 176.9 | -78.3 | -176.4 | 178.5 | -171.9 | 1.3 | 112 | M41 A42 V43 Y48 N49 | M41-R45 WeakPolarHBondContact O-CG 3.33Å; M41-R45 PolarHBondContact O-N 3.24Å; A42-R45 PolarHBondContact O-N 3.31Å; V43-R45 PolarHBondContact O-N 3.45Å; R45-Y48 PolarHBondContact O-N 2.93Å; R45-N49 WeakPolarHBondContact O-CB 3.36Å; R45-N49 PolarHBondContact O-N 3.37Å |
| 46 | N | 75 | Confident | 69.7 | Low | 115 Ų | 115 | 111.7 Ų | 111.7 | 62% | 0.615 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63.9 | -43.7 | 177.6 | -168.6 | 0 | 0 | 0 | 0 | 112.1 | A42 V43 K44 N49 R50 | A42-N46 PolarHBondContact O-N 3.07Å; V43-N46 PolarHBondContact O-N 3.26Å; K44-N46 VanDerWaalsContact C-N 3.33Å; K44-N46 PolarHBondContact O-N 3.01Å; N46-N49 PolarHBondContact O-N 3.4Å; N46-R50 WeakPolarHBondContact O-CB 3.37Å; N46-R50 PolarHBondContact O-N 2.89Å |
| 47 | I | 73.9 | Confident | 69.9 | Low | 91 Ų | 91 | 113 Ų | 113 | 47% | 0.467 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62 | -45.9 | 176.3 | -65.8 | 168.2 | 0 | 0 | 0 | 110.9 | V43 K44 R50 I51 | V43-I47 HydrophobicContact CG1-CD1 3.92Å; V43-I47 WeakPolarHBondContact O-CG1 3.4Å; V43-I47 PolarHBondContact O-N 2.94Å; K44-I47 PolarHBondContact O-N 2.93Å; I47-R50 PolarHBondContact O-N 3.27Å; I47-I51 HydrophobicContact CG2-CD1 3.69Å; I47-I51 HydrophobicContact CG2-CG1 4.37Å; I47-I51 VanDerWaalsContact O-CG1 3.28Å; I47-I51 WeakPolarHBondContact O-CG1 3.4Å; I47-I51 PolarHBondContact O-N 3.45Å |
| 48 | Y | 71.2 | Confident | 70.4 | Confident | 165 Ų | 165 | 114.4 Ų | 114.4 | 65% | 0.647 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -61.2 | -46.1 | 177.2 | -84.1 | -68.3 | 0 | 0 | 0 | 112 | K44 R45 R50 I51 S52 | K44-Y48 WeakPolarHBondContact O-CD2 3.27Å; K44-Y48 PolarHBondContact O-N 3.41Å; R45-Y48 PolarHBondContact O-N 2.93Å; Y48-R50 VanDerWaalsContact C-N 3.34Å; Y48-R50 PolarHBondContact O-N 3.15Å; Y48-I51 PolarHBondContact O-N 2.88Å; Y48-S52 WeakPolarHBondContact O-CB 3.34Å; Y48-S52 PolarHBondContact O-N 3.25Å |
| 49 | N | 73.7 | Confident | 71 | Confident | 99 Ų | 99 | 113.5 Ų | 113.5 | 53% | 0.529 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -59.3 | -46.6 | 176.1 | -75.5 | -1.9 | 0 | 0 | 0 | 110.9 | R45 N46 I51 S52 H53 | R45-N49 WeakPolarHBondContact O-CB 3.36Å; R45-N49 PolarHBondContact O-N 3.37Å; N46-N49 PolarHBondContact O-N 3.4Å; N49-I51 PolarHBondContact O-N 3.39Å; N49-S52 PolarHBondContact O-N 2.84Å; N49-H53 WeakPolarHBondContact O-CB 3.49Å; N49-H53 PolarHBondContact O-CD2 2.99Å; N49-H53 PolarHBondContact O-N 3.1Å |
| 50 | R | 74.3 | Confident | 71.2 | Confident | 152 Ų | 152 | 107.5 Ų | 107.5 | 57% | 0.574 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.4 | -41 | 178.1 | -168.7 | 178.7 | -172.6 | -169.8 | 3.4 | 112.6 | N46 I47 Y48 R54 | N46-R50 WeakPolarHBondContact O-CB 3.37Å; N46-R50 PolarHBondContact O-N 2.89Å; I47-R50 PolarHBondContact O-N 3.27Å; Y48-R50 VanDerWaalsContact C-N 3.34Å; Y48-R50 PolarHBondContact O-N 3.15Å; R50-R54 WeakPolarHBondContact O-CG 3.16Å; R50-R54 PolarHBondContact O-N 2.93Å; R50-R54 VanDerWaalsContact O-N 3.1Å |
| 51 | I | 75.4 | Confident | 71.4 | Confident | 77 Ų | 77 | 111.8 Ų | 111.8 | 40% | 0.395 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -68.2 | -42.7 | 176.6 | -68.1 | 168.9 | 0 | 0 | 0 | 110.7 | I47 Y48 N49 R54 K55 | I47-I51 HydrophobicContact CG2-CD1 3.69Å; I47-I51 HydrophobicContact CG2-CG1 4.37Å; I47-I51 VanDerWaalsContact O-CG1 3.28Å; I47-I51 WeakPolarHBondContact O-CG1 3.4Å; I47-I51 PolarHBondContact O-N 3.45Å; Y48-I51 PolarHBondContact O-N 2.88Å; N49-I51 PolarHBondContact O-N 3.39Å; I51-R54 PolarHBondContact O-N 3.19Å; I51-K55 HydrophobicContact CG2-CD 4.38Å; I51-K55 WeakPolarHBondContact O-CG 3.41Å; I51-K55 PolarHBondContact O-N 2.84Å |
| 52 | S | 74 | Confident | 71.9 | Confident | 74 Ų | 74 | 114.9 Ų | 114.9 | 52% | 0.517 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -60 | -49.4 | 177.4 | -170.8 | 0 | 0 | 0 | 0 | 111.1 | Y48 N49 R54 K55 F56 | Y48-S52 WeakPolarHBondContact O-CB 3.34Å; Y48-S52 PolarHBondContact O-N 3.25Å; N49-S52 PolarHBondContact O-N 2.84Å; S52-R54 VanDerWaalsContact C-N 3.35Å; S52-R54 PolarHBondContact O-N 2.84Å; S52-K55 PolarHBondContact O-N 3.33Å; S52-K55 VanDerWaalsContact O-N 3.12Å; S52-F56 WeakPolarHBondContact O-CB 3.3Å; S52-F56 PolarHBondContact O-N 3.48Å |
| 53 | H | 71.9 | Confident | 72 | Confident | 121 Ų | 121 | 118.7 Ų | 118.7 | 56% | 0.56 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -59 | -42.1 | 175.7 | -82.5 | -71.6 | 0 | 0 | 0 | 112.7 | N49 K55 F56 N57 | N49-H53 WeakPolarHBondContact O-CB 3.49Å; N49-H53 PolarHBondContact O-CD2 2.99Å; N49-H53 PolarHBondContact O-N 3.1Å; H53-K55 PolarHBondContact O-N 3.32Å; H53-F56 PolarHBondContact O-N 2.91Å; H53-N57 WeakPolarHBondContact O-CB 3.28Å; H53-N57 PolarHBondContact O-N 3.32Å |
| 54 | R | 74.9 | Confident | 72.1 | Confident | 154 Ų | 154 | 115.3 Ų | 115.3 | 58% | 0.581 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.1 | -41.2 | 175.4 | -76.4 | 176.1 | 176 | -172.1 | -2.4 | 112.3 | R50 I51 S52 K58 | R50-R54 WeakPolarHBondContact O-CG 3.16Å; R50-R54 PolarHBondContact O-N 2.93Å; R50-R54 VanDerWaalsContact O-N 3.1Å; I51-R54 PolarHBondContact O-N 3.19Å; S52-R54 VanDerWaalsContact C-N 3.35Å; S52-R54 PolarHBondContact O-N 2.84Å; R54-K58 WeakPolarHBondContact O-CB 3.38Å; R54-K58 PolarHBondContact O-N 3.11Å |
| 55 | K | 76.9 | Confident | 71.9 | Confident | 131 Ų | 131 | 113.5 Ų | 113.5 | 57% | 0.57 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65.6 | -41.9 | 176 | -75.6 | -177.8 | -178.9 | 179.9 | 0 | 111.1 | I51 S52 H53 K58 R59 | I51-K55 HydrophobicContact CG2-CD 4.38Å; I51-K55 WeakPolarHBondContact O-CG 3.41Å; I51-K55 PolarHBondContact O-N 2.84Å; S52-K55 PolarHBondContact O-N 3.33Å; S52-K55 VanDerWaalsContact O-N 3.12Å; H53-K55 PolarHBondContact O-N 3.32Å; K55-K58 PolarHBondContact O-N 2.96Å; K55-R59 WeakPolarHBondContact O-CG 3.5Å; K55-R59 PolarHBondContact O-N 3.12Å; K55-R59 VanDerWaalsContact O-N 3.11Å |
| 56 | F | 72.8 | Confident | 71.8 | Confident | 71 Ų | 71 | 110.7 Ų | 110.7 | 31% | 0.311 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.1 | -54.6 | 175.6 | -177.5 | -94.8 | 0 | 0 | 0 | 111 | S52 H53 K58 R59 V60 L68 L71 | S52-F56 WeakPolarHBondContact O-CB 3.3Å; S52-F56 PolarHBondContact O-N 3.48Å; H53-F56 PolarHBondContact O-N 2.91Å; F56-K58 VanDerWaalsContact C-N 3.25Å; F56-K58 PolarHBondContact O-N 3.37Å; F56-R59 WeakPolarHBondContact O-CA 3.46Å; F56-R59 WeakPolarHBondContact O-CB 3.46Å; F56-R59 PolarHBondContact O-N 3.46Å; F56-V60 HydrophobicContact CD1-CG2 4Å; F56-V60 HydrophobicContact CE1-CG2 3.64Å; F56-V60 HydrophobicContact CE2-CG2 4.44Å; F56-V60 HydrophobicContact CZ-CG2 3.88Å; F56-V60 WeakPolarHBondContact O-CG2 3.48Å; F56-V60 PolarHBondContact O-N 3.03Å; F56-L68 HydrophobicContact CE1-CD2 4.08Å; F56-L68 HydrophobicContact CZ-CD2 4Å; F56-L71 HydrophobicContact CE2-CB 3.86Å; F56-L71 HydrophobicContact CE2-CD1 4Å |
| 57 | N | 69.9 | Low | 71.3 | Confident | 90 Ų | 90 | 105.9 Ų | 105.9 | 48% | 0.481 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -56 | -39.8 | 178.2 | -74.2 | 1.2 | 0 | 0 | 0 | 112.1 | H53 R59 V60 L61 | H53-N57 WeakPolarHBondContact O-CB 3.28Å; H53-N57 PolarHBondContact O-N 3.32Å; N57-R59 PolarHBondContact O-N 3.44Å; N57-V60 PolarHBondContact O-N 3.48Å; N57-L61 WeakPolarHBondContact O-CB 3.24Å; N57-L61 VanDerWaalsContact O-CG 3.24Å; N57-L61 WeakPolarHBondContact O-CG 3.38Å; N57-L61 PolarHBondContact O-N 2.91Å |
| 58 | K | 75.2 | Confident | 70.6 | Confident | 133 Ų | 133 | 105.3 Ų | 105.3 | 58% | 0.578 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -66.4 | -34.6 | 176.5 | -170.6 | 174.7 | -177.6 | 175.8 | 0 | 112.9 | R54 K55 F56 K62 | R54-K58 WeakPolarHBondContact O-CB 3.38Å; R54-K58 PolarHBondContact O-N 3.11Å; K55-K58 PolarHBondContact O-N 2.96Å; F56-K58 VanDerWaalsContact C-N 3.25Å; F56-K58 PolarHBondContact O-N 3.37Å; K58-K62 WeakPolarHBondContact O-CB 3.49Å; K58-K62 WeakPolarHBondContact O-CG 3.38Å; K58-K62 PolarHBondContact O-N 3.19Å; K58-K62 VanDerWaalsContact O-N 3.15Å |
| 59 | R | 71.5 | Confident | 70.5 | Confident | 135 Ų | 135 | 106.4 Ų | 106.4 | 51% | 0.509 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -68.9 | -45.7 | 175.2 | -71.6 | -175.6 | -145.1 | 174.9 | 5.9 | 110.9 | K55 F56 N57 L61 K62 R63 | K55-R59 WeakPolarHBondContact O-CG 3.5Å; K55-R59 PolarHBondContact O-N 3.12Å; K55-R59 VanDerWaalsContact O-N 3.11Å; F56-R59 WeakPolarHBondContact O-CA 3.46Å; F56-R59 WeakPolarHBondContact O-CB 3.46Å; F56-R59 PolarHBondContact O-N 3.46Å; N57-R59 PolarHBondContact O-N 3.44Å; R59-L61 PolarHBondContact O-N 2.86Å; R59-K62 PolarHBondContact O-N 3.37Å; R59-R63 WeakPolarHBondContact O-CB 3.09Å; R59-R63 PolarHBondContact O-N 3.24Å |
| 60 | V | 64.4 | Low | 70 | Confident | 21 Ų | 21 | 108 Ų | 108 | 13% | 0.127 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -60.2 | -45.6 | 177 | 176.8 | 0 | 0 | 0 | 0 | 110.8 | F56 N57 K62 R63 G64 L68 L71 | F56-V60 HydrophobicContact CD1-CG2 4Å; F56-V60 HydrophobicContact CE1-CG2 3.64Å; F56-V60 HydrophobicContact CE2-CG2 4.44Å; F56-V60 HydrophobicContact CZ-CG2 3.88Å; F56-V60 WeakPolarHBondContact O-CG2 3.48Å; F56-V60 PolarHBondContact O-N 3.03Å; N57-V60 PolarHBondContact O-N 3.48Å; V60-K62 VanDerWaalsContact C-N 3.31Å; V60-K62 PolarHBondContact O-N 3.17Å; V60-R63 PolarHBondContact O-N 3.13Å; V60-G64 CarbonylContact O-C 3.35Å; V60-G64 WeakPolarHBondContact O-CA 3.42Å; V60-G64 PolarHBondContact O-N 3.13Å; V60-L68 HydrophobicContact CB-CD2 4.32Å; V60-L68 HydrophobicContact CG1-CD1 4.47Å; V60-L68 HydrophobicContact CG1-CD2 3.72Å; V60-L68 HydrophobicContact CG1-CG 3.98Å; V60-L68 HydrophobicContact CG2-CD2 3.56Å; V60-L68 HydrophobicContact CG2-CG 4.44Å; V60-L71 HydrophobicContact CG2-CD1 4.3Å |
| 61 | L | 68.8 | Low | 69.3 | Low | 150 Ų | 150 | 102.9 Ų | 102.9 | 79% | 0.785 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -64.2 | -32.9 | 177.3 | -72.9 | 170.6 | 0 | 0 | 0 | 113.5 | N57 R59 | N57-L61 WeakPolarHBondContact O-CB 3.24Å; N57-L61 VanDerWaalsContact O-CG 3.24Å; N57-L61 WeakPolarHBondContact O-CG 3.38Å; N57-L61 PolarHBondContact O-N 2.91Å; R59-L61 PolarHBondContact O-N 2.86Å |
| 62 | K | 74 | Confident | 68.3 | Low | 164 Ų | 164 | 109.6 Ų | 109.6 | 71% | 0.713 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -79.1 | -34.6 | 179.1 | -80.9 | -173.2 | 172 | -161.2 | 0 | 113.5 | K58 R59 V60 | K58-K62 WeakPolarHBondContact O-CB 3.49Å; K58-K62 WeakPolarHBondContact O-CG 3.38Å; K58-K62 PolarHBondContact O-N 3.19Å; K58-K62 VanDerWaalsContact O-N 3.15Å; R59-K62 PolarHBondContact O-N 3.37Å; V60-K62 VanDerWaalsContact C-N 3.31Å; V60-K62 PolarHBondContact O-N 3.17Å |
| 63 | R | 68.4 | Low | 68 | Low | 144 Ų | 144 | 111.4 Ų | 111.4 | 54% | 0.543 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -95.7 | -10.5 | -176.1 | -72.4 | -175 | 175.3 | 174 | -4.6 | 113.6 | R59 V60 T67 | R59-R63 WeakPolarHBondContact O-CB 3.09Å; R59-R63 PolarHBondContact O-N 3.24Å; V60-R63 PolarHBondContact O-N 3.13Å; R63-T67 HydrophobicContact CB-CG2 3.78Å; R63-T67 WeakPolarHBondContact CB-OG1 3.2Å |
| 64 | G | 68.7 | Low | 67.8 | Low | 15 Ų | 15 | 110.9 Ų | 110.9 | 16% | 0.155 | 52% | 0.516 | C | S | . | . | trans | 87.3 | 155.9 | -172.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | V60 E66 T67 | V60-G64 CarbonylContact O-C 3.35Å; V60-G64 WeakPolarHBondContact O-CA 3.42Å; V60-G64 PolarHBondContact O-N 3.13Å; G64-E66 PolarHBondContact O-N 3Å; G64-E66 VanDerWaalsContact O-N 3.13Å; G64-T67 PolarHBondContact O-N 2.91Å; G64-T67 PolarHBondContact O-OG1 2.95Å | ||
| 65 | P | 66.2 | Low | 67.4 | Low | 93 Ų | 93 | 108.5 Ų | 108.5 | 60% | 0.604 | 51% | 0.512 | S | S | * | . | G | 310 helix | trans | -61.6 | -19.1 | 179.8 | 27.1 | -34.8 | 0 | 0 | 0 | 112.8 | T67 L68 | P65-T67 PolarHBondContact O-N 3.43Å; P65-T67 VanDerWaalsContact O-N 3.13Å; P65-L68 HydrophobicContact CB-CD1 4.26Å; P65-L68 WeakPolarHBondContact O-CB 3.45Å; P65-L68 WeakPolarHBondContact O-CD1 3.36Å; P65-L68 VanDerWaalsContact O-CG 3.3Å; P65-L68 WeakPolarHBondContact O-CG 3.44Å; P65-L68 PolarHBondContact O-N 3.36Å; P65-L68 VanDerWaalsContact O-N 3.17Å |
| 66 | E | 66.8 | Low | 66.8 | Low | 129 Ų | 129 | 107.2 Ų | 107.2 | 60% | 0.603 | 51% | 0.509 | S | S | * | . | G | 310 helix | trans | -67.2 | -3.2 | 176.5 | 60.1 | -149.1 | 139.8 | 0 | 0 | 115.2 | G64 W69 | G64-E66 PolarHBondContact O-N 3Å; G64-E66 VanDerWaalsContact O-N 3.13Å; E66-W69 VanDerWaalsContact CA-CZ2 3.44Å; E66-W69 HydrophobicContact CB-CH2 4.4Å; E66-W69 HydrophobicContact CB-CZ2 3.98Å; E66-W69 WeakPolarHBondContact O-CZ2 3.47Å; E66-W69 PolarHBondContact O-NE1 3.15Å |
| 67 | T | 65.2 | Low | 66.4 | Low | 15 Ų | 15 | 109.4 Ų | 109.4 | 9% | 0.092 | 52% | 0.521 | C | S | . | . | G | 310 helix | trans | -107.2 | 7.1 | 173.4 | 59.1 | 0 | 0 | 0 | 0 | 113.7 | R63 G64 P65 W69 E70 | R63-T67 HydrophobicContact CB-CG2 3.78Å; R63-T67 WeakPolarHBondContact CB-OG1 3.2Å; G64-T67 PolarHBondContact O-N 2.91Å; G64-T67 PolarHBondContact O-OG1 2.95Å; P65-T67 PolarHBondContact O-N 3.43Å; P65-T67 VanDerWaalsContact O-N 3.13Å; T67-W69 VanDerWaalsContact C-N 3.29Å; T67-W69 PolarHBondContact O-N 3.2Å; T67-E70 PolarHBondContact O-N 3.48Å |
| 68 | L | 59.5 | Low | 66.2 | Low | 78 Ų | 78 | 110.7 Ų | 110.7 | 41% | 0.408 | 52% | 0.523 | S | S | . | . | G | 310 helix | trans | -60.8 | -38 | 179.9 | -79.7 | 167.6 | 0 | 0 | 0 | 112.5 | F56 V60 P65 E70 | F56-L68 HydrophobicContact CE1-CD2 4.08Å; F56-L68 HydrophobicContact CZ-CD2 4Å; V60-L68 HydrophobicContact CB-CD2 4.32Å; V60-L68 HydrophobicContact CG1-CD1 4.47Å; V60-L68 HydrophobicContact CG1-CD2 3.72Å; V60-L68 HydrophobicContact CG1-CG 3.98Å; V60-L68 HydrophobicContact CG2-CD2 3.56Å; V60-L68 HydrophobicContact CG2-CG 4.44Å; P65-L68 HydrophobicContact CB-CD1 4.26Å; P65-L68 WeakPolarHBondContact O-CB 3.45Å; P65-L68 WeakPolarHBondContact O-CD1 3.36Å; P65-L68 VanDerWaalsContact O-CG 3.3Å; P65-L68 WeakPolarHBondContact O-CG 3.44Å; P65-L68 PolarHBondContact O-N 3.36Å; P65-L68 VanDerWaalsContact O-N 3.17Å; L68-E70 VanDerWaalsContact C-N 3.35Å |
| 69 | W | 67.9 | Low | 65.6 | Low | 189 Ų | 189 | 109.1 Ų | 109.1 | 72% | 0.716 | 52% | 0.52 | S | S | * | . | G | 310 helix | trans | -78.1 | -12.8 | 178.5 | 39.7 | 76.7 | 0 | 0 | 0 | 114.4 | E66 T67 L71 | E66-W69 VanDerWaalsContact CA-CZ2 3.44Å; E66-W69 HydrophobicContact CB-CH2 4.4Å; E66-W69 HydrophobicContact CB-CZ2 3.98Å; E66-W69 WeakPolarHBondContact O-CZ2 3.47Å; E66-W69 PolarHBondContact O-NE1 3.15Å; T67-W69 VanDerWaalsContact C-N 3.29Å; T67-W69 PolarHBondContact O-N 3.2Å; W69-L71 VanDerWaalsContact C-N 3.32Å |
| 70 | E | 64.2 | Low | 65.1 | Low | 133 Ų | 133 | 107.2 Ų | 107.2 | 62% | 0.621 | 52% | 0.52 | S | S | * | . | G | 310 helix | trans | -84.6 | -7.4 | 175.4 | -64.2 | -177.2 | 169.1 | 0 | 0 | 113 | T67 L68 | T67-E70 PolarHBondContact O-N 3.48Å; L68-E70 VanDerWaalsContact C-N 3.35Å |
| 71 | L | 58.6 | Low | 65.2 | Low | 43 Ų | 43 | 114.3 Ų | 114.3 | 23% | 0.225 | 55% | 0.553 | C | S | . | * | trans | -110.8 | 4.7 | -170.2 | -74.1 | 164.7 | 0 | 0 | 0 | 114.5 | F56 V60 W69 | F56-L71 HydrophobicContact CE2-CB 3.86Å; F56-L71 HydrophobicContact CE2-CD1 4Å; V60-L71 HydrophobicContact CG2-CD1 4.3Å; W69-L71 VanDerWaalsContact C-N 3.32Å | ||
| 72 | D | 53.7 | Low | 64.8 | Low | 219 Ų | 219 | 111.1 Ų | 111.1 | 100% | 1.171 | 53% | 0.532 | S | S | * | . | trans | -62.6 | 0 | 169.4 | -127.5 | 13.2 | 0 | 0 | 0 | 111 |
Retrieved 72 of 72 residues in 60.9 ms
(Link to these results)