| 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 | 45.2 | Very low | 45.7 | Very low | 250 Ų | 250 | 133.9 Ų | 133.9 | 100% | 1.232 | 75% | 0.753 | S | S | * | * | 0 | 66.5 | 0 | -63.4 | 176.8 | 95.4 | 0 | 0 | 109.7 | |||||
| 2 | A | 41.4 | Very low | 46 | Very low | 76 Ų | 76 | 135.1 Ų | 135.1 | 63% | 0.628 | 75% | 0.748 | S | S | * | * | trans | -174.8 | 74.7 | 165 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 3 | V | 46.3 | Very low | 46.6 | Very low | 146 Ų | 146 | 128.5 Ų | 128.5 | 89% | 0.885 | 71% | 0.71 | S | S | * | * | trans | -116.5 | 22.8 | 163.3 | -63.7 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 4 | F | 40.6 | Very low | 46.9 | Very low | 203 Ų | 203 | 129.6 Ų | 129.6 | 89% | 0.89 | 71% | 0.712 | S | S | * | * | trans | -103.9 | 20.9 | -179.1 | -104.8 | -86.3 | 0 | 0 | 0 | 112.1 | ||||
| 5 | D | 45.4 | Very low | 46.9 | Very low | 131 Ų | 131 | 129.7 Ų | 129.7 | 70% | 0.701 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -97.7 | 93 | 172.7 | -70.6 | -57.2 | 0 | 0 | 0 | 109.9 | ||
| 6 | L | 47.1 | Very low | 46.8 | Very low | 171 Ų | 171 | 133.5 Ų | 133.5 | 90% | 0.895 | 71% | 0.714 | S | S | * | * | S | Bend | trans | 48.8 | 76.2 | 144.7 | -58.3 | 172 | 0 | 0 | 0 | 117.3 | ||
| 7 | A | 47.8 | Very low | 46.6 | Very low | 89 Ų | 89 | 131 Ų | 131 | 74% | 0.736 | 73% | 0.727 | S | S | * | * | trans | -149.4 | 27.5 | 160.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 8 | I | 48 | Very low | 46.7 | Very low | 90 Ų | 90 | 125.8 Ų | 125.8 | 46% | 0.462 | 71% | 0.708 | S | S | . | * | trans | -146.8 | 107.2 | 159 | -45.4 | 176.6 | 0 | 0 | 0 | 108.3 | A10 D46 | I8-A10 HydrophobicContact CG2-CB 4.24Å; I8-A10 PolarHBondContact O-N 2.91Å; I8-D46 WeakPolarHBondContact CG2-O 3.44Å | ||
| 9 | P | 47.7 | Very low | 47.1 | Very low | 73 Ų | 73 | 129.8 Ų | 129.8 | 47% | 0.474 | 71% | 0.711 | S | S | . | * | trans | -72.2 | 76.6 | 159.7 | 32.8 | -30.7 | 0 | 0 | 0 | 107.1 | E11 Q12 | P9-E11 PolarHBondContact O-N 3.4Å; P9-E11 VanDerWaalsContact O-N 3.1Å; P9-Q12 HydrophobicContact CB-CB 4.16Å; P9-Q12 HydrophobicContact CB-CG 3.96Å; P9-Q12 HydrophobicContact CG-CB 4.32Å; P9-Q12 HydrophobicContact CG-CG 4.34Å; P9-Q12 PolarHBondContact O-N 2.86Å | ||
| 10 | A | 47.8 | Very low | 47.7 | Very low | 66 Ų | 66 | 126.7 Ų | 126.7 | 55% | 0.545 | 70% | 0.696 | S | S | . | * | G | 310 helix | trans | -59.8 | -18 | 169.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | I8 Q12 I13 | I8-A10 HydrophobicContact CG2-CB 4.24Å; I8-A10 PolarHBondContact O-N 2.91Å; A10-Q12 VanDerWaalsContact C-N 3.33Å; A10-I13 PolarHBondContact O-N 3.1Å |
| 11 | E | 45.5 | Very low | 48.4 | Very low | 178 Ų | 178 | 122 Ų | 122 | 83% | 0.832 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -69.7 | -21.9 | 170.9 | -150.5 | -178.7 | 163 | 0 | 0 | 113.8 | P9 | P9-E11 PolarHBondContact O-N 3.4Å; P9-E11 VanDerWaalsContact O-N 3.1Å |
| 12 | Q | 48.9 | Very low | 49.4 | Very low | 148 Ų | 148 | 115.5 Ų | 115.5 | 69% | 0.692 | 65% | 0.651 | S | S | * | * | G | 310 helix | trans | -84 | -10.9 | 174.1 | -76.2 | -172.2 | -52.6 | 0 | 0 | 113.8 | P9 A10 I14 | P9-Q12 HydrophobicContact CB-CB 4.16Å; P9-Q12 HydrophobicContact CB-CG 3.96Å; P9-Q12 HydrophobicContact CG-CB 4.32Å; P9-Q12 HydrophobicContact CG-CG 4.34Å; P9-Q12 PolarHBondContact O-N 2.86Å; A10-Q12 VanDerWaalsContact C-N 3.33Å; Q12-I14 VanDerWaalsContact C-N 3.33Å |
| 13 | I | 53.6 | Low | 50.5 | Low | 50 Ų | 50 | 115.8 Ų | 115.8 | 26% | 0.256 | 64% | 0.642 | S | S | . | * | S | Bend | trans | -82.7 | -16.8 | 177.4 | -60.8 | 176.8 | 0 | 0 | 0 | 111.1 | A10 F15 M35 I47 | A10-I13 PolarHBondContact O-N 3.1Å; I13-F15 PolarHBondContact O-N 3.43Å; I13-M35 HydrophobicContact CG2-CE 3.23Å; I13-M35 HydrophobicContact CG2-SD 3.85Å; I13-I47 HydrophobicContact CD1-CD1 4.24Å; I13-I47 HydrophobicContact CD1-CG1 3.59Å |
| 14 | I | 51.7 | Low | 51.5 | Low | 144 Ų | 144 | 119.5 Ų | 119.5 | 74% | 0.738 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -80.6 | 72.8 | 159.4 | -51.4 | -172.4 | 0 | 0 | 0 | 107.4 | Q12 H16 | Q12-I14 VanDerWaalsContact C-N 3.33Å; I14-H16 PolarHBondContact O-N 3.21Å |
| 15 | F | 46.4 | Very low | 53.1 | Low | 131 Ų | 131 | 116.6 Ų | 116.6 | 58% | 0.575 | 63% | 0.629 | S | S | * | * | trans | -51.6 | 115 | 173.5 | -161.7 | -93.1 | 0 | 0 | 0 | 108.7 | I13 G17 | I13-F15 PolarHBondContact O-N 3.43Å; F15-G17 PolarHBondContact O-N 3.25Å | ||
| 16 | H | 45.5 | Very low | 54.6 | Low | 190 Ų | 190 | 112.1 Ų | 112.1 | 88% | 0.88 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -42.2 | 103.3 | 172.2 | -117.4 | -96.1 | 0 | 0 | 0 | 109.8 | I14 G18 | I14-H16 PolarHBondContact O-N 3.21Å; H16-G18 PolarHBondContact O-N 3.12Å |
| 17 | G | 44.1 | Very low | 56.2 | Low | 91 Ų | 91 | 107.3 Ų | 107.3 | 94% | 0.938 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 73.4 | 22.9 | 159.7 | 0 | 0 | 0 | 0 | 0 | 119.9 | F15 | F15-G17 PolarHBondContact O-N 3.25Š|
| 18 | G | 47.1 | Very low | 57.9 | Low | 38 Ų | 38 | 105.4 Ų | 105.4 | 39% | 0.392 | 57% | 0.566 | S | S | . | * | S | Bend | trans | -156.9 | 130.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | H16 V20 | H16-G18 PolarHBondContact O-N 3.12Å; G18-V20 PolarHBondContact O-N 3.33Å |
| 19 | R | 54.5 | Low | 59.5 | Low | 202 Ų | 202 | 109.7 Ų | 109.7 | 76% | 0.762 | 58% | 0.576 | S | S | * | * | trans | -54.5 | 115.9 | 165.6 | -58.7 | 175.9 | -154.2 | 150.8 | 8.6 | 106.6 | C21 | R19-C21 WeakPolarHBondContact CB-O 3.46Å; R19-C21 PolarHBondContact O-N 3.06Å | ||
| 20 | V | 59.5 | Low | 61 | Low | 67 Ų | 67 | 112.4 Ų | 112.4 | 41% | 0.406 | 58% | 0.581 | S | S | . | * | S | Bend | trans | -48.5 | -28.9 | -179.5 | -170.1 | 0 | 0 | 0 | 0 | 111.5 | G18 C39 | G18-V20 PolarHBondContact O-N 3.33Å; V20-C39 HydrophobicContact CG1-CB 4.16Å; V20-C39 WeakPolarHBondContact CG1-SG 3.13Å |
| 21 | C | 61.6 | Low | 62.5 | Low | 28 Ų | 28 | 117.4 Ų | 117.4 | 19% | 0.189 | 59% | 0.587 | C | S | . | * | trans | -137.3 | 127.6 | 174.5 | 29.9 | 0 | 0 | 0 | 0 | 108.8 | R19 N23 C36 C39 | R19-C21 WeakPolarHBondContact CB-O 3.46Å; R19-C21 PolarHBondContact O-N 3.06Å; C21-N23 HydrophobicContact CB-CB 4.17Å; C21-N23 PolarHBondContact O-N 2.98Å; C21-C36 HydrophobicContact CB-CB 4.27Å; C21-C36 WeakPolarHBondContact CB-SG 3.27Å; C21-C36 WeakPolarHBondContact SG-CB 3.41Å; C21-C36 CovalentContact SG-SG 2.05Å; C21-C36 PolarHBondContact SG-SG 2.9Å; C21-C39 PolarHBondContact SG-SG 3.26Å | ||
| 22 | S | 66 | Low | 63.8 | Low | 113 Ų | 113 | 111.7 Ų | 111.7 | 79% | 0.79 | 58% | 0.575 | S | S | * | * | trans | -68.7 | 13 | 167.3 | -100.4 | 0 | 0 | 0 | 0 | 113.4 | R24 | S22-R24 PolarHBondContact O-N 2.86Š| ||
| 23 | N | 64.6 | Low | 65.1 | Low | 83 Ų | 83 | 106.2 Ų | 106.2 | 44% | 0.444 | 55% | 0.55 | S | S | . | * | trans | -85.9 | 115 | -173.9 | -134.6 | -31.4 | 0 | 0 | 0 | 109.5 | C21 H25 | C21-N23 HydrophobicContact CB-CB 4.17Å; C21-N23 PolarHBondContact O-N 2.98Å; N23-H25 PolarHBondContact O-N 3.04Å | ||
| 24 | R | 67.4 | Low | 66.1 | Low | 223 Ų | 223 | 108.6 Ų | 108.6 | 84% | 0.842 | 56% | 0.563 | S | S | * | * | trans | -73 | -15.7 | 178.2 | -114.8 | 175.6 | -171.8 | 161.1 | 1.7 | 112.9 | S22 | S22-R24 PolarHBondContact O-N 2.86Š| ||
| 25 | H | 74.9 | Confident | 67.3 | Low | 142 Ų | 142 | 102.3 Ų | 102.3 | 66% | 0.657 | 53% | 0.531 | S | S | * | . | S | Bend | trans | -96.1 | 126.7 | -169.4 | -73 | -156.8 | 0 | 0 | 0 | 111.9 | N23 R37 | N23-H25 PolarHBondContact O-N 3.04Å; H25-R37 PolarHBondContact O-NH1 2.77Å |
| 26 | G | 76.8 | Confident | 69 | Low | 38 Ų | 38 | 96.2 Ų | 96.2 | 39% | 0.392 | 51% | 0.505 | S | S | . | . | S | Bend | trans | 70.4 | 44.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | R37 | G26-R37 PolarHBondContact O-N 3.17Š|
| 27 | L | 81.3 | Confident | 71 | Confident | 70 Ų | 70 | 93.5 Ų | 93.5 | 37% | 0.366 | 49% | 0.487 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.1 | 121.7 | 168 | -170.8 | 72.9 | 0 | 0 | 0 | 109.8 | R29 | L27-R29 HydrophobicContact CD2-CG 3.9Å; L27-R29 HydrophobicContact CG-CG 4.06Å |
| 28 | I | 82.1 | Confident | 72.7 | Confident | 48 Ų | 48 | 94.1 Ų | 94.1 | 25% | 0.246 | 47% | 0.465 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.8 | 111.6 | 173.2 | -57.6 | 175.7 | 0 | 0 | 0 | 107.5 | K30 N34 M35 R37 F40 | I28-K30 HydrophobicContact CG2-CB 4.19Å; I28-N34 WeakPolarHBondContact O-CA 3.49Å; I28-N34 PolarHBondContact O-N 3.38Å; I28-N34 VanDerWaalsContact O-N 3.12Å; I28-M35 WeakPolarHBondContact CA-O 3.42Å; I28-M35 WeakPolarHBondContact CB-O 3.45Å; I28-M35 PolarHBondContact N-O 2.87Å; I28-M35 PolarHBondContact O-N 3.44Å; I28-R37 HydrophobicContact CD1-CB 4.18Å; I28-R37 HydrophobicContact CG1-CB 4.5Å; I28-F40 HydrophobicContact CD1-CB 3.72Å; I28-F40 HydrophobicContact CD1-CD1 3.89Å; I28-F40 HydrophobicContact CD1-CD2 4.28Å; I28-F40 HydrophobicContact CD1-CG 3.68Å |
| 29 | R | 83.4 | Confident | 74.2 | Confident | 180 Ų | 180 | 92.8 Ų | 92.8 | 68% | 0.679 | 45% | 0.45 | S | S | * | . | trans | -104.1 | -1.6 | 177.4 | -53.6 | -178.6 | 105.2 | 147 | 0.9 | 112.7 | L27 G32 | L27-R29 HydrophobicContact CD2-CG 3.9Å; L27-R29 HydrophobicContact CG-CG 4.06Å; R29-G32 PolarHBondContact O-N 3.18Å | ||
| 30 | K | 77.3 | Confident | 75.5 | Confident | 131 Ų | 131 | 85.2 Ų | 85.2 | 57% | 0.57 | 42% | 0.423 | S | S | * | . | G | 310 helix | trans | -64.4 | 139.4 | 176.9 | -156.1 | -178.9 | -177.6 | -160.6 | 0 | 108.8 | I28 G32 L33 | I28-K30 HydrophobicContact CG2-CB 4.19Å; K30-G32 PolarHBondContact O-N 3.47Å; K30-G32 VanDerWaalsContact O-N 3.14Å; K30-L33 PolarHBondContact O-N 3.28Å |
| 31 | Y | 79.8 | Confident | 76.6 | Confident | 171 Ų | 171 | 91.9 Ų | 91.9 | 67% | 0.671 | 44% | 0.44 | S | S | * | . | G | 310 helix | trans | 59.2 | 20.8 | -179.8 | -44.2 | -70.1 | 0 | 0 | 0 | 114.8 | L33 | Y31-L33 VanDerWaalsContact C-N 3.26Å; Y31-L33 HydrophobicContact CD2-CD1 4.41Å; Y31-L33 PolarHBondContact O-N 2.81Å |
| 32 | G | 73.4 | Confident | 77.6 | Confident | 57 Ų | 57 | 96.7 Ų | 96.7 | 59% | 0.588 | 46% | 0.46 | S | S | * | . | G | 310 helix | trans | 75.7 | 7.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | R29 K30 N34 | R29-G32 PolarHBondContact O-N 3.18Å; K30-G32 PolarHBondContact O-N 3.47Å; K30-G32 VanDerWaalsContact O-N 3.14Å; G32-N34 VanDerWaalsContact C-N 3.32Å; G32-N34 PolarHBondContact O-N 3.39Å; G32-N34 PolarHBondContact O-ND2 3.14Å |
| 33 | L | 77 | Confident | 78.1 | Confident | 34 Ų | 34 | 94.9 Ų | 94.9 | 18% | 0.178 | 44% | 0.437 | C | S | . | . | trans | -66.4 | -24.7 | -171.7 | -74.2 | 159.9 | 0 | 0 | 0 | 114.6 | K30 Y31 M35 F40 I47 F49 | K30-L33 PolarHBondContact O-N 3.28Å; Y31-L33 VanDerWaalsContact C-N 3.26Å; Y31-L33 HydrophobicContact CD2-CD1 4.41Å; Y31-L33 PolarHBondContact O-N 2.81Å; L33-M35 HydrophobicContact CB-CE 4.09Å; L33-M35 HydrophobicContact CD2-CE 3.59Å; L33-M35 HydrophobicContact CG-CE 4.47Å; L33-M35 VanDerWaalsContact O-CE 3.31Å; L33-M35 WeakPolarHBondContact O-CE 3.2Å; L33-M35 VanDerWaalsContact O-CG 3.27Å; L33-M35 WeakPolarHBondContact O-CG 3.32Å; L33-M35 PolarHBondContact O-N 3.12Å; L33-F40 HydrophobicContact CD1-CD2 4.35Å; L33-F40 HydrophobicContact CD1-CE2 3.94Å; L33-I47 HydrophobicContact CD2-CD1 4.29Å; L33-F49 HydrophobicContact CD1-CE2 4.3Å; L33-F49 HydrophobicContact CD1-CZ 4.41Å | ||
| 34 | N | 74.6 | Confident | 78.8 | Confident | 99 Ų | 99 | 91.7 Ų | 91.7 | 53% | 0.529 | 42% | 0.422 | S | S | . | . | trans | 39 | 39.7 | 177.8 | -71.3 | -48.2 | 0 | 0 | 0 | 115 | I28 G32 | I28-N34 WeakPolarHBondContact O-CA 3.49Å; I28-N34 PolarHBondContact O-N 3.38Å; I28-N34 VanDerWaalsContact O-N 3.12Å; G32-N34 VanDerWaalsContact C-N 3.32Å; G32-N34 PolarHBondContact O-N 3.39Å; G32-N34 PolarHBondContact O-ND2 3.14Å | ||
| 35 | M | 76.7 | Confident | 79.3 | Confident | 12 Ų | 12 | 89.8 Ų | 89.8 | 6% | 0.059 | 42% | 0.42 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.7 | 146.2 | -174.2 | -87.2 | -178.4 | -89 | 0 | 0 | 110.7 | I13 I28 L33 Y43 I47 | I13-M35 HydrophobicContact CG2-CE 3.23Å; I13-M35 HydrophobicContact CG2-SD 3.85Å; I28-M35 WeakPolarHBondContact CA-O 3.42Å; I28-M35 WeakPolarHBondContact CB-O 3.45Å; I28-M35 PolarHBondContact N-O 2.87Å; I28-M35 PolarHBondContact O-N 3.44Å; L33-M35 HydrophobicContact CB-CE 4.09Å; L33-M35 HydrophobicContact CD2-CE 3.59Å; L33-M35 HydrophobicContact CG-CE 4.47Å; L33-M35 VanDerWaalsContact O-CE 3.31Å; L33-M35 WeakPolarHBondContact O-CE 3.2Å; L33-M35 VanDerWaalsContact O-CG 3.27Å; L33-M35 WeakPolarHBondContact O-CG 3.32Å; L33-M35 PolarHBondContact O-N 3.12Å; M35-Y43 HydrophobicContact SD-CD2 4.5Å; M35-I47 HydrophobicContact CE-CD1 4.41Å |
| 36 | C | 81.8 | Confident | 79.5 | Confident | 3 Ų | 3 | 87.7 Ų | 87.7 | 2% | 0.02 | 41% | 0.413 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.6 | 153.6 | 175.3 | 64.9 | 0 | 0 | 0 | 0 | 111.3 | C21 Q38 C39 F40 | C21-C36 HydrophobicContact CB-CB 4.27Å; C21-C36 WeakPolarHBondContact CB-SG 3.27Å; C21-C36 WeakPolarHBondContact SG-CB 3.41Å; C21-C36 CovalentContact SG-SG 2.05Å; C21-C36 PolarHBondContact SG-SG 2.9Å; C36-Q38 PolarHBondContact O-N 2.9Å; C36-C39 PolarHBondContact O-N 3.05Å; C36-C39 VanDerWaalsContact O-N 3.12Å; C36-C39 PolarHBondContact SG-SG 2.76Å; C36-F40 PolarHBondContact O-N 3.03Å |
| 37 | R | 86.1 | Confident | 79.6 | Confident | 134 Ų | 134 | 87.5 Ų | 87.5 | 51% | 0.506 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -54.9 | -28.6 | -178.5 | 69.8 | -179.7 | -177.1 | -82.7 | 4.7 | 114.9 | H25 G26 I28 R41 | H25-R37 PolarHBondContact O-NH1 2.77Å; G26-R37 PolarHBondContact O-N 3.17Å; I28-R37 HydrophobicContact CD1-CB 4.18Å; I28-R37 HydrophobicContact CG1-CB 4.5Å; R37-R41 WeakPolarHBondContact O-CG 3.31Å; R37-R41 PolarHBondContact O-N 3.46Å |
| 38 | Q | 81.6 | Confident | 79.6 | Confident | 104 Ų | 104 | 86.6 Ų | 86.6 | 49% | 0.486 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -72.4 | -48.2 | 178.6 | -71 | 171.2 | -5 | 0 | 0 | 110.9 | C36 F40 R41 Q42 | C36-Q38 PolarHBondContact O-N 2.9Å; Q38-F40 VanDerWaalsContact C-N 3.34Å; Q38-R41 PolarHBondContact O-N 2.86Å; Q38-Q42 PolarHBondContact O-N 3.34Å |
| 39 | C | 77.7 | Confident | 79.6 | Confident | 10 Ų | 10 | 88.5 Ų | 88.5 | 7% | 0.068 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -64.2 | -40.3 | 174.6 | -63.1 | 0 | 0 | 0 | 0 | 111.3 | V20 C21 C36 R41 Q42 Y43 | V20-C39 HydrophobicContact CG1-CB 4.16Å; V20-C39 WeakPolarHBondContact CG1-SG 3.13Å; C21-C39 PolarHBondContact SG-SG 3.26Å; C36-C39 PolarHBondContact O-N 3.05Å; C36-C39 VanDerWaalsContact O-N 3.12Å; C36-C39 PolarHBondContact SG-SG 2.76Å; C39-R41 PolarHBondContact O-N 3.02Å; C39-Q42 WeakPolarHBondContact O-CB 3.24Å; C39-Q42 PolarHBondContact O-N 3.21Å; C39-Y43 HydrophobicContact CB-CD2 4.4Å; C39-Y43 VanDerWaalsContact O-CD2 3.24Å; C39-Y43 WeakPolarHBondContact O-CD2 3.42Å; C39-Y43 PolarHBondContact O-N 3.49Å |
| 40 | F | 81.9 | Confident | 79.7 | Confident | 43 Ų | 43 | 86.3 Ų | 86.3 | 19% | 0.189 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -56 | -38 | 176.1 | -178.8 | -98.9 | 0 | 0 | 0 | 112.4 | I28 L33 C36 Q38 Q42 A44 F49 | I28-F40 HydrophobicContact CD1-CB 3.72Å; I28-F40 HydrophobicContact CD1-CD1 3.89Å; I28-F40 HydrophobicContact CD1-CD2 4.28Å; I28-F40 HydrophobicContact CD1-CG 3.68Å; L33-F40 HydrophobicContact CD1-CD2 4.35Å; L33-F40 HydrophobicContact CD1-CE2 3.94Å; C36-F40 PolarHBondContact O-N 3.03Å; Q38-F40 VanDerWaalsContact C-N 3.34Å; F40-Q42 VanDerWaalsContact C-N 3.34Å; F40-Q42 PolarHBondContact O-N 2.75Å; F40-A44 HydrophobicContact CE1-CB 4.45Å; F40-A44 WeakPolarHBondContact O-CA 3.49Å; F40-A44 WeakPolarHBondContact O-CB 3.5Å; F40-A44 PolarHBondContact O-N 3.22Å; F40-F49 AromaticContact CE2-CD2 3.85Å; F40-F49 HydrophobicContact CE2-CD2 3.85Å; F40-F49 AromaticContact CE2-CE2 3.77Å; F40-F49 HydrophobicContact CE2-CE2 3.77Å; F40-F49 HydrophobicContact CE2-CG 4.43Å; F40-F49 HydrophobicContact CE2-CZ 4.3Å; F40-F49 HydrophobicContact CZ-CD1 4.21Å; F40-F49 AromaticContact CZ-CD2 3.81Å; F40-F49 HydrophobicContact CZ-CD2 3.81Å; F40-F49 HydrophobicContact CZ-CE1 4.39Å; F40-F49 HydrophobicContact CZ-CE2 4.01Å; F40-F49 AromaticContact CZ-CG 3.93Å; F40-F49 HydrophobicContact CZ-CG 3.93Å; F40-F49 HydrophobicContact CZ-CZ 4.3Å |
| 41 | R | 83.1 | Confident | 80 | Confident | 206 Ų | 206 | 88.4 Ų | 88.4 | 78% | 0.777 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -69 | -29.7 | 177.5 | -71.8 | 177.4 | 69.4 | 114.3 | 1.6 | 113.9 | R37 Q38 C39 | R37-R41 WeakPolarHBondContact O-CG 3.31Å; R37-R41 PolarHBondContact O-N 3.46Å; Q38-R41 PolarHBondContact O-N 2.86Å; C39-R41 PolarHBondContact O-N 3.02Å |
| 42 | Q | 81.3 | Confident | 80.1 | Confident | 130 Ų | 130 | 87.2 Ų | 87.2 | 61% | 0.607 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -72.7 | -48.2 | 177.1 | -66.4 | 172.7 | 7.8 | 0 | 0 | 109.7 | Q38 C39 F40 | Q38-Q42 PolarHBondContact O-N 3.34Å; C39-Q42 WeakPolarHBondContact O-CB 3.24Å; C39-Q42 PolarHBondContact O-N 3.21Å; F40-Q42 VanDerWaalsContact C-N 3.34Å; F40-Q42 PolarHBondContact O-N 2.75Å |
| 43 | Y | 76.5 | Confident | 80 | Confident | 75 Ų | 75 | 94 Ų | 94 | 29% | 0.294 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -86.3 | -6.7 | -177.5 | -63.6 | -69.8 | 0 | 0 | 0 | 114.4 | M35 C39 K45 D46 I47 | M35-Y43 HydrophobicContact SD-CD2 4.5Å; C39-Y43 HydrophobicContact CB-CD2 4.4Å; C39-Y43 VanDerWaalsContact O-CD2 3.24Å; C39-Y43 WeakPolarHBondContact O-CD2 3.42Å; C39-Y43 PolarHBondContact O-N 3.49Å; Y43-K45 PolarHBondContact O-N 3.44Å; Y43-D46 PolarHBondContact O-N 2.05Å; Y43-I47 WeakPolarHBondContact O-CB 3.49Å; Y43-I47 WeakPolarHBondContact O-CD1 3.14Å; Y43-I47 WeakPolarHBondContact O-CG1 3.39Å; Y43-I47 PolarHBondContact O-N 3.07Å |
| 44 | A | 79.5 | Confident | 80.2 | Confident | 16 Ų | 16 | 97.1 Ų | 97.1 | 13% | 0.132 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -54.4 | -40.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | F40 G48 F49 | F40-A44 HydrophobicContact CE1-CB 4.45Å; F40-A44 WeakPolarHBondContact O-CA 3.49Å; F40-A44 WeakPolarHBondContact O-CB 3.5Å; F40-A44 PolarHBondContact O-N 3.22Å; A44-G48 PolarHBondContact O-N 3.32Å; A44-F49 HydrophobicContact CB-CB 4.16Å; A44-F49 WeakPolarHBondContact O-CA 3.03Å; A44-F49 WeakPolarHBondContact O-CB 3.42Å; A44-F49 PolarHBondContact O-N 2.95Å |
| 45 | K | 78.8 | Confident | 80.5 | Confident | 183 Ų | 183 | 96.9 Ų | 96.9 | 80% | 0.796 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -66.3 | -43.9 | 177.2 | -68 | -174.7 | -179.8 | -175.1 | 0 | 112 | Y43 G48 | Y43-K45 PolarHBondContact O-N 3.44Å; K45-G48 PolarHBondContact O-N 3.48Å; K45-G48 VanDerWaalsContact O-N 3.12Å |
| 46 | D | 78.7 | Confident | 80.7 | Confident | 98 Ų | 98 | 101.7 Ų | 101.7 | 52% | 0.524 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -71.2 | -32.2 | -178.2 | -53.3 | -37.2 | 0 | 0 | 0 | 112.3 | I8 Y43 G48 | I8-D46 WeakPolarHBondContact CG2-O 3.44Å; Y43-D46 PolarHBondContact O-N 2.05Å; D46-G48 PolarHBondContact O-N 3.12Å |
| 47 | I | 78.8 | Confident | 80.6 | Confident | 34 Ų | 34 | 107.5 Ų | 107.5 | 17% | 0.174 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -74.2 | -14.8 | 173.9 | -59.4 | 159.9 | 0 | 0 | 0 | 111.2 | I13 L33 M35 Y43 F49 | I13-I47 HydrophobicContact CD1-CD1 4.24Å; I13-I47 HydrophobicContact CD1-CG1 3.59Å; L33-I47 HydrophobicContact CD2-CD1 4.29Å; M35-I47 HydrophobicContact CE-CD1 4.41Å; Y43-I47 WeakPolarHBondContact O-CB 3.49Å; Y43-I47 WeakPolarHBondContact O-CD1 3.14Å; Y43-I47 WeakPolarHBondContact O-CG1 3.39Å; Y43-I47 PolarHBondContact O-N 3.07Å; I47-F49 HydrophobicContact CB-CD2 3.89Å; I47-F49 HydrophobicContact CB-CE2 4.32Å; I47-F49 HydrophobicContact CG2-CD2 3.51Å; I47-F49 HydrophobicContact CG2-CE2 3.47Å; I47-F49 VanDerWaalsContact CG2-CE2 3.47Å |
| 48 | G | 82.5 | Confident | 80.3 | Confident | 51 Ų | 51 | 105.8 Ų | 105.8 | 53% | 0.526 | 52% | 0.515 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 85.2 | 16.4 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | A44 K45 D46 I50 | A44-G48 PolarHBondContact O-N 3.32Å; K45-G48 PolarHBondContact O-N 3.48Å; K45-G48 VanDerWaalsContact O-N 3.12Å; D46-G48 PolarHBondContact O-N 3.12Å; G48-I50 PolarHBondContact O-N 3.4Å |
| 49 | F | 82.2 | Confident | 80.2 | Confident | 87 Ų | 87 | 105.9 Ų | 105.9 | 38% | 0.382 | 52% | 0.517 | S | S | . | . | trans | -72.9 | 108.2 | 168.3 | -78.6 | -83 | 0 | 0 | 0 | 109.9 | L33 F40 A44 I47 | L33-F49 HydrophobicContact CD1-CE2 4.3Å; L33-F49 HydrophobicContact CD1-CZ 4.41Å; F40-F49 AromaticContact CE2-CD2 3.85Å; F40-F49 HydrophobicContact CE2-CD2 3.85Å; F40-F49 AromaticContact CE2-CE2 3.77Å; F40-F49 HydrophobicContact CE2-CE2 3.77Å; F40-F49 HydrophobicContact CE2-CG 4.43Å; F40-F49 HydrophobicContact CE2-CZ 4.3Å; F40-F49 HydrophobicContact CZ-CD1 4.21Å; F40-F49 AromaticContact CZ-CD2 3.81Å; F40-F49 HydrophobicContact CZ-CD2 3.81Å; F40-F49 HydrophobicContact CZ-CE1 4.39Å; F40-F49 HydrophobicContact CZ-CE2 4.01Å; F40-F49 AromaticContact CZ-CG 3.93Å; F40-F49 HydrophobicContact CZ-CG 3.93Å; F40-F49 HydrophobicContact CZ-CZ 4.3Å; A44-F49 HydrophobicContact CB-CB 4.16Å; A44-F49 WeakPolarHBondContact O-CA 3.03Å; A44-F49 WeakPolarHBondContact O-CB 3.42Å; A44-F49 PolarHBondContact O-N 2.95Å; I47-F49 HydrophobicContact CB-CD2 3.89Å; I47-F49 HydrophobicContact CB-CE2 4.32Å; I47-F49 HydrophobicContact CG2-CD2 3.51Å; I47-F49 HydrophobicContact CG2-CE2 3.47Å; I47-F49 VanDerWaalsContact CG2-CE2 3.47Å | ||
| 50 | I | 84.1 | Confident | 80.4 | Confident | 135 Ų | 135 | 112.8 Ų | 112.8 | 69% | 0.692 | 55% | 0.549 | S | S | * | . | trans | -93.2 | 139.1 | 169.6 | 58.6 | 170.8 | 0 | 0 | 0 | 110.3 | G48 L52 | G48-I50 PolarHBondContact O-N 3.4Å; I50-L52 HydrophobicContact CD1-CD2 3.91Å; I50-L52 HydrophobicContact CD1-CG 4.46Å; I50-L52 HydrophobicContact CG1-CD2 4.39Å; I50-L52 HydrophobicContact CG1-CG 4.44Å; I50-L52 PolarHBondContact O-N 2.97Å | ||
| 51 | K | 83.4 | Confident | 80.3 | Confident | 175 Ų | 175 | 118.2 Ų | 118.2 | 76% | 0.761 | 58% | 0.577 | S | S | * | * | trans | -74.9 | 106 | 169.1 | -171.5 | -168.6 | 178.7 | -126.9 | 0 | 107.1 | D53 | K51-D53 IonicContact NZ-OD2 2.76Å; K51-D53 PolarHBondContact NZ-OD2 3.24Å | ||
| 52 | L | 82.1 | Confident | 80 | Confident | 145 Ų | 145 | 110.8 Ų | 110.8 | 76% | 0.759 | 56% | 0.56 | S | S | * | * | trans | -77.7 | 121.1 | 161.4 | -62.6 | 172.2 | 0 | 0 | 0 | 106.1 | I50 | I50-L52 HydrophobicContact CD1-CD2 3.91Å; I50-L52 HydrophobicContact CD1-CG 4.46Å; I50-L52 HydrophobicContact CG1-CD2 4.39Å; I50-L52 HydrophobicContact CG1-CG 4.44Å; I50-L52 PolarHBondContact O-N 2.97Å | ||
| 53 | D | 72.4 | Confident | 79.9 | Confident | 201 Ų | 201 | 109.1 Ų | 109.1 | 100% | 1.075 | 56% | 0.556 | S | S | * | * | trans | -78.3 | 0 | 175.4 | -159.5 | -119.4 | 0 | 0 | 0 | 110.5 | K51 | K51-D53 IonicContact NZ-OD2 2.76Å; K51-D53 PolarHBondContact NZ-OD2 3.24Å |
Retrieved 53 of 53 residues in 18 ms
(Link to these results)