| 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 | 38.2 | Very low | 56.3 | Low | 250 Ų | 250 | 142.9 Ų | 142.9 | 100% | 1.232 | 84% | 0.843 | S | S | * | * | 0 | 131.3 | 0 | -62.2 | -178.6 | 179.3 | 0 | 0 | 108 | |||||
| 2 | A | 42.7 | Very low | 58.6 | Low | 94 Ų | 94 | 143.2 Ų | 143.2 | 78% | 0.777 | 82% | 0.82 | S | S | * | * | trans | -103.8 | 121.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | N4 | A2-N4 PolarHBondContact O-N 3.03Š| ||
| 3 | G | 50.5 | Low | 61.1 | Low | 76 Ų | 76 | 144.2 Ų | 144.2 | 78% | 0.784 | 83% | 0.831 | S | S | * | * | trans | -85.4 | 107 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | K5 | G3-K5 PolarHBondContact O-N 3.47Š| ||
| 4 | N | 46.5 | Very low | 63.2 | Low | 161 Ų | 161 | 141.7 Ų | 141.7 | 86% | 0.861 | 81% | 0.806 | S | S | * | * | trans | -68.4 | 91.1 | 176.1 | -78.4 | -2.3 | 0 | 0 | 0 | 110.9 | A2 G6 | A2-N4 PolarHBondContact O-N 3.03Å; N4-G6 PolarHBondContact O-N 3.08Å | ||
| 5 | K | 52.7 | Low | 64.8 | Low | 205 Ų | 205 | 140.9 Ų | 140.9 | 89% | 0.891 | 80% | 0.798 | S | S | * | * | trans | -74.6 | 88.4 | -179.8 | -166.2 | 169.3 | -174 | 173.4 | 0 | 110.3 | G3 R7 | G3-K5 PolarHBondContact O-N 3.47Å; K5-R7 PolarHBondContact O-N 3.31Å | ||
| 6 | G | 52.7 | Low | 66.2 | Low | 71 Ų | 71 | 135.3 Ų | 135.3 | 73% | 0.732 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 132.3 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | N4 | N4-G6 PolarHBondContact O-N 3.08Š|
| 7 | R | 58 | Low | 67.4 | Low | 252 Ų | 252 | 135.3 Ų | 135.3 | 95% | 0.951 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 133.1 | 169.4 | -73.6 | 175.7 | 168.1 | 157.6 | -5.1 | 108.8 | K5 | K5-R7 PolarHBondContact O-N 3.31Š|
| 8 | G | 59.2 | Low | 68.6 | Low | 75 Ų | 75 | 132.6 Ų | 132.6 | 77% | 0.773 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 148.3 | 175 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 9 | R | 63.4 | Low | 69.7 | Low | 209 Ų | 209 | 130.5 Ų | 130.5 | 79% | 0.789 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 143.6 | 172.3 | -67.1 | -178.6 | 179.2 | -116.3 | 4.4 | 109.6 | ||
| 10 | A | 76.7 | Confident | 70.6 | Confident | 88 Ų | 88 | 126.9 Ų | 126.9 | 73% | 0.727 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 143.9 | 174 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 11 | A | 78.6 | Confident | 71.4 | Confident | 91 Ų | 91 | 124 Ų | 124 | 75% | 0.752 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 145.5 | 172.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 12 | Y | 84.2 | Confident | 73.6 | Confident | 146 Ų | 146 | 115 Ų | 115 | 57% | 0.573 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 170.2 | 170.5 | -58.2 | -63.5 | 0 | 0 | 0 | 111.1 | F14 I16 | Y12-F14 HydrophobicContact CD2-CE1 4.23Å; Y12-F14 AromaticContact CD2-CZ 3.87Å; Y12-F14 HydrophobicContact CD2-CZ 3.87Å; Y12-F14 AromaticContact CG-CE1 3.9Å; Y12-F14 HydrophobicContact CG-CE1 3.9Å; Y12-F14 HydrophobicContact CG-CZ 4.03Å; Y12-F14 PolarHBondContact O-N 3.33Å; Y12-I16 HydrophobicContact CD2-CD1 3.74Å; Y12-I16 HydrophobicContact CD2-CG1 4.01Å; Y12-I16 HydrophobicContact CE2-CD1 4.27Å |
| 13 | T | 91.1 | Very high | 75.3 | Confident | 156 Ų | 156 | 119.7 Ų | 119.7 | 96% | 0.957 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -71.5 | -11.1 | 176.6 | 49.1 | 0 | 0 | 0 | 0 | 114 | ||
| 14 | F | 89.6 | Confident | 76.5 | Confident | 110 Ų | 110 | 120 Ų | 120 | 48% | 0.482 | 68% | 0.684 | S | S | . | * | S | Bend | trans | -114.3 | 154.6 | 179 | 63.7 | -92.1 | 0 | 0 | 0 | 111.5 | Y12 I16 V19 | Y12-F14 HydrophobicContact CD2-CE1 4.23Å; Y12-F14 AromaticContact CD2-CZ 3.87Å; Y12-F14 HydrophobicContact CD2-CZ 3.87Å; Y12-F14 AromaticContact CG-CE1 3.9Å; Y12-F14 HydrophobicContact CG-CE1 3.9Å; Y12-F14 HydrophobicContact CG-CZ 4.03Å; Y12-F14 PolarHBondContact O-N 3.33Å; F14-I16 HydrophobicContact CE2-CG1 4.35Å; F14-I16 PolarHBondContact O-N 3.19Å; F14-I16 VanDerWaalsContact O-N 3.14Å; F14-V19 HydrophobicContact CD2-CG2 3.94Å; F14-V19 HydrophobicContact CE2-CG2 3.95Å |
| 15 | N | 88.6 | Confident | 78 | Confident | 130 Ų | 130 | 116.9 Ų | 116.9 | 70% | 0.695 | 66% | 0.664 | S | S | * | * | trans | -73.7 | 104.3 | -178.8 | -65.9 | -35.5 | 0 | 0 | 0 | 111.1 | E17 A18 | N15-E17 VanDerWaalsContact C-N 3.26Å; N15-E17 PolarHBondContact O-N 3.48Å; N15-A18 HydrophobicContact CB-CB 4Å; N15-A18 WeakPolarHBondContact O-CB 3.39Å; N15-A18 PolarHBondContact O-N 3.49Å; N15-A18 VanDerWaalsContact O-N 3.08Å | ||
| 16 | I | 86.7 | Confident | 79.4 | Confident | 51 Ų | 51 | 114.8 Ų | 114.8 | 26% | 0.262 | 66% | 0.655 | S | S | . | * | G | 310 helix | trans | -56.5 | -39.8 | 179.5 | -62.1 | 172.3 | 0 | 0 | 0 | 111.8 | Y12 F14 A18 V19 G20 F21 | Y12-I16 HydrophobicContact CD2-CD1 3.74Å; Y12-I16 HydrophobicContact CD2-CG1 4.01Å; Y12-I16 HydrophobicContact CE2-CD1 4.27Å; F14-I16 HydrophobicContact CE2-CG1 4.35Å; F14-I16 PolarHBondContact O-N 3.19Å; F14-I16 VanDerWaalsContact O-N 3.14Å; I16-A18 VanDerWaalsContact C-N 3.27Å; I16-A18 PolarHBondContact O-N 2.8Å; I16-V19 WeakPolarHBondContact O-CB 3.42Å; I16-V19 PolarHBondContact O-N 2.56Å; I16-G20 PolarHBondContact O-N 3.09Å; I16-F21 HydrophobicContact CG2-CB 3.76Å; I16-F21 PolarHBondContact O-N 3.14Å |
| 17 | E | 86.4 | Confident | 81 | Confident | 135 Ų | 135 | 114 Ų | 114 | 63% | 0.631 | 63% | 0.634 | S | S | * | * | G | 310 helix | trans | -64.5 | -30.2 | 179.5 | -63.8 | 175 | 174.7 | 0 | 0 | 112.3 | N15 V19 G20 F21 | N15-E17 VanDerWaalsContact C-N 3.26Å; N15-E17 PolarHBondContact O-N 3.48Å; E17-V19 VanDerWaalsContact C-N 3.29Å; E17-V19 PolarHBondContact O-N 2.84Å; E17-G20 PolarHBondContact O-N 3.33Å; E17-F21 WeakPolarHBondContact CA-O 3.48Å |
| 18 | A | 89.3 | Confident | 82.5 | Confident | 87 Ų | 87 | 106.7 Ų | 106.7 | 72% | 0.719 | 62% | 0.619 | S | S | * | * | G | 310 helix | trans | -77 | -13.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | N15 I16 G20 | N15-A18 HydrophobicContact CB-CB 4Å; N15-A18 WeakPolarHBondContact O-CB 3.39Å; N15-A18 PolarHBondContact O-N 3.49Å; N15-A18 VanDerWaalsContact O-N 3.08Å; I16-A18 VanDerWaalsContact C-N 3.27Å; I16-A18 PolarHBondContact O-N 2.8Å; A18-G20 VanDerWaalsContact C-N 3.31Å |
| 19 | V | 88.6 | Confident | 84 | Confident | 93 Ų | 93 | 108.8 Ų | 108.8 | 56% | 0.564 | 61% | 0.612 | S | S | * | * | G | 310 helix | trans | -85.6 | -9.3 | 170.4 | -176.6 | 0 | 0 | 0 | 0 | 111.1 | F14 I16 E17 F21 | F14-V19 HydrophobicContact CD2-CG2 3.94Å; F14-V19 HydrophobicContact CE2-CG2 3.95Å; I16-V19 WeakPolarHBondContact O-CB 3.42Å; I16-V19 PolarHBondContact O-N 2.56Å; E17-V19 VanDerWaalsContact C-N 3.29Å; E17-V19 PolarHBondContact O-N 2.84Å; V19-F21 HydrophobicContact CG1-CD2 4.44Å |
| 20 | G | 88.6 | Confident | 85.3 | Confident | 57 Ų | 57 | 104.2 Ų | 104.2 | 59% | 0.588 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 99.7 | 12.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | I16 E17 A18 | I16-G20 PolarHBondContact O-N 3.09Å; E17-G20 PolarHBondContact O-N 3.33Å; A18-G20 VanDerWaalsContact C-N 3.31Å |
| 21 | F | 87.1 | Confident | 86.1 | Confident | 66 Ų | 66 | 105.4 Ų | 105.4 | 29% | 0.289 | 61% | 0.605 | S | S | . | * | trans | -103.1 | 109.9 | 170.6 | -69.8 | -78.4 | 0 | 0 | 0 | 110.5 | I16 E17 V19 E25 L27 | I16-F21 HydrophobicContact CG2-CB 3.76Å; I16-F21 PolarHBondContact O-N 3.14Å; E17-F21 WeakPolarHBondContact CA-O 3.48Å; V19-F21 HydrophobicContact CG1-CD2 4.44Å; F21-E25 WeakPolarHBondContact CA-OE2 3.42Å; F21-L27 HydrophobicContact CB-CD2 4.08Å; F21-L27 HydrophobicContact CD1-CD2 3.84Å; F21-L27 HydrophobicContact CD2-CD2 3.85Å; F21-L27 HydrophobicContact CE1-CD2 4.19Å; F21-L27 HydrophobicContact CE2-CD2 4.2Å; F21-L27 HydrophobicContact CG-CD2 3.66Å; F21-L27 HydrophobicContact CZ-CD2 4.36Å | ||
| 22 | S | 84.5 | Confident | 86.8 | Confident | 63 Ų | 63 | 109.2 Ų | 109.2 | 44% | 0.441 | 61% | 0.612 | S | S | . | * | trans | -77.9 | 165.7 | 174.9 | 95.1 | 0 | 0 | 0 | 0 | 112.5 | G24 E25 | S22-G24 PolarHBondContact O-N 2.97Å; S22-E25 WeakPolarHBondContact CB-OE1 3.19Å; S22-E25 VanDerWaalsContact N-CD 3.29Å; S22-E25 PolarHBondContact N-OE2 2.78Å; S22-E25 PolarHBondContact O-N 3.45Å; S22-E25 VanDerWaalsContact O-N 3.09Å; S22-E25 PolarHBondContact OG-OE1 2.98Å | ||
| 23 | K | 77.1 | Confident | 87.3 | Confident | 192 Ų | 192 | 110.1 Ų | 110.1 | 84% | 0.835 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | 88.5 | -167.9 | -172 | 177.2 | -179.4 | 174.3 | 0 | 113.5 | ||
| 24 | G | 76.3 | Confident | 87.5 | Confident | 82 Ų | 82 | 107.5 Ų | 107.5 | 85% | 0.845 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 128.3 | -2.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | S22 | S22-G24 PolarHBondContact O-N 2.97Š|
| 25 | E | 79.1 | Confident | 87.7 | Confident | 95 Ų | 95 | 107.5 Ų | 107.5 | 44% | 0.444 | 62% | 0.616 | S | S | . | * | trans | -70.4 | 161.2 | 179.2 | -74.6 | 170.1 | -168.8 | 0 | 0 | 113.6 | F21 S22 L27 | F21-E25 WeakPolarHBondContact CA-OE2 3.42Å; S22-E25 WeakPolarHBondContact CB-OE1 3.19Å; S22-E25 VanDerWaalsContact N-CD 3.29Å; S22-E25 PolarHBondContact N-OE2 2.78Å; S22-E25 PolarHBondContact O-N 3.45Å; S22-E25 VanDerWaalsContact O-N 3.09Å; S22-E25 PolarHBondContact OG-OE1 2.98Å; E25-L27 PolarHBondContact O-N 2.88Å | ||
| 26 | K | 81.8 | Confident | 88.1 | Confident | 161 Ų | 161 | 105.5 Ų | 105.5 | 70% | 0.7 | 61% | 0.61 | S | S | * | * | trans | -76 | 90 | -179 | -163.4 | -166.4 | 175.4 | -157.5 | 0 | 110.8 | D29 | K26-D29 WeakPolarHBondContact CE-OD2 3.48Å; K26-D29 IonicContact NZ-OD1 3.92Å; K26-D29 IonicContact NZ-OD2 2.78Å; K26-D29 PolarHBondContact NZ-OD2 3.46Å | ||
| 27 | L | 86.4 | Confident | 88.6 | Confident | 55 Ų | 55 | 110.8 Ų | 110.8 | 29% | 0.288 | 64% | 0.638 | S | S | . | * | P | Polyproline II helix | trans | -52.3 | 151.2 | 162.1 | -70.4 | 169.3 | 0 | 0 | 0 | 111.2 | F21 E25 | F21-L27 HydrophobicContact CB-CD2 4.08Å; F21-L27 HydrophobicContact CD1-CD2 3.84Å; F21-L27 HydrophobicContact CD2-CD2 3.85Å; F21-L27 HydrophobicContact CE1-CD2 4.19Å; F21-L27 HydrophobicContact CE2-CD2 4.2Å; F21-L27 HydrophobicContact CG-CD2 3.66Å; F21-L27 HydrophobicContact CZ-CD2 4.36Å; E25-L27 PolarHBondContact O-N 2.88Å |
| 28 | P | 89.5 | Confident | 89.1 | Confident | 98 Ų | 98 | 113 Ų | 113 | 64% | 0.636 | 65% | 0.646 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 148.6 | 177.2 | 26 | -35.2 | 0 | 0 | 0 | 112.1 | ||
| 29 | D | 89.8 | Confident | 89.4 | Confident | 120 Ų | 120 | 113.2 Ų | 113.2 | 64% | 0.642 | 64% | 0.639 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 144.4 | -178.9 | -65.9 | -59.8 | 0 | 0 | 0 | 111.2 | K26 V31 | K26-D29 WeakPolarHBondContact CE-OD2 3.48Å; K26-D29 IonicContact NZ-OD1 3.92Å; K26-D29 IonicContact NZ-OD2 2.78Å; K26-D29 PolarHBondContact NZ-OD2 3.46Å; D29-V31 PolarHBondContact O-N 3.16Å |
| 30 | V | 91.5 | Very high | 89.8 | Confident | 113 Ų | 113 | 116.4 Ų | 116.4 | 69% | 0.685 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 118.2 | -176.5 | -179.9 | 0 | 0 | 0 | 0 | 109.8 | L32 | V30-L32 PolarHBondContact O-N 3.41Å; V30-L32 VanDerWaalsContact O-N 3.16Å |
| 31 | V | 92.9 | Very high | 90.1 | Very high | 113 Ų | 113 | 117.7 Ų | 117.7 | 69% | 0.685 | 65% | 0.65 | S | S | * | * | trans | -64.6 | 111.5 | 177.8 | 177.4 | 0 | 0 | 0 | 0 | 110.1 | D29 K33 | D29-V31 PolarHBondContact O-N 3.16Å; V31-K33 WeakPolarHBondContact CG1-O 3.12Å | ||
| 32 | L | 93.6 | Very high | 90.5 | Very high | 171 Ų | 171 | 122 Ų | 122 | 90% | 0.895 | 68% | 0.676 | S | S | * | * | trans | -83.1 | -20.9 | -173.9 | -59.2 | -179.2 | 0 | 0 | 0 | 114.4 | V30 | V30-L32 PolarHBondContact O-N 3.41Å; V30-L32 VanDerWaalsContact O-N 3.16Å | ||
| 33 | K | 94.3 | Very high | 91.1 | Very high | 164 Ų | 164 | 128.5 Ų | 128.5 | 71% | 0.713 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -142.6 | 139.8 | -179.6 | -171.1 | -174.3 | 72.7 | 170.9 | 0 | 108 | V31 | V31-K33 WeakPolarHBondContact CG1-O 3.12Š|
| 34 | P | 95.8 | Very high | 92 | Very high | 102 Ų | 102 | 126.9 Ų | 126.9 | 66% | 0.662 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 150.2 | 172.5 | 23.7 | -34.7 | 0 | 0 | 0 | 111.7 | ||
| 35 | P | 94.4 | Very high | 93 | Very high | 109 Ų | 109 | 128.8 Ų | 128.8 | 71% | 0.708 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 155.4 | 169.3 | -24.7 | 35.1 | 0 | 0 | 0 | 112.3 | ||
| 36 | P | 96.4 | Very high | 93.9 | Very high | 88 Ų | 88 | 130.7 Ų | 130.7 | 57% | 0.571 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 155 | 173.3 | 30.2 | -35.8 | 0 | 0 | 0 | 111.4 | F38 | P36-F38 PolarHBondContact O-N 3.06Š|
| 37 | L | 97.3 | Very high | 94.6 | Very high | 162 Ų | 162 | 128.5 Ų | 128.5 | 85% | 0.848 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -61.7 | -33.3 | 175.5 | -65.1 | 175.8 | 0 | 0 | 0 | 112.4 | ||
| 38 | F | 96.2 | Very high | 95 | Very high | 183 Ų | 183 | 133.7 Ų | 133.7 | 80% | 0.803 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -119.4 | 97.9 | 176.2 | -55.8 | -68.9 | 0 | 0 | 0 | 108 | P36 | P36-F38 PolarHBondContact O-N 3.06Š|
| 39 | P | 96.1 | Very high | 95.3 | Very high | 90 Ų | 90 | 136.9 Ų | 136.9 | 58% | 0.584 | 73% | 0.734 | S | S | * | * | trans | -73.2 | 150.6 | 168.3 | 31.6 | -34 | 0 | 0 | 0 | 110.2 | ||||
| 40 | D | 96.6 | Very high | 95.6 | Very high | 161 Ų | 161 | 137.4 Ų | 137.4 | 86% | 0.861 | 74% | 0.741 | S | S | * | * | trans | -62.4 | 142 | 175.2 | -68.8 | -63.4 | 0 | 0 | 0 | 111.9 | ||||
| 41 | T | 95 | Very high | 95.8 | Very high | 84 Ų | 84 | 133.2 Ų | 133.2 | 52% | 0.515 | 72% | 0.721 | S | S | . | * | trans | -109.6 | 128.2 | 179.1 | 63.8 | 0 | 0 | 0 | 0 | 110.7 | Y43 | T41-Y43 PolarHBondContact O-N 2.95Å; T41-Y43 PolarHBondContact OG1-O 2.88Å | ||
| 42 | D | 97.1 | Very high | 96 | Very high | 156 Ų | 156 | 136.2 Ų | 136.2 | 83% | 0.834 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -55.5 | -27.5 | -179.5 | -61.2 | -28.2 | 0 | 0 | 0 | 113.6 | ||
| 43 | Y | 96.5 | Very high | 96.2 | Very high | 200 Ų | 200 | 130 Ų | 130 | 78% | 0.784 | 71% | 0.705 | S | S | * | * | trans | -125.6 | 157.6 | -178.8 | -59.3 | -74.6 | 0 | 0 | 0 | 111.9 | T41 | T41-Y43 PolarHBondContact O-N 2.95Å; T41-Y43 PolarHBondContact OG1-O 2.88Å | ||
| 44 | K | 96.1 | Very high | 96.3 | Very high | 158 Ų | 158 | 125.9 Ų | 125.9 | 69% | 0.687 | 69% | 0.688 | S | S | * | * | trans | -114.8 | 155.9 | 174.6 | -60.4 | -56.4 | 179.1 | -165.3 | 0 | 109.7 | ||||
| 45 | P | 96.8 | Very high | 96.4 | Very high | 121 Ų | 121 | 126.5 Ų | 126.5 | 79% | 0.786 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 156.9 | 178.5 | 26.6 | -35.7 | 0 | 0 | 0 | 112.3 | ||
| 46 | V | 97.3 | Very high | 96.5 | Very high | 135 Ų | 135 | 128.6 Ų | 128.6 | 82% | 0.818 | 68% | 0.677 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 137.5 | 175.2 | -176.5 | 0 | 0 | 0 | 0 | 109.5 | ||
| 47 | P | 96.6 | Very high | 96.6 | Very high | 115 Ų | 115 | 130 Ų | 130 | 75% | 0.747 | 68% | 0.677 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 153.8 | 173.7 | -27 | 35.7 | 0 | 0 | 0 | 113.4 | ||
| 48 | L | 95.7 | Very high | 96.6 | Very high | 164 Ų | 164 | 126.6 Ų | 126.6 | 86% | 0.859 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 152.8 | 172.7 | -64.2 | 175.5 | 0 | 0 | 0 | 110.8 | ||
| 49 | K | 96.3 | Very high | 96.7 | Very high | 166 Ų | 166 | 119.6 Ų | 119.6 | 72% | 0.722 | 64% | 0.636 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 141.4 | 170.5 | -66.7 | -175.9 | 177.9 | -175 | 0 | 110.1 | E54 | K49-E54 HydrophobicContact CB-CG 4.03Å; K49-E54 VanDerWaalsContact CD-OE1 3.27Å; K49-E54 WeakPolarHBondContact CD-OE1 3.42Å |
| 50 | T | 94.6 | Very high | 96.8 | Very high | 130 Ų | 130 | 118.1 Ų | 118.1 | 80% | 0.798 | 62% | 0.623 | S | S | * | * | trans | -113.2 | 146.2 | 173.3 | 50.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 51 | G | 96.8 | Very high | 96.9 | Very high | 26 Ų | 26 | 116.6 Ų | 116.6 | 27% | 0.268 | 61% | 0.608 | S | S | . | * | S | Bend | trans | 151.5 | 148.9 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | G53 E54 E55 | G51-G53 PolarHBondContact O-N 2.92Å; G51-G53 VanDerWaalsContact O-N 3.14Å; G51-E54 PolarHBondContact O-N 3.01Å; G51-E54 VanDerWaalsContact O-N 3.1Å; G51-E55 PolarHBondContact O-N 3.32Å |
| 52 | E | 96.8 | Very high | 97 | Very high | 176 Ų | 176 | 117.2 Ų | 117.2 | 82% | 0.822 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -55.2 | -33.9 | -176.5 | -60 | 172 | 178.2 | 0 | 0 | 113 | Y56 | E52-Y56 VanDerWaalsContact O-CB 3.29Å; E52-Y56 WeakPolarHBondContact O-CB 3.34Å; E52-Y56 PolarHBondContact O-N 3.36Å |
| 53 | G | 97.2 | Very high | 97 | Very high | 41 Ų | 41 | 115 Ų | 115 | 42% | 0.423 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -71.7 | -44 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | G51 M57 | G51-G53 PolarHBondContact O-N 2.92Å; G51-G53 VanDerWaalsContact O-N 3.14Å; G53-M57 WeakPolarHBondContact O-CE 3.39Å; G53-M57 WeakPolarHBondContact O-CG 3.27Å; G53-M57 PolarHBondContact O-N 3.02Å |
| 54 | E | 97.1 | Very high | 97.1 | Very high | 76 Ų | 76 | 109.8 Ų | 109.8 | 36% | 0.355 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -62.1 | -41 | 172.1 | -81.7 | 82.2 | 173 | 0 | 0 | 112.1 | K49 G51 M57 L58 | K49-E54 HydrophobicContact CB-CG 4.03Å; K49-E54 VanDerWaalsContact CD-OE1 3.27Å; K49-E54 WeakPolarHBondContact CD-OE1 3.42Å; G51-E54 PolarHBondContact O-N 3.01Å; G51-E54 VanDerWaalsContact O-N 3.1Å; E54-M57 HydrophobicContact CG-CE 4.44Å; E54-M57 PolarHBondContact O-N 3.48Å; E54-L58 PolarHBondContact O-N 2.81Å |
| 55 | E | 96.9 | Very high | 97.1 | Very high | 116 Ų | 116 | 107.7 Ų | 107.7 | 54% | 0.542 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -67.6 | -43.2 | 177 | -73.3 | 163.9 | -147.4 | 0 | 0 | 112 | G51 M57 L58 A59 | G51-E55 PolarHBondContact O-N 3.32Å; E55-M57 VanDerWaalsContact C-N 3.35Å; E55-M57 PolarHBondContact O-N 2.85Å; E55-L58 WeakPolarHBondContact O-CB 3.22Å; E55-L58 PolarHBondContact O-N 2.74Å; E55-L58 VanDerWaalsContact O-N 3.11Å; E55-A59 PolarHBondContact O-N 2.93Å |
| 56 | Y | 97.9 | Very high | 97.1 | Very high | 153 Ų | 153 | 106.4 Ų | 106.4 | 60% | 0.6 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -59.4 | -43.1 | 172.8 | 175.2 | -105.3 | 0 | 0 | 0 | 112.3 | E52 L58 A59 L60 | E52-Y56 VanDerWaalsContact O-CB 3.29Å; E52-Y56 WeakPolarHBondContact O-CB 3.34Å; E52-Y56 PolarHBondContact O-N 3.36Å; Y56-L58 VanDerWaalsContact C-N 3.29Å; Y56-L58 PolarHBondContact O-N 3Å; Y56-A59 PolarHBondContact O-N 2.97Å; Y56-L60 HydrophobicContact CE1-CD2 4.35Å; Y56-L60 WeakPolarHBondContact O-CB 3.46Å; Y56-L60 PolarHBondContact O-N 2.9Å |
| 57 | M | 97.9 | Very high | 97.1 | Very high | 116 Ų | 116 | 102.8 Ų | 102.8 | 57% | 0.571 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66 | -30.1 | 175.2 | -73.2 | -173.3 | -68.8 | 0 | 0 | 112.9 | G53 E54 E55 K61 | G53-M57 WeakPolarHBondContact O-CE 3.39Å; G53-M57 WeakPolarHBondContact O-CG 3.27Å; G53-M57 PolarHBondContact O-N 3.02Å; E54-M57 HydrophobicContact CG-CE 4.44Å; E54-M57 PolarHBondContact O-N 3.48Å; E55-M57 VanDerWaalsContact C-N 3.35Å; E55-M57 PolarHBondContact O-N 2.85Å; M57-K61 VanDerWaalsContact O-CB 3.28Å; M57-K61 WeakPolarHBondContact O-CB 3.36Å; M57-K61 PolarHBondContact O-N 3.18Å |
| 58 | L | 97.3 | Very high | 97 | Very high | 92 Ų | 92 | 103.1 Ų | 103.1 | 48% | 0.482 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -71.2 | -44.9 | 174.8 | 179.7 | 60.3 | 0 | 0 | 0 | 111.8 | E54 E55 Y56 K61 Q62 | E54-L58 PolarHBondContact O-N 2.81Å; E55-L58 WeakPolarHBondContact O-CB 3.22Å; E55-L58 PolarHBondContact O-N 2.74Å; E55-L58 VanDerWaalsContact O-N 3.11Å; Y56-L58 VanDerWaalsContact C-N 3.29Å; Y56-L58 PolarHBondContact O-N 3Å; L58-K61 WeakPolarHBondContact O-CB 3.29Å; L58-K61 PolarHBondContact O-N 3.14Å; L58-Q62 PolarHBondContact O-N 3.4Å; L58-Q62 VanDerWaalsContact O-N 3.14Å |
| 59 | A | 97.9 | Very high | 97 | Very high | 36 Ų | 36 | 101.6 Ų | 101.6 | 30% | 0.298 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.4 | -50.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | E55 Y56 K61 Q62 E63 | E55-A59 PolarHBondContact O-N 2.93Å; Y56-A59 PolarHBondContact O-N 2.97Å; A59-K61 PolarHBondContact O-N 2.95Å; A59-K61 VanDerWaalsContact O-N 3.17Å; A59-Q62 WeakPolarHBondContact O-CA 3.28Å; A59-Q62 WeakPolarHBondContact O-CB 3.38Å; A59-Q62 PolarHBondContact O-N 3.42Å; A59-E63 PolarHBondContact O-N 3.11Å |
| 60 | L | 98.1 | Very high | 96.8 | Very high | 59 Ų | 59 | 101.5 Ų | 101.5 | 31% | 0.309 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -58 | -33.5 | 176.4 | -176.5 | 62.6 | 0 | 0 | 0 | 112.2 | Y56 Q62 L64 | Y56-L60 HydrophobicContact CE1-CD2 4.35Å; Y56-L60 WeakPolarHBondContact O-CB 3.46Å; Y56-L60 PolarHBondContact O-N 2.9Å; L60-Q62 VanDerWaalsContact C-N 3.35Å; L60-L64 HydrophobicContact CD1-CD1 4.44Å; L60-L64 HydrophobicContact CD1-CG 4.34Å; L60-L64 HydrophobicContact CG-CD1 4.07Å; L60-L64 HydrophobicContact CG-CG 4.44Å; L60-L64 VanDerWaalsContact O-CB 3.28Å; L60-L64 WeakPolarHBondContact O-CB 3.42Å; L60-L64 WeakPolarHBondContact O-CD1 3.5Å; L60-L64 WeakPolarHBondContact O-CG 3.27Å; L60-L64 PolarHBondContact O-N 3.05Å |
| 61 | K | 98.1 | Very high | 96.8 | Very high | 128 Ų | 128 | 99 Ų | 99 | 56% | 0.557 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -71.6 | -23.4 | 173.8 | 177.6 | -172 | 171.5 | -165.4 | 0 | 113.3 | M57 L58 A59 R65 | M57-K61 VanDerWaalsContact O-CB 3.28Å; M57-K61 WeakPolarHBondContact O-CB 3.36Å; M57-K61 PolarHBondContact O-N 3.18Å; L58-K61 WeakPolarHBondContact O-CB 3.29Å; L58-K61 PolarHBondContact O-N 3.14Å; A59-K61 PolarHBondContact O-N 2.95Å; A59-K61 VanDerWaalsContact O-N 3.17Å; K61-R65 WeakPolarHBondContact O-CG 3.36Å; K61-R65 PolarHBondContact O-NE 3.18Å; K61-R65 VanDerWaalsContact O-NE 3.11Å |
| 62 | Q | 97.5 | Very high | 96.6 | Very high | 97 Ų | 97 | 100.5 Ų | 100.5 | 45% | 0.453 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -76.4 | -53.9 | 168.7 | -71.2 | 160.5 | -34.9 | 0 | 0 | 109.8 | L58 A59 L60 L64 R65 E66 | L58-Q62 PolarHBondContact O-N 3.4Å; L58-Q62 VanDerWaalsContact O-N 3.14Å; A59-Q62 WeakPolarHBondContact O-CA 3.28Å; A59-Q62 WeakPolarHBondContact O-CB 3.38Å; A59-Q62 PolarHBondContact O-N 3.42Å; L60-Q62 VanDerWaalsContact C-N 3.35Å; Q62-L64 VanDerWaalsContact C-N 3.32Å; Q62-L64 PolarHBondContact O-N 2.93Å; Q62-R65 VanDerWaalsContact CG-NH2 3.34Å; Q62-R65 WeakPolarHBondContact O-CB 3.19Å; Q62-R65 PolarHBondContact O-N 2.92Å; Q62-E66 PolarHBondContact O-N 3.46Å |
| 63 | E | 98 | Very high | 96.4 | Very high | 111 Ų | 111 | 99 Ų | 99 | 52% | 0.519 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -53.3 | -44.2 | 178.7 | -67.1 | 175.9 | 176.5 | 0 | 0 | 113 | A59 R65 E66 T67 | A59-E63 PolarHBondContact O-N 3.11Å; E63-R65 PolarHBondContact O-N 3.01Å; E63-E66 PolarHBondContact O-N 3.43Å; E63-T67 VanDerWaalsContact O-CB 3.31Å; E63-T67 WeakPolarHBondContact O-CB 3.39Å; E63-T67 PolarHBondContact O-N 3.42Å; E63-T67 PolarHBondContact O-OG1 2.93Å |
| 64 | L | 97.9 | Very high | 96.3 | Very high | 90 Ų | 90 | 101.6 Ų | 101.6 | 47% | 0.471 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.2 | -38.4 | 176.8 | -76.2 | 170 | 0 | 0 | 0 | 112.3 | L60 Q62 E66 T67 M68 | L60-L64 HydrophobicContact CD1-CD1 4.44Å; L60-L64 HydrophobicContact CD1-CG 4.34Å; L60-L64 HydrophobicContact CG-CD1 4.07Å; L60-L64 HydrophobicContact CG-CG 4.44Å; L60-L64 VanDerWaalsContact O-CB 3.28Å; L60-L64 WeakPolarHBondContact O-CB 3.42Å; L60-L64 WeakPolarHBondContact O-CD1 3.5Å; L60-L64 WeakPolarHBondContact O-CG 3.27Å; L60-L64 PolarHBondContact O-N 3.05Å; Q62-L64 VanDerWaalsContact C-N 3.32Å; Q62-L64 PolarHBondContact O-N 2.93Å; L64-E66 VanDerWaalsContact C-N 3.33Å; L64-E66 PolarHBondContact O-N 2.96Å; L64-T67 PolarHBondContact O-N 3.1Å; L64-M68 VanDerWaalsContact O-CB 3.27Å; L64-M68 WeakPolarHBondContact O-CB 3.21Å; L64-M68 WeakPolarHBondContact O-CG 3.42Å; L64-M68 PolarHBondContact O-N 3.47Å |
| 65 | R | 96.7 | Very high | 96.1 | Very high | 113 Ų | 113 | 105.4 Ų | 105.4 | 43% | 0.426 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65 | -36.6 | 177.5 | -80.1 | -175.4 | -71.1 | 155.1 | -1.5 | 111.9 | K61 Q62 E63 K69 | K61-R65 WeakPolarHBondContact O-CG 3.36Å; K61-R65 PolarHBondContact O-NE 3.18Å; K61-R65 VanDerWaalsContact O-NE 3.11Å; Q62-R65 VanDerWaalsContact CG-NH2 3.34Å; Q62-R65 WeakPolarHBondContact O-CB 3.19Å; Q62-R65 PolarHBondContact O-N 2.92Å; E63-R65 PolarHBondContact O-N 3.01Å; R65-K69 WeakPolarHBondContact O-CG 3.28Å |
| 66 | E | 95.8 | Very high | 95.9 | Very high | 95 Ų | 95 | 105 Ų | 105 | 44% | 0.444 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -74 | -48.3 | 174.3 | -56.5 | -175.4 | -175.2 | 0 | 0 | 112.3 | Q62 E63 L64 M68 K69 R70 | Q62-E66 PolarHBondContact O-N 3.46Å; E63-E66 PolarHBondContact O-N 3.43Å; L64-E66 VanDerWaalsContact C-N 3.33Å; L64-E66 PolarHBondContact O-N 2.96Å; E66-M68 VanDerWaalsContact C-N 3.3Å; E66-M68 PolarHBondContact O-N 3.26Å; E66-K69 WeakPolarHBondContact O-CB 3.4Å; E66-K69 PolarHBondContact O-N 3.14Å; E66-R70 PolarHBondContact O-N 3.11Å; E66-R70 VanDerWaalsContact O-N 3.11Å; E66-R70 IonicContact OE2-CZ 3.24Å; E66-R70 VanDerWaalsContact OE2-CZ 3.24Å; E66-R70 IonicContact OE2-NH1 2.86Å; E66-R70 PolarHBondContact OE2-NH1 3.17Å; E66-R70 IonicContact OE2-NH2 2.7Å; E66-R70 PolarHBondContact OE2-NH2 3.09Å |
| 67 | T | 97.2 | Very high | 95.6 | Very high | 59 Ų | 59 | 104.1 Ų | 104.1 | 36% | 0.362 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.2 | -43 | -176.3 | -55.6 | 0 | 0 | 0 | 0 | 110.4 | E63 L64 K69 R70 M71 | E63-T67 VanDerWaalsContact O-CB 3.31Å; E63-T67 WeakPolarHBondContact O-CB 3.39Å; E63-T67 PolarHBondContact O-N 3.42Å; E63-T67 PolarHBondContact O-OG1 2.93Å; L64-T67 PolarHBondContact O-N 3.1Å; T67-K69 VanDerWaalsContact C-N 3.33Å; T67-K69 PolarHBondContact O-N 2.86Å; T67-R70 PolarHBondContact O-N 3.26Å; T67-R70 VanDerWaalsContact O-N 3.15Å; T67-M71 HydrophobicContact CG2-CE 3.96Å; T67-M71 WeakPolarHBondContact O-CG 3.33Å; T67-M71 PolarHBondContact O-N 3.37Å |
| 68 | M | 95.9 | Very high | 95.2 | Very high | 121 Ų | 121 | 104.3 Ų | 104.3 | 60% | 0.596 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64 | -32.6 | 176.3 | -70.7 | -179.8 | 73.4 | 0 | 0 | 113.4 | L64 E66 F74 | L64-M68 VanDerWaalsContact O-CB 3.27Å; L64-M68 WeakPolarHBondContact O-CB 3.21Å; L64-M68 WeakPolarHBondContact O-CG 3.42Å; L64-M68 PolarHBondContact O-N 3.47Å; E66-M68 VanDerWaalsContact C-N 3.3Å; E66-M68 PolarHBondContact O-N 3.26Å; M68-F74 WeakPolarHBondContact O-CB 3.43Å |
| 69 | K | 94.6 | Very high | 94.6 | Very high | 132 Ų | 132 | 105.8 Ų | 105.8 | 57% | 0.574 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -67.3 | -36.9 | 172.7 | -71.1 | 169.6 | -179.5 | -179.3 | 0 | 112.1 | R65 E66 T67 F74 | R65-K69 WeakPolarHBondContact O-CG 3.28Å; E66-K69 WeakPolarHBondContact O-CB 3.4Å; E66-K69 PolarHBondContact O-N 3.14Å; T67-K69 VanDerWaalsContact C-N 3.33Å; T67-K69 PolarHBondContact O-N 2.86Å; K69-F74 HydrophobicContact CG-CE2 4.41Å; K69-F74 HydrophobicContact CG-CZ 4.49Å; K69-F74 WeakPolarHBondContact O-CB 3.42Å; K69-F74 WeakPolarHBondContact O-CD1 3.38Å |
| 70 | R | 92.9 | Very high | 93.8 | Very high | 164 Ų | 164 | 112.6 Ų | 112.6 | 62% | 0.619 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -72.3 | -31.5 | 178.7 | -64.4 | 174.4 | -174.5 | 119.1 | 6.3 | 112.4 | E66 T67 | E66-R70 PolarHBondContact O-N 3.11Å; E66-R70 VanDerWaalsContact O-N 3.11Å; E66-R70 IonicContact OE2-CZ 3.24Å; E66-R70 VanDerWaalsContact OE2-CZ 3.24Å; E66-R70 IonicContact OE2-NH1 2.86Å; E66-R70 PolarHBondContact OE2-NH1 3.17Å; E66-R70 IonicContact OE2-NH2 2.7Å; E66-R70 PolarHBondContact OE2-NH2 3.09Å; T67-R70 PolarHBondContact O-N 3.26Å; T67-R70 VanDerWaalsContact O-N 3.15Å |
| 71 | M | 93.4 | Very high | 92.8 | Very high | 79 Ų | 79 | 121.2 Ų | 121.2 | 39% | 0.389 | 57% | 0.571 | S | S | . | * | S | Bend | trans | -60 | 149.9 | -179.4 | -75.1 | -174.1 | -177.6 | 0 | 0 | 113.5 | T67 Y73 F74 | T67-M71 HydrophobicContact CG2-CE 3.96Å; T67-M71 WeakPolarHBondContact O-CG 3.33Å; T67-M71 PolarHBondContact O-N 3.37Å; M71-Y73 HydrophobicContact CB-CD2 3.95Å; M71-Y73 HydrophobicContact CG-CD2 4.44Å; M71-Y73 PolarHBondContact O-N 3.16Å; M71-Y73 VanDerWaalsContact O-N 3.09Å; M71-Y73 HydrophobicContact SD-CD2 3.85Å; M71-Y73 HydrophobicContact SD-CE2 4.15Å; M71-F74 PolarHBondContact O-N 3.06Å |
| 72 | P | 93.9 | Very high | 92 | Very high | 56 Ų | 56 | 120.4 Ų | 120.4 | 36% | 0.364 | 57% | 0.569 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -58 | -21 | 173.7 | -27.5 | 36.4 | 0 | 0 | 0 | 115.1 | F74 W99 | P72-F74 PolarHBondContact O-N 3.04Å; P72-W99 HydrophobicContact CB-CB 3.82Å |
| 73 | Y | 92.6 | Very high | 91.3 | Very high | 144 Ų | 144 | 123.7 Ų | 123.7 | 57% | 0.565 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.1 | -16.1 | 176.2 | -48.8 | -65 | 0 | 0 | 0 | 113.5 | M71 I75 W99 | M71-Y73 HydrophobicContact CB-CD2 3.95Å; M71-Y73 HydrophobicContact CG-CD2 4.44Å; M71-Y73 PolarHBondContact O-N 3.16Å; M71-Y73 VanDerWaalsContact O-N 3.09Å; M71-Y73 HydrophobicContact SD-CD2 3.85Å; M71-Y73 HydrophobicContact SD-CE2 4.15Å; Y73-I75 PolarHBondContact O-N 3.39Å; Y73-I75 VanDerWaalsContact O-N 3.16Å; Y73-W99 HydrophobicContact CD1-CD2 4.25Å; Y73-W99 HydrophobicContact CD1-CE3 4.05Å; Y73-W99 HydrophobicContact CD1-CZ3 4.35Å; Y73-W99 AromaticContact CE1-CD2 3.59Å; Y73-W99 HydrophobicContact CE1-CD2 3.59Å; Y73-W99 AromaticContact CE1-CE2 3.76Å; Y73-W99 AromaticContact CE1-CE3 3.82Å; Y73-W99 HydrophobicContact CE1-CE3 3.82Å; Y73-W99 AromaticContact CE1-CG 3.98Å; Y73-W99 HydrophobicContact CE1-CG 3.98Å; Y73-W99 HydrophobicContact CE1-CH2 4.32Å; Y73-W99 HydrophobicContact CE1-CZ2 4.14Å; Y73-W99 HydrophobicContact CE1-CZ3 4.16Å |
| 74 | F | 94.8 | Very high | 90.8 | Very high | 97 Ų | 97 | 123.4 Ų | 123.4 | 43% | 0.425 | 59% | 0.591 | S | S | . | * | trans | -80.4 | 93.5 | 171.3 | -171.3 | -106.6 | 0 | 0 | 0 | 109.8 | M68 K69 M71 P72 E76 K96 | M68-F74 WeakPolarHBondContact O-CB 3.43Å; K69-F74 HydrophobicContact CG-CE2 4.41Å; K69-F74 HydrophobicContact CG-CZ 4.49Å; K69-F74 WeakPolarHBondContact O-CB 3.42Å; K69-F74 WeakPolarHBondContact O-CD1 3.38Å; M71-F74 PolarHBondContact O-N 3.06Å; P72-F74 PolarHBondContact O-N 3.04Å; F74-E76 HydrophobicContact CD1-CG 3.79Å; F74-E76 HydrophobicContact CE1-CG 3.72Å; F74-E76 PolarHBondContact O-N 3.35Å; F74-K96 PolarHBondContact O-NZ 2.97Å; F74-K96 VanDerWaalsContact O-NZ 3.11Å | ||
| 75 | I | 92.6 | Very high | 90.2 | Very high | 156 Ų | 156 | 128.5 Ų | 128.5 | 80% | 0.8 | 61% | 0.612 | S | S | * | * | trans | -75.7 | 103.6 | 175.4 | -56.2 | 175.1 | 0 | 0 | 0 | 108.2 | Y73 | Y73-I75 PolarHBondContact O-N 3.39Å; Y73-I75 VanDerWaalsContact O-N 3.16Å | ||
| 76 | E | 91.8 | Very high | 89.9 | Confident | 106 Ų | 106 | 131.1 Ų | 131.1 | 50% | 0.495 | 62% | 0.622 | S | S | . | * | P | Polyproline II helix | trans | -69.5 | 151.7 | 174.1 | -72.8 | 154.9 | -133.5 | 0 | 0 | 111.6 | F74 K96 | F74-E76 HydrophobicContact CD1-CG 3.79Å; F74-E76 HydrophobicContact CE1-CG 3.72Å; F74-E76 PolarHBondContact O-N 3.35Å; E76-K96 IonicContact OE1-NZ 2.67Å; E76-K96 PolarHBondContact OE1-NZ 3.04Å |
| 77 | T | 92.9 | Very high | 89.7 | Confident | 135 Ų | 135 | 133.9 Ų | 133.9 | 83% | 0.828 | 63% | 0.629 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 125.5 | 170.4 | 46.7 | 0 | 0 | 0 | 0 | 109.6 | ||
| 78 | P | 88.4 | Confident | 89.2 | Confident | 120 Ų | 120 | 133.5 Ų | 133.5 | 78% | 0.779 | 63% | 0.629 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 141.8 | -177.2 | 26.8 | -34.8 | 0 | 0 | 0 | 111.3 | E80 | P78-E80 PolarHBondContact O-N 3.11Š|
| 79 | E | 84.6 | Confident | 88.8 | Confident | 123 Ų | 123 | 131 Ų | 131 | 58% | 0.575 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -57 | 135.4 | 176 | 59.1 | 166.2 | -170.3 | 0 | 0 | 111.3 | Q82 K89 | E79-Q82 PolarHBondContact OE2-NE2 2.91Å; E79-K89 IonicContact OE1-NZ 2.7Å; E79-K89 PolarHBondContact OE1-NZ 3.26Å; E79-K89 IonicContact OE2-NZ 2.97Å; E79-K89 PolarHBondContact OE2-NZ 2.86Å |
| 80 | E | 82.5 | Confident | 88.4 | Confident | 179 Ų | 179 | 132.2 Ų | 132.2 | 84% | 0.836 | 62% | 0.616 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 163.1 | 165.7 | -63.6 | -158.9 | 155.7 | 0 | 0 | 110.2 | P78 Q82 | P78-E80 PolarHBondContact O-N 3.11Å; E80-Q82 PolarHBondContact O-N 3.43Å; E80-Q82 VanDerWaalsContact O-N 3.07Å |
| 81 | R | 77.6 | Confident | 88 | Confident | 240 Ų | 240 | 132.4 Ų | 132.4 | 91% | 0.906 | 62% | 0.618 | S | S | * | * | trans | -73.8 | 108.2 | -177.1 | -66.4 | -169.4 | -174.6 | -174.7 | 6.2 | 110.1 | D83 | R81-D83 PolarHBondContact O-N 2.81Š| ||
| 82 | Q | 80.6 | Confident | 87.7 | Confident | 112 Ų | 112 | 135.9 Ų | 135.9 | 52% | 0.523 | 64% | 0.635 | S | S | . | * | trans | -53.9 | 132.6 | 168.1 | -64.6 | 166 | -7.5 | 0 | 0 | 110.3 | E79 E80 I84 K89 | E79-Q82 PolarHBondContact OE2-NE2 2.91Å; E80-Q82 PolarHBondContact O-N 3.43Å; E80-Q82 VanDerWaalsContact O-N 3.07Å; Q82-I84 PolarHBondContact O-N 3.15Å; Q82-K89 VanDerWaalsContact CD-NZ 3.26Å | ||
| 83 | D | 81.9 | Confident | 87.3 | Confident | 166 Ų | 166 | 138.3 Ų | 138.3 | 89% | 0.888 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -66.6 | -22.3 | -173.5 | -56.5 | -58.9 | 0 | 0 | 0 | 114.2 | R81 | R81-D83 PolarHBondContact O-N 2.81Š|
| 84 | I | 87.4 | Confident | 86.9 | Confident | 105 Ų | 105 | 136.9 Ų | 136.9 | 54% | 0.538 | 65% | 0.646 | S | S | . | * | S | Bend | trans | -132.2 | 121.4 | -173.2 | -56.3 | 176.4 | 0 | 0 | 0 | 109.3 | Q82 R86 | Q82-I84 PolarHBondContact O-N 3.15Å; I84-R86 HydrophobicContact CG2-CG 4.09Å |
| 85 | E | 87.2 | Confident | 86.4 | Confident | 197 Ų | 197 | 141.7 Ų | 141.7 | 92% | 0.921 | 66% | 0.662 | S | S | * | * | trans | -73.3 | 127.4 | 169.8 | -62.2 | -171.7 | 172.7 | 0 | 0 | 110 | ||||
| 86 | R | 90.2 | Very high | 86.1 | Confident | 168 Ų | 168 | 138.5 Ų | 138.5 | 63% | 0.634 | 64% | 0.643 | S | S | * | * | trans | -126.4 | 143.2 | -178 | -61.8 | -172.5 | -177.2 | -149.4 | 1.6 | 111.4 | I84 S88 K89 | I84-R86 HydrophobicContact CG2-CG 4.09Å; R86-S88 PolarHBondContact O-N 3.05Å; R86-K89 VanDerWaalsContact O-CB 3.25Å; R86-K89 WeakPolarHBondContact O-CB 3.35Å; R86-K89 PolarHBondContact O-N 2.89Å | ||
| 87 | Y | 90.3 | Very high | 85.9 | Confident | 152 Ų | 152 | 141.5 Ų | 141.5 | 60% | 0.596 | 66% | 0.657 | S | S | * | * | G | 310 helix | trans | -56 | -35.4 | 178.2 | -177.3 | -99.7 | 0 | 0 | 0 | 113.3 | K89 R90 Y91 | Y87-K89 PolarHBondContact O-N 2.75Å; Y87-K89 VanDerWaalsContact O-N 3.12Å; Y87-R90 VanDerWaalsContact CZ-NH2 3.34Å; Y87-R90 WeakPolarHBondContact O-CG 3.39Å; Y87-R90 PolarHBondContact O-N 3.32Å; Y87-R90 VanDerWaalsContact O-N 3.14Å; Y87-R90 PolarHBondContact OH-NH2 2.86Å; Y87-Y91 HydrophobicContact CD1-CE2 4.23Å; Y87-Y91 AromaticContact CE1-CE2 3.71Å; Y87-Y91 HydrophobicContact CE1-CE2 3.71Å; Y87-Y91 PolarHBondContact OH-OH 3.03Å |
| 88 | S | 87.6 | Confident | 85.8 | Confident | 51 Ų | 51 | 143 Ų | 143 | 36% | 0.357 | 65% | 0.654 | S | S | . | * | G | 310 helix | trans | -57.9 | -23 | 175.7 | 54.6 | 0 | 0 | 0 | 0 | 114.2 | R86 R90 Y91 M92 | R86-S88 PolarHBondContact O-N 3.05Å; S88-R90 PolarHBondContact O-N 3.47Å; S88-R90 VanDerWaalsContact O-N 3.1Å; S88-Y91 PolarHBondContact O-N 2.95Å; S88-M92 PolarHBondContact O-N 3.15Å |
| 89 | K | 87.4 | Confident | 86 | Confident | 69 Ų | 69 | 143.8 Ų | 143.8 | 30% | 0.3 | 64% | 0.642 | S | S | . | * | G | 310 helix | trans | -62.9 | -15.6 | 176.7 | -171.8 | 153.6 | -177.9 | 146 | 0 | 113.5 | E79 Q82 R86 Y87 | E79-K89 IonicContact OE1-NZ 2.7Å; E79-K89 PolarHBondContact OE1-NZ 3.26Å; E79-K89 IonicContact OE2-NZ 2.97Å; E79-K89 PolarHBondContact OE2-NZ 2.86Å; Q82-K89 VanDerWaalsContact CD-NZ 3.26Å; R86-K89 VanDerWaalsContact O-CB 3.25Å; R86-K89 WeakPolarHBondContact O-CB 3.35Å; R86-K89 PolarHBondContact O-N 2.89Å; Y87-K89 PolarHBondContact O-N 2.75Å; Y87-K89 VanDerWaalsContact O-N 3.12Å |
| 90 | R | 85.3 | Confident | 86.4 | Confident | 158 Ų | 158 | 144.1 Ų | 144.1 | 60% | 0.596 | 65% | 0.646 | S | S | * | * | G | 310 helix | trans | -69.9 | -34.1 | 171.1 | -57.6 | -152.7 | -61.2 | 177.2 | 5.7 | 112.7 | Y87 S88 | Y87-R90 VanDerWaalsContact CZ-NH2 3.34Å; Y87-R90 WeakPolarHBondContact O-CG 3.39Å; Y87-R90 PolarHBondContact O-N 3.32Å; Y87-R90 VanDerWaalsContact O-N 3.14Å; Y87-R90 PolarHBondContact OH-NH2 2.86Å; S88-R90 PolarHBondContact O-N 3.47Å; S88-R90 VanDerWaalsContact O-N 3.1Å |
| 91 | Y | 86.1 | Confident | 87 | Confident | 167 Ų | 167 | 136.8 Ų | 136.8 | 66% | 0.655 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.8 | -35 | -179.1 | -54.1 | -77.9 | 0 | 0 | 0 | 112.2 | Y87 S88 K93 | Y87-Y91 HydrophobicContact CD1-CE2 4.23Å; Y87-Y91 AromaticContact CE1-CE2 3.71Å; Y87-Y91 HydrophobicContact CE1-CE2 3.71Å; Y87-Y91 PolarHBondContact OH-OH 3.03Å; S88-Y91 PolarHBondContact O-N 2.95Å; Y91-K93 PolarHBondContact O-N 3.11Å |
| 92 | M | 85.4 | Confident | 87.8 | Confident | 152 Ų | 152 | 128.7 Ų | 128.7 | 75% | 0.749 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -75.1 | 18 | 174.7 | -66.5 | 177.1 | 165.1 | 0 | 0 | 113.7 | S88 V94 | S88-M92 PolarHBondContact O-N 3.15Å; M92-V94 PolarHBondContact O-N 3.2Å |
| 93 | K | 85.5 | Confident | 88.4 | Confident | 108 Ų | 108 | 127.4 Ų | 127.4 | 47% | 0.47 | 58% | 0.579 | S | S | . | * | trans | -84.1 | 103.1 | -178.6 | -174.4 | 57.5 | -178.8 | 165 | 0 | 110 | Y91 Y95 | Y91-K93 PolarHBondContact O-N 3.11Å; K93-Y95 HydrophobicContact CB-CE2 4.16Å; K93-Y95 HydrophobicContact CG-CE1 4.18Å; K93-Y95 HydrophobicContact CG-CE2 4.26Å; K93-Y95 WeakPolarHBondContact O-CD2 3.31Å; K93-Y95 WeakPolarHBondContact O-CE2 3.34Å; K93-Y95 PolarHBondContact O-N 2.67Å | ||
| 94 | V | 85.8 | Confident | 89.1 | Confident | 113 Ų | 113 | 130.9 Ų | 130.9 | 69% | 0.685 | 58% | 0.58 | S | S | * | * | trans | -62.2 | 122.6 | 169.8 | -176.7 | 0 | 0 | 0 | 0 | 109.4 | M92 | M92-V94 PolarHBondContact O-N 3.2Š| ||
| 95 | Y | 83.2 | Confident | 89.5 | Confident | 199 Ų | 199 | 136 Ų | 136 | 78% | 0.78 | 59% | 0.592 | S | S | * | * | trans | -100.6 | 121.7 | 171.4 | -62.8 | -83.8 | 0 | 0 | 0 | 108.7 | K93 | K93-Y95 HydrophobicContact CB-CE2 4.16Å; K93-Y95 HydrophobicContact CG-CE1 4.18Å; K93-Y95 HydrophobicContact CG-CE2 4.26Å; K93-Y95 WeakPolarHBondContact O-CD2 3.31Å; K93-Y95 WeakPolarHBondContact O-CE2 3.34Å; K93-Y95 PolarHBondContact O-N 2.67Å | ||
| 96 | K | 87.1 | Confident | 89.9 | Confident | 88 Ų | 88 | 129.2 Ų | 129.2 | 38% | 0.383 | 56% | 0.562 | S | S | . | * | trans | -130.6 | 135.3 | 175.9 | -163.6 | 176.6 | -170.8 | 179.7 | 0 | 107.7 | F74 E76 | F74-K96 PolarHBondContact O-NZ 2.97Å; F74-K96 VanDerWaalsContact O-NZ 3.11Å; E76-K96 IonicContact OE1-NZ 2.67Å; E76-K96 PolarHBondContact OE1-NZ 3.04Å | ||
| 97 | E | 87.6 | Confident | 90.2 | Very high | 169 Ų | 169 | 124.7 Ų | 124.7 | 79% | 0.79 | 56% | 0.555 | S | S | * | * | trans | -72.1 | 131.8 | -179.4 | -171.5 | 175.1 | -163.4 | 0 | 0 | 110.8 | ||||
| 98 | E | 89.6 | Confident | 90.3 | Very high | 166 Ų | 166 | 127 Ų | 127 | 78% | 0.776 | 56% | 0.562 | S | S | * | * | trans | -92.2 | 114.1 | -177.7 | -171.6 | 173.9 | -172.3 | 0 | 0 | 110.9 | ||||
| 99 | W | 93.3 | Very high | 90.6 | Very high | 137 Ų | 137 | 133.5 Ų | 133.5 | 52% | 0.519 | 59% | 0.587 | S | S | . | * | P | Polyproline II helix | trans | -74.4 | 127.6 | 177.7 | 170.1 | 76.8 | 0 | 0 | 0 | 111.9 | P72 Y73 P101 | P72-W99 HydrophobicContact CB-CB 3.82Å; Y73-W99 HydrophobicContact CD1-CD2 4.25Å; Y73-W99 HydrophobicContact CD1-CE3 4.05Å; Y73-W99 HydrophobicContact CD1-CZ3 4.35Å; Y73-W99 AromaticContact CE1-CD2 3.59Å; Y73-W99 HydrophobicContact CE1-CD2 3.59Å; Y73-W99 AromaticContact CE1-CE2 3.76Å; Y73-W99 AromaticContact CE1-CE3 3.82Å; Y73-W99 HydrophobicContact CE1-CE3 3.82Å; Y73-W99 AromaticContact CE1-CG 3.98Å; Y73-W99 HydrophobicContact CE1-CG 3.98Å; Y73-W99 HydrophobicContact CE1-CH2 4.32Å; Y73-W99 HydrophobicContact CE1-CZ2 4.14Å; Y73-W99 HydrophobicContact CE1-CZ3 4.16Å; W99-P101 HydrophobicContact CE3-CG 4.18Å; W99-P101 HydrophobicContact CH2-CB 3.99Å; W99-P101 HydrophobicContact CH2-CG 3.94Å; W99-P101 HydrophobicContact CZ2-CB 4.43Å; W99-P101 HydrophobicContact CZ3-CB 4.29Å; W99-P101 HydrophobicContact CZ3-CG 3.71Å |
| 100 | I | 93.1 | Very high | 90.8 | Very high | 130 Ų | 130 | 136 Ų | 136 | 67% | 0.667 | 60% | 0.601 | S | S | * | * | P | Polyproline II helix | trans | -101.2 | 119.4 | -177.4 | -53.3 | 179.4 | 0 | 0 | 0 | 110.7 | ||
| 101 | P | 94.5 | Very high | 91 | Very high | 25 Ų | 25 | 132 Ų | 132 | 16% | 0.162 | 59% | 0.59 | C | S | . | * | P | Polyproline II helix | trans | -68.7 | 157.8 | 177.2 | -18.9 | 30.3 | 0 | 0 | 0 | 114.8 | W99 W103 L106 | W99-P101 HydrophobicContact CE3-CG 4.18Å; W99-P101 HydrophobicContact CH2-CB 3.99Å; W99-P101 HydrophobicContact CH2-CG 3.94Å; W99-P101 HydrophobicContact CZ2-CB 4.43Å; W99-P101 HydrophobicContact CZ3-CB 4.29Å; W99-P101 HydrophobicContact CZ3-CG 3.71Å; P101-W103 HydrophobicContact CB-CH2 4.5Å; P101-W103 HydrophobicContact CB-CZ2 4.28Å; P101-W103 HydrophobicContact CG-CH2 4.09Å; P101-W103 HydrophobicContact CG-CZ2 3.84Å; P101-W103 VanDerWaalsContact O-CD1 3.29Å; P101-W103 PolarHBondContact O-N 3.47Å; P101-W103 PolarHBondContact O-NE1 3.34Å; P101-L106 HydrophobicContact CB-CD1 4.11Å; P101-L106 HydrophobicContact CB-CD2 3.82Å; P101-L106 HydrophobicContact CG-CD2 4.23Å |
| 102 | D | 94.9 | Very high | 91.2 | Very high | 70 Ų | 70 | 128.7 Ų | 128.7 | 37% | 0.374 | 59% | 0.589 | S | S | . | * | trans | -72.5 | 92.8 | 166.5 | 179.6 | 8.6 | 0 | 0 | 0 | 111.1 | R104 R105 L106 | D102-R104 PolarHBondContact O-N 2.97Å; D102-R104 WeakPolarHBondContact OD1-CB 3.43Å; D102-R104 WeakPolarHBondContact OD1-CG 3.39Å; D102-R104 PolarHBondContact OD1-N 3.07Å; D102-R105 HydrophobicContact CB-CG 4.45Å; D102-R105 PolarHBondContact O-N 3.02Å; D102-R105 WeakPolarHBondContact OD2-CD 3.06Å; D102-R105 WeakPolarHBondContact OD2-CG 3.19Å; D102-R105 IonicContact OD2-CZ 3.99Å; D102-R105 IonicContact OD2-NE 2.92Å; D102-R105 PolarHBondContact OD2-NE 2.86Å; D102-L106 PolarHBondContact O-N 2.7Å | ||
| 103 | W | 94.2 | Very high | 91.2 | Very high | 85 Ų | 85 | 131.3 Ų | 131.3 | 32% | 0.322 | 59% | 0.591 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64 | -0.5 | 176.8 | -60.1 | 112 | 0 | 0 | 0 | 115.2 | P101 L106 M110 M111 P112 | P101-W103 HydrophobicContact CB-CH2 4.5Å; P101-W103 HydrophobicContact CB-CZ2 4.28Å; P101-W103 HydrophobicContact CG-CH2 4.09Å; P101-W103 HydrophobicContact CG-CZ2 3.84Å; P101-W103 VanDerWaalsContact O-CD1 3.29Å; P101-W103 PolarHBondContact O-N 3.47Å; P101-W103 PolarHBondContact O-NE1 3.34Å; W103-L106 HydrophobicContact CE3-CB 3.81Å; W103-L106 HydrophobicContact CE3-CD2 4.21Å; W103-L106 HydrophobicContact CH2-CD2 4.21Å; W103-L106 HydrophobicContact CZ3-CB 3.97Å; W103-L106 HydrophobicContact CZ3-CD2 3.7Å; W103-L106 HydrophobicContact CZ3-CG 4.5Å; W103-M110 HydrophobicContact CZ3-CB 4.11Å; W103-M111 HydrophobicContact CD2-CG 3.61Å; W103-M111 HydrophobicContact CD2-SD 4.37Å; W103-M111 HydrophobicContact CE3-CB 4.45Å; W103-M111 HydrophobicContact CE3-CG 3.4Å; W103-M111 VanDerWaalsContact CE3-CG 3.4Å; W103-M111 HydrophobicContact CG-CG 4.18Å; W103-M111 HydrophobicContact CG-SD 4.33Å; W103-M111 HydrophobicContact CH2-CG 4.34Å; W103-M111 HydrophobicContact CZ2-CG 4.48Å; W103-M111 HydrophobicContact CZ3-CB 4.4Å; W103-M111 HydrophobicContact CZ3-CG 3.81Å; W103-P112 HydrophobicContact CZ2-CG 4.39Å |
| 104 | R | 95.4 | Very high | 90.6 | Very high | 240 Ų | 240 | 133.4 Ų | 133.4 | 91% | 0.906 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.1 | -20.9 | 166.7 | -55.7 | -179.6 | 176.5 | -152.6 | -0.4 | 112.4 | D102 | D102-R104 PolarHBondContact O-N 2.97Å; D102-R104 WeakPolarHBondContact OD1-CB 3.43Å; D102-R104 WeakPolarHBondContact OD1-CG 3.39Å; D102-R104 PolarHBondContact OD1-N 3.07Å |
| 105 | R | 95.9 | Very high | 89.4 | Confident | 211 Ų | 211 | 137.1 Ų | 137.1 | 80% | 0.796 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.4 | -35.2 | 178.8 | -62.2 | 174.9 | -169 | -131.6 | -1.8 | 112.6 | D102 | D102-R105 HydrophobicContact CB-CG 4.45Å; D102-R105 PolarHBondContact O-N 3.02Å; D102-R105 WeakPolarHBondContact OD2-CD 3.06Å; D102-R105 WeakPolarHBondContact OD2-CG 3.19Å; D102-R105 IonicContact OD2-CZ 3.99Å; D102-R105 IonicContact OD2-NE 2.92Å; D102-R105 PolarHBondContact OD2-NE 2.86Å |
| 106 | L | 95.4 | Very high | 87.8 | Confident | 56 Ų | 56 | 133.1 Ų | 133.1 | 29% | 0.293 | 61% | 0.613 | S | S | . | * | S | Bend | trans | -82.3 | 146.8 | 179.9 | -81.7 | 73.1 | 0 | 0 | 0 | 111.5 | P101 D102 W103 M110 | P101-L106 HydrophobicContact CB-CD1 4.11Å; P101-L106 HydrophobicContact CB-CD2 3.82Å; P101-L106 HydrophobicContact CG-CD2 4.23Å; D102-L106 PolarHBondContact O-N 2.7Å; W103-L106 HydrophobicContact CE3-CB 3.81Å; W103-L106 HydrophobicContact CE3-CD2 4.21Å; W103-L106 HydrophobicContact CH2-CD2 4.21Å; W103-L106 HydrophobicContact CZ3-CB 3.97Å; W103-L106 HydrophobicContact CZ3-CD2 3.7Å; W103-L106 HydrophobicContact CZ3-CG 4.5Å; L106-M110 HydrophobicContact CD2-CE 4.32Å |
| 107 | P | 96.4 | Very high | 86.3 | Confident | 73 Ų | 73 | 138.6 Ų | 138.6 | 47% | 0.474 | 64% | 0.637 | S | S | . | * | trans | -67 | 143.8 | 176.8 | 28.4 | -34.7 | 0 | 0 | 0 | 111.6 | E109 M110 | P107-E109 PolarHBondContact O-N 2.7Å; P107-M110 HydrophobicContact CG-CG 3.96Å; P107-M110 HydrophobicContact CG-SD 3.76Å; P107-M110 PolarHBondContact O-N 3.27Å | ||
| 108 | R | 92.8 | Very high | 84.5 | Confident | 201 Ų | 201 | 140.1 Ų | 140.1 | 76% | 0.758 | 64% | 0.641 | S | S | * | * | G | 310 helix | trans | -55.6 | -19.5 | -178.4 | 177.3 | 157.8 | -161.3 | -158.7 | 4.9 | 114.8 | M111 | R108-M111 HydrophobicContact CB-CE 4.28Å; R108-M111 HydrophobicContact CG-CE 3.64Å |
| 109 | E | 93.1 | Very high | 82.7 | Confident | 187 Ų | 187 | 136.5 Ų | 136.5 | 87% | 0.874 | 64% | 0.64 | S | S | * | * | G | 310 helix | trans | -74.5 | -27.1 | 179 | -64.3 | 175.8 | -171.8 | 0 | 0 | 113.1 | P107 | P107-E109 PolarHBondContact O-N 2.7Š|
| 110 | M | 91.8 | Very high | 80.9 | Confident | 122 Ų | 122 | 132.6 Ų | 132.6 | 60% | 0.601 | 64% | 0.642 | S | S | * | * | G | 310 helix | trans | -82.2 | -9 | 179.7 | -70.6 | 179.5 | 72.1 | 0 | 0 | 114.1 | W103 L106 P107 P112 | W103-M110 HydrophobicContact CZ3-CB 4.11Å; L106-M110 HydrophobicContact CD2-CE 4.32Å; P107-M110 HydrophobicContact CG-CG 3.96Å; P107-M110 HydrophobicContact CG-SD 3.76Å; P107-M110 PolarHBondContact O-N 3.27Å; M110-P112 WeakPolarHBondContact O-CD 3.25Å |
| 111 | M | 90.8 | Very high | 79.1 | Confident | 74 Ų | 74 | 132.6 Ų | 132.6 | 37% | 0.365 | 65% | 0.651 | S | S | . | * | S | Bend | trans | -62.6 | 126.1 | -179.4 | -83.4 | -164.2 | -74.9 | 0 | 0 | 111.5 | W103 R108 R113 | W103-M111 HydrophobicContact CD2-CG 3.61Å; W103-M111 HydrophobicContact CD2-SD 4.37Å; W103-M111 HydrophobicContact CE3-CB 4.45Å; W103-M111 HydrophobicContact CE3-CG 3.4Å; W103-M111 VanDerWaalsContact CE3-CG 3.4Å; W103-M111 HydrophobicContact CG-CG 4.18Å; W103-M111 HydrophobicContact CG-SD 4.33Å; W103-M111 HydrophobicContact CH2-CG 4.34Å; W103-M111 HydrophobicContact CZ2-CG 4.48Å; W103-M111 HydrophobicContact CZ3-CB 4.4Å; W103-M111 HydrophobicContact CZ3-CG 3.81Å; R108-M111 HydrophobicContact CB-CE 4.28Å; R108-M111 HydrophobicContact CG-CE 3.64Å; M111-R113 PolarHBondContact O-N 2.97Å |
| 112 | P | 90.4 | Very high | 77.5 | Confident | 97 Ų | 97 | 140.2 Ų | 140.2 | 63% | 0.63 | 68% | 0.681 | S | S | * | * | trans | -54.5 | 101.2 | 172.8 | -28.1 | 36.2 | 0 | 0 | 0 | 111.4 | W103 M110 N114 | W103-P112 HydrophobicContact CZ2-CG 4.39Å; M110-P112 WeakPolarHBondContact O-CD 3.25Å; P112-N114 PolarHBondContact O-N 3.17Å | ||
| 113 | R | 85.6 | Confident | 75.7 | Confident | 207 Ų | 207 | 142.6 Ų | 142.6 | 78% | 0.781 | 70% | 0.7 | S | S | * | * | trans | -77.4 | 106.6 | 172 | -73.2 | -172.4 | 176.8 | -164.5 | 0.7 | 108 | M111 K115 | M111-R113 PolarHBondContact O-N 2.97Å; R113-K115 PolarHBondContact O-N 3.43Å | ||
| 114 | N | 71.2 | Confident | 73.8 | Confident | 151 Ų | 151 | 148.4 Ų | 148.4 | 81% | 0.807 | 73% | 0.728 | S | S | * | * | trans | -51.9 | 95 | 158.4 | -78.3 | -16.1 | 0 | 0 | 0 | 108.4 | P112 C116 | P112-N114 PolarHBondContact O-N 3.17Å; N114-C116 PolarHBondContact O-N 3.24Å | ||
| 115 | K | 61.3 | Low | 71.5 | Confident | 192 Ų | 192 | 146.7 Ų | 146.7 | 84% | 0.835 | 73% | 0.727 | S | S | * | * | trans | -66.2 | 88.9 | 167.9 | -72.2 | 176.7 | -177 | 171.2 | 0 | 105.2 | R113 K117 | R113-K115 PolarHBondContact O-N 3.43Å; K115-K117 PolarHBondContact O-N 3.02Å | ||
| 116 | C | 49 | Very low | 69.3 | Low | 114 Ų | 114 | 141 Ų | 141 | 77% | 0.77 | 73% | 0.725 | S | S | * | * | trans | -46.5 | 111.7 | 164.7 | -63.5 | 0 | 0 | 0 | 0 | 105.9 | N114 K118 | N114-C116 PolarHBondContact O-N 3.24Å; C116-K118 VanDerWaalsContact C-N 3.33Å; C116-K118 PolarHBondContact O-N 3.28Å | ||
| 117 | K | 56 | Low | 67 | Low | 204 Ų | 204 | 148 Ų | 148 | 89% | 0.887 | 75% | 0.753 | S | S | * | * | trans | -53.5 | 107.1 | 172.4 | -66.3 | 177 | -177.5 | 175 | 0 | 104 | K115 A119 | K115-K117 PolarHBondContact O-N 3.02Å; K117-A119 PolarHBondContact O-N 3.14Å | ||
| 118 | K | 50.6 | Low | 64.5 | Low | 201 Ų | 201 | 152.1 Ų | 152.1 | 87% | 0.874 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 116.6 | 179.8 | -81.1 | -172.1 | 176.1 | -178 | 0 | 104.7 | C116 G120 | C116-K118 VanDerWaalsContact C-N 3.33Å; C116-K118 PolarHBondContact O-N 3.28Å; K118-G120 PolarHBondContact O-N 3.1Å; K118-G120 VanDerWaalsContact O-N 3.15Å |
| 119 | A | 52 | Low | 62.2 | Low | 90 Ų | 90 | 147.5 Ų | 147.5 | 74% | 0.744 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -48.8 | 129.1 | -176.7 | 0 | 0 | 0 | 0 | 0 | 107.5 | K117 | K117-A119 PolarHBondContact O-N 3.14Š|
| 120 | G | 54.2 | Low | 59.7 | Low | 54 Ų | 54 | 142 Ų | 142 | 56% | 0.557 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 145.3 | -175.4 | 0 | 0 | 0 | 0 | 0 | 110 | K118 K122 | K118-G120 PolarHBondContact O-N 3.1Å; K118-G120 VanDerWaalsContact O-N 3.15Å; G120-K122 PolarHBondContact O-N 3.02Å |
| 121 | P | 55.2 | Low | 57.8 | Low | 131 Ų | 131 | 145.5 Ų | 145.5 | 85% | 0.851 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -47.2 | 112.4 | -169.5 | 20.1 | -33.3 | 0 | 0 | 0 | 109.4 | ||
| 122 | K | 62.1 | Low | 55.6 | Low | 185 Ų | 185 | 145.6 Ų | 145.6 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | trans | -45.6 | 126.5 | -165.9 | -72.1 | -175.4 | 176.8 | -176.8 | 0 | 108.8 | G120 K124 | G120-K122 PolarHBondContact O-N 3.02Å; K122-K124 PolarHBondContact O-N 3.01Å | ||
| 123 | P | 55.5 | Low | 53.8 | Low | 120 Ų | 120 | 145.5 Ų | 145.5 | 78% | 0.779 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 123.9 | -177.7 | 21.1 | -32.2 | 0 | 0 | 0 | 107.9 | K125 | P123-K125 PolarHBondContact O-N 3.12Š|
| 124 | K | 54.7 | Low | 52.2 | Low | 206 Ų | 206 | 140.1 Ų | 140.1 | 90% | 0.896 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 117.7 | -180 | -69.8 | 177.6 | 179.9 | 174.7 | 0 | 106.2 | K122 A126 | K122-K124 PolarHBondContact O-N 3.01Å; K124-A126 PolarHBondContact O-N 3.22Å |
| 125 | K | 48.5 | Very low | 51.7 | Low | 204 Ų | 204 | 136.4 Ų | 136.4 | 89% | 0.887 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 116.3 | 173.7 | -76.8 | -164.6 | 171.8 | -164.2 | 0 | 107.5 | P123 | P123-K125 PolarHBondContact O-N 3.12Š|
| 126 | A | 49.3 | Very low | 51.7 | Low | 93 Ų | 93 | 132.6 Ų | 132.6 | 77% | 0.769 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 140.7 | 162.7 | 0 | 0 | 0 | 0 | 0 | 107.4 | K124 | K124-A126 PolarHBondContact O-N 3.22Š|
| 127 | K | 46.2 | Very low | 52.8 | Low | 202 Ų | 202 | 131.4 Ų | 131.4 | 88% | 0.878 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 148.9 | 176 | -69 | -174.7 | 177 | -177.1 | 0 | 109.4 | A129 | K127-A129 PolarHBondContact O-N 3.11Š|
| 128 | D | 43.5 | Very low | 53.5 | Low | 160 Ų | 160 | 127.2 Ų | 127.2 | 86% | 0.856 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 127.4 | -168.5 | -58.1 | -106 | 0 | 0 | 0 | 114.4 | ||
| 129 | A | 45.3 | Very low | 54.8 | Low | 104 Ų | 104 | 120.2 Ų | 120.2 | 86% | 0.86 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -146.9 | 110.4 | 152 | 0 | 0 | 0 | 0 | 0 | 107.2 | K127 | K127-A129 PolarHBondContact O-N 3.11Š|
| 130 | G | 40.5 | Very low | 56 | Low | 71 Ų | 71 | 118.9 Ų | 118.9 | 73% | 0.732 | 70% | 0.703 | S | S | * | * | S | Bend | trans | 102.8 | 112.1 | -173.1 | 0 | 0 | 0 | 0 | 0 | 113 | G132 | G130-G132 VanDerWaalsContact C-N 3.26Å; G130-G132 PolarHBondContact O-N 2.91Å |
| 131 | K | 51.5 | Low | 57.3 | Low | 196 Ų | 196 | 119.1 Ų | 119.1 | 85% | 0.852 | 69% | 0.694 | S | S | * | * | trans | -79.1 | 68.7 | -176.8 | -169.9 | -173.8 | 176.3 | -175.5 | 0 | 111.4 | T133 | K131-T133 PolarHBondContact O-N 3Š| ||
| 132 | G | 44.3 | Very low | 58.7 | Low | 75 Ų | 75 | 118.4 Ų | 118.4 | 77% | 0.773 | 68% | 0.682 | S | S | * | * | trans | -71 | 85.5 | 173 | 0 | 0 | 0 | 0 | 0 | 111.7 | G130 S134 | G130-G132 VanDerWaalsContact C-N 3.26Å; G130-G132 PolarHBondContact O-N 2.91Å; G132-S134 PolarHBondContact O-N 2.74Å; G132-S134 VanDerWaalsContact O-N 3.11Å | ||
| 133 | T | 52.9 | Low | 59.8 | Low | 96 Ų | 96 | 116.3 Ų | 116.3 | 59% | 0.589 | 67% | 0.673 | S | S | * | * | trans | -64 | 108.7 | 166.8 | 43.5 | 0 | 0 | 0 | 0 | 108.9 | K131 L135 | K131-T133 PolarHBondContact O-N 3Å; T133-L135 PolarHBondContact O-N 2.84Å; T133-L135 VanDerWaalsContact O-N 3.13Å | ||
| 134 | S | 53.4 | Low | 61.3 | Low | 94 Ų | 94 | 115.9 Ų | 115.9 | 66% | 0.657 | 66% | 0.659 | S | S | * | * | trans | -59 | 114.8 | 170.3 | 51.9 | 0 | 0 | 0 | 0 | 109 | G132 T136 | G132-S134 PolarHBondContact O-N 2.74Å; G132-S134 VanDerWaalsContact O-N 3.11Å; S134-T136 PolarHBondContact O-N 3.13Å | ||
| 135 | L | 60.3 | Low | 62.7 | Low | 72 Ų | 72 | 109.8 Ų | 109.8 | 38% | 0.377 | 64% | 0.636 | S | S | . | * | trans | -73.3 | 80 | -179.3 | -53.4 | 175.1 | 0 | 0 | 0 | 109 | T133 N137 D140 V141 K144 | T133-L135 PolarHBondContact O-N 2.84Å; T133-L135 VanDerWaalsContact O-N 3.13Å; L135-N137 VanDerWaalsContact C-N 3.32Å; L135-D140 HydrophobicContact CB-CB 4.48Å; L135-D140 HydrophobicContact CD2-CB 3.77Å; L135-V141 HydrophobicContact CB-CG2 3.75Å; L135-V141 HydrophobicContact CD1-CG2 4.29Å; L135-K144 HydrophobicContact CD1-CB 4.41Å; L135-K144 HydrophobicContact CD1-CD 3.88Å | ||
| 136 | T | 61.6 | Low | 64.3 | Low | 112 Ų | 112 | 104.6 Ų | 104.6 | 69% | 0.687 | 62% | 0.615 | S | S | * | * | trans | -84.2 | -8.6 | -180 | 52.1 | 0 | 0 | 0 | 0 | 113 | S134 | S134-T136 PolarHBondContact O-N 3.13Š| ||
| 137 | N | 70.4 | Confident | 65.9 | Low | 90 Ų | 90 | 105.1 Ų | 105.1 | 48% | 0.481 | 60% | 0.601 | S | S | . | * | S | Bend | trans | -113.9 | 135.6 | -180 | -42.8 | -58.7 | 0 | 0 | 0 | 109.3 | L135 A139 D140 V141 | L135-N137 VanDerWaalsContact C-N 3.32Å; N137-A139 PolarHBondContact O-N 3.05Å; N137-D140 WeakPolarHBondContact CB-OD2 3.49Å; N137-D140 PolarHBondContact ND2-OD2 2.86Å; N137-D140 PolarHBondContact O-N 2.92Å; N137-V141 PolarHBondContact O-N 2.96Å |
| 138 | T | 72.1 | Confident | 67.4 | Low | 116 Ų | 116 | 100.1 Ų | 100.1 | 71% | 0.712 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -57.3 | -37 | 178.8 | 48.6 | 0 | 0 | 0 | 0 | 112.6 | D140 V141 L142 | T138-D140 VanDerWaalsContact C-N 3.28Å; T138-D140 PolarHBondContact O-N 3.16Å; T138-V141 WeakPolarHBondContact O-CB 3.43Å; T138-V141 PolarHBondContact O-N 3.26Å; T138-V141 VanDerWaalsContact O-N 3.16Å; T138-L142 WeakPolarHBondContact O-CG 3.48Å; T138-L142 PolarHBondContact O-N 3.33Å |
| 139 | A | 77.1 | Confident | 69 | Low | 54 Ų | 54 | 98.4 Ų | 98.4 | 45% | 0.446 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -61.6 | -31 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | N137 K143 | N137-A139 PolarHBondContact O-N 3.05Å; A139-K143 WeakPolarHBondContact O-CG 3.4Å; A139-K143 PolarHBondContact O-N 3.25Å |
| 140 | D | 78.2 | Confident | 70.6 | Confident | 61 Ų | 61 | 100.3 Ų | 100.3 | 33% | 0.326 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -81 | -25.3 | 178.1 | -56.1 | -37.6 | 0 | 0 | 0 | 111.6 | L135 N137 T138 K144 | L135-D140 HydrophobicContact CB-CB 4.48Å; L135-D140 HydrophobicContact CD2-CB 3.77Å; N137-D140 WeakPolarHBondContact CB-OD2 3.49Å; N137-D140 PolarHBondContact ND2-OD2 2.86Å; N137-D140 PolarHBondContact O-N 2.92Å; T138-D140 VanDerWaalsContact C-N 3.28Å; T138-D140 PolarHBondContact O-N 3.16Å; D140-K144 PolarHBondContact O-N 3.37Å |
| 141 | V | 81.8 | Confident | 72 | Confident | 60 Ų | 60 | 104.6 Ų | 104.6 | 36% | 0.364 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -71.6 | -50 | 169.8 | 179.8 | 0 | 0 | 0 | 0 | 110.3 | L135 N137 T138 K143 K144 I145 | L135-V141 HydrophobicContact CB-CG2 3.75Å; L135-V141 HydrophobicContact CD1-CG2 4.29Å; N137-V141 PolarHBondContact O-N 2.96Å; T138-V141 WeakPolarHBondContact O-CB 3.43Å; T138-V141 PolarHBondContact O-N 3.26Å; T138-V141 VanDerWaalsContact O-N 3.16Å; V141-K143 PolarHBondContact O-N 2.97Å; V141-K144 PolarHBondContact O-N 3.24Å; V141-I145 HydrophobicContact CG1-CD1 4.08Å; V141-I145 PolarHBondContact O-N 3.41Å |
| 142 | L | 84.4 | Confident | 72.2 | Confident | 116 Ų | 116 | 102.4 Ų | 102.4 | 61% | 0.607 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -57 | -46.9 | 179.6 | -72 | 168.5 | 0 | 0 | 0 | 112 | T138 K144 I145 E146 | T138-L142 WeakPolarHBondContact O-CG 3.48Å; T138-L142 PolarHBondContact O-N 3.33Å; L142-K144 PolarHBondContact O-N 3Å; L142-I145 PolarHBondContact O-N 3.42Å; L142-I145 VanDerWaalsContact O-N 3.13Å; L142-E146 PolarHBondContact O-N 3.47Å |
| 143 | K | 84.9 | Confident | 72.7 | Confident | 140 Ų | 140 | 106.3 Ų | 106.3 | 61% | 0.609 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -58.9 | -32.1 | 174.6 | -79.1 | 179.6 | 175.3 | -179.8 | 0 | 113.8 | A139 V141 E147 | A139-K143 WeakPolarHBondContact O-CG 3.4Å; A139-K143 PolarHBondContact O-N 3.25Å; V141-K143 PolarHBondContact O-N 2.97Å; K143-E147 VanDerWaalsContact O-CB 3.29Å; K143-E147 WeakPolarHBondContact O-CB 3.4Å; K143-E147 PolarHBondContact O-N 3.18Å |
| 144 | K | 86.4 | Confident | 72.8 | Confident | 111 Ų | 111 | 104.1 Ų | 104.1 | 48% | 0.483 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -78.8 | -28.1 | 178.8 | -168.3 | 171.8 | -177.7 | -176.1 | 0 | 112.5 | L135 D140 V141 L142 L148 | L135-K144 HydrophobicContact CD1-CB 4.41Å; L135-K144 HydrophobicContact CD1-CD 3.88Å; D140-K144 PolarHBondContact O-N 3.37Å; V141-K144 PolarHBondContact O-N 3.24Å; L142-K144 PolarHBondContact O-N 3Å; K144-L148 HydrophobicContact CG-CD1 4.5Å; K144-L148 WeakPolarHBondContact O-CD1 3.3Å; K144-L148 VanDerWaalsContact O-CG 3.25Å; K144-L148 WeakPolarHBondContact O-CG 3.26Å; K144-L148 PolarHBondContact O-N 3Å; K144-L148 VanDerWaalsContact O-N 3.17Å |
| 145 | I | 85.1 | Confident | 72.3 | Confident | 79 Ų | 79 | 108.8 Ų | 108.8 | 41% | 0.405 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -67.7 | -50.9 | 169.7 | -64.6 | 165.9 | 0 | 0 | 0 | 108.9 | V141 L142 E147 L148 E149 | V141-I145 HydrophobicContact CG1-CD1 4.08Å; V141-I145 PolarHBondContact O-N 3.41Å; L142-I145 PolarHBondContact O-N 3.42Å; L142-I145 VanDerWaalsContact O-N 3.13Å; I145-E147 PolarHBondContact O-N 3.13Å; I145-E147 VanDerWaalsContact O-N 3.17Å; I145-L148 WeakPolarHBondContact O-CA 3.27Å; I145-L148 PolarHBondContact O-N 2.69Å; I145-E149 HydrophobicContact CG2-CG 4.39Å; I145-E149 WeakPolarHBondContact CG2-OE1 3.47Å; I145-E149 WeakPolarHBondContact O-CG 3.31Å; I145-E149 PolarHBondContact O-N 3.17Å |
| 146 | E | 82 | Confident | 71.6 | Confident | 95 Ų | 95 | 116 Ų | 116 | 44% | 0.444 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -58.5 | -29.8 | 176.6 | -162.7 | -160 | 158.8 | 0 | 0 | 113.2 | L142 K150 | L142-E146 PolarHBondContact O-N 3.47Å; E146-K150 VanDerWaalsContact O-CD 3.31Å; E146-K150 WeakPolarHBondContact O-CD 3.48Å; E146-K150 VanDerWaalsContact O-CG 3.3Å; E146-K150 WeakPolarHBondContact O-CG 3.29Å; E146-K150 IonicContact OE1-NZ 2.61Å; E146-K150 PolarHBondContact OE1-NZ 2.97Å |
| 147 | E | 83 | Confident | 70.8 | Confident | 104 Ų | 104 | 115.8 Ų | 115.8 | 49% | 0.486 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -81.3 | -20.9 | 174.7 | -166.9 | -177.1 | -169.5 | 0 | 0 | 113.4 | K143 I145 R151 | K143-E147 VanDerWaalsContact O-CB 3.29Å; K143-E147 WeakPolarHBondContact O-CB 3.4Å; K143-E147 PolarHBondContact O-N 3.18Å; I145-E147 PolarHBondContact O-N 3.13Å; I145-E147 VanDerWaalsContact O-N 3.17Å; E147-R151 VanDerWaalsContact CD-NH2 3.25Å; E147-R151 VanDerWaalsContact O-CD 3.27Å; E147-R151 WeakPolarHBondContact O-CD 3.43Å; E147-R151 VanDerWaalsContact O-CG 3.26Å; E147-R151 WeakPolarHBondContact O-CG 3.25Å; E147-R151 PolarHBondContact O-NE 3.04Å; E147-R151 IonicContact OE1-CZ 3.78Å; E147-R151 IonicContact OE1-NH2 2.69Å; E147-R151 PolarHBondContact OE1-NH2 3.17Å; E147-R151 IonicContact OE2-NH2 3.96Å |
| 148 | L | 77.7 | Confident | 69.1 | Low | 97 Ų | 97 | 118.5 Ų | 118.5 | 51% | 0.508 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -85.9 | -42.8 | 175.1 | -75.7 | 168.2 | 0 | 0 | 0 | 111.7 | K144 I145 K150 R151 D152 | K144-L148 HydrophobicContact CG-CD1 4.5Å; K144-L148 WeakPolarHBondContact O-CD1 3.3Å; K144-L148 VanDerWaalsContact O-CG 3.25Å; K144-L148 WeakPolarHBondContact O-CG 3.26Å; K144-L148 PolarHBondContact O-N 3Å; K144-L148 VanDerWaalsContact O-N 3.17Å; I145-L148 WeakPolarHBondContact O-CA 3.27Å; I145-L148 PolarHBondContact O-N 2.69Å; L148-K150 PolarHBondContact O-N 3.17Å; L148-R151 WeakPolarHBondContact O-CA 3.49Å; L148-R151 WeakPolarHBondContact O-CB 3.48Å; L148-R151 PolarHBondContact O-N 2.61Å; L148-D152 PolarHBondContact O-N 3.17Å; L148-D152 VanDerWaalsContact O-N 3.07Å |
| 149 | E | 76.2 | Confident | 67.2 | Low | 124 Ų | 124 | 122.3 Ų | 122.3 | 58% | 0.579 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -53.5 | -43.4 | 174.7 | -69 | 165.3 | 166.4 | 0 | 0 | 111.1 | I145 R151 D152 D153 | I145-E149 HydrophobicContact CG2-CG 4.39Å; I145-E149 WeakPolarHBondContact CG2-OE1 3.47Å; I145-E149 WeakPolarHBondContact O-CG 3.31Å; I145-E149 PolarHBondContact O-N 3.17Å; E149-R151 PolarHBondContact O-N 3.24Å; E149-R151 VanDerWaalsContact O-N 3.12Å; E149-D152 PolarHBondContact O-N 2.9Å; E149-D153 PolarHBondContact O-N 3.23Å |
| 150 | K | 78.1 | Confident | 64.9 | Low | 143 Ų | 143 | 127.8 Ų | 127.8 | 62% | 0.622 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -73.2 | 3.4 | 176.9 | -64.9 | 172.5 | -166.8 | 170.3 | 0 | 115.2 | E146 L148 | E146-K150 VanDerWaalsContact O-CD 3.31Å; E146-K150 WeakPolarHBondContact O-CD 3.48Å; E146-K150 VanDerWaalsContact O-CG 3.3Å; E146-K150 WeakPolarHBondContact O-CG 3.29Å; E146-K150 IonicContact OE1-NZ 2.61Å; E146-K150 PolarHBondContact OE1-NZ 2.97Å; L148-K150 PolarHBondContact O-N 3.17Å |
| 151 | R | 70.9 | Confident | 62.5 | Low | 161 Ų | 161 | 132.4 Ų | 132.4 | 61% | 0.608 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -116 | -19.8 | 173.1 | -64.3 | 172.4 | -170.5 | -157.2 | 4 | 112.5 | E147 L148 E149 | E147-R151 VanDerWaalsContact CD-NH2 3.25Å; E147-R151 VanDerWaalsContact O-CD 3.27Å; E147-R151 WeakPolarHBondContact O-CD 3.43Å; E147-R151 VanDerWaalsContact O-CG 3.26Å; E147-R151 WeakPolarHBondContact O-CG 3.25Å; E147-R151 PolarHBondContact O-NE 3.04Å; E147-R151 IonicContact OE1-CZ 3.78Å; E147-R151 IonicContact OE1-NH2 2.69Å; E147-R151 PolarHBondContact OE1-NH2 3.17Å; E147-R151 IonicContact OE2-NH2 3.96Å; L148-R151 WeakPolarHBondContact O-CA 3.49Å; L148-R151 WeakPolarHBondContact O-CB 3.48Å; L148-R151 PolarHBondContact O-N 2.61Å; E149-R151 PolarHBondContact O-N 3.24Å; E149-R151 VanDerWaalsContact O-N 3.12Å |
| 152 | D | 55.5 | Low | 60.1 | Low | 150 Ų | 150 | 137 Ų | 137 | 80% | 0.802 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -81 | -30.7 | 178.8 | -148.3 | 52.3 | 0 | 0 | 0 | 111.6 | L148 E149 G154 | L148-D152 PolarHBondContact O-N 3.17Å; L148-D152 VanDerWaalsContact O-N 3.07Å; E149-D152 PolarHBondContact O-N 2.9Å; D152-G154 PolarHBondContact O-N 2.95Å |
| 153 | D | 55 | Low | 57.4 | Low | 157 Ų | 157 | 138.5 Ų | 138.5 | 84% | 0.84 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.7 | 16.3 | 176.9 | -163.2 | -139.1 | 0 | 0 | 0 | 114.5 | E149 | E149-D153 PolarHBondContact O-N 3.23Š|
| 154 | G | 54.8 | Low | 55.1 | Low | 51 Ų | 51 | 141.3 Ų | 141.3 | 53% | 0.526 | 70% | 0.697 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -167.6 | 49.1 | -164.2 | 0 | 0 | 0 | 0 | 0 | 119.3 | D152 | D152-G154 PolarHBondContact O-N 2.95Š|
| 155 | E | 43.4 | Very low | 52.3 | Low | 192 Ų | 192 | 145.3 Ų | 145.3 | 90% | 0.897 | 72% | 0.718 | S | S | * | * | trans | -166.8 | 114.7 | 140.7 | -109.8 | 157 | -156.4 | 0 | 0 | 112.9 | ||||
| 156 | K | 45.1 | Very low | 49.5 | Very low | 222 Ų | 222 | 144.6 Ų | 144.6 | 97% | 0.965 | 73% | 0.73 | S | S | * | * | trans | -102.9 | 105.1 | 163.6 | -81.5 | -177.8 | 177.2 | 174.7 | 0 | 109.2 | ||||
| 157 | S | 43.7 | Very low | 46.9 | Very low | 109 Ų | 109 | 145.6 Ų | 145.6 | 76% | 0.762 | 75% | 0.747 | S | S | * | * | trans | -151.5 | 116.3 | 162.4 | -157.7 | 0 | 0 | 0 | 0 | 105 | ||||
| 158 | D | 35.4 | Very low | 44.4 | Very low | 147 Ų | 147 | 148.1 Ų | 148.1 | 79% | 0.786 | 76% | 0.757 | S | S | * | * | cis | 64.3 | 92.8 | 42.2 | -157.9 | 27 | 0 | 0 | 0 | 112.2 | ||||
| 159 | E | 32.8 | Very low | 42.1 | Very low | 195 Ų | 195 | 150 Ų | 150 | 91% | 0.911 | 76% | 0.763 | S | S | * | * | -162.6 | 150.1 | 129.7 | -159.3 | 162.9 | -148.5 | 0 | 0 | 108.6 | |||||
| 160 | E | 29.3 | Very low | 40 | Very low | 169 Ų | 169 | 153 Ų | 153 | 79% | 0.79 | 77% | 0.774 | S | S | * | * | trans | -86.2 | 155.5 | -169.1 | -63.3 | 170.5 | 109.5 | 0 | 0 | 114.6 | ||||
| 161 | N | 27.3 | Very low | 37.8 | Very low | 158 Ų | 158 | 150.7 Ų | 150.7 | 85% | 0.845 | 78% | 0.776 | S | S | * | * | -152.3 | 149.5 | 123.1 | -149.7 | -18.3 | 0 | 0 | 0 | 111.5 | |||||
| 162 | E | 30.6 | Very low | 35.9 | Very low | 156 Ų | 156 | 150.9 Ų | 150.9 | 73% | 0.729 | 78% | 0.781 | S | S | * | * | trans | -91.4 | 146.9 | -167.3 | -54.6 | 170.7 | 104.9 | 0 | 0 | 112.4 | ||||
| 163 | D | 29 | Very low | 34.5 | Very low | 149 Ų | 149 | 151 Ų | 151 | 80% | 0.797 | 78% | 0.776 | S | S | * | * | trans | 179.5 | 84 | 130 | -115.3 | -26.9 | 0 | 0 | 0 | 112.4 | ||||
| 164 | K | 35.8 | Very low | 33.2 | Very low | 198 Ų | 198 | 146.3 Ų | 146.3 | 86% | 0.861 | 77% | 0.765 | S | S | * | * | 172.3 | 135 | 115.6 | -94.9 | 161.8 | -175.6 | 167.2 | 0 | 115.8 | |||||
| 165 | E | 26.7 | Very low | 31.9 | Very low | 196 Ų | 196 | 150.9 Ų | 150.9 | 92% | 0.916 | 78% | 0.778 | S | S | * | * | trans | -59.8 | 155.1 | 161.5 | -52.7 | 168.3 | 112.8 | 0 | 0 | 111.5 | ||||
| 166 | G | 27.5 | Very low | 31.3 | Very low | 63 Ų | 63 | 149 Ų | 149 | 65% | 0.649 | 77% | 0.774 | S | S | * | * | cis | 156.5 | 164.3 | -3.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 167 | S | 27 | Very low | 30.5 | Very low | 116 Ų | 116 | 146.3 Ų | 146.3 | 81% | 0.811 | 77% | 0.77 | S | S | * | * | trans | 63.8 | 151.1 | -173.6 | -63.9 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 168 | K | 30.1 | Very low | 29.8 | Very low | 158 Ų | 158 | 148.1 Ų | 148.1 | 69% | 0.687 | 77% | 0.771 | S | S | * | * | cis | -167.3 | 159.2 | -6.7 | -112.5 | 171.2 | 162.7 | -111.6 | 0 | 105.8 | ||||
| 169 | E | 30.9 | Very low | 29.4 | Very low | 136 Ų | 136 | 148 Ų | 148 | 64% | 0.636 | 77% | 0.771 | S | S | * | * | cis | -155.3 | 139.8 | -4 | -146.8 | 141.6 | -147.7 | 0 | 0 | 105.9 | ||||
| 170 | K | 32.1 | Very low | 29.1 | Very low | 188 Ų | 188 | 146 Ų | 146 | 82% | 0.817 | 77% | 0.766 | S | S | * | * | 34.2 | 127.4 | 93.7 | -81.8 | -172.9 | 177.8 | -176.7 | 0 | 114.8 | |||||
| 171 | S | 31.2 | Very low | 29.1 | Very low | 94 Ų | 94 | 144.9 Ų | 144.9 | 66% | 0.657 | 77% | 0.766 | S | S | * | * | cis | -153.5 | 150.9 | 24 | -41.9 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 172 | K | 30.8 | Very low | 29.2 | Very low | 165 Ų | 165 | 141.1 Ų | 141.1 | 72% | 0.717 | 76% | 0.756 | S | S | * | * | 68.4 | 147.4 | 99.6 | -66.1 | -179.1 | 126.2 | -131.9 | 0 | 116 | |||||
| 173 | E | 27 | Very low | 29.5 | Very low | 151 Ų | 151 | 138.5 Ų | 138.5 | 71% | 0.706 | 76% | 0.762 | S | S | * | * | cis | -165 | 177.2 | 0.3 | -111.2 | 160 | 157 | 0 | 0 | 107.8 | ||||
| 174 | G | 27 | Very low | 29.7 | Very low | 59 Ų | 59 | 141 Ų | 141 | 61% | 0.608 | 77% | 0.769 | S | S | * | * | cis | -106 | -134.8 | -1.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 175 | D | 28.3 | Very low | 30.1 | Very low | 148 Ų | 148 | 140.4 Ų | 140.4 | 79% | 0.791 | 77% | 0.769 | S | S | * | * | cis | 62.9 | 147.1 | 5.8 | -57.9 | -16.8 | 0 | 0 | 0 | 117 | ||||
| 176 | D | 29 | Very low | 30.5 | Very low | 153 Ų | 153 | 140.9 Ų | 140.9 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | cis | -96.1 | -139.6 | -2.7 | -59.7 | -82.3 | 0 | 0 | 0 | 111.1 | ||||
| 177 | D | 28.3 | Very low | 30.8 | Very low | 164 Ų | 164 | 147.1 Ų | 147.1 | 88% | 0.877 | 78% | 0.783 | S | S | * | * | cis | -158.8 | -172.1 | 1.4 | -151.6 | -22.7 | 0 | 0 | 0 | 109.9 | ||||
| 178 | D | 29.1 | Very low | 31.3 | Very low | 147 Ų | 147 | 152.2 Ų | 152.2 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | trans | -109.8 | 166.2 | -167.2 | -117.2 | -30.3 | 0 | 0 | 0 | 118.2 | ||||
| 179 | D | 27.8 | Very low | 32.2 | Very low | 146 Ų | 146 | 150.8 Ų | 150.8 | 78% | 0.781 | 79% | 0.786 | S | S | * | * | trans | 69.6 | 145.9 | 149.1 | -107.3 | -22 | 0 | 0 | 0 | 127.5 | ||||
| 180 | D | 26.6 | Very low | 32.8 | Very low | 152 Ų | 152 | 152.9 Ų | 152.9 | 81% | 0.813 | 80% | 0.796 | S | S | * | * | trans | 67.4 | 161.7 | 149.8 | -120.9 | -10.8 | 0 | 0 | 0 | 126.8 | ||||
| 181 | D | 28.3 | Very low | 33.4 | Very low | 146 Ų | 146 | 152.5 Ų | 152.5 | 78% | 0.781 | 80% | 0.797 | S | S | * | * | trans | -48.4 | 162.6 | -163.8 | -153.5 | -139 | 0 | 0 | 0 | 123.3 | ||||
| 182 | A | 29.9 | Very low | 34.1 | Very low | 78 Ų | 78 | 157.7 Ų | 157.7 | 65% | 0.645 | 81% | 0.811 | S | S | * | * | trans | 65.1 | 99.9 | 152.1 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 183 | A | 38.3 | Very low | 34.9 | Very low | 102 Ų | 102 | 158.4 Ų | 158.4 | 84% | 0.843 | 82% | 0.817 | S | S | * | * | trans | 31.4 | 121.7 | 130.3 | 0 | 0 | 0 | 0 | 0 | 123 | ||||
| 184 | E | 32.8 | Very low | 36 | Very low | 202 Ų | 202 | 159.9 Ų | 159.9 | 94% | 0.944 | 82% | 0.824 | S | S | * | * | -154.5 | -168.6 | 127.2 | -132.3 | 170.2 | -177.9 | 0 | 0 | 112.6 | |||||
| 185 | Q | 42.7 | Very low | 37.1 | Very low | 184 Ų | 184 | 166.7 Ų | 166.7 | 86% | 0.86 | 84% | 0.84 | S | S | * | * | trans | -117.2 | 137.2 | -177.6 | -61.4 | 174.8 | -36.7 | 0 | 0 | 110.7 | ||||
| 186 | E | 35 | Very low | 38.1 | Very low | 207 Ų | 207 | 168.7 Ų | 168.7 | 97% | 0.967 | 84% | 0.844 | S | S | * | * | trans | -138.5 | 156.2 | 156.1 | -73.9 | -160.3 | 144.2 | 0 | 0 | 110.9 | ||||
| 187 | E | 34.1 | Very low | 38.9 | Very low | 193 Ų | 193 | 167 Ų | 167 | 90% | 0.902 | 84% | 0.836 | S | S | * | * | trans | -120 | 131.3 | -170.4 | -177.2 | 168.4 | -147 | 0 | 0 | 108 | ||||
| 188 | Y | 37.4 | Very low | 40.5 | Very low | 223 Ų | 223 | 165.7 Ų | 165.7 | 88% | 0.875 | 83% | 0.828 | S | S | * | * | trans | -105.9 | 127.5 | -174.9 | -136 | -87.1 | 0 | 0 | 0 | 109.7 | ||||
| 189 | D | 48.9 | Very low | 42.1 | Very low | 128 Ų | 128 | 167.1 Ų | 167.1 | 68% | 0.684 | 82% | 0.824 | S | S | * | * | trans | -87.4 | 133.8 | -177.8 | -162 | -19 | 0 | 0 | 0 | 110.5 | E191 | D189-E191 PolarHBondContact OD1-N 3.45Š| ||
| 190 | E | 44.8 | Very low | 43.6 | Very low | 180 Ų | 180 | 166.5 Ų | 166.5 | 84% | 0.841 | 82% | 0.819 | S | S | * | * | trans | -107.8 | -3.5 | -174.3 | -66.8 | -170.9 | 145.1 | 0 | 0 | 113.3 | E192 | E190-E192 PolarHBondContact O-N 3.07Š| ||
| 191 | E | 44.7 | Very low | 45.1 | Very low | 181 Ų | 181 | 165.4 Ų | 165.4 | 85% | 0.846 | 81% | 0.814 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.2 | -11 | -165.8 | -66.4 | -165.9 | 172.7 | 0 | 0 | 116.5 | D189 | D189-E191 PolarHBondContact OD1-N 3.45Š|
| 192 | E | 45.3 | Very low | 46.6 | Very low | 202 Ų | 202 | 162.8 Ų | 162.8 | 94% | 0.944 | 81% | 0.807 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.7 | 17.1 | -165.7 | -146.6 | -179.2 | -145.6 | 0 | 0 | 116.5 | E190 | E190-E192 PolarHBondContact O-N 3.07Š|
| 193 | Q | 47.2 | Very low | 48.2 | Very low | 180 Ų | 180 | 167.1 Ų | 167.1 | 84% | 0.841 | 81% | 0.807 | S | S | * | * | S | Bend | trans | -126.5 | 11.7 | -169.7 | -158.4 | 151.3 | 115 | 0 | 0 | 118 | ||
| 194 | E | 50.3 | Low | 49.2 | Very low | 183 Ų | 183 | 171.1 Ų | 171.1 | 86% | 0.855 | 81% | 0.806 | S | S | * | * | trans | -103.7 | -5 | -175.7 | -63.9 | -153.8 | 148 | 0 | 0 | 117.3 | ||||
| 195 | E | 49.7 | Very low | 50.6 | Low | 202 Ų | 202 | 169.7 Ų | 169.7 | 94% | 0.944 | 80% | 0.8 | S | S | * | * | S | Bend | trans | -82.1 | -17.8 | -166.4 | -89.8 | -163.4 | 153.5 | 0 | 0 | 118.5 | ||
| 196 | E | 49.6 | Very low | 50.8 | Low | 189 Ų | 189 | 169.2 Ų | 169.2 | 88% | 0.883 | 80% | 0.803 | S | S | * | * | trans | -114.9 | 76 | -178 | -72.1 | -163.7 | 152.5 | 0 | 0 | 113.9 | ||||
| 197 | N | 46.8 | Very low | 51.9 | Low | 119 Ų | 119 | 163 Ų | 163 | 64% | 0.636 | 79% | 0.794 | S | S | * | * | trans | -132.3 | 78.5 | 169.1 | -82.5 | -77.8 | 0 | 0 | 0 | 112.8 | Y199 | N197-Y199 PolarHBondContact O-N 2.9Š| ||
| 198 | D | 60.2 | Low | 52.7 | Low | 136 Ų | 136 | 160.2 Ų | 160.2 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | G | 310 helix | trans | -55 | -11.2 | 174 | -77.2 | -32.3 | 0 | 0 | 0 | 115 | I200 N201 | D198-I200 PolarHBondContact O-N 3.27Å; D198-I200 VanDerWaalsContact O-N 3.17Å; D198-N201 PolarHBondContact O-N 3.26Å |
| 199 | Y | 64.5 | Low | 53.6 | Low | 176 Ų | 176 | 157.5 Ų | 157.5 | 69% | 0.69 | 79% | 0.786 | S | S | * | * | G | 310 helix | trans | -54.1 | -32.3 | -178.3 | -165.9 | -102.9 | 0 | 0 | 0 | 114.1 | N197 S202 | N197-Y199 PolarHBondContact O-N 2.9Å; Y199-S202 PolarHBondContact O-OG 2.89Å |
| 200 | I | 58.8 | Low | 53.7 | Low | 133 Ų | 133 | 160.1 Ų | 160.1 | 68% | 0.682 | 79% | 0.792 | S | S | * | * | G | 310 helix | trans | -69.1 | -38.7 | -179.5 | -71.2 | 174.3 | 0 | 0 | 0 | 112 | D198 S202 | D198-I200 PolarHBondContact O-N 3.27Å; D198-I200 VanDerWaalsContact O-N 3.17Å; I200-S202 PolarHBondContact O-N 3.44Å |
| 201 | N | 57.7 | Low | 53.8 | Low | 130 Ų | 130 | 154.1 Ų | 154.1 | 70% | 0.695 | 78% | 0.779 | S | S | * | * | G | 310 helix | trans | -74.4 | -11.3 | -172.1 | -71.5 | -19 | 0 | 0 | 0 | 113.9 | D198 | D198-N201 PolarHBondContact O-N 3.26Š|
| 202 | S | 60 | Low | 54.2 | Low | 91 Ų | 91 | 150.5 Ų | 150.5 | 64% | 0.636 | 78% | 0.779 | S | S | * | * | G | 310 helix | trans | -109.1 | 1.7 | -176.2 | 51.4 | 0 | 0 | 0 | 0 | 114.5 | Y199 I200 | Y199-S202 PolarHBondContact O-OG 2.89Å; I200-S202 PolarHBondContact O-N 3.44Å |
| 203 | Y | 63.3 | Low | 54.6 | Low | 168 Ų | 168 | 148.3 Ų | 148.3 | 66% | 0.659 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -93 | -10 | -176.3 | -161.1 | -101 | 0 | 0 | 0 | 114.6 | ||
| 204 | F | 58.5 | Low | 54.7 | Low | 187 Ų | 187 | 145.3 Ų | 145.3 | 82% | 0.82 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -127.7 | -4.1 | -175.2 | -78.8 | -76.3 | 0 | 0 | 0 | 115.9 | ||
| 205 | E | 62.2 | Low | 54.9 | Low | 172 Ų | 172 | 144 Ų | 144 | 80% | 0.804 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -111.2 | 77.2 | 172.2 | -70.8 | -161.8 | 142.2 | 0 | 0 | 111.7 | ||
| 206 | D | 48.2 | Very low | 55.3 | Low | 173 Ų | 173 | 140.6 Ų | 140.6 | 93% | 0.925 | 76% | 0.76 | S | S | * | * | S | Bend | trans | 179.4 | 134.5 | 130.7 | -104.2 | -21.9 | 0 | 0 | 0 | 111.9 | ||
| 207 | G | 57 | Low | 55.6 | Low | 76 Ų | 76 | 138.2 Ų | 138.2 | 78% | 0.784 | 75% | 0.754 | S | S | * | * | trans | 115.3 | 33.6 | 145.5 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 208 | D | 51 | Low | 56 | Low | 136 Ų | 136 | 139.3 Ų | 139.3 | 73% | 0.727 | 77% | 0.765 | S | S | * | * | trans | -143.5 | 80.4 | 152.6 | -141.1 | -5.7 | 0 | 0 | 0 | 114.2 | F210 | D208-F210 PolarHBondContact O-N 3.12Š| ||
| 209 | D | 57.6 | Low | 55.8 | Low | 165 Ų | 165 | 140.3 Ų | 140.3 | 88% | 0.882 | 77% | 0.77 | S | S | * | * | trans | -73.3 | 62.5 | 164.2 | 177.7 | 37.2 | 0 | 0 | 0 | 110.2 | G211 | D209-G211 PolarHBondContact O-N 2.9Š| ||
| 210 | F | 49.8 | Very low | 55.4 | Low | 183 Ų | 183 | 139.6 Ų | 139.6 | 80% | 0.803 | 77% | 0.773 | S | S | * | * | trans | -90.8 | 82.4 | 177.4 | -136.9 | -77.5 | 0 | 0 | 0 | 111 | D208 | D208-F210 PolarHBondContact O-N 3.12Š| ||
| 211 | G | 47.5 | Very low | 55.2 | Low | 55 Ų | 55 | 138.1 Ų | 138.1 | 57% | 0.567 | 78% | 0.781 | S | S | * | * | trans | -69.5 | 146.3 | -169.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | D209 | D209-G211 PolarHBondContact O-N 2.9Š| ||
| 212 | A | 52 | Low | 54.8 | Low | 104 Ų | 104 | 137.3 Ų | 137.3 | 86% | 0.86 | 78% | 0.781 | S | S | * | * | trans | 72.4 | 131.2 | 147.5 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 213 | D | 53.6 | Low | 54.3 | Low | 156 Ų | 156 | 145.9 Ų | 145.9 | 83% | 0.834 | 80% | 0.801 | S | S | * | * | trans | 80.2 | 74 | 141.6 | -141.2 | 52.5 | 0 | 0 | 0 | 120 | ||||
| 214 | S | 51 | Low | 53.9 | Low | 118 Ų | 118 | 144.8 Ų | 144.8 | 83% | 0.825 | 81% | 0.808 | S | S | * | * | trans | -170.1 | 92.9 | 142.6 | -75.6 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 215 | D | 53 | Low | 53.6 | Low | 154 Ų | 154 | 142.5 Ų | 142.5 | 82% | 0.824 | 81% | 0.808 | S | S | * | * | 68.8 | 95 | 72.8 | -158.6 | 33.5 | 0 | 0 | 0 | 112.6 | |||||
| 216 | D | 58.6 | Low | 53.1 | Low | 131 Ų | 131 | 140.9 Ų | 140.9 | 70% | 0.701 | 81% | 0.808 | S | S | * | * | trans | 23.9 | 111.5 | 153.3 | -161.1 | 16.8 | 0 | 0 | 0 | 119.3 | ||||
| 217 | N | 55.5 | Low | 53.4 | Low | 139 Ų | 139 | 139 Ų | 139 | 74% | 0.743 | 80% | 0.801 | S | S | * | * | trans | 173.8 | 92.8 | 134.6 | -101.2 | -83.2 | 0 | 0 | 0 | 111 | ||||
| 218 | T | 55.6 | Low | 53.2 | Low | 142 Ų | 142 | 142.9 Ų | 142.9 | 87% | 0.871 | 80% | 0.802 | S | S | * | * | trans | -132.9 | 67.9 | 166 | 55.5 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 219 | D | 56.4 | Low | 53.4 | Low | 158 Ų | 158 | 143.4 Ų | 143.4 | 85% | 0.845 | 81% | 0.807 | S | S | * | * | trans | -62.8 | 142.8 | 174.4 | -120.8 | -16.9 | 0 | 0 | 0 | 111.4 | A221 | D219-A221 PolarHBondContact O-N 3.26Š| ||
| 220 | E | 56.1 | Low | 53 | Low | 160 Ų | 160 | 141.9 Ų | 141.9 | 75% | 0.748 | 80% | 0.801 | S | S | * | * | trans | -74 | 115.6 | -165.1 | -168 | -169.1 | 138.4 | 0 | 0 | 113.4 | T222 | E220-T222 HydrophobicContact CG-CG2 4.29Å; E220-T222 WeakPolarHBondContact OE1-CG2 3.48Å; E220-T222 PolarHBondContact OE1-OG1 3.27Å | ||
| 221 | A | 55.3 | Low | 53.3 | Low | 102 Ų | 102 | 138.7 Ų | 138.7 | 84% | 0.843 | 80% | 0.801 | S | S | * | * | trans | -105.1 | 63.7 | -179 | 0 | 0 | 0 | 0 | 0 | 113.3 | D219 | D219-A221 PolarHBondContact O-N 3.26Š| ||
| 222 | T | 48.1 | Very low | 53.8 | Low | 114 Ų | 114 | 145.7 Ų | 145.7 | 70% | 0.699 | 82% | 0.821 | S | S | * | * | trans | -82 | 146.4 | 170.3 | 38.1 | 0 | 0 | 0 | 0 | 112.1 | E220 | E220-T222 HydrophobicContact CG-CG2 4.29Å; E220-T222 WeakPolarHBondContact OE1-CG2 3.48Å; E220-T222 PolarHBondContact OE1-OG1 3.27Å | ||
| 223 | Y | 50.3 | Low | 53.9 | Low | 270 Ų | 270 | 149.5 Ų | 149.5 | 100% | 1.059 | 82% | 0.817 | S | S | * | * | trans | -141.2 | 0 | -169.6 | -176.1 | -82.7 | 0 | 0 | 0 | 115.2 |
Retrieved 223 of 223 residues in 39.2 ms
(Link to these results)