| 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 | 43.8 | Very low | 56.1 | Low | 244 Ų | 244 | 148.5 Ų | 148.5 | 100% | 1.202 | 75% | 0.75 | S | S | * | * | 0 | 101.9 | 0 | -156.5 | 173.5 | -169.3 | 0 | 0 | 107.1 | |||||
| 2 | A | 47.7 | Very low | 56.2 | Low | 104 Ų | 104 | 140 Ų | 140 | 86% | 0.86 | 73% | 0.727 | S | S | * | * | trans | -88.8 | 117 | -171.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | R4 | A2-R4 PolarHBondContact O-N 3.13Š| ||
| 3 | I | 56.4 | Low | 56.1 | Low | 149 Ų | 149 | 140.6 Ų | 140.6 | 76% | 0.764 | 73% | 0.727 | S | S | * | * | trans | -76.8 | 105.4 | 176.7 | -60.1 | 169.1 | 0 | 0 | 0 | 107.6 | Q5 | I3-Q5 HydrophobicContact CG2-CG 4.16Å; I3-Q5 PolarHBondContact O-N 3.21Å; I3-Q5 VanDerWaalsContact O-N 3.07Å | ||
| 4 | R | 55 | Low | 56.3 | Low | 223 Ų | 223 | 136.4 Ų | 136.4 | 84% | 0.842 | 72% | 0.724 | S | S | * | * | trans | -71.3 | 96.2 | 168.6 | -84.7 | -179.2 | 145.2 | -171.9 | -6.2 | 108.7 | A2 Y6 | A2-R4 PolarHBondContact O-N 3.13Å; R4-Y6 PolarHBondContact O-N 3.4Å | ||
| 5 | Q | 63.7 | Low | 56.3 | Low | 170 Ų | 170 | 137.2 Ų | 137.2 | 79% | 0.794 | 73% | 0.727 | S | S | * | * | trans | -73.6 | 101 | 166.6 | -67.1 | -178.5 | -7.6 | 0 | 0 | 108 | I3 F7 | I3-Q5 HydrophobicContact CG2-CG 4.16Å; I3-Q5 PolarHBondContact O-N 3.21Å; I3-Q5 VanDerWaalsContact O-N 3.07Å; Q5-F7 PolarHBondContact O-N 3.09Å | ||
| 6 | Y | 61.8 | Low | 55.8 | Low | 215 Ų | 215 | 132.4 Ų | 132.4 | 84% | 0.843 | 72% | 0.721 | S | S | * | * | trans | -67.6 | 113.5 | 170 | -118.5 | -97.2 | 0 | 0 | 0 | 107.9 | R4 D8 | R4-Y6 PolarHBondContact O-N 3.4Å; Y6-D8 PolarHBondContact O-N 3.31Å; Y6-D8 VanDerWaalsContact O-N 3.17Å | ||
| 7 | F | 59.2 | Low | 55.6 | Low | 179 Ų | 179 | 137.4 Ų | 137.4 | 79% | 0.785 | 73% | 0.734 | S | S | * | * | trans | -75.4 | 100.7 | 174.4 | -141 | -93.7 | 0 | 0 | 0 | 107.5 | Q5 S9 | Q5-F7 PolarHBondContact O-N 3.09Å; F7-S9 PolarHBondContact O-N 3.05Å | ||
| 8 | D | 57.8 | Low | 55.4 | Low | 92 Ų | 92 | 141.9 Ų | 141.9 | 49% | 0.492 | 74% | 0.739 | S | S | . | * | trans | -67.9 | 106.9 | 172.9 | -172.1 | -5.8 | 0 | 0 | 0 | 108.1 | Y6 L10 A11 | Y6-D8 PolarHBondContact O-N 3.31Å; Y6-D8 VanDerWaalsContact O-N 3.17Å; D8-L10 PolarHBondContact O-N 3.34Å; D8-L10 VanDerWaalsContact O-N 3.11Å; D8-L10 VanDerWaalsContact OD1-CB 3.28Å; D8-L10 WeakPolarHBondContact OD1-CB 3.07Å; D8-L10 PolarHBondContact OD1-N 3.4Å; D8-A11 HydrophobicContact CB-CB 4.06Å; D8-A11 VanDerWaalsContact O-CB 3.28Å; D8-A11 WeakPolarHBondContact O-CB 3.47Å; D8-A11 PolarHBondContact O-N 3.27Å | ||
| 9 | S | 56.9 | Low | 55.3 | Low | 84 Ų | 84 | 139 Ų | 139 | 59% | 0.587 | 74% | 0.738 | S | S | * | * | H | α-helix | trans | -60.7 | -21 | 179.5 | -65.9 | 0 | 0 | 0 | 0 | 111.7 | F7 G12 M13 | F7-S9 PolarHBondContact O-N 3.05Å; S9-G12 PolarHBondContact O-N 2.81Å; S9-M13 WeakPolarHBondContact O-CG 3.32Å; S9-M13 PolarHBondContact O-N 3.44Å |
| 10 | L | 59 | Low | 55.1 | Low | 117 Ų | 117 | 141.6 Ų | 141.6 | 61% | 0.613 | 75% | 0.746 | S | S | * | * | H | α-helix | trans | -74 | -30.9 | 172.8 | -59.5 | 175.5 | 0 | 0 | 0 | 112.4 | D8 G12 M13 A14 | D8-L10 PolarHBondContact O-N 3.34Å; D8-L10 VanDerWaalsContact O-N 3.11Å; D8-L10 VanDerWaalsContact OD1-CB 3.28Å; D8-L10 WeakPolarHBondContact OD1-CB 3.07Å; D8-L10 PolarHBondContact OD1-N 3.4Å; L10-G12 VanDerWaalsContact C-N 3.27Å; L10-G12 PolarHBondContact O-N 2.96Å; L10-M13 HydrophobicContact CD2-SD 4.17Å; L10-M13 PolarHBondContact O-N 3.42Å; L10-M13 VanDerWaalsContact O-N 3.13Å; L10-A14 PolarHBondContact O-N 3.16Å |
| 11 | A | 56.2 | Low | 54.8 | Low | 57 Ų | 57 | 140 Ų | 140 | 47% | 0.471 | 74% | 0.738 | S | S | . | * | H | α-helix | trans | -65.1 | -32.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | D8 | D8-A11 HydrophobicContact CB-CB 4.06Å; D8-A11 VanDerWaalsContact O-CB 3.28Å; D8-A11 WeakPolarHBondContact O-CB 3.47Å; D8-A11 PolarHBondContact O-N 3.27Å |
| 12 | G | 56.8 | Low | 55.1 | Low | 46 Ų | 46 | 139.6 Ų | 139.6 | 47% | 0.474 | 72% | 0.723 | S | S | . | * | H | α-helix | trans | -76.1 | -24.7 | 171.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | S9 L10 | S9-G12 PolarHBondContact O-N 2.81Å; L10-G12 VanDerWaalsContact C-N 3.27Å; L10-G12 PolarHBondContact O-N 2.96Å |
| 13 | M | 55.4 | Low | 55.3 | Low | 148 Ų | 148 | 143.9 Ų | 143.9 | 73% | 0.729 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -77.5 | -24.8 | 175.9 | -70 | -177.6 | -166.5 | 0 | 0 | 112.8 | S9 L10 L15 | S9-M13 WeakPolarHBondContact O-CG 3.32Å; S9-M13 PolarHBondContact O-N 3.44Å; L10-M13 HydrophobicContact CD2-SD 4.17Å; L10-M13 PolarHBondContact O-N 3.42Å; L10-M13 VanDerWaalsContact O-N 3.13Å; M13-L15 VanDerWaalsContact C-N 3.32Å; M13-L15 PolarHBondContact O-N 2.9Å |
| 14 | A | 58.5 | Low | 55.1 | Low | 82 Ų | 82 | 147.6 Ų | 147.6 | 68% | 0.678 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -74.2 | -18.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | L10 | L10-A14 PolarHBondContact O-N 3.16Š|
| 15 | L | 56.7 | Low | 54.8 | Low | 148 Ų | 148 | 140 Ų | 140 | 78% | 0.775 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -126.1 | 93.1 | -172.3 | -63.6 | 173.5 | 0 | 0 | 0 | 110.7 | M13 | M13-L15 VanDerWaalsContact C-N 3.32Å; M13-L15 PolarHBondContact O-N 2.9Å |
| 16 | G | 48.2 | Very low | 54 | Low | 61 Ų | 61 | 135.6 Ų | 135.6 | 63% | 0.629 | 71% | 0.708 | S | S | * | * | trans | 114.8 | 16.9 | 139.7 | 0 | 0 | 0 | 0 | 0 | 120.8 | R18 | G16-R18 PolarHBondContact O-N 3.49Š| ||
| 17 | K | 51.6 | Low | 53.5 | Low | 216 Ų | 216 | 130.3 Ų | 130.3 | 94% | 0.939 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.9 | 27.4 | 166.7 | -91.1 | -148.6 | 179.5 | -173 | 0 | 115.4 | ||
| 18 | R | 52.2 | Low | 53 | Low | 219 Ų | 219 | 132.7 Ų | 132.7 | 83% | 0.826 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.3 | 10.2 | 177.1 | -58.1 | -166.6 | -139.7 | -175.4 | 4.8 | 114.6 | G16 | G16-R18 PolarHBondContact O-N 3.49Š|
| 19 | A | 53.1 | Low | 52.7 | Low | 87 Ų | 87 | 132.8 Ų | 132.8 | 72% | 0.719 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -92.8 | -17.6 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 20 | Q | 52.4 | Low | 52.6 | Low | 191 Ų | 191 | 137 Ų | 137 | 89% | 0.893 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -118.8 | -3 | -167.1 | -110 | -175.8 | -7.5 | 0 | 0 | 116.9 | ||
| 21 | D | 48.8 | Very low | 52.3 | Low | 108 Ų | 108 | 141 Ų | 141 | 58% | 0.578 | 73% | 0.729 | S | S | * | * | trans | -112.5 | 17.9 | -176.2 | -122.3 | -63.5 | 0 | 0 | 0 | 113.8 | E23 | D21-E23 PolarHBondContact O-N 3.43Š| ||
| 22 | R | 50.5 | Low | 52.1 | Low | 235 Ų | 235 | 145.3 Ų | 145.3 | 89% | 0.887 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.1 | -9.3 | 179.8 | -72.2 | -172.6 | 82.7 | 130.5 | -0.8 | 114.1 | ||
| 23 | E | 50.7 | Low | 51.9 | Low | 195 Ų | 195 | 148.3 Ų | 148.3 | 91% | 0.911 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.9 | -14.3 | -173.4 | -146.7 | -176.8 | 149.2 | 0 | 0 | 114 | D21 | D21-E23 PolarHBondContact O-N 3.43Š|
| 24 | R | 52.3 | Low | 51.9 | Low | 226 Ų | 226 | 145.3 Ų | 145.3 | 85% | 0.853 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.1 | -8 | -168.2 | -137.1 | 174.4 | -171 | 178.6 | 2.7 | 116.3 | G26 | R24-G26 VanDerWaalsContact C-N 3.34Å; R24-G26 PolarHBondContact O-N 2.76Å |
| 25 | V | 48.7 | Very low | 51.8 | Low | 65 Ų | 65 | 147.3 Ų | 147.3 | 39% | 0.394 | 74% | 0.735 | S | S | . | * | trans | -100 | 46.5 | -175.7 | -152.9 | 0 | 0 | 0 | 0 | 112 | S27 L29 | V25-S27 VanDerWaalsContact C-N 3.32Å; V25-S27 PolarHBondContact O-N 2.94Å; V25-L29 HydrophobicContact CB-CD1 3.83Å; V25-L29 HydrophobicContact CG1-CB 4.35Å; V25-L29 HydrophobicContact CG1-CD1 3.22Å; V25-L29 HydrophobicContact CG1-CG 3.5Å | ||
| 26 | G | 46.9 | Very low | 51.6 | Low | 76 Ų | 76 | 142.3 Ų | 142.3 | 78% | 0.784 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -75.6 | -1.1 | -172.3 | 0 | 0 | 0 | 0 | 0 | 117 | R24 | R24-G26 VanDerWaalsContact C-N 3.34Å; R24-G26 PolarHBondContact O-N 2.76Å |
| 27 | S | 52.5 | Low | 51.9 | Low | 104 Ų | 104 | 141.4 Ų | 141.4 | 73% | 0.727 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -163.6 | 1.8 | -171.1 | 42.3 | 0 | 0 | 0 | 0 | 116.9 | V25 | V25-S27 VanDerWaalsContact C-N 3.32Å; V25-S27 PolarHBondContact O-N 2.94Å |
| 28 | R | 48.6 | Very low | 52 | Low | 229 Ų | 229 | 136.9 Ų | 136.9 | 86% | 0.864 | 69% | 0.693 | S | S | * | * | trans | -120.4 | 3.1 | -171.9 | -84 | -177.3 | 159.9 | 174.2 | -5.2 | 116.4 | Q30 | R28-Q30 VanDerWaalsContact C-N 3.35Å; R28-Q30 PolarHBondContact O-N 3.14Å | ||
| 29 | L | 51.9 | Low | 52.2 | Low | 94 Ų | 94 | 130.3 Ų | 130.3 | 49% | 0.492 | 69% | 0.686 | S | S | . | * | trans | -90.3 | 19.3 | -178.7 | -93.1 | 164.3 | 0 | 0 | 0 | 114.3 | V25 F31 F32 | V25-L29 HydrophobicContact CB-CD1 3.83Å; V25-L29 HydrophobicContact CG1-CB 4.35Å; V25-L29 HydrophobicContact CG1-CD1 3.22Å; V25-L29 HydrophobicContact CG1-CG 3.5Å; L29-F31 VanDerWaalsContact C-N 3.3Å; L29-F31 PolarHBondContact O-N 3.31Å; L29-F32 HydrophobicContact CB-CE2 4.1Å; L29-F32 HydrophobicContact CD2-CE2 3.84Å; L29-F32 HydrophobicContact CD2-CZ 3.82Å; L29-F32 HydrophobicContact CG-CE2 4.49Å; L29-F32 WeakPolarHBondContact O-CD2 3.36Å; L29-F32 WeakPolarHBondContact O-CE2 3.02Å | ||
| 30 | Q | 53.7 | Low | 52.3 | Low | 173 Ų | 173 | 133.7 Ų | 133.7 | 81% | 0.808 | 69% | 0.691 | S | S | * | * | trans | -79.7 | -5.8 | -177 | -69.3 | -168.5 | -2.4 | 0 | 0 | 114.8 | R28 | R28-Q30 VanDerWaalsContact C-N 3.35Å; R28-Q30 PolarHBondContact O-N 3.14Å | ||
| 31 | F | 52.6 | Low | 52 | Low | 201 Ų | 201 | 126.7 Ų | 126.7 | 88% | 0.882 | 67% | 0.67 | S | S | * | * | trans | -105.9 | 64.8 | 173.8 | -60.3 | -78.9 | 0 | 0 | 0 | 110 | L29 D33 | L29-F31 VanDerWaalsContact C-N 3.3Å; L29-F31 PolarHBondContact O-N 3.31Å; F31-D33 PolarHBondContact O-N 3.06Å; F31-D33 VanDerWaalsContact O-N 3.16Å | ||
| 32 | F | 51.5 | Low | 52.1 | Low | 148 Ų | 148 | 129.2 Ų | 129.2 | 65% | 0.649 | 68% | 0.676 | S | S | * | * | trans | -69.8 | 106.3 | 164.6 | -90.1 | -85.2 | 0 | 0 | 0 | 108.3 | L29 S34 | L29-F32 HydrophobicContact CB-CE2 4.1Å; L29-F32 HydrophobicContact CD2-CE2 3.84Å; L29-F32 HydrophobicContact CD2-CZ 3.82Å; L29-F32 HydrophobicContact CG-CE2 4.49Å; L29-F32 WeakPolarHBondContact O-CD2 3.36Å; L29-F32 WeakPolarHBondContact O-CE2 3.02Å; F32-S34 PolarHBondContact O-N 3.33Å; F32-S34 VanDerWaalsContact O-N 3.07Å | ||
| 33 | D | 53.3 | Low | 52.2 | Low | 109 Ų | 109 | 130 Ų | 130 | 58% | 0.583 | 68% | 0.679 | S | S | * | * | trans | -53.7 | 113.6 | 166.3 | -173 | -7.9 | 0 | 0 | 0 | 108.2 | F31 L35 G36 G37 | F31-D33 PolarHBondContact O-N 3.06Å; F31-D33 VanDerWaalsContact O-N 3.16Å; D33-L35 PolarHBondContact O-N 3.16Å; D33-L35 PolarHBondContact OD1-N 3.07Å; D33-G36 PolarHBondContact O-N 3.41Å; D33-G37 PolarHBondContact O-N 3.28Å | ||
| 34 | S | 54.8 | Low | 52 | Low | 85 Ų | 85 | 132 Ų | 132 | 59% | 0.594 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -58.1 | -24.2 | -176.4 | -68 | 0 | 0 | 0 | 0 | 111.2 | F32 M38 | F32-S34 PolarHBondContact O-N 3.33Å; F32-S34 VanDerWaalsContact O-N 3.07Å; S34-M38 WeakPolarHBondContact O-CE 3.21Å; S34-M38 WeakPolarHBondContact O-CG 3.48Å; S34-M38 PolarHBondContact O-N 3.29Å |
| 35 | L | 57.6 | Low | 51.8 | Low | 124 Ų | 124 | 127.8 Ų | 127.8 | 65% | 0.649 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -80.1 | -34.7 | 176.4 | -60.1 | 177.2 | 0 | 0 | 0 | 112.6 | D33 M38 A39 | D33-L35 PolarHBondContact O-N 3.16Å; D33-L35 PolarHBondContact OD1-N 3.07Å; L35-M38 PolarHBondContact O-N 3.14Å; L35-A39 PolarHBondContact O-N 3Å |
| 36 | G | 52.1 | Low | 51.5 | Low | 42 Ų | 42 | 126.9 Ų | 126.9 | 43% | 0.433 | 67% | 0.667 | S | S | . | * | H | α-helix | trans | -68.5 | -32.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | D33 | D33-G36 PolarHBondContact O-N 3.41Å |
| 37 | G | 53.9 | Low | 51.3 | Low | 43 Ų | 43 | 130.6 Ų | 130.6 | 44% | 0.443 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -74.4 | -26.7 | 173 | 0 | 0 | 0 | 0 | 0 | 114 | D33 G41 | D33-G37 PolarHBondContact O-N 3.28Å; G37-G41 PolarHBondContact O-N 3.25Å |
| 38 | M | 54.2 | Low | 51.1 | Low | 120 Ų | 120 | 129.5 Ų | 129.5 | 59% | 0.591 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -76.4 | -29.7 | 176.6 | -72.7 | 178.8 | -149.9 | 0 | 0 | 112.6 | S34 L35 | S34-M38 WeakPolarHBondContact O-CE 3.21Å; S34-M38 WeakPolarHBondContact O-CG 3.48Å; S34-M38 PolarHBondContact O-N 3.29Å; L35-M38 PolarHBondContact O-N 3.14Å |
| 39 | A | 56.7 | Low | 51 | Low | 81 Ų | 81 | 124.8 Ų | 124.8 | 67% | 0.669 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -76 | -21.6 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | L35 | L35-A39 PolarHBondContact O-N 3Å |
| 40 | L | 54.1 | Low | 50.9 | Low | 159 Ų | 159 | 125.8 Ų | 125.8 | 83% | 0.832 | 64% | 0.639 | S | S | * | * | S | Bend | trans | -124.6 | 11.1 | -177.1 | -65.9 | 175.1 | 0 | 0 | 0 | 114.3 | ||
| 41 | G | 47.3 | Very low | 50.4 | Low | 43 Ų | 43 | 122.8 Ų | 122.8 | 44% | 0.443 | 62% | 0.621 | S | S | . | * | S | Bend | trans | -112.4 | 5.5 | -166.8 | 0 | 0 | 0 | 0 | 0 | 118.4 | G37 | G37-G41 PolarHBondContact O-N 3.25Š|
| 42 | K | 50.6 | Low | 50.2 | Low | 162 Ų | 162 | 120.1 Ų | 120.1 | 70% | 0.704 | 61% | 0.605 | S | S | * | * | S | Bend | trans | -116.2 | 14.6 | -171.6 | -65.4 | -162.3 | -178.2 | -178.1 | 0 | 118.2 | ||
| 43 | R | 52.3 | Low | 50.2 | Low | 251 Ų | 251 | 118.7 Ų | 118.7 | 95% | 0.947 | 60% | 0.603 | S | S | * | * | S | Bend | trans | -102.8 | -10.2 | 173.4 | -69.5 | -169 | 179.3 | -168.2 | 0.7 | 115.9 | ||
| 44 | R | 47.2 | Very low | 50.2 | Low | 237 Ų | 237 | 118.3 Ų | 118.3 | 89% | 0.894 | 60% | 0.601 | S | S | * | * | S | Bend | trans | -146.2 | 64.5 | 173.1 | -67.6 | -165.9 | 178.8 | -154 | 0.5 | 111.1 | ||
| 45 | Q | 47.1 | Very low | 50 | Low | 138 Ų | 138 | 122.9 Ų | 122.9 | 65% | 0.645 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -177.9 | -0.8 | 156.9 | -102.3 | -179.9 | 60 | 0 | 0 | 111.9 | F47 V48 | Q45-F47 PolarHBondContact O-N 2.97Å; Q45-V48 PolarHBondContact O-N 3.18Å |
| 46 | A | 43.7 | Very low | 49.7 | Very low | 46 Ų | 46 | 123.1 Ų | 123.1 | 38% | 0.38 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -64.8 | -12.1 | 160.4 | 0 | 0 | 0 | 0 | 0 | 113 | V48 H50 | A46-V48 PolarHBondContact O-N 3.18Å; A46-H50 VanDerWaalsContact O-CB 3.24Å; A46-H50 WeakPolarHBondContact O-CB 2.74Å; A46-H50 PolarHBondContact O-N 3.05Å; A46-H50 VanDerWaalsContact O-N 3.14Å |
| 47 | F | 42.4 | Very low | 49.7 | Very low | 154 Ų | 154 | 131.9 Ų | 131.9 | 68% | 0.675 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -81.4 | 9 | 176.2 | -137.6 | -92 | 0 | 0 | 0 | 114.4 | Q45 Y51 | Q45-F47 PolarHBondContact O-N 2.97Å; F47-Y51 VanDerWaalsContact CA-CE2 3.42Å; F47-Y51 HydrophobicContact CB-CD2 4.39Å; F47-Y51 HydrophobicContact CB-CE2 3.87Å; F47-Y51 AromaticContact CD1-CD2 3.97Å; F47-Y51 HydrophobicContact CD1-CD2 3.97Å; F47-Y51 AromaticContact CD1-CE1 3.95Å; F47-Y51 HydrophobicContact CD1-CE1 3.95Å; F47-Y51 AromaticContact CD1-CE2 3.22Å; F47-Y51 HydrophobicContact CD1-CE2 3.22Å; F47-Y51 AromaticContact CD1-CZ 3.22Å; F47-Y51 WeakPolarHBondContact CD1-OH 3.29Å; F47-Y51 AromaticContact CD2-CE2 3.66Å; F47-Y51 HydrophobicContact CD2-CE2 3.66Å; F47-Y51 AromaticContact CD2-CZ 3.82Å; F47-Y51 WeakPolarHBondContact CD2-OH 3.08Å; F47-Y51 AromaticContact CE1-CE1 3.65Å; F47-Y51 HydrophobicContact CE1-CE1 3.65Å; F47-Y51 AromaticContact CE1-CE2 3.67Å; F47-Y51 HydrophobicContact CE1-CE2 3.67Å; F47-Y51 AromaticContact CE1-CZ 3.11Å; F47-Y51 WeakPolarHBondContact CE1-OH 3.21Å; F47-Y51 HydrophobicContact CE2-CE2 4.07Å; F47-Y51 AromaticContact CE2-CZ 3.74Å; F47-Y51 WeakPolarHBondContact CE2-OH 3.25Å; F47-Y51 HydrophobicContact CG-CD2 4.14Å; F47-Y51 AromaticContact CG-CE2 3.25Å; F47-Y51 HydrophobicContact CG-CE2 3.25Å; F47-Y51 AromaticContact CG-CZ 3.62Å; F47-Y51 HydrophobicContact CZ-CE1 4.19Å; F47-Y51 HydrophobicContact CZ-CE2 4.11Å; F47-Y51 AromaticContact CZ-CZ 3.42Å; F47-Y51 VanDerWaalsContact CZ-CZ 3.42Å; F47-Y51 WeakPolarHBondContact CZ-OH 3.21Å; F47-Y51 WeakPolarHBondContact O-CD2 3.24Å; F47-Y51 WeakPolarHBondContact O-CE2 2.74Å |
| 48 | V | 46.8 | Very low | 49.7 | Very low | 81 Ų | 81 | 134.7 Ų | 134.7 | 49% | 0.491 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -122.2 | -36.6 | 170.9 | -177.4 | 0 | 0 | 0 | 0 | 110.4 | Q45 A46 Y51 R52 | Q45-V48 PolarHBondContact O-N 3.18Å; A46-V48 PolarHBondContact O-N 3.18Å; V48-Y51 PolarHBondContact O-N 3Å; V48-R52 WeakPolarHBondContact O-CB 3.35Å; V48-R52 PolarHBondContact O-N 3.36Å |
| 49 | F | 48 | Very low | 49.6 | Very low | 130 Ų | 130 | 131.7 Ų | 131.7 | 57% | 0.57 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -78.5 | -28.3 | 178 | -74.1 | -83.9 | 0 | 0 | 0 | 114.3 | Y51 L53 | F49-Y51 VanDerWaalsContact C-N 3.32Å; F49-L53 PolarHBondContact O-N 3.5Å; F49-L53 VanDerWaalsContact O-N 3.16Å |
| 50 | H | 48.3 | Very low | 49.2 | Very low | 114 Ų | 114 | 131.6 Ų | 131.6 | 53% | 0.528 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -76.8 | -24 | 171.6 | -136.3 | -75.2 | 0 | 0 | 0 | 112 | A46 L54 | A46-H50 VanDerWaalsContact O-CB 3.24Å; A46-H50 WeakPolarHBondContact O-CB 2.74Å; A46-H50 PolarHBondContact O-N 3.05Å; A46-H50 VanDerWaalsContact O-N 3.14Å; H50-L54 WeakPolarHBondContact O-CB 2.91Å; H50-L54 VanDerWaalsContact O-CD1 3.29Å; H50-L54 WeakPolarHBondContact O-CD1 3.28Å; H50-L54 WeakPolarHBondContact O-CG 3.02Å; H50-L54 PolarHBondContact O-N 3.26Å |
| 51 | Y | 43.4 | Very low | 48.7 | Very low | 111 Ų | 111 | 129.1 Ų | 129.1 | 44% | 0.435 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -77.9 | -37.6 | 175.5 | -66 | -100.5 | 0 | 0 | 0 | 109.7 | F47 V48 F49 L54 Y55 | F47-Y51 VanDerWaalsContact CA-CE2 3.42Å; F47-Y51 HydrophobicContact CB-CD2 4.39Å; F47-Y51 HydrophobicContact CB-CE2 3.87Å; F47-Y51 AromaticContact CD1-CD2 3.97Å; F47-Y51 HydrophobicContact CD1-CD2 3.97Å; F47-Y51 AromaticContact CD1-CE1 3.95Å; F47-Y51 HydrophobicContact CD1-CE1 3.95Å; F47-Y51 AromaticContact CD1-CE2 3.22Å; F47-Y51 HydrophobicContact CD1-CE2 3.22Å; F47-Y51 AromaticContact CD1-CZ 3.22Å; F47-Y51 WeakPolarHBondContact CD1-OH 3.29Å; F47-Y51 AromaticContact CD2-CE2 3.66Å; F47-Y51 HydrophobicContact CD2-CE2 3.66Å; F47-Y51 AromaticContact CD2-CZ 3.82Å; F47-Y51 WeakPolarHBondContact CD2-OH 3.08Å; F47-Y51 AromaticContact CE1-CE1 3.65Å; F47-Y51 HydrophobicContact CE1-CE1 3.65Å; F47-Y51 AromaticContact CE1-CE2 3.67Å; F47-Y51 HydrophobicContact CE1-CE2 3.67Å; F47-Y51 AromaticContact CE1-CZ 3.11Å; F47-Y51 WeakPolarHBondContact CE1-OH 3.21Å; F47-Y51 HydrophobicContact CE2-CE2 4.07Å; F47-Y51 AromaticContact CE2-CZ 3.74Å; F47-Y51 WeakPolarHBondContact CE2-OH 3.25Å; F47-Y51 HydrophobicContact CG-CD2 4.14Å; F47-Y51 AromaticContact CG-CE2 3.25Å; F47-Y51 HydrophobicContact CG-CE2 3.25Å; F47-Y51 AromaticContact CG-CZ 3.62Å; F47-Y51 HydrophobicContact CZ-CE1 4.19Å; F47-Y51 HydrophobicContact CZ-CE2 4.11Å; F47-Y51 AromaticContact CZ-CZ 3.42Å; F47-Y51 VanDerWaalsContact CZ-CZ 3.42Å; F47-Y51 WeakPolarHBondContact CZ-OH 3.21Å; F47-Y51 WeakPolarHBondContact O-CD2 3.24Å; F47-Y51 WeakPolarHBondContact O-CE2 2.74Å; V48-Y51 PolarHBondContact O-N 3Å; F49-Y51 VanDerWaalsContact C-N 3.32Å; Y51-L54 PolarHBondContact O-N 3.29Å; Y51-Y55 WeakPolarHBondContact O-CA 3.38Å; Y51-Y55 WeakPolarHBondContact O-CB 3.48Å; Y51-Y55 PolarHBondContact O-N 3.45Å |
| 52 | R | 48.7 | Very low | 48.8 | Very low | 145 Ų | 145 | 135.7 Ų | 135.7 | 55% | 0.547 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -64.6 | -43.8 | 173.7 | -163.1 | 174 | -168.1 | -159.6 | 1.8 | 112.6 | V48 Y55 E56 | V48-R52 WeakPolarHBondContact O-CB 3.35Å; V48-R52 PolarHBondContact O-N 3.36Å; R52-Y55 PolarHBondContact O-N 3.48Å; R52-E56 WeakPolarHBondContact O-CB 3.21Å; R52-E56 PolarHBondContact O-N 3.28Å |
| 53 | L | 52 | Low | 48.8 | Very low | 117 Ų | 117 | 133.8 Ų | 133.8 | 61% | 0.613 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -72.1 | -30.1 | 176 | -80.9 | 163.5 | 0 | 0 | 0 | 113.4 | F49 R57 | F49-L53 PolarHBondContact O-N 3.5Å; F49-L53 VanDerWaalsContact O-N 3.16Å; L53-R57 WeakPolarHBondContact O-CB 3.36Å; L53-R57 PolarHBondContact O-N 2.92Å |
| 54 | L | 52.4 | Low | 48.7 | Very low | 101 Ų | 101 | 127.6 Ų | 127.6 | 53% | 0.529 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -78.9 | -31.7 | 173.4 | -72 | 168.7 | 0 | 0 | 0 | 112.4 | H50 Y51 S58 | H50-L54 WeakPolarHBondContact O-CB 2.91Å; H50-L54 VanDerWaalsContact O-CD1 3.29Å; H50-L54 WeakPolarHBondContact O-CD1 3.28Å; H50-L54 WeakPolarHBondContact O-CG 3.02Å; H50-L54 PolarHBondContact O-N 3.26Å; Y51-L54 PolarHBondContact O-N 3.29Å; L54-S58 VanDerWaalsContact O-CB 3.25Å; L54-S58 WeakPolarHBondContact O-CB 3.28Å; L54-S58 PolarHBondContact O-N 3.07Å |
| 55 | Y | 50.5 | Low | 48.8 | Very low | 182 Ų | 182 | 126.5 Ų | 126.5 | 71% | 0.714 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -73.1 | -45.9 | 175.6 | -168.1 | -96 | 0 | 0 | 0 | 111 | Y51 R52 R57 S58 S59 | Y51-Y55 WeakPolarHBondContact O-CA 3.38Å; Y51-Y55 WeakPolarHBondContact O-CB 3.48Å; Y51-Y55 PolarHBondContact O-N 3.45Å; R52-Y55 PolarHBondContact O-N 3.48Å; Y55-R57 PolarHBondContact O-N 3.13Å; Y55-S58 PolarHBondContact O-N 3.41Å; Y55-S58 VanDerWaalsContact O-N 3.14Å; Y55-S59 PolarHBondContact O-N 3.18Å; Y55-S59 PolarHBondContact O-OG 3.17Å; Y55-S59 VanDerWaalsContact O-OG 3.05Å |
| 56 | E | 51.7 | Low | 49.1 | Very low | 128 Ų | 128 | 124.2 Ų | 124.2 | 60% | 0.598 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -61.9 | -31.3 | 173.4 | -91.9 | -166.4 | 96.7 | 0 | 0 | 112.9 | R52 | R52-E56 WeakPolarHBondContact O-CB 3.21Å; R52-E56 PolarHBondContact O-N 3.28Å |
| 57 | R | 52.2 | Low | 49.3 | Very low | 227 Ų | 227 | 134.1 Ų | 134.1 | 86% | 0.857 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -84.3 | -16.5 | 178.3 | -150.7 | 174.5 | -162.6 | -177 | 3.9 | 113.1 | L53 Y55 | L53-R57 WeakPolarHBondContact O-CB 3.36Å; L53-R57 PolarHBondContact O-N 2.92Å; Y55-R57 PolarHBondContact O-N 3.13Å |
| 58 | S | 54.3 | Low | 49.6 | Very low | 102 Ų | 102 | 135.4 Ų | 135.4 | 71% | 0.713 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -94.1 | -22.7 | 175.5 | -169 | 0 | 0 | 0 | 0 | 112.8 | L54 Y55 G60 | L54-S58 VanDerWaalsContact O-CB 3.25Å; L54-S58 WeakPolarHBondContact O-CB 3.28Å; L54-S58 PolarHBondContact O-N 3.07Å; Y55-S58 PolarHBondContact O-N 3.41Å; Y55-S58 VanDerWaalsContact O-N 3.14Å; S58-G60 PolarHBondContact O-N 2.98Å |
| 59 | S | 51 | Low | 49.4 | Very low | 57 Ų | 57 | 136.4 Ų | 136.4 | 40% | 0.399 | 69% | 0.691 | S | S | . | * | trans | -92.5 | 74.3 | 174.2 | 61.9 | 0 | 0 | 0 | 0 | 110.3 | Y55 C61 | Y55-S59 PolarHBondContact O-N 3.18Å; Y55-S59 PolarHBondContact O-OG 3.17Å; Y55-S59 VanDerWaalsContact O-OG 3.05Å; S59-C61 PolarHBondContact O-N 3.11Å | ||
| 60 | G | 49.4 | Very low | 49 | Very low | 79 Ų | 79 | 137.4 Ų | 137.4 | 81% | 0.814 | 70% | 0.699 | S | S | * | * | trans | -66.7 | 37.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | S58 | S58-G60 PolarHBondContact O-N 2.98Š| ||
| 61 | C | 43.9 | Very low | 48.9 | Very low | 107 Ų | 107 | 140.3 Ų | 140.3 | 72% | 0.723 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -141.8 | 112.3 | 179.1 | -73.7 | 0 | 0 | 0 | 0 | 110.2 | S59 | S59-C61 PolarHBondContact O-N 3.11Š|
| 62 | H | 48.7 | Very low | 49.2 | Very low | 181 Ų | 181 | 148.4 Ų | 148.4 | 84% | 0.838 | 75% | 0.751 | S | S | * | * | trans | 20.6 | 142.4 | 159.7 | -78.7 | -91.3 | 0 | 0 | 0 | 122.2 | C64 | H62-C64 PolarHBondContact O-N 3.23Å; H62-C64 VanDerWaalsContact O-N 3.09Å | ||
| 63 | P | 51.8 | Low | 49.2 | Very low | 122 Ų | 122 | 148.6 Ų | 148.6 | 79% | 0.792 | 76% | 0.761 | S | S | * | * | trans | -79.6 | 100.1 | -161.8 | 33.7 | -34.6 | 0 | 0 | 0 | 113 | K65 | P63-K65 PolarHBondContact O-N 3.18Š| ||
| 64 | C | 49.2 | Very low | 49 | Very low | 121 Ų | 121 | 150.2 Ų | 150.2 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | trans | -87.8 | 99.2 | 164.5 | -81.1 | 0 | 0 | 0 | 0 | 110.4 | H62 S66 | H62-C64 PolarHBondContact O-N 3.23Å; H62-C64 VanDerWaalsContact O-N 3.09Å; C64-S66 PolarHBondContact O-N 3.07Å | ||
| 65 | K | 49.8 | Very low | 48.9 | Very low | 214 Ų | 214 | 152.9 Ų | 152.9 | 93% | 0.93 | 78% | 0.782 | S | S | * | * | trans | -11 | 106.5 | 156.2 | -66.7 | 169.7 | 176.4 | 173 | 0 | 114.1 | P63 | P63-K65 PolarHBondContact O-N 3.18Š| ||
| 66 | S | 53.3 | Low | 48.8 | Very low | 89 Ų | 89 | 151.2 Ų | 151.2 | 62% | 0.622 | 79% | 0.786 | S | S | * | * | trans | -143.7 | 104.2 | 155.1 | 47.3 | 0 | 0 | 0 | 0 | 109.8 | C64 F68 | C64-S66 PolarHBondContact O-N 3.07Å; S66-F68 PolarHBondContact O-N 3.26Å; S66-F68 VanDerWaalsContact O-N 3.13Å | ||
| 67 | R | 47.3 | Very low | 48.6 | Very low | 254 Ų | 254 | 152.7 Ų | 152.7 | 96% | 0.958 | 80% | 0.798 | S | S | * | * | trans | -57.9 | 107.5 | 158.4 | -87.6 | 177.7 | 171.5 | 174.7 | -3.7 | 106.7 | ||||
| 68 | F | 48.6 | Very low | 48.3 | Very low | 181 Ų | 181 | 147.7 Ų | 147.7 | 79% | 0.794 | 79% | 0.794 | S | S | * | * | trans | -94.7 | 101.4 | 158.6 | -116.1 | -89.7 | 0 | 0 | 0 | 107.1 | S66 | S66-F68 PolarHBondContact O-N 3.26Å; S66-F68 VanDerWaalsContact O-N 3.13Å | ||
| 69 | S | 42.3 | Very low | 47.9 | Very low | 102 Ų | 102 | 151 Ų | 151 | 71% | 0.713 | 80% | 0.8 | S | S | * | * | trans | -75.9 | 116.5 | 164.5 | -156.1 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 70 | M | 40.3 | Very low | 47.7 | Very low | 151 Ų | 151 | 158.2 Ų | 158.2 | 74% | 0.744 | 83% | 0.831 | S | S | * | * | trans | -100.7 | 96.5 | 167.6 | -169.7 | 173.1 | -81 | 0 | 0 | 105 | ||||
| 71 | E | 45.9 | Very low | 47.5 | Very low | 175 Ų | 175 | 164.8 Ų | 164.8 | 82% | 0.818 | 83% | 0.832 | S | S | * | * | trans | -68.9 | 142.4 | 165.4 | -67.6 | -160.9 | 112.3 | 0 | 0 | 108.4 | ||||
| 72 | F | 49.4 | Very low | 47.9 | Very low | 281 Ų | 281 | 170.1 Ų | 170.1 | 100% | 1.232 | 84% | 0.842 | S | S | * | * | trans | -64.4 | 0 | -173 | -74.4 | -91 | 0 | 0 | 0 | 113.5 |
Retrieved 72 of 72 residues in 33.7 ms
(Link to these results)