| 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 | 47.8 | Very low | 45.6 | Very low | 230 Ų | 230 | 161.8 Ų | 161.8 | 100% | 1.133 | 82% | 0.822 | S | S | * | * | 0 | 92.2 | 0 | -80.5 | 176.2 | 83.2 | 0 | 0 | 107.3 | |||||
| 2 | E | 44 | Very low | 45.8 | Very low | 189 Ų | 189 | 162.1 Ų | 162.1 | 88% | 0.883 | 82% | 0.824 | S | S | * | * | trans | -92.7 | 107.9 | -177.2 | -150.8 | 160 | 125.1 | 0 | 0 | 107.7 | ||||
| 3 | K | 48 | Very low | 45.4 | Very low | 190 Ų | 190 | 159.8 Ų | 159.8 | 83% | 0.826 | 82% | 0.815 | S | S | * | * | trans | -93.8 | 98.9 | 174.5 | -77 | -168.8 | 176.3 | -168.1 | 0 | 108.2 | R5 | K3-R5 PolarHBondContact O-N 3.15Š| ||
| 4 | S | 50.1 | Low | 45.4 | Very low | 107 Ų | 107 | 156.5 Ų | 156.5 | 75% | 0.748 | 81% | 0.806 | S | S | * | * | trans | -60.9 | 121.2 | 171.9 | -53 | 0 | 0 | 0 | 0 | 110.3 | V6 | S4-V6 PolarHBondContact O-N 3.32Š| ||
| 5 | R | 45.9 | Very low | 46.2 | Very low | 217 Ų | 217 | 155.1 Ų | 155.1 | 82% | 0.819 | 81% | 0.807 | S | S | * | * | trans | -74.1 | 106.4 | 175.7 | -167.4 | -179.3 | -170.3 | -172 | 0.3 | 108 | K3 E7 | K3-R5 PolarHBondContact O-N 3.15Å; R5-E7 PolarHBondContact O-N 3.1Å | ||
| 6 | V | 51 | Low | 47.2 | Very low | 129 Ų | 129 | 152.2 Ų | 152.2 | 78% | 0.782 | 80% | 0.798 | S | S | * | * | trans | -78.7 | 96.3 | 168 | 173.5 | 0 | 0 | 0 | 0 | 107.3 | S4 K8 | S4-V6 PolarHBondContact O-N 3.32Å; V6-K8 PolarHBondContact O-N 3.3Å | ||
| 7 | E | 46.6 | Very low | 48.7 | Very low | 152 Ų | 152 | 151.4 Ų | 151.4 | 71% | 0.71 | 79% | 0.789 | S | S | * | * | trans | -69.4 | 112.9 | 162.8 | -77.2 | -177.7 | 147.3 | 0 | 0 | 108 | R5 | R5-E7 PolarHBondContact O-N 3.1Š| ||
| 8 | K | 48.5 | Very low | 50 | Low | 186 Ų | 186 | 144.7 Ų | 144.7 | 81% | 0.809 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 130.6 | 171.2 | -74 | -176.8 | 175.8 | -179.8 | 0 | 108.2 | V6 | V6-K8 PolarHBondContact O-N 3.3Š|
| 9 | P | 44.8 | Very low | 51.6 | Low | 126 Ų | 126 | 144.5 Ų | 144.5 | 82% | 0.818 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 140.5 | 176.3 | 26.7 | -31.4 | 0 | 0 | 0 | 109.9 | ||
| 10 | G | 37.7 | Very low | 53.4 | Low | 68 Ų | 68 | 141 Ų | 141 | 70% | 0.701 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -47.4 | 133.7 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | I12 | G10-I12 PolarHBondContact O-N 3.23Š|
| 11 | K | 37.9 | Very low | 55 | Low | 186 Ų | 186 | 142 Ų | 142 | 81% | 0.809 | 73% | 0.734 | S | S | * | * | trans | -58.1 | 104.6 | 163.1 | -158.7 | 179.1 | -172.6 | -172.4 | 0 | 105.9 | D13 | K11-D13 PolarHBondContact O-N 2.72Š| ||
| 12 | I | 48 | Very low | 56.8 | Low | 165 Ų | 165 | 138 Ų | 138 | 85% | 0.846 | 71% | 0.712 | S | S | * | * | trans | -65.8 | 108.6 | 168.5 | -62.3 | 168.2 | 0 | 0 | 0 | 104 | G10 V14 | G10-I12 PolarHBondContact O-N 3.23Å; I12-V14 PolarHBondContact O-N 3.13Å | ||
| 13 | D | 39.8 | Very low | 58.8 | Low | 132 Ų | 132 | 131.3 Ų | 131.3 | 71% | 0.706 | 68% | 0.684 | S | S | * | * | trans | -53.8 | 131 | -177 | -85.7 | -49.2 | 0 | 0 | 0 | 109.4 | K11 V15 | K11-D13 PolarHBondContact O-N 2.72Å; D13-V15 PolarHBondContact O-N 3.22Å | ||
| 14 | V | 45.9 | Very low | 60.5 | Low | 114 Ų | 114 | 126.3 Ų | 126.3 | 69% | 0.691 | 67% | 0.665 | S | S | * | * | trans | -45.4 | 124.4 | 174.2 | -179.9 | 0 | 0 | 0 | 0 | 107.2 | I12 T16 | I12-V14 PolarHBondContact O-N 3.13Å; V14-T16 PolarHBondContact O-N 3.08Å | ||
| 15 | V | 57.5 | Low | 62 | Low | 135 Ų | 135 | 127.7 Ų | 127.7 | 82% | 0.818 | 66% | 0.658 | S | S | * | * | trans | -56.6 | 93 | 163.4 | 177.8 | 0 | 0 | 0 | 0 | 105.6 | D13 H17 | D13-V15 PolarHBondContact O-N 3.22Å; V15-H17 PolarHBondContact O-N 2.97Å | ||
| 16 | T | 62.6 | Low | 63.8 | Low | 109 Ų | 109 | 122.7 Ų | 122.7 | 67% | 0.669 | 64% | 0.644 | S | S | * | * | trans | -60.5 | 111.8 | 169.3 | 40.8 | 0 | 0 | 0 | 0 | 104.5 | V14 V18 | V14-T16 PolarHBondContact O-N 3.08Å; T16-V18 WeakPolarHBondContact O-CG2 3.43Å; T16-V18 PolarHBondContact O-N 3.47Å | ||
| 17 | H | 71.6 | Confident | 65.4 | Low | 138 Ų | 138 | 120.8 Ų | 120.8 | 64% | 0.639 | 63% | 0.629 | S | S | * | * | trans | -62.7 | 104.8 | 178.7 | -167.9 | 33.9 | 0 | 0 | 0 | 107.1 | V15 H19 | V15-H17 PolarHBondContact O-N 2.97Å; H17-H19 AromaticContact CD2-CE1 2.91Å; H17-H19 PolarHBondContact CD2-CE1 3.15Å; H17-H19 AromaticContact CD2-ND1 3.68Å; H17-H19 AromaticContact CD2-NE2 3.14Å; H17-H19 PolarHBondContact CD2-NE2 3.34Å; H17-H19 AromaticContact CG-CE1 3.84Å; H17-H19 AromaticContact CG-NE2 3.78Å; H17-H19 AromaticContact NE2-CE1 3.27Å; H17-H19 PolarHBondContact NE2-CE1 3.16Å; H17-H19 VanDerWaalsContact NE2-CE1 3.27Å; H17-H19 AromaticContact NE2-ND1 3.75Å; H17-H19 AromaticContact NE2-NE2 3.97Å; H17-H19 PolarHBondContact O-CD2 3.43Å; H17-H19 VanDerWaalsContact O-CD2 3.28Å; H17-H19 PolarHBondContact O-N 3.46Å | ||
| 18 | V | 72.2 | Confident | 67.1 | Low | 31 Ų | 31 | 115.8 Ų | 115.8 | 19% | 0.188 | 61% | 0.614 | C | S | . | * | trans | -75.3 | 120.2 | 176.2 | -179.1 | 0 | 0 | 0 | 0 | 106.3 | T16 D20 T23 M24 L27 | T16-V18 WeakPolarHBondContact O-CG2 3.43Å; T16-V18 PolarHBondContact O-N 3.47Å; V18-D20 VanDerWaalsContact CG1-OD2 3.3Å; V18-D20 WeakPolarHBondContact CG1-OD2 3.48Å; V18-T23 VanDerWaalsContact CG1-CB 3.46Å; V18-T23 HydrophobicContact CG1-CG2 3.55Å; V18-T23 HydrophobicContact CG2-CG2 4.28Å; V18-M24 HydrophobicContact CB-CG 4.05Å; V18-M24 HydrophobicContact CG1-CG 3.73Å; V18-L27 HydrophobicContact CB-CD1 4.43Å; V18-L27 HydrophobicContact CG2-CD1 3.76Å | ||
| 19 | H | 81.4 | Confident | 68.8 | Low | 141 Ų | 141 | 109.3 Ų | 109.3 | 65% | 0.653 | 59% | 0.587 | S | S | * | * | trans | -106.5 | -18.8 | -177 | -75.2 | -73.8 | 0 | 0 | 0 | 112.6 | H17 | H17-H19 AromaticContact CD2-CE1 2.91Å; H17-H19 PolarHBondContact CD2-CE1 3.15Å; H17-H19 AromaticContact CD2-ND1 3.68Å; H17-H19 AromaticContact CD2-NE2 3.14Å; H17-H19 PolarHBondContact CD2-NE2 3.34Å; H17-H19 AromaticContact CG-CE1 3.84Å; H17-H19 AromaticContact CG-NE2 3.78Å; H17-H19 AromaticContact NE2-CE1 3.27Å; H17-H19 PolarHBondContact NE2-CE1 3.16Å; H17-H19 VanDerWaalsContact NE2-CE1 3.27Å; H17-H19 AromaticContact NE2-ND1 3.75Å; H17-H19 AromaticContact NE2-NE2 3.97Å; H17-H19 PolarHBondContact O-CD2 3.43Å; H17-H19 VanDerWaalsContact O-CD2 3.28Å; H17-H19 PolarHBondContact O-N 3.46Å | ||
| 20 | D | 88 | Confident | 70.5 | Confident | 75 Ų | 75 | 107.7 Ų | 107.7 | 40% | 0.401 | 58% | 0.579 | S | S | . | * | S | Bend | trans | -81.8 | 130.1 | 177.4 | 68 | 105.4 | 0 | 0 | 0 | 109.9 | V18 E22 T23 M24 | V18-D20 VanDerWaalsContact CG1-OD2 3.3Å; V18-D20 WeakPolarHBondContact CG1-OD2 3.48Å; D20-E22 PolarHBondContact O-N 2.97Å; D20-T23 VanDerWaalsContact CG-OG1 3.29Å; D20-T23 PolarHBondContact O-N 3.03Å; D20-T23 WeakPolarHBondContact OD1-CA 3.3Å; D20-T23 WeakPolarHBondContact OD1-CB 3.41Å; D20-T23 PolarHBondContact OD1-N 3.34Å; D20-T23 PolarHBondContact OD1-OG1 3.16Å; D20-T23 WeakPolarHBondContact OD2-CB 3.26Å; D20-T23 PolarHBondContact OD2-OG1 3.49Å; D20-M24 WeakPolarHBondContact O-CG 3.29Å; D20-M24 PolarHBondContact O-N 3.32Å |
| 21 | E | 86.9 | Confident | 72.6 | Confident | 163 Ų | 163 | 108.2 Ų | 108.2 | 76% | 0.762 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -62.9 | -32.7 | -174.5 | -65.3 | -177 | 173.6 | 0 | 0 | 112.3 | M24 F25 | E21-M24 HydrophobicContact CB-CE 4.41Å; E21-M24 HydrophobicContact CG-CE 4.05Å; E21-M24 PolarHBondContact O-N 2.67Å; E21-F25 VanDerWaalsContact O-CB 3.31Å; E21-F25 WeakPolarHBondContact O-CB 3.3Å; E21-F25 PolarHBondContact O-N 3.23Å |
| 22 | E | 84 | Confident | 74.7 | Confident | 144 Ų | 144 | 102.4 Ų | 102.4 | 67% | 0.673 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.7 | -54.4 | 178.9 | -174 | 172.2 | -169 | 0 | 0 | 111.4 | D20 M24 F25 E26 | D20-E22 PolarHBondContact O-N 2.97Å; E22-M24 VanDerWaalsContact C-N 3.31Å; E22-M24 PolarHBondContact O-N 3.2Å; E22-F25 WeakPolarHBondContact O-CB 3.46Å; E22-F25 PolarHBondContact O-N 3.04Å; E22-F25 VanDerWaalsContact O-N 3.1Å; E22-E26 WeakPolarHBondContact O-CG 3.38Å; E22-E26 PolarHBondContact O-N 3.3Å |
| 23 | T | 86.7 | Confident | 76.4 | Confident | 50 Ų | 50 | 96.3 Ų | 96.3 | 31% | 0.307 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.3 | -36.3 | 177.5 | -57.3 | 0 | 0 | 0 | 0 | 111 | V18 D20 F25 E26 L27 | V18-T23 VanDerWaalsContact CG1-CB 3.46Å; V18-T23 HydrophobicContact CG1-CG2 3.55Å; V18-T23 HydrophobicContact CG2-CG2 4.28Å; D20-T23 VanDerWaalsContact CG-OG1 3.29Å; D20-T23 PolarHBondContact O-N 3.03Å; D20-T23 WeakPolarHBondContact OD1-CA 3.3Å; D20-T23 WeakPolarHBondContact OD1-CB 3.41Å; D20-T23 PolarHBondContact OD1-N 3.34Å; D20-T23 PolarHBondContact OD1-OG1 3.16Å; D20-T23 WeakPolarHBondContact OD2-CB 3.26Å; D20-T23 PolarHBondContact OD2-OG1 3.49Å; T23-F25 VanDerWaalsContact C-N 3.28Å; T23-F25 PolarHBondContact O-N 3.41Å; T23-E26 PolarHBondContact O-N 3.11Å; T23-L27 HydrophobicContact CG2-CD1 3.96Å; T23-L27 HydrophobicContact CG2-CG 4.15Å; T23-L27 VanDerWaalsContact O-CB 3.28Å; T23-L27 WeakPolarHBondContact O-CB 3.44Å; T23-L27 WeakPolarHBondContact O-CG 3.49Å; T23-L27 PolarHBondContact O-N 3.36Å |
| 24 | M | 82.8 | Confident | 78.6 | Confident | 85 Ų | 85 | 97.7 Ų | 97.7 | 42% | 0.419 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59.3 | -42.1 | 173.3 | -75.2 | -167.4 | -70.1 | 0 | 0 | 111.6 | V18 D20 E21 E22 A28 | V18-M24 HydrophobicContact CB-CG 4.05Å; V18-M24 HydrophobicContact CG1-CG 3.73Å; D20-M24 WeakPolarHBondContact O-CG 3.29Å; D20-M24 PolarHBondContact O-N 3.32Å; E21-M24 HydrophobicContact CB-CE 4.41Å; E21-M24 HydrophobicContact CG-CE 4.05Å; E21-M24 PolarHBondContact O-N 2.67Å; E22-M24 VanDerWaalsContact C-N 3.31Å; E22-M24 PolarHBondContact O-N 3.2Å; M24-A28 WeakPolarHBondContact O-CB 3.26Å; M24-A28 PolarHBondContact O-N 3.14Å |
| 25 | F | 81.9 | Confident | 80.6 | Confident | 135 Ų | 135 | 98.5 Ų | 98.5 | 59% | 0.592 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -68.9 | -45.6 | 178 | -175.3 | -113.7 | 0 | 0 | 0 | 112 | E21 E22 T23 L27 A28 L29 | E21-F25 VanDerWaalsContact O-CB 3.31Å; E21-F25 WeakPolarHBondContact O-CB 3.3Å; E21-F25 PolarHBondContact O-N 3.23Å; E22-F25 WeakPolarHBondContact O-CB 3.46Å; E22-F25 PolarHBondContact O-N 3.04Å; E22-F25 VanDerWaalsContact O-N 3.1Å; T23-F25 VanDerWaalsContact C-N 3.28Å; T23-F25 PolarHBondContact O-N 3.41Å; F25-L27 VanDerWaalsContact C-N 3.33Å; F25-L27 PolarHBondContact O-N 3.5Å; F25-A28 WeakPolarHBondContact O-CB 3.34Å; F25-A28 PolarHBondContact O-N 3.37Å; F25-L29 HydrophobicContact CD1-CD1 3.9Å; F25-L29 HydrophobicContact CD1-CG 4.39Å; F25-L29 HydrophobicContact CE1-CD1 3.46Å; F25-L29 VanDerWaalsContact CE1-CD1 3.46Å; F25-L29 HydrophobicContact CE1-CD2 4.49Å; F25-L29 HydrophobicContact CE1-CG 4.08Å; F25-L29 HydrophobicContact CE2-CD2 4.28Å; F25-L29 HydrophobicContact CE2-CG 4.33Å; F25-L29 HydrophobicContact CZ-CD1 3.82Å; F25-L29 HydrophobicContact CZ-CD2 4.01Å; F25-L29 HydrophobicContact CZ-CG 4.04Å; F25-L29 WeakPolarHBondContact O-CG 3.25Å; F25-L29 PolarHBondContact O-N 2.95Å |
| 26 | E | 84.4 | Confident | 81.9 | Confident | 112 Ų | 112 | 92.9 Ų | 92.9 | 52% | 0.523 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.6 | -43 | 175.6 | -71.6 | -172 | 161.8 | 0 | 0 | 112.1 | E22 T23 L29 S30 | E22-E26 WeakPolarHBondContact O-CG 3.38Å; E22-E26 PolarHBondContact O-N 3.3Å; T23-E26 PolarHBondContact O-N 3.11Å; E26-L29 PolarHBondContact O-N 3.46Å; E26-S30 WeakPolarHBondContact O-CB 3.44Å; E26-S30 PolarHBondContact O-N 3.29Å |
| 27 | L | 84.8 | Confident | 83.1 | Confident | 89 Ų | 89 | 89.1 Ų | 89.1 | 47% | 0.466 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.1 | -44.4 | 175.2 | -75.1 | 174 | 0 | 0 | 0 | 111.3 | V18 T23 F25 L29 S30 A31 | V18-L27 HydrophobicContact CB-CD1 4.43Å; V18-L27 HydrophobicContact CG2-CD1 3.76Å; T23-L27 HydrophobicContact CG2-CD1 3.96Å; T23-L27 HydrophobicContact CG2-CG 4.15Å; T23-L27 VanDerWaalsContact O-CB 3.28Å; T23-L27 WeakPolarHBondContact O-CB 3.44Å; T23-L27 WeakPolarHBondContact O-CG 3.49Å; T23-L27 PolarHBondContact O-N 3.36Å; F25-L27 VanDerWaalsContact C-N 3.33Å; F25-L27 PolarHBondContact O-N 3.5Å; L27-L29 VanDerWaalsContact C-N 3.35Å; L27-L29 PolarHBondContact O-N 3.47Å; L27-S30 WeakPolarHBondContact CA-OG 3.47Å; L27-S30 PolarHBondContact O-N 2.91Å; L27-S30 PolarHBondContact O-OG 3.19Å; L27-A31 PolarHBondContact O-N 3.06Å; L27-A31 VanDerWaalsContact O-N 3.09Å |
| 28 | A | 81.9 | Confident | 84 | Confident | 48 Ų | 48 | 88.1 Ų | 88.1 | 40% | 0.397 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -59.4 | -45 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | M24 F25 A31 M32 | M24-A28 WeakPolarHBondContact O-CB 3.26Å; M24-A28 PolarHBondContact O-N 3.14Å; F25-A28 WeakPolarHBondContact O-CB 3.34Å; F25-A28 PolarHBondContact O-N 3.37Å; A28-A31 PolarHBondContact O-N 3.37Å; A28-M32 WeakPolarHBondContact O-CG 3.49Å |
| 29 | L | 83.4 | Confident | 84.9 | Confident | 49 Ų | 49 | 88.5 Ų | 88.5 | 26% | 0.257 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -63.2 | -42.7 | 175.4 | -67.4 | 179 | 0 | 0 | 0 | 111.8 | F25 E26 L27 A31 M32 L37 | F25-L29 HydrophobicContact CD1-CD1 3.9Å; F25-L29 HydrophobicContact CD1-CG 4.39Å; F25-L29 HydrophobicContact CE1-CD1 3.46Å; F25-L29 VanDerWaalsContact CE1-CD1 3.46Å; F25-L29 HydrophobicContact CE1-CD2 4.49Å; F25-L29 HydrophobicContact CE1-CG 4.08Å; F25-L29 HydrophobicContact CE2-CD2 4.28Å; F25-L29 HydrophobicContact CE2-CG 4.33Å; F25-L29 HydrophobicContact CZ-CD1 3.82Å; F25-L29 HydrophobicContact CZ-CD2 4.01Å; F25-L29 HydrophobicContact CZ-CG 4.04Å; F25-L29 WeakPolarHBondContact O-CG 3.25Å; F25-L29 PolarHBondContact O-N 2.95Å; E26-L29 PolarHBondContact O-N 3.46Å; L27-L29 VanDerWaalsContact C-N 3.35Å; L27-L29 PolarHBondContact O-N 3.47Å; L29-A31 PolarHBondContact O-N 2.82Å; L29-M32 HydrophobicContact CD2-SD 4.43Å; L29-M32 PolarHBondContact O-N 3.32Å; L29-M32 VanDerWaalsContact O-N 3.15Å; L29-L37 HydrophobicContact CB-CD2 4.08Å; L29-L37 HydrophobicContact CD2-CD2 3.68Å; L29-L37 HydrophobicContact CG-CD2 4.46Å |
| 30 | S | 80.4 | Confident | 85.3 | Confident | 92 Ų | 92 | 82.8 Ų | 82.8 | 64% | 0.643 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -65.7 | -22.9 | -179.6 | 77.3 | 0 | 0 | 0 | 0 | 113.7 | E26 L27 | E26-S30 WeakPolarHBondContact O-CB 3.44Å; E26-S30 PolarHBondContact O-N 3.29Å; L27-S30 WeakPolarHBondContact CA-OG 3.47Å; L27-S30 PolarHBondContact O-N 2.91Å; L27-S30 PolarHBondContact O-OG 3.19Å |
| 31 | A | 82.2 | Confident | 85.4 | Confident | 79 Ų | 79 | 86.7 Ų | 86.7 | 65% | 0.653 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.2 | -13.2 | 178 | 0 | 0 | 0 | 0 | 0 | 113.2 | L27 A28 L29 | L27-A31 PolarHBondContact O-N 3.06Å; L27-A31 VanDerWaalsContact O-N 3.09Å; A28-A31 PolarHBondContact O-N 3.37Å; L29-A31 PolarHBondContact O-N 2.82Å |
| 32 | M | 82.4 | Confident | 85.7 | Confident | 64 Ų | 64 | 83.2 Ų | 83.2 | 32% | 0.315 | 44% | 0.435 | S | S | . | . | S | Bend | trans | -82.1 | 148.1 | 178.6 | -68.2 | 176.5 | 178.5 | 0 | 0 | 111.2 | A28 L29 T36 L37 I40 | A28-M32 WeakPolarHBondContact O-CG 3.49Å; L29-M32 HydrophobicContact CD2-SD 4.43Å; L29-M32 PolarHBondContact O-N 3.32Å; L29-M32 VanDerWaalsContact O-N 3.15Å; M32-T36 HydrophobicContact CB-CG2 4.26Å; M32-T36 HydrophobicContact CG-CG2 4.35Å; M32-T36 HydrophobicContact SD-CG2 4.1Å; M32-L37 HydrophobicContact CB-CD2 3.99Å; M32-L37 HydrophobicContact CB-CG 4.1Å; M32-L37 HydrophobicContact SD-CD2 4.1Å; M32-I40 HydrophobicContact CE-CD1 4.29Å; M32-I40 HydrophobicContact SD-CD1 3.57Å; M32-I40 VanDerWaalsContact SD-CD1 3.57Å |
| 33 | A | 84.5 | Confident | 86.1 | Confident | 37 Ų | 37 | 77.2 Ų | 77.2 | 31% | 0.306 | 41% | 0.407 | S | S | . | . | trans | -62.3 | 147.6 | 169.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | E35 T36 L37 | A33-E35 VanDerWaalsContact C-N 3.25Å; A33-E35 HydrophobicContact CB-CG 3.91Å; A33-E35 PolarHBondContact O-N 2.96Å; A33-T36 WeakPolarHBondContact O-CA 3.47Å; A33-T36 VanDerWaalsContact O-CB 3.31Å; A33-T36 WeakPolarHBondContact O-CB 3.48Å; A33-T36 PolarHBondContact O-N 2.97Å; A33-L37 PolarHBondContact O-N 3.27Å; A33-L37 VanDerWaalsContact O-N 3.08Å | ||
| 34 | E | 86.2 | Confident | 86.4 | Confident | 161 Ų | 161 | 79.9 Ų | 79.9 | 75% | 0.752 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -56.6 | -39.3 | -178.5 | -173.8 | 171.2 | -165.5 | 0 | 0 | 112.3 | T36 L37 E38 | E34-T36 VanDerWaalsContact C-N 3.27Å; E34-T36 PolarHBondContact O-N 3.35Å; E34-L37 WeakPolarHBondContact O-CB 3.04Å; E34-L37 PolarHBondContact O-N 3.48Å; E34-L37 VanDerWaalsContact O-N 3.15Å; E34-E38 PolarHBondContact O-N 3.14Å |
| 35 | E | 86.4 | Confident | 87 | Confident | 132 Ų | 132 | 82.1 Ų | 82.1 | 62% | 0.617 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -60.5 | -32.9 | 174.1 | 63.8 | -173 | -170.4 | 0 | 0 | 113.5 | A33 T39 | A33-E35 VanDerWaalsContact C-N 3.25Å; A33-E35 HydrophobicContact CB-CG 3.91Å; A33-E35 PolarHBondContact O-N 2.96Å; E35-T39 PolarHBondContact O-N 3.31Å; E35-T39 VanDerWaalsContact O-N 3.12Å; E35-T39 PolarHBondContact O-OG1 3.31Å |
| 36 | T | 85.7 | Confident | 87.5 | Confident | 16 Ų | 16 | 79.1 Ų | 79.1 | 10% | 0.098 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -73.6 | -41.2 | 176.1 | -62.8 | 0 | 0 | 0 | 0 | 109.9 | M32 A33 E34 E38 T39 I40 K64 | M32-T36 HydrophobicContact CB-CG2 4.26Å; M32-T36 HydrophobicContact CG-CG2 4.35Å; M32-T36 HydrophobicContact SD-CG2 4.1Å; A33-T36 WeakPolarHBondContact O-CA 3.47Å; A33-T36 VanDerWaalsContact O-CB 3.31Å; A33-T36 WeakPolarHBondContact O-CB 3.48Å; A33-T36 PolarHBondContact O-N 2.97Å; E34-T36 VanDerWaalsContact C-N 3.27Å; E34-T36 PolarHBondContact O-N 3.35Å; T36-E38 VanDerWaalsContact C-N 3.34Å; T36-E38 PolarHBondContact O-N 3.43Å; T36-T39 PolarHBondContact O-N 3.47Å; T36-I40 HydrophobicContact CG2-CD1 4.1Å; T36-I40 WeakPolarHBondContact O-CG1 3.02Å; T36-I40 PolarHBondContact O-N 3.1Å; T36-K64 HydrophobicContact CG2-CB 3.94Å; T36-K64 HydrophobicContact CG2-CG 4.27Å |
| 37 | L | 87.7 | Confident | 87.9 | Confident | 31 Ų | 31 | 74.9 Ų | 74.9 | 16% | 0.162 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -63 | -40.5 | 174.7 | -66 | 177.4 | 0 | 0 | 0 | 112 | L29 M32 A33 E34 I40 R41 | L29-L37 HydrophobicContact CB-CD2 4.08Å; L29-L37 HydrophobicContact CD2-CD2 3.68Å; L29-L37 HydrophobicContact CG-CD2 4.46Å; M32-L37 HydrophobicContact CB-CD2 3.99Å; M32-L37 HydrophobicContact CB-CG 4.1Å; M32-L37 HydrophobicContact SD-CD2 4.1Å; A33-L37 PolarHBondContact O-N 3.27Å; A33-L37 VanDerWaalsContact O-N 3.08Å; E34-L37 WeakPolarHBondContact O-CB 3.04Å; E34-L37 PolarHBondContact O-N 3.48Å; E34-L37 VanDerWaalsContact O-N 3.15Å; L37-I40 PolarHBondContact O-N 2.86Å; L37-R41 VanDerWaalsContact O-CG 3.3Å; L37-R41 WeakPolarHBondContact O-CG 3.21Å; L37-R41 PolarHBondContact O-N 2.9Å |
| 38 | E | 90.8 | Very high | 88.2 | Confident | 116 Ų | 116 | 77.1 Ų | 77.1 | 54% | 0.542 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -58.9 | -48.4 | 173.9 | -172.7 | 173.9 | -167.6 | 0 | 0 | 110.9 | E34 T36 I40 R41 D42 | E34-E38 PolarHBondContact O-N 3.14Å; T36-E38 VanDerWaalsContact C-N 3.34Å; T36-E38 PolarHBondContact O-N 3.43Å; E38-I40 VanDerWaalsContact C-N 3.32Å; E38-I40 PolarHBondContact O-N 3.12Å; E38-R41 WeakPolarHBondContact O-CB 2.93Å; E38-R41 PolarHBondContact O-N 3.01Å; E38-R41 VanDerWaalsContact O-N 3.12Å; E38-D42 PolarHBondContact O-N 3.12Å |
| 39 | T | 90.2 | Very high | 88.8 | Confident | 39 Ų | 39 | 81.6 Ų | 81.6 | 24% | 0.239 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -59 | -42 | 177 | -54.3 | 0 | 0 | 0 | 0 | 112.2 | E35 T36 D42 F43 V60 K64 | E35-T39 PolarHBondContact O-N 3.31Å; E35-T39 VanDerWaalsContact O-N 3.12Å; E35-T39 PolarHBondContact O-OG1 3.31Å; T36-T39 PolarHBondContact O-N 3.47Å; T39-D42 PolarHBondContact O-N 2.98Å; T39-F43 WeakPolarHBondContact O-CB 3.44Å; T39-F43 PolarHBondContact O-N 3.29Å; T39-V60 HydrophobicContact CG2-CG1 3.58Å; T39-K64 HydrophobicContact CG2-CG 4.47Å; T39-K64 VanDerWaalsContact OG1-CE 3.25Å; T39-K64 WeakPolarHBondContact OG1-CE 3.22Å |
| 40 | I | 89 | Confident | 89.3 | Confident | 21 Ų | 21 | 82.8 Ų | 82.8 | 11% | 0.108 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -65.6 | -41.1 | 177.6 | -68.8 | 167.6 | 0 | 0 | 0 | 110.7 | M32 T36 L37 E38 F43 I44 L57 | M32-I40 HydrophobicContact CE-CD1 4.29Å; M32-I40 HydrophobicContact SD-CD1 3.57Å; M32-I40 VanDerWaalsContact SD-CD1 3.57Å; T36-I40 HydrophobicContact CG2-CD1 4.1Å; T36-I40 WeakPolarHBondContact O-CG1 3.02Å; T36-I40 PolarHBondContact O-N 3.1Å; L37-I40 PolarHBondContact O-N 2.86Å; E38-I40 VanDerWaalsContact C-N 3.32Å; E38-I40 PolarHBondContact O-N 3.12Å; I40-F43 WeakPolarHBondContact O-CB 3.2Å; I40-F43 PolarHBondContact O-N 3.16Å; I40-I44 HydrophobicContact CG2-CD1 4.01Å; I40-I44 VanDerWaalsContact O-CG1 3.29Å; I40-I44 WeakPolarHBondContact O-CG1 3.5Å; I40-I44 PolarHBondContact O-N 3.13Å; I40-L57 HydrophobicContact CG2-CD1 4.44Å |
| 41 | R | 91.5 | Very high | 89.9 | Confident | 158 Ų | 158 | 85.7 Ų | 85.7 | 60% | 0.596 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -63.3 | -45.1 | 176.5 | -72.6 | 171 | -174.3 | 162 | 3.8 | 111.5 | L37 E38 F43 I44 L45 | L37-R41 VanDerWaalsContact O-CG 3.3Å; L37-R41 WeakPolarHBondContact O-CG 3.21Å; L37-R41 PolarHBondContact O-N 2.9Å; E38-R41 WeakPolarHBondContact O-CB 2.93Å; E38-R41 PolarHBondContact O-N 3.01Å; E38-R41 VanDerWaalsContact O-N 3.12Å; R41-F43 VanDerWaalsContact C-N 3.3Å; R41-F43 PolarHBondContact O-N 2.99Å; R41-I44 WeakPolarHBondContact O-CB 3.46Å; R41-I44 PolarHBondContact O-N 2.87Å; R41-I44 VanDerWaalsContact O-N 3.14Å; R41-L45 PolarHBondContact O-N 2.96Å; R41-L45 VanDerWaalsContact O-N 3.16Å |
| 42 | D | 93.5 | Very high | 90.5 | Very high | 89 Ų | 89 | 84.2 Ų | 84.2 | 48% | 0.476 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -61.2 | -40.8 | 176.6 | -73.7 | -12.1 | 0 | 0 | 0 | 111.5 | E38 T39 I44 L45 | E38-D42 PolarHBondContact O-N 3.12Å; T39-D42 PolarHBondContact O-N 2.98Å; D42-I44 PolarHBondContact O-N 3.5Å; D42-L45 PolarHBondContact O-N 3.49Å |
| 43 | F | 92.5 | Very high | 90.9 | Very high | 18 Ų | 18 | 83.3 Ų | 83.3 | 8% | 0.079 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -60.3 | -44.6 | 173.9 | 177.5 | -88.7 | 0 | 0 | 0 | 111.8 | T39 I40 R41 L45 I46 A47 Q50 P53 A56 L57 V60 | T39-F43 WeakPolarHBondContact O-CB 3.44Å; T39-F43 PolarHBondContact O-N 3.29Å; I40-F43 WeakPolarHBondContact O-CB 3.2Å; I40-F43 PolarHBondContact O-N 3.16Å; R41-F43 VanDerWaalsContact C-N 3.3Å; R41-F43 PolarHBondContact O-N 2.99Å; F43-L45 PolarHBondContact O-N 2.84Å; F43-I46 CarbonylContact O-C 3.59Å; F43-I46 VanDerWaalsContact O-CG1 3.3Å; F43-I46 WeakPolarHBondContact O-CG1 3.48Å; F43-I46 PolarHBondContact O-N 3.37Å; F43-I46 VanDerWaalsContact O-N 3.1Å; F43-A47 HydrophobicContact CD1-CB 4.44Å; F43-A47 HydrophobicContact CE1-CB 3.96Å; F43-A47 HydrophobicContact CZ-CB 4.46Å; F43-A47 PolarHBondContact O-N 3Å; F43-Q50 HydrophobicContact CE2-CG 4.17Å; F43-Q50 HydrophobicContact CZ-CG 4.21Å; F43-P53 VanDerWaalsContact CZ-O 3.26Å; F43-P53 WeakPolarHBondContact CZ-O 3.43Å; F43-A56 HydrophobicContact CE2-CB 3.58Å; F43-A56 HydrophobicContact CZ-CB 3.72Å; F43-L57 HydrophobicContact CD1-CB 4.05Å; F43-L57 HydrophobicContact CD1-CD1 3.6Å; F43-L57 HydrophobicContact CD1-CG 4.35Å; F43-L57 HydrophobicContact CE1-CB 3.52Å; F43-L57 HydrophobicContact CE1-CD1 3.99Å; F43-L57 HydrophobicContact CE1-CG 4.25Å; F43-L57 HydrophobicContact CG-CD1 4.23Å; F43-L57 HydrophobicContact CZ-CB 3.9Å; F43-L57 VanDerWaalsContact CZ-N 3.3Å; F43-V60 HydrophobicContact CD2-CG2 3.88Å; F43-V60 HydrophobicContact CE2-CG2 4.46Å; F43-V60 HydrophobicContact CG-CG2 4.49Å |
| 44 | I | 92.1 | Very high | 91.1 | Very high | 107 Ų | 107 | 89.9 Ų | 89.9 | 55% | 0.549 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -59.8 | -37.2 | 179.8 | -70.2 | 164.1 | 0 | 0 | 0 | 111.1 | I40 R41 D42 I46 A47 | I40-I44 HydrophobicContact CG2-CD1 4.01Å; I40-I44 VanDerWaalsContact O-CG1 3.29Å; I40-I44 WeakPolarHBondContact O-CG1 3.5Å; I40-I44 PolarHBondContact O-N 3.13Å; R41-I44 WeakPolarHBondContact O-CB 3.46Å; R41-I44 PolarHBondContact O-N 2.87Å; R41-I44 VanDerWaalsContact O-N 3.14Å; D42-I44 PolarHBondContact O-N 3.5Å; I44-I46 PolarHBondContact O-N 3.47Å; I44-A47 WeakPolarHBondContact O-CB 3.14Å; I44-A47 PolarHBondContact O-N 3.09Å |
| 45 | L | 94.4 | Very high | 91.2 | Very high | 132 Ų | 132 | 87.1 Ų | 87.1 | 69% | 0.691 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -64.5 | -23.2 | 178.4 | -68.3 | 175.2 | 0 | 0 | 0 | 113.9 | R41 D42 F43 | R41-L45 PolarHBondContact O-N 2.96Å; R41-L45 VanDerWaalsContact O-N 3.16Å; D42-L45 PolarHBondContact O-N 3.49Å; F43-L45 PolarHBondContact O-N 2.84Å |
| 46 | I | 93.7 | Very high | 91.5 | Very high | 72 Ų | 72 | 81.9 Ų | 81.9 | 37% | 0.369 | 43% | 0.43 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -113.3 | 5.6 | 179.8 | 66.9 | 166.8 | 0 | 0 | 0 | 112.9 | F43 I44 D48 Q49 | F43-I46 CarbonylContact O-C 3.59Å; F43-I46 VanDerWaalsContact O-CG1 3.3Å; F43-I46 WeakPolarHBondContact O-CG1 3.48Å; F43-I46 PolarHBondContact O-N 3.37Å; F43-I46 VanDerWaalsContact O-N 3.1Å; I44-I46 PolarHBondContact O-N 3.47Å; I46-D48 VanDerWaalsContact C-N 3.26Å; I46-D48 PolarHBondContact O-N 2.91Å; I46-Q49 WeakPolarHBondContact O-CB 3.47Å; I46-Q49 PolarHBondContact O-N 2.87Å; I46-Q49 VanDerWaalsContact O-N 3.1Å |
| 47 | A | 91.9 | Very high | 91.6 | Very high | 22 Ų | 22 | 83.5 Ų | 83.5 | 18% | 0.182 | 44% | 0.438 | C | S | . | . | G | 310 helix | trans | -65.3 | -30.1 | -171 | 0 | 0 | 0 | 0 | 0 | 112.5 | F43 I44 Q49 Q50 P53 | F43-A47 HydrophobicContact CD1-CB 4.44Å; F43-A47 HydrophobicContact CE1-CB 3.96Å; F43-A47 HydrophobicContact CZ-CB 4.46Å; F43-A47 PolarHBondContact O-N 3Å; I44-A47 WeakPolarHBondContact O-CB 3.14Å; I44-A47 PolarHBondContact O-N 3.09Å; A47-Q49 PolarHBondContact O-N 3.21Å; A47-Q50 WeakPolarHBondContact O-CB 3.33Å; A47-Q50 PolarHBondContact O-N 3Å; A47-Q50 VanDerWaalsContact O-N 3.15Å; A47-P53 HydrophobicContact CB-CB 4.37Å |
| 48 | D | 92.3 | Very high | 91.6 | Very high | 136 Ų | 136 | 88.8 Ų | 88.8 | 73% | 0.727 | 46% | 0.46 | S | S | * | . | G | 310 helix | trans | -66.9 | -21.3 | 176.9 | 69.8 | -45.8 | 0 | 0 | 0 | 113.1 | I46 | I46-D48 VanDerWaalsContact C-N 3.26Å; I46-D48 PolarHBondContact O-N 2.91Å |
| 49 | Q | 94.6 | Very high | 91.5 | Very high | 143 Ų | 143 | 86 Ų | 86 | 67% | 0.668 | 46% | 0.457 | S | S | * | . | G | 310 helix | trans | -84.9 | -12.4 | 176.6 | -56.6 | 174.4 | 17.1 | 0 | 0 | 112.5 | I46 A47 | I46-Q49 WeakPolarHBondContact O-CB 3.47Å; I46-Q49 PolarHBondContact O-N 2.87Å; I46-Q49 VanDerWaalsContact O-N 3.1Å; A47-Q49 PolarHBondContact O-N 3.21Å |
| 50 | Q | 92.3 | Very high | 91.3 | Very high | 74 Ų | 74 | 85.8 Ų | 85.8 | 35% | 0.346 | 46% | 0.455 | S | S | . | . | trans | -82 | 133.7 | -179.7 | -59.5 | -59.6 | -46.9 | 0 | 0 | 110.8 | F43 A47 A52 P53 A56 | F43-Q50 HydrophobicContact CE2-CG 4.17Å; F43-Q50 HydrophobicContact CZ-CG 4.21Å; A47-Q50 WeakPolarHBondContact O-CB 3.33Å; A47-Q50 PolarHBondContact O-N 3Å; A47-Q50 VanDerWaalsContact O-N 3.15Å; Q50-A52 PolarHBondContact O-N 2.87Å; Q50-P53 HydrophobicContact CB-CB 4.26Å; Q50-A56 HydrophobicContact CG-CB 4.25Å | ||
| 51 | T | 94.1 | Very high | 91.1 | Very high | 152 Ų | 152 | 86.6 Ų | 86.6 | 93% | 0.933 | 46% | 0.462 | S | S | * | . | S | Bend | trans | -64.8 | -28.2 | 173.4 | -48.1 | 0 | 0 | 0 | 0 | 112.3 | ||
| 52 | A | 93.6 | Very high | 90.6 | Very high | 48 Ų | 48 | 83.2 Ų | 83.2 | 40% | 0.397 | 46% | 0.456 | S | S | . | . | S | Bend | trans | -141.4 | 78.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | Q50 F54 T55 A56 | Q50-A52 PolarHBondContact O-N 2.87Å; A52-F54 PolarHBondContact O-N 3.5Å; A52-T55 PolarHBondContact O-N 3.3Å; A52-T55 VanDerWaalsContact O-N 3.16Å; A52-A56 PolarHBondContact O-N 3.33Å |
| 53 | P | 91 | Very high | 90.1 | Very high | 45 Ų | 45 | 83.6 Ų | 83.6 | 29% | 0.292 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -61.4 | -39.1 | -168.9 | 21 | -32.3 | 0 | 0 | 0 | 113.4 | F43 A47 Q50 T55 A56 L57 | F43-P53 VanDerWaalsContact CZ-O 3.26Å; F43-P53 WeakPolarHBondContact CZ-O 3.43Å; A47-P53 HydrophobicContact CB-CB 4.37Å; Q50-P53 HydrophobicContact CB-CB 4.26Å; P53-T55 PolarHBondContact O-N 2.99Å; P53-A56 PolarHBondContact O-N 3.33Å; P53-L57 WeakPolarHBondContact O-CB 3.35Å; P53-L57 PolarHBondContact O-N 3.24Å |
| 54 | F | 88.6 | Confident | 89.3 | Confident | 176 Ų | 176 | 85.3 Ų | 85.3 | 77% | 0.772 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -65.2 | -40 | 177.2 | -70.5 | -77.4 | 0 | 0 | 0 | 112.9 | A52 A56 K58 | A52-F54 PolarHBondContact O-N 3.5Å; F54-A56 VanDerWaalsContact C-N 3.35Å; F54-K58 WeakPolarHBondContact O-CB 3.31Å; F54-K58 PolarHBondContact O-N 3.15Å |
| 55 | T | 90.1 | Very high | 88.2 | Confident | 102 Ų | 102 | 83.9 Ų | 83.9 | 63% | 0.626 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -65.2 | -41.9 | 176.4 | -56.8 | 0 | 0 | 0 | 0 | 110.8 | A52 P53 K58 A59 | A52-T55 PolarHBondContact O-N 3.3Å; A52-T55 VanDerWaalsContact O-N 3.16Å; P53-T55 PolarHBondContact O-N 2.99Å; T55-K58 PolarHBondContact O-N 3.08Å; T55-A59 PolarHBondContact O-N 3.44Å; T55-A59 VanDerWaalsContact O-N 3.15Å |
| 56 | A | 91.3 | Very high | 86.9 | Confident | 22 Ų | 22 | 82.6 Ų | 82.6 | 18% | 0.182 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -68.3 | -42.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | F43 Q50 A52 P53 F54 K58 A59 V60 | F43-A56 HydrophobicContact CE2-CB 3.58Å; F43-A56 HydrophobicContact CZ-CB 3.72Å; Q50-A56 HydrophobicContact CG-CB 4.25Å; A52-A56 PolarHBondContact O-N 3.33Å; P53-A56 PolarHBondContact O-N 3.33Å; F54-A56 VanDerWaalsContact C-N 3.35Å; A56-K58 VanDerWaalsContact C-N 3.33Å; A56-K58 PolarHBondContact O-N 3.33Å; A56-A59 WeakPolarHBondContact O-CB 3.45Å; A56-A59 PolarHBondContact O-N 3.4Å; A56-A59 VanDerWaalsContact O-N 3.16Å; A56-V60 PolarHBondContact O-N 2.98Å |
| 57 | L | 89.3 | Confident | 85.8 | Confident | 51 Ų | 51 | 84.3 Ų | 84.3 | 27% | 0.267 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -58.7 | -45.4 | 173.9 | -179.8 | 61.3 | 0 | 0 | 0 | 111.3 | I40 F43 P53 A59 V60 C61 | I40-L57 HydrophobicContact CG2-CD1 4.44Å; F43-L57 HydrophobicContact CD1-CB 4.05Å; F43-L57 HydrophobicContact CD1-CD1 3.6Å; F43-L57 HydrophobicContact CD1-CG 4.35Å; F43-L57 HydrophobicContact CE1-CB 3.52Å; F43-L57 HydrophobicContact CE1-CD1 3.99Å; F43-L57 HydrophobicContact CE1-CG 4.25Å; F43-L57 HydrophobicContact CG-CD1 4.23Å; F43-L57 HydrophobicContact CZ-CB 3.9Å; F43-L57 VanDerWaalsContact CZ-N 3.3Å; P53-L57 WeakPolarHBondContact O-CB 3.35Å; P53-L57 PolarHBondContact O-N 3.24Å; L57-A59 VanDerWaalsContact C-N 3.27Å; L57-A59 PolarHBondContact O-N 2.98Å; L57-V60 PolarHBondContact O-N 3.33Å; L57-C61 PolarHBondContact O-N 3.28Å; L57-C61 PolarHBondContact O-SG 2.88Å; L57-C61 VanDerWaalsContact O-SG 3.37Å |
| 58 | K | 87 | Confident | 84.7 | Confident | 142 Ų | 142 | 85.9 Ų | 85.9 | 62% | 0.617 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -57.4 | -42 | 177 | -177.5 | -179.2 | 177.7 | 179.3 | 0 | 111.4 | F54 T55 A56 C61 L62 | F54-K58 WeakPolarHBondContact O-CB 3.31Å; F54-K58 PolarHBondContact O-N 3.15Å; T55-K58 PolarHBondContact O-N 3.08Å; A56-K58 VanDerWaalsContact C-N 3.33Å; A56-K58 PolarHBondContact O-N 3.33Å; K58-C61 PolarHBondContact O-N 2.91Å; K58-L62 HydrophobicContact CG-CD1 4.07Å; K58-L62 WeakPolarHBondContact O-CB 3.49Å; K58-L62 VanDerWaalsContact O-CG 3.3Å; K58-L62 WeakPolarHBondContact O-CG 3.43Å; K58-L62 PolarHBondContact O-N 2.95Å |
| 59 | A | 88.3 | Confident | 83.6 | Confident | 57 Ų | 57 | 85.9 Ų | 85.9 | 47% | 0.471 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -63.8 | -44.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | T55 A56 L57 L62 D63 | T55-A59 PolarHBondContact O-N 3.44Å; T55-A59 VanDerWaalsContact O-N 3.15Å; A56-A59 WeakPolarHBondContact O-CB 3.45Å; A56-A59 PolarHBondContact O-N 3.4Å; A56-A59 VanDerWaalsContact O-N 3.16Å; L57-A59 VanDerWaalsContact C-N 3.27Å; L57-A59 PolarHBondContact O-N 2.98Å; A59-L62 PolarHBondContact O-N 3.49Å; A59-D63 WeakPolarHBondContact O-CB 3.3Å; A59-D63 PolarHBondContact O-N 2.91Å |
| 60 | V | 87.1 | Confident | 82.2 | Confident | 35 Ų | 35 | 82 Ų | 82 | 21% | 0.212 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -59.1 | -47.5 | 175.4 | 171.9 | 0 | 0 | 0 | 0 | 111.4 | T39 F43 A56 L57 L62 D63 K64 | T39-V60 HydrophobicContact CG2-CG1 3.58Å; F43-V60 HydrophobicContact CD2-CG2 3.88Å; F43-V60 HydrophobicContact CE2-CG2 4.46Å; F43-V60 HydrophobicContact CG-CG2 4.49Å; A56-V60 PolarHBondContact O-N 2.98Å; L57-V60 PolarHBondContact O-N 3.33Å; V60-L62 PolarHBondContact O-N 2.81Å; V60-D63 PolarHBondContact O-N 2.92Å; V60-K64 WeakPolarHBondContact O-CG 3.29Å; V60-K64 PolarHBondContact O-N 3.05Å; V60-K64 VanDerWaalsContact O-N 3.11Å |
| 61 | C | 83 | Confident | 81 | Confident | 37 Ų | 37 | 79.7 Ų | 79.7 | 25% | 0.25 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -61 | -45.6 | 177.5 | -66.6 | 0 | 0 | 0 | 0 | 111.3 | L57 K58 D63 K64 L65 | L57-C61 PolarHBondContact O-N 3.28Å; L57-C61 PolarHBondContact O-SG 2.88Å; L57-C61 VanDerWaalsContact O-SG 3.37Å; K58-C61 PolarHBondContact O-N 2.91Å; C61-D63 PolarHBondContact O-N 3.15Å; C61-K64 PolarHBondContact O-N 3.15Å; C61-L65 WeakPolarHBondContact O-CB 3.4Å; C61-L65 WeakPolarHBondContact O-CG 3.47Å; C61-L65 PolarHBondContact O-N 3.1Å |
| 62 | L | 81.2 | Confident | 79.6 | Confident | 88 Ų | 88 | 74.9 Ų | 74.9 | 46% | 0.461 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -62.4 | -40.8 | 179 | -74.8 | 170.9 | 0 | 0 | 0 | 112.7 | K58 A59 V60 K64 L65 I66 | K58-L62 HydrophobicContact CG-CD1 4.07Å; K58-L62 WeakPolarHBondContact O-CB 3.49Å; K58-L62 VanDerWaalsContact O-CG 3.3Å; K58-L62 WeakPolarHBondContact O-CG 3.43Å; K58-L62 PolarHBondContact O-N 2.95Å; A59-L62 PolarHBondContact O-N 3.49Å; V60-L62 PolarHBondContact O-N 2.81Å; L62-K64 VanDerWaalsContact C-N 3.34Å; L62-K64 PolarHBondContact O-N 2.89Å; L62-L65 HydrophobicContact CD2-CD1 4.39Å; L62-L65 PolarHBondContact O-N 2.87Å; L62-I66 VanDerWaalsContact O-CG1 3.29Å; L62-I66 WeakPolarHBondContact O-CG1 3.47Å; L62-I66 PolarHBondContact O-N 2.99Å |
| 63 | D | 82.7 | Confident | 78.5 | Confident | 96 Ų | 96 | 75.2 Ų | 75.2 | 51% | 0.513 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -58.8 | -47 | 176.1 | -165.2 | 66.2 | 0 | 0 | 0 | 110.8 | A59 V60 C61 I66 D67 | A59-D63 WeakPolarHBondContact O-CB 3.3Å; A59-D63 PolarHBondContact O-N 2.91Å; V60-D63 PolarHBondContact O-N 2.92Å; C61-D63 PolarHBondContact O-N 3.15Å; D63-I66 PolarHBondContact O-N 3.25Å; D63-D67 PolarHBondContact O-N 3.09Å; D63-D67 VanDerWaalsContact O-N 3.14Å |
| 64 | K | 76.8 | Confident | 77.4 | Confident | 55 Ų | 55 | 80.5 Ų | 80.5 | 24% | 0.239 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -69.1 | -35.4 | 177 | -64.7 | -55.7 | -177.5 | -174.4 | 0 | 114.4 | T36 T39 V60 C61 L62 I66 D67 D68 | T36-K64 HydrophobicContact CG2-CB 3.94Å; T36-K64 HydrophobicContact CG2-CG 4.27Å; T39-K64 HydrophobicContact CG2-CG 4.47Å; T39-K64 VanDerWaalsContact OG1-CE 3.25Å; T39-K64 WeakPolarHBondContact OG1-CE 3.22Å; V60-K64 WeakPolarHBondContact O-CG 3.29Å; V60-K64 PolarHBondContact O-N 3.05Å; V60-K64 VanDerWaalsContact O-N 3.11Å; C61-K64 PolarHBondContact O-N 3.15Å; L62-K64 VanDerWaalsContact C-N 3.34Å; L62-K64 PolarHBondContact O-N 2.89Å; K64-I66 PolarHBondContact O-N 3.36Å; K64-D67 PolarHBondContact O-N 2.77Å; K64-D68 PolarHBondContact O-N 3.41Å |
| 65 | L | 69.7 | Low | 76.2 | Confident | 77 Ų | 77 | 77 Ų | 77 | 40% | 0.403 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -64.7 | -32 | 174 | -68.2 | 167.1 | 0 | 0 | 0 | 111.4 | C61 L62 L71 | C61-L65 WeakPolarHBondContact O-CB 3.4Å; C61-L65 WeakPolarHBondContact O-CG 3.47Å; C61-L65 PolarHBondContact O-N 3.1Å; L62-L65 HydrophobicContact CD2-CD1 4.39Å; L62-L65 PolarHBondContact O-N 2.87Å; L65-L71 HydrophobicContact CB-CD2 3.75Å; L65-L71 HydrophobicContact CD2-CD2 3.16Å; L65-L71 HydrophobicContact CG-CD2 3.97Å |
| 66 | I | 67.2 | Low | 74.9 | Confident | 105 Ų | 105 | 72.9 Ų | 72.9 | 54% | 0.538 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -71.8 | -36.1 | 174.6 | -68.5 | 165.8 | 0 | 0 | 0 | 110.4 | L62 D63 K64 Q72 | L62-I66 VanDerWaalsContact O-CG1 3.29Å; L62-I66 WeakPolarHBondContact O-CG1 3.47Å; L62-I66 PolarHBondContact O-N 2.99Å; D63-I66 PolarHBondContact O-N 3.25Å; K64-I66 PolarHBondContact O-N 3.36Å; I66-Q72 PolarHBondContact O-NE2 3.47Å |
| 67 | D | 68.7 | Low | 73.7 | Confident | 108 Ų | 108 | 78.1 Ų | 78.1 | 58% | 0.578 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -74.2 | -24.5 | 177.1 | -74.5 | -18.9 | 0 | 0 | 0 | 113.5 | D63 K64 R69 | D63-D67 PolarHBondContact O-N 3.09Å; D63-D67 VanDerWaalsContact O-N 3.14Å; K64-D67 PolarHBondContact O-N 2.77Å; D67-R69 PolarHBondContact O-N 3.24Å |
| 68 | D | 70.2 | Confident | 72.5 | Confident | 54 Ų | 54 | 80.1 Ų | 80.1 | 29% | 0.289 | 42% | 0.417 | S | S | . | . | trans | -72.7 | 93.9 | 178.1 | -172.4 | -19.9 | 0 | 0 | 0 | 111.6 | K64 A70 L71 Q72 | K64-D68 PolarHBondContact O-N 3.41Å; D68-A70 PolarHBondContact O-N 2.84Å; D68-A70 WeakPolarHBondContact OD1-CA 3.47Å; D68-A70 WeakPolarHBondContact OD1-CB 3.49Å; D68-A70 PolarHBondContact OD1-N 2.89Å; D68-L71 HydrophobicContact CB-CB 3.96Å; D68-L71 WeakPolarHBondContact O-CB 3.39Å; D68-L71 PolarHBondContact O-N 3.47Å; D68-L71 VanDerWaalsContact O-N 3.09Å; D68-L71 PolarHBondContact OD1-N 3.18Å; D68-Q72 PolarHBondContact O-N 3.42Å | ||
| 69 | R | 67.8 | Low | 70.9 | Confident | 137 Ų | 137 | 79.7 Ų | 79.7 | 52% | 0.517 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -55.5 | -33.5 | 176.3 | -172.3 | 172.1 | -175.7 | -104.8 | 5.3 | 113.1 | D67 Q72 I73 | D67-R69 PolarHBondContact O-N 3.24Å; R69-Q72 PolarHBondContact O-N 3.31Å; R69-I73 HydrophobicContact CG-CD1 4.06Å; R69-I73 WeakPolarHBondContact O-CB 3.5Å; R69-I73 WeakPolarHBondContact O-CD1 3.39Å; R69-I73 WeakPolarHBondContact O-CG1 3.45Å; R69-I73 PolarHBondContact O-N 3.07Å |
| 70 | A | 66.5 | Low | 69.2 | Low | 61 Ų | 61 | 85.5 Ų | 85.5 | 50% | 0.504 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -71.3 | -37.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111 | D68 I73 R74 | D68-A70 PolarHBondContact O-N 2.84Å; D68-A70 WeakPolarHBondContact OD1-CA 3.47Å; D68-A70 WeakPolarHBondContact OD1-CB 3.49Å; D68-A70 PolarHBondContact OD1-N 2.89Å; A70-I73 PolarHBondContact O-N 3.39Å; A70-R74 WeakPolarHBondContact O-CB 3.46Å; A70-R74 PolarHBondContact O-N 3.31Å |
| 71 | L | 66.5 | Low | 67.5 | Low | 26 Ų | 26 | 92.5 Ų | 92.5 | 14% | 0.136 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -68.1 | -43.1 | 171.7 | -174.6 | 69.7 | 0 | 0 | 0 | 111.9 | L65 D68 I73 R74 L75 | L65-L71 HydrophobicContact CB-CD2 3.75Å; L65-L71 HydrophobicContact CD2-CD2 3.16Å; L65-L71 HydrophobicContact CG-CD2 3.97Å; D68-L71 HydrophobicContact CB-CB 3.96Å; D68-L71 WeakPolarHBondContact O-CB 3.39Å; D68-L71 PolarHBondContact O-N 3.47Å; D68-L71 VanDerWaalsContact O-N 3.09Å; D68-L71 PolarHBondContact OD1-N 3.18Å; L71-I73 VanDerWaalsContact C-N 3.28Å; L71-I73 PolarHBondContact O-N 3.47Å; L71-R74 WeakPolarHBondContact O-CB 3.31Å; L71-R74 PolarHBondContact O-N 2.87Å; L71-R74 VanDerWaalsContact O-N 3.15Å; L71-L75 HydrophobicContact CD1-CG 4.42Å; L71-L75 HydrophobicContact CD2-CD1 4.46Å; L71-L75 HydrophobicContact CG-CD1 4.06Å; L71-L75 HydrophobicContact CG-CG 4.29Å; L71-L75 WeakPolarHBondContact O-CB 3.4Å; L71-L75 WeakPolarHBondContact O-CG 3.4Å; L71-L75 PolarHBondContact O-N 2.91Å |
| 72 | Q | 65.7 | Low | 66 | Low | 51 Ų | 51 | 93 Ų | 93 | 24% | 0.238 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -56.7 | -43.7 | 174.1 | -70.1 | -171 | -16.7 | 0 | 0 | 111.5 | I66 D68 R69 L75 A76 F90 | I66-Q72 PolarHBondContact O-NE2 3.47Å; D68-Q72 PolarHBondContact O-N 3.42Å; R69-Q72 PolarHBondContact O-N 3.31Å; Q72-L75 PolarHBondContact O-N 2.85Å; Q72-A76 WeakPolarHBondContact O-CB 3.21Å; Q72-A76 PolarHBondContact O-N 3.42Å; Q72-F90 HydrophobicContact CB-CD1 4.08Å; Q72-F90 HydrophobicContact CG-CD1 4.38Å |
| 73 | I | 69.5 | Low | 64.9 | Low | 55 Ų | 55 | 93.5 Ų | 93.5 | 28% | 0.282 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64 | -44.8 | 175.8 | -70.3 | 164.9 | 0 | 0 | 0 | 110.7 | R69 A70 L71 A76 I77 | R69-I73 HydrophobicContact CG-CD1 4.06Å; R69-I73 WeakPolarHBondContact O-CB 3.5Å; R69-I73 WeakPolarHBondContact O-CD1 3.39Å; R69-I73 WeakPolarHBondContact O-CG1 3.45Å; R69-I73 PolarHBondContact O-N 3.07Å; A70-I73 PolarHBondContact O-N 3.39Å; L71-I73 VanDerWaalsContact C-N 3.28Å; L71-I73 PolarHBondContact O-N 3.47Å; I73-A76 PolarHBondContact O-N 3.43Å; I73-I77 HydrophobicContact CG2-CD1 3.57Å; I73-I77 HydrophobicContact CG2-CG1 4.38Å; I73-I77 WeakPolarHBondContact O-CB 3.39Å; I73-I77 WeakPolarHBondContact O-CG1 3.28Å; I73-I77 PolarHBondContact O-N 3.37Å |
| 74 | R | 68.4 | Low | 63.8 | Low | 156 Ų | 156 | 92.8 Ų | 92.8 | 59% | 0.589 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -58.2 | -52.6 | 175.7 | -87.6 | 172.1 | 53.1 | -154.6 | -5.6 | 111.3 | A70 L71 A76 I77 T78 | A70-R74 WeakPolarHBondContact O-CB 3.46Å; A70-R74 PolarHBondContact O-N 3.31Å; L71-R74 WeakPolarHBondContact O-CB 3.31Å; L71-R74 PolarHBondContact O-N 2.87Å; L71-R74 VanDerWaalsContact O-N 3.15Å; R74-A76 VanDerWaalsContact C-N 3.26Å; R74-A76 PolarHBondContact O-N 3.02Å; R74-I77 CarbonylContact O-C 3.54Å; R74-I77 PolarHBondContact O-N 2.54Å; R74-T78 WeakPolarHBondContact O-CB 3.47Å; R74-T78 WeakPolarHBondContact O-CG2 3.49Å; R74-T78 PolarHBondContact O-N 3.27Å; R74-T78 PolarHBondContact O-OG1 3.14Å |
| 75 | L | 63.4 | Low | 62.9 | Low | 101 Ų | 101 | 98 Ų | 98 | 53% | 0.529 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -58.4 | -39 | 177.4 | -70.5 | 172.9 | 0 | 0 | 0 | 111.8 | L71 Q72 I77 T78 | L71-L75 HydrophobicContact CD1-CG 4.42Å; L71-L75 HydrophobicContact CD2-CD1 4.46Å; L71-L75 HydrophobicContact CG-CD1 4.06Å; L71-L75 HydrophobicContact CG-CG 4.29Å; L71-L75 WeakPolarHBondContact O-CB 3.4Å; L71-L75 WeakPolarHBondContact O-CG 3.4Å; L71-L75 PolarHBondContact O-N 2.91Å; Q72-L75 PolarHBondContact O-N 2.85Å; L75-I77 VanDerWaalsContact C-N 3.28Å; L75-I77 PolarHBondContact O-N 2.8Å; L75-T78 PolarHBondContact O-N 2.87Å |
| 76 | A | 63.3 | Low | 62.6 | Low | 17 Ų | 17 | 96.8 Ų | 96.8 | 14% | 0.14 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -68.3 | -24.4 | 176 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q72 I73 R74 L82 P87 F90 | Q72-A76 WeakPolarHBondContact O-CB 3.21Å; Q72-A76 PolarHBondContact O-N 3.42Å; I73-A76 PolarHBondContact O-N 3.43Å; R74-A76 VanDerWaalsContact C-N 3.26Å; R74-A76 PolarHBondContact O-N 3.02Å; A76-L82 HydrophobicContact CB-CD1 4.34Å; A76-P87 HydrophobicContact CB-CB 4.19Å; A76-F90 HydrophobicContact CB-CD2 3.87Å; A76-F90 HydrophobicContact CB-CE2 4.34Å |
| 77 | I | 66.2 | Low | 62.2 | Low | 131 Ų | 131 | 95.1 Ų | 95.1 | 67% | 0.672 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -90.5 | -30.5 | 177.7 | -68.2 | 168.8 | 0 | 0 | 0 | 111.7 | I73 R74 L75 | I73-I77 HydrophobicContact CG2-CD1 3.57Å; I73-I77 HydrophobicContact CG2-CG1 4.38Å; I73-I77 WeakPolarHBondContact O-CB 3.39Å; I73-I77 WeakPolarHBondContact O-CG1 3.28Å; I73-I77 PolarHBondContact O-N 3.37Å; R74-I77 CarbonylContact O-C 3.54Å; R74-I77 PolarHBondContact O-N 2.54Å; L75-I77 VanDerWaalsContact C-N 3.28Å; L75-I77 PolarHBondContact O-N 2.8Å |
| 78 | T | 64.5 | Low | 62.2 | Low | 93 Ų | 93 | 96.7 Ų | 96.7 | 57% | 0.571 | 51% | 0.514 | S | S | * | . | S | Bend | trans | -103.8 | 29.3 | -166.9 | 61.8 | 0 | 0 | 0 | 0 | 116.4 | R74 L75 | R74-T78 WeakPolarHBondContact O-CB 3.47Å; R74-T78 WeakPolarHBondContact O-CG2 3.49Å; R74-T78 PolarHBondContact O-N 3.27Å; R74-T78 PolarHBondContact O-OG1 3.14Å; L75-T78 PolarHBondContact O-N 2.87Å |
| 79 | D | 52.5 | Low | 61.9 | Low | 134 Ų | 134 | 96.4 Ų | 96.4 | 72% | 0.717 | 51% | 0.514 | S | S | * | . | trans | 95.2 | 143.5 | 159 | -145.1 | 9.2 | 0 | 0 | 0 | 119.7 | E81 | D79-E81 PolarHBondContact O-N 3.28Š| ||
| 80 | E | 53.2 | Low | 61.5 | Low | 179 Ų | 179 | 91.9 Ų | 91.9 | 84% | 0.836 | 50% | 0.498 | S | S | * | . | S | Bend | trans | 76.8 | -33.7 | 152.1 | -120.2 | 165.1 | -171.3 | 0 | 0 | 124.9 | ||
| 81 | E | 50.2 | Low | 61.5 | Low | 181 Ų | 181 | 94.7 Ų | 94.7 | 85% | 0.846 | 50% | 0.504 | S | S | * | . | trans | -137.5 | 51.1 | -169.4 | -142 | -178.5 | -170.5 | 0 | 0 | 115.9 | D79 A83 | D79-E81 PolarHBondContact O-N 3.28Å; E81-A83 PolarHBondContact O-N 3.31Å | ||
| 82 | L | 52.8 | Low | 61.2 | Low | 47 Ų | 47 | 107 Ų | 107 | 25% | 0.246 | 55% | 0.549 | C | S | . | . | S | Bend | trans | -67.5 | 23.7 | 164 | -72.7 | 178.3 | 0 | 0 | 0 | 113.1 | A76 G84 R85 P87 F90 | A76-L82 HydrophobicContact CB-CD1 4.34Å; L82-G84 PolarHBondContact O-N 3.21Å; L82-R85 HydrophobicContact CB-CB 4.11Å; L82-R85 WeakPolarHBondContact CB-O 3.3Å; L82-R85 WeakPolarHBondContact CD1-O 3.45Å; L82-R85 WeakPolarHBondContact O-CA 3.47Å; L82-R85 VanDerWaalsContact O-CB 3.26Å; L82-R85 WeakPolarHBondContact O-CB 3.48Å; L82-R85 PolarHBondContact O-N 2.71Å; L82-P87 HydrophobicContact CD1-CG 4.22Å; L82-F90 HydrophobicContact CD1-CE2 3.83Å; L82-F90 HydrophobicContact CD2-CD2 4.47Å; L82-F90 HydrophobicContact CD2-CE2 3.35Å; L82-F90 HydrophobicContact CD2-CZ 3.61Å; L82-F90 HydrophobicContact CG-CE2 4.2Å |
| 83 | A | 56.7 | Low | 60.9 | Low | 99 Ų | 99 | 109.8 Ų | 109.8 | 82% | 0.818 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 47 | 32.4 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113 | E81 | E81-A83 PolarHBondContact O-N 3.31Š|
| 84 | G | 59.7 | Low | 60.5 | Low | 81 Ų | 81 | 112.6 Ų | 112.6 | 84% | 0.835 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 82.5 | 6.4 | -174 | 0 | 0 | 0 | 0 | 0 | 116 | L82 | L82-G84 PolarHBondContact O-N 3.21Š|
| 85 | R | 59.2 | Low | 60.1 | Low | 164 Ų | 164 | 110.2 Ų | 110.2 | 62% | 0.619 | 58% | 0.579 | S | S | * | * | trans | -80.4 | 135.2 | 171.9 | -85.7 | -169.4 | -176.6 | -154.2 | 2.9 | 111.2 | L82 V89 | L82-R85 HydrophobicContact CB-CB 4.11Å; L82-R85 WeakPolarHBondContact CB-O 3.3Å; L82-R85 WeakPolarHBondContact CD1-O 3.45Å; L82-R85 WeakPolarHBondContact O-CA 3.47Å; L82-R85 VanDerWaalsContact O-CB 3.26Å; L82-R85 WeakPolarHBondContact O-CB 3.48Å; L82-R85 PolarHBondContact O-N 2.71Å; R85-V89 HydrophobicContact CB-CG2 4.13Å | ||
| 86 | P | 62.6 | Low | 59.9 | Low | 52 Ų | 52 | 110.8 Ų | 110.8 | 34% | 0.338 | 58% | 0.581 | S | S | . | * | trans | -78.9 | 149.1 | 177.1 | 29.3 | -33.9 | 0 | 0 | 0 | 112 | F88 V89 | P86-F88 HydrophobicContact CB-CD1 3.53Å; P86-F88 HydrophobicContact CB-CE1 3.32Å; P86-F88 HydrophobicContact CB-CG 4.49Å; P86-F88 HydrophobicContact CB-CZ 4.1Å; P86-F88 HydrophobicContact CG-CD1 3.6Å; P86-F88 HydrophobicContact CG-CE1 2.98Å; P86-F88 HydrophobicContact CG-CE2 4.05Å; P86-F88 HydrophobicContact CG-CG 4.37Å; P86-F88 HydrophobicContact CG-CZ 3.23Å; P86-F88 PolarHBondContact O-N 3.02Å; P86-V89 HydrophobicContact CG-CG1 4.19Å; P86-V89 WeakPolarHBondContact O-CG2 2.94Å; P86-V89 PolarHBondContact O-N 3.04Å; P86-V89 VanDerWaalsContact O-N 3.13Å | ||
| 87 | P | 57.8 | Low | 59.7 | Low | 70 Ų | 70 | 116.6 Ų | 116.6 | 46% | 0.455 | 61% | 0.609 | S | S | . | * | G | 310 helix | trans | -53.1 | -29.6 | -175.5 | -29.5 | 34.8 | 0 | 0 | 0 | 115.5 | A76 L82 V89 F90 | A76-P87 HydrophobicContact CB-CB 4.19Å; L82-P87 HydrophobicContact CD1-CG 4.22Å; P87-V89 PolarHBondContact O-N 3.35Å; P87-V89 VanDerWaalsContact O-N 3.13Å; P87-F90 WeakPolarHBondContact O-CD2 3.42Å; P87-F90 PolarHBondContact O-N 3.34Å |
| 88 | F | 68.8 | Low | 59.2 | Low | 142 Ų | 142 | 115.7 Ų | 115.7 | 62% | 0.623 | 61% | 0.605 | S | S | * | * | G | 310 helix | trans | -63.3 | -19.2 | -178.3 | 69.5 | -105.8 | 0 | 0 | 0 | 114.1 | P86 F90 L91 | P86-F88 HydrophobicContact CB-CD1 3.53Å; P86-F88 HydrophobicContact CB-CE1 3.32Å; P86-F88 HydrophobicContact CB-CG 4.49Å; P86-F88 HydrophobicContact CB-CZ 4.1Å; P86-F88 HydrophobicContact CG-CD1 3.6Å; P86-F88 HydrophobicContact CG-CE1 2.98Å; P86-F88 HydrophobicContact CG-CE2 4.05Å; P86-F88 HydrophobicContact CG-CG 4.37Å; P86-F88 HydrophobicContact CG-CZ 3.23Å; P86-F88 PolarHBondContact O-N 3.02Å; F88-F90 PolarHBondContact O-N 3.31Å; F88-L91 PolarHBondContact O-N 3.21Å; F88-L91 VanDerWaalsContact O-N 3.08Å |
| 89 | V | 64.8 | Low | 58.8 | Low | 48 Ų | 48 | 117.3 Ų | 117.3 | 29% | 0.291 | 61% | 0.607 | S | S | . | * | G | 310 helix | trans | -65.1 | -19.7 | 178.3 | -64.4 | 0 | 0 | 0 | 0 | 113.1 | R85 P86 P87 | R85-V89 HydrophobicContact CB-CG2 4.13Å; P86-V89 HydrophobicContact CG-CG1 4.19Å; P86-V89 WeakPolarHBondContact O-CG2 2.94Å; P86-V89 PolarHBondContact O-N 3.04Å; P86-V89 VanDerWaalsContact O-N 3.13Å; P87-V89 PolarHBondContact O-N 3.35Å; P87-V89 VanDerWaalsContact O-N 3.13Å |
| 90 | F | 60.2 | Low | 59.3 | Low | 42 Ų | 42 | 116 Ų | 116 | 18% | 0.184 | 60% | 0.599 | C | S | . | * | G | 310 helix | trans | -93.1 | -1 | 176.4 | -55 | -76.1 | 0 | 0 | 0 | 113.1 | Q72 A76 L82 P87 F88 R92 | Q72-F90 HydrophobicContact CB-CD1 4.08Å; Q72-F90 HydrophobicContact CG-CD1 4.38Å; A76-F90 HydrophobicContact CB-CD2 3.87Å; A76-F90 HydrophobicContact CB-CE2 4.34Å; L82-F90 HydrophobicContact CD1-CE2 3.83Å; L82-F90 HydrophobicContact CD2-CD2 4.47Å; L82-F90 HydrophobicContact CD2-CE2 3.35Å; L82-F90 HydrophobicContact CD2-CZ 3.61Å; L82-F90 HydrophobicContact CG-CE2 4.2Å; P87-F90 WeakPolarHBondContact O-CD2 3.42Å; P87-F90 PolarHBondContact O-N 3.34Å; F88-F90 PolarHBondContact O-N 3.31Å; F90-R92 VanDerWaalsContact C-N 3.35Å |
| 91 | L | 65.8 | Low | 59.8 | Low | 119 Ų | 119 | 110.8 Ų | 110.8 | 62% | 0.623 | 58% | 0.579 | S | S | * | * | trans | -94.9 | 21.5 | -178.4 | -60.5 | 179.9 | 0 | 0 | 0 | 113.5 | F88 | F88-L91 PolarHBondContact O-N 3.21Å; F88-L91 VanDerWaalsContact O-N 3.08Å | ||
| 92 | R | 59.4 | Low | 60.7 | Low | 284 Ų | 284 | 104.4 Ų | 104.4 | 100% | 1.072 | 56% | 0.555 | S | S | * | * | trans | -93.3 | 0 | 172.7 | -86.9 | -173.6 | 173.7 | 161.9 | -0.6 | 112.7 | F90 | F90-R92 VanDerWaalsContact C-N 3.35Š|
Retrieved 92 of 92 residues in 19.4 ms
(Link to these results)