| 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 | 36.1 | Very low | 54.9 | Low | 239 Ų | 239 | 133 Ų | 133 | 100% | 1.177 | 80% | 0.795 | S | S | * | * | 0 | 109.9 | 0 | -171.3 | 172.2 | 174.6 | 0 | 0 | 105.5 | |||||
| 2 | I | 44.1 | Very low | 55.5 | Low | 145 Ų | 145 | 139.1 Ų | 139.1 | 74% | 0.744 | 80% | 0.803 | S | S | * | * | cis | -128 | 132.1 | 30.2 | -76.8 | 146.6 | 0 | 0 | 0 | 109.8 | L4 | I2-L4 HydrophobicContact CG2-CG 4.2Š| ||
| 3 | A | 54.3 | Low | 55.9 | Low | 86 Ų | 86 | 147 Ų | 147 | 71% | 0.711 | 81% | 0.812 | S | S | * | * | trans | -81.6 | 121.2 | 165.4 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 4 | L | 67.1 | Low | 56.5 | Low | 163 Ų | 163 | 152.4 Ų | 152.4 | 85% | 0.853 | 81% | 0.814 | S | S | * | * | trans | -101.5 | 81.8 | 162.4 | -83.8 | 164.1 | 0 | 0 | 0 | 108.3 | I2 S6 | I2-L4 HydrophobicContact CG2-CG 4.2Å; L4-S6 VanDerWaalsContact C-N 3.29Å; L4-S6 PolarHBondContact O-N 3.29Å | ||
| 5 | L | 56.7 | Low | 56.9 | Low | 157 Ų | 157 | 149.3 Ų | 149.3 | 82% | 0.822 | 80% | 0.797 | S | S | * | * | trans | -62.9 | 91.2 | 157.1 | -76.8 | 157.7 | 0 | 0 | 0 | 107.9 | V7 | L5-V7 PolarHBondContact O-N 3.03Š| ||
| 6 | S | 66.7 | Low | 57 | Low | 112 Ų | 112 | 146.9 Ų | 146.9 | 78% | 0.783 | 79% | 0.789 | S | S | * | * | trans | -90.8 | 98.9 | 165 | -169.9 | 0 | 0 | 0 | 0 | 109 | L4 S8 | L4-S6 VanDerWaalsContact C-N 3.29Å; L4-S6 PolarHBondContact O-N 3.29Å; S6-S8 PolarHBondContact O-N 3.21Å | ||
| 7 | V | 52.2 | Low | 57.2 | Low | 108 Ų | 108 | 143.7 Ų | 143.7 | 66% | 0.655 | 78% | 0.777 | S | S | * | * | trans | -61 | 97.4 | 171.4 | 174.9 | 0 | 0 | 0 | 0 | 108.6 | L5 K9 | L5-V7 PolarHBondContact O-N 3.03Å; V7-K9 HydrophobicContact CG1-CB 4.25Å; V7-K9 HydrophobicContact CG1-CD 4.01Å; V7-K9 HydrophobicContact CG1-CG 3.75Å; V7-K9 PolarHBondContact O-N 2.99Å | ||
| 8 | S | 60.1 | Low | 57.5 | Low | 109 Ų | 109 | 139.6 Ų | 139.6 | 76% | 0.762 | 76% | 0.757 | S | S | * | * | trans | -81.9 | 70.3 | 169.5 | -158.1 | 0 | 0 | 0 | 0 | 110 | S6 G10 | S6-S8 PolarHBondContact O-N 3.21Å; S8-G10 PolarHBondContact O-N 3.01Å | ||
| 9 | K | 53.6 | Low | 57.3 | Low | 192 Ų | 192 | 136.4 Ų | 136.4 | 84% | 0.835 | 74% | 0.739 | S | S | * | * | trans | -75.9 | 96.7 | 159.2 | -83.7 | 177.7 | 178.6 | 178.3 | 0 | 107.4 | V7 | V7-K9 HydrophobicContact CG1-CB 4.25Å; V7-K9 HydrophobicContact CG1-CD 4.01Å; V7-K9 HydrophobicContact CG1-CG 3.75Å; V7-K9 PolarHBondContact O-N 2.99Å | ||
| 10 | G | 56.6 | Low | 57.4 | Low | 72 Ų | 72 | 136.4 Ų | 136.4 | 74% | 0.742 | 73% | 0.732 | S | S | * | * | trans | 104.6 | 100.6 | 159.4 | 0 | 0 | 0 | 0 | 0 | 116.5 | S8 | S8-G10 PolarHBondContact O-N 3.01Š| ||
| 11 | A | 56.6 | Low | 57.7 | Low | 80 Ų | 80 | 134 Ų | 134 | 66% | 0.661 | 72% | 0.722 | S | S | * | * | trans | -163.1 | 82.6 | 156.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | R13 | A11-R13 PolarHBondContact O-N 3.49Š| ||
| 12 | K | 62.3 | Low | 58.9 | Low | 206 Ų | 206 | 127.5 Ų | 127.5 | 90% | 0.896 | 69% | 0.692 | S | S | * | * | 47.6 | 50.3 | 128.5 | -146.9 | 171.7 | -174.7 | -178.3 | 0 | 117.3 | R14 | K12-R14 PolarHBondContact O-N 3.02Š| |||
| 13 | R | 59.8 | Low | 59.7 | Low | 242 Ų | 242 | 124.7 Ų | 124.7 | 91% | 0.913 | 68% | 0.679 | S | S | * | * | trans | -82.7 | 32.2 | 171.4 | -100.2 | -171.3 | 176.1 | -155.7 | 0.7 | 114.4 | A11 | A11-R13 PolarHBondContact O-N 3.49Š| ||
| 14 | R | 65 | Low | 60 | Low | 222 Ų | 222 | 123.3 Ų | 123.3 | 84% | 0.838 | 66% | 0.662 | S | S | * | * | trans | -98.8 | 131.3 | 169.5 | -93.2 | -178.5 | -78.4 | 159.5 | -4.5 | 108.1 | K12 | K12-R14 PolarHBondContact O-N 3.02Š| ||
| 15 | N | 61.8 | Low | 60 | Low | 106 Ų | 106 | 119.4 Ų | 119.4 | 57% | 0.567 | 65% | 0.645 | S | S | * | * | S | Bend | trans | 94.1 | 54.2 | 163 | -142.9 | 50.4 | 0 | 0 | 0 | 119.1 | ||
| 16 | V | 59.2 | Low | 60.6 | Low | 111 Ų | 111 | 117.3 Ų | 117.3 | 67% | 0.673 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -148.3 | -28.9 | 146.9 | 140 | 0 | 0 | 0 | 0 | 109.5 | ||
| 17 | T | 59.7 | Low | 60.6 | Low | 93 Ų | 93 | 115.2 Ų | 115.2 | 57% | 0.571 | 62% | 0.62 | S | S | * | * | S | Bend | trans | -78.8 | -21.5 | 168.4 | 17.5 | 0 | 0 | 0 | 0 | 113.1 | K20 T21 | T17-K20 PolarHBondContact O-N 2.97Å; T17-T21 PolarHBondContact O-N 3.5Å; T17-T21 PolarHBondContact O-OG1 3.03Å |
| 18 | T | 62.5 | Low | 61.5 | Low | 69 Ų | 69 | 115.8 Ų | 115.8 | 42% | 0.423 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -76.7 | -26 | 178.3 | -45 | 0 | 0 | 0 | 0 | 112.9 | K20 T21 N22 | T18-K20 VanDerWaalsContact C-N 3.32Å; T18-T21 PolarHBondContact O-N 3.09Å; T18-N22 PolarHBondContact O-N 3.22Å |
| 19 | D | 54.5 | Low | 62.3 | Low | 79 Ų | 79 | 113.1 Ų | 113.1 | 42% | 0.422 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -76.2 | -19.5 | 169.9 | -67.3 | -43.3 | 0 | 0 | 0 | 113 | N22 N23 | D19-N22 PolarHBondContact O-OD1 3.27Å; D19-N23 VanDerWaalsContact O-CG 3.29Å; D19-N23 PolarHBondContact O-ND2 2.91Å |
| 20 | K | 58.4 | Low | 63.7 | Low | 137 Ų | 137 | 107 Ų | 107 | 60% | 0.596 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -81.1 | -37.1 | 166.8 | -67.6 | -175 | -179.8 | -178.6 | 0 | 110.7 | T17 T18 N22 N23 T24 | T17-K20 PolarHBondContact O-N 2.97Å; T18-K20 VanDerWaalsContact C-N 3.32Å; K20-N22 PolarHBondContact O-N 3.32Å; K20-N23 PolarHBondContact O-OD1 3.2Å; K20-T24 WeakPolarHBondContact O-CB 3.47Å; K20-T24 PolarHBondContact O-N 2.94Å; K20-T24 PolarHBondContact O-OG1 2.91Å |
| 21 | T | 64.6 | Low | 64.8 | Low | 85 Ų | 85 | 107.1 Ų | 107.1 | 52% | 0.521 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -68.7 | -37.6 | -177.7 | -52 | 0 | 0 | 0 | 0 | 112.9 | T17 T18 T25 | T17-T21 PolarHBondContact O-N 3.5Å; T17-T21 PolarHBondContact O-OG1 3.03Å; T18-T21 PolarHBondContact O-N 3.09Å; T21-T25 WeakPolarHBondContact O-CB 3.43Å; T21-T25 PolarHBondContact O-N 3.36Å; T21-T25 VanDerWaalsContact O-N 3.09Å; T21-T25 PolarHBondContact O-OG1 3.21Å |
| 22 | N | 61.1 | Low | 66 | Low | 103 Ų | 103 | 106.8 Ų | 106.8 | 55% | 0.551 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -74.9 | -31.9 | -179.1 | 67.8 | 6.9 | 0 | 0 | 0 | 114.2 | T18 D19 K20 | T18-N22 PolarHBondContact O-N 3.22Å; D19-N22 PolarHBondContact O-OD1 3.27Å; K20-N22 PolarHBondContact O-N 3.32Å |
| 23 | N | 61 | Low | 67.1 | Low | 87 Ų | 87 | 105.9 Ų | 105.9 | 47% | 0.465 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -83.9 | -27.7 | 176.3 | 74.3 | 10.7 | 0 | 0 | 0 | 112.7 | D19 K20 S27 | D19-N23 VanDerWaalsContact O-CG 3.29Å; D19-N23 PolarHBondContact O-ND2 2.91Å; K20-N23 PolarHBondContact O-OD1 3.2Å; N23-S27 WeakPolarHBondContact O-CB 3.33Å; N23-S27 PolarHBondContact O-N 2.72Å; N23-S27 PolarHBondContact O-OG 2.63Å |
| 24 | T | 61.4 | Low | 68.4 | Low | 56 Ų | 56 | 98.8 Ų | 98.8 | 34% | 0.344 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -81.9 | -29.4 | -179.7 | -49.8 | 0 | 0 | 0 | 0 | 109.8 | K20 Q28 | K20-T24 WeakPolarHBondContact O-CB 3.47Å; K20-T24 PolarHBondContact O-N 2.94Å; K20-T24 PolarHBondContact O-OG1 2.91Å; T24-Q28 HydrophobicContact CG2-CG 3.81Å; T24-Q28 WeakPolarHBondContact O-CA 3.34Å; T24-Q28 WeakPolarHBondContact O-CB 3.03Å; T24-Q28 WeakPolarHBondContact O-CG 3.03Å; T24-Q28 PolarHBondContact O-N 3.23Å; T24-Q28 PolarHBondContact O-OE1 3.01Å |
| 25 | T | 66.3 | Low | 69.4 | Low | 81 Ų | 81 | 94.9 Ų | 94.9 | 50% | 0.497 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.5 | -40.7 | 176.4 | -48.7 | 0 | 0 | 0 | 0 | 112.6 | T21 S29 | T21-T25 WeakPolarHBondContact O-CB 3.43Å; T21-T25 PolarHBondContact O-N 3.36Å; T21-T25 VanDerWaalsContact O-N 3.09Å; T21-T25 PolarHBondContact O-OG1 3.21Å; T25-S29 WeakPolarHBondContact O-CB 3.35Å; T25-S29 PolarHBondContact O-N 3.31Å |
| 26 | N | 69.8 | Low | 70.5 | Confident | 114 Ų | 114 | 93.8 Ų | 93.8 | 61% | 0.61 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -68 | -47.2 | 175.3 | -164 | -38.2 | 0 | 0 | 0 | 110.6 | Q28 S29 V30 | N26-Q28 PolarHBondContact O-N 3.44Å; N26-S29 PolarHBondContact O-N 2.77Å; N26-V30 WeakPolarHBondContact O-CG2 3.28Å; N26-V30 PolarHBondContact O-N 2.78Å |
| 27 | S | 66.4 | Low | 71.8 | Confident | 68 Ų | 68 | 89.5 Ų | 89.5 | 48% | 0.476 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.2 | -41.1 | 177.4 | -54.3 | 0 | 0 | 0 | 0 | 112.5 | N23 V30 S31 | N23-S27 WeakPolarHBondContact O-CB 3.33Å; N23-S27 PolarHBondContact O-N 2.72Å; N23-S27 PolarHBondContact O-OG 2.63Å; S27-V30 PolarHBondContact O-N 3.01Å; S27-S31 WeakPolarHBondContact O-CB 3.32Å; S27-S31 PolarHBondContact O-N 3.41Å; S27-S31 PolarHBondContact O-OG 3.14Å; S27-S31 VanDerWaalsContact O-OG 3.06Å |
| 28 | Q | 72 | Confident | 73 | Confident | 119 Ų | 119 | 89.8 Ų | 89.8 | 56% | 0.556 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.5 | -40.6 | 174.8 | -77.6 | 171.4 | -37.5 | 0 | 0 | 111.5 | T24 N26 S31 S32 | T24-Q28 HydrophobicContact CG2-CG 3.81Å; T24-Q28 WeakPolarHBondContact O-CA 3.34Å; T24-Q28 WeakPolarHBondContact O-CB 3.03Å; T24-Q28 WeakPolarHBondContact O-CG 3.03Å; T24-Q28 PolarHBondContact O-N 3.23Å; T24-Q28 PolarHBondContact O-OE1 3.01Å; N26-Q28 PolarHBondContact O-N 3.44Å; Q28-S31 PolarHBondContact O-N 2.9Å; Q28-S32 VanDerWaalsContact O-CB 3.32Å; Q28-S32 WeakPolarHBondContact O-CB 3.48Å; Q28-S32 PolarHBondContact O-N 3.38Å |
| 29 | S | 76.6 | Confident | 74.1 | Confident | 54 Ų | 54 | 88.9 Ų | 88.9 | 38% | 0.378 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.9 | -41.6 | 174.9 | -177.5 | 0 | 0 | 0 | 0 | 111.6 | T25 N26 R33 | T25-S29 WeakPolarHBondContact O-CB 3.35Å; T25-S29 PolarHBondContact O-N 3.31Å; N26-S29 PolarHBondContact O-N 2.77Å; S29-R33 VanDerWaalsContact O-CG 3.28Å; S29-R33 WeakPolarHBondContact O-CG 3.4Å; S29-R33 PolarHBondContact O-N 2.6Å |
| 30 | V | 81.8 | Confident | 75.6 | Confident | 62 Ų | 62 | 93 Ų | 93 | 38% | 0.376 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -67.7 | -46 | 177.2 | 173.8 | 0 | 0 | 0 | 0 | 110.8 | N26 S27 S32 R33 I34 | N26-V30 WeakPolarHBondContact O-CG2 3.28Å; N26-V30 PolarHBondContact O-N 2.78Å; S27-V30 PolarHBondContact O-N 3.01Å; V30-S32 VanDerWaalsContact C-N 3.31Å; V30-S32 PolarHBondContact O-N 2.84Å; V30-R33 WeakPolarHBondContact O-CB 3.33Å; V30-R33 PolarHBondContact O-N 3.5Å; V30-R33 VanDerWaalsContact O-N 3.14Å; V30-I34 HydrophobicContact CG1-CD1 3.66Å; V30-I34 HydrophobicContact CG1-CG1 4.26Å; V30-I34 WeakPolarHBondContact O-CG1 3.06Å; V30-I34 PolarHBondContact O-N 3.45Å |
| 31 | S | 80.2 | Confident | 76.9 | Confident | 75 Ų | 75 | 90.4 Ų | 90.4 | 52% | 0.524 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.6 | -40.5 | 175.9 | -65.2 | 0 | 0 | 0 | 0 | 112.1 | S27 Q28 I34 M35 | S27-S31 WeakPolarHBondContact O-CB 3.32Å; S27-S31 PolarHBondContact O-N 3.41Å; S27-S31 PolarHBondContact O-OG 3.14Å; S27-S31 VanDerWaalsContact O-OG 3.06Å; Q28-S31 PolarHBondContact O-N 2.9Å; S31-I34 PolarHBondContact O-N 3.48Å; S31-M35 VanDerWaalsContact O-CB 3.32Å; S31-M35 WeakPolarHBondContact O-CB 3.47Å; S31-M35 PolarHBondContact O-N 3.19Å |
| 32 | S | 82.3 | Confident | 77.8 | Confident | 74 Ų | 74 | 94 Ų | 94 | 52% | 0.517 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.6 | -44.7 | 174.2 | 177.2 | 0 | 0 | 0 | 0 | 111.5 | Q28 V30 M35 S36 | Q28-S32 VanDerWaalsContact O-CB 3.32Å; Q28-S32 WeakPolarHBondContact O-CB 3.48Å; Q28-S32 PolarHBondContact O-N 3.38Å; V30-S32 VanDerWaalsContact C-N 3.31Å; V30-S32 PolarHBondContact O-N 2.84Å; S32-M35 PolarHBondContact O-N 2.9Å; S32-S36 PolarHBondContact O-N 3.06Å; S32-S36 PolarHBondContact O-OG 3.33Å |
| 33 | R | 85.4 | Confident | 78.8 | Confident | 186 Ų | 186 | 92.5 Ų | 92.5 | 70% | 0.702 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.9 | -42.9 | 175.6 | -73.4 | 173.5 | 176.3 | -168.4 | -0.3 | 112.6 | S29 V30 G37 | S29-R33 VanDerWaalsContact O-CG 3.28Å; S29-R33 WeakPolarHBondContact O-CG 3.4Å; S29-R33 PolarHBondContact O-N 2.6Å; V30-R33 WeakPolarHBondContact O-CB 3.33Å; V30-R33 PolarHBondContact O-N 3.5Å; V30-R33 VanDerWaalsContact O-N 3.14Å; R33-G37 PolarHBondContact O-N 2.81Å |
| 34 | I | 87.4 | Confident | 79.9 | Confident | 94 Ų | 94 | 94 Ų | 94 | 48% | 0.482 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.1 | -44.2 | 177.8 | -68 | 167.6 | 0 | 0 | 0 | 110.8 | V30 S31 G37 L38 | V30-I34 HydrophobicContact CG1-CD1 3.66Å; V30-I34 HydrophobicContact CG1-CG1 4.26Å; V30-I34 WeakPolarHBondContact O-CG1 3.06Å; V30-I34 PolarHBondContact O-N 3.45Å; S31-I34 PolarHBondContact O-N 3.48Å; I34-G37 CarbonylContact O-C 3.49Å; I34-G37 VanDerWaalsContact O-CA 3.3Å; I34-G37 WeakPolarHBondContact O-CA 3.3Å; I34-G37 PolarHBondContact O-N 2.8Å; I34-L38 HydrophobicContact CG2-CD1 3.71Å; I34-L38 HydrophobicContact CG2-CG 4.4Å; I34-L38 PolarHBondContact O-N 3.05Å |
| 35 | M | 84.5 | Confident | 80.9 | Confident | 139 Ų | 139 | 96.6 Ų | 96.6 | 69% | 0.685 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.3 | -46.1 | 179.1 | -173.4 | 67.5 | 77.2 | 0 | 0 | 111.3 | S31 S32 G37 L38 G39 | S31-M35 VanDerWaalsContact O-CB 3.32Å; S31-M35 WeakPolarHBondContact O-CB 3.47Å; S31-M35 PolarHBondContact O-N 3.19Å; S32-M35 PolarHBondContact O-N 2.9Å; M35-G37 PolarHBondContact O-N 3.37Å; M35-L38 PolarHBondContact O-N 3.13Å; M35-G39 PolarHBondContact O-N 2.99Å; M35-G39 VanDerWaalsContact O-N 3.13Å |
| 36 | S | 85 | Confident | 81.4 | Confident | 84 Ų | 84 | 98.8 Ų | 98.8 | 59% | 0.587 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -59.9 | -37.4 | 171.6 | -63.7 | 0 | 0 | 0 | 0 | 111.5 | S32 G39 W40 | S32-S36 PolarHBondContact O-N 3.06Å; S32-S36 PolarHBondContact O-OG 3.33Å; S36-G39 PolarHBondContact O-N 3.39Å; S36-W40 PolarHBondContact O-N 2.86Å |
| 37 | G | 86.6 | Confident | 81.6 | Confident | 21 Ų | 21 | 98.4 Ų | 98.4 | 22% | 0.216 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -60.2 | -46.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | R33 I34 M35 G39 W40 F41 | R33-G37 PolarHBondContact O-N 2.81Å; I34-G37 CarbonylContact O-C 3.49Å; I34-G37 VanDerWaalsContact O-CA 3.3Å; I34-G37 WeakPolarHBondContact O-CA 3.3Å; I34-G37 PolarHBondContact O-N 2.8Å; M35-G37 PolarHBondContact O-N 3.37Å; G37-G39 VanDerWaalsContact C-N 3.34Å; G37-W40 VanDerWaalsContact CA-NE1 3.29Å; G37-W40 PolarHBondContact O-NE1 2.89Å; G37-F41 WeakPolarHBondContact O-CB 3.32Å; G37-F41 PolarHBondContact O-N 3.38Å |
| 38 | L | 85.3 | Confident | 82 | Confident | 99 Ų | 99 | 100.9 Ų | 100.9 | 52% | 0.518 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -70 | -34.6 | 179.7 | -76.3 | 157.5 | 0 | 0 | 0 | 111.6 | I34 M35 F41 W42 | I34-L38 HydrophobicContact CG2-CD1 3.71Å; I34-L38 HydrophobicContact CG2-CG 4.4Å; I34-L38 PolarHBondContact O-N 3.05Å; M35-L38 PolarHBondContact O-N 3.13Å; L38-F41 PolarHBondContact O-N 3.08Å; L38-W42 WeakPolarHBondContact O-CB 3.5Å; L38-W42 PolarHBondContact O-N 3.25Å |
| 39 | G | 86 | Confident | 82.2 | Confident | 49 Ų | 49 | 98.3 Ų | 98.3 | 51% | 0.505 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.7 | -43.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | M35 S36 G37 F41 P43 | M35-G39 PolarHBondContact O-N 2.99Å; M35-G39 VanDerWaalsContact O-N 3.13Å; S36-G39 PolarHBondContact O-N 3.39Å; G37-G39 VanDerWaalsContact C-N 3.34Å; G39-F41 VanDerWaalsContact C-N 3.31Å; G39-P43 WeakPolarHBondContact O-CD 3.36Å |
| 40 | W | 84.7 | Confident | 82.3 | Confident | 167 Ų | 167 | 103.1 Ų | 103.1 | 63% | 0.633 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -73.1 | -26.1 | 177 | 76.2 | -94.8 | 0 | 0 | 0 | 112.7 | S36 G37 P43 F44 | S36-W40 PolarHBondContact O-N 2.86Å; G37-W40 VanDerWaalsContact CA-NE1 3.29Å; G37-W40 PolarHBondContact O-NE1 2.89Å; W40-P43 WeakPolarHBondContact O-CD 3.37Å; W40-P43 WeakPolarHBondContact O-CG 3.44Å; W40-F44 HydrophobicContact CE3-CD2 4.43Å; W40-F44 AromaticContact CE3-CE2 3.99Å; W40-F44 HydrophobicContact CE3-CE2 3.99Å; W40-F44 HydrophobicContact CZ3-CE2 4.2Å; W40-F44 WeakPolarHBondContact O-CD2 3.35Å; W40-F44 WeakPolarHBondContact O-CE2 3.45Å |
| 41 | F | 86 | Confident | 82 | Confident | 82 Ų | 82 | 104.7 Ų | 104.7 | 36% | 0.36 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -84.9 | -28.1 | -179 | -168.7 | -134 | 0 | 0 | 0 | 113.5 | G37 L38 G39 F44 F45 | G37-F41 WeakPolarHBondContact O-CB 3.32Å; G37-F41 PolarHBondContact O-N 3.38Å; L38-F41 PolarHBondContact O-N 3.08Å; G39-F41 VanDerWaalsContact C-N 3.31Å; F41-F44 HydrophobicContact CD2-CB 4.26Å; F41-F44 HydrophobicContact CD2-CD2 4.42Å; F41-F44 HydrophobicContact CE2-CB 4.39Å; F41-F44 WeakPolarHBondContact O-CB 3.37Å; F41-F44 PolarHBondContact O-N 3.33Å; F41-F44 VanDerWaalsContact O-N 3.08Å; F41-F45 AromaticContact CD1-CD2 3.55Å; F41-F45 HydrophobicContact CD1-CD2 3.55Å; F41-F45 AromaticContact CD1-CE2 3.12Å; F41-F45 HydrophobicContact CD1-CE2 3.12Å; F41-F45 AromaticContact CD1-CZ 3.94Å; F41-F45 HydrophobicContact CD1-CZ 3.94Å; F41-F45 AromaticContact CE1-CD2 3.55Å; F41-F45 HydrophobicContact CE1-CD2 3.55Å; F41-F45 HydrophobicContact CE1-CE1 4.11Å; F41-F45 AromaticContact CE1-CE2 2.8Å; F41-F45 HydrophobicContact CE1-CE2 2.8Å; F41-F45 HydrophobicContact CE1-CG 4.47Å; F41-F45 AromaticContact CE1-CZ 3.12Å; F41-F45 HydrophobicContact CE1-CZ 3.12Å; F41-F45 HydrophobicContact CG-CD2 4.2Å; F41-F45 HydrophobicContact CG-CE2 4.16Å; F41-F45 HydrophobicContact CZ-CD2 4.09Å; F41-F45 HydrophobicContact CZ-CE1 4.17Å; F41-F45 AromaticContact CZ-CE2 3.59Å; F41-F45 HydrophobicContact CZ-CE2 3.59Å; F41-F45 AromaticContact CZ-CZ 3.58Å; F41-F45 HydrophobicContact CZ-CZ 3.58Å; F41-F45 PolarHBondContact O-N 2.87Å |
| 42 | W | 83.7 | Confident | 81.7 | Confident | 160 Ų | 160 | 105.7 Ų | 105.7 | 61% | 0.606 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -48.6 | -46.3 | 177.5 | -172.7 | -107.8 | 0 | 0 | 0 | 115.6 | L38 F44 F45 K46 | L38-W42 WeakPolarHBondContact O-CB 3.5Å; L38-W42 PolarHBondContact O-N 3.25Å; W42-F44 VanDerWaalsContact C-N 3.32Å; W42-F44 PolarHBondContact O-N 3.26Å; W42-F45 PolarHBondContact O-N 3.4Å; W42-K46 VanDerWaalsContact CZ2-CE 3.44Å; W42-K46 PolarHBondContact O-N 3.02Å |
| 43 | P | 81.7 | Confident | 81.4 | Confident | 72 Ų | 72 | 106.7 Ų | 106.7 | 47% | 0.468 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.2 | -34.1 | 178.5 | 24.2 | -34.8 | 0 | 0 | 0 | 113.2 | G39 W40 F45 K46 Q47 | G39-P43 WeakPolarHBondContact O-CD 3.36Å; W40-P43 WeakPolarHBondContact O-CD 3.37Å; W40-P43 WeakPolarHBondContact O-CG 3.44Å; P43-F45 VanDerWaalsContact C-N 3.32Å; P43-F45 PolarHBondContact O-N 3.09Å; P43-K46 PolarHBondContact O-N 3.44Å; P43-K46 VanDerWaalsContact O-N 3.09Å; P43-Q47 PolarHBondContact O-N 3.2Å |
| 44 | F | 84 | Confident | 80.9 | Confident | 118 Ų | 118 | 105.4 Ų | 105.4 | 52% | 0.518 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.9 | -39.2 | 176.5 | -68.2 | -83.7 | 0 | 0 | 0 | 111.6 | W40 F41 W42 K46 Q47 L48 | W40-F44 HydrophobicContact CE3-CD2 4.43Å; W40-F44 AromaticContact CE3-CE2 3.99Å; W40-F44 HydrophobicContact CE3-CE2 3.99Å; W40-F44 HydrophobicContact CZ3-CE2 4.2Å; W40-F44 WeakPolarHBondContact O-CD2 3.35Å; W40-F44 WeakPolarHBondContact O-CE2 3.45Å; F41-F44 HydrophobicContact CD2-CB 4.26Å; F41-F44 HydrophobicContact CD2-CD2 4.42Å; F41-F44 HydrophobicContact CE2-CB 4.39Å; F41-F44 WeakPolarHBondContact O-CB 3.37Å; F41-F44 PolarHBondContact O-N 3.33Å; F41-F44 VanDerWaalsContact O-N 3.08Å; W42-F44 VanDerWaalsContact C-N 3.32Å; W42-F44 PolarHBondContact O-N 3.26Å; F44-K46 VanDerWaalsContact C-N 3.28Å; F44-K46 PolarHBondContact O-N 3.41Å; F44-Q47 PolarHBondContact O-N 3.09Å; F44-L48 PolarHBondContact O-N 2.95Å; F44-L48 VanDerWaalsContact O-N 3.09Å |
| 45 | F | 83 | Confident | 80.4 | Confident | 111 Ų | 111 | 105.8 Ų | 105.8 | 49% | 0.487 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -69.5 | -19.7 | 173.4 | -84.2 | -57.8 | 0 | 0 | 0 | 114.6 | F41 W42 P43 P49 | F41-F45 AromaticContact CD1-CD2 3.55Å; F41-F45 HydrophobicContact CD1-CD2 3.55Å; F41-F45 AromaticContact CD1-CE2 3.12Å; F41-F45 HydrophobicContact CD1-CE2 3.12Å; F41-F45 AromaticContact CD1-CZ 3.94Å; F41-F45 HydrophobicContact CD1-CZ 3.94Å; F41-F45 AromaticContact CE1-CD2 3.55Å; F41-F45 HydrophobicContact CE1-CD2 3.55Å; F41-F45 HydrophobicContact CE1-CE1 4.11Å; F41-F45 AromaticContact CE1-CE2 2.8Å; F41-F45 HydrophobicContact CE1-CE2 2.8Å; F41-F45 HydrophobicContact CE1-CG 4.47Å; F41-F45 AromaticContact CE1-CZ 3.12Å; F41-F45 HydrophobicContact CE1-CZ 3.12Å; F41-F45 HydrophobicContact CG-CD2 4.2Å; F41-F45 HydrophobicContact CG-CE2 4.16Å; F41-F45 HydrophobicContact CZ-CD2 4.09Å; F41-F45 HydrophobicContact CZ-CE1 4.17Å; F41-F45 AromaticContact CZ-CE2 3.59Å; F41-F45 HydrophobicContact CZ-CE2 3.59Å; F41-F45 AromaticContact CZ-CZ 3.58Å; F41-F45 HydrophobicContact CZ-CZ 3.58Å; F41-F45 PolarHBondContact O-N 2.87Å; W42-F45 PolarHBondContact O-N 3.4Å; P43-F45 VanDerWaalsContact C-N 3.32Å; P43-F45 PolarHBondContact O-N 3.09Å; F45-P49 WeakPolarHBondContact O-CD 3.17Å; F45-P49 WeakPolarHBondContact O-CG 2.78Å |
| 46 | K | 78 | Confident | 79.9 | Confident | 127 Ų | 127 | 101.1 Ų | 101.1 | 55% | 0.552 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -84.1 | -31.7 | 171.8 | -69.7 | -67.6 | -175.3 | 179.4 | 0 | 111.6 | W42 P43 F44 P49 | W42-K46 VanDerWaalsContact CZ2-CE 3.44Å; W42-K46 PolarHBondContact O-N 3.02Å; P43-K46 PolarHBondContact O-N 3.44Å; P43-K46 VanDerWaalsContact O-N 3.09Å; F44-K46 VanDerWaalsContact C-N 3.28Å; F44-K46 PolarHBondContact O-N 3.41Å; K46-P49 WeakPolarHBondContact O-CD 3.01Å |
| 47 | Q | 73.7 | Confident | 79.3 | Confident | 106 Ų | 106 | 102.5 Ų | 102.5 | 50% | 0.495 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -69.7 | -40.2 | 176.4 | -163.9 | 65.1 | 46.6 | 0 | 0 | 112.2 | P43 F44 Y50 H51 | P43-Q47 PolarHBondContact O-N 3.2Å; F44-Q47 PolarHBondContact O-N 3.09Å; Q47-Y50 PolarHBondContact O-N 3.19Å; Q47-H51 PolarHBondContact NE2-CD2 3.29Å; Q47-H51 PolarHBondContact NE2-NE2 3.21Å; Q47-H51 PolarHBondContact O-CD2 2.79Å; Q47-H51 PolarHBondContact O-N 3.35Å |
| 48 | L | 74.2 | Confident | 78.4 | Confident | 119 Ų | 119 | 107.5 Ų | 107.5 | 62% | 0.623 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -58 | -57.3 | -179 | -128.2 | 84.3 | 0 | 0 | 0 | 114.2 | F44 Y50 H51 V52 | F44-L48 PolarHBondContact O-N 2.95Å; F44-L48 VanDerWaalsContact O-N 3.09Å; L48-Y50 VanDerWaalsContact C-N 3.27Å; L48-Y50 PolarHBondContact O-N 3.21Å; L48-H51 PolarHBondContact O-N 3Å; L48-V52 WeakPolarHBondContact O-CG2 3.02Å; L48-V52 PolarHBondContact O-N 3.03Å |
| 49 | P | 75.5 | Confident | 77.9 | Confident | 65 Ų | 65 | 109.5 Ų | 109.5 | 42% | 0.422 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -65.6 | -31.6 | -177.7 | 26.9 | -34.3 | 0 | 0 | 0 | 111.7 | F45 K46 V52 C53 | F45-P49 WeakPolarHBondContact O-CD 3.17Å; F45-P49 WeakPolarHBondContact O-CG 2.78Å; K46-P49 WeakPolarHBondContact O-CD 3.01Å; P49-V52 VanDerWaalsContact CA-CG2 3.5Å; P49-C53 WeakPolarHBondContact O-CB 3.47Å; P49-C53 PolarHBondContact O-N 3.37Å |
| 50 | Y | 79.6 | Confident | 77 | Confident | 155 Ų | 155 | 109.9 Ų | 109.9 | 61% | 0.608 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.9 | -42.1 | 176.2 | -173.2 | -101.6 | 0 | 0 | 0 | 111.4 | Q47 L48 R54 | Q47-Y50 PolarHBondContact O-N 3.19Å; L48-Y50 VanDerWaalsContact C-N 3.27Å; L48-Y50 PolarHBondContact O-N 3.21Å; Y50-R54 WeakPolarHBondContact O-CB 3.36Å; Y50-R54 PolarHBondContact O-N 3.47Å; Y50-R54 VanDerWaalsContact O-N 3.07Å |
| 51 | H | 74.5 | Confident | 75.8 | Confident | 96 Ų | 96 | 109.1 Ų | 109.1 | 44% | 0.444 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -70.4 | -47.1 | 174.6 | -83 | -80.2 | 0 | 0 | 0 | 112.8 | Q47 L48 C53 R54 I55 | Q47-H51 PolarHBondContact NE2-CD2 3.29Å; Q47-H51 PolarHBondContact NE2-NE2 3.21Å; Q47-H51 PolarHBondContact O-CD2 2.79Å; Q47-H51 PolarHBondContact O-N 3.35Å; L48-H51 PolarHBondContact O-N 3Å; H51-C53 VanDerWaalsContact C-N 3.31Å; H51-C53 PolarHBondContact O-N 2.86Å; H51-R54 PolarHBondContact O-N 3.07Å; H51-R54 VanDerWaalsContact O-N 3.15Å; H51-I55 HydrophobicContact CB-CD1 4.27Å; H51-I55 WeakPolarHBondContact O-CD1 3.36Å; H51-I55 PolarHBondContact O-N 2.87Å |
| 52 | V | 75.5 | Confident | 75 | Confident | 96 Ų | 96 | 108.6 Ų | 108.6 | 58% | 0.582 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -65.8 | -34.3 | 179.4 | -72.5 | 0 | 0 | 0 | 0 | 112.6 | L48 P49 R54 G56 | L48-V52 WeakPolarHBondContact O-CG2 3.02Å; L48-V52 PolarHBondContact O-N 3.03Å; P49-V52 VanDerWaalsContact CA-CG2 3.5Å; V52-R54 VanDerWaalsContact C-N 3.35Å; V52-G56 PolarHBondContact O-N 3.36Å |
| 53 | C | 74.2 | Confident | 73.6 | Confident | 95 Ų | 95 | 112.6 Ų | 112.6 | 64% | 0.642 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -68.1 | -35.7 | 174.3 | -158 | 0 | 0 | 0 | 0 | 111.1 | P49 H51 N57 | P49-C53 WeakPolarHBondContact O-CB 3.47Å; P49-C53 PolarHBondContact O-N 3.37Å; H51-C53 VanDerWaalsContact C-N 3.31Å; H51-C53 PolarHBondContact O-N 2.86Å; C53-N57 WeakPolarHBondContact O-CB 3.4Å; C53-N57 PolarHBondContact O-N 3.15Å |
| 54 | R | 75.6 | Confident | 73.1 | Confident | 159 Ų | 159 | 114.7 Ų | 114.7 | 60% | 0.6 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -73.4 | -39.7 | 174.3 | -150.2 | -150 | -175.1 | 169.6 | 4 | 113.4 | Y50 H51 V52 G56 N57 L58 | Y50-R54 WeakPolarHBondContact O-CB 3.36Å; Y50-R54 PolarHBondContact O-N 3.47Å; Y50-R54 VanDerWaalsContact O-N 3.07Å; H51-R54 PolarHBondContact O-N 3.07Å; H51-R54 VanDerWaalsContact O-N 3.15Å; V52-R54 VanDerWaalsContact C-N 3.35Å; R54-G56 VanDerWaalsContact C-N 3.31Å; R54-N57 PolarHBondContact O-N 3.4Å; R54-L58 PolarHBondContact O-N 2.93Å |
| 55 | I | 76.9 | Confident | 72.6 | Confident | 102 Ų | 102 | 114.5 Ų | 114.5 | 52% | 0.523 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -59.9 | -45.1 | 172.2 | -88.1 | 88.5 | 0 | 0 | 0 | 109.4 | H51 L58 F59 | H51-I55 HydrophobicContact CB-CD1 4.27Å; H51-I55 WeakPolarHBondContact O-CD1 3.36Å; H51-I55 PolarHBondContact O-N 2.87Å; I55-L58 PolarHBondContact O-N 2.88Å; I55-F59 PolarHBondContact O-N 3.31Å |
| 56 | G | 75 | Confident | 72 | Confident | 40 Ų | 40 | 114.7 Ų | 114.7 | 41% | 0.412 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -63.7 | -39.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113 | V52 R54 L58 F59 G60 | V52-G56 PolarHBondContact O-N 3.36Å; R54-G56 VanDerWaalsContact C-N 3.31Å; G56-L58 VanDerWaalsContact C-N 3.29Å; G56-L58 PolarHBondContact O-N 3.42Å; G56-F59 PolarHBondContact O-N 2.95Å; G56-G60 PolarHBondContact O-N 3.21Å |
| 57 | N | 72.3 | Confident | 71.6 | Confident | 114 Ų | 114 | 113.9 Ų | 113.9 | 61% | 0.61 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -66.8 | -28.9 | 175.1 | -168.6 | 54.6 | 0 | 0 | 0 | 113.1 | C53 R54 | C53-N57 WeakPolarHBondContact O-CB 3.4Å; C53-N57 PolarHBondContact O-N 3.15Å; R54-N57 PolarHBondContact O-N 3.4Å |
| 58 | L | 67.9 | Low | 71.5 | Confident | 125 Ų | 125 | 114.4 Ų | 114.4 | 65% | 0.654 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -76.5 | -37 | 172.9 | -91 | 151.3 | 0 | 0 | 0 | 112.6 | R54 I55 G56 | R54-L58 PolarHBondContact O-N 2.93Å; I55-L58 PolarHBondContact O-N 2.88Å; G56-L58 VanDerWaalsContact C-N 3.29Å; G56-L58 PolarHBondContact O-N 3.42Å |
| 59 | F | 74.9 | Confident | 71.3 | Confident | 142 Ų | 142 | 114.1 Ų | 114.1 | 62% | 0.623 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -77.4 | -30.6 | 179.5 | -145.8 | -96.8 | 0 | 0 | 0 | 112.4 | I55 G56 Y63 | I55-F59 PolarHBondContact O-N 3.31Å; G56-F59 PolarHBondContact O-N 2.95Å; F59-Y63 HydrophobicContact CD1-CD2 4.15Å; F59-Y63 HydrophobicContact CD1-CE2 4.06Å; F59-Y63 AromaticContact CE1-CD2 3.99Å; F59-Y63 HydrophobicContact CE1-CD2 3.99Å; F59-Y63 AromaticContact CE1-CE2 3.43Å; F59-Y63 HydrophobicContact CE1-CE2 3.43Å; F59-Y63 VanDerWaalsContact CE1-CE2 3.43Å; F59-Y63 AromaticContact CZ-CE2 3.99Å; F59-Y63 HydrophobicContact CZ-CE2 3.99Å |
| 60 | G | 66.5 | Low | 71 | Confident | 57 Ų | 57 | 117.6 Ų | 117.6 | 59% | 0.588 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.8 | -9.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | G56 | G56-G60 PolarHBondContact O-N 3.21Š|
| 61 | L | 59.7 | Low | 70.4 | Confident | 151 Ų | 151 | 114.8 Ų | 114.8 | 79% | 0.791 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.3 | -2.9 | 176.2 | -144.3 | 95.5 | 0 | 0 | 0 | 113.2 | ||
| 62 | G | 69.6 | Low | 70 | Confident | 70 Ų | 70 | 116.3 Ų | 116.3 | 72% | 0.722 | 64% | 0.642 | S | S | * | * | trans | -120.4 | 2.8 | -175.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 63 | Y | 52.4 | Low | 69.5 | Low | 245 Ų | 245 | 118.2 Ų | 118.2 | 96% | 0.961 | 65% | 0.648 | S | S | * | * | trans | -107.3 | 0 | 166.8 | -93.8 | -85.4 | 0 | 0 | 0 | 109.2 | F59 | F59-Y63 HydrophobicContact CD1-CD2 4.15Å; F59-Y63 HydrophobicContact CD1-CE2 4.06Å; F59-Y63 AromaticContact CE1-CD2 3.99Å; F59-Y63 HydrophobicContact CE1-CD2 3.99Å; F59-Y63 AromaticContact CE1-CE2 3.43Å; F59-Y63 HydrophobicContact CE1-CE2 3.43Å; F59-Y63 VanDerWaalsContact CE1-CE2 3.43Å; F59-Y63 AromaticContact CZ-CE2 3.99Å; F59-Y63 HydrophobicContact CZ-CE2 3.99Å |
Retrieved 63 of 63 residues in 33 ms
(Link to these results)