| 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 | 80.2 | Confident | 84 | Confident | 214 Ų | 214 | 155 Ų | 155 | 100% | 1.054 | 81% | 0.806 | S | S | * | * | 0 | 143.7 | 0 | -102.9 | -175.8 | 69.7 | 0 | 0 | 107.6 | |||||
| 2 | P | 82.5 | Confident | 84.1 | Confident | 116 Ų | 116 | 151.3 Ų | 151.3 | 75% | 0.753 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 142.2 | 163.7 | 27.2 | -31.4 | 0 | 0 | 0 | 109.3 | ||
| 3 | D | 83.6 | Confident | 84.1 | Confident | 155 Ų | 155 | 151.4 Ų | 151.4 | 83% | 0.829 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 141.6 | 173.8 | -76.8 | -28.2 | 0 | 0 | 0 | 109.9 | ||
| 4 | V | 84.7 | Confident | 84.2 | Confident | 122 Ų | 122 | 148.4 Ų | 148.4 | 74% | 0.739 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 125 | 178.4 | 179.7 | 0 | 0 | 0 | 0 | 107.9 | F6 | V4-F6 PolarHBondContact O-N 3.31Š|
| 5 | P | 82.9 | Confident | 84 | Confident | 112 Ų | 112 | 144.7 Ų | 144.7 | 73% | 0.727 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 142.9 | 178.3 | 23.2 | -32.1 | 0 | 0 | 0 | 109.8 | E7 | P5-E7 PolarHBondContact O-N 3.27Š|
| 6 | F | 82.3 | Confident | 83.6 | Confident | 209 Ų | 209 | 142.1 Ų | 142.1 | 92% | 0.917 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 133.5 | 179.1 | -62.7 | -76.2 | 0 | 0 | 0 | 110.7 | V4 T8 | V4-F6 PolarHBondContact O-N 3.31Å; F6-T8 PolarHBondContact O-N 2.86Å |
| 7 | E | 84 | Confident | 82.9 | Confident | 170 Ų | 170 | 142.5 Ų | 142.5 | 79% | 0.794 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 137.8 | 175.7 | -168.3 | 169.5 | -168.2 | 0 | 0 | 110.1 | P5 K9 | P5-E7 PolarHBondContact O-N 3.27Å; E7-K9 PolarHBondContact O-N 3.37Å; E7-K9 VanDerWaalsContact O-N 3.17Å |
| 8 | T | 85.6 | Confident | 82.4 | Confident | 101 Ų | 101 | 143.6 Ų | 143.6 | 62% | 0.62 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 121.1 | 179.7 | 49.2 | 0 | 0 | 0 | 0 | 109.5 | F6 F10 | F6-T8 PolarHBondContact O-N 2.86Å; T8-F10 WeakPolarHBondContact O-CD2 3.23Å; T8-F10 PolarHBondContact O-N 3.31Å; T8-F10 VanDerWaalsContact O-N 3.12Å |
| 9 | K | 85.6 | Confident | 81.4 | Confident | 201 Ų | 201 | 145.2 Ų | 145.2 | 87% | 0.874 | 74% | 0.736 | S | S | * | * | trans | -71.2 | 107.3 | 174 | -63.8 | -176.7 | -179.1 | -179.9 | 0 | 109 | E7 V11 | E7-K9 PolarHBondContact O-N 3.37Å; E7-K9 VanDerWaalsContact O-N 3.17Å; K9-V11 PolarHBondContact O-N 3.18Å | ||
| 10 | F | 86.6 | Confident | 80.7 | Confident | 174 Ų | 174 | 147.8 Ų | 147.8 | 76% | 0.763 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 125.5 | 170.9 | -65.9 | -80.9 | 0 | 0 | 0 | 109.7 | T8 | T8-F10 WeakPolarHBondContact O-CD2 3.23Å; T8-F10 PolarHBondContact O-N 3.31Å; T8-F10 VanDerWaalsContact O-N 3.12Å |
| 11 | V | 86.3 | Confident | 80 | Confident | 131 Ų | 131 | 146.2 Ų | 146.2 | 79% | 0.794 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 123.1 | 170.9 | -179.6 | 0 | 0 | 0 | 0 | 107.4 | K9 Y13 | K9-V11 PolarHBondContact O-N 3.18Å; V11-Y13 PolarHBondContact O-N 3.45Å |
| 12 | P | 85.2 | Confident | 79.7 | Confident | 110 Ų | 110 | 140.3 Ų | 140.3 | 71% | 0.714 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 133.2 | 178.6 | 25.1 | -32.5 | 0 | 0 | 0 | 109.9 | P14 | P12-P14 WeakPolarHBondContact O-CD 3.33Š|
| 13 | Y | 84.2 | Confident | 79.3 | Confident | 153 Ų | 153 | 143.6 Ų | 143.6 | 60% | 0.6 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 119.2 | 176.2 | -176.1 | -115.9 | 0 | 0 | 0 | 108.8 | V11 F15 L17 | V11-Y13 PolarHBondContact O-N 3.45Å; Y13-F15 HydrophobicContact CD1-CB 4.05Å; Y13-F15 HydrophobicContact CD1-CD2 4.43Å; Y13-F15 WeakPolarHBondContact CD1-O 3.25Å; Y13-F15 HydrophobicContact CD2-CD2 4.19Å; Y13-F15 HydrophobicContact CE1-CB 3.51Å; Y13-F15 AromaticContact CE1-CD2 3.89Å; Y13-F15 HydrophobicContact CE1-CD2 3.89Å; Y13-F15 HydrophobicContact CE1-CG 4.19Å; Y13-F15 WeakPolarHBondContact CE1-O 3.3Å; Y13-F15 AromaticContact CE2-CD2 3.58Å; Y13-F15 HydrophobicContact CE2-CD2 3.58Å; Y13-F15 HydrophobicContact CE2-CE2 4.23Å; Y13-F15 AromaticContact CZ-CD2 3.4Å; Y13-F15 VanDerWaalsContact CZ-CD2 3.4Å; Y13-F15 PolarHBondContact O-N 3.16Å; Y13-F15 VanDerWaalsContact O-N 3.12Å; Y13-F15 WeakPolarHBondContact OH-CD2 3.19Å; Y13-L17 HydrophobicContact CD1-CG 4.35Å |
| 14 | P | 85.3 | Confident | 79.1 | Confident | 109 Ų | 109 | 143.2 Ų | 143.2 | 71% | 0.708 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -76.3 | -0.4 | -169 | 30.5 | -35.8 | 0 | 0 | 0 | 113.4 | P12 | P12-P14 WeakPolarHBondContact O-CD 3.33Š|
| 15 | F | 80.9 | Confident | 79 | Confident | 94 Ų | 94 | 141.6 Ų | 141.6 | 41% | 0.412 | 70% | 0.696 | S | S | . | * | S | Bend | trans | -108.7 | 140.1 | 179.2 | -47.8 | -79.9 | 0 | 0 | 0 | 110 | Y13 L17 | Y13-F15 HydrophobicContact CD1-CB 4.05Å; Y13-F15 HydrophobicContact CD1-CD2 4.43Å; Y13-F15 WeakPolarHBondContact CD1-O 3.25Å; Y13-F15 HydrophobicContact CD2-CD2 4.19Å; Y13-F15 HydrophobicContact CE1-CB 3.51Å; Y13-F15 AromaticContact CE1-CD2 3.89Å; Y13-F15 HydrophobicContact CE1-CD2 3.89Å; Y13-F15 HydrophobicContact CE1-CG 4.19Å; Y13-F15 WeakPolarHBondContact CE1-O 3.3Å; Y13-F15 AromaticContact CE2-CD2 3.58Å; Y13-F15 HydrophobicContact CE2-CD2 3.58Å; Y13-F15 HydrophobicContact CE2-CE2 4.23Å; Y13-F15 AromaticContact CZ-CD2 3.4Å; Y13-F15 VanDerWaalsContact CZ-CD2 3.4Å; Y13-F15 PolarHBondContact O-N 3.16Å; Y13-F15 VanDerWaalsContact O-N 3.12Å; Y13-F15 WeakPolarHBondContact OH-CD2 3.19Å; F15-L17 PolarHBondContact O-N 3.03Å |
| 16 | D | 76.9 | Confident | 79.1 | Confident | 103 Ų | 103 | 139.6 Ų | 139.6 | 55% | 0.551 | 68% | 0.681 | S | S | * | * | trans | -57.4 | 122.8 | 172.6 | -169.5 | -4.7 | 0 | 0 | 0 | 109.3 | K18 R19 | D16-K18 PolarHBondContact O-N 3.48Å; D16-K18 WeakPolarHBondContact OD1-CA 3.49Å; D16-K18 VanDerWaalsContact OD1-CB 3.26Å; D16-K18 WeakPolarHBondContact OD1-CB 3.33Å; D16-K18 PolarHBondContact OD1-N 2.66Å; D16-R19 HydrophobicContact CB-CB 4.47Å; D16-R19 WeakPolarHBondContact O-CB 3.47Å; D16-R19 PolarHBondContact O-N 3.41Å | ||
| 17 | L | 73.1 | Confident | 79.4 | Confident | 149 Ų | 149 | 138.3 Ų | 138.3 | 78% | 0.78 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.4 | -16.9 | 172.1 | -80 | 148.7 | 0 | 0 | 0 | 111.1 | Y13 F15 R19 | Y13-L17 HydrophobicContact CD1-CG 4.35Å; F15-L17 PolarHBondContact O-N 3.03Å; L17-R19 PolarHBondContact O-N 3.19Å |
| 18 | K | 73.3 | Confident | 79.5 | Confident | 162 Ų | 162 | 136.6 Ų | 136.6 | 70% | 0.704 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | 17.3 | 167.7 | -52.8 | 178.5 | -179.8 | 178.4 | 0 | 112.9 | D16 Y20 | D16-K18 PolarHBondContact O-N 3.48Å; D16-K18 WeakPolarHBondContact OD1-CA 3.49Å; D16-K18 VanDerWaalsContact OD1-CB 3.26Å; D16-K18 WeakPolarHBondContact OD1-CB 3.33Å; D16-K18 PolarHBondContact OD1-N 2.66Å; K18-Y20 PolarHBondContact O-N 3.08Å |
| 19 | R | 63.2 | Low | 79.6 | Confident | 174 Ų | 174 | 135.4 Ų | 135.4 | 66% | 0.657 | 66% | 0.658 | S | S | * | * | trans | -69.1 | 39.2 | 170.8 | -161.9 | -179.4 | -166.3 | -157.8 | 3.2 | 112.1 | D16 L17 V21 | D16-R19 HydrophobicContact CB-CB 4.47Å; D16-R19 WeakPolarHBondContact O-CB 3.47Å; D16-R19 PolarHBondContact O-N 3.41Å; L17-R19 PolarHBondContact O-N 3.19Å; R19-V21 PolarHBondContact O-N 3.26Å | ||
| 20 | Y | 67.6 | Low | 79.7 | Confident | 196 Ų | 196 | 131 Ų | 131 | 77% | 0.769 | 65% | 0.648 | S | S | * | * | trans | -63.6 | 113.6 | 149.6 | -60.1 | -71.4 | 0 | 0 | 0 | 106.1 | K18 P22 | K18-Y20 PolarHBondContact O-N 3.08Å; Y20-P22 WeakPolarHBondContact O-CD 3.46Å | ||
| 21 | V | 65.9 | Low | 79.9 | Confident | 115 Ų | 115 | 126.4 Ų | 126.4 | 70% | 0.697 | 64% | 0.638 | S | S | * | * | trans | -58.9 | 118.5 | 163.4 | 177.9 | 0 | 0 | 0 | 0 | 104.9 | R19 Y23 | R19-V21 PolarHBondContact O-N 3.26Å; V21-Y23 PolarHBondContact O-N 3.28Å; V21-Y23 VanDerWaalsContact O-N 3.13Å | ||
| 22 | P | 72.7 | Confident | 80.1 | Confident | 90 Ų | 90 | 125.9 Ų | 125.9 | 58% | 0.584 | 63% | 0.625 | S | S | * | * | trans | -53.3 | 129 | 171.6 | 23.2 | -32.2 | 0 | 0 | 0 | 106.2 | Y20 K24 | Y20-P22 WeakPolarHBondContact O-CD 3.46Å; P22-K24 WeakPolarHBondContact O-CG 3.25Å; P22-K24 PolarHBondContact O-N 3.27Å | ||
| 23 | Y | 74.8 | Confident | 80.4 | Confident | 185 Ų | 185 | 129.5 Ų | 129.5 | 73% | 0.725 | 63% | 0.63 | S | S | * | * | trans | -50.1 | 110 | -179.4 | 175.2 | -95.2 | 0 | 0 | 0 | 108.2 | V21 E29 | V21-Y23 PolarHBondContact O-N 3.28Å; V21-Y23 VanDerWaalsContact O-N 3.13Å; Y23-E29 PolarHBondContact OH-OE2 3.29Å | ||
| 24 | K | 79 | Confident | 80.7 | Confident | 148 Ų | 148 | 130 Ų | 130 | 64% | 0.643 | 64% | 0.635 | S | S | * | * | trans | -118.8 | 114.3 | 177.5 | -79.7 | -177.2 | -178.4 | -174.8 | 0 | 105.1 | P22 T26 | P22-K24 WeakPolarHBondContact O-CG 3.25Å; P22-K24 PolarHBondContact O-N 3.27Å; K24-T26 PolarHBondContact O-N 3.31Å; K24-T26 VanDerWaalsContact O-N 3.1Å | ||
| 25 | P | 83.7 | Confident | 80.9 | Confident | 88 Ų | 88 | 131.7 Ų | 131.7 | 57% | 0.571 | 64% | 0.638 | S | S | * | * | trans | -55.9 | 122.4 | 179 | 22.5 | -31.9 | 0 | 0 | 0 | 108.6 | ||||
| 26 | T | 84.9 | Confident | 81.1 | Confident | 69 Ų | 69 | 135.7 Ų | 135.7 | 42% | 0.423 | 66% | 0.658 | S | S | . | * | trans | -81 | 156.9 | -178 | 59.4 | 0 | 0 | 0 | 0 | 110.6 | K24 L28 E29 T30 | K24-T26 PolarHBondContact O-N 3.31Å; K24-T26 VanDerWaalsContact O-N 3.1Å; T26-L28 PolarHBondContact O-N 3.39Å; T26-L28 VanDerWaalsContact O-N 3.12Å; T26-E29 PolarHBondContact N-OE1 3.3Å; T26-E29 WeakPolarHBondContact O-CB 3.24Å; T26-E29 PolarHBondContact O-N 3.06Å; T26-E29 VanDerWaalsContact O-N 3.09Å; T26-E29 PolarHBondContact OG1-OE1 3.08Å; T26-T30 PolarHBondContact O-N 2.95Å | ||
| 27 | K | 88 | Confident | 81.5 | Confident | 183 Ų | 183 | 139 Ų | 139 | 80% | 0.796 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -55.1 | -32.1 | 173.7 | -74.1 | -170.7 | 177.5 | -175.9 | 0 | 111.9 | T30 S31 | K27-T30 WeakPolarHBondContact CA-OG1 3.34Å; K27-T30 PolarHBondContact O-N 3.19Å; K27-T30 PolarHBondContact O-OG1 2.77Å; K27-S31 VanDerWaalsContact O-CB 3.26Å; K27-S31 WeakPolarHBondContact O-CB 2.81Å; K27-S31 PolarHBondContact O-N 3.48Å; K27-S31 PolarHBondContact O-OG 3.36Å |
| 28 | L | 86.5 | Confident | 82.2 | Confident | 134 Ų | 134 | 135 Ų | 135 | 70% | 0.702 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -60.2 | -48 | 177.8 | -171.3 | 65.5 | 0 | 0 | 0 | 111.5 | T26 T30 S31 F32 | T26-L28 PolarHBondContact O-N 3.39Å; T26-L28 VanDerWaalsContact O-N 3.12Å; L28-T30 PolarHBondContact O-N 2.9Å; L28-S31 WeakPolarHBondContact CA-OG 3.15Å; L28-S31 PolarHBondContact O-N 3.36Å; L28-S31 PolarHBondContact O-OG 2.78Å; L28-F32 PolarHBondContact O-N 3.05Å |
| 29 | E | 88.1 | Confident | 82.8 | Confident | 76 Ų | 76 | 133.6 Ų | 133.6 | 36% | 0.355 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -59.9 | -44.9 | 175.2 | -70.3 | 159.1 | -109.3 | 0 | 0 | 111.5 | Y23 T26 S31 F32 | Y23-E29 PolarHBondContact OH-OE2 3.29Å; T26-E29 PolarHBondContact N-OE1 3.3Å; T26-E29 WeakPolarHBondContact O-CB 3.24Å; T26-E29 PolarHBondContact O-N 3.06Å; T26-E29 VanDerWaalsContact O-N 3.09Å; T26-E29 PolarHBondContact OG1-OE1 3.08Å; E29-S31 VanDerWaalsContact C-N 3.32Å; E29-S31 PolarHBondContact O-N 2.87Å; E29-F32 WeakPolarHBondContact O-CB 3.42Å; E29-F32 PolarHBondContact O-N 3.05Å |
| 30 | T | 87.6 | Confident | 83.8 | Confident | 107 Ų | 107 | 135.1 Ų | 135.1 | 66% | 0.656 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -71.3 | -26.3 | -179.2 | 59.2 | 0 | 0 | 0 | 0 | 113.7 | T26 K27 L28 | T26-T30 PolarHBondContact O-N 2.95Å; K27-T30 WeakPolarHBondContact CA-OG1 3.34Å; K27-T30 PolarHBondContact O-N 3.19Å; K27-T30 PolarHBondContact O-OG1 2.77Å; L28-T30 PolarHBondContact O-N 2.9Å |
| 31 | S | 90.1 | Very high | 84.7 | Confident | 79 Ų | 79 | 131.4 Ų | 131.4 | 55% | 0.552 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -90.3 | -7.7 | 178.7 | 66.1 | 0 | 0 | 0 | 0 | 113.2 | K27 L28 E29 K33 | K27-S31 VanDerWaalsContact O-CB 3.26Å; K27-S31 WeakPolarHBondContact O-CB 2.81Å; K27-S31 PolarHBondContact O-N 3.48Å; K27-S31 PolarHBondContact O-OG 3.36Å; L28-S31 WeakPolarHBondContact CA-OG 3.15Å; L28-S31 PolarHBondContact O-N 3.36Å; L28-S31 PolarHBondContact O-OG 2.78Å; E29-S31 VanDerWaalsContact C-N 3.32Å; E29-S31 PolarHBondContact O-N 2.87Å; S31-K33 PolarHBondContact O-N 3.03Å |
| 32 | F | 91.3 | Very high | 85.7 | Confident | 120 Ų | 120 | 131.4 Ų | 131.4 | 53% | 0.526 | 65% | 0.653 | S | S | . | * | trans | -68.5 | 121.1 | -178.7 | -173.3 | -98.3 | 0 | 0 | 0 | 109.5 | L28 E29 F34 | L28-F32 PolarHBondContact O-N 3.05Å; E29-F32 WeakPolarHBondContact O-CB 3.42Å; E29-F32 PolarHBondContact O-N 3.05Å; F32-F34 AromaticContact CD1-CD1 3.69Å; F32-F34 HydrophobicContact CD1-CD1 3.69Å; F32-F34 HydrophobicContact CD1-CD2 4.1Å; F32-F34 AromaticContact CD1-CE1 3.64Å; F32-F34 HydrophobicContact CD1-CE1 3.64Å; F32-F34 HydrophobicContact CD1-CE2 4.06Å; F32-F34 AromaticContact CD1-CG 3.92Å; F32-F34 HydrophobicContact CD1-CG 3.92Å; F32-F34 AromaticContact CD1-CZ 3.83Å; F32-F34 HydrophobicContact CD1-CZ 3.83Å; F32-F34 AromaticContact CE1-CD1 3.57Å; F32-F34 HydrophobicContact CE1-CD1 3.57Å; F32-F34 AromaticContact CE1-CE1 3.82Å; F32-F34 HydrophobicContact CE1-CE1 3.82Å; F32-F34 HydrophobicContact CE1-CG 4.04Å; F32-F34 HydrophobicContact CE1-CZ 4.46Å | ||
| 33 | K | 91.6 | Very high | 86.1 | Confident | 186 Ų | 186 | 134.5 Ų | 134.5 | 81% | 0.809 | 66% | 0.659 | S | S | * | * | trans | -86.9 | 110 | 173 | -65.6 | -174.1 | 178.1 | -175.3 | 0 | 107.6 | S31 | S31-K33 PolarHBondContact O-N 3.03Š| ||
| 34 | F | 90.2 | Very high | 86.5 | Confident | 164 Ų | 164 | 131.2 Ų | 131.2 | 72% | 0.719 | 65% | 0.653 | S | S | * | * | trans | -70.3 | 135.6 | 173.4 | -63.8 | -85.7 | 0 | 0 | 0 | 109.7 | F32 Q36 | F32-F34 AromaticContact CD1-CD1 3.69Å; F32-F34 HydrophobicContact CD1-CD1 3.69Å; F32-F34 HydrophobicContact CD1-CD2 4.1Å; F32-F34 AromaticContact CD1-CE1 3.64Å; F32-F34 HydrophobicContact CD1-CE1 3.64Å; F32-F34 HydrophobicContact CD1-CE2 4.06Å; F32-F34 AromaticContact CD1-CG 3.92Å; F32-F34 HydrophobicContact CD1-CG 3.92Å; F32-F34 AromaticContact CD1-CZ 3.83Å; F32-F34 HydrophobicContact CD1-CZ 3.83Å; F32-F34 AromaticContact CE1-CD1 3.57Å; F32-F34 HydrophobicContact CE1-CD1 3.57Å; F32-F34 AromaticContact CE1-CE1 3.82Å; F32-F34 HydrophobicContact CE1-CE1 3.82Å; F32-F34 HydrophobicContact CE1-CG 4.04Å; F32-F34 HydrophobicContact CE1-CZ 4.46Å; F34-Q36 PolarHBondContact O-N 3.46Å | ||
| 35 | D | 89 | Confident | 86.4 | Confident | 143 Ų | 143 | 130.1 Ų | 130.1 | 77% | 0.765 | 66% | 0.662 | S | S | * | * | trans | -61.9 | 134.4 | 169.4 | -68 | -20.3 | 0 | 0 | 0 | 108.8 | L37 | D35-L37 PolarHBondContact O-N 3.26Š| ||
| 36 | Q | 86 | Confident | 86 | Confident | 178 Ų | 178 | 131.9 Ų | 131.9 | 83% | 0.832 | 66% | 0.661 | S | S | * | * | trans | -71.5 | 104.3 | 174.7 | -70.7 | -179.4 | -10.1 | 0 | 0 | 108.4 | F34 V38 | F34-Q36 PolarHBondContact O-N 3.46Å; Q36-V38 HydrophobicContact CB-CG2 3.96Å; Q36-V38 PolarHBondContact O-N 2.82Å | ||
| 37 | L | 85.2 | Confident | 85.9 | Confident | 174 Ų | 174 | 131.8 Ų | 131.8 | 91% | 0.911 | 66% | 0.659 | S | S | * | * | trans | -77.5 | 88.7 | 173.9 | -62.1 | 178.3 | 0 | 0 | 0 | 108.7 | D35 | D35-L37 PolarHBondContact O-N 3.26Š| ||
| 38 | V | 86.4 | Confident | 85.6 | Confident | 63 Ų | 63 | 129.7 Ų | 129.7 | 38% | 0.382 | 66% | 0.655 | S | S | . | * | trans | -103.3 | 153.5 | 178.2 | -163.5 | 0 | 0 | 0 | 0 | 109.8 | Q36 L42 E43 | Q36-V38 HydrophobicContact CB-CG2 3.96Å; Q36-V38 PolarHBondContact O-N 2.82Å; V38-L42 HydrophobicContact CB-CD2 4.11Å; V38-L42 HydrophobicContact CG1-CB 4.47Å; V38-L42 HydrophobicContact CG1-CD2 4.05Å; V38-E43 HydrophobicContact CG1-CG 4.25Å | ||
| 39 | E | 86.8 | Confident | 85.4 | Confident | 133 Ų | 133 | 129.5 Ų | 129.5 | 62% | 0.621 | 66% | 0.659 | S | S | * | * | trans | -55.7 | 157.6 | 168.1 | -62.4 | -169 | 161.2 | 0 | 0 | 111.3 | D41 L42 | E39-D41 PolarHBondContact O-N 3.36Å; E39-D41 VanDerWaalsContact O-N 3.08Å; E39-L42 PolarHBondContact O-N 2.71Å | ||
| 40 | K | 85.1 | Confident | 84.7 | Confident | 206 Ų | 206 | 129.9 Ų | 129.9 | 90% | 0.896 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.2 | -30.7 | -178.5 | -69.6 | -175.9 | 178.6 | 179.2 | 0 | 113.1 | L42 | K40-L42 VanDerWaalsContact C-N 3.3Š|
| 41 | D | 86.2 | Confident | 84.1 | Confident | 119 Ų | 119 | 126.4 Ų | 126.4 | 64% | 0.636 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.9 | 10.1 | -177.3 | -56.7 | -28.8 | 0 | 0 | 0 | 112.3 | E39 E43 I44 | E39-D41 PolarHBondContact O-N 3.36Å; E39-D41 VanDerWaalsContact O-N 3.08Å; D41-E43 PolarHBondContact O-N 3.15Å; D41-E43 VanDerWaalsContact O-N 3.1Å; D41-I44 WeakPolarHBondContact O-CA 3.4Å; D41-I44 WeakPolarHBondContact O-CB 3.31Å; D41-I44 PolarHBondContact O-N 2.81Å |
| 42 | L | 85.7 | Confident | 83.3 | Confident | 114 Ų | 114 | 127.7 Ų | 127.7 | 60% | 0.597 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 54.9 | 27.2 | -179.3 | -60 | 175.2 | 0 | 0 | 0 | 113.9 | V38 E39 K40 I44 | V38-L42 HydrophobicContact CB-CD2 4.11Å; V38-L42 HydrophobicContact CG1-CB 4.47Å; V38-L42 HydrophobicContact CG1-CD2 4.05Å; E39-L42 PolarHBondContact O-N 2.71Å; K40-L42 VanDerWaalsContact C-N 3.3Å; L42-I44 HydrophobicContact CB-CD1 4.15Å; L42-I44 HydrophobicContact CB-CG1 4.19Å; L42-I44 PolarHBondContact O-N 3.02Å; L42-I44 VanDerWaalsContact O-N 3.14Å |
| 43 | E | 81.3 | Confident | 82.3 | Confident | 155 Ų | 155 | 125.1 Ų | 125.1 | 72% | 0.724 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 59.9 | 13.1 | -170.3 | -55.2 | 178.4 | 174.4 | 0 | 0 | 114.1 | V38 D41 C45 | V38-E43 HydrophobicContact CG1-CG 4.25Å; D41-E43 PolarHBondContact O-N 3.15Å; D41-E43 VanDerWaalsContact O-N 3.1Å; E43-C45 PolarHBondContact O-N 3.49Å |
| 44 | I | 84 | Confident | 81.4 | Confident | 117 Ų | 117 | 123.5 Ų | 123.5 | 60% | 0.6 | 66% | 0.658 | S | S | * | * | trans | -88 | 83.2 | 175.5 | -53.2 | 174.3 | 0 | 0 | 0 | 108 | D41 L42 F46 | D41-I44 WeakPolarHBondContact O-CA 3.4Å; D41-I44 WeakPolarHBondContact O-CB 3.31Å; D41-I44 PolarHBondContact O-N 2.81Å; L42-I44 HydrophobicContact CB-CD1 4.15Å; L42-I44 HydrophobicContact CB-CG1 4.19Å; L42-I44 PolarHBondContact O-N 3.02Å; L42-I44 VanDerWaalsContact O-N 3.14Å; I44-F46 PolarHBondContact O-N 3.11Å | ||
| 45 | C | 77.4 | Confident | 80.6 | Confident | 124 Ų | 124 | 124.5 Ų | 124.5 | 84% | 0.838 | 66% | 0.663 | S | S | * | * | trans | -75.2 | 93.1 | 174.2 | -171.1 | 0 | 0 | 0 | 0 | 110.1 | E43 | E43-C45 PolarHBondContact O-N 3.49Š| ||
| 46 | F | 75.3 | Confident | 79.9 | Confident | 125 Ų | 125 | 125 Ų | 125 | 55% | 0.548 | 67% | 0.665 | S | S | . | * | trans | -97.3 | 101.7 | 175.8 | -171.3 | -108.1 | 0 | 0 | 0 | 110.8 | I44 L48 A51 F54 | I44-F46 PolarHBondContact O-N 3.11Å; F46-L48 HydrophobicContact CD1-CD2 3.93Å; F46-L48 HydrophobicContact CD1-CG 4.44Å; F46-L48 HydrophobicContact CE1-CD2 3.4Å; F46-L48 HydrophobicContact CE1-CG 4.34Å; F46-L48 HydrophobicContact CZ-CD2 4.38Å; F46-A51 HydrophobicContact CZ-CB 4.39Å; F46-F54 HydrophobicContact CE2-CD2 4.36Å | ||
| 47 | D | 82.6 | Confident | 79.2 | Confident | 68 Ų | 68 | 121.9 Ų | 121.9 | 36% | 0.364 | 65% | 0.654 | S | S | . | * | trans | -90.6 | 115.4 | 176.1 | 172.9 | 28.4 | 0 | 0 | 0 | 111.3 | V49 T50 A51 | D47-V49 PolarHBondContact O-N 3.35Å; D47-V49 VanDerWaalsContact OD1-CB 3.29Å; D47-V49 WeakPolarHBondContact OD1-CB 3.44Å; D47-V49 WeakPolarHBondContact OD1-CG2 3.38Å; D47-V49 PolarHBondContact OD1-N 3.1Å; D47-T50 WeakPolarHBondContact CB-OG1 3.32Å; D47-T50 PolarHBondContact O-N 3.14Å; D47-T50 PolarHBondContact O-OG1 3.02Å; D47-T50 WeakPolarHBondContact OD2-CG2 3.48Å; D47-T50 PolarHBondContact OD2-N 3Å; D47-T50 PolarHBondContact OD2-OG1 2.64Å; D47-A51 PolarHBondContact O-N 2.64Å | ||
| 48 | L | 81.3 | Confident | 78.8 | Confident | 138 Ų | 138 | 120.2 Ų | 120.2 | 72% | 0.723 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.4 | -19.5 | 177.8 | -67.1 | 173.2 | 0 | 0 | 0 | 113.2 | F46 | F46-L48 HydrophobicContact CD1-CD2 3.93Å; F46-L48 HydrophobicContact CD1-CG 4.44Å; F46-L48 HydrophobicContact CE1-CD2 3.4Å; F46-L48 HydrophobicContact CE1-CG 4.34Å; F46-L48 HydrophobicContact CZ-CD2 4.38Å |
| 49 | V | 81.7 | Confident | 78.4 | Confident | 131 Ų | 131 | 122.1 Ų | 122.1 | 79% | 0.794 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | -32.6 | 178.3 | -175.6 | 0 | 0 | 0 | 0 | 111.1 | D47 | D47-V49 PolarHBondContact O-N 3.35Å; D47-V49 VanDerWaalsContact OD1-CB 3.29Å; D47-V49 WeakPolarHBondContact OD1-CB 3.44Å; D47-V49 WeakPolarHBondContact OD1-CG2 3.38Å; D47-V49 PolarHBondContact OD1-N 3.1Å |
| 50 | T | 73.9 | Confident | 78.1 | Confident | 84 Ų | 84 | 118.7 Ų | 118.7 | 52% | 0.515 | 66% | 0.662 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -102.4 | 6.6 | -179 | 50 | 0 | 0 | 0 | 0 | 113.9 | D47 S52 G53 | D47-T50 WeakPolarHBondContact CB-OG1 3.32Å; D47-T50 PolarHBondContact O-N 3.14Å; D47-T50 PolarHBondContact O-OG1 3.02Å; D47-T50 WeakPolarHBondContact OD2-CG2 3.48Å; D47-T50 PolarHBondContact OD2-N 3Å; D47-T50 PolarHBondContact OD2-OG1 2.64Å; T50-S52 PolarHBondContact O-N 3.3Å; T50-G53 PolarHBondContact O-N 2.7Å |
| 51 | A | 74.9 | Confident | 78.1 | Confident | 34 Ų | 34 | 114.8 Ų | 114.8 | 28% | 0.281 | 66% | 0.657 | S | S | . | * | G | 310 helix | trans | -57.8 | -11.2 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | F46 D47 G53 F54 | F46-A51 HydrophobicContact CZ-CB 4.39Å; D47-A51 PolarHBondContact O-N 2.64Å; A51-G53 PolarHBondContact O-N 3.08Å; A51-G53 VanDerWaalsContact O-N 3.15Å; A51-F54 PolarHBondContact O-N 3.12Å |
| 52 | S | 72.7 | Confident | 78.1 | Confident | 106 Ų | 106 | 112.7 Ų | 112.7 | 74% | 0.741 | 65% | 0.646 | S | S | * | * | G | 310 helix | trans | -61.8 | -19 | 177.5 | 64 | 0 | 0 | 0 | 0 | 114.4 | T50 | T50-S52 PolarHBondContact O-N 3.3Š|
| 53 | G | 71.6 | Confident | 78.3 | Confident | 65 Ų | 65 | 111.1 Ų | 111.1 | 67% | 0.67 | 64% | 0.638 | S | S | * | * | G | 310 helix | trans | -76.1 | -22.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | T50 A51 K55 | T50-G53 PolarHBondContact O-N 2.7Å; A51-G53 PolarHBondContact O-N 3.08Å; A51-G53 VanDerWaalsContact O-N 3.15Å; G53-K55 PolarHBondContact O-N 2.97Å |
| 54 | F | 72.6 | Confident | 78.7 | Confident | 153 Ų | 153 | 107.9 Ų | 107.9 | 67% | 0.671 | 63% | 0.63 | S | S | * | * | trans | -95.1 | 79 | -178 | -61.2 | -79.8 | 0 | 0 | 0 | 110 | F46 A51 | F46-F54 HydrophobicContact CE2-CD2 4.36Å; A51-F54 PolarHBondContact O-N 3.12Å | ||
| 55 | K | 73.9 | Confident | 79 | Confident | 185 Ų | 185 | 106.6 Ų | 106.6 | 80% | 0.804 | 63% | 0.628 | S | S | * | * | trans | -81.7 | 122.9 | 170.6 | -70.9 | -175.5 | 179.3 | 178.5 | 0 | 109.2 | G53 D57 | G53-K55 PolarHBondContact O-N 2.97Å; K55-D57 PolarHBondContact O-N 2.97Å | ||
| 56 | N | 73.8 | Confident | 79.6 | Confident | 152 Ų | 152 | 104.1 Ų | 104.1 | 81% | 0.813 | 61% | 0.606 | S | S | * | * | trans | -68 | 92.9 | 171.9 | -66.7 | -12.6 | 0 | 0 | 0 | 109.2 | T58 | N56-T58 PolarHBondContact O-N 3.3Å; N56-T58 VanDerWaalsContact O-N 3.14Å | ||
| 57 | D | 71.7 | Confident | 80.2 | Confident | 114 Ų | 114 | 102.8 Ų | 102.8 | 61% | 0.61 | 60% | 0.602 | S | S | * | * | trans | -73.7 | 103.1 | 167.7 | -169.8 | -0.6 | 0 | 0 | 0 | 108.5 | K55 S59 | K55-D57 PolarHBondContact O-N 2.97Å; D57-S59 PolarHBondContact O-N 3.27Å; D57-S59 WeakPolarHBondContact OD1-CB 3.27Å; D57-S59 PolarHBondContact OD1-N 2.95Å | ||
| 58 | T | 75.9 | Confident | 80.4 | Confident | 138 Ų | 138 | 108.2 Ų | 108.2 | 85% | 0.847 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | -6.4 | 179.9 | -43.7 | 0 | 0 | 0 | 0 | 111.6 | N56 | N56-T58 PolarHBondContact O-N 3.3Å; N56-T58 VanDerWaalsContact O-N 3.14Å |
| 59 | S | 77.5 | Confident | 80.7 | Confident | 104 Ų | 104 | 108.3 Ų | 108.3 | 73% | 0.727 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.5 | -16.7 | -175.5 | -168.2 | 0 | 0 | 0 | 0 | 114.2 | D57 | D57-S59 PolarHBondContact O-N 3.27Å; D57-S59 WeakPolarHBondContact OD1-CB 3.27Å; D57-S59 PolarHBondContact OD1-N 2.95Å |
| 60 | A | 81.2 | Confident | 80.9 | Confident | 61 Ų | 61 | 107.7 Ų | 107.7 | 50% | 0.504 | 61% | 0.609 | S | S | . | * | S | Bend | trans | -79.3 | 130.6 | -175.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | L62 | A60-L62 PolarHBondContact O-N 3.47Š|
| 61 | P | 84.2 | Confident | 81.3 | Confident | 123 Ų | 123 | 107.7 Ų | 107.7 | 80% | 0.799 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 133.6 | 170.5 | 27.8 | -32.6 | 0 | 0 | 0 | 109.6 | ||
| 62 | L | 86.5 | Confident | 81.5 | Confident | 75 Ų | 75 | 112.3 Ų | 112.3 | 39% | 0.393 | 62% | 0.619 | S | S | . | * | P | Polyproline II helix | trans | -64.8 | 139.2 | 177.1 | -172.6 | 65.4 | 0 | 0 | 0 | 110.4 | A60 D66 Q67 I70 | A60-L62 PolarHBondContact O-N 3.47Å; L62-D66 HydrophobicContact CD1-CB 3.62Å; L62-D66 HydrophobicContact CD2-CB 4.26Å; L62-D66 HydrophobicContact CG-CB 3.81Å; L62-Q67 HydrophobicContact CB-CG 3.85Å; L62-Q67 HydrophobicContact CD2-CB 4.27Å; L62-Q67 HydrophobicContact CD2-CG 3.6Å; L62-Q67 HydrophobicContact CG-CG 3.78Å; L62-Q67 PolarHBondContact O-NE2 3.04Å; L62-I70 HydrophobicContact CD2-CD1 3.29Å; L62-I70 HydrophobicContact CD2-CG1 4.4Å |
| 63 | D | 89.8 | Confident | 81.2 | Confident | 82 Ų | 82 | 113.7 Ų | 113.7 | 44% | 0.439 | 61% | 0.613 | S | S | . | * | P | Polyproline II helix | trans | -59.1 | 139.5 | 176.3 | -169.6 | -74 | 0 | 0 | 0 | 110.2 | V65 D66 Q67 | D63-V65 PolarHBondContact O-N 3.44Å; D63-V65 VanDerWaalsContact O-N 3.15Å; D63-V65 WeakPolarHBondContact OD1-CB 3.22Å; D63-V65 WeakPolarHBondContact OD1-CG2 3.46Å; D63-V65 PolarHBondContact OD1-N 3.41Å; D63-D66 HydrophobicContact CB-CB 4.31Å; D63-D66 PolarHBondContact O-N 2.93Å; D63-Q67 WeakPolarHBondContact O-CG 3.29Å; D63-Q67 PolarHBondContact O-N 2.88Å |
| 64 | P | 90.6 | Very high | 80.7 | Confident | 86 Ų | 86 | 115.8 Ų | 115.8 | 56% | 0.558 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -56.5 | -27.1 | 177.8 | 23.3 | -36.2 | 0 | 0 | 0 | 114.2 | R68 | P64-R68 WeakPolarHBondContact O-CG 3.34Å; P64-R68 PolarHBondContact O-N 3.36Å |
| 65 | V | 89.8 | Confident | 79.9 | Confident | 90 Ų | 90 | 115.8 Ų | 115.8 | 55% | 0.545 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -69.9 | -46.4 | 173.7 | 179.8 | 0 | 0 | 0 | 0 | 110.2 | D63 Q67 R68 L69 | D63-V65 PolarHBondContact O-N 3.44Å; D63-V65 VanDerWaalsContact O-N 3.15Å; D63-V65 WeakPolarHBondContact OD1-CB 3.22Å; D63-V65 WeakPolarHBondContact OD1-CG2 3.46Å; D63-V65 PolarHBondContact OD1-N 3.41Å; V65-Q67 VanDerWaalsContact C-N 3.34Å; V65-Q67 PolarHBondContact O-N 3.37Å; V65-R68 WeakPolarHBondContact O-CB 3.37Å; V65-R68 PolarHBondContact O-N 3.17Å; V65-L69 PolarHBondContact O-N 3.47Å |
| 66 | D | 89.3 | Confident | 79 | Confident | 73 Ų | 73 | 111.9 Ų | 111.9 | 39% | 0.39 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -68 | -35.3 | 179.2 | -62.9 | -26.4 | 0 | 0 | 0 | 111.7 | L62 D63 R68 L69 I70 | L62-D66 HydrophobicContact CD1-CB 3.62Å; L62-D66 HydrophobicContact CD2-CB 4.26Å; L62-D66 HydrophobicContact CG-CB 3.81Å; D63-D66 HydrophobicContact CB-CB 4.31Å; D63-D66 PolarHBondContact O-N 2.93Å; D66-R68 PolarHBondContact O-N 3.29Å; D66-L69 WeakPolarHBondContact O-CB 3.35Å; D66-L69 PolarHBondContact O-N 3.11Å; D66-I70 WeakPolarHBondContact O-CG1 3.31Å; D66-I70 PolarHBondContact O-N 3.43Å |
| 67 | Q | 88.8 | Confident | 78.1 | Confident | 97 Ų | 97 | 109.4 Ų | 109.4 | 45% | 0.453 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -55.3 | -41.3 | 172.5 | -74.9 | 177.6 | 18.2 | 0 | 0 | 111.7 | L62 D63 V65 L69 I70 E71 | L62-Q67 HydrophobicContact CB-CG 3.85Å; L62-Q67 HydrophobicContact CD2-CB 4.27Å; L62-Q67 HydrophobicContact CD2-CG 3.6Å; L62-Q67 HydrophobicContact CG-CG 3.78Å; L62-Q67 PolarHBondContact O-NE2 3.04Å; D63-Q67 WeakPolarHBondContact O-CG 3.29Å; D63-Q67 PolarHBondContact O-N 2.88Å; V65-Q67 VanDerWaalsContact C-N 3.34Å; V65-Q67 PolarHBondContact O-N 3.37Å; Q67-L69 VanDerWaalsContact C-N 3.3Å; Q67-L69 PolarHBondContact O-N 3.25Å; Q67-I70 PolarHBondContact O-N 3.06Å; Q67-E71 PolarHBondContact O-N 3.25Å |
| 68 | R | 86.4 | Confident | 77.3 | Confident | 182 Ų | 182 | 107.4 Ų | 107.4 | 69% | 0.687 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -68 | -27.8 | 177.6 | -71.3 | 178.2 | -179.8 | 174.2 | 2.4 | 113.2 | P64 V65 D66 I70 | P64-R68 WeakPolarHBondContact O-CG 3.34Å; P64-R68 PolarHBondContact O-N 3.36Å; V65-R68 WeakPolarHBondContact O-CB 3.37Å; V65-R68 PolarHBondContact O-N 3.17Å; D66-R68 PolarHBondContact O-N 3.29Å; R68-I70 VanDerWaalsContact C-N 3.3Å |
| 69 | L | 87.5 | Confident | 76.3 | Confident | 139 Ų | 139 | 105.8 Ų | 105.8 | 73% | 0.728 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -74.4 | -22.6 | 177.9 | -61.1 | 177.1 | 0 | 0 | 0 | 112.4 | V65 D66 Q67 | V65-L69 PolarHBondContact O-N 3.47Å; D66-L69 WeakPolarHBondContact O-CB 3.35Å; D66-L69 PolarHBondContact O-N 3.11Å; Q67-L69 VanDerWaalsContact C-N 3.3Å; Q67-L69 PolarHBondContact O-N 3.25Å |
| 70 | I | 87 | Confident | 75.2 | Confident | 119 Ų | 119 | 105.4 Ų | 105.4 | 61% | 0.61 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -87.3 | -17.7 | 178.4 | -58.8 | 177 | 0 | 0 | 0 | 111.8 | L62 D66 Q67 R68 E72 | L62-I70 HydrophobicContact CD2-CD1 3.29Å; L62-I70 HydrophobicContact CD2-CG1 4.4Å; D66-I70 WeakPolarHBondContact O-CG1 3.31Å; D66-I70 PolarHBondContact O-N 3.43Å; Q67-I70 PolarHBondContact O-N 3.06Å; R68-I70 VanDerWaalsContact C-N 3.3Å; I70-E72 PolarHBondContact O-N 3.05Å; I70-E72 VanDerWaalsContact O-N 3.13Å |
| 71 | E | 82.8 | Confident | 73.9 | Confident | 84 Ų | 84 | 106.3 Ų | 106.3 | 39% | 0.393 | 54% | 0.544 | S | S | . | . | S | Bend | trans | -60.8 | 117 | 175.8 | -68.6 | 173.6 | -170.7 | 0 | 0 | 110.2 | Q67 E73 | Q67-E71 PolarHBondContact O-N 3.25Å; E71-E73 PolarHBondContact O-N 3.47Å |
| 72 | E | 77.3 | Confident | 72.5 | Confident | 131 Ų | 131 | 107.1 Ų | 107.1 | 61% | 0.612 | 54% | 0.535 | S | S | * | . | trans | -55.6 | 135.4 | 172.6 | -70 | 173.7 | 171.4 | 0 | 0 | 109.7 | I70 D74 R75 | I70-E72 PolarHBondContact O-N 3.05Å; I70-E72 VanDerWaalsContact O-N 3.13Å; E72-D74 HydrophobicContact CB-CB 4.33Å; E72-D74 PolarHBondContact O-N 3.49Å; E72-R75 WeakPolarHBondContact O-CB 3.48Å; E72-R75 PolarHBondContact O-N 3.13Å | ||
| 73 | E | 67.7 | Low | 71 | Confident | 134 Ų | 134 | 106 Ų | 106 | 63% | 0.626 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -55.7 | -25.9 | 174.9 | -167.1 | 176.4 | -171.3 | 0 | 0 | 111 | E71 R75 Q76 L77 | E71-E73 PolarHBondContact O-N 3.47Å; E73-R75 PolarHBondContact O-N 3.34Å; E73-Q76 CarbonylContact O-C 3.5Å; E73-Q76 WeakPolarHBondContact O-CA 3.25Å; E73-Q76 WeakPolarHBondContact O-CB 3.43Å; E73-Q76 PolarHBondContact O-N 2.92Å; E73-L77 HydrophobicContact CG-CD1 3.94Å; E73-L77 HydrophobicContact CG-CG 4.22Å; E73-L77 PolarHBondContact O-N 3.41Å |
| 74 | D | 61.2 | Low | 69.3 | Low | 109 Ų | 109 | 107.9 Ų | 107.9 | 58% | 0.583 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -58.6 | -30.6 | 172.1 | -75.9 | -22.8 | 0 | 0 | 0 | 113.3 | E72 S78 | E72-D74 HydrophobicContact CB-CB 4.33Å; E72-D74 PolarHBondContact O-N 3.49Å; D74-S78 WeakPolarHBondContact O-CA 3.35Å; D74-S78 WeakPolarHBondContact O-CB 3.38Å; D74-S78 PolarHBondContact O-N 2.66Å; D74-S78 PolarHBondContact O-OG 3.03Å |
| 75 | R | 56.2 | Low | 67.9 | Low | 153 Ų | 153 | 111.3 Ų | 111.3 | 58% | 0.577 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -67.2 | -43.5 | 168.8 | -74.5 | -171.8 | -178.4 | 152.9 | 4.9 | 110.5 | E72 E73 L77 S78 L79 | E72-R75 WeakPolarHBondContact O-CB 3.48Å; E72-R75 PolarHBondContact O-N 3.13Å; E73-R75 PolarHBondContact O-N 3.34Å; R75-L77 PolarHBondContact O-N 2.99Å; R75-S78 PolarHBondContact O-OG 3.42Å; R75-L79 HydrophobicContact CB-CD1 4.29Å; R75-L79 WeakPolarHBondContact O-CB 3.32Å; R75-L79 WeakPolarHBondContact O-CD1 3.36Å; R75-L79 WeakPolarHBondContact O-CG 3.38Å; R75-L79 PolarHBondContact O-N 3.09Å |
| 76 | Q | 53.3 | Low | 66.8 | Low | 104 Ų | 104 | 110.3 Ų | 110.3 | 49% | 0.486 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.2 | -40.9 | 179 | -61.1 | -170.8 | -11.5 | 0 | 0 | 111.7 | E73 H80 | E73-Q76 CarbonylContact O-C 3.5Å; E73-Q76 WeakPolarHBondContact O-CA 3.25Å; E73-Q76 WeakPolarHBondContact O-CB 3.43Å; E73-Q76 PolarHBondContact O-N 2.92Å; Q76-H80 WeakPolarHBondContact O-CB 3.17Å; Q76-H80 PolarHBondContact O-N 3.25Å |
| 77 | L | 56.1 | Low | 65.9 | Low | 100 Ų | 100 | 113.3 Ų | 113.3 | 52% | 0.524 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -77.4 | -33.1 | 178.8 | -72.1 | 167.5 | 0 | 0 | 0 | 113.7 | E73 R75 P81 | E73-L77 HydrophobicContact CG-CD1 3.94Å; E73-L77 HydrophobicContact CG-CG 4.22Å; E73-L77 PolarHBondContact O-N 3.41Å; R75-L77 PolarHBondContact O-N 2.99Å; L77-P81 WeakPolarHBondContact O-CD 3.44Å |
| 78 | S | 55.2 | Low | 65.3 | Low | 72 Ų | 72 | 114.9 Ų | 114.9 | 50% | 0.503 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -79.1 | -28.2 | 174.6 | 64.3 | 0 | 0 | 0 | 0 | 112.8 | D74 R75 P81 | D74-S78 WeakPolarHBondContact O-CA 3.35Å; D74-S78 WeakPolarHBondContact O-CB 3.38Å; D74-S78 PolarHBondContact O-N 2.66Å; D74-S78 PolarHBondContact O-OG 3.03Å; R75-S78 PolarHBondContact O-OG 3.42Å; S78-P81 WeakPolarHBondContact O-CD 3.5Å |
| 79 | L | 54.5 | Low | 65 | Low | 104 Ų | 104 | 112.7 Ų | 112.7 | 55% | 0.545 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -77.7 | -32.1 | 169.8 | -69.7 | 159.6 | 0 | 0 | 0 | 111.5 | R75 F82 T83 | R75-L79 HydrophobicContact CB-CD1 4.29Å; R75-L79 WeakPolarHBondContact O-CB 3.32Å; R75-L79 WeakPolarHBondContact O-CD1 3.36Å; R75-L79 WeakPolarHBondContact O-CG 3.38Å; R75-L79 PolarHBondContact O-N 3.09Å; L79-F82 CarbonylContact O-C 3.58Å; L79-F82 PolarHBondContact O-N 3.26Å; L79-T83 HydrophobicContact CB-CG2 4.24Å; L79-T83 WeakPolarHBondContact O-CG2 3.5Å; L79-T83 PolarHBondContact O-N 3.04Å |
| 80 | H | 54.4 | Low | 64.5 | Low | 96 Ų | 96 | 109.1 Ų | 109.1 | 44% | 0.444 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -57.4 | -40.2 | -175.3 | -130.1 | -105.8 | 0 | 0 | 0 | 117.2 | Q76 F82 T83 F84 | Q76-H80 WeakPolarHBondContact O-CB 3.17Å; Q76-H80 PolarHBondContact O-N 3.25Å; H80-F82 PolarHBondContact O-N 2.97Å; H80-T83 WeakPolarHBondContact CA-OG1 3.37Å; H80-T83 PolarHBondContact O-N 3.29Å; H80-T83 PolarHBondContact O-OG1 3.25Å; H80-F84 AromaticContact CE1-CD2 3.76Å; H80-F84 AromaticContact CE1-CE2 3.43Å; H80-F84 VanDerWaalsContact CE1-CE2 3.43Å; H80-F84 WeakPolarHBondContact CE1-CE2 3.5Å; H80-F84 AromaticContact ND1-CD2 3.87Å; H80-F84 PolarHBondContact O-N 3.5Å |
| 81 | P | 54.1 | Low | 64.4 | Low | 80 Ų | 80 | 108 Ų | 108 | 52% | 0.519 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65.4 | -25.1 | 176.9 | 23.2 | -32.6 | 0 | 0 | 0 | 111.5 | L77 S78 R85 | L77-P81 WeakPolarHBondContact O-CD 3.44Å; S78-P81 WeakPolarHBondContact O-CD 3.5Å; P81-R85 VanDerWaalsContact O-CB 3.3Å; P81-R85 WeakPolarHBondContact O-CB 3.42Å |
| 82 | F | 53.3 | Low | 64.5 | Low | 140 Ų | 140 | 111 Ų | 111 | 61% | 0.614 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -89.2 | -29 | 175.3 | -65.9 | -78.3 | 0 | 0 | 0 | 112.9 | L79 H80 R85 S86 | L79-F82 CarbonylContact O-C 3.58Å; L79-F82 PolarHBondContact O-N 3.26Å; H80-F82 PolarHBondContact O-N 2.97Å; F82-R85 PolarHBondContact O-N 3.2Å; F82-S86 VanDerWaalsContact O-CB 3.22Å; F82-S86 WeakPolarHBondContact O-CB 3.36Å; F82-S86 PolarHBondContact O-N 3.47Å; F82-S86 PolarHBondContact O-OG 3.42Å |
| 83 | T | 56 | Low | 65 | Low | 52 Ų | 52 | 106.8 Ų | 106.8 | 32% | 0.319 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -70.9 | -34.9 | -178.4 | 68.6 | 0 | 0 | 0 | 0 | 113.4 | L79 H80 S86 K87 | L79-T83 HydrophobicContact CB-CG2 4.24Å; L79-T83 WeakPolarHBondContact O-CG2 3.5Å; L79-T83 PolarHBondContact O-N 3.04Å; H80-T83 WeakPolarHBondContact CA-OG1 3.37Å; H80-T83 PolarHBondContact O-N 3.29Å; H80-T83 PolarHBondContact O-OG1 3.25Å; T83-S86 PolarHBondContact O-OG 3.36Å; T83-K87 WeakPolarHBondContact O-CG 3.49Å |
| 84 | F | 54 | Low | 66.1 | Low | 120 Ų | 120 | 106.9 Ų | 106.9 | 53% | 0.526 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -76.6 | -36.6 | 172.3 | -92.9 | -85.3 | 0 | 0 | 0 | 112 | H80 | H80-F84 AromaticContact CE1-CD2 3.76Å; H80-F84 AromaticContact CE1-CE2 3.43Å; H80-F84 VanDerWaalsContact CE1-CE2 3.43Å; H80-F84 WeakPolarHBondContact CE1-CE2 3.5Å; H80-F84 AromaticContact ND1-CD2 3.87Å; H80-F84 PolarHBondContact O-N 3.5Å |
| 85 | R | 61.1 | Low | 67.6 | Low | 158 Ų | 158 | 112.3 Ų | 112.3 | 60% | 0.596 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -68.5 | -36.3 | 178.7 | -155.3 | -176.5 | 176.3 | -176.5 | -3.3 | 111.5 | P81 F82 H88 H89 | P81-R85 VanDerWaalsContact O-CB 3.3Å; P81-R85 WeakPolarHBondContact O-CB 3.42Å; F82-R85 PolarHBondContact O-N 3.2Å; R85-H88 PolarHBondContact O-N 3.17Å; R85-H89 WeakPolarHBondContact CG-NE2 3.1Å; R85-H89 PolarHBondContact O-CD2 2.95Å; R85-H89 PolarHBondContact O-N 3.49Å |
| 86 | S | 67.1 | Low | 69.2 | Low | 69 Ų | 69 | 110.5 Ų | 110.5 | 48% | 0.483 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -67.3 | -35.3 | 180 | 67.4 | 0 | 0 | 0 | 0 | 113.3 | F82 T83 H88 H89 G90 | F82-S86 VanDerWaalsContact O-CB 3.22Å; F82-S86 WeakPolarHBondContact O-CB 3.36Å; F82-S86 PolarHBondContact O-N 3.47Å; F82-S86 PolarHBondContact O-OG 3.42Å; T83-S86 PolarHBondContact O-OG 3.36Å; S86-H88 PolarHBondContact O-N 3.33Å; S86-H89 PolarHBondContact O-N 3.17Å; S86-G90 PolarHBondContact O-N 3.41Å |
| 87 | K | 70.2 | Confident | 70.8 | Confident | 137 Ų | 137 | 116.2 Ų | 116.2 | 60% | 0.596 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -59.4 | -33 | 179.5 | -73.8 | 176.9 | -177.3 | 179.3 | 0 | 113 | T83 | T83-K87 WeakPolarHBondContact O-CG 3.49Å |
| 88 | H | 76.3 | Confident | 72.3 | Confident | 130 Ų | 130 | 122.7 Ų | 122.7 | 60% | 0.602 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -86.9 | -30.7 | 179.6 | -69.8 | -71.8 | 0 | 0 | 0 | 113.6 | R85 S86 G90 L91 | R85-H88 PolarHBondContact O-N 3.17Å; S86-H88 PolarHBondContact O-N 3.33Å; H88-G90 VanDerWaalsContact C-N 3.26Å; H88-G90 PolarHBondContact O-N 3.36Å; H88-L91 HydrophobicContact CB-CD1 4.44Å; H88-L91 WeakPolarHBondContact O-CB 2.98Å; H88-L91 PolarHBondContact O-N 2.86Å |
| 89 | H | 78.9 | Confident | 73.9 | Confident | 136 Ų | 136 | 125 Ų | 125 | 63% | 0.63 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -70.3 | -20.4 | -179.9 | -68.7 | -47.4 | 0 | 0 | 0 | 114 | R85 S86 | R85-H89 WeakPolarHBondContact CG-NE2 3.1Å; R85-H89 PolarHBondContact O-CD2 2.95Å; R85-H89 PolarHBondContact O-N 3.49Å; S86-H89 PolarHBondContact O-N 3.17Å |
| 90 | G | 78.3 | Confident | 75.4 | Confident | 63 Ų | 63 | 128.7 Ų | 128.7 | 65% | 0.649 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.8 | -1.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | S86 H88 V92 | S86-G90 PolarHBondContact O-N 3.41Å; H88-G90 VanDerWaalsContact C-N 3.26Å; H88-G90 PolarHBondContact O-N 3.36Å; G90-V92 PolarHBondContact O-N 2.69Å |
| 91 | L | 83.8 | Confident | 76.9 | Confident | 96 Ų | 96 | 134 Ų | 134 | 50% | 0.503 | 65% | 0.648 | S | S | . | * | trans | -69.7 | 125.7 | -179.3 | -63.7 | 175.6 | 0 | 0 | 0 | 110 | H88 V93 | H88-L91 HydrophobicContact CB-CD1 4.44Å; H88-L91 WeakPolarHBondContact O-CB 2.98Å; H88-L91 PolarHBondContact O-N 2.86Å; L91-V93 HydrophobicContact CB-CG2 4.47Å; L91-V93 PolarHBondContact O-N 2.9Å | ||
| 92 | V | 85.6 | Confident | 78.1 | Confident | 146 Ų | 146 | 138.2 Ų | 138.2 | 89% | 0.885 | 66% | 0.664 | S | S | * | * | trans | -76.7 | 118.2 | 172.2 | -179.7 | 0 | 0 | 0 | 0 | 108.1 | G90 | G90-V92 PolarHBondContact O-N 2.69Š| ||
| 93 | V | 88.3 | Confident | 79 | Confident | 43 Ų | 43 | 133.8 Ų | 133.8 | 26% | 0.261 | 65% | 0.651 | S | S | . | * | trans | -116.5 | 126.5 | -178.4 | -170.5 | 0 | 0 | 0 | 0 | 109.1 | L91 W95 M96 | L91-V93 HydrophobicContact CB-CG2 4.47Å; L91-V93 PolarHBondContact O-N 2.9Å; V93-W95 HydrophobicContact CG1-CD2 4.42Å; V93-W95 HydrophobicContact CG1-CG 4.15Å; V93-W95 HydrophobicContact CG1-CZ2 4.44Å; V93-W95 PolarHBondContact O-N 3.26Å; V93-M96 HydrophobicContact CB-CB 4.12Å; V93-M96 HydrophobicContact CB-CE 4.18Å; V93-M96 HydrophobicContact CG2-CE 3.99Å; V93-M96 PolarHBondContact O-N 3.42Å | ||
| 94 | P | 90.2 | Very high | 79.8 | Confident | 136 Ų | 136 | 135.9 Ų | 135.9 | 88% | 0.883 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.8 | -25 | -169.7 | -27.9 | 34.5 | 0 | 0 | 0 | 116.4 | ||
| 95 | W | 92 | Very high | 80.3 | Confident | 223 Ų | 223 | 135 Ų | 135 | 85% | 0.845 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.6 | -5.9 | -179.3 | 56.2 | -79.1 | 0 | 0 | 0 | 113.4 | V93 | V93-W95 HydrophobicContact CG1-CD2 4.42Å; V93-W95 HydrophobicContact CG1-CG 4.15Å; V93-W95 HydrophobicContact CG1-CZ2 4.44Å; V93-W95 PolarHBondContact O-N 3.26Å |
| 96 | M | 89.5 | Confident | 80.2 | Confident | 115 Ų | 115 | 133.8 Ų | 133.8 | 57% | 0.567 | 67% | 0.668 | S | S | * | * | trans | -106.7 | 110 | -177.5 | -171.7 | 171.4 | 61.1 | 0 | 0 | 109.9 | V93 | V93-M96 HydrophobicContact CB-CB 4.12Å; V93-M96 HydrophobicContact CB-CE 4.18Å; V93-M96 HydrophobicContact CG2-CE 3.99Å; V93-M96 PolarHBondContact O-N 3.42Å | ||
| 97 | R | 88 | Confident | 80 | Confident | 225 Ų | 225 | 133.5 Ų | 133.5 | 85% | 0.849 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 154.8 | 172.5 | -70.2 | -172.2 | 170.5 | 85.7 | 1.2 | 110.8 | ||
| 98 | R | 87.7 | Confident | 79.5 | Confident | 236 Ų | 236 | 131.9 Ų | 131.9 | 89% | 0.891 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 143.6 | 168 | -70 | -166.6 | -73.6 | 170 | -3.8 | 109.4 | E100 | R98-E100 PolarHBondContact O-N 3.4Š|
| 99 | T | 89.5 | Confident | 78.5 | Confident | 119 Ų | 119 | 128 Ų | 128 | 73% | 0.73 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 125.1 | 173.5 | 51.5 | 0 | 0 | 0 | 0 | 109.5 | ||
| 100 | E | 86 | Confident | 77.6 | Confident | 182 Ų | 182 | 126.3 Ų | 126.3 | 85% | 0.85 | 66% | 0.657 | S | S | * | * | P | Polyproline II helix | trans | -97.6 | 135.5 | 170.7 | -68.6 | 178.4 | -175 | 0 | 0 | 109.2 | R98 | R98-E100 PolarHBondContact O-N 3.4Š|
| 101 | Y | 85.9 | Confident | 76.8 | Confident | 209 Ų | 209 | 134 Ų | 134 | 82% | 0.82 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -87.6 | 141.4 | 173.1 | -66.2 | -86.7 | 0 | 0 | 0 | 109.2 | S103 | Y101-S103 PolarHBondContact O-N 2.76Š|
| 102 | I | 77.6 | Confident | 75.8 | Confident | 167 Ų | 167 | 132.5 Ų | 132.5 | 86% | 0.856 | 66% | 0.659 | S | S | * | * | trans | -71.1 | 103 | 175.3 | -58 | 171.7 | 0 | 0 | 0 | 107.6 | ||||
| 103 | S | 72 | Confident | 74.9 | Confident | 48 Ų | 48 | 129.4 Ų | 129.4 | 34% | 0.336 | 64% | 0.644 | S | S | . | * | trans | -85.2 | 161.5 | 171.2 | 72.3 | 0 | 0 | 0 | 0 | 111.1 | Y101 D105 | Y101-S103 PolarHBondContact O-N 2.76Å; S103-D105 WeakPolarHBondContact CB-OD2 3.26Å; S103-D105 PolarHBondContact O-N 2.73Å; S103-D105 WeakPolarHBondContact OG-CB 3.47Å; S103-D105 PolarHBondContact OG-N 3.28Å; S103-D105 PolarHBondContact OG-OD2 3.39Å | ||
| 104 | S | 72.9 | Confident | 73.9 | Confident | 96 Ų | 96 | 129.8 Ų | 129.8 | 67% | 0.671 | 65% | 0.651 | S | S | * | * | trans | -72.1 | 4.2 | 172.7 | 48.1 | 0 | 0 | 0 | 0 | 113.6 | F106 | S104-F106 PolarHBondContact O-N 2.98Š| ||
| 105 | D | 65.4 | Low | 72.9 | Confident | 100 Ų | 100 | 131.6 Ų | 131.6 | 54% | 0.535 | 65% | 0.646 | S | S | . | * | trans | -74.9 | 130.9 | -169.4 | -58.2 | -43.7 | 0 | 0 | 0 | 112.4 | S103 G107 Y109 | S103-D105 WeakPolarHBondContact CB-OD2 3.26Å; S103-D105 PolarHBondContact O-N 2.73Å; S103-D105 WeakPolarHBondContact OG-CB 3.47Å; S103-D105 PolarHBondContact OG-N 3.28Å; S103-D105 PolarHBondContact OG-OD2 3.39Å; D105-G107 PolarHBondContact O-N 3.45Å; D105-Y109 WeakPolarHBondContact O-CD2 3.4Å; D105-Y109 VanDerWaalsContact O-CE2 3.32Å; D105-Y109 WeakPolarHBondContact O-CE2 3.36Å | ||
| 106 | F | 58.1 | Low | 71.7 | Confident | 134 Ų | 134 | 122.8 Ų | 122.8 | 59% | 0.588 | 62% | 0.62 | S | S | * | * | G | 310 helix | trans | -56.4 | -18 | -171 | -73.5 | -96.2 | 0 | 0 | 0 | 115 | S104 N108 Y109 L122 | S104-F106 PolarHBondContact O-N 2.98Å; F106-N108 PolarHBondContact O-N 3.48Å; F106-Y109 PolarHBondContact O-N 3.12Å; F106-Y109 VanDerWaalsContact O-N 3.13Å; F106-L122 HydrophobicContact CD1-CD2 3.62Å; F106-L122 HydrophobicContact CD1-CG 4.05Å; F106-L122 HydrophobicContact CE1-CB 4.34Å; F106-L122 HydrophobicContact CE1-CD2 3.71Å; F106-L122 HydrophobicContact CE1-CG 3.59Å; F106-L122 HydrophobicContact CG-CD2 4.48Å; F106-L122 HydrophobicContact CZ-CG 4.35Å |
| 107 | G | 64.3 | Low | 70.4 | Confident | 62 Ų | 62 | 121.6 Ų | 121.6 | 64% | 0.639 | 61% | 0.609 | S | S | * | * | G | 310 helix | trans | -62.8 | -34.4 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | D105 Y109 | D105-G107 PolarHBondContact O-N 3.45Å; G107-Y109 VanDerWaalsContact C-N 3.31Å; G107-Y109 PolarHBondContact O-N 3.12Å |
| 108 | N | 58.9 | Low | 69.5 | Low | 104 Ų | 104 | 116.2 Ų | 116.2 | 56% | 0.556 | 60% | 0.596 | S | S | * | * | G | 310 helix | trans | -77 | -19.7 | 178.1 | -72.4 | -31.2 | 0 | 0 | 0 | 113 | F106 S110 | F106-N108 PolarHBondContact O-N 3.48Å; N108-S110 VanDerWaalsContact C-N 3.31Å; N108-S110 PolarHBondContact O-N 3.38Å |
| 109 | Y | 56.7 | Low | 68.4 | Low | 48 Ų | 48 | 114 Ų | 114 | 19% | 0.188 | 59% | 0.593 | C | S | . | * | G | 310 helix | trans | -80.7 | -12.2 | -177.1 | -58.6 | -90.3 | 0 | 0 | 0 | 113.2 | D105 F106 G107 R111 L112 L120 L122 | D105-Y109 WeakPolarHBondContact O-CD2 3.4Å; D105-Y109 VanDerWaalsContact O-CE2 3.32Å; D105-Y109 WeakPolarHBondContact O-CE2 3.36Å; F106-Y109 PolarHBondContact O-N 3.12Å; F106-Y109 VanDerWaalsContact O-N 3.13Å; G107-Y109 VanDerWaalsContact C-N 3.31Å; G107-Y109 PolarHBondContact O-N 3.12Å; Y109-R111 PolarHBondContact O-N 3.2Å; Y109-L112 HydrophobicContact CD1-CD1 3.4Å; Y109-L112 VanDerWaalsContact CD1-CD1 3.4Å; Y109-L112 HydrophobicContact CD1-CG 4.48Å; Y109-L112 HydrophobicContact CE1-CD1 4.19Å; Y109-L112 HydrophobicContact CG-CD1 4.23Å; Y109-L112 WeakPolarHBondContact O-CB 3.43Å; Y109-L112 PolarHBondContact O-N 3.49Å; Y109-L120 HydrophobicContact CD1-CD2 3.87Å; Y109-L120 HydrophobicContact CE1-CD2 3.27Å; Y109-L122 HydrophobicContact CD1-CD2 3.53Å; Y109-L122 HydrophobicContact CD2-CD2 3.56Å; Y109-L122 HydrophobicContact CE1-CD2 3.98Å; Y109-L122 HydrophobicContact CE2-CD2 3.92Å; Y109-L122 HydrophobicContact CG-CD2 3.32Å |
| 110 | S | 59.5 | Low | 67.2 | Low | 101 Ų | 101 | 112.9 Ų | 112.9 | 71% | 0.706 | 58% | 0.582 | S | S | * | * | G | 310 helix | trans | -60.9 | -28.2 | 174.8 | -169.1 | 0 | 0 | 0 | 0 | 112.3 | N108 | N108-S110 VanDerWaalsContact C-N 3.31Å; N108-S110 PolarHBondContact O-N 3.38Å |
| 111 | R | 61.2 | Low | 66 | Low | 223 Ų | 223 | 106.6 Ų | 106.6 | 84% | 0.842 | 57% | 0.566 | S | S | * | * | G | 310 helix | trans | -82.9 | -9.2 | 175.9 | -54.3 | -170.6 | -151.8 | -152.9 | 5.9 | 114 | Y109 | Y109-R111 PolarHBondContact O-N 3.2Š|
| 112 | L | 63.1 | Low | 64.8 | Low | 65 Ų | 65 | 98.6 Ų | 98.6 | 34% | 0.34 | 54% | 0.537 | S | S | . | . | S | Bend | trans | -78.1 | 133.7 | 178.8 | -64.9 | -177.5 | 0 | 0 | 0 | 110.1 | Y109 A116 R117 | Y109-L112 HydrophobicContact CD1-CD1 3.4Å; Y109-L112 VanDerWaalsContact CD1-CD1 3.4Å; Y109-L112 HydrophobicContact CD1-CG 4.48Å; Y109-L112 HydrophobicContact CE1-CD1 4.19Å; Y109-L112 HydrophobicContact CG-CD1 4.23Å; Y109-L112 WeakPolarHBondContact O-CB 3.43Å; Y109-L112 PolarHBondContact O-N 3.49Å; L112-A116 HydrophobicContact CB-CB 4.01Å; L112-A116 HydrophobicContact CD1-CB 4.48Å; L112-R117 HydrophobicContact CB-CG 3.97Å |
| 113 | S | 66.9 | Low | 63.7 | Low | 82 Ų | 82 | 92.1 Ų | 92.1 | 57% | 0.573 | 51% | 0.505 | S | S | * | . | trans | -49.6 | 145.6 | 169.7 | 176 | 0 | 0 | 0 | 0 | 110.8 | K115 A116 R117 | S113-K115 PolarHBondContact O-N 3.35Å; S113-A116 WeakPolarHBondContact O-CA 3.3Å; S113-A116 WeakPolarHBondContact O-CB 3.46Å; S113-A116 PolarHBondContact O-N 3.36Å; S113-R117 PolarHBondContact O-N 3.05Å; S113-R117 VanDerWaalsContact O-N 3.14Å | ||
| 114 | A | 67.1 | Low | 62.8 | Low | 50 Ų | 50 | 93.9 Ų | 93.9 | 41% | 0.413 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -47.3 | -38.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | A116 R117 I118 | A114-A116 PolarHBondContact O-N 3.09Å; A114-R117 PolarHBondContact O-N 2.75Å; A114-I118 VanDerWaalsContact O-CG1 3.31Å; A114-I118 WeakPolarHBondContact O-CG1 3.22Å; A114-I118 PolarHBondContact O-N 3.44Å; A114-I118 VanDerWaalsContact O-N 3.11Å |
| 115 | K | 68.3 | Low | 61.9 | Low | 175 Ų | 175 | 93.4 Ų | 93.4 | 76% | 0.761 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.8 | -39.8 | 175.7 | -70.6 | -176.3 | 177.5 | 177.8 | 0 | 113.3 | S113 K119 | S113-K115 PolarHBondContact O-N 3.35Å; K115-K119 PolarHBondContact O-N 3.28Å; K115-K119 VanDerWaalsContact O-N 3.15Å |
| 116 | A | 67.8 | Low | 61.3 | Low | 37 Ų | 37 | 94.8 Ų | 94.8 | 31% | 0.306 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -70.7 | -35.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | L112 S113 A114 K119 L120 | L112-A116 HydrophobicContact CB-CB 4.01Å; L112-A116 HydrophobicContact CD1-CB 4.48Å; S113-A116 WeakPolarHBondContact O-CA 3.3Å; S113-A116 WeakPolarHBondContact O-CB 3.46Å; S113-A116 PolarHBondContact O-N 3.36Å; A114-A116 PolarHBondContact O-N 3.09Å; A116-K119 PolarHBondContact O-N 2.89Å; A116-L120 PolarHBondContact O-N 3.14Å; A116-L120 VanDerWaalsContact O-N 3.17Å |
| 117 | R | 62.8 | Low | 60.6 | Low | 90 Ų | 90 | 96.2 Ų | 96.2 | 34% | 0.34 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -67.8 | -39.6 | 175.7 | -50.7 | -174.4 | -45.4 | -149 | 4 | 112.8 | L112 S113 A114 L120 G121 L122 T123 | L112-R117 HydrophobicContact CB-CG 3.97Å; S113-R117 PolarHBondContact O-N 3.05Å; S113-R117 VanDerWaalsContact O-N 3.14Å; A114-R117 PolarHBondContact O-N 2.75Å; R117-L120 PolarHBondContact O-N 3.45Å; R117-G121 PolarHBondContact O-N 3.23Å; R117-L122 PolarHBondContact O-N 2.97Å; R117-T123 HydrophobicContact CB-CG2 3.37Å; R117-T123 HydrophobicContact CG-CG2 4.46Å |
| 118 | I | 67.3 | Low | 59.7 | Low | 112 Ų | 112 | 101.8 Ų | 101.8 | 57% | 0.574 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -63.4 | -45.2 | 176 | -66.9 | 164.2 | 0 | 0 | 0 | 110.3 | A114 L120 G121 T123 | A114-I118 VanDerWaalsContact O-CG1 3.31Å; A114-I118 WeakPolarHBondContact O-CG1 3.22Å; A114-I118 PolarHBondContact O-N 3.44Å; A114-I118 VanDerWaalsContact O-N 3.11Å; I118-L120 PolarHBondContact O-N 3.19Å; I118-G121 PolarHBondContact O-N 2.96Å; I118-G121 VanDerWaalsContact O-N 3.11Å; I118-T123 HydrophobicContact CG1-CG2 4.35Å |
| 119 | K | 65.9 | Low | 59.1 | Low | 190 Ų | 190 | 104.4 Ų | 104.4 | 83% | 0.826 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -63.8 | -28.7 | 179.6 | -167.2 | 174.8 | -177.9 | -178.2 | 0 | 113.1 | K115 A116 G121 | K115-K119 PolarHBondContact O-N 3.28Å; K115-K119 VanDerWaalsContact O-N 3.15Å; A116-K119 PolarHBondContact O-N 2.89Å; K119-G121 VanDerWaalsContact C-N 3.35Å |
| 120 | L | 63.5 | Low | 58.8 | Low | 95 Ų | 95 | 111.2 Ų | 111.2 | 50% | 0.497 | 59% | 0.59 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.4 | 1.1 | 177.5 | -121.8 | 82.2 | 0 | 0 | 0 | 114.1 | Y109 A116 R117 I118 L122 | Y109-L120 HydrophobicContact CD1-CD2 3.87Å; Y109-L120 HydrophobicContact CE1-CD2 3.27Å; A116-L120 PolarHBondContact O-N 3.14Å; A116-L120 VanDerWaalsContact O-N 3.17Å; R117-L120 PolarHBondContact O-N 3.45Å; I118-L120 PolarHBondContact O-N 3.19Å; L120-L122 HydrophobicContact CB-CD1 4.16Å; L120-L122 HydrophobicContact CD2-CD1 4.17Å; L120-L122 WeakPolarHBondContact O-CD1 3.43Å; L120-L122 PolarHBondContact O-N 2.9Å; L120-L122 VanDerWaalsContact O-N 3.17Å |
| 121 | G | 61.2 | Low | 58.5 | Low | 50 Ų | 50 | 110.5 Ų | 110.5 | 52% | 0.515 | 58% | 0.582 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 71.1 | 3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115 | R117 I118 K119 T123 | R117-G121 PolarHBondContact O-N 3.23Å; I118-G121 PolarHBondContact O-N 2.96Å; I118-G121 VanDerWaalsContact O-N 3.11Å; K119-G121 VanDerWaalsContact C-N 3.35Å; G121-T123 VanDerWaalsContact C-N 3.35Å; G121-T123 PolarHBondContact O-N 2.85Å |
| 122 | L | 59.9 | Low | 58.4 | Low | 42 Ų | 42 | 103.5 Ų | 103.5 | 22% | 0.22 | 57% | 0.565 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -76.4 | -18 | -174.1 | -101.8 | 75.8 | 0 | 0 | 0 | 114.1 | F106 Y109 R117 L120 | F106-L122 HydrophobicContact CD1-CD2 3.62Å; F106-L122 HydrophobicContact CD1-CG 4.05Å; F106-L122 HydrophobicContact CE1-CB 4.34Å; F106-L122 HydrophobicContact CE1-CD2 3.71Å; F106-L122 HydrophobicContact CE1-CG 3.59Å; F106-L122 HydrophobicContact CG-CD2 4.48Å; F106-L122 HydrophobicContact CZ-CG 4.35Å; Y109-L122 HydrophobicContact CD1-CD2 3.53Å; Y109-L122 HydrophobicContact CD2-CD2 3.56Å; Y109-L122 HydrophobicContact CE1-CD2 3.98Å; Y109-L122 HydrophobicContact CE2-CD2 3.92Å; Y109-L122 HydrophobicContact CG-CD2 3.32Å; R117-L122 PolarHBondContact O-N 2.97Å; L120-L122 HydrophobicContact CB-CD1 4.16Å; L120-L122 HydrophobicContact CD2-CD1 4.17Å; L120-L122 WeakPolarHBondContact O-CD1 3.43Å; L120-L122 PolarHBondContact O-N 2.9Å; L120-L122 VanDerWaalsContact O-N 3.17Å |
| 123 | T | 55.6 | Low | 58.4 | Low | 30 Ų | 30 | 103.9 Ų | 103.9 | 18% | 0.184 | 57% | 0.57 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -85.6 | -4.6 | -179.4 | 52.4 | 0 | 0 | 0 | 0 | 114 | R117 I118 G121 | R117-T123 HydrophobicContact CB-CG2 3.37Å; R117-T123 HydrophobicContact CG-CG2 4.46Å; I118-T123 HydrophobicContact CG1-CG2 4.35Å; G121-T123 VanDerWaalsContact C-N 3.35Å; G121-T123 PolarHBondContact O-N 2.85Å |
| 124 | A | 52.6 | Low | 58.8 | Low | 86 Ų | 86 | 106.8 Ų | 106.8 | 71% | 0.711 | 57% | 0.57 | S | S | * | * | S | Bend | trans | -81.1 | -23.1 | -170.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 125 | A | 53.8 | Low | 59.4 | Low | 86 Ų | 86 | 114.4 Ų | 114.4 | 71% | 0.711 | 59% | 0.587 | S | S | * | * | S | Bend | trans | -92.2 | -18.8 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 126 | N | 52.5 | Low | 60.2 | Low | 128 Ų | 128 | 108.8 Ų | 108.8 | 68% | 0.684 | 57% | 0.571 | S | S | * | * | S | Bend | trans | -112.4 | 5.1 | -172.4 | -65.1 | -13.4 | 0 | 0 | 0 | 114.2 | Q128 | N126-Q128 PolarHBondContact O-N 3.48Š|
| 127 | F | 44.5 | Very low | 61.2 | Low | 165 Ų | 165 | 116.2 Ų | 116.2 | 72% | 0.724 | 59% | 0.591 | S | S | * | * | trans | -81 | 59 | 159.1 | -91.6 | -89.2 | 0 | 0 | 0 | 108.5 | E129 | F127-E129 VanDerWaalsContact C-N 3.29Å; F127-E129 PolarHBondContact O-N 2.97Å | ||
| 128 | Q | 45.5 | Very low | 62.5 | Low | 179 Ų | 179 | 119.3 Ų | 119.3 | 84% | 0.836 | 61% | 0.609 | S | S | * | * | trans | -67.5 | 105.7 | 156.3 | -164.3 | 170.9 | -18.8 | 0 | 0 | 103.7 | N126 E130 | N126-Q128 PolarHBondContact O-N 3.48Å; Q128-E130 PolarHBondContact O-N 3.23Å; Q128-E130 VanDerWaalsContact O-N 3.1Å | ||
| 129 | E | 44.9 | Very low | 63.5 | Low | 158 Ų | 158 | 115.4 Ų | 115.4 | 74% | 0.738 | 59% | 0.592 | S | S | * | * | trans | -37.2 | 122.1 | 178.1 | -65.6 | 178.9 | 155.9 | 0 | 0 | 108.6 | F127 T131 | F127-E129 VanDerWaalsContact C-N 3.29Å; F127-E129 PolarHBondContact O-N 2.97Å; E129-T131 PolarHBondContact O-N 3.45Å | ||
| 130 | E | 50.4 | Low | 64.6 | Low | 192 Ų | 192 | 110.8 Ų | 110.8 | 90% | 0.897 | 57% | 0.573 | S | S | * | * | trans | -61.9 | 76.9 | 164 | -71 | -176.8 | 174.8 | 0 | 0 | 106.5 | Q128 P132 | Q128-E130 PolarHBondContact O-N 3.23Å; Q128-E130 VanDerWaalsContact O-N 3.1Å; E130-P132 WeakPolarHBondContact O-CD 3.49Å | ||
| 131 | T | 53.9 | Low | 65.9 | Low | 86 Ų | 86 | 110.8 Ų | 110.8 | 53% | 0.528 | 57% | 0.573 | S | S | . | * | trans | -53.1 | 127.2 | 164.7 | 54 | 0 | 0 | 0 | 0 | 104.3 | E129 V133 | E129-T131 PolarHBondContact O-N 3.45Å; T131-V133 VanDerWaalsContact O-CG2 3.27Å; T131-V133 WeakPolarHBondContact O-CG2 3.26Å; T131-V133 PolarHBondContact O-N 3.42Å | ||
| 132 | P | 58.3 | Low | 67.3 | Low | 76 Ų | 76 | 115.4 Ų | 115.4 | 49% | 0.494 | 58% | 0.581 | S | S | . | * | trans | -70.8 | 85.2 | -178.7 | 25.5 | -31.1 | 0 | 0 | 0 | 107.6 | E130 Y134 R135 | E130-P132 WeakPolarHBondContact O-CD 3.49Å; P132-Y134 PolarHBondContact O-N 3.27Å; P132-R135 HydrophobicContact CB-CG 4.13Å; P132-R135 HydrophobicContact CG-CG 4.13Å; P132-R135 VanDerWaalsContact O-CG 3.32Å; P132-R135 WeakPolarHBondContact O-CG 3.34Å | ||
| 133 | V | 64.5 | Low | 68.6 | Low | 72 Ų | 72 | 114.4 Ų | 114.4 | 44% | 0.436 | 58% | 0.579 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -63.3 | -10.8 | -171.8 | 177.5 | 0 | 0 | 0 | 0 | 111.8 | T131 S139 | T131-V133 VanDerWaalsContact O-CG2 3.27Å; T131-V133 WeakPolarHBondContact O-CG2 3.26Å; T131-V133 PolarHBondContact O-N 3.42Å; V133-S139 PolarHBondContact O-OG 2.74Å |
| 134 | Y | 74 | Confident | 70.2 | Confident | 144 Ų | 144 | 117.3 Ų | 117.3 | 57% | 0.565 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.7 | 36.1 | -170 | -50.6 | -53.3 | 0 | 0 | 0 | 113.8 | P132 Q140 A143 | P132-Y134 PolarHBondContact O-N 3.27Å; Y134-Q140 PolarHBondContact O-NE2 2.83Å; Y134-A143 HydrophobicContact CD1-CB 3.81Å; Y134-A143 HydrophobicContact CE1-CB 3.31Å |
| 135 | R | 79 | Confident | 72 | Confident | 209 Ų | 209 | 114.8 Ų | 114.8 | 79% | 0.789 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -71.6 | -42.6 | -177.8 | -74.3 | -92.3 | -176.6 | 106.5 | -2.1 | 114.1 | P132 | P132-R135 HydrophobicContact CB-CG 4.13Å; P132-R135 HydrophobicContact CG-CG 4.13Å; P132-R135 VanDerWaalsContact O-CG 3.32Å; P132-R135 WeakPolarHBondContact O-CG 3.34Å |
| 136 | S | 86.3 | Confident | 73.7 | Confident | 58 Ų | 58 | 118.1 Ų | 118.1 | 41% | 0.406 | 57% | 0.569 | S | S | . | * | S | Bend | trans | -101.8 | 151.3 | -178.6 | 67.6 | 0 | 0 | 0 | 0 | 111.4 | E138 S139 Q140 | S136-E138 PolarHBondContact O-N 3.48Å; S136-S139 PolarHBondContact O-N 3.4Å; S136-S139 VanDerWaalsContact O-N 3.12Å; S136-S139 WeakPolarHBondContact OG-CB 3.17Å; S136-S139 PolarHBondContact OG-N 3.4Å; S136-S139 VanDerWaalsContact OG-N 3.08Å; S136-Q140 WeakPolarHBondContact O-CG 3.5Å; S136-Q140 PolarHBondContact O-N 3.26Å |
| 137 | R | 89.4 | Confident | 75.3 | Confident | 193 Ų | 193 | 115.7 Ų | 115.7 | 73% | 0.728 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -55.1 | -39.2 | 173.1 | 179.8 | 175.5 | 178.7 | -101.7 | 0.2 | 111.7 | Q140 L141 | R137-Q140 PolarHBondContact O-N 3.21Å; R137-L141 HydrophobicContact CG-CD1 4.25Å; R137-L141 WeakPolarHBondContact O-CG 2.92Å; R137-L141 PolarHBondContact O-N 2.73Å |
| 138 | E | 90 | Very high | 77.4 | Confident | 154 Ų | 154 | 115.1 Ų | 115.1 | 72% | 0.72 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -65.3 | -43 | 176.9 | -66.7 | 176.3 | 178 | 0 | 0 | 111.9 | S136 Q140 L141 Q142 | S136-E138 PolarHBondContact O-N 3.48Å; E138-Q140 VanDerWaalsContact C-N 3.31Å; E138-Q140 PolarHBondContact O-N 3.12Å; E138-L141 PolarHBondContact O-N 3.03Å; E138-Q142 WeakPolarHBondContact O-CB 3.5Å; E138-Q142 PolarHBondContact O-N 2.81Å |
| 139 | S | 87.7 | Confident | 79.3 | Confident | 31 Ų | 31 | 112.7 Ų | 112.7 | 22% | 0.217 | 55% | 0.545 | C | S | . | . | H | α-helix | trans | -64.4 | -37.6 | 176.4 | -162.6 | 0 | 0 | 0 | 0 | 111.9 | V133 S136 A143 | V133-S139 PolarHBondContact O-OG 2.74Å; S136-S139 PolarHBondContact O-N 3.4Å; S136-S139 VanDerWaalsContact O-N 3.12Å; S136-S139 WeakPolarHBondContact OG-CB 3.17Å; S136-S139 PolarHBondContact OG-N 3.4Å; S136-S139 VanDerWaalsContact OG-N 3.08Å; S139-A143 VanDerWaalsContact O-CB 3.29Å; S139-A143 WeakPolarHBondContact O-CB 3.47Å; S139-A143 PolarHBondContact O-N 3.03Å |
| 140 | Q | 89.4 | Confident | 81.3 | Confident | 92 Ų | 92 | 109 Ų | 109 | 43% | 0.43 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.8 | -47.8 | 173.8 | -71.7 | 172.5 | 9.7 | 0 | 0 | 111.9 | Y134 S136 R137 E138 Q142 A143 I144 | Y134-Q140 PolarHBondContact O-NE2 2.83Å; S136-Q140 WeakPolarHBondContact O-CG 3.5Å; S136-Q140 PolarHBondContact O-N 3.26Å; R137-Q140 PolarHBondContact O-N 3.21Å; E138-Q140 VanDerWaalsContact C-N 3.31Å; E138-Q140 PolarHBondContact O-N 3.12Å; Q140-Q142 VanDerWaalsContact C-N 3.34Å; Q140-Q142 PolarHBondContact O-N 2.95Å; Q140-A143 PolarHBondContact O-N 2.86Å; Q140-I144 VanDerWaalsContact O-CG1 3.31Å; Q140-I144 WeakPolarHBondContact O-CG1 3.12Å; Q140-I144 PolarHBondContact O-N 3.29Å |
| 141 | L | 90.8 | Very high | 82.8 | Confident | 95 Ų | 95 | 104.8 Ų | 104.8 | 50% | 0.497 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.9 | -41 | 177.6 | -71.4 | 172.7 | 0 | 0 | 0 | 111.9 | R137 E138 A143 I144 G145 | R137-L141 HydrophobicContact CG-CD1 4.25Å; R137-L141 WeakPolarHBondContact O-CG 2.92Å; R137-L141 PolarHBondContact O-N 2.73Å; E138-L141 PolarHBondContact O-N 3.03Å; L141-A143 VanDerWaalsContact C-N 3.35Å; L141-I144 PolarHBondContact O-N 3.13Å; L141-G145 PolarHBondContact O-N 3.05Å |
| 142 | Q | 89.9 | Confident | 83.8 | Confident | 147 Ų | 147 | 108 Ų | 108 | 69% | 0.687 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.4 | -41.8 | 176 | -173.1 | -179.6 | 13.7 | 0 | 0 | 111.5 | E138 Q140 G145 R146 | E138-Q142 WeakPolarHBondContact O-CB 3.5Å; E138-Q142 PolarHBondContact O-N 2.81Å; Q140-Q142 VanDerWaalsContact C-N 3.34Å; Q140-Q142 PolarHBondContact O-N 2.95Å; Q142-G145 PolarHBondContact O-N 3.1Å; Q142-R146 WeakPolarHBondContact O-CB 3.04Å; Q142-R146 PolarHBondContact O-N 3.21Å |
| 143 | A | 88.4 | Confident | 84.5 | Confident | 21 Ų | 21 | 112.2 Ų | 112.2 | 17% | 0.174 | 53% | 0.534 | C | S | . | . | H | α-helix | trans | -64 | -42.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y134 S139 Q140 L141 R146 T147 | Y134-A143 HydrophobicContact CD1-CB 3.81Å; Y134-A143 HydrophobicContact CE1-CB 3.31Å; S139-A143 VanDerWaalsContact O-CB 3.29Å; S139-A143 WeakPolarHBondContact O-CB 3.47Å; S139-A143 PolarHBondContact O-N 3.03Å; Q140-A143 PolarHBondContact O-N 2.86Å; L141-A143 VanDerWaalsContact C-N 3.35Å; A143-R146 WeakPolarHBondContact O-CB 3.36Å; A143-R146 PolarHBondContact O-N 3.09Å; A143-T147 WeakPolarHBondContact O-CG2 3.16Å; A143-T147 PolarHBondContact O-N 3.35Å |
| 144 | I | 88.9 | Confident | 84.7 | Confident | 92 Ų | 92 | 111.8 Ų | 111.8 | 47% | 0.472 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.2 | -49.5 | 175 | -68.5 | 166.1 | 0 | 0 | 0 | 109.9 | Q140 L141 R146 T147 F148 | Q140-I144 VanDerWaalsContact O-CG1 3.31Å; Q140-I144 WeakPolarHBondContact O-CG1 3.12Å; Q140-I144 PolarHBondContact O-N 3.29Å; L141-I144 PolarHBondContact O-N 3.13Å; I144-R146 VanDerWaalsContact C-N 3.26Å; I144-R146 PolarHBondContact O-N 3.28Å; I144-T147 PolarHBondContact O-N 3.02Å; I144-T147 VanDerWaalsContact O-N 3.09Å; I144-T147 PolarHBondContact O-OG1 3.42Å; I144-F148 HydrophobicContact CG2-CD2 4.2Å; I144-F148 HydrophobicContact CG2-CE2 3.73Å; I144-F148 VanDerWaalsContact O-CD2 3.25Å; I144-F148 WeakPolarHBondContact O-CD2 3.46Å; I144-F148 PolarHBondContact O-N 2.83Å |
| 145 | G | 90.1 | Very high | 84.4 | Confident | 32 Ų | 32 | 111.3 Ų | 111.3 | 33% | 0.33 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -56.9 | -40.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L141 Q142 T147 F148 E149 | L141-G145 PolarHBondContact O-N 3.05Å; Q142-G145 PolarHBondContact O-N 3.1Å; G145-T147 VanDerWaalsContact C-N 3.35Å; G145-T147 PolarHBondContact O-N 3.31Å; G145-F148 PolarHBondContact O-N 3.26Å; G145-E149 PolarHBondContact O-N 3.16Å |
| 146 | R | 88.7 | Confident | 83.7 | Confident | 156 Ų | 156 | 108 Ų | 108 | 59% | 0.589 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -62 | -38.4 | 176.5 | -175 | 175.2 | 176.5 | -175.5 | -6 | 112.8 | Q142 A143 I144 F148 E149 E150 | Q142-R146 WeakPolarHBondContact O-CB 3.04Å; Q142-R146 PolarHBondContact O-N 3.21Å; A143-R146 WeakPolarHBondContact O-CB 3.36Å; A143-R146 PolarHBondContact O-N 3.09Å; I144-R146 VanDerWaalsContact C-N 3.26Å; I144-R146 PolarHBondContact O-N 3.28Å; R146-F148 VanDerWaalsContact C-N 3.32Å; R146-F148 PolarHBondContact O-N 2.93Å; R146-E149 PolarHBondContact O-N 2.9Å; R146-E150 HydrophobicContact CG-CG 4.11Å; R146-E150 IonicContact CZ-OE1 2.86Å; R146-E150 IonicContact NE-OE1 3.56Å; R146-E150 PolarHBondContact NE-OE1 3.39Å; R146-E150 IonicContact NH2-OE1 2.69Å; R146-E150 PolarHBondContact NH2-OE1 2.58Å; R146-E150 WeakPolarHBondContact O-CB 3.1Å; R146-E150 WeakPolarHBondContact O-CG 3.1Å; R146-E150 PolarHBondContact O-N 3.04Å |
| 147 | T | 87.1 | Confident | 82.7 | Confident | 78 Ų | 78 | 112.2 Ų | 112.2 | 48% | 0.479 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -61.9 | -39.9 | 177.3 | 59.9 | 0 | 0 | 0 | 0 | 112.2 | A143 I144 G145 E149 E150 V151 | A143-T147 WeakPolarHBondContact O-CG2 3.16Å; A143-T147 PolarHBondContact O-N 3.35Å; I144-T147 PolarHBondContact O-N 3.02Å; I144-T147 VanDerWaalsContact O-N 3.09Å; I144-T147 PolarHBondContact O-OG1 3.42Å; G145-T147 VanDerWaalsContact C-N 3.35Å; G145-T147 PolarHBondContact O-N 3.31Å; T147-E149 PolarHBondContact O-N 3.48Å; T147-E150 PolarHBondContact O-N 3.29Å; T147-V151 WeakPolarHBondContact O-CG2 3.48Å; T147-V151 PolarHBondContact O-N 2.67Å |
| 148 | F | 87.6 | Confident | 82 | Confident | 153 Ų | 153 | 109.1 Ų | 109.1 | 67% | 0.671 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -66.2 | -36.8 | 176.7 | -72 | -75.4 | 0 | 0 | 0 | 112.7 | I144 G145 R146 | I144-F148 HydrophobicContact CG2-CD2 4.2Å; I144-F148 HydrophobicContact CG2-CE2 3.73Å; I144-F148 VanDerWaalsContact O-CD2 3.25Å; I144-F148 WeakPolarHBondContact O-CD2 3.46Å; I144-F148 PolarHBondContact O-N 2.83Å; G145-F148 PolarHBondContact O-N 3.26Å; R146-F148 VanDerWaalsContact C-N 3.32Å; R146-F148 PolarHBondContact O-N 2.93Å |
| 149 | E | 86.3 | Confident | 81.4 | Confident | 128 Ų | 128 | 108.5 Ų | 108.5 | 60% | 0.598 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -74.1 | -31.2 | 175.8 | -67.1 | -179.4 | -170.8 | 0 | 0 | 113.3 | G145 R146 T147 | G145-E149 PolarHBondContact O-N 3.16Å; R146-E149 PolarHBondContact O-N 2.9Å; T147-E149 PolarHBondContact O-N 3.48Å |
| 150 | E | 85.9 | Confident | 81 | Confident | 79 Ų | 79 | 111.1 Ų | 111.1 | 37% | 0.369 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -76.6 | -25.8 | -178.9 | -78.7 | -177.5 | 169.6 | 0 | 0 | 112.8 | R146 T147 E152 K153 A154 | R146-E150 HydrophobicContact CG-CG 4.11Å; R146-E150 IonicContact CZ-OE1 2.86Å; R146-E150 IonicContact NE-OE1 3.56Å; R146-E150 PolarHBondContact NE-OE1 3.39Å; R146-E150 IonicContact NH2-OE1 2.69Å; R146-E150 PolarHBondContact NH2-OE1 2.58Å; R146-E150 WeakPolarHBondContact O-CB 3.1Å; R146-E150 WeakPolarHBondContact O-CG 3.1Å; R146-E150 PolarHBondContact O-N 3.04Å; T147-E150 PolarHBondContact O-N 3.29Å; E150-E152 VanDerWaalsContact C-N 3.26Å; E150-E152 PolarHBondContact O-N 3.49Å; E150-K153 CarbonylContact O-C 3.52Å; E150-K153 PolarHBondContact O-N 2.79Å; E150-A154 WeakPolarHBondContact O-CB 3.38Å; E150-A154 PolarHBondContact O-N 2.88Å |
| 151 | V | 83.2 | Confident | 80.6 | Confident | 104 Ų | 104 | 112.6 Ų | 112.6 | 63% | 0.63 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -53.9 | -43.9 | 176.7 | 168.5 | 0 | 0 | 0 | 0 | 111.5 | T147 K153 | T147-V151 WeakPolarHBondContact O-CG2 3.48Å; T147-V151 PolarHBondContact O-N 2.67Å; V151-K153 VanDerWaalsContact C-N 3.3Å; V151-K153 PolarHBondContact O-N 2.78Å |
| 152 | E | 74.2 | Confident | 80.2 | Confident | 155 Ų | 155 | 112.3 Ų | 112.3 | 72% | 0.724 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -64.5 | -33.7 | 177.3 | -66.1 | -64 | 138.2 | 0 | 0 | 112.8 | E150 | E150-E152 VanDerWaalsContact C-N 3.26Å; E150-E152 PolarHBondContact O-N 3.49Å |
| 153 | K | 73 | Confident | 79.8 | Confident | 163 Ų | 163 | 108.9 Ų | 108.9 | 71% | 0.709 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -90.5 | -23.4 | -176.5 | -65.6 | 174.5 | -175 | 162.5 | 0 | 113.1 | E150 V151 R155 | E150-K153 CarbonylContact O-C 3.52Å; E150-K153 PolarHBondContact O-N 2.79Å; V151-K153 VanDerWaalsContact C-N 3.3Å; V151-K153 PolarHBondContact O-N 2.78Å; K153-R155 PolarHBondContact O-N 3.26Å; K153-R155 VanDerWaalsContact O-N 3.14Å |
| 154 | A | 68 | Low | 79.7 | Confident | 63 Ų | 63 | 116 Ų | 116 | 52% | 0.521 | 62% | 0.62 | S | S | . | * | trans | -78.7 | 14.5 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | E150 L156 | E150-A154 WeakPolarHBondContact O-CB 3.38Å; E150-A154 PolarHBondContact O-N 2.88Å; A154-L156 VanDerWaalsContact C-N 3.28Å; A154-L156 PolarHBondContact O-N 2.91Å | ||
| 155 | R | 67.8 | Low | 79.5 | Confident | 134 Ų | 134 | 118.7 Ų | 118.7 | 51% | 0.506 | 63% | 0.63 | S | S | . | * | trans | -56 | 90.1 | 168.4 | -170.9 | 178.9 | 169.5 | 127.4 | -0.1 | 109.5 | K153 E157 I163 E166 | K153-R155 PolarHBondContact O-N 3.26Å; K153-R155 VanDerWaalsContact O-N 3.14Å; R155-E157 VanDerWaalsContact C-N 3.31Å; R155-E157 HydrophobicContact CG-CG 4.37Å; R155-E157 IonicContact NE-OE1 3.19Å; R155-E157 PolarHBondContact NE-OE1 2.83Å; R155-E157 PolarHBondContact O-N 3.04Å; R155-I163 HydrophobicContact CG-CD1 3.55Å; R155-E166 IonicContact NH1-OE1 3.45Å | ||
| 156 | L | 65.3 | Low | 79.1 | Confident | 141 Ų | 141 | 123 Ų | 123 | 74% | 0.738 | 64% | 0.642 | S | S | * | * | trans | -73.1 | 85.6 | -178.2 | -78.1 | 165 | 0 | 0 | 0 | 109.3 | A154 K158 | A154-L156 VanDerWaalsContact C-N 3.28Å; A154-L156 PolarHBondContact O-N 2.91Å; L156-K158 VanDerWaalsContact C-N 3.33Å; L156-K158 PolarHBondContact O-N 3.39Å | ||
| 157 | E | 65.8 | Low | 79 | Confident | 146 Ų | 146 | 122.7 Ų | 122.7 | 68% | 0.682 | 65% | 0.649 | S | S | * | * | trans | -71.2 | 91.1 | 168.9 | -63.7 | -169.1 | 167.7 | 0 | 0 | 109.1 | R155 | R155-E157 VanDerWaalsContact C-N 3.31Å; R155-E157 HydrophobicContact CG-CG 4.37Å; R155-E157 IonicContact NE-OE1 3.19Å; R155-E157 PolarHBondContact NE-OE1 2.83Å; R155-E157 PolarHBondContact O-N 3.04Å | ||
| 158 | K | 73.5 | Confident | 78.9 | Confident | 128 Ų | 128 | 123.6 Ų | 123.6 | 56% | 0.557 | 66% | 0.656 | S | S | * | * | trans | -79.3 | 127.9 | 165.5 | -71.9 | 178.5 | -179 | 173.8 | 0 | 107.8 | L156 G160 L161 | L156-K158 VanDerWaalsContact C-N 3.33Å; L156-K158 PolarHBondContact O-N 3.39Å; K158-G160 PolarHBondContact O-N 3.46Å; K158-G160 VanDerWaalsContact O-N 3.09Å; K158-L161 HydrophobicContact CB-CB 4.2Å; K158-L161 HydrophobicContact CB-CD1 3.74Å; K158-L161 HydrophobicContact CD-CD1 3.72Å; K158-L161 HydrophobicContact CG-CD1 4.36Å; K158-L161 PolarHBondContact O-N 3.13Å | ||
| 159 | P | 77.6 | Confident | 78.7 | Confident | 141 Ų | 141 | 124.7 Ų | 124.7 | 92% | 0.916 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.5 | 120.6 | 177.8 | 23.9 | -32.3 | 0 | 0 | 0 | 109.6 | ||
| 160 | G | 80.1 | Confident | 78.5 | Confident | 86 Ų | 86 | 124.3 Ų | 124.3 | 89% | 0.887 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 99.1 | -3.8 | -177 | 0 | 0 | 0 | 0 | 0 | 115.7 | K158 | K158-G160 PolarHBondContact O-N 3.46Å; K158-G160 VanDerWaalsContact O-N 3.09Å |
| 161 | L | 81.5 | Confident | 78 | Confident | 122 Ų | 122 | 124 Ų | 124 | 64% | 0.639 | 67% | 0.674 | S | S | * | * | trans | -115.4 | 118 | 172.5 | -76.3 | 154.7 | 0 | 0 | 0 | 109.2 | K158 | K158-L161 HydrophobicContact CB-CB 4.2Å; K158-L161 HydrophobicContact CB-CD1 3.74Å; K158-L161 HydrophobicContact CD-CD1 3.72Å; K158-L161 HydrophobicContact CG-CD1 4.36Å; K158-L161 PolarHBondContact O-N 3.13Å | ||
| 162 | A | 82.3 | Confident | 77.5 | Confident | 89 Ų | 89 | 122 Ų | 122 | 74% | 0.736 | 66% | 0.659 | S | S | * | * | trans | -99.1 | 136.1 | 171.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | I164 | A162-I164 PolarHBondContact O-N 3.45Š| ||
| 163 | I | 81.5 | Confident | 77.6 | Confident | 75 Ų | 75 | 121.6 Ų | 121.6 | 39% | 0.385 | 66% | 0.655 | S | S | . | * | trans | -74.8 | 123 | 174 | -59 | 169.2 | 0 | 0 | 0 | 107.5 | R155 E166 | R155-I163 HydrophobicContact CG-CD1 3.55Å; I163-E166 HydrophobicContact CG2-CG 3.58Å | ||
| 164 | I | 85.4 | Confident | 77.7 | Confident | 171 Ų | 171 | 121.3 Ų | 121.3 | 88% | 0.877 | 66% | 0.657 | S | S | * | * | trans | -88 | -46.2 | -177.7 | -63 | 171.9 | 0 | 0 | 0 | 110.4 | A162 | A162-I164 PolarHBondContact O-N 3.45Š| ||
| 165 | E | 84.8 | Confident | 77.8 | Confident | 149 Ų | 149 | 120.1 Ų | 120.1 | 70% | 0.696 | 64% | 0.64 | S | S | * | * | trans | -147.7 | 138.4 | -176.2 | -172.1 | 177.5 | 174.5 | 0 | 0 | 109.4 | ||||
| 166 | E | 82.2 | Confident | 77.9 | Confident | 121 Ų | 121 | 123.5 Ų | 123.5 | 57% | 0.565 | 65% | 0.653 | S | S | * | * | trans | -114.5 | 117.4 | 174.3 | -67.3 | 178.1 | -179.6 | 0 | 0 | 107.8 | R155 I163 | R155-E166 IonicContact NH1-OE1 3.45Å; I163-E166 HydrophobicContact CG2-CG 3.58Å | ||
| 167 | M | 85.2 | Confident | 78.3 | Confident | 150 Ų | 150 | 125.3 Ų | 125.3 | 74% | 0.739 | 66% | 0.655 | S | S | * | * | trans | -109.5 | 115.3 | -178.4 | -167.6 | -177.9 | -51.9 | 0 | 0 | 109.5 | ||||
| 168 | P | 85.2 | Confident | 78.5 | Confident | 97 Ų | 97 | 122.3 Ų | 122.3 | 63% | 0.63 | 64% | 0.644 | S | S | * | * | trans | -73 | 134.1 | -179.9 | 31.1 | -34.8 | 0 | 0 | 0 | 110.1 | L170 | P168-L170 VanDerWaalsContact C-N 3.31Å; P168-L170 HydrophobicContact CB-CD1 4.38Å; P168-L170 HydrophobicContact CB-CG 4.17Å; P168-L170 HydrophobicContact CG-CD1 4.34Å; P168-L170 PolarHBondContact O-N 3.29Å | ||
| 169 | I | 83.2 | Confident | 78.2 | Confident | 176 Ų | 176 | 121.3 Ų | 121.3 | 90% | 0.903 | 66% | 0.659 | S | S | * | * | trans | -83.6 | 83.1 | 174.7 | -54.5 | 173.5 | 0 | 0 | 0 | 107.6 | ||||
| 170 | L | 82 | Confident | 77.6 | Confident | 121 Ų | 121 | 119.5 Ų | 119.5 | 63% | 0.634 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -100.8 | 145.9 | 173.3 | -64.5 | 174.7 | 0 | 0 | 0 | 109.7 | P168 D172 | P168-L170 VanDerWaalsContact C-N 3.31Å; P168-L170 HydrophobicContact CB-CD1 4.38Å; P168-L170 HydrophobicContact CB-CG 4.17Å; P168-L170 HydrophobicContact CG-CD1 4.34Å; P168-L170 PolarHBondContact O-N 3.29Å; L170-D172 PolarHBondContact O-N 3.43Å |
| 171 | P | 75.7 | Confident | 76.8 | Confident | 73 Ų | 73 | 118 Ų | 118 | 47% | 0.474 | 63% | 0.627 | S | S | . | * | P | Polyproline II helix | trans | -59.4 | 134 | 165.5 | 26.2 | -31.4 | 0 | 0 | 0 | 108.5 | F173 | P171-F173 HydrophobicContact CG-CE1 4.05Å; P171-F173 HydrophobicContact CG-CE2 4.28Å; P171-F173 HydrophobicContact CG-CZ 3.66Å; P171-F173 VanDerWaalsContact O-CD2 3.24Å; P171-F173 WeakPolarHBondContact O-CD2 3.44Å; P171-F173 VanDerWaalsContact O-CE2 3.25Å; P171-F173 WeakPolarHBondContact O-CE2 3.5Å; P171-F173 PolarHBondContact O-N 3.33Å |
| 172 | D | 74 | Confident | 76.2 | Confident | 61 Ų | 61 | 117.5 Ų | 117.5 | 33% | 0.326 | 62% | 0.622 | S | S | . | * | P | Polyproline II helix | trans | -72.6 | 116.2 | -175.3 | -169.7 | -29.5 | 0 | 0 | 0 | 110.7 | L170 E174 M175 W176 | L170-D172 PolarHBondContact O-N 3.43Å; D172-E174 PolarHBondContact OD1-N 3.04Å; D172-M175 HydrophobicContact CB-CB 4.43Å; D172-M175 VanDerWaalsContact CG-CB 3.41Å; D172-M175 WeakPolarHBondContact OD1-CB 3.45Å; D172-M175 WeakPolarHBondContact OD1-CG 3.44Å; D172-M175 PolarHBondContact OD1-N 3.41Å; D172-M175 WeakPolarHBondContact OD2-CB 3.46Å; D172-M175 WeakPolarHBondContact OD2-CG 3.5Å; D172-W176 WeakPolarHBondContact O-CB 3.34Å; D172-W176 PolarHBondContact O-NE1 3.2Å |
| 173 | F | 76.2 | Confident | 75.4 | Confident | 146 Ų | 146 | 115.4 Ų | 115.4 | 64% | 0.64 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.6 | -14.4 | -177.2 | -59.4 | -70 | 0 | 0 | 0 | 113.6 | P171 | P171-F173 HydrophobicContact CG-CE1 4.05Å; P171-F173 HydrophobicContact CG-CE2 4.28Å; P171-F173 HydrophobicContact CG-CZ 3.66Å; P171-F173 VanDerWaalsContact O-CD2 3.24Å; P171-F173 WeakPolarHBondContact O-CD2 3.44Å; P171-F173 VanDerWaalsContact O-CE2 3.25Å; P171-F173 WeakPolarHBondContact O-CE2 3.5Å; P171-F173 PolarHBondContact O-N 3.33Å |
| 174 | E | 74.9 | Confident | 74.7 | Confident | 158 Ų | 158 | 118.5 Ų | 118.5 | 74% | 0.738 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97 | -44.3 | -174.7 | -63.9 | -170.9 | 173.7 | 0 | 0 | 110.6 | D172 | D172-E174 PolarHBondContact OD1-N 3.04Š|
| 175 | M | 68.8 | Low | 73.9 | Confident | 37 Ų | 37 | 114 Ų | 114 | 18% | 0.182 | 59% | 0.59 | C | S | . | * | G | 310 helix | trans | -77.7 | -27.4 | -175.9 | -58 | -70.9 | -84.4 | 0 | 0 | 112.8 | D172 K177 L178 E203 F205 R222 | D172-M175 HydrophobicContact CB-CB 4.43Å; D172-M175 VanDerWaalsContact CG-CB 3.41Å; D172-M175 WeakPolarHBondContact OD1-CB 3.45Å; D172-M175 WeakPolarHBondContact OD1-CG 3.44Å; D172-M175 PolarHBondContact OD1-N 3.41Å; D172-M175 WeakPolarHBondContact OD2-CB 3.46Å; D172-M175 WeakPolarHBondContact OD2-CG 3.5Å; M175-K177 PolarHBondContact O-N 3.45Å; M175-K177 VanDerWaalsContact O-N 3.08Å; M175-L178 WeakPolarHBondContact O-CB 3.48Å; M175-L178 PolarHBondContact O-N 3.49Å; M175-E203 WeakPolarHBondContact CE-OE2 3.39Å; M175-F205 HydrophobicContact CE-CE2 4.35Å; M175-F205 HydrophobicContact CE-CZ 4.12Å; M175-R222 VanDerWaalsContact CE-CZ 3.44Å; M175-R222 PolarHBondContact SD-NH1 3.34Å; M175-R222 PolarHBondContact SD-NH2 3.3Å |
| 176 | W | 70.6 | Confident | 73.4 | Confident | 206 Ų | 206 | 114.9 Ų | 114.9 | 78% | 0.78 | 60% | 0.6 | S | S | * | * | G | 310 helix | trans | -62.4 | -19.8 | -177.2 | -83.6 | 42.9 | 0 | 0 | 0 | 114.1 | D172 L178 | D172-W176 WeakPolarHBondContact O-CB 3.34Å; D172-W176 PolarHBondContact O-NE1 3.2Å; W176-L178 VanDerWaalsContact C-N 3.29Å |
| 177 | K | 74.1 | Confident | 72.8 | Confident | 179 Ų | 179 | 114.7 Ų | 114.7 | 78% | 0.778 | 61% | 0.606 | S | S | * | * | G | 310 helix | trans | -77.4 | -18.3 | 176.2 | -61.8 | 175 | -172.8 | 169.2 | 0 | 112.7 | M175 | M175-K177 PolarHBondContact O-N 3.45Å; M175-K177 VanDerWaalsContact O-N 3.08Å |
| 178 | L | 69.3 | Low | 72 | Confident | 83 Ų | 83 | 112 Ų | 112 | 44% | 0.435 | 60% | 0.595 | S | S | . | * | S | Bend | trans | -92.6 | 129 | -173.9 | -62.5 | 173.5 | 0 | 0 | 0 | 109.5 | M175 W176 C180 R222 | M175-L178 WeakPolarHBondContact O-CB 3.48Å; M175-L178 PolarHBondContact O-N 3.49Å; W176-L178 VanDerWaalsContact C-N 3.29Å; L178-C180 PolarHBondContact O-N 2.85Å; L178-C180 VanDerWaalsContact O-N 3.08Å; L178-R222 VanDerWaalsContact CD1-CZ 3.45Å |
| 179 | A | 67.6 | Low | 71.2 | Confident | 106 Ų | 106 | 109.7 Ų | 109.7 | 88% | 0.876 | 58% | 0.58 | S | S | * | * | trans | -63.1 | 113.2 | 172.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 180 | C | 64.4 | Low | 70.4 | Confident | 104 Ų | 104 | 104.7 Ų | 104.7 | 70% | 0.703 | 56% | 0.558 | S | S | * | * | trans | -81.5 | 136.5 | 166.2 | 53.9 | 0 | 0 | 0 | 0 | 108.8 | L178 F220 | L178-C180 PolarHBondContact O-N 2.85Å; L178-C180 VanDerWaalsContact O-N 3.08Å; C180-F220 HydrophobicContact CB-CD1 4.25Å | ||
| 181 | A | 64.3 | Low | 69.6 | Low | 53 Ų | 53 | 103 Ų | 103 | 44% | 0.438 | 55% | 0.554 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -110.1 | 127.9 | 168.8 | 0 | 0 | 0 | 0 | 0 | 107.7 | V183 | A181-V183 HydrophobicContact CB-CG2 4.21Å; A181-V183 PolarHBondContact O-N 2.81Å |
| 182 | Q | 67.4 | Low | 69.1 | Low | 112 Ų | 112 | 109.4 Ų | 109.4 | 52% | 0.523 | 57% | 0.574 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -73.7 | 115.7 | 165.9 | -174 | -179.4 | 7.7 | 0 | 0 | 107.3 | F220 | Q182-F220 HydrophobicContact CB-CE1 4.16Å |
| 183 | V | 65.6 | Low | 68.5 | Low | 46 Ų | 46 | 114 Ų | 114 | 28% | 0.279 | 60% | 0.599 | S | S | . | * | trans | -117.3 | 112.8 | 177.8 | -174.3 | 0 | 0 | 0 | 0 | 107.5 | A181 F185 Y219 | A181-V183 HydrophobicContact CB-CG2 4.21Å; A181-V183 PolarHBondContact O-N 2.81Å; V183-F185 HydrophobicContact CB-CE2 3.92Å; V183-F185 HydrophobicContact CB-CZ 4.16Å; V183-F185 HydrophobicContact CG1-CD2 4.21Å; V183-F185 HydrophobicContact CG1-CE1 3.98Å; V183-F185 HydrophobicContact CG1-CE2 3.65Å; V183-F185 HydrophobicContact CG1-CZ 3.52Å; V183-Y219 PolarHBondContact N-O 2.81Å | ||
| 184 | I | 68.6 | Low | 67.5 | Low | 140 Ų | 140 | 111.5 Ų | 111.5 | 72% | 0.718 | 59% | 0.591 | S | S | * | * | trans | -85 | 127.3 | 174.8 | -56.9 | 172.7 | 0 | 0 | 0 | 107 | ||||
| 185 | F | 66.8 | Low | 66.6 | Low | 75 Ų | 75 | 110.1 Ų | 110.1 | 33% | 0.329 | 59% | 0.588 | S | S | . | * | trans | -111.2 | 133.4 | 174.1 | -62.9 | -87.9 | 0 | 0 | 0 | 109.4 | V183 V187 P189 | V183-F185 HydrophobicContact CB-CE2 3.92Å; V183-F185 HydrophobicContact CB-CZ 4.16Å; V183-F185 HydrophobicContact CG1-CD2 4.21Å; V183-F185 HydrophobicContact CG1-CE1 3.98Å; V183-F185 HydrophobicContact CG1-CE2 3.65Å; V183-F185 HydrophobicContact CG1-CZ 3.52Å; F185-V187 VanDerWaalsContact CB-O 3.23Å; F185-V187 WeakPolarHBondContact CB-O 3.37Å; F185-V187 PolarHBondContact O-N 3.06Å; F185-P189 HydrophobicContact CB-CB 4.48Å; F185-P189 HydrophobicContact CB-CG 4.45Å; F185-P189 HydrophobicContact CD1-CB 3.98Å; F185-P189 HydrophobicContact CD2-CB 3.79Å; F185-P189 HydrophobicContact CD2-CG 3.61Å; F185-P189 HydrophobicContact CE1-CB 4.09Å; F185-P189 HydrophobicContact CE2-CB 3.9Å; F185-P189 HydrophobicContact CE2-CG 3.92Å; F185-P189 HydrophobicContact CG-CB 3.83Å; F185-P189 HydrophobicContact CG-CG 4Å; F185-P189 HydrophobicContact CZ-CB 4.04Å | ||
| 186 | D | 76 | Confident | 66 | Low | 169 Ų | 169 | 114.5 Ų | 114.5 | 90% | 0.904 | 62% | 0.619 | S | S | * | * | S | Bend | trans | -68.7 | -17.2 | 174.1 | -64.1 | -27.9 | 0 | 0 | 0 | 112.5 | ||
| 187 | V | 68.4 | Low | 64.9 | Low | 116 Ų | 116 | 112.2 Ų | 112.2 | 70% | 0.703 | 62% | 0.621 | S | S | * | * | S | Bend | trans | -137.6 | 142.8 | -176.6 | -177.6 | 0 | 0 | 0 | 0 | 108.4 | F185 P189 | F185-V187 VanDerWaalsContact CB-O 3.23Å; F185-V187 WeakPolarHBondContact CB-O 3.37Å; F185-V187 PolarHBondContact O-N 3.06Å; V187-P189 WeakPolarHBondContact O-CD 3.32Å |
| 188 | D | 68.9 | Low | 63.8 | Low | 93 Ų | 93 | 106.1 Ų | 106.1 | 50% | 0.497 | 60% | 0.604 | S | S | . | * | trans | -48.3 | 114.2 | 177.6 | -176.7 | -2.3 | 0 | 0 | 0 | 110.5 | T190 | D188-T190 PolarHBondContact O-N 3.06Å; D188-T190 VanDerWaalsContact OD1-CB 3.3Å; D188-T190 WeakPolarHBondContact OD1-CB 3.39Å; D188-T190 PolarHBondContact OD1-N 3.04Å; D188-T190 PolarHBondContact OD1-OG1 2.81Å | ||
| 189 | P | 67.3 | Low | 62.6 | Low | 49 Ų | 49 | 111.5 Ų | 111.5 | 32% | 0.318 | 63% | 0.627 | S | S | . | * | trans | -73.4 | -4.8 | -175 | 30.7 | -36.7 | 0 | 0 | 0 | 112.8 | F185 V187 P191 Y219 | F185-P189 HydrophobicContact CB-CB 4.48Å; F185-P189 HydrophobicContact CB-CG 4.45Å; F185-P189 HydrophobicContact CD1-CB 3.98Å; F185-P189 HydrophobicContact CD2-CB 3.79Å; F185-P189 HydrophobicContact CD2-CG 3.61Å; F185-P189 HydrophobicContact CE1-CB 4.09Å; F185-P189 HydrophobicContact CE2-CB 3.9Å; F185-P189 HydrophobicContact CE2-CG 3.92Å; F185-P189 HydrophobicContact CG-CB 3.83Å; F185-P189 HydrophobicContact CG-CG 4Å; F185-P189 HydrophobicContact CZ-CB 4.04Å; V187-P189 WeakPolarHBondContact O-CD 3.32Å; P189-P191 VanDerWaalsContact O-CD 3.25Å; P189-P191 WeakPolarHBondContact O-CD 3.4Å; P189-Y219 HydrophobicContact CG-CD1 3.79Å; P189-Y219 HydrophobicContact CG-CD2 4.48Å; P189-Y219 HydrophobicContact CG-CE1 3.99Å; P189-Y219 HydrophobicContact CG-CG 4.04Å | ||
| 190 | T | 67.8 | Low | 61.7 | Low | 72 Ų | 72 | 110.9 Ų | 110.9 | 44% | 0.442 | 61% | 0.613 | S | S | . | * | S | Bend | trans | -68.3 | 115.3 | 180 | -44.2 | 0 | 0 | 0 | 0 | 110.3 | D188 K192 | D188-T190 PolarHBondContact O-N 3.06Å; D188-T190 VanDerWaalsContact OD1-CB 3.3Å; D188-T190 WeakPolarHBondContact OD1-CB 3.39Å; D188-T190 PolarHBondContact OD1-N 3.04Å; D188-T190 PolarHBondContact OD1-OG1 2.81Å; T190-K192 PolarHBondContact O-N 3.15Å |
| 191 | P | 65.3 | Low | 60.9 | Low | 85 Ų | 85 | 112.1 Ų | 112.1 | 55% | 0.552 | 61% | 0.612 | S | S | * | * | trans | -64 | 125.8 | 176.3 | -15.2 | 28.8 | 0 | 0 | 0 | 109.4 | P189 D193 M194 | P189-P191 VanDerWaalsContact O-CD 3.25Å; P189-P191 WeakPolarHBondContact O-CD 3.4Å; P191-D193 PolarHBondContact O-N 3.45Å; P191-M194 HydrophobicContact CB-CG 3.86Å; P191-M194 HydrophobicContact CG-CG 4Å | ||
| 192 | K | 65.2 | Low | 60.3 | Low | 207 Ų | 207 | 114.2 Ų | 114.2 | 90% | 0.9 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.3 | -11.8 | -178.4 | -66.2 | -178.2 | -180 | 177.8 | 0 | 113.8 | T190 | T190-K192 PolarHBondContact O-N 3.15Š|
| 193 | D | 60.1 | Low | 59.6 | Low | 159 Ų | 159 | 112 Ų | 112 | 85% | 0.85 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.2 | 22.3 | -171 | -62.6 | -36 | 0 | 0 | 0 | 113.9 | P191 D195 | P191-D193 PolarHBondContact O-N 3.45Å; D193-D195 PolarHBondContact O-N 3.08Å |
| 194 | M | 55.8 | Low | 58.7 | Low | 93 Ų | 93 | 117.8 Ų | 117.8 | 46% | 0.458 | 63% | 0.63 | S | S | . | * | trans | -80.6 | 119.8 | 175.9 | -83.3 | -83.9 | -81.3 | 0 | 0 | 111.4 | P191 A198 V200 | P191-M194 HydrophobicContact CB-CG 3.86Å; P191-M194 HydrophobicContact CG-CG 4Å; M194-A198 HydrophobicContact CE-CB 3.8Å; M194-A198 HydrophobicContact SD-CB 4.26Å; M194-V200 HydrophobicContact CE-CB 3.96Å; M194-V200 HydrophobicContact CE-CG2 3.53Å | ||
| 195 | D | 57 | Low | 57.9 | Low | 129 Ų | 129 | 115.9 Ų | 115.9 | 69% | 0.69 | 62% | 0.617 | S | S | * | * | trans | -56.9 | 135.5 | 165.7 | -87.1 | -38.5 | 0 | 0 | 0 | 109.8 | D193 L197 A198 | D193-D195 PolarHBondContact O-N 3.08Å; D195-L197 PolarHBondContact O-N 2.94Å; D195-A198 PolarHBondContact O-N 3.14Å | ||
| 196 | P | 54.5 | Low | 56.9 | Low | 128 Ų | 128 | 117 Ų | 117 | 83% | 0.831 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | 6.3 | -175.5 | 26.6 | -34.7 | 0 | 0 | 0 | 114.9 | ||
| 197 | L | 48.9 | Very low | 55.6 | Low | 158 Ų | 158 | 113.9 Ų | 113.9 | 83% | 0.827 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.6 | -7.1 | -179 | -83.1 | 120.6 | 0 | 0 | 0 | 114.5 | D195 E199 | D195-L197 PolarHBondContact O-N 2.94Å; L197-E199 PolarHBondContact O-N 2.83Å |
| 198 | A | 50.3 | Low | 54.6 | Low | 51 Ų | 51 | 116.5 Ų | 116.5 | 42% | 0.421 | 63% | 0.631 | S | S | . | * | S | Bend | trans | -84.8 | 104.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | M194 D195 V200 | M194-A198 HydrophobicContact CE-CB 3.8Å; M194-A198 HydrophobicContact SD-CB 4.26Å; D195-A198 PolarHBondContact O-N 3.14Å; A198-V200 PolarHBondContact O-N 3.1Å |
| 199 | E | 44.2 | Very low | 53.4 | Low | 196 Ų | 196 | 115.5 Ų | 115.5 | 92% | 0.916 | 63% | 0.631 | S | S | * | * | trans | -62.1 | 63.1 | 176.4 | -68.8 | 177.4 | 160.9 | 0 | 0 | 112.8 | L197 N201 | L197-E199 PolarHBondContact O-N 2.83Å; E199-N201 PolarHBondContact O-N 3.18Å | ||
| 200 | V | 48.7 | Very low | 52 | Low | 93 Ų | 93 | 121 Ų | 121 | 56% | 0.564 | 66% | 0.659 | S | S | * | * | trans | -87.9 | 99.4 | 157.7 | -175.6 | 0 | 0 | 0 | 0 | 105.5 | M194 A198 V202 | M194-V200 HydrophobicContact CE-CB 3.96Å; M194-V200 HydrophobicContact CE-CG2 3.53Å; A198-V200 PolarHBondContact O-N 3.1Å; V200-V202 HydrophobicContact CB-CG2 4.39Å; V200-V202 HydrophobicContact CG1-CG2 3.69Å; V200-V202 PolarHBondContact O-N 3.33Å | ||
| 201 | N | 48.7 | Very low | 50.4 | Low | 131 Ų | 131 | 123.9 Ų | 123.9 | 70% | 0.701 | 67% | 0.671 | S | S | * | * | trans | -66 | 81.9 | 171.3 | -118.1 | 10.9 | 0 | 0 | 0 | 108.8 | E199 E203 | E199-N201 PolarHBondContact O-N 3.18Å; N201-E203 HydrophobicContact CB-CG 4.33Å; N201-E203 PolarHBondContact ND2-OE1 3.01Å; N201-E203 PolarHBondContact O-N 3.14Å | ||
| 202 | V | 51.6 | Low | 49.2 | Very low | 97 Ų | 97 | 125.4 Ų | 125.4 | 59% | 0.588 | 68% | 0.679 | S | S | * | * | trans | -79.2 | 80.7 | 167.4 | -171.8 | 0 | 0 | 0 | 0 | 106.6 | V200 K204 | V200-V202 HydrophobicContact CB-CG2 4.39Å; V200-V202 HydrophobicContact CG1-CG2 3.69Å; V200-V202 PolarHBondContact O-N 3.33Å; V202-K204 PolarHBondContact O-N 3.04Å | ||
| 203 | E | 51.8 | Low | 47.9 | Very low | 64 Ų | 64 | 124.1 Ų | 124.1 | 30% | 0.299 | 68% | 0.676 | S | S | . | * | trans | -75 | 112.2 | 176.1 | -70.4 | 165.4 | -164.9 | 0 | 0 | 108.7 | M175 N201 F205 | M175-E203 WeakPolarHBondContact CE-OE2 3.39Å; N201-E203 HydrophobicContact CB-CG 4.33Å; N201-E203 PolarHBondContact ND2-OE1 3.01Å; N201-E203 PolarHBondContact O-N 3.14Å; E203-F205 HydrophobicContact CB-CD2 4.17Å; E203-F205 HydrophobicContact CB-CE2 3.45Å; E203-F205 VanDerWaalsContact CB-CE2 3.45Å; E203-F205 HydrophobicContact CB-CZ 3.72Å; E203-F205 HydrophobicContact CG-CZ 4.45Å; E203-F205 WeakPolarHBondContact O-CD2 3.29Å; E203-F205 PolarHBondContact O-N 2.93Å; E203-F205 WeakPolarHBondContact OE2-CZ 3.33Å | ||
| 204 | K | 46.8 | Very low | 47.1 | Very low | 168 Ų | 168 | 123.3 Ų | 123.3 | 73% | 0.73 | 67% | 0.672 | S | S | * | * | trans | -81.3 | 102.6 | 174.8 | -66.3 | -178.3 | -177.9 | -179.7 | 0 | 108.5 | V202 | V202-K204 PolarHBondContact O-N 3.04Š| ||
| 205 | F | 51.2 | Low | 46.6 | Very low | 100 Ų | 100 | 127.4 Ų | 127.4 | 44% | 0.439 | 69% | 0.69 | S | S | . | * | P | Polyproline II helix | trans | -91.2 | 119.1 | 170.9 | -62.3 | -77.1 | 0 | 0 | 0 | 109.6 | M175 E203 L207 F220 | M175-F205 HydrophobicContact CE-CE2 4.35Å; M175-F205 HydrophobicContact CE-CZ 4.12Å; E203-F205 HydrophobicContact CB-CD2 4.17Å; E203-F205 HydrophobicContact CB-CE2 3.45Å; E203-F205 VanDerWaalsContact CB-CE2 3.45Å; E203-F205 HydrophobicContact CB-CZ 3.72Å; E203-F205 HydrophobicContact CG-CZ 4.45Å; E203-F205 WeakPolarHBondContact O-CD2 3.29Å; E203-F205 PolarHBondContact O-N 2.93Å; E203-F205 WeakPolarHBondContact OE2-CZ 3.33Å; F205-L207 PolarHBondContact O-N 3.27Å; F205-F220 HydrophobicContact CB-CD2 4.35Å |
| 206 | A | 46.8 | Very low | 46 | Very low | 98 Ų | 98 | 127.3 Ų | 127.3 | 81% | 0.81 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 116.8 | 163.3 | 0 | 0 | 0 | 0 | 0 | 107.8 | I208 | A206-I208 PolarHBondContact O-N 3.28Š|
| 207 | L | 48.8 | Very low | 45.7 | Very low | 104 Ų | 104 | 130.5 Ų | 130.5 | 55% | 0.545 | 69% | 0.686 | S | S | . | * | P | Polyproline II helix | trans | -72 | 125 | 171.8 | -161.8 | 82.4 | 0 | 0 | 0 | 108 | F205 S209 F220 | F205-L207 PolarHBondContact O-N 3.27Å; L207-S209 VanDerWaalsContact C-N 3.33Å; L207-S209 PolarHBondContact O-N 3.39Å; L207-F220 HydrophobicContact CD1-CZ 4.24Å |
| 208 | I | 46.4 | Very low | 45.8 | Very low | 171 Ų | 171 | 126.3 Ų | 126.3 | 88% | 0.877 | 66% | 0.662 | S | S | * | * | trans | -80.9 | 90.3 | 162.3 | -59.2 | 172.3 | 0 | 0 | 0 | 105.5 | A206 | A206-I208 PolarHBondContact O-N 3.28Š| ||
| 209 | S | 44.5 | Very low | 45.7 | Very low | 72 Ų | 72 | 127.3 Ų | 127.3 | 50% | 0.503 | 66% | 0.656 | S | S | . | * | trans | -74.4 | 121.4 | 164.1 | 43.7 | 0 | 0 | 0 | 0 | 108.2 | L207 D211 | L207-S209 VanDerWaalsContact C-N 3.33Å; L207-S209 PolarHBondContact O-N 3.39Å; S209-D211 PolarHBondContact O-N 3.25Å | ||
| 210 | D | 37 | Very low | 46.1 | Very low | 166 Ų | 166 | 120.3 Ų | 120.3 | 89% | 0.888 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -67.6 | 119.5 | 166.6 | -166.4 | 25.5 | 0 | 0 | 0 | 107.1 | ||
| 211 | D | 35.1 | Very low | 46.2 | Very low | 132 Ų | 132 | 121.7 Ų | 121.7 | 71% | 0.706 | 62% | 0.623 | S | S | * | * | S | Bend | trans | 76.5 | 146.3 | 178.3 | -128.7 | -13.8 | 0 | 0 | 0 | 117.6 | S209 | S209-D211 PolarHBondContact O-N 3.25Š|
| 212 | T | 40.8 | Very low | 46.4 | Very low | 116 Ų | 116 | 120.5 Ų | 120.5 | 71% | 0.712 | 61% | 0.608 | S | S | * | * | trans | 74.8 | 99.6 | 177.9 | 44.5 | 0 | 0 | 0 | 0 | 119.3 | D214 | T212-D214 PolarHBondContact O-N 3.15Š| ||
| 213 | Q | 37.3 | Very low | 46.1 | Very low | 181 Ų | 181 | 125.3 Ų | 125.3 | 85% | 0.846 | 62% | 0.616 | S | S | * | * | trans | 2.2 | 100.7 | 132.9 | -62.1 | 177.4 | -33 | 0 | 0 | 115.1 | ||||
| 214 | D | 44 | Very low | 45.9 | Very low | 142 Ų | 142 | 129.3 Ų | 129.3 | 76% | 0.759 | 63% | 0.634 | S | S | * | * | 173.6 | 129.6 | 129.9 | -84.2 | -27.6 | 0 | 0 | 0 | 108.3 | T212 D216 | T212-D214 PolarHBondContact O-N 3.15Å; D214-D216 PolarHBondContact O-N 3.21Å | |||
| 215 | E | 43.4 | Very low | 45.4 | Very low | 178 Ų | 178 | 128.4 Ų | 128.4 | 83% | 0.832 | 63% | 0.631 | S | S | * | * | trans | -74.9 | 67.5 | 178.4 | -67.5 | -162.2 | 169.9 | 0 | 0 | 110.7 | ||||
| 216 | D | 45.1 | Very low | 44.7 | Very low | 127 Ų | 127 | 128.7 Ų | 128.7 | 68% | 0.679 | 64% | 0.643 | S | S | * | * | trans | -93.9 | 111.1 | 171.1 | -77.5 | -16.7 | 0 | 0 | 0 | 109.4 | D214 Q218 | D214-D216 PolarHBondContact O-N 3.21Å; D216-Q218 PolarHBondContact O-N 3.29Å; D216-Q218 VanDerWaalsContact O-N 3.16Å | ||
| 217 | Y | 48.3 | Very low | 44.2 | Very low | 195 Ų | 195 | 132.3 Ų | 132.3 | 77% | 0.765 | 65% | 0.648 | S | S | * | * | trans | -63.4 | 115 | 171.9 | -64.7 | -77.7 | 0 | 0 | 0 | 109.8 | ||||
| 218 | Q | 51.2 | Low | 43.6 | Very low | 71 Ų | 71 | 140.7 Ų | 140.7 | 33% | 0.332 | 68% | 0.68 | S | S | . | * | trans | -95.5 | 132.3 | 177.5 | -61.3 | -175.6 | 6.5 | 0 | 0 | 110.6 | D216 F220 | D216-Q218 PolarHBondContact O-N 3.29Å; D216-Q218 VanDerWaalsContact O-N 3.16Å; Q218-F220 HydrophobicContact CB-CE2 4.15Å | ||
| 219 | Y | 48.8 | Very low | 43.4 | Very low | 71 Ų | 71 | 139.2 Ų | 139.2 | 28% | 0.278 | 67% | 0.67 | S | S | . | * | trans | -100.1 | 127.9 | 176.2 | -61.5 | -91.9 | 0 | 0 | 0 | 109.8 | V183 P189 | V183-Y219 PolarHBondContact N-O 2.81Å; P189-Y219 HydrophobicContact CG-CD1 3.79Å; P189-Y219 HydrophobicContact CG-CD2 4.48Å; P189-Y219 HydrophobicContact CG-CE1 3.99Å; P189-Y219 HydrophobicContact CG-CG 4.04Å | ||
| 220 | F | 52.7 | Low | 43.4 | Very low | 50 Ų | 50 | 142.7 Ų | 142.7 | 22% | 0.219 | 68% | 0.679 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -108.3 | 125.9 | 171.7 | -67.5 | -83.4 | 0 | 0 | 0 | 108.9 | C180 Q182 F205 L207 Q218 | C180-F220 HydrophobicContact CB-CD1 4.25Å; Q182-F220 HydrophobicContact CB-CE1 4.16Å; F205-F220 HydrophobicContact CB-CD2 4.35Å; L207-F220 HydrophobicContact CD1-CZ 4.24Å; Q218-F220 HydrophobicContact CB-CE2 4.15Å |
| 221 | Q | 50.2 | Low | 43.7 | Very low | 122 Ų | 122 | 141.4 Ų | 141.4 | 57% | 0.57 | 67% | 0.667 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -105.8 | 119.7 | 176.6 | -161.9 | 176.7 | 12.2 | 0 | 0 | 109.5 | ||
| 222 | R | 53 | Low | 44.2 | Very low | 105 Ų | 105 | 141.9 Ų | 141.9 | 40% | 0.396 | 67% | 0.665 | S | S | . | * | trans | -96.3 | 122.3 | 177.2 | -170.2 | 176.9 | 178.4 | -152.4 | -0.1 | 109.5 | M175 L178 | M175-R222 VanDerWaalsContact CE-CZ 3.44Å; M175-R222 PolarHBondContact SD-NH1 3.34Å; M175-R222 PolarHBondContact SD-NH2 3.3Å; L178-R222 VanDerWaalsContact CD1-CZ 3.45Å | ||
| 223 | R | 44.3 | Very low | 44.4 | Very low | 199 Ų | 199 | 143.6 Ų | 143.6 | 75% | 0.751 | 66% | 0.662 | S | S | * | * | trans | -86.2 | 110.2 | 167.5 | -73.8 | -168.7 | -162.6 | 165.4 | 7.4 | 109.2 | F225 | R223-F225 HydrophobicContact CB-CD2 4.1Å; R223-F225 HydrophobicContact CB-CE2 4.1Å; R223-F225 HydrophobicContact CG-CE2 4.47Å; R223-F225 PolarHBondContact O-N 2.9Å | ||
| 224 | H | 47.9 | Very low | 44.9 | Very low | 148 Ų | 148 | 141.1 Ų | 141.1 | 69% | 0.685 | 65% | 0.65 | S | S | * | * | trans | -78.2 | 98.7 | 159.9 | -118.8 | -78.9 | 0 | 0 | 0 | 107.7 | ||||
| 225 | F | 37.4 | Very low | 45 | Very low | 148 Ų | 148 | 141 Ų | 141 | 65% | 0.649 | 64% | 0.642 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 120.7 | 161.8 | -83.3 | -79 | 0 | 0 | 0 | 107.6 | R223 L227 | R223-F225 HydrophobicContact CB-CD2 4.1Å; R223-F225 HydrophobicContact CB-CE2 4.1Å; R223-F225 HydrophobicContact CG-CE2 4.47Å; R223-F225 PolarHBondContact O-N 2.9Å; F225-L227 PolarHBondContact O-N 2.86Å |
| 226 | P | 36.3 | Very low | 45.1 | Very low | 107 Ų | 107 | 138.2 Ų | 138.2 | 70% | 0.695 | 63% | 0.627 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 126.1 | 164.8 | 28.1 | -28.6 | 0 | 0 | 0 | 107.4 | F228 | P226-F228 PolarHBondContact O-N 3.37Š|
| 227 | L | 35.9 | Very low | 45.1 | Very low | 174 Ų | 174 | 139.1 Ų | 139.1 | 91% | 0.911 | 62% | 0.623 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 126.1 | 166.2 | -74.7 | 161.9 | 0 | 0 | 0 | 107.4 | F225 | F225-L227 PolarHBondContact O-N 2.86Š|
| 228 | F | 35 | Very low | 44.8 | Very low | 279 Ų | 279 | 134 Ų | 134 | 100% | 1.224 | 61% | 0.61 | S | S | * | * | trans | -59.7 | 0 | 167.1 | -80.5 | -86.2 | 0 | 0 | 0 | 111.5 | P226 | P226-F228 PolarHBondContact O-N 3.37Š|
Retrieved 228 of 228 residues in 220 ms
(Link to these results)