| 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 | S | 54.6 | Low | 72 | Confident | 153 Ų | 153 | 136.1 Ų | 136.1 | 100% | 1.07 | 70% | 0.7 | S | S | * | * | 0 | 114.4 | 0 | -164.5 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 2 | R | 54 | Low | 72.5 | Confident | 247 Ų | 247 | 137.2 Ų | 137.2 | 93% | 0.932 | 71% | 0.708 | S | S | * | * | trans | -90.4 | 107.1 | 178.2 | -69.1 | -175.9 | 178.2 | -163.5 | 0.4 | 107.2 | S4 | R2-S4 PolarHBondContact O-N 2.87Š| ||
| 3 | F | 64.8 | Low | 72.8 | Confident | 178 Ų | 178 | 134.7 Ų | 134.7 | 78% | 0.781 | 70% | 0.696 | S | S | * | * | trans | -70.9 | 111 | 172.9 | -81.7 | -86.5 | 0 | 0 | 0 | 108.7 | ||||
| 4 | S | 68.1 | Low | 72.8 | Confident | 111 Ų | 111 | 133.9 Ų | 133.9 | 78% | 0.776 | 70% | 0.703 | S | S | * | * | trans | -78.5 | 119.8 | 167.7 | 43.7 | 0 | 0 | 0 | 0 | 108.4 | R2 | R2-S4 PolarHBondContact O-N 2.87Š| ||
| 5 | F | 69.8 | Low | 72.5 | Confident | 167 Ų | 167 | 137.1 Ų | 137.1 | 73% | 0.732 | 71% | 0.713 | S | S | * | * | trans | -100.1 | 104.6 | 175.1 | -172.6 | -107.3 | 0 | 0 | 0 | 108.3 | I10 | F5-I10 HydrophobicContact CD1-CD1 4.11Å; F5-I10 HydrophobicContact CD1-CG1 4.47Å; F5-I10 HydrophobicContact CD2-CG1 4.2Å; F5-I10 HydrophobicContact CE1-CD1 3.19Å; F5-I10 HydrophobicContact CE1-CG1 3.74Å; F5-I10 HydrophobicContact CE2-CD1 3.87Å; F5-I10 HydrophobicContact CE2-CG1 3.4Å; F5-I10 VanDerWaalsContact CE2-CG1 3.4Å; F5-I10 HydrophobicContact CZ-CD1 3.07Å; F5-I10 HydrophobicContact CZ-CG1 3.16Å | ||
| 6 | S | 83.1 | Confident | 71.8 | Confident | 62 Ų | 62 | 140.7 Ų | 140.7 | 43% | 0.434 | 73% | 0.725 | S | S | . | * | trans | -102.9 | 146.4 | 171.6 | -178.6 | 0 | 0 | 0 | 0 | 109 | R8 S9 I10 | S6-R8 PolarHBondContact O-N 3.36Å; S6-R8 VanDerWaalsContact O-N 3.08Å; S6-R8 PolarHBondContact OG-N 2.79Å; S6-S9 WeakPolarHBondContact O-CA 3.35Å; S6-S9 WeakPolarHBondContact O-CB 3.37Å; S6-S9 PolarHBondContact O-N 3.1Å; S6-I10 PolarHBondContact O-N 3.48Å | ||
| 7 | V | 78.5 | Confident | 70.3 | Confident | 101 Ų | 101 | 141.3 Ų | 141.3 | 61% | 0.612 | 73% | 0.73 | S | S | * | * | H | α-helix | trans | -52.8 | -32 | 173.2 | 177 | 0 | 0 | 0 | 0 | 111 | S9 I10 L11 | V7-S9 PolarHBondContact O-N 3.34Å; V7-I10 PolarHBondContact O-N 3.27Å; V7-L11 HydrophobicContact CG1-CD1 3.91Å; V7-L11 PolarHBondContact O-N 2.96Å |
| 8 | R | 77.2 | Confident | 69.4 | Low | 189 Ų | 189 | 138.9 Ų | 138.9 | 71% | 0.713 | 74% | 0.735 | S | S | * | * | H | α-helix | trans | -61.3 | -39.1 | 173.2 | -72.2 | -178 | 170.7 | 176.5 | -5 | 113.5 | S6 I10 L11 D12 L13 | S6-R8 PolarHBondContact O-N 3.36Å; S6-R8 VanDerWaalsContact O-N 3.08Å; S6-R8 PolarHBondContact OG-N 2.79Å; R8-I10 VanDerWaalsContact C-N 3.31Å; R8-I10 PolarHBondContact O-N 2.98Å; R8-L11 PolarHBondContact O-N 3.02Å; R8-D12 PolarHBondContact O-N 3.39Å; R8-D12 VanDerWaalsContact O-N 3.13Å; R8-L13 PolarHBondContact O-N 3.16Å |
| 9 | S | 77.6 | Confident | 68 | Low | 82 Ų | 82 | 141.4 Ų | 141.4 | 57% | 0.573 | 74% | 0.742 | S | S | * | * | H | α-helix | trans | -71.6 | -23.7 | 178.5 | 167.1 | 0 | 0 | 0 | 0 | 112.9 | S6 V7 | S6-S9 WeakPolarHBondContact O-CA 3.35Å; S6-S9 WeakPolarHBondContact O-CB 3.37Å; S6-S9 PolarHBondContact O-N 3.1Å; V7-S9 PolarHBondContact O-N 3.34Å |
| 10 | I | 81.6 | Confident | 66.7 | Low | 91 Ų | 91 | 138.5 Ų | 138.5 | 47% | 0.467 | 74% | 0.739 | S | S | . | * | H | α-helix | trans | -77.4 | -38.6 | 175.5 | -52.4 | 167.4 | 0 | 0 | 0 | 110.8 | F5 S6 V7 R8 D12 | F5-I10 HydrophobicContact CD1-CD1 4.11Å; F5-I10 HydrophobicContact CD1-CG1 4.47Å; F5-I10 HydrophobicContact CD2-CG1 4.2Å; F5-I10 HydrophobicContact CE1-CD1 3.19Å; F5-I10 HydrophobicContact CE1-CG1 3.74Å; F5-I10 HydrophobicContact CE2-CD1 3.87Å; F5-I10 HydrophobicContact CE2-CG1 3.4Å; F5-I10 VanDerWaalsContact CE2-CG1 3.4Å; F5-I10 HydrophobicContact CZ-CD1 3.07Å; F5-I10 HydrophobicContact CZ-CG1 3.16Å; S6-I10 PolarHBondContact O-N 3.48Å; V7-I10 PolarHBondContact O-N 3.27Å; R8-I10 VanDerWaalsContact C-N 3.31Å; R8-I10 PolarHBondContact O-N 2.98Å; I10-D12 VanDerWaalsContact C-N 3.32Å |
| 11 | L | 82.6 | Confident | 65.4 | Low | 116 Ų | 116 | 136.7 Ų | 136.7 | 61% | 0.607 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.5 | 7.2 | -174 | -64.2 | 177.1 | 0 | 0 | 0 | 112.6 | V7 R8 L13 | V7-L11 HydrophobicContact CG1-CD1 3.91Å; V7-L11 PolarHBondContact O-N 2.96Å; R8-L11 PolarHBondContact O-N 3.02Å; L11-L13 VanDerWaalsContact C-N 3.27Å; L11-L13 HydrophobicContact CB-CD1 3.34Å; L11-L13 HydrophobicContact CD1-CD1 4.36Å; L11-L13 HydrophobicContact CG-CD1 4.5Å; L11-L13 PolarHBondContact O-N 3.31Å |
| 12 | D | 78 | Confident | 65.1 | Low | 149 Ų | 149 | 134.6 Ų | 134.6 | 80% | 0.797 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 46.7 | 45.5 | 176.1 | -154.2 | 47.1 | 0 | 0 | 0 | 113.5 | R8 I10 | R8-D12 PolarHBondContact O-N 3.39Å; R8-D12 VanDerWaalsContact O-N 3.13Å; I10-D12 VanDerWaalsContact C-N 3.32Å |
| 13 | L | 76.6 | Confident | 64.8 | Low | 105 Ų | 105 | 134.5 Ų | 134.5 | 55% | 0.55 | 73% | 0.726 | S | S | . | * | P | Polyproline II helix | trans | -81.4 | 135.8 | 177.3 | -78 | 97.8 | 0 | 0 | 0 | 110.6 | R8 L11 E15 | R8-L13 PolarHBondContact O-N 3.16Å; L11-L13 VanDerWaalsContact C-N 3.27Å; L11-L13 HydrophobicContact CB-CD1 3.34Å; L11-L13 HydrophobicContact CD1-CD1 4.36Å; L11-L13 HydrophobicContact CG-CD1 4.5Å; L11-L13 PolarHBondContact O-N 3.31Å; L13-E15 PolarHBondContact O-N 2.82Å |
| 14 | P | 73.1 | Confident | 63.8 | Low | 123 Ų | 123 | 131.2 Ų | 131.2 | 80% | 0.799 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -63 | 135.7 | 179.3 | 24.8 | -32.6 | 0 | 0 | 0 | 111.3 | Q16 | P14-Q16 PolarHBondContact O-N 3.48Š|
| 15 | E | 67.6 | Low | 62.5 | Low | 183 Ų | 183 | 131.2 Ų | 131.2 | 86% | 0.855 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 121 | 173.7 | -138.5 | 158.4 | 134.7 | 0 | 0 | 108 | L13 D17 | L13-E15 PolarHBondContact O-N 2.82Å; E15-D17 PolarHBondContact O-N 3.08Å |
| 16 | Q | 62.1 | Low | 61.4 | Low | 194 Ų | 194 | 128.8 Ų | 128.8 | 91% | 0.907 | 73% | 0.729 | S | S | * | * | trans | -86.7 | 92.7 | -177 | -152.5 | -179.6 | 25.7 | 0 | 0 | 108.3 | P14 A18 | P14-Q16 PolarHBondContact O-N 3.48Å; Q16-A18 PolarHBondContact O-N 3.32Å | ||
| 17 | D | 46.7 | Very low | 59.4 | Low | 151 Ų | 151 | 131.7 Ų | 131.7 | 81% | 0.807 | 74% | 0.744 | S | S | * | * | trans | -67.4 | 119.9 | 169.2 | -75.6 | -53.7 | 0 | 0 | 0 | 109.3 | E15 | E15-D17 PolarHBondContact O-N 3.08Š| ||
| 18 | A | 52.8 | Low | 57.8 | Low | 99 Ų | 99 | 136.3 Ų | 136.3 | 82% | 0.818 | 75% | 0.752 | S | S | * | * | trans | -90.1 | 110.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | Q16 | Q16-A18 PolarHBondContact O-N 3.32Š| ||
| 19 | E | 42.9 | Very low | 56.3 | Low | 185 Ų | 185 | 132 Ų | 132 | 86% | 0.864 | 75% | 0.75 | S | S | * | * | trans | -149.4 | 150.8 | 160.8 | -109.7 | -60.3 | 135.4 | 0 | 0 | 110.4 | ||||
| 20 | A | 42.4 | Very low | 54.9 | Low | 84 Ų | 84 | 134.2 Ų | 134.2 | 69% | 0.694 | 77% | 0.766 | S | S | * | * | trans | -91.8 | 153.7 | -144.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 21 | A | 38.9 | Very low | 52.6 | Low | 100 Ų | 100 | 135.5 Ų | 135.5 | 83% | 0.826 | 78% | 0.782 | S | S | * | * | trans | 179.5 | 158.7 | 135 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 22 | P | 49.4 | Very low | 51.2 | Low | 109 Ų | 109 | 135.9 Ų | 135.9 | 71% | 0.708 | 79% | 0.794 | S | S | * | * | trans | -118.5 | 169.3 | -146.3 | 42.9 | -31.9 | 0 | 0 | 0 | 117.1 | ||||
| 23 | R | 47.3 | Very low | 49.7 | Very low | 245 Ų | 245 | 134 Ų | 134 | 93% | 0.925 | 79% | 0.793 | S | S | * | * | trans | 74.3 | 137.2 | 163.3 | -49.8 | -173.8 | 168.6 | -178.4 | -4.8 | 114.9 | ||||
| 24 | S | 43.2 | Very low | 48.5 | Very low | 110 Ų | 110 | 134.1 Ų | 134.1 | 77% | 0.769 | 80% | 0.803 | S | S | * | * | cis | -165.4 | 140 | 24.3 | 174 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 25 | S | 40.3 | Very low | 47.2 | Very low | 110 Ų | 110 | 131.8 Ų | 131.8 | 77% | 0.769 | 79% | 0.789 | S | S | * | * | 147.4 | 121.3 | 122.9 | 65.5 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 26 | S | 46.6 | Very low | 46.7 | Very low | 116 Ų | 116 | 128.9 Ų | 128.9 | 81% | 0.811 | 79% | 0.786 | S | S | * | * | trans | -70.4 | 130.4 | 172.4 | 172 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 27 | V | 41.5 | Very low | 46 | Very low | 124 Ų | 124 | 128.8 Ų | 128.8 | 75% | 0.752 | 78% | 0.779 | S | S | * | * | trans | -155.6 | 126.9 | 138.4 | -98.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 28 | Y | 45.6 | Very low | 46 | Very low | 197 Ų | 197 | 127 Ų | 127 | 77% | 0.773 | 77% | 0.774 | S | S | * | * | trans | -29.5 | 137.6 | 176.9 | 72.2 | -74.1 | 0 | 0 | 0 | 117.3 | ||||
| 29 | S | 44.8 | Very low | 45.8 | Very low | 98 Ų | 98 | 126.6 Ų | 126.6 | 69% | 0.685 | 76% | 0.764 | S | S | * | * | -179.6 | 95.9 | 123.5 | -83.5 | 0 | 0 | 0 | 0 | 110 | C31 | S29-C31 PolarHBondContact O-N 3.29Š| |||
| 30 | S | 48.1 | Very low | 46.3 | Very low | 129 Ų | 129 | 128.1 Ų | 128.1 | 90% | 0.902 | 76% | 0.762 | S | S | * | * | trans | -67.3 | 118.9 | 163.5 | -57.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 31 | C | 33.5 | Very low | 46.9 | Very low | 118 Ų | 118 | 130 Ų | 130 | 80% | 0.797 | 77% | 0.765 | S | S | * | * | trans | -129 | 109.7 | 151 | 63.3 | 0 | 0 | 0 | 0 | 108.1 | S29 S33 | S29-C31 PolarHBondContact O-N 3.29Å; C31-S33 PolarHBondContact O-N 3.4Å | ||
| 32 | S | 54.3 | Low | 47.4 | Very low | 125 Ų | 125 | 133.2 Ų | 133.2 | 87% | 0.874 | 76% | 0.763 | S | S | * | * | trans | -59.8 | 99.6 | 173.6 | -53.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 33 | S | 46.8 | Very low | 47.4 | Very low | 110 Ų | 110 | 134.1 Ų | 134.1 | 77% | 0.769 | 77% | 0.77 | S | S | * | * | trans | -97.2 | 96.2 | 160.8 | -170.2 | 0 | 0 | 0 | 0 | 107.6 | C31 S35 | C31-S33 PolarHBondContact O-N 3.4Å; S33-S35 PolarHBondContact O-N 3.02Å | ||
| 34 | S | 51.7 | Low | 47.5 | Very low | 107 Ų | 107 | 130.2 Ų | 130.2 | 75% | 0.748 | 77% | 0.768 | S | S | * | * | trans | -51.9 | 103.3 | 162.5 | 38.8 | 0 | 0 | 0 | 0 | 109.1 | P36 | S34-P36 WeakPolarHBondContact O-CD 3.39Š| ||
| 35 | S | 45.1 | Very low | 48 | Very low | 74 Ų | 74 | 136.1 Ų | 136.1 | 52% | 0.517 | 77% | 0.773 | S | S | . | * | trans | -62.4 | 121 | 165.1 | 178.7 | 0 | 0 | 0 | 0 | 108 | S33 Y37 | S33-S35 PolarHBondContact O-N 3.02Å; S35-Y37 PolarHBondContact O-N 2.89Å | ||
| 36 | P | 57.3 | Low | 48.2 | Very low | 121 Ų | 121 | 136.6 Ų | 136.6 | 79% | 0.786 | 78% | 0.777 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | 17.5 | -176.4 | 30.4 | -35 | 0 | 0 | 0 | 113.3 | S34 | S34-P36 WeakPolarHBondContact O-CD 3.39Š|
| 37 | Y | 46.8 | Very low | 48.5 | Very low | 193 Ų | 193 | 136.2 Ų | 136.2 | 76% | 0.757 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.9 | -6.9 | -170.6 | -158.3 | -102.5 | 0 | 0 | 0 | 114.9 | S35 S39 | S35-Y37 PolarHBondContact O-N 2.89Å; Y37-S39 VanDerWaalsContact C-N 3.3Å; Y37-S39 PolarHBondContact O-N 3.45Å |
| 38 | T | 46.9 | Very low | 48.8 | Very low | 114 Ų | 114 | 136 Ų | 136 | 70% | 0.699 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.8 | 19.5 | 175.2 | 35.2 | 0 | 0 | 0 | 0 | 113.9 | ||
| 39 | S | 48.8 | Very low | 49 | Very low | 89 Ų | 89 | 135.1 Ų | 135.1 | 62% | 0.622 | 78% | 0.779 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.9 | -3 | -179.6 | -172.7 | 0 | 0 | 0 | 0 | 114.9 | Y37 | Y37-S39 VanDerWaalsContact C-N 3.3Å; Y37-S39 PolarHBondContact O-N 3.45Å |
| 40 | W | 52.4 | Low | 49.1 | Very low | 217 Ų | 217 | 135.9 Ų | 135.9 | 82% | 0.822 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -107.8 | 4.9 | -169.4 | -65 | 102.6 | 0 | 0 | 0 | 115.6 | ||
| 41 | V | 56.3 | Low | 49.2 | Very low | 125 Ų | 125 | 135.2 Ų | 135.2 | 76% | 0.758 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -120 | 4 | -180 | -62.7 | 0 | 0 | 0 | 0 | 115.1 | ||
| 42 | E | 47.9 | Very low | 49.7 | Very low | 167 Ų | 167 | 136.2 Ų | 136.2 | 78% | 0.78 | 78% | 0.778 | S | S | * | * | trans | -123.3 | 78.1 | 172.5 | -112 | 122.3 | 156.5 | 0 | 0 | 111 | ||||
| 43 | C | 49.8 | Very low | 49.6 | Very low | 127 Ų | 127 | 139.6 Ų | 139.6 | 86% | 0.858 | 78% | 0.78 | S | S | * | * | trans | -130.1 | 16.8 | 161.9 | -91.3 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 44 | D | 49.9 | Very low | 49.2 | Very low | 164 Ų | 164 | 137.5 Ų | 137.5 | 88% | 0.877 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -132.3 | 57.1 | -178.1 | -116.8 | -64.8 | 0 | 0 | 0 | 111.1 | ||
| 45 | R | 54.3 | Low | 48.5 | Very low | 233 Ų | 233 | 136.6 Ų | 136.6 | 88% | 0.879 | 77% | 0.768 | S | S | * | * | trans | -164.7 | 86.4 | 155.3 | -143.6 | 169.2 | -165.2 | -126 | 0.1 | 113.1 | ||||
| 46 | S | 43.1 | Very low | 48.3 | Very low | 121 Ų | 121 | 142.4 Ų | 142.4 | 85% | 0.846 | 79% | 0.785 | S | S | * | * | trans | -145.7 | 113.4 | 153.8 | -80.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 47 | P | 54 | Low | 47.9 | Very low | 108 Ų | 108 | 143.7 Ų | 143.7 | 70% | 0.701 | 78% | 0.78 | S | S | * | * | trans | -62.8 | 142.6 | 173.7 | -22.9 | 34.2 | 0 | 0 | 0 | 113.3 | M49 | P47-M49 PolarHBondContact O-N 3.19Š| ||
| 48 | C | 47.6 | Very low | 48 | Very low | 119 Ų | 119 | 140.3 Ų | 140.3 | 80% | 0.804 | 78% | 0.782 | S | S | * | * | trans | -51.2 | 126.4 | 165.4 | 47.5 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 49 | M | 49.4 | Very low | 48.2 | Very low | 178 Ų | 178 | 139 Ų | 139 | 88% | 0.877 | 78% | 0.777 | S | S | * | * | trans | -109.8 | 119.6 | 164.2 | -70.1 | -76.5 | 92.5 | 0 | 0 | 108.3 | P47 | P47-M49 PolarHBondContact O-N 3.19Š| ||
| 50 | S | 46.5 | Very low | 48.9 | Very low | 115 Ų | 115 | 140.2 Ų | 140.2 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | -82.6 | 150.1 | 176 | 176 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 51 | S | 51.5 | Low | 48.2 | Very low | 115 Ų | 115 | 137 Ų | 137 | 80% | 0.804 | 78% | 0.782 | S | S | * | * | trans | 178.3 | 110.4 | 142.2 | -88.5 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 52 | D | 42.5 | Very low | 48 | Very low | 139 Ų | 139 | 135 Ų | 135 | 74% | 0.743 | 77% | 0.773 | S | S | * | * | 75.4 | 103.5 | 86.1 | -167.8 | -102.7 | 0 | 0 | 0 | 113 | |||||
| 53 | E | 52.5 | Low | 47.9 | Very low | 196 Ų | 196 | 132.4 Ų | 132.4 | 92% | 0.916 | 77% | 0.769 | S | S | * | * | trans | -146.9 | 119.4 | 153.9 | -71.3 | -89.2 | 70.3 | 0 | 0 | 105.6 | ||||
| 54 | G | 38.8 | Very low | 48 | Very low | 65 Ų | 65 | 135.9 Ų | 135.9 | 67% | 0.67 | 77% | 0.77 | S | S | * | * | trans | -93.8 | -172.7 | -161.8 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 55 | S | 38 | Very low | 48.3 | Very low | 88 Ų | 88 | 133.3 Ų | 133.3 | 62% | 0.615 | 76% | 0.762 | S | S | * | * | trans | 82.6 | 102.6 | 145.7 | -139.2 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 56 | F | 39 | Very low | 47.7 | Very low | 197 Ų | 197 | 129.3 Ų | 129.3 | 86% | 0.864 | 76% | 0.758 | S | S | * | * | 169 | 119.2 | 90.3 | -85.3 | -72.5 | 0 | 0 | 0 | 110.2 | |||||
| 57 | E | 49.5 | Very low | 47.7 | Very low | 148 Ų | 148 | 129.6 Ų | 129.6 | 69% | 0.692 | 75% | 0.75 | S | S | * | * | trans | -79.4 | 152.9 | 160.9 | -98.2 | -79.9 | 116.9 | 0 | 0 | 109.3 | S59 | E57-S59 PolarHBondContact OE2-N 2.93Š| ||
| 58 | P | 49.3 | Very low | 47.5 | Very low | 122 Ų | 122 | 129 Ų | 129 | 79% | 0.792 | 75% | 0.748 | S | S | * | * | -145.8 | 127 | 87.7 | 32.5 | -12.8 | 0 | 0 | 0 | 116.5 | |||||
| 59 | S | 51.3 | Low | 47.8 | Very low | 86 Ų | 86 | 128.7 Ų | 128.7 | 60% | 0.601 | 75% | 0.745 | S | S | * | * | 7.3 | 171.4 | 123.9 | -108.8 | 0 | 0 | 0 | 0 | 121.6 | E57 | E57-S59 PolarHBondContact OE2-N 2.93Š| |||
| 60 | P | 63.6 | Low | 47.8 | Very low | 114 Ų | 114 | 128.4 Ų | 128.4 | 74% | 0.74 | 75% | 0.746 | S | S | * | * | cis | -141.7 | -170.3 | -9.7 | 30 | -5.7 | 0 | 0 | 0 | 115 | ||||
| 61 | D | 38.5 | Very low | 48 | Very low | 150 Ų | 150 | 129 Ų | 129 | 80% | 0.802 | 74% | 0.74 | S | S | * | * | trans | 108 | 125.6 | 151.5 | -145.3 | 55 | 0 | 0 | 0 | 115.6 | ||||
| 62 | S | 52.1 | Low | 48.1 | Very low | 82 Ų | 82 | 131.2 Ų | 131.2 | 57% | 0.573 | 74% | 0.742 | S | S | * | * | cis | -162.4 | 136.7 | 22.3 | -137.7 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 63 | T | 44.9 | Very low | 48.4 | Very low | 113 Ų | 113 | 131.9 Ų | 131.9 | 69% | 0.693 | 74% | 0.741 | S | S | * | * | 75.5 | 93.5 | 128.8 | -47.6 | 0 | 0 | 0 | 0 | 123.3 | |||||
| 64 | K | 52.2 | Low | 48.3 | Very low | 200 Ų | 200 | 128.1 Ų | 128.1 | 87% | 0.87 | 73% | 0.733 | S | S | * | * | 90.3 | 152.7 | 125.6 | -77.7 | -168.5 | 179.3 | -174.3 | 0 | 124.5 | |||||
| 65 | P | 55.7 | Low | 48.8 | Very low | 111 Ų | 111 | 130.6 Ų | 130.6 | 72% | 0.721 | 74% | 0.735 | S | S | * | * | trans | -117.6 | 176.3 | -152.9 | 43.2 | -28.7 | 0 | 0 | 0 | 114.6 | ||||
| 66 | D | 42.8 | Very low | 49.5 | Very low | 148 Ų | 148 | 134 Ų | 134 | 79% | 0.791 | 74% | 0.742 | S | S | * | * | 151.5 | 126.6 | 127.6 | -160.9 | -127 | 0 | 0 | 0 | 113.8 | |||||
| 67 | D | 42.2 | Very low | 50.1 | Low | 128 Ų | 128 | 133.8 Ų | 133.8 | 68% | 0.684 | 74% | 0.735 | S | S | * | * | trans | 128 | 128.1 | 132.4 | -150.7 | -113.3 | 0 | 0 | 0 | 119.3 | ||||
| 68 | S | 50 | Low | 50.3 | Low | 94 Ų | 94 | 133.1 Ų | 133.1 | 66% | 0.657 | 74% | 0.735 | S | S | * | * | trans | 84.7 | 114.6 | 153 | -80.4 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 69 | P | 53.3 | Low | 50.6 | Low | 113 Ų | 113 | 134.3 Ų | 134.3 | 73% | 0.734 | 73% | 0.728 | S | S | * | * | trans | -99 | 136.2 | 174.7 | 36.8 | -27.4 | 0 | 0 | 0 | 111.7 | ||||
| 70 | L | 49.7 | Very low | 51.1 | Low | 172 Ų | 172 | 139.9 Ų | 139.9 | 90% | 0.901 | 74% | 0.741 | S | S | * | * | trans | -148.3 | 98.5 | 149.7 | -77.8 | -173.8 | 0 | 0 | 0 | 110.2 | L72 | L70-L72 PolarHBondContact O-N 3.33Š| ||
| 71 | D | 50.3 | Low | 51 | Low | 127 Ų | 127 | 139.1 Ų | 139.1 | 68% | 0.679 | 74% | 0.738 | S | S | * | * | trans | -19.7 | 109.7 | 145 | -179.8 | 31.6 | 0 | 0 | 0 | 114.4 | E73 | D71-E73 WeakPolarHBondContact OD1-CG 3.41Š| ||
| 72 | L | 53.2 | Low | 52.6 | Low | 162 Ų | 162 | 141.7 Ų | 141.7 | 85% | 0.848 | 74% | 0.742 | S | S | * | * | trans | -141 | 71.8 | 154 | -74.8 | -179.1 | 0 | 0 | 0 | 107.8 | L70 P74 | L70-L72 PolarHBondContact O-N 3.33Å; L72-P74 WeakPolarHBondContact O-CD 3.19Å | ||
| 73 | E | 50.3 | Low | 53.8 | Low | 154 Ų | 154 | 147.2 Ų | 147.2 | 72% | 0.72 | 76% | 0.756 | S | S | * | * | trans | -46.8 | 113.7 | 162 | -72.5 | -77.7 | 113.2 | 0 | 0 | 110.8 | D71 V75 | D71-E73 WeakPolarHBondContact OD1-CG 3.41Å; E73-V75 VanDerWaalsContact C-N 3.26Å; E73-V75 PolarHBondContact O-N 3.08Å | ||
| 74 | P | 49.1 | Very low | 55.8 | Low | 116 Ų | 116 | 152.7 Ų | 152.7 | 75% | 0.753 | 76% | 0.764 | S | S | * | * | trans | -73.7 | 91.2 | 164.6 | -8.4 | 26.9 | 0 | 0 | 0 | 106.8 | L72 E76 | L72-P74 WeakPolarHBondContact O-CD 3.19Å; P74-E76 PolarHBondContact O-N 3.06Å | ||
| 75 | V | 50.4 | Low | 57.5 | Low | 117 Ų | 117 | 154.1 Ų | 154.1 | 71% | 0.709 | 76% | 0.764 | S | S | * | * | trans | -35.4 | 111.3 | 169.8 | 165.3 | 0 | 0 | 0 | 0 | 109.4 | E73 R77 | E73-V75 VanDerWaalsContact C-N 3.26Å; E73-V75 PolarHBondContact O-N 3.08Å; V75-R77 VanDerWaalsContact C-N 3.29Å; V75-R77 PolarHBondContact O-N 3.38Å | ||
| 76 | E | 51.6 | Low | 59.2 | Low | 160 Ų | 160 | 154.9 Ų | 154.9 | 75% | 0.748 | 77% | 0.766 | S | S | * | * | trans | -56.1 | 91.6 | 176 | -68.2 | -164.5 | 136.6 | 0 | 0 | 109.6 | P74 I78 | P74-E76 PolarHBondContact O-N 3.06Å; E76-I78 HydrophobicContact CB-CG1 4.05Å; E76-I78 PolarHBondContact O-N 3.34Å | ||
| 77 | R | 52.2 | Low | 61.7 | Low | 193 Ų | 193 | 155.2 Ų | 155.2 | 73% | 0.728 | 77% | 0.767 | S | S | * | * | trans | -76.2 | 80.4 | 161.2 | -62.2 | -168.2 | -147.4 | -158.2 | 12.5 | 106.6 | V75 K79 | V75-R77 VanDerWaalsContact C-N 3.29Å; V75-R77 PolarHBondContact O-N 3.38Å; R77-K79 HydrophobicContact CB-CD 4.48Å; R77-K79 HydrophobicContact CB-CG 4.27Å; R77-K79 PolarHBondContact O-N 3.4Å | ||
| 78 | I | 54 | Low | 64.3 | Low | 133 Ų | 133 | 152.2 Ų | 152.2 | 68% | 0.682 | 75% | 0.748 | S | S | * | * | trans | -68 | 62 | 162.1 | -49.9 | 178.6 | 0 | 0 | 0 | 107.9 | E76 K80 | E76-I78 HydrophobicContact CB-CG1 4.05Å; E76-I78 PolarHBondContact O-N 3.34Å; I78-K80 VanDerWaalsContact C-N 3.3Å; I78-K80 PolarHBondContact O-N 3.36Å; I78-K80 VanDerWaalsContact O-N 3.08Å | ||
| 79 | K | 54.4 | Low | 66.6 | Low | 148 Ų | 148 | 150.5 Ų | 150.5 | 64% | 0.643 | 74% | 0.736 | S | S | * | * | trans | -73.3 | 95.1 | 161 | -71.5 | 176 | -179.7 | 180 | 0 | 104.5 | R77 S81 | R77-K79 HydrophobicContact CB-CD 4.48Å; R77-K79 HydrophobicContact CB-CG 4.27Å; R77-K79 PolarHBondContact O-N 3.4Å; K79-S81 VanDerWaalsContact O-CA 3.3Å; K79-S81 WeakPolarHBondContact O-CA 3.44Å; K79-S81 WeakPolarHBondContact O-CB 3.48Å; K79-S81 PolarHBondContact O-N 3.07Å | ||
| 80 | K | 63.3 | Low | 68.8 | Low | 202 Ų | 202 | 152.4 Ų | 152.4 | 88% | 0.878 | 73% | 0.733 | S | S | * | * | trans | -22.6 | 83.7 | 166 | -55.7 | 169 | -172.2 | 179.9 | 0 | 110.9 | I78 K82 | I78-K80 VanDerWaalsContact C-N 3.3Å; I78-K80 PolarHBondContact O-N 3.36Å; I78-K80 VanDerWaalsContact O-N 3.08Å; K80-K82 PolarHBondContact O-N 3.28Å | ||
| 81 | S | 60 | Low | 71.1 | Confident | 99 Ų | 99 | 147.4 Ų | 147.4 | 69% | 0.692 | 72% | 0.717 | S | S | * | * | trans | -83.6 | 119.1 | -167.3 | 101.2 | 0 | 0 | 0 | 0 | 106.4 | K79 K83 | K79-S81 VanDerWaalsContact O-CA 3.3Å; K79-S81 WeakPolarHBondContact O-CA 3.44Å; K79-S81 WeakPolarHBondContact O-CB 3.48Å; K79-S81 PolarHBondContact O-N 3.07Å; S81-K83 PolarHBondContact O-N 3.03Å | ||
| 82 | K | 73.8 | Confident | 73.4 | Confident | 203 Ų | 203 | 143.2 Ų | 143.2 | 88% | 0.883 | 69% | 0.693 | S | S | * | * | trans | -57.7 | 111.9 | 167.9 | -95.6 | 164.2 | 172.9 | 152.4 | 0 | 106.1 | K80 R84 | K80-K82 PolarHBondContact O-N 3.28Å; K82-R84 PolarHBondContact O-N 3.43Å | ||
| 83 | K | 76.4 | Confident | 75.5 | Confident | 199 Ų | 199 | 137.1 Ų | 137.1 | 87% | 0.865 | 66% | 0.662 | S | S | * | * | trans | -46.7 | 112 | 176.6 | -88.9 | 135.9 | 174 | 166.8 | 0 | 108.3 | S81 R85 | S81-K83 PolarHBondContact O-N 3.03Å; K83-R85 PolarHBondContact O-N 2.9Å | ||
| 84 | R | 85.9 | Confident | 77.8 | Confident | 227 Ų | 227 | 133.9 Ų | 133.9 | 86% | 0.857 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 131.7 | 178.5 | -172.6 | -172.3 | -61.4 | -113.7 | 2.6 | 107.4 | K82 V86 | K82-R84 PolarHBondContact O-N 3.43Å; R84-V86 PolarHBondContact O-N 2.87Å |
| 85 | R | 89.8 | Confident | 80.2 | Confident | 231 Ų | 231 | 131.3 Ų | 131.3 | 87% | 0.872 | 63% | 0.627 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 127.8 | 174.5 | -69.1 | -177 | -175.5 | 166.6 | 1.6 | 108.6 | K83 | K83-R85 PolarHBondContact O-N 2.9Š|
| 86 | V | 90.8 | Very high | 82.5 | Confident | 126 Ų | 126 | 125.7 Ų | 125.7 | 76% | 0.764 | 59% | 0.593 | S | S | * | * | P | Polyproline II helix | trans | -95 | 134.8 | 173.5 | -178.4 | 0 | 0 | 0 | 0 | 108.2 | R84 | R84-V86 PolarHBondContact O-N 2.87Š|
| 87 | L | 95.1 | Very high | 84.7 | Confident | 155 Ų | 155 | 121.3 Ų | 121.3 | 81% | 0.812 | 57% | 0.573 | S | S | * | * | P | Polyproline II helix | trans | -98.3 | 149.7 | 175.5 | -59.9 | 179.1 | 0 | 0 | 0 | 109.9 | ||
| 88 | F | 97.6 | Very high | 86.9 | Confident | 65 Ų | 65 | 118 Ų | 118 | 29% | 0.285 | 56% | 0.56 | S | S | . | * | P | Polyproline II helix | trans | -73.3 | 147.9 | 171.6 | -58.2 | -40.4 | 0 | 0 | 0 | 110.7 | Q92 L96 L120 Q124 W128 | F88-Q92 HydrophobicContact CB-CB 4.22Å; F88-L96 HydrophobicContact CD2-CD1 4.32Å; F88-L120 HydrophobicContact CD1-CD1 4.35Å; F88-L120 HydrophobicContact CD1-CD2 3.75Å; F88-L120 HydrophobicContact CE1-CD1 4.27Å; F88-L120 HydrophobicContact CE1-CD2 3.7Å; F88-Q124 HydrophobicContact CE1-CB 4.23Å; F88-Q124 HydrophobicContact CE1-CG 4.26Å; F88-Q124 HydrophobicContact CZ-CB 3.92Å; F88-Q124 HydrophobicContact CZ-CG 4.2Å; F88-W128 AromaticContact CD2-CD1 3.68Å; F88-W128 HydrophobicContact CE2-CB 4.18Å; F88-W128 AromaticContact CE2-CD1 3.59Å; F88-W128 HydrophobicContact CE2-CG 4.22Å |
| 89 | S | 98.3 | Very high | 89 | Confident | 58 Ų | 58 | 115 Ų | 115 | 41% | 0.406 | 54% | 0.54 | S | S | . | . | P | Polyproline II helix | trans | -66.6 | 164.5 | 173.9 | 83.4 | 0 | 0 | 0 | 0 | 111.2 | A91 Q92 T93 | S89-A91 VanDerWaalsContact C-N 3.34Å; S89-A91 PolarHBondContact O-N 3.02Å; S89-Q92 PolarHBondContact O-N 2.93Å; S89-Q92 WeakPolarHBondContact OG-CG 3.39Å; S89-Q92 PolarHBondContact OG-N 3.39Å; S89-Q92 VanDerWaalsContact OG-N 3.16Å; S89-T93 PolarHBondContact O-N 3.47Å; S89-T93 PolarHBondContact O-OG1 3.36Å |
| 90 | K | 98.1 | Very high | 91.1 | Very high | 154 Ų | 154 | 108.2 Ų | 108.2 | 67% | 0.67 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.2 | -44.1 | 176.3 | -174.6 | 62.2 | 172.9 | 179.7 | 0 | 111.4 | T93 L94 | K90-T93 PolarHBondContact O-N 3.16Å; K90-L94 HydrophobicContact CG-CD1 4.26Å; K90-L94 WeakPolarHBondContact O-CG 3.19Å; K90-L94 PolarHBondContact O-N 3.44Å |
| 91 | A | 98.1 | Very high | 92.8 | Very high | 67 Ų | 67 | 108.1 Ų | 108.1 | 55% | 0.554 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.5 | -45 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | S89 T93 L94 E95 | S89-A91 VanDerWaalsContact C-N 3.34Å; S89-A91 PolarHBondContact O-N 3.02Å; A91-T93 VanDerWaalsContact C-N 3.32Å; A91-T93 PolarHBondContact O-N 2.88Å; A91-L94 PolarHBondContact O-N 2.91Å; A91-E95 PolarHBondContact O-N 2.91Å; A91-E95 VanDerWaalsContact O-N 3.08Å |
| 92 | Q | 98.5 | Very high | 94.6 | Very high | 39 Ų | 39 | 109.1 Ų | 109.1 | 18% | 0.182 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -59 | -44.6 | 175.6 | -74.1 | 173.6 | -30.1 | 0 | 0 | 111.4 | F88 S89 E95 L96 L118 | F88-Q92 HydrophobicContact CB-CB 4.22Å; S89-Q92 PolarHBondContact O-N 2.93Å; S89-Q92 WeakPolarHBondContact OG-CG 3.39Å; S89-Q92 PolarHBondContact OG-N 3.39Å; S89-Q92 VanDerWaalsContact OG-N 3.16Å; Q92-E95 PolarHBondContact O-N 3.02Å; Q92-L96 WeakPolarHBondContact O-CB 3.41Å; Q92-L96 WeakPolarHBondContact O-CD1 3.41Å; Q92-L96 WeakPolarHBondContact O-CG 3.15Å; Q92-L96 PolarHBondContact O-N 3.3Å; Q92-L118 PolarHBondContact NE2-O 3.32Å |
| 93 | T | 98.4 | Very high | 95.7 | Very high | 34 Ų | 34 | 102.2 Ų | 102.2 | 21% | 0.209 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -63.5 | -43.4 | 179.3 | -56.3 | 0 | 0 | 0 | 0 | 111.7 | S89 K90 A91 L96 E97 | S89-T93 PolarHBondContact O-N 3.47Å; S89-T93 PolarHBondContact O-OG1 3.36Å; K90-T93 PolarHBondContact O-N 3.16Å; A91-T93 VanDerWaalsContact C-N 3.32Å; A91-T93 PolarHBondContact O-N 2.88Å; T93-L96 PolarHBondContact O-N 3.47Å; T93-E97 HydrophobicContact CG2-CG 4.48Å; T93-E97 WeakPolarHBondContact O-CB 3.29Å; T93-E97 VanDerWaalsContact O-CG 3.29Å; T93-E97 WeakPolarHBondContact O-CG 3.49Å; T93-E97 PolarHBondContact O-N 3.37Å |
| 94 | L | 98.4 | Very high | 96.7 | Very high | 85 Ų | 85 | 99 Ų | 99 | 45% | 0.445 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63.5 | -42.8 | 179.5 | -72.4 | 173.2 | 0 | 0 | 0 | 112.4 | K90 A91 E97 R98 | K90-L94 HydrophobicContact CG-CD1 4.26Å; K90-L94 WeakPolarHBondContact O-CG 3.19Å; K90-L94 PolarHBondContact O-N 3.44Å; A91-L94 PolarHBondContact O-N 2.91Å; L94-E97 PolarHBondContact O-N 3.46Å; L94-R98 WeakPolarHBondContact O-CB 3.49Å; L94-R98 PolarHBondContact O-N 3.1Å |
| 95 | E | 98.6 | Very high | 97.3 | Very high | 62 Ų | 62 | 95.3 Ų | 95.3 | 29% | 0.29 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -67.9 | -38.6 | 177.1 | -77.5 | -60.6 | 137.7 | 0 | 0 | 112.4 | A91 Q92 E97 R98 R99 L118 | A91-E95 PolarHBondContact O-N 2.91Å; A91-E95 VanDerWaalsContact O-N 3.08Å; Q92-E95 PolarHBondContact O-N 3.02Å; E95-E97 VanDerWaalsContact C-N 3.33Å; E95-E97 PolarHBondContact O-N 2.89Å; E95-R98 VanDerWaalsContact CD-NH1 3.34Å; E95-R98 PolarHBondContact O-N 3.23Å; E95-R98 IonicContact OE1-CZ 3.46Å; E95-R98 IonicContact OE1-NE 3.39Å; E95-R98 IonicContact OE1-NH1 2.79Å; E95-R98 PolarHBondContact OE1-NH1 2.95Å; E95-R98 IonicContact OE2-CZ 2.94Å; E95-R98 IonicContact OE2-NE 3.84Å; E95-R98 PolarHBondContact OE2-NE 3.39Å; E95-R98 IonicContact OE2-NH1 3.1Å; E95-R98 PolarHBondContact OE2-NH1 3.37Å; E95-R98 VanDerWaalsContact OE2-NH1 3.1Å; E95-R98 IonicContact OE2-NH2 3.36Å; E95-R98 PolarHBondContact OE2-NH2 3.01Å; E95-R99 PolarHBondContact O-N 3.42Å; E95-L118 HydrophobicContact CB-CD1 4.05Å; E95-L118 HydrophobicContact CB-CD2 3.51Å; E95-L118 HydrophobicContact CB-CG 4.42Å; E95-L118 HydrophobicContact CG-CD2 3.93Å |
| 96 | L | 98.6 | Very high | 97.7 | Very high | 0 Ų | 0 | 85.3 Ų | 85.3 | 0% | 0 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -59.5 | -44.6 | 171.8 | -72.2 | 165.4 | 0 | 0 | 0 | 111.2 | F88 Q92 T93 R99 F100 L114 L118 L120 V125 W128 F129 | F88-L96 HydrophobicContact CD2-CD1 4.32Å; Q92-L96 WeakPolarHBondContact O-CB 3.41Å; Q92-L96 WeakPolarHBondContact O-CD1 3.41Å; Q92-L96 WeakPolarHBondContact O-CG 3.15Å; Q92-L96 PolarHBondContact O-N 3.3Å; T93-L96 PolarHBondContact O-N 3.47Å; L96-R99 PolarHBondContact O-N 3.24Å; L96-F100 VanDerWaalsContact O-CB 3.29Å; L96-F100 WeakPolarHBondContact O-CB 3.44Å; L96-F100 PolarHBondContact O-N 2.77Å; L96-L114 HydrophobicContact CD2-CD2 4.02Å; L96-L118 HydrophobicContact CD2-CD1 3.86Å; L96-L118 HydrophobicContact CG-CD1 3.74Å; L96-L120 HydrophobicContact CD1-CD1 4.14Å; L96-V125 HydrophobicContact CD2-CG1 4.32Å; L96-V125 HydrophobicContact CD2-CG2 4.48Å; L96-W128 HydrophobicContact CB-CD2 3.9Å; L96-W128 HydrophobicContact CB-CE3 3.89Å; L96-W128 HydrophobicContact CB-CH2 3.68Å; L96-W128 HydrophobicContact CB-CZ2 3.67Å; L96-W128 HydrophobicContact CB-CZ3 3.79Å; L96-W128 HydrophobicContact CD1-CD2 3.86Å; L96-W128 HydrophobicContact CD1-CG 3.83Å; L96-W128 HydrophobicContact CD2-CD2 4.4Å; L96-W128 HydrophobicContact CD2-CE3 4.3Å; L96-W128 HydrophobicContact CG-CD2 4.27Å; L96-W128 HydrophobicContact CG-CE3 4.46Å; L96-F129 HydrophobicContact CD2-CE2 4Å |
| 97 | E | 98.4 | Very high | 98.1 | Very high | 68 Ų | 68 | 82 Ų | 82 | 32% | 0.318 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -65.3 | -41 | 176.2 | -72.8 | 174.2 | 174.1 | 0 | 0 | 112.4 | T93 L94 E95 F100 R101 W128 | T93-E97 HydrophobicContact CG2-CG 4.48Å; T93-E97 WeakPolarHBondContact O-CB 3.29Å; T93-E97 VanDerWaalsContact O-CG 3.29Å; T93-E97 WeakPolarHBondContact O-CG 3.49Å; T93-E97 PolarHBondContact O-N 3.37Å; L94-E97 PolarHBondContact O-N 3.46Å; E95-E97 VanDerWaalsContact C-N 3.33Å; E95-E97 PolarHBondContact O-N 2.89Å; E97-F100 PolarHBondContact O-N 3.34Å; E97-R101 WeakPolarHBondContact O-CG 3.29Å; E97-R101 PolarHBondContact O-N 2.93Å; E97-W128 HydrophobicContact CB-CH2 4.45Å; E97-W128 HydrophobicContact CG-CH2 3.77Å; E97-W128 HydrophobicContact CG-CZ2 3.78Å |
| 98 | R | 98.5 | Very high | 98.2 | Very high | 123 Ų | 123 | 76.3 Ų | 76.3 | 46% | 0.464 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -58.5 | -50.1 | 175.2 | -169.5 | -175 | 90.1 | -178.3 | 11.9 | 110.7 | L94 E95 R101 | L94-R98 WeakPolarHBondContact O-CB 3.49Å; L94-R98 PolarHBondContact O-N 3.1Å; E95-R98 VanDerWaalsContact CD-NH1 3.34Å; E95-R98 PolarHBondContact O-N 3.23Å; E95-R98 IonicContact OE1-CZ 3.46Å; E95-R98 IonicContact OE1-NE 3.39Å; E95-R98 IonicContact OE1-NH1 2.79Å; E95-R98 PolarHBondContact OE1-NH1 2.95Å; E95-R98 IonicContact OE2-CZ 2.94Å; E95-R98 IonicContact OE2-NE 3.84Å; E95-R98 PolarHBondContact OE2-NE 3.39Å; E95-R98 IonicContact OE2-NH1 3.1Å; E95-R98 PolarHBondContact OE2-NH1 3.37Å; E95-R98 VanDerWaalsContact OE2-NH1 3.1Å; E95-R98 IonicContact OE2-NH2 3.36Å; E95-R98 PolarHBondContact OE2-NH2 3.01Å; R98-R101 PolarHBondContact O-N 3.11Å |
| 99 | R | 98.4 | Very high | 98.2 | Very high | 69 Ų | 69 | 77.6 Ų | 77.6 | 26% | 0.26 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -66.1 | -38 | 178 | -170.8 | 62.7 | 176.6 | 159.2 | 3.4 | 111.8 | E95 L96 R101 Q102 Q103 L106 E110 L114 F129 | E95-R99 PolarHBondContact O-N 3.42Å; L96-R99 PolarHBondContact O-N 3.24Å; R99-R101 PolarHBondContact O-N 2.94Å; R99-Q102 VanDerWaalsContact NH1-OE1 3.11Å; R99-Q102 WeakPolarHBondContact O-CB 3.29Å; R99-Q102 PolarHBondContact O-N 3.45Å; R99-Q102 VanDerWaalsContact O-N 3.16Å; R99-Q103 PolarHBondContact O-N 2.97Å; R99-L106 HydrophobicContact CG-CD2 4.25Å; R99-E110 IonicContact NH2-OE1 3.96Å; R99-E110 PolarHBondContact NH2-OE1 2.94Å; R99-L114 HydrophobicContact CB-CD1 4.49Å; R99-L114 HydrophobicContact CB-CD2 4.22Å; R99-L114 HydrophobicContact CG-CD1 4.48Å; R99-L114 HydrophobicContact CG-CD2 3.98Å; R99-F129 HydrophobicContact CB-CZ 4.45Å; R99-F129 HydrophobicContact CG-CZ 4.3Å |
| 100 | F | 98.4 | Very high | 98.3 | Very high | 7 Ų | 7 | 77.4 Ų | 77.4 | 3% | 0.031 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -62.7 | -39.1 | 178.5 | -174.4 | -92.5 | 0 | 0 | 0 | 113.3 | L96 E97 Q102 Q103 R104 W128 F129 H132 R133 M136 | L96-F100 VanDerWaalsContact O-CB 3.29Å; L96-F100 WeakPolarHBondContact O-CB 3.44Å; L96-F100 PolarHBondContact O-N 2.77Å; E97-F100 PolarHBondContact O-N 3.34Å; F100-Q102 PolarHBondContact O-N 2.84Å; F100-Q103 CarbonylContact O-C 3.33Å; F100-Q103 PolarHBondContact O-N 3.32Å; F100-R104 HydrophobicContact CE1-CG 3.96Å; F100-R104 HydrophobicContact CE2-CB 4.06Å; F100-R104 HydrophobicContact CE2-CG 4.2Å; F100-R104 HydrophobicContact CZ-CB 4.02Å; F100-R104 HydrophobicContact CZ-CG 3.72Å; F100-W128 HydrophobicContact CB-CH2 4.32Å; F100-W128 HydrophobicContact CB-CZ3 4.02Å; F100-W128 HydrophobicContact CD2-CZ3 4.32Å; F100-W128 HydrophobicContact CG-CZ3 4.35Å; F100-F129 HydrophobicContact CB-CE1 4.26Å; F100-F129 HydrophobicContact CB-CZ 4.35Å; F100-F129 AromaticContact CD2-CD1 3.72Å; F100-F129 HydrophobicContact CD2-CD1 3.72Å; F100-F129 AromaticContact CD2-CE1 3.73Å; F100-F129 HydrophobicContact CD2-CE1 3.73Å; F100-F129 HydrophobicContact CD2-CG 4.47Å; F100-F129 HydrophobicContact CD2-CZ 4.49Å; F100-F129 HydrophobicContact CE2-CD1 4.28Å; F100-F129 HydrophobicContact CG-CE1 4.49Å; F100-H132 AromaticContact CD1-CD2 3.31Å; F100-H132 WeakPolarHBondContact CD1-CD2 3.32Å; F100-H132 AromaticContact CD1-NE2 3.29Å; F100-H132 VanDerWaalsContact CD1-NE2 3.29Å; F100-H132 WeakPolarHBondContact CD1-NE2 3.42Å; F100-H132 HydrophobicContact CD2-CB 4.41Å; F100-H132 AromaticContact CD2-CD2 3.87Å; F100-H132 AromaticContact CE1-CD2 3.09Å; F100-H132 WeakPolarHBondContact CE1-CD2 3.41Å; F100-H132 AromaticContact CE1-NE2 3.35Å; F100-H132 WeakPolarHBondContact CE1-NE2 3.42Å; F100-H132 HydrophobicContact CE2-CB 4.28Å; F100-H132 AromaticContact CE2-CD2 3.68Å; F100-H132 AromaticContact CG-CD2 3.71Å; F100-H132 AromaticContact CG-NE2 3.96Å; F100-H132 AromaticContact CZ-CD2 3.29Å; F100-H132 WeakPolarHBondContact CZ-CD2 3.4Å; F100-R133 HydrophobicContact CE2-CG 3.74Å; F100-R133 HydrophobicContact CZ-CG 3.93Å; F100-M136 HydrophobicContact CE1-SD 4.4Å |
| 101 | R | 97.8 | Very high | 98.3 | Very high | 200 Ų | 200 | 73.1 Ų | 73.1 | 76% | 0.755 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -60.7 | -35.9 | 175 | -76.8 | -173.3 | -72.2 | 161.3 | -4.6 | 112.1 | E97 R98 R99 | E97-R101 WeakPolarHBondContact O-CG 3.29Å; E97-R101 PolarHBondContact O-N 2.93Å; R98-R101 PolarHBondContact O-N 3.11Å; R99-R101 PolarHBondContact O-N 2.94Å |
| 102 | Q | 98 | Very high | 98.3 | Very high | 120 Ų | 120 | 74.4 Ų | 74.4 | 56% | 0.561 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -74 | -43.2 | 176.2 | -61.2 | 169.1 | 3.3 | 0 | 0 | 111.3 | R99 F100 | R99-Q102 VanDerWaalsContact NH1-OE1 3.11Å; R99-Q102 WeakPolarHBondContact O-CB 3.29Å; R99-Q102 PolarHBondContact O-N 3.45Å; R99-Q102 VanDerWaalsContact O-N 3.16Å; F100-Q102 PolarHBondContact O-N 2.84Å |
| 103 | Q | 97.9 | Very high | 98.3 | Very high | 57 Ų | 57 | 78 Ų | 78 | 27% | 0.266 | 36% | 0.363 | S | S | . | . | trans | -149.2 | 113.2 | -171.9 | -173.7 | 174.9 | -34.1 | 0 | 0 | 111.1 | R99 F100 Y105 L106 E110 F129 | R99-Q103 PolarHBondContact O-N 2.97Å; F100-Q103 CarbonylContact O-C 3.33Å; F100-Q103 PolarHBondContact O-N 3.32Å; Q103-Y105 VanDerWaalsContact C-N 3.27Å; Q103-Y105 WeakPolarHBondContact CG-O 3.49Å; Q103-Y105 PolarHBondContact NE2-O 3.31Å; Q103-Y105 PolarHBondContact O-N 3.36Å; Q103-L106 HydrophobicContact CB-CD2 4.43Å; Q103-L106 HydrophobicContact CG-CD2 4.24Å; Q103-E110 PolarHBondContact NE2-OE1 3.43Å; Q103-E110 PolarHBondContact NE2-OE2 3.24Å; Q103-E110 PolarHBondContact OE1-OE1 3.29Å; Q103-E110 VanDerWaalsContact OE1-OE1 3.11Å; Q103-F129 WeakPolarHBondContact O-CE1 3.44Å | ||
| 104 | R | 97.5 | Very high | 98.3 | Very high | 131 Ų | 131 | 77 Ų | 77 | 49% | 0.494 | 36% | 0.356 | S | S | . | . | S | Bend | trans | -73.7 | -16.6 | -175.8 | -68.9 | -177.6 | 157.3 | 105.5 | -3.2 | 114.2 | F100 R133 M136 | F100-R104 HydrophobicContact CE1-CG 3.96Å; F100-R104 HydrophobicContact CE2-CB 4.06Å; F100-R104 HydrophobicContact CE2-CG 4.2Å; F100-R104 HydrophobicContact CZ-CB 4.02Å; F100-R104 HydrophobicContact CZ-CG 3.72Å; R104-R133 WeakPolarHBondContact O-CD 3.47Å; R104-M136 PolarHBondContact NH2-SD 3.26Å |
| 105 | Y | 98.3 | Very high | 98.3 | Very high | 151 Ų | 151 | 73 Ų | 73 | 59% | 0.592 | 34% | 0.336 | S | S | * | . | S | Bend | trans | -137.5 | 119.8 | -175.8 | -66.3 | -107.9 | 0 | 0 | 0 | 109.4 | Q103 | Q103-Y105 VanDerWaalsContact C-N 3.27Å; Q103-Y105 WeakPolarHBondContact CG-O 3.49Å; Q103-Y105 PolarHBondContact NE2-O 3.31Å; Q103-Y105 PolarHBondContact O-N 3.36Å |
| 106 | L | 98.2 | Very high | 98.3 | Very high | 20 Ų | 20 | 78 Ų | 78 | 11% | 0.105 | 35% | 0.352 | C | S | . | . | trans | -97.3 | 137.7 | 176.9 | -59.9 | 179.7 | 0 | 0 | 0 | 111.2 | R99 Q103 E110 R111 L114 V125 F129 | R99-L106 HydrophobicContact CG-CD2 4.25Å; Q103-L106 HydrophobicContact CB-CD2 4.43Å; Q103-L106 HydrophobicContact CG-CD2 4.24Å; L106-E110 HydrophobicContact CB-CB 4.36Å; L106-E110 HydrophobicContact CD2-CB 4.32Å; L106-R111 HydrophobicContact CB-CB 4.42Å; L106-L114 HydrophobicContact CD1-CD2 3.74Å; L106-V125 HydrophobicContact CD1-CG1 4.05Å; L106-F129 HydrophobicContact CD1-CD1 4.29Å; L106-F129 HydrophobicContact CD1-CD2 4.17Å; L106-F129 HydrophobicContact CD1-CE1 3.77Å; L106-F129 HydrophobicContact CD1-CE2 3.63Å; L106-F129 HydrophobicContact CD1-CG 4.49Å; L106-F129 HydrophobicContact CD1-CZ 3.42Å; L106-F129 VanDerWaalsContact CD1-CZ 3.42Å; L106-F129 HydrophobicContact CD2-CE1 4.19Å; L106-F129 HydrophobicContact CD2-CZ 4.34Å; L106-F129 HydrophobicContact CG-CD1 4.06Å; L106-F129 HydrophobicContact CG-CE1 3.6Å; L106-F129 HydrophobicContact CG-CE2 4.39Å; L106-F129 HydrophobicContact CG-CZ 3.8Å | ||
| 107 | S | 98.3 | Very high | 98.3 | Very high | 57 Ų | 57 | 84 Ų | 84 | 40% | 0.399 | 38% | 0.383 | S | S | . | . | trans | -67.8 | 171.4 | 164.9 | 67.6 | 0 | 0 | 0 | 0 | 111.3 | E110 R111 | S107-E110 VanDerWaalsContact CB-OE2 3.27Å; S107-E110 WeakPolarHBondContact CB-OE2 3.49Å; S107-E110 PolarHBondContact N-OE2 2.87Å; S107-E110 WeakPolarHBondContact OG-CG 3.21Å; S107-E110 PolarHBondContact OG-OE2 3.44Å; S107-R111 WeakPolarHBondContact O-CB 3.35Å; S107-R111 PolarHBondContact O-N 3.25Å; S107-R111 VanDerWaalsContact O-N 3.15Å | ||
| 108 | G | 98.2 | Very high | 98.3 | Very high | 36 Ų | 36 | 81.7 Ų | 81.7 | 37% | 0.371 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -55.8 | -57.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | E110 R111 E112 | G108-E110 PolarHBondContact O-N 3.37Å; G108-R111 WeakPolarHBondContact O-CB 3.29Å; G108-R111 PolarHBondContact O-N 3.16Å; G108-E112 PolarHBondContact O-N 3.46Å; G108-E112 VanDerWaalsContact O-N 3.1Å |
| 109 | P | 98.4 | Very high | 98.3 | Very high | 91 Ų | 91 | 81 Ų | 81 | 59% | 0.591 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -60.9 | -40.9 | -178 | -26 | 35.3 | 0 | 0 | 0 | 113.6 | R111 E112 Q113 | P109-R111 VanDerWaalsContact C-N 3.29Å; P109-R111 PolarHBondContact O-N 3.47Å; P109-E112 WeakPolarHBondContact O-CB 3.16Å; P109-E112 PolarHBondContact O-N 3.04Å; P109-Q113 PolarHBondContact O-N 2.9Å |
| 110 | E | 98.4 | Very high | 98.2 | Very high | 55 Ų | 55 | 78.8 Ų | 78.8 | 26% | 0.257 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -64.6 | -36.5 | 178.9 | -66.7 | 171.6 | 117.5 | 0 | 0 | 112.2 | R99 Q103 L106 S107 G108 Q113 L114 | R99-E110 IonicContact NH2-OE1 3.96Å; R99-E110 PolarHBondContact NH2-OE1 2.94Å; Q103-E110 PolarHBondContact NE2-OE1 3.43Å; Q103-E110 PolarHBondContact NE2-OE2 3.24Å; Q103-E110 PolarHBondContact OE1-OE1 3.29Å; Q103-E110 VanDerWaalsContact OE1-OE1 3.11Å; L106-E110 HydrophobicContact CB-CB 4.36Å; L106-E110 HydrophobicContact CD2-CB 4.32Å; S107-E110 VanDerWaalsContact CB-OE2 3.27Å; S107-E110 WeakPolarHBondContact CB-OE2 3.49Å; S107-E110 PolarHBondContact N-OE2 2.87Å; S107-E110 WeakPolarHBondContact OG-CG 3.21Å; S107-E110 PolarHBondContact OG-OE2 3.44Å; G108-E110 PolarHBondContact O-N 3.37Å; E110-Q113 PolarHBondContact O-N 2.87Å; E110-L114 WeakPolarHBondContact O-CB 3.29Å; E110-L114 PolarHBondContact O-N 3.17Å |
| 111 | R | 98.6 | Very high | 98.2 | Very high | 63 Ų | 63 | 81.7 Ų | 81.7 | 24% | 0.238 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -66.4 | -41.6 | 176.1 | -172.8 | -169.6 | -56 | 159 | 5.8 | 111.1 | L106 S107 G108 P109 L114 A115 P122 V125 | L106-R111 HydrophobicContact CB-CB 4.42Å; S107-R111 WeakPolarHBondContact O-CB 3.35Å; S107-R111 PolarHBondContact O-N 3.25Å; S107-R111 VanDerWaalsContact O-N 3.15Å; G108-R111 WeakPolarHBondContact O-CB 3.29Å; G108-R111 PolarHBondContact O-N 3.16Å; P109-R111 VanDerWaalsContact C-N 3.29Å; P109-R111 PolarHBondContact O-N 3.47Å; R111-L114 PolarHBondContact O-N 3.34Å; R111-A115 WeakPolarHBondContact O-CB 3.09Å; R111-A115 PolarHBondContact O-N 3.15Å; R111-P122 WeakPolarHBondContact CD-O 3.44Å; R111-P122 HydrophobicContact CG-CB 4.21Å; R111-V125 HydrophobicContact CG-CB 3.84Å; R111-V125 HydrophobicContact CG-CG1 3.78Å |
| 112 | E | 98.6 | Very high | 98.3 | Very high | 94 Ų | 94 | 74.8 Ų | 74.8 | 44% | 0.439 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -62.1 | -43.8 | 175.9 | -69.9 | 174.6 | -161 | 0 | 0 | 111.7 | G108 P109 A115 R116 P122 | G108-E112 PolarHBondContact O-N 3.46Å; G108-E112 VanDerWaalsContact O-N 3.1Å; P109-E112 WeakPolarHBondContact O-CB 3.16Å; P109-E112 PolarHBondContact O-N 3.04Å; E112-A115 WeakPolarHBondContact O-CB 3.31Å; E112-A115 PolarHBondContact O-N 3.38Å; E112-R116 WeakPolarHBondContact O-CG 3.31Å; E112-R116 PolarHBondContact O-N 2.63Å; E112-R116 IonicContact OE2-NH1 3.19Å; E112-P122 HydrophobicContact CG-CG 4.24Å |
| 113 | Q | 98.5 | Very high | 98.3 | Very high | 115 Ų | 115 | 73.4 Ų | 73.4 | 54% | 0.537 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -60.8 | -48 | 175.9 | -177.3 | 177.3 | -61.3 | 0 | 0 | 111.8 | P109 E110 A115 R116 L117 | P109-Q113 PolarHBondContact O-N 2.9Å; E110-Q113 PolarHBondContact O-N 2.87Å; Q113-A115 VanDerWaalsContact C-N 3.3Å; Q113-A115 PolarHBondContact O-N 3.19Å; Q113-R116 PolarHBondContact O-N 2.82Å; Q113-L117 HydrophobicContact CG-CD1 4.29Å; Q113-L117 WeakPolarHBondContact O-CG 3.41Å; Q113-L117 PolarHBondContact O-N 2.86Å; Q113-L117 VanDerWaalsContact O-N 3.07Å |
| 114 | L | 98.5 | Very high | 98.3 | Very high | 12 Ų | 12 | 74 Ų | 74 | 6% | 0.063 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -64.4 | -37.8 | 179.6 | -172.5 | 63.2 | 0 | 0 | 0 | 112.1 | L96 R99 L106 E110 R111 L117 L118 V125 F129 | L96-L114 HydrophobicContact CD2-CD2 4.02Å; R99-L114 HydrophobicContact CB-CD1 4.49Å; R99-L114 HydrophobicContact CB-CD2 4.22Å; R99-L114 HydrophobicContact CG-CD1 4.48Å; R99-L114 HydrophobicContact CG-CD2 3.98Å; L106-L114 HydrophobicContact CD1-CD2 3.74Å; E110-L114 WeakPolarHBondContact O-CB 3.29Å; E110-L114 PolarHBondContact O-N 3.17Å; R111-L114 PolarHBondContact O-N 3.34Å; L114-L117 PolarHBondContact O-N 2.81Å; L114-L118 HydrophobicContact CD1-CD1 3.88Å; L114-L118 HydrophobicContact CD1-CG 4.18Å; L114-L118 HydrophobicContact CG-CD1 4.04Å; L114-L118 WeakPolarHBondContact O-CG 3.22Å; L114-L118 PolarHBondContact O-N 3.17Å; L114-L118 VanDerWaalsContact O-N 3.08Å; L114-V125 HydrophobicContact CD2-CG1 3.9Å; L114-F129 HydrophobicContact CD2-CE2 3.93Å; L114-F129 HydrophobicContact CD2-CZ 4.23Å |
| 115 | A | 98.6 | Very high | 98.4 | Very high | 2 Ų | 2 | 67.7 Ų | 67.7 | 2% | 0.017 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -59.1 | -46.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | R111 E112 Q113 L118 S119 L120 P122 V125 | R111-A115 WeakPolarHBondContact O-CB 3.09Å; R111-A115 PolarHBondContact O-N 3.15Å; E112-A115 WeakPolarHBondContact O-CB 3.31Å; E112-A115 PolarHBondContact O-N 3.38Å; Q113-A115 VanDerWaalsContact C-N 3.3Å; Q113-A115 PolarHBondContact O-N 3.19Å; A115-L118 PolarHBondContact O-N 3.02Å; A115-S119 PolarHBondContact O-N 2.71Å; A115-L120 CarbonylContact C-O 3.41Å; A115-L120 VanDerWaalsContact CB-O 3.29Å; A115-L120 WeakPolarHBondContact CB-O 3.47Å; A115-L120 PolarHBondContact O-N 2.97Å; A115-L120 VanDerWaalsContact O-O 3.11Å; A115-P122 HydrophobicContact CB-CG 4.08Å; A115-V125 HydrophobicContact CB-CG2 4.08Å |
| 116 | R | 98.4 | Very high | 98.4 | Very high | 166 Ų | 166 | 65.5 Ų | 65.5 | 63% | 0.626 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -59.7 | -46.6 | 174.9 | -70.1 | -174 | -68 | -103 | 4.3 | 112.3 | E112 Q113 L118 S119 | E112-R116 WeakPolarHBondContact O-CG 3.31Å; E112-R116 PolarHBondContact O-N 2.63Å; E112-R116 IonicContact OE2-NH1 3.19Å; Q113-R116 PolarHBondContact O-N 2.82Å; R116-L118 VanDerWaalsContact C-N 3.3Å; R116-L118 PolarHBondContact O-N 2.92Å; R116-S119 PolarHBondContact O-N 3.19Å |
| 117 | L | 98.1 | Very high | 98.4 | Very high | 126 Ų | 126 | 68.6 Ų | 68.6 | 66% | 0.66 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -63.3 | -33.3 | -178.5 | -70 | 172.9 | 0 | 0 | 0 | 113.6 | Q113 L114 | Q113-L117 HydrophobicContact CG-CD1 4.29Å; Q113-L117 WeakPolarHBondContact O-CG 3.41Å; Q113-L117 PolarHBondContact O-N 2.86Å; Q113-L117 VanDerWaalsContact O-N 3.07Å; L114-L117 PolarHBondContact O-N 2.81Å |
| 118 | L | 98.1 | Very high | 98.4 | Very high | 21 Ų | 21 | 67.4 Ų | 67.4 | 11% | 0.11 | 36% | 0.355 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -102 | 4.7 | -176.4 | -58.3 | -176.9 | 0 | 0 | 0 | 113.6 | Q92 E95 L96 L114 A115 R116 L120 | Q92-L118 PolarHBondContact NE2-O 3.32Å; E95-L118 HydrophobicContact CB-CD1 4.05Å; E95-L118 HydrophobicContact CB-CD2 3.51Å; E95-L118 HydrophobicContact CB-CG 4.42Å; E95-L118 HydrophobicContact CG-CD2 3.93Å; L96-L118 HydrophobicContact CD2-CD1 3.86Å; L96-L118 HydrophobicContact CG-CD1 3.74Å; L114-L118 HydrophobicContact CD1-CD1 3.88Å; L114-L118 HydrophobicContact CD1-CG 4.18Å; L114-L118 HydrophobicContact CG-CD1 4.04Å; L114-L118 WeakPolarHBondContact O-CG 3.22Å; L114-L118 PolarHBondContact O-N 3.17Å; L114-L118 VanDerWaalsContact O-N 3.08Å; A115-L118 PolarHBondContact O-N 3.02Å; R116-L118 VanDerWaalsContact C-N 3.3Å; R116-L118 PolarHBondContact O-N 2.92Å; L118-L120 HydrophobicContact CB-CD1 4.15Å; L118-L120 HydrophobicContact CB-CG 4.1Å; L118-L120 PolarHBondContact O-N 2.95Å |
| 119 | S | 98.3 | Very high | 98.4 | Very high | 109 Ų | 109 | 66 Ų | 66 | 76% | 0.762 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.9 | 43.8 | -172.9 | -49.8 | 0 | 0 | 0 | 0 | 112.5 | A115 R116 | A115-S119 PolarHBondContact O-N 2.71Å; R116-S119 PolarHBondContact O-N 3.19Å |
| 120 | L | 97.9 | Very high | 98.4 | Very high | 22 Ų | 22 | 66.8 Ų | 66.8 | 12% | 0.115 | 33% | 0.334 | C | S | . | . | trans | -114.7 | 166.2 | 175.6 | -64.5 | -179.9 | 0 | 0 | 0 | 109.9 | F88 L96 A115 L118 Q124 V125 | F88-L120 HydrophobicContact CD1-CD1 4.35Å; F88-L120 HydrophobicContact CD1-CD2 3.75Å; F88-L120 HydrophobicContact CE1-CD1 4.27Å; F88-L120 HydrophobicContact CE1-CD2 3.7Å; L96-L120 HydrophobicContact CD1-CD1 4.14Å; A115-L120 CarbonylContact C-O 3.41Å; A115-L120 VanDerWaalsContact CB-O 3.29Å; A115-L120 WeakPolarHBondContact CB-O 3.47Å; A115-L120 PolarHBondContact O-N 2.97Å; A115-L120 VanDerWaalsContact O-O 3.11Å; L118-L120 HydrophobicContact CB-CD1 4.15Å; L118-L120 HydrophobicContact CB-CG 4.1Å; L118-L120 PolarHBondContact O-N 2.95Å; L120-Q124 HydrophobicContact CB-CB 4.47Å; L120-V125 HydrophobicContact CB-CG2 4.21Å; L120-V125 HydrophobicContact CD1-CG2 4.41Å | ||
| 121 | T | 98.5 | Very high | 98.3 | Very high | 68 Ų | 68 | 69 Ų | 69 | 42% | 0.417 | 35% | 0.348 | S | S | . | . | trans | -83.3 | 150.5 | 168.9 | 61.6 | 0 | 0 | 0 | 0 | 110.7 | T123 Q124 V125 | T121-T123 PolarHBondContact O-N 3.33Å; T121-T123 VanDerWaalsContact O-N 3.17Å; T121-Q124 WeakPolarHBondContact O-CB 3.4Å; T121-Q124 PolarHBondContact O-N 2.66Å; T121-Q124 WeakPolarHBondContact OG1-CB 3.43Å; T121-Q124 VanDerWaalsContact OG1-CD 3.29Å; T121-Q124 VanDerWaalsContact OG1-CG 3.22Å; T121-Q124 WeakPolarHBondContact OG1-CG 3.31Å; T121-Q124 PolarHBondContact OG1-N 3.08Å; T121-Q124 PolarHBondContact OG1-OE1 3.42Å; T121-V125 PolarHBondContact O-N 3.11Å; T121-V125 VanDerWaalsContact O-N 3.16Å | ||
| 122 | P | 98.4 | Very high | 98.3 | Very high | 55 Ų | 55 | 67.7 Ų | 67.7 | 36% | 0.357 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -53.1 | -39.2 | 173.2 | -26.2 | 34.4 | 0 | 0 | 0 | 111.7 | R111 E112 A115 Q124 V125 K126 | R111-P122 WeakPolarHBondContact CD-O 3.44Å; R111-P122 HydrophobicContact CG-CB 4.21Å; E112-P122 HydrophobicContact CG-CG 4.24Å; A115-P122 HydrophobicContact CB-CG 4.08Å; P122-Q124 PolarHBondContact O-N 2.93Å; P122-V125 PolarHBondContact O-N 3.31Å; P122-K126 PolarHBondContact O-N 3.34Å |
| 123 | T | 98.4 | Very high | 98.2 | Very high | 91 Ų | 91 | 66.6 Ų | 66.6 | 56% | 0.558 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -62.3 | -41.9 | 177.4 | -58.2 | 0 | 0 | 0 | 0 | 112.9 | T121 V125 K126 I127 | T121-T123 PolarHBondContact O-N 3.33Å; T121-T123 VanDerWaalsContact O-N 3.17Å; T123-V125 VanDerWaalsContact C-N 3.34Å; T123-V125 PolarHBondContact O-N 3.43Å; T123-K126 WeakPolarHBondContact O-CB 3.12Å; T123-K126 PolarHBondContact O-N 2.93Å; T123-I127 HydrophobicContact CG2-CD1 3.96Å; T123-I127 HydrophobicContact CG2-CG1 4.48Å; T123-I127 WeakPolarHBondContact O-CG1 3.2Å; T123-I127 PolarHBondContact O-N 3.04Å |
| 124 | Q | 98.2 | Very high | 98.1 | Very high | 68 Ų | 68 | 67 Ų | 67 | 32% | 0.318 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61.3 | -43.2 | 175 | -78.9 | 164.4 | -41.2 | 0 | 0 | 111.7 | F88 L120 T121 P122 I127 W128 | F88-Q124 HydrophobicContact CE1-CB 4.23Å; F88-Q124 HydrophobicContact CE1-CG 4.26Å; F88-Q124 HydrophobicContact CZ-CB 3.92Å; F88-Q124 HydrophobicContact CZ-CG 4.2Å; L120-Q124 HydrophobicContact CB-CB 4.47Å; T121-Q124 WeakPolarHBondContact O-CB 3.4Å; T121-Q124 PolarHBondContact O-N 2.66Å; T121-Q124 WeakPolarHBondContact OG1-CB 3.43Å; T121-Q124 VanDerWaalsContact OG1-CD 3.29Å; T121-Q124 VanDerWaalsContact OG1-CG 3.22Å; T121-Q124 WeakPolarHBondContact OG1-CG 3.31Å; T121-Q124 PolarHBondContact OG1-N 3.08Å; T121-Q124 PolarHBondContact OG1-OE1 3.42Å; P122-Q124 PolarHBondContact O-N 2.93Å; Q124-I127 PolarHBondContact O-N 3.43Å; Q124-W128 WeakPolarHBondContact O-CB 3.37Å; Q124-W128 PolarHBondContact O-N 3Å |
| 125 | V | 98.6 | Very high | 97.9 | Very high | 0 Ų | 0 | 73 Ų | 73 | 0% | 0 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -62.1 | -44.5 | 174.9 | 179.6 | 0 | 0 | 0 | 0 | 110.6 | L96 L106 R111 L114 A115 L120 T121 P122 T123 I127 W128 F129 | L96-V125 HydrophobicContact CD2-CG1 4.32Å; L96-V125 HydrophobicContact CD2-CG2 4.48Å; L106-V125 HydrophobicContact CD1-CG1 4.05Å; R111-V125 HydrophobicContact CG-CB 3.84Å; R111-V125 HydrophobicContact CG-CG1 3.78Å; L114-V125 HydrophobicContact CD2-CG1 3.9Å; A115-V125 HydrophobicContact CB-CG2 4.08Å; L120-V125 HydrophobicContact CB-CG2 4.21Å; L120-V125 HydrophobicContact CD1-CG2 4.41Å; T121-V125 PolarHBondContact O-N 3.11Å; T121-V125 VanDerWaalsContact O-N 3.16Å; P122-V125 PolarHBondContact O-N 3.31Å; T123-V125 VanDerWaalsContact C-N 3.34Å; T123-V125 PolarHBondContact O-N 3.43Å; V125-I127 PolarHBondContact O-N 3.11Å; V125-W128 PolarHBondContact O-N 3.39Å; V125-F129 HydrophobicContact CG1-CD2 3.79Å; V125-F129 HydrophobicContact CG1-CE2 3.87Å; V125-F129 VanDerWaalsContact O-CD2 3.31Å; V125-F129 WeakPolarHBondContact O-CD2 3.27Å; V125-F129 PolarHBondContact O-N 3.48Å |
| 126 | K | 98.4 | Very high | 97.5 | Very high | 105 Ų | 105 | 76.3 Ų | 76.3 | 46% | 0.457 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -56 | -50.3 | 175.8 | -178.3 | -172.8 | 176.2 | -178.2 | 0 | 111.5 | P122 T123 F129 Q130 | P122-K126 PolarHBondContact O-N 3.34Å; T123-K126 WeakPolarHBondContact O-CB 3.12Å; T123-K126 PolarHBondContact O-N 2.93Å; K126-F129 PolarHBondContact O-N 3.22Å; K126-Q130 WeakPolarHBondContact O-CB 3.3Å; K126-Q130 PolarHBondContact O-N 3.2Å |
| 127 | I | 98.4 | Very high | 97.1 | Very high | 85 Ų | 85 | 75.3 Ų | 75.3 | 44% | 0.436 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -63.2 | -44.7 | -179.4 | -69.2 | 168.5 | 0 | 0 | 0 | 110.2 | T123 Q124 V125 F129 Q130 N131 | T123-I127 HydrophobicContact CG2-CD1 3.96Å; T123-I127 HydrophobicContact CG2-CG1 4.48Å; T123-I127 WeakPolarHBondContact O-CG1 3.2Å; T123-I127 PolarHBondContact O-N 3.04Å; Q124-I127 PolarHBondContact O-N 3.43Å; V125-I127 PolarHBondContact O-N 3.11Å; I127-F129 PolarHBondContact O-N 3.41Å; I127-Q130 PolarHBondContact O-N 3.29Å; I127-N131 WeakPolarHBondContact O-CB 3.43Å; I127-N131 VanDerWaalsContact O-CG 3.29Å; I127-N131 PolarHBondContact O-N 2.97Å |
| 128 | W | 98.3 | Very high | 96.6 | Very high | 32 Ų | 32 | 75.3 Ų | 75.3 | 12% | 0.121 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -60.7 | -47.4 | 178.7 | -170.3 | 96.7 | 0 | 0 | 0 | 111.5 | F88 L96 E97 F100 Q124 V125 Q130 N131 H132 | F88-W128 AromaticContact CD2-CD1 3.68Å; F88-W128 HydrophobicContact CE2-CB 4.18Å; F88-W128 AromaticContact CE2-CD1 3.59Å; F88-W128 HydrophobicContact CE2-CG 4.22Å; L96-W128 HydrophobicContact CB-CD2 3.9Å; L96-W128 HydrophobicContact CB-CE3 3.89Å; L96-W128 HydrophobicContact CB-CH2 3.68Å; L96-W128 HydrophobicContact CB-CZ2 3.67Å; L96-W128 HydrophobicContact CB-CZ3 3.79Å; L96-W128 HydrophobicContact CD1-CD2 3.86Å; L96-W128 HydrophobicContact CD1-CG 3.83Å; L96-W128 HydrophobicContact CD2-CD2 4.4Å; L96-W128 HydrophobicContact CD2-CE3 4.3Å; L96-W128 HydrophobicContact CG-CD2 4.27Å; L96-W128 HydrophobicContact CG-CE3 4.46Å; E97-W128 HydrophobicContact CB-CH2 4.45Å; E97-W128 HydrophobicContact CG-CH2 3.77Å; E97-W128 HydrophobicContact CG-CZ2 3.78Å; F100-W128 HydrophobicContact CB-CH2 4.32Å; F100-W128 HydrophobicContact CB-CZ3 4.02Å; F100-W128 HydrophobicContact CD2-CZ3 4.32Å; F100-W128 HydrophobicContact CG-CZ3 4.35Å; Q124-W128 WeakPolarHBondContact O-CB 3.37Å; Q124-W128 PolarHBondContact O-N 3Å; V125-W128 PolarHBondContact O-N 3.39Å; W128-Q130 VanDerWaalsContact C-N 3.29Å; W128-Q130 PolarHBondContact O-N 3.14Å; W128-N131 PolarHBondContact O-N 3.43Å; W128-H132 HydrophobicContact CE3-CB 4.13Å; W128-H132 HydrophobicContact CH2-CB 4.23Å; W128-H132 AromaticContact CH2-CE1 3.86Å; W128-H132 AromaticContact CH2-CG 3.83Å; W128-H132 AromaticContact CH2-ND1 3.19Å; W128-H132 WeakPolarHBondContact CH2-ND1 3.35Å; W128-H132 AromaticContact CZ2-ND1 3.61Å; W128-H132 HydrophobicContact CZ3-CB 3.9Å; W128-H132 AromaticContact CZ3-CG 3.89Å; W128-H132 AromaticContact CZ3-ND1 3.75Å; W128-H132 VanDerWaalsContact O-CB 3.31Å; W128-H132 WeakPolarHBondContact O-CB 3.34Å; W128-H132 PolarHBondContact O-N 2.86Å |
| 129 | F | 98.6 | Very high | 95.3 | Very high | 7 Ų | 7 | 76.9 Ų | 76.9 | 3% | 0.031 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -63.5 | -34 | 177 | -89.8 | -107.3 | 0 | 0 | 0 | 112.5 | L96 R99 F100 Q103 L106 L114 V125 K126 I127 R133 | L96-F129 HydrophobicContact CD2-CE2 4Å; R99-F129 HydrophobicContact CB-CZ 4.45Å; R99-F129 HydrophobicContact CG-CZ 4.3Å; F100-F129 HydrophobicContact CB-CE1 4.26Å; F100-F129 HydrophobicContact CB-CZ 4.35Å; F100-F129 AromaticContact CD2-CD1 3.72Å; F100-F129 HydrophobicContact CD2-CD1 3.72Å; F100-F129 AromaticContact CD2-CE1 3.73Å; F100-F129 HydrophobicContact CD2-CE1 3.73Å; F100-F129 HydrophobicContact CD2-CG 4.47Å; F100-F129 HydrophobicContact CD2-CZ 4.49Å; F100-F129 HydrophobicContact CE2-CD1 4.28Å; F100-F129 HydrophobicContact CG-CE1 4.49Å; Q103-F129 WeakPolarHBondContact O-CE1 3.44Å; L106-F129 HydrophobicContact CD1-CD1 4.29Å; L106-F129 HydrophobicContact CD1-CD2 4.17Å; L106-F129 HydrophobicContact CD1-CE1 3.77Å; L106-F129 HydrophobicContact CD1-CE2 3.63Å; L106-F129 HydrophobicContact CD1-CG 4.49Å; L106-F129 HydrophobicContact CD1-CZ 3.42Å; L106-F129 VanDerWaalsContact CD1-CZ 3.42Å; L106-F129 HydrophobicContact CD2-CE1 4.19Å; L106-F129 HydrophobicContact CD2-CZ 4.34Å; L106-F129 HydrophobicContact CG-CD1 4.06Å; L106-F129 HydrophobicContact CG-CE1 3.6Å; L106-F129 HydrophobicContact CG-CE2 4.39Å; L106-F129 HydrophobicContact CG-CZ 3.8Å; L114-F129 HydrophobicContact CD2-CE2 3.93Å; L114-F129 HydrophobicContact CD2-CZ 4.23Å; V125-F129 HydrophobicContact CG1-CD2 3.79Å; V125-F129 HydrophobicContact CG1-CE2 3.87Å; V125-F129 VanDerWaalsContact O-CD2 3.31Å; V125-F129 WeakPolarHBondContact O-CD2 3.27Å; V125-F129 PolarHBondContact O-N 3.48Å; K126-F129 PolarHBondContact O-N 3.22Å; I127-F129 PolarHBondContact O-N 3.41Å; F129-R133 VanDerWaalsContact O-CG 3.32Å; F129-R133 WeakPolarHBondContact O-CG 3.45Å; F129-R133 PolarHBondContact O-N 3.35Å; F129-R133 VanDerWaalsContact O-N 3.14Å; F129-R133 PolarHBondContact O-NE 2.83Å |
| 130 | Q | 98.3 | Very high | 93.6 | Very high | 107 Ų | 107 | 81.4 Ų | 81.4 | 50% | 0.5 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -68.6 | -47.8 | 175 | -172 | 156.7 | 25 | 0 | 0 | 111.8 | K126 I127 W128 H132 R133 Y134 | K126-Q130 WeakPolarHBondContact O-CB 3.3Å; K126-Q130 PolarHBondContact O-N 3.2Å; I127-Q130 PolarHBondContact O-N 3.29Å; W128-Q130 VanDerWaalsContact C-N 3.29Å; W128-Q130 PolarHBondContact O-N 3.14Å; Q130-H132 VanDerWaalsContact C-N 3.31Å; Q130-H132 PolarHBondContact O-N 2.92Å; Q130-R133 PolarHBondContact O-N 3.22Å; Q130-Y134 WeakPolarHBondContact O-CB 3.47Å; Q130-Y134 PolarHBondContact O-N 2.92Å |
| 131 | N | 97.5 | Very high | 91.8 | Very high | 101 Ų | 101 | 84 Ų | 84 | 54% | 0.54 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -60.9 | -41.6 | 176.4 | -71.8 | -15.5 | 0 | 0 | 0 | 111.6 | I127 W128 Y134 K135 | I127-N131 WeakPolarHBondContact O-CB 3.43Å; I127-N131 VanDerWaalsContact O-CG 3.29Å; I127-N131 PolarHBondContact O-N 2.97Å; W128-N131 PolarHBondContact O-N 3.43Å; N131-Y134 PolarHBondContact O-N 3.06Å; N131-K135 PolarHBondContact O-N 3.5Å |
| 132 | H | 97.4 | Very high | 89.9 | Confident | 35 Ų | 35 | 87.2 Ų | 87.2 | 16% | 0.162 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -63.7 | -47 | 179.6 | -163.3 | 102.8 | 0 | 0 | 0 | 111.7 | F100 W128 Q130 Y134 K135 M136 | F100-H132 AromaticContact CD1-CD2 3.31Å; F100-H132 WeakPolarHBondContact CD1-CD2 3.32Å; F100-H132 AromaticContact CD1-NE2 3.29Å; F100-H132 VanDerWaalsContact CD1-NE2 3.29Å; F100-H132 WeakPolarHBondContact CD1-NE2 3.42Å; F100-H132 HydrophobicContact CD2-CB 4.41Å; F100-H132 AromaticContact CD2-CD2 3.87Å; F100-H132 AromaticContact CE1-CD2 3.09Å; F100-H132 WeakPolarHBondContact CE1-CD2 3.41Å; F100-H132 AromaticContact CE1-NE2 3.35Å; F100-H132 WeakPolarHBondContact CE1-NE2 3.42Å; F100-H132 HydrophobicContact CE2-CB 4.28Å; F100-H132 AromaticContact CE2-CD2 3.68Å; F100-H132 AromaticContact CG-CD2 3.71Å; F100-H132 AromaticContact CG-NE2 3.96Å; F100-H132 AromaticContact CZ-CD2 3.29Å; F100-H132 WeakPolarHBondContact CZ-CD2 3.4Å; W128-H132 HydrophobicContact CE3-CB 4.13Å; W128-H132 HydrophobicContact CH2-CB 4.23Å; W128-H132 AromaticContact CH2-CE1 3.86Å; W128-H132 AromaticContact CH2-CG 3.83Å; W128-H132 AromaticContact CH2-ND1 3.19Å; W128-H132 WeakPolarHBondContact CH2-ND1 3.35Å; W128-H132 AromaticContact CZ2-ND1 3.61Å; W128-H132 HydrophobicContact CZ3-CB 3.9Å; W128-H132 AromaticContact CZ3-CG 3.89Å; W128-H132 AromaticContact CZ3-ND1 3.75Å; W128-H132 VanDerWaalsContact O-CB 3.31Å; W128-H132 WeakPolarHBondContact O-CB 3.34Å; W128-H132 PolarHBondContact O-N 2.86Å; Q130-H132 VanDerWaalsContact C-N 3.31Å; Q130-H132 PolarHBondContact O-N 2.92Å; H132-Y134 VanDerWaalsContact C-N 3.3Å; H132-Y134 PolarHBondContact O-N 3.3Å; H132-K135 PolarHBondContact O-N 3.24Å; H132-M136 PolarHBondContact O-N 3.19Å; H132-M136 VanDerWaalsContact O-N 3.11Å |
| 133 | R | 97.3 | Very high | 87.8 | Confident | 71 Ų | 71 | 86.6 Ų | 86.6 | 27% | 0.268 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -59.8 | -41.2 | 174.1 | -73.3 | -179.1 | -69.8 | 147.7 | -3.4 | 112.1 | F100 R104 F129 Q130 M136 K137 | F100-R133 HydrophobicContact CE2-CG 3.74Å; F100-R133 HydrophobicContact CZ-CG 3.93Å; R104-R133 WeakPolarHBondContact O-CD 3.47Å; F129-R133 VanDerWaalsContact O-CG 3.32Å; F129-R133 WeakPolarHBondContact O-CG 3.45Å; F129-R133 PolarHBondContact O-N 3.35Å; F129-R133 VanDerWaalsContact O-N 3.14Å; F129-R133 PolarHBondContact O-NE 2.83Å; Q130-R133 PolarHBondContact O-N 3.22Å; R133-M136 PolarHBondContact O-N 3.45Å; R133-K137 PolarHBondContact O-N 3.14Å |
| 134 | Y | 96.6 | Very high | 85.4 | Confident | 124 Ų | 124 | 87.2 Ų | 87.2 | 49% | 0.486 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63.1 | -45.9 | 178.6 | -171.7 | -99.7 | 0 | 0 | 0 | 112.2 | Q130 N131 H132 M136 K137 R138 | Q130-Y134 WeakPolarHBondContact O-CB 3.47Å; Q130-Y134 PolarHBondContact O-N 2.92Å; N131-Y134 PolarHBondContact O-N 3.06Å; H132-Y134 VanDerWaalsContact C-N 3.3Å; H132-Y134 PolarHBondContact O-N 3.3Å; Y134-M136 VanDerWaalsContact C-N 3.33Å; Y134-M136 PolarHBondContact O-N 3.15Å; Y134-K137 PolarHBondContact O-N 3.19Å; Y134-R138 WeakPolarHBondContact O-CB 3.39Å; Y134-R138 PolarHBondContact O-N 3.32Å; Y134-R138 PolarHBondContact OH-NH2 2.67Å |
| 135 | K | 93.3 | Very high | 83.1 | Confident | 138 Ų | 138 | 91.1 Ų | 91.1 | 60% | 0.6 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -58.6 | -44.8 | 177.1 | -171.8 | 176.4 | 66.5 | 173.6 | 0 | 111.6 | N131 H132 K137 R138 G139 | N131-K135 PolarHBondContact O-N 3.5Å; H132-K135 PolarHBondContact O-N 3.24Å; K135-K137 VanDerWaalsContact C-N 3.33Å; K135-K137 PolarHBondContact O-N 3.2Å; K135-R138 PolarHBondContact O-N 3.45Å; K135-G139 PolarHBondContact O-N 2.85Å; K135-G139 VanDerWaalsContact O-N 3.11Å |
| 136 | M | 90.8 | Very high | 80.5 | Confident | 72 Ų | 72 | 97.1 Ų | 97.1 | 36% | 0.355 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.9 | -37.4 | 178.3 | -161.1 | -174.3 | 79.9 | 0 | 0 | 112.3 | F100 R104 H132 R133 Y134 | F100-M136 HydrophobicContact CE1-SD 4.4Å; R104-M136 PolarHBondContact NH2-SD 3.26Å; H132-M136 PolarHBondContact O-N 3.19Å; H132-M136 VanDerWaalsContact O-N 3.11Å; R133-M136 PolarHBondContact O-N 3.45Å; Y134-M136 VanDerWaalsContact C-N 3.33Å; Y134-M136 PolarHBondContact O-N 3.15Å |
| 137 | K | 90.4 | Very high | 77.9 | Confident | 144 Ų | 144 | 97.5 Ų | 97.5 | 63% | 0.626 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -70.5 | -42.7 | 175.4 | -168.3 | -178.6 | 76 | 168.2 | 0 | 111.9 | R133 Y134 K135 G139 R140 A141 | R133-K137 PolarHBondContact O-N 3.14Å; Y134-K137 PolarHBondContact O-N 3.19Å; K135-K137 VanDerWaalsContact C-N 3.33Å; K135-K137 PolarHBondContact O-N 3.2Å; K137-G139 VanDerWaalsContact C-N 3.34Å; K137-G139 PolarHBondContact O-N 3.12Å; K137-R140 PolarHBondContact O-N 2.98Å; K137-A141 PolarHBondContact O-N 3.05Å |
| 138 | R | 88.1 | Confident | 75.3 | Confident | 126 Ų | 126 | 101 Ų | 101 | 48% | 0.475 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.4 | -39 | -177.7 | -173.5 | 69 | 82.5 | 163 | 13.4 | 111.8 | Y134 K135 R140 A141 E142 | Y134-R138 WeakPolarHBondContact O-CB 3.39Å; Y134-R138 PolarHBondContact O-N 3.32Å; Y134-R138 PolarHBondContact OH-NH2 2.67Å; K135-R138 PolarHBondContact O-N 3.45Å; R138-R140 PolarHBondContact O-N 3.45Å; R138-A141 PolarHBondContact O-N 3.18Å; R138-E142 PolarHBondContact O-N 3.41Å |
| 139 | G | 70.1 | Confident | 72.8 | Confident | 54 Ų | 54 | 103.3 Ų | 103.3 | 56% | 0.557 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -62.8 | -24 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | K135 K137 | K135-G139 PolarHBondContact O-N 2.85Å; K135-G139 VanDerWaalsContact O-N 3.11Å; K137-G139 VanDerWaalsContact C-N 3.34Å; K137-G139 PolarHBondContact O-N 3.12Å |
| 140 | R | 62.3 | Low | 70.5 | Confident | 204 Ų | 204 | 110.4 Ų | 110.4 | 77% | 0.77 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -83.8 | -25 | 176.5 | -69.1 | -176.2 | 177.3 | -128.1 | -2.9 | 113.6 | K137 R138 | K137-R140 PolarHBondContact O-N 2.98Å; R138-R140 PolarHBondContact O-N 3.45Å |
| 141 | A | 60.9 | Low | 68.5 | Low | 76 Ų | 76 | 111.4 Ų | 111.4 | 63% | 0.628 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -82.8 | -30.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | K137 R138 G143 | K137-A141 PolarHBondContact O-N 3.05Å; R138-A141 PolarHBondContact O-N 3.18Å; A141-G143 VanDerWaalsContact C-N 3.33Å |
| 142 | E | 58.7 | Low | 65.8 | Low | 136 Ų | 136 | 112.8 Ų | 112.8 | 64% | 0.636 | 62% | 0.624 | S | S | * | * | S | Bend | trans | -89.5 | 0.8 | 177.3 | -59.2 | -74.2 | 141 | 0 | 0 | 112.7 | R138 | R138-E142 PolarHBondContact O-N 3.41Š|
| 143 | G | 52.4 | Low | 63.3 | Low | 43 Ų | 43 | 117.6 Ų | 117.6 | 44% | 0.443 | 65% | 0.647 | S | S | . | * | trans | -118.7 | 33.5 | -167.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | A141 L145 | A141-G143 VanDerWaalsContact C-N 3.33Å; G143-L145 PolarHBondContact O-N 3.21Å | ||
| 144 | A | 50 | Low | 61 | Low | 104 Ų | 104 | 119.2 Ų | 119.2 | 86% | 0.86 | 67% | 0.666 | S | S | * | * | trans | -77.5 | 35.5 | 168.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 145 | L | 47.9 | Very low | 58.9 | Low | 150 Ų | 150 | 118.9 Ų | 118.9 | 79% | 0.785 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -131.6 | 128.9 | 163.5 | -90.9 | 166.5 | 0 | 0 | 0 | 107.4 | G143 S147 | G143-L145 PolarHBondContact O-N 3.21Å; L145-S147 PolarHBondContact O-N 3.42Å |
| 146 | P | 45 | Very low | 57.1 | Low | 125 Ų | 125 | 119.2 Ų | 119.2 | 81% | 0.812 | 69% | 0.687 | S | S | * | * | trans | -72.8 | 113.3 | -176.6 | 30.4 | -30.1 | 0 | 0 | 0 | 108.1 | ||||
| 147 | S | 42.9 | Very low | 55.5 | Low | 113 Ų | 113 | 123.1 Ų | 123.1 | 79% | 0.79 | 71% | 0.708 | S | S | * | * | trans | -106 | 90 | 163.8 | -157.4 | 0 | 0 | 0 | 0 | 107.3 | L145 | L145-S147 PolarHBondContact O-N 3.42Š| ||
| 148 | D | 44.6 | Very low | 54.1 | Low | 158 Ų | 158 | 126.7 Ų | 126.7 | 85% | 0.845 | 72% | 0.718 | S | S | * | * | trans | -63.1 | 154.9 | 150.2 | -125.1 | -72.4 | 0 | 0 | 0 | 108.6 | ||||
| 149 | A | 46 | Very low | 52.8 | Low | 82 Ų | 82 | 130.9 Ų | 130.9 | 68% | 0.678 | 73% | 0.734 | S | S | * | * | S | Bend | trans | 75.2 | 102.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||
| 150 | D | 50.3 | Low | 52.3 | Low | 155 Ų | 155 | 134 Ų | 134 | 83% | 0.829 | 74% | 0.741 | S | S | * | * | 20.7 | 115.3 | 128.2 | -132.1 | -87.6 | 0 | 0 | 0 | 118.1 | |||||
| 151 | I | 55.1 | Low | 52.3 | Low | 129 Ų | 129 | 130.5 Ų | 130.5 | 66% | 0.662 | 74% | 0.743 | S | S | * | * | trans | 156 | 125.8 | 147.5 | -75.8 | 149.3 | 0 | 0 | 0 | 107.3 | Q153 | I151-Q153 HydrophobicContact CG2-CG 3.7Å; I151-Q153 PolarHBondContact O-N 2.9Å | ||
| 152 | P | 42.4 | Very low | 52.5 | Low | 129 Ų | 129 | 132 Ų | 132 | 84% | 0.838 | 74% | 0.744 | S | S | * | * | trans | -76.1 | 78.2 | 171.2 | 30.9 | -30.3 | 0 | 0 | 0 | 109.8 | ||||
| 153 | Q | 43.9 | Very low | 52.7 | Low | 137 Ų | 137 | 130.7 Ų | 130.7 | 64% | 0.64 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 126.8 | 167.3 | -73.7 | -146.7 | 0.1 | 0 | 0 | 109.2 | I151 | I151-Q153 HydrophobicContact CG2-CG 3.7Å; I151-Q153 PolarHBondContact O-N 2.9Å |
| 154 | P | 49 | Very low | 53.4 | Low | 104 Ų | 104 | 134.2 Ų | 134.2 | 68% | 0.675 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 139.8 | 170.7 | 25.8 | -31.7 | 0 | 0 | 0 | 108.5 | L156 | P154-L156 PolarHBondContact O-N 3.25Š|
| 155 | P | 52.7 | Low | 54.2 | Low | 117 Ų | 117 | 137.3 Ų | 137.3 | 76% | 0.76 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 117.3 | -176.3 | 22.5 | -31.7 | 0 | 0 | 0 | 108.4 | L157 | P155-L157 PolarHBondContact O-N 3.29Š|
| 156 | L | 56.2 | Low | 55.1 | Low | 145 Ų | 145 | 134.3 Ų | 134.3 | 76% | 0.759 | 74% | 0.744 | S | S | * | * | trans | -51.6 | 111.8 | 175 | -64 | -179.2 | 0 | 0 | 0 | 107.1 | P154 R158 | P154-L156 PolarHBondContact O-N 3.25Å; L156-R158 PolarHBondContact O-N 3.14Å | ||
| 157 | L | 57.3 | Low | 55.3 | Low | 155 Ų | 155 | 138 Ų | 138 | 81% | 0.812 | 74% | 0.741 | S | S | * | * | trans | -55.3 | 113.3 | 179.1 | -64.8 | 173.3 | 0 | 0 | 0 | 106.8 | P155 R159 | P155-L157 PolarHBondContact O-N 3.29Å; L157-R159 VanDerWaalsContact C-N 3.33Å; L157-R159 PolarHBondContact O-N 3.36Å | ||
| 158 | R | 60.8 | Low | 55.9 | Low | 218 Ų | 218 | 139.3 Ų | 139.3 | 82% | 0.823 | 74% | 0.74 | S | S | * | * | trans | -56.1 | 103.1 | 168.5 | -67.1 | -179.1 | 179.5 | 127.8 | -2.5 | 105.9 | L156 V160 | L156-R158 PolarHBondContact O-N 3.14Å; R158-V160 VanDerWaalsContact C-N 3.34Å; R158-V160 PolarHBondContact O-N 3.47Å | ||
| 159 | R | 61.1 | Low | 56.4 | Low | 214 Ų | 214 | 135.1 Ų | 135.1 | 81% | 0.808 | 73% | 0.734 | S | S | * | * | trans | -68.1 | 97.2 | 177.5 | -66.8 | 177.5 | 92.3 | 114.6 | -4.3 | 106.4 | L157 V161 | L157-R159 VanDerWaalsContact C-N 3.33Å; L157-R159 PolarHBondContact O-N 3.36Å; R159-V161 PolarHBondContact O-N 2.84Å | ||
| 160 | V | 58.7 | Low | 56.8 | Low | 119 Ų | 119 | 139.3 Ų | 139.3 | 72% | 0.721 | 74% | 0.736 | S | S | * | * | trans | -76 | 110.5 | 170.4 | 179.5 | 0 | 0 | 0 | 0 | 106.4 | R158 V162 | R158-V160 VanDerWaalsContact C-N 3.34Å; R158-V160 PolarHBondContact O-N 3.47Å; V160-V162 HydrophobicContact CG1-CG2 4.28Å; V160-V162 PolarHBondContact O-N 3.49Å; V160-V162 VanDerWaalsContact O-N 3.14Å | ||
| 161 | V | 61.8 | Low | 56.7 | Low | 132 Ų | 132 | 136.5 Ų | 136.5 | 80% | 0.8 | 73% | 0.727 | S | S | * | * | trans | -71.8 | 103.6 | 167.3 | 179.9 | 0 | 0 | 0 | 0 | 106.3 | R159 P163 | R159-V161 PolarHBondContact O-N 2.84Å; V161-P163 WeakPolarHBondContact O-CD 3.48Å | ||
| 162 | V | 66.4 | Low | 56 | Low | 107 Ų | 107 | 139.2 Ų | 139.2 | 65% | 0.648 | 73% | 0.734 | S | S | * | * | trans | -77.7 | 120.3 | 172 | -179.3 | 0 | 0 | 0 | 0 | 107 | V160 I164 | V160-V162 HydrophobicContact CG1-CG2 4.28Å; V160-V162 PolarHBondContact O-N 3.49Å; V160-V162 VanDerWaalsContact O-N 3.14Å; V162-I164 PolarHBondContact O-N 3.24Å | ||
| 163 | P | 62 | Low | 56.2 | Low | 108 Ų | 108 | 140.8 Ų | 140.8 | 70% | 0.701 | 73% | 0.73 | S | S | * | * | trans | -60.5 | 114.3 | 174.2 | -18.8 | 30.8 | 0 | 0 | 0 | 109 | V161 L165 | V161-P163 WeakPolarHBondContact O-CD 3.48Å; P163-L165 PolarHBondContact O-N 3.47Å | ||
| 164 | I | 67.4 | Low | 56.2 | Low | 117 Ų | 117 | 139.1 Ų | 139.1 | 60% | 0.6 | 73% | 0.729 | S | S | * | * | trans | -70.5 | 110.9 | 172.1 | -59.2 | 172.6 | 0 | 0 | 0 | 106 | V162 V166 | V162-I164 PolarHBondContact O-N 3.24Å; I164-V166 PolarHBondContact O-N 3.41Å | ||
| 165 | L | 65.8 | Low | 56 | Low | 170 Ų | 170 | 140.5 Ų | 140.5 | 89% | 0.89 | 74% | 0.74 | S | S | * | * | trans | -62.1 | 104.3 | 169 | -80.6 | 144.9 | 0 | 0 | 0 | 107.9 | P163 R167 | P163-L165 PolarHBondContact O-N 3.47Å; L165-R167 PolarHBondContact O-N 3.08Å | ||
| 166 | V | 67.1 | Low | 55.2 | Low | 87 Ų | 87 | 142.7 Ų | 142.7 | 53% | 0.527 | 74% | 0.738 | S | S | . | * | trans | -70.2 | 123.1 | 174.4 | -175.3 | 0 | 0 | 0 | 0 | 107.8 | I164 | I164-V166 PolarHBondContact O-N 3.41Š| ||
| 167 | R | 49.8 | Very low | 54.4 | Low | 203 Ų | 203 | 143.8 Ų | 143.8 | 77% | 0.766 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -106.1 | 126.4 | 158.5 | -158.6 | 179.9 | 178.1 | 150.2 | 2.9 | 106.8 | L165 | L165-R167 PolarHBondContact O-N 3.08Š|
| 168 | D | 55.5 | Low | 53.1 | Low | 140 Ų | 140 | 145.2 Ų | 145.2 | 75% | 0.749 | 75% | 0.745 | S | S | * | * | S | Bend | trans | 72.3 | 36.5 | 175.7 | -46.7 | -42.3 | 0 | 0 | 0 | 117.5 | K170 | D168-K170 VanDerWaalsContact C-N 3.35Å; D168-K170 PolarHBondContact O-N 2.99Å; D168-K170 VanDerWaalsContact O-N 3.12Å |
| 169 | G | 56 | Low | 52.3 | Low | 70 Ų | 70 | 139.3 Ų | 139.3 | 72% | 0.722 | 74% | 0.743 | S | S | * | * | S | Bend | trans | 68.9 | 17.2 | 153.3 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||
| 170 | K | 53.5 | Low | 51.3 | Low | 169 Ų | 169 | 136.1 Ų | 136.1 | 74% | 0.735 | 74% | 0.742 | S | S | * | * | trans | -125.7 | 121.9 | 173.4 | -68.1 | -178.6 | 179.5 | -177.2 | 0 | 111.3 | D168 F172 | D168-K170 VanDerWaalsContact C-N 3.35Å; D168-K170 PolarHBondContact O-N 2.99Å; D168-K170 VanDerWaalsContact O-N 3.12Å; K170-F172 PolarHBondContact O-N 3.38Å | ||
| 171 | P | 47.8 | Very low | 50.4 | Low | 96 Ų | 96 | 139.9 Ų | 139.9 | 62% | 0.623 | 75% | 0.749 | S | S | * | * | trans | -67.8 | 120.4 | 174.9 | 27.3 | -31.2 | 0 | 0 | 0 | 109.4 | H173 | P171-H173 PolarHBondContact O-N 2.95Å; P171-H173 VanDerWaalsContact O-N 3.15Å | ||
| 172 | F | 40.7 | Very low | 49.3 | Very low | 187 Ų | 187 | 137.6 Ų | 137.6 | 82% | 0.82 | 74% | 0.743 | S | S | * | * | trans | -69.6 | 105.6 | 170 | -119.9 | -98.7 | 0 | 0 | 0 | 108 | K170 T174 | K170-F172 PolarHBondContact O-N 3.38Å; F172-T174 PolarHBondContact O-N 3.41Å | ||
| 173 | H | 47.4 | Very low | 47.9 | Very low | 162 Ų | 162 | 138.3 Ų | 138.3 | 75% | 0.75 | 75% | 0.753 | S | S | * | * | trans | -68.1 | 115.3 | 170.3 | -72.8 | -80.4 | 0 | 0 | 0 | 108.4 | P171 C175 | P171-H173 PolarHBondContact O-N 2.95Å; P171-H173 VanDerWaalsContact O-N 3.15Å; H173-C175 PolarHBondContact O-N 3.12Å | ||
| 174 | T | 43.6 | Very low | 46.7 | Very low | 102 Ų | 102 | 137.8 Ų | 137.8 | 63% | 0.626 | 75% | 0.751 | S | S | * | * | trans | -67.8 | 121.1 | 167.7 | 40.7 | 0 | 0 | 0 | 0 | 107.7 | F172 F176 | F172-T174 PolarHBondContact O-N 3.41Å; T174-F176 PolarHBondContact O-N 3.18Å | ||
| 175 | C | 44 | Very low | 45.4 | Very low | 133 Ų | 133 | 140.5 Ų | 140.5 | 90% | 0.899 | 77% | 0.766 | S | S | * | * | trans | -57.9 | 108.5 | 175 | -53.5 | 0 | 0 | 0 | 0 | 109.4 | H173 | H173-C175 PolarHBondContact O-N 3.12Š| ||
| 176 | F | 37.3 | Very low | 43.8 | Very low | 163 Ų | 163 | 139 Ų | 139 | 72% | 0.715 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -93.4 | 133.3 | 157 | -83.3 | -85.3 | 0 | 0 | 0 | 107.8 | T174 E178 | T174-F176 PolarHBondContact O-N 3.18Å; F176-E178 PolarHBondContact O-N 3.36Å |
| 177 | I | 38.3 | Very low | 42.3 | Very low | 168 Ų | 168 | 139.8 Ų | 139.8 | 86% | 0.862 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 119.8 | 176.4 | -66.8 | -175.7 | 0 | 0 | 0 | 108.8 | ||
| 178 | E | 30.6 | Very low | 42.3 | Very low | 184 Ų | 184 | 135.8 Ų | 135.8 | 86% | 0.86 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 116.4 | 174.3 | -163.2 | 169.6 | -173.4 | 0 | 0 | 108.2 | F176 | F176-E178 PolarHBondContact O-N 3.36Š|
| 179 | A | 43.8 | Very low | 41.6 | Very low | 95 Ų | 95 | 133.3 Ų | 133.3 | 79% | 0.785 | 77% | 0.773 | S | S | * | * | trans | -110.5 | 102.4 | 165.7 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 180 | D | 40.4 | Very low | 41.3 | Very low | 146 Ų | 146 | 135.8 Ų | 135.8 | 78% | 0.781 | 78% | 0.776 | S | S | * | * | trans | -51.5 | 125.7 | 172.1 | -172 | -81.3 | 0 | 0 | 0 | 112 | ||||
| 181 | K | 39.9 | Very low | 41.1 | Very low | 198 Ų | 198 | 133.3 Ų | 133.3 | 86% | 0.861 | 78% | 0.777 | S | S | * | * | trans | -163 | 117.8 | 133 | -136.8 | 179.9 | 179.7 | -175.8 | 0 | 112.5 | ||||
| 182 | A | 39.2 | Very low | 41.1 | Very low | 84 Ų | 84 | 137 Ų | 137 | 69% | 0.694 | 79% | 0.786 | S | S | * | * | trans | -58.8 | 144.3 | 171.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 183 | S | 35.1 | Very low | 41.6 | Very low | 122 Ų | 122 | 133.1 Ų | 133.1 | 85% | 0.853 | 78% | 0.78 | S | S | * | * | -170.7 | 151.4 | 126.3 | -166.7 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 184 | C | 36.9 | Very low | 41.5 | Very low | 98 Ų | 98 | 134.5 Ų | 134.5 | 66% | 0.662 | 79% | 0.786 | S | S | * | * | trans | -109.4 | 159 | -146.5 | -29.1 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 185 | L | 40 | Very low | 41.6 | Very low | 173 Ų | 173 | 134.2 Ų | 134.2 | 91% | 0.906 | 80% | 0.795 | S | S | * | * | trans | 72.4 | 108.2 | 150.6 | -51.7 | 172.8 | 0 | 0 | 0 | 118.9 | ||||
| 186 | T | 33.3 | Very low | 42.2 | Very low | 140 Ų | 140 | 133.2 Ų | 133.2 | 86% | 0.859 | 78% | 0.784 | S | S | * | * | -168.3 | 136 | 98.8 | -156.2 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 187 | S | 35 | Very low | 42.9 | Very low | 102 Ų | 102 | 131.3 Ų | 131.3 | 71% | 0.713 | 79% | 0.788 | S | S | * | * | trans | -87.4 | -179.4 | 163.4 | -136.4 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 188 | P | 49.6 | Very low | 43.3 | Very low | 120 Ų | 120 | 131.8 Ų | 131.8 | 78% | 0.779 | 78% | 0.784 | S | S | * | * | cis | -137.4 | 171.1 | 9.3 | 33.2 | -9.6 | 0 | 0 | 0 | 117.4 | ||||
| 189 | A | 40.9 | Very low | 44.4 | Very low | 87 Ų | 87 | 128.7 Ų | 128.7 | 72% | 0.719 | 78% | 0.78 | S | S | * | * | trans | -62.9 | 168.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 190 | P | 49.4 | Very low | 44.9 | Very low | 123 Ų | 123 | 131.7 Ų | 131.7 | 80% | 0.799 | 78% | 0.782 | S | S | * | * | -154 | -159.6 | 79.7 | 37.4 | -14 | 0 | 0 | 0 | 113.5 | |||||
| 191 | P | 49.6 | Very low | 45.2 | Very low | 116 Ų | 116 | 128.8 Ų | 128.8 | 75% | 0.753 | 78% | 0.778 | S | S | * | * | -120.5 | 162 | -64.7 | 35.5 | -20.1 | 0 | 0 | 0 | 114.2 | |||||
| 192 | H | 48.1 | Very low | 45.8 | Very low | 173 Ų | 173 | 128 Ų | 128 | 80% | 0.801 | 78% | 0.775 | S | S | * | * | trans | 50.7 | 121.9 | 149.3 | -145.7 | -49.2 | 0 | 0 | 0 | 121.8 | ||||
| 193 | P | 51.9 | Low | 46.6 | Very low | 107 Ų | 107 | 129.5 Ų | 129.5 | 70% | 0.695 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -87 | 137.4 | 169.9 | 34.2 | -30.6 | 0 | 0 | 0 | 111.7 | ||
| 194 | Q | 43.9 | Very low | 47.3 | Very low | 190 Ų | 190 | 128.2 Ų | 128.2 | 89% | 0.888 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 123.7 | 162.2 | -73.3 | -123.2 | -16 | 0 | 0 | 109 | V196 | Q194-V196 PolarHBondContact O-N 3.13Š|
| 195 | A | 46.4 | Very low | 47.9 | Very low | 97 Ų | 97 | 131.4 Ų | 131.4 | 80% | 0.802 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 118.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||
| 196 | V | 55.8 | Low | 48.8 | Very low | 112 Ų | 112 | 131.9 Ų | 131.9 | 68% | 0.679 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -91.3 | 125 | 162.3 | -69.5 | 0 | 0 | 0 | 0 | 108.3 | Q194 F198 | Q194-V196 PolarHBondContact O-N 3.13Å; V196-F198 HydrophobicContact CG2-CE2 4.31Å; V196-F198 PolarHBondContact O-N 3.48Å |
| 197 | P | 51.8 | Low | 49.9 | Very low | 122 Ų | 122 | 133.9 Ų | 133.9 | 79% | 0.792 | 78% | 0.781 | S | S | * | * | trans | -75.8 | 109.7 | 169.6 | 28.7 | -28.2 | 0 | 0 | 0 | 108.1 | P199 | P197-P199 WeakPolarHBondContact O-CD 3.37Š| ||
| 198 | F | 46.6 | Very low | 50.7 | Low | 179 Ų | 179 | 134.9 Ų | 134.9 | 79% | 0.785 | 78% | 0.784 | S | S | * | * | trans | -62.7 | 125 | 163.7 | -83.4 | -91 | 0 | 0 | 0 | 108.7 | V196 L200 | V196-F198 HydrophobicContact CG2-CE2 4.31Å; V196-F198 PolarHBondContact O-N 3.48Å; F198-L200 PolarHBondContact O-N 2.78Å; F198-L200 VanDerWaalsContact O-N 3.14Å | ||
| 199 | P | 53.9 | Low | 50.9 | Low | 118 Ų | 118 | 134.2 Ų | 134.2 | 77% | 0.766 | 78% | 0.783 | S | S | * | * | trans | -74.1 | 106.9 | 169.8 | 28.7 | -28.9 | 0 | 0 | 0 | 108.4 | P197 A201 | P197-P199 WeakPolarHBondContact O-CD 3.37Å; P199-A201 PolarHBondContact O-N 3.34Å | ||
| 200 | L | 54.5 | Low | 51.4 | Low | 159 Ų | 159 | 136.7 Ų | 136.7 | 83% | 0.832 | 79% | 0.792 | S | S | * | * | trans | -71.1 | 81.7 | 161.3 | -70.7 | 176.6 | 0 | 0 | 0 | 108.4 | F198 F202 | F198-L200 PolarHBondContact O-N 2.78Å; F198-L200 VanDerWaalsContact O-N 3.14Å; L200-F202 HydrophobicContact CD2-CE2 4.1Å | ||
| 201 | A | 48.3 | Very low | 51.8 | Low | 85 Ų | 85 | 134.3 Ų | 134.3 | 70% | 0.702 | 79% | 0.79 | S | S | * | * | trans | -111.9 | 87.7 | 163.2 | 0 | 0 | 0 | 0 | 0 | 107.8 | P199 P203 | P199-A201 PolarHBondContact O-N 3.34Å; A201-P203 WeakPolarHBondContact O-CD 3.5Å | ||
| 202 | F | 52.5 | Low | 52 | Low | 182 Ų | 182 | 134.3 Ų | 134.3 | 80% | 0.798 | 79% | 0.792 | S | S | * | * | trans | -76.6 | 122.5 | 161.7 | -78.4 | -83.8 | 0 | 0 | 0 | 107.7 | L200 A204 | L200-F202 HydrophobicContact CD2-CE2 4.1Å; F202-A204 PolarHBondContact O-N 2.98Å | ||
| 203 | P | 55.8 | Low | 52.4 | Low | 115 Ų | 115 | 133.9 Ų | 133.9 | 75% | 0.747 | 80% | 0.795 | S | S | * | * | trans | -67.8 | 130.1 | 169 | 26.4 | -29.1 | 0 | 0 | 0 | 108.7 | A201 L205 | A201-P203 WeakPolarHBondContact O-CD 3.5Å; P203-L205 PolarHBondContact O-N 3.36Å; P203-L205 VanDerWaalsContact O-N 3.12Å | ||
| 204 | A | 48.9 | Very low | 52.3 | Low | 94 Ų | 94 | 133.9 Ų | 133.9 | 78% | 0.777 | 80% | 0.795 | S | S | * | * | trans | -57.6 | 114.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | F202 Q206 | F202-A204 PolarHBondContact O-N 2.98Å; A204-Q206 PolarHBondContact O-N 3.25Å | ||
| 205 | L | 49.6 | Very low | 53 | Low | 166 Ų | 166 | 130.2 Ų | 130.2 | 87% | 0.869 | 79% | 0.79 | S | S | * | * | trans | -63.3 | 104.9 | 168.6 | -87.6 | 162.9 | 0 | 0 | 0 | 108.1 | P203 H207 | P203-L205 PolarHBondContact O-N 3.36Å; P203-L205 VanDerWaalsContact O-N 3.12Å; L205-H207 PolarHBondContact O-N 3.17Å | ||
| 206 | Q | 58.6 | Low | 53.5 | Low | 183 Ų | 183 | 135.6 Ų | 135.6 | 86% | 0.855 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -60 | 124.6 | 166.8 | -73.7 | 173.9 | 22.3 | 0 | 0 | 108.7 | A204 P208 | A204-Q206 PolarHBondContact O-N 3.25Å; Q206-P208 WeakPolarHBondContact O-CD 3.5Å |
| 207 | H | 55.9 | Low | 53.4 | Low | 182 Ų | 182 | 140.8 Ų | 140.8 | 84% | 0.843 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 127.9 | 169.6 | -75.9 | -95.2 | 0 | 0 | 0 | 109.7 | L205 | L205-H207 PolarHBondContact O-N 3.17Š|
| 208 | P | 52.1 | Low | 53.6 | Low | 122 Ų | 122 | 142.4 Ų | 142.4 | 79% | 0.792 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 127 | 162.9 | 28.7 | -28.8 | 0 | 0 | 0 | 109.2 | Q206 | Q206-P208 WeakPolarHBondContact O-CD 3.5Š|
| 209 | S | 54.3 | Low | 54.1 | Low | 106 Ų | 106 | 141.7 Ų | 141.7 | 74% | 0.741 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 147.7 | 171.8 | -54.1 | 0 | 0 | 0 | 0 | 112.2 | G211 | S209-G211 PolarHBondContact O-N 3.12Å; S209-G211 VanDerWaalsContact O-N 3.14Å |
| 210 | P | 52.5 | Low | 54.1 | Low | 140 Ų | 140 | 144.8 Ų | 144.8 | 91% | 0.909 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -80.6 | 99 | 178.4 | 32.4 | -29.5 | 0 | 0 | 0 | 108.9 | ||
| 211 | G | 57.4 | Low | 54 | Low | 73 Ų | 73 | 146.9 Ų | 146.9 | 75% | 0.753 | 80% | 0.801 | S | S | * | * | trans | -176.9 | 53.7 | -177 | 0 | 0 | 0 | 0 | 0 | 115.7 | S209 | S209-G211 PolarHBondContact O-N 3.12Å; S209-G211 VanDerWaalsContact O-N 3.14Å | ||
| 212 | S | 52.6 | Low | 54.3 | Low | 116 Ų | 116 | 148.8 Ų | 148.8 | 81% | 0.811 | 81% | 0.807 | S | S | * | * | trans | -170.1 | 104.7 | 151 | -164.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 213 | L | 57.5 | Low | 54.1 | Low | 163 Ų | 163 | 144.8 Ų | 144.8 | 85% | 0.853 | 81% | 0.807 | S | S | * | * | trans | -78.9 | 132.4 | 159.7 | -75.5 | 168.6 | 0 | 0 | 0 | 107.6 | S215 | L213-S215 PolarHBondContact O-N 3.36Š| ||
| 214 | P | 50.3 | Low | 53.7 | Low | 108 Ų | 108 | 144.2 Ų | 144.2 | 70% | 0.701 | 81% | 0.812 | S | S | * | * | trans | -67.4 | 128.3 | 172.7 | 24.9 | -30.7 | 0 | 0 | 0 | 110.5 | R216 | P214-R216 PolarHBondContact O-N 3.01Š| ||
| 215 | S | 58.3 | Low | 53.7 | Low | 112 Ų | 112 | 144.4 Ų | 144.4 | 78% | 0.783 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -62.8 | 22.2 | 178.2 | -60.8 | 0 | 0 | 0 | 0 | 115.8 | L213 Y217 | L213-S215 PolarHBondContact O-N 3.36Å; S215-Y217 VanDerWaalsContact C-N 3.32Å; S215-Y217 PolarHBondContact O-N 3.45Å |
| 216 | R | 56.9 | Low | 53.8 | Low | 211 Ų | 211 | 140.8 Ų | 140.8 | 80% | 0.796 | 81% | 0.808 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.4 | 9.7 | -170.9 | -149.4 | -167 | 176.9 | -126.8 | 0.3 | 114.9 | P214 | P214-R216 PolarHBondContact O-N 3.01Š|
| 217 | Y | 53.7 | Low | 53.4 | Low | 220 Ų | 220 | 136.9 Ų | 136.9 | 86% | 0.863 | 80% | 0.801 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.9 | 36.6 | 179.5 | -84.7 | -81.3 | 0 | 0 | 0 | 113.7 | S215 | S215-Y217 VanDerWaalsContact C-N 3.32Å; S215-Y217 PolarHBondContact O-N 3.45Å |
| 218 | Q | 55.1 | Low | 53.4 | Low | 157 Ų | 157 | 139.2 Ų | 139.2 | 73% | 0.734 | 80% | 0.802 | S | S | * | * | trans | -117.9 | 53.7 | 175.1 | -165.6 | 165.9 | -0.7 | 0 | 0 | 111.8 | ||||
| 219 | Q | 57.5 | Low | 53.5 | Low | 164 Ų | 164 | 142.5 Ų | 142.5 | 77% | 0.766 | 80% | 0.804 | S | S | * | * | S | Bend | trans | -150.6 | 15.5 | 169.6 | -82.2 | -44.3 | -21.3 | 0 | 0 | 118.8 | ||
| 220 | H | 54.9 | Low | 53.1 | Low | 182 Ų | 182 | 141 Ų | 141 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | trans | -147.6 | 82 | 168.5 | -73.3 | -70.3 | 0 | 0 | 0 | 113.3 | ||||
| 221 | F | 51.8 | Low | 52.9 | Low | 203 Ų | 203 | 149.9 Ų | 149.9 | 89% | 0.89 | 81% | 0.814 | S | S | * | * | trans | -127.1 | 112.1 | 149.8 | -81.6 | -80.9 | 0 | 0 | 0 | 107.5 | A223 | F221-A223 PolarHBondContact O-N 3.34Š| ||
| 222 | P | 53.3 | Low | 52.7 | Low | 126 Ų | 126 | 153.8 Ų | 153.8 | 82% | 0.818 | 82% | 0.817 | S | S | * | * | trans | -66.5 | 127 | 166.9 | 26.2 | -28.9 | 0 | 0 | 0 | 108.4 | A224 | P222-A224 PolarHBondContact O-N 3.41Š| ||
| 223 | A | 49.7 | Very low | 52.7 | Low | 98 Ų | 98 | 155.7 Ų | 155.7 | 81% | 0.81 | 82% | 0.817 | S | S | * | * | trans | -52.7 | 129.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | F221 A225 | F221-A223 PolarHBondContact O-N 3.34Å; A223-A225 PolarHBondContact O-N 3.21Å | ||
| 224 | A | 46.8 | Very low | 52.4 | Low | 102 Ų | 102 | 155.3 Ų | 155.3 | 84% | 0.843 | 82% | 0.815 | S | S | * | * | trans | -60.6 | 115.6 | 169.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | P222 A226 | P222-A224 PolarHBondContact O-N 3.41Å; A224-A226 PolarHBondContact O-N 3.38Å | ||
| 225 | A | 48.7 | Very low | 52.6 | Low | 99 Ų | 99 | 158.1 Ų | 158.1 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | trans | -66.7 | 117 | 166.3 | 0 | 0 | 0 | 0 | 0 | 108.1 | A223 S227 | A223-A225 PolarHBondContact O-N 3.21Å; A225-S227 PolarHBondContact O-N 3.4Å; A225-S227 VanDerWaalsContact O-N 3.12Å | ||
| 226 | A | 51.1 | Low | 52.2 | Low | 89 Ų | 89 | 161 Ų | 161 | 74% | 0.736 | 82% | 0.824 | S | S | * | * | trans | -58.4 | 109.2 | 169.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | A224 R228 | A224-A226 PolarHBondContact O-N 3.38Å; A226-R228 PolarHBondContact O-N 3.14Å | ||
| 227 | S | 52 | Low | 51.9 | Low | 102 Ų | 102 | 157.7 Ų | 157.7 | 71% | 0.713 | 83% | 0.826 | S | S | * | * | trans | -88 | 96 | 163.6 | -160.5 | 0 | 0 | 0 | 0 | 107.9 | A225 F229 | A225-S227 PolarHBondContact O-N 3.4Å; A225-S227 VanDerWaalsContact O-N 3.12Å; S227-F229 PolarHBondContact O-N 3.41Å | ||
| 228 | R | 54.5 | Low | 51.8 | Low | 230 Ų | 230 | 153.2 Ų | 153.2 | 87% | 0.868 | 82% | 0.824 | S | S | * | * | trans | -76.9 | 106.6 | 165.1 | -66.7 | 177 | 142.9 | -161.1 | -7 | 107.3 | A226 | A226-R228 PolarHBondContact O-N 3.14Š| ||
| 229 | F | 53.8 | Low | 51.5 | Low | 191 Ų | 191 | 152.9 Ų | 152.9 | 84% | 0.838 | 83% | 0.831 | S | S | * | * | trans | -120.8 | 117 | 154.2 | -84 | -80.7 | 0 | 0 | 0 | 108.7 | S227 | S227-F229 PolarHBondContact O-N 3.41Š| ||
| 230 | A | 46.7 | Very low | 51 | Low | 74 Ų | 74 | 152 Ų | 152 | 61% | 0.612 | 84% | 0.836 | S | S | * | * | trans | -86.2 | 160.5 | 169.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 231 | W | 48.8 | Very low | 50.6 | Low | 328 Ų | 328 | 149.3 Ų | 149.3 | 100% | 1.242 | 84% | 0.835 | S | S | * | * | trans | 83.8 | 0 | 175.1 | -49.6 | 87.5 | 0 | 0 | 0 | 115.3 |
Retrieved 231 of 231 residues in 344.4 ms
(Link to these results)