| 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 | 55 | Low | 62.3 | Low | 236 Ų | 236 | 118.9 Ų | 118.9 | 100% | 1.163 | 66% | 0.663 | S | S | * | * | 0 | 103.9 | 0 | -63.1 | 165.4 | 101 | 0 | 0 | 107 | |||||
| 2 | P | 53.7 | Low | 63.3 | Low | 99 Ų | 99 | 117.3 Ų | 117.3 | 64% | 0.643 | 65% | 0.651 | S | S | * | * | trans | -72.2 | 141.3 | -178.6 | 29.4 | -32.3 | 0 | 0 | 0 | 110 | S4 | P2-S4 PolarHBondContact O-N 2.93Š| ||
| 3 | P | 59 | Low | 64.5 | Low | 93 Ų | 93 | 116.8 Ų | 116.8 | 60% | 0.604 | 65% | 0.646 | S | S | * | * | trans | -65.6 | 128.9 | -175.5 | 26.3 | -33.3 | 0 | 0 | 0 | 110.7 | G5 L6 | P3-G5 PolarHBondContact O-N 3.14Å; P3-L6 HydrophobicContact CG-CD1 4Å; P3-L6 PolarHBondContact O-N 3.01Å | ||
| 4 | S | 62.5 | Low | 65.4 | Low | 102 Ų | 102 | 113.2 Ų | 113.2 | 71% | 0.713 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.8 | -11.7 | -172 | -48.8 | 0 | 0 | 0 | 0 | 115.5 | P2 | P2-S4 PolarHBondContact O-N 2.93Š|
| 5 | G | 61.4 | Low | 66 | Low | 57 Ų | 57 | 112.8 Ų | 112.8 | 59% | 0.588 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.8 | -30.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | P3 R7 | P3-G5 PolarHBondContact O-N 3.14Å; G5-R7 VanDerWaalsContact C-N 3.32Å; G5-R7 PolarHBondContact O-N 3.25Å |
| 6 | L | 59 | Low | 66.6 | Low | 121 Ų | 121 | 112.6 Ų | 112.6 | 63% | 0.634 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.9 | -15.2 | -178.2 | -87.2 | 110.4 | 0 | 0 | 0 | 114 | P3 L9 P10 | P3-L6 HydrophobicContact CG-CD1 4Å; P3-L6 PolarHBondContact O-N 3.01Å; L6-L9 WeakPolarHBondContact O-CB 3.41Å; L6-P10 WeakPolarHBondContact O-CD 3.48Å |
| 7 | R | 64.3 | Low | 67.3 | Low | 205 Ų | 205 | 116.2 Ų | 116.2 | 77% | 0.774 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80 | -19.5 | 178 | -71 | -155.2 | 165.3 | 174.3 | -2.8 | 113.9 | G5 P10 | G5-R7 VanDerWaalsContact C-N 3.32Å; G5-R7 PolarHBondContact O-N 3.25Å; R7-P10 WeakPolarHBondContact O-CD 3.48Å |
| 8 | L | 63.7 | Low | 67.7 | Low | 97 Ų | 97 | 115.7 Ų | 115.7 | 51% | 0.508 | 62% | 0.621 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86.4 | -20 | 175.1 | -75.9 | 152.9 | 0 | 0 | 0 | 112.1 | L11 L12 | L8-L11 WeakPolarHBondContact O-CB 2.99Å; L8-L11 PolarHBondContact O-N 3.43Å; L8-L12 HydrophobicContact CB-CD1 4.21Å; L8-L12 WeakPolarHBondContact O-CB 3.42Å; L8-L12 WeakPolarHBondContact O-CG 3.38Å; L8-L12 PolarHBondContact O-N 3.45Å |
| 9 | L | 67.7 | Low | 67.9 | Low | 92 Ų | 92 | 116.2 Ų | 116.2 | 48% | 0.482 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -56.6 | -44.5 | 179.3 | -160.7 | 140.5 | 0 | 0 | 0 | 114.2 | L6 L11 L12 L13 | L6-L9 WeakPolarHBondContact O-CB 3.41Å; L9-L11 PolarHBondContact O-N 2.96Å; L9-L12 PolarHBondContact O-N 2.77Å; L9-L13 HydrophobicContact CD2-CD1 3.74Å; L9-L13 HydrophobicContact CG-CD1 4.48Å; L9-L13 PolarHBondContact O-N 3.39Å; L9-L13 VanDerWaalsContact O-N 3.11Å |
| 10 | P | 69.4 | Low | 68.2 | Low | 87 Ų | 87 | 115.8 Ų | 115.8 | 57% | 0.565 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -71.7 | -13.1 | 175.5 | 29.3 | -36.7 | 0 | 0 | 0 | 114 | L6 R7 P14 | L6-P10 WeakPolarHBondContact O-CD 3.48Å; R7-P10 WeakPolarHBondContact O-CD 3.48Å; P10-P14 WeakPolarHBondContact O-CD 3.44Å; P10-P14 VanDerWaalsContact O-CG 3.25Å; P10-P14 WeakPolarHBondContact O-CG 3.34Å |
| 11 | L | 69.9 | Low | 68.3 | Low | 119 Ų | 119 | 115 Ų | 115 | 62% | 0.623 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -92.6 | -33.8 | 174.5 | -166.3 | 82 | 0 | 0 | 0 | 111.5 | L8 L9 P14 L15 | L8-L11 WeakPolarHBondContact O-CB 2.99Å; L8-L11 PolarHBondContact O-N 3.43Å; L9-L11 PolarHBondContact O-N 2.96Å; L11-P14 WeakPolarHBondContact O-CD 3.35Å; L11-P14 WeakPolarHBondContact O-CG 3.46Å; L11-L15 WeakPolarHBondContact O-CB 3.49Å; L11-L15 PolarHBondContact O-N 3.17Å |
| 12 | L | 74.4 | Confident | 69 | Low | 99 Ų | 99 | 106.9 Ų | 106.9 | 52% | 0.518 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -71.8 | -36.9 | 177.6 | -75.6 | 166.2 | 0 | 0 | 0 | 112.2 | L8 L9 L15 L16 | L8-L12 HydrophobicContact CB-CD1 4.21Å; L8-L12 WeakPolarHBondContact O-CB 3.42Å; L8-L12 WeakPolarHBondContact O-CG 3.38Å; L8-L12 PolarHBondContact O-N 3.45Å; L9-L12 PolarHBondContact O-N 2.77Å; L12-L15 PolarHBondContact O-N 3.1Å; L12-L16 VanDerWaalsContact O-CB 3.28Å; L12-L16 WeakPolarHBondContact O-CB 3.34Å; L12-L16 PolarHBondContact O-N 3.28Å |
| 13 | L | 78 | Confident | 69.3 | Low | 112 Ų | 112 | 107.9 Ų | 107.9 | 59% | 0.586 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -59.1 | -50.9 | 178 | -118.1 | 122.4 | 0 | 0 | 0 | 113.8 | L9 L15 L16 W17 | L9-L13 HydrophobicContact CD2-CD1 3.74Å; L9-L13 HydrophobicContact CG-CD1 4.48Å; L9-L13 PolarHBondContact O-N 3.39Å; L9-L13 VanDerWaalsContact O-N 3.11Å; L13-L15 VanDerWaalsContact C-N 3.34Å; L13-L16 PolarHBondContact O-N 3.03Å; L13-W17 VanDerWaalsContact O-CB 3.32Å; L13-W17 WeakPolarHBondContact O-CB 3.41Å; L13-W17 PolarHBondContact O-N 3.17Å |
| 14 | P | 76.9 | Confident | 69.5 | Low | 66 Ų | 66 | 106 Ų | 106 | 43% | 0.429 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -69.9 | -30.2 | 176.6 | 26.5 | -34 | 0 | 0 | 0 | 112.3 | P10 L11 W17 L18 | P10-P14 WeakPolarHBondContact O-CD 3.44Å; P10-P14 VanDerWaalsContact O-CG 3.25Å; P10-P14 WeakPolarHBondContact O-CG 3.34Å; L11-P14 WeakPolarHBondContact O-CD 3.35Å; L11-P14 WeakPolarHBondContact O-CG 3.46Å; P14-W17 PolarHBondContact O-N 2.85Å; P14-L18 WeakPolarHBondContact O-CB 3.43Å; P14-L18 PolarHBondContact O-N 2.94Å |
| 15 | L | 74.4 | Confident | 69.6 | Low | 107 Ų | 107 | 106.9 Ų | 106.9 | 56% | 0.56 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -68.2 | -41.5 | 175.4 | -173.4 | 66.7 | 0 | 0 | 0 | 111.7 | L11 L12 L13 L18 L19 | L11-L15 WeakPolarHBondContact O-CB 3.49Å; L11-L15 PolarHBondContact O-N 3.17Å; L12-L15 PolarHBondContact O-N 3.1Å; L13-L15 VanDerWaalsContact C-N 3.34Å; L15-L18 PolarHBondContact O-N 3.18Å; L15-L19 WeakPolarHBondContact O-CB 3.33Å; L15-L19 PolarHBondContact O-N 2.74Å |
| 16 | L | 76.2 | Confident | 69.3 | Low | 109 Ų | 109 | 109.8 Ų | 109.8 | 57% | 0.571 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -68 | -41.2 | 174.6 | -175 | 65.8 | 0 | 0 | 0 | 110.9 | L12 L13 L18 L19 V20 | L12-L16 VanDerWaalsContact O-CB 3.28Å; L12-L16 WeakPolarHBondContact O-CB 3.34Å; L12-L16 PolarHBondContact O-N 3.28Å; L13-L16 PolarHBondContact O-N 3.03Å; L16-L18 VanDerWaalsContact C-N 3.34Å; L16-L19 PolarHBondContact O-N 3.38Å; L16-V20 VanDerWaalsContact O-CG2 3.27Å; L16-V20 WeakPolarHBondContact O-CG2 3.36Å; L16-V20 PolarHBondContact O-N 2.91Å |
| 17 | W | 78.1 | Confident | 69.4 | Low | 174 Ų | 174 | 108.7 Ų | 108.7 | 66% | 0.659 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -63.8 | -41.1 | 175.4 | -167.5 | 46.6 | 0 | 0 | 0 | 111.5 | L13 P14 V20 L21 | L13-W17 VanDerWaalsContact O-CB 3.32Å; L13-W17 WeakPolarHBondContact O-CB 3.41Å; L13-W17 PolarHBondContact O-N 3.17Å; P14-W17 PolarHBondContact O-N 2.85Å; W17-V20 PolarHBondContact O-N 3.2Å; W17-L21 HydrophobicContact CD2-CD2 4.5Å; W17-L21 HydrophobicContact CG-CD1 4.45Å; W17-L21 HydrophobicContact CZ2-CD2 4.01Å; W17-L21 WeakPolarHBondContact O-CB 3.46Å; W17-L21 PolarHBondContact O-N 2.99Å |
| 18 | L | 75.3 | Confident | 69 | Low | 107 Ų | 107 | 103 Ų | 103 | 56% | 0.56 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -62.8 | -42.2 | 173.5 | -172.9 | 66.7 | 0 | 0 | 0 | 111.2 | P14 L15 L16 V20 L21 T22 | P14-L18 WeakPolarHBondContact O-CB 3.43Å; P14-L18 PolarHBondContact O-N 2.94Å; L15-L18 PolarHBondContact O-N 3.18Å; L16-L18 VanDerWaalsContact C-N 3.34Å; L18-V20 VanDerWaalsContact C-N 3.32Å; L18-V20 PolarHBondContact O-N 3.46Å; L18-L21 CarbonylContact O-C 3.59Å; L18-L21 PolarHBondContact O-N 3Å; L18-T22 HydrophobicContact CD1-CG2 4.48Å; L18-T22 HydrophobicContact CG-CG2 4.4Å; L18-T22 WeakPolarHBondContact O-CB 3.23Å; L18-T22 VanDerWaalsContact O-CG2 3.29Å; L18-T22 WeakPolarHBondContact O-CG2 3.48Å; L18-T22 PolarHBondContact O-N 3.35Å; L18-T22 PolarHBondContact O-OG1 3Å |
| 19 | L | 71.7 | Confident | 68.5 | Low | 125 Ų | 125 | 101.3 Ų | 101.3 | 65% | 0.654 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -64.6 | -35.3 | 177.2 | -170.6 | 65.9 | 0 | 0 | 0 | 112.6 | L15 L16 T22 | L15-L19 WeakPolarHBondContact O-CB 3.33Å; L15-L19 PolarHBondContact O-N 2.74Å; L16-L19 PolarHBondContact O-N 3.38Å; L19-T22 WeakPolarHBondContact CA-OG1 3.21Å; L19-T22 PolarHBondContact O-OG1 3.35Å |
| 20 | V | 73 | Confident | 68 | Low | 109 Ų | 109 | 105.3 Ų | 105.3 | 66% | 0.661 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -75.5 | -35 | 175.6 | 171.9 | 0 | 0 | 0 | 0 | 111.8 | L16 W17 L18 | L16-V20 VanDerWaalsContact O-CG2 3.27Å; L16-V20 WeakPolarHBondContact O-CG2 3.36Å; L16-V20 PolarHBondContact O-N 2.91Å; W17-V20 PolarHBondContact O-N 3.2Å; L18-V20 VanDerWaalsContact C-N 3.32Å; L18-V20 PolarHBondContact O-N 3.46Å |
| 21 | L | 70.4 | Confident | 67 | Low | 100 Ų | 100 | 105 Ų | 105 | 52% | 0.524 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -84.4 | -19 | 178.3 | -102.4 | 65.4 | 0 | 0 | 0 | 113.6 | W17 L18 P23 | W17-L21 HydrophobicContact CD2-CD2 4.5Å; W17-L21 HydrophobicContact CG-CD1 4.45Å; W17-L21 HydrophobicContact CZ2-CD2 4.01Å; W17-L21 WeakPolarHBondContact O-CB 3.46Å; W17-L21 PolarHBondContact O-N 2.99Å; L18-L21 CarbonylContact O-C 3.59Å; L18-L21 PolarHBondContact O-N 3Å; L21-P23 WeakPolarHBondContact O-CD 3.37Å |
| 22 | T | 69.1 | Low | 66.3 | Low | 64 Ų | 64 | 106.1 Ų | 106.1 | 39% | 0.393 | 64% | 0.643 | S | S | . | * | S | Bend | trans | -70.1 | 112.1 | 171.9 | 41 | 0 | 0 | 0 | 0 | 108 | L18 L19 G24 | L18-T22 HydrophobicContact CD1-CG2 4.48Å; L18-T22 HydrophobicContact CG-CG2 4.4Å; L18-T22 WeakPolarHBondContact O-CB 3.23Å; L18-T22 VanDerWaalsContact O-CG2 3.29Å; L18-T22 WeakPolarHBondContact O-CG2 3.48Å; L18-T22 PolarHBondContact O-N 3.35Å; L18-T22 PolarHBondContact O-OG1 3Å; L19-T22 WeakPolarHBondContact CA-OG1 3.21Å; L19-T22 PolarHBondContact O-OG1 3.35Å; T22-G24 PolarHBondContact O-N 2.89Å |
| 23 | P | 60.3 | Low | 65.5 | Low | 120 Ų | 120 | 105.9 Ų | 105.9 | 78% | 0.779 | 65% | 0.649 | S | S | * | * | trans | -57.6 | 113.5 | 162.4 | 24.9 | -30.7 | 0 | 0 | 0 | 105.6 | L21 | L21-P23 WeakPolarHBondContact O-CD 3.37Š| ||
| 24 | G | 64.3 | Low | 64.5 | Low | 53 Ų | 53 | 109.3 Ų | 109.3 | 55% | 0.546 | 66% | 0.659 | S | S | . | * | P | Polyproline II helix | trans | -50.2 | 146.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | T22 P26 | T22-G24 PolarHBondContact O-N 2.89Å; G24-P26 VanDerWaalsContact O-N 3.11Å |
| 25 | P | 64.8 | Low | 63.7 | Low | 121 Ų | 121 | 112.9 Ų | 112.9 | 79% | 0.786 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -48.2 | 130 | 173.6 | 20.4 | -30.3 | 0 | 0 | 0 | 106.7 | A27 | P25-A27 PolarHBondContact O-N 3.33Š|
| 26 | P | 54.8 | Low | 63.3 | Low | 119 Ų | 119 | 112.9 Ų | 112.9 | 77% | 0.773 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 120.5 | 177.5 | 22.3 | -31.3 | 0 | 0 | 0 | 104.7 | G24 A28 | G24-P26 VanDerWaalsContact O-N 3.11Å; P26-A28 PolarHBondContact O-N 3.34Å |
| 27 | A | 61 | Low | 63.7 | Low | 98 Ų | 98 | 111.7 Ų | 111.7 | 81% | 0.81 | 67% | 0.673 | S | S | * | * | trans | -59 | 89.9 | 162.5 | 0 | 0 | 0 | 0 | 0 | 103 | P25 G29 | P25-A27 PolarHBondContact O-N 3.33Å; A27-G29 PolarHBondContact O-N 3.09Å | ||
| 28 | A | 56.3 | Low | 64.2 | Low | 85 Ų | 85 | 107.8 Ų | 107.8 | 70% | 0.702 | 66% | 0.663 | S | S | * | * | trans | -54 | 104 | 169.9 | 0 | 0 | 0 | 0 | 0 | 101.6 | P26 L30 | P26-A28 PolarHBondContact O-N 3.34Å; A28-L30 PolarHBondContact O-N 2.83Å | ||
| 29 | G | 51.8 | Low | 64.9 | Low | 61 Ų | 61 | 107 Ų | 107 | 63% | 0.629 | 66% | 0.657 | S | S | * | * | trans | -46.5 | 134.5 | -171.2 | 0 | 0 | 0 | 0 | 0 | 106.6 | A27 S31 | A27-G29 PolarHBondContact O-N 3.09Å; G29-S31 PolarHBondContact O-N 3.48Å | ||
| 30 | L | 57 | Low | 65.8 | Low | 177 Ų | 177 | 105.4 Ų | 105.4 | 93% | 0.927 | 65% | 0.648 | S | S | * | * | trans | -65.9 | 56.8 | 167 | -62.2 | 172 | 0 | 0 | 0 | 108 | A28 T32 | A28-L30 PolarHBondContact O-N 2.83Å; L30-T32 VanDerWaalsContact C-N 3.31Å; L30-T32 PolarHBondContact O-N 2.91Å; L30-T32 VanDerWaalsContact O-N 3.13Å | ||
| 31 | S | 48.5 | Very low | 66.7 | Low | 81 Ų | 81 | 103.1 Ų | 103.1 | 57% | 0.566 | 64% | 0.635 | S | S | * | * | trans | -72.6 | 100.5 | 161.8 | -171.1 | 0 | 0 | 0 | 0 | 103.3 | G29 C33 | G29-S31 PolarHBondContact O-N 3.48Å; S31-C33 PolarHBondContact O-N 3.16Å; S31-C33 WeakPolarHBondContact OG-CB 3.31Å; S31-C33 PolarHBondContact OG-SG 2.95Å | ||
| 32 | T | 56.8 | Low | 67.9 | Low | 141 Ų | 141 | 103.7 Ų | 103.7 | 87% | 0.865 | 63% | 0.633 | S | S | * | * | trans | -59.5 | 15.9 | 166.4 | 52.2 | 0 | 0 | 0 | 0 | 112.6 | L30 K34 | L30-T32 VanDerWaalsContact C-N 3.31Å; L30-T32 PolarHBondContact O-N 2.91Å; L30-T32 VanDerWaalsContact O-N 3.13Å; T32-K34 VanDerWaalsContact C-N 3.34Å; T32-K34 PolarHBondContact O-N 3.32Å; T32-K34 VanDerWaalsContact O-N 3.08Å | ||
| 33 | C | 56.3 | Low | 69.1 | Low | 95 Ų | 95 | 108.4 Ų | 108.4 | 64% | 0.642 | 64% | 0.644 | S | S | * | * | trans | -79.6 | 84.7 | 168.8 | -62 | 0 | 0 | 0 | 0 | 108.8 | S31 T35 | S31-C33 PolarHBondContact O-N 3.16Å; S31-C33 WeakPolarHBondContact OG-CB 3.31Å; S31-C33 PolarHBondContact OG-SG 2.95Å; C33-T35 PolarHBondContact O-N 3.23Å; C33-T35 VanDerWaalsContact O-N 3.15Å | ||
| 34 | K | 57.1 | Low | 70.9 | Confident | 184 Ų | 184 | 110.4 Ų | 110.4 | 80% | 0.8 | 64% | 0.64 | S | S | * | * | trans | -42.1 | 123.4 | 157 | -174.8 | 163.8 | 178.1 | 64.6 | 0 | 107.7 | T32 I36 | T32-K34 VanDerWaalsContact C-N 3.34Å; T32-K34 PolarHBondContact O-N 3.32Å; T32-K34 VanDerWaalsContact O-N 3.08Å; K34-I36 PolarHBondContact O-N 3.49Å | ||
| 35 | T | 61 | Low | 72.4 | Confident | 141 Ų | 141 | 116 Ų | 116 | 87% | 0.865 | 65% | 0.645 | S | S | * | * | trans | -61.5 | 89 | 168.5 | 45.2 | 0 | 0 | 0 | 0 | 107.2 | C33 D37 | C33-T35 PolarHBondContact O-N 3.23Å; C33-T35 VanDerWaalsContact O-N 3.15Å; T35-D37 PolarHBondContact O-N 2.65Å | ||
| 36 | I | 65.4 | Low | 74 | Confident | 107 Ų | 107 | 115.7 Ų | 115.7 | 55% | 0.549 | 64% | 0.635 | S | S | . | * | trans | -75.9 | 117.5 | 179.5 | -176.7 | 165.9 | 0 | 0 | 0 | 106.7 | K34 M38 V41 | K34-I36 PolarHBondContact O-N 3.49Å; I36-M38 HydrophobicContact CB-CE 3.97Å; I36-M38 HydrophobicContact CD1-CE 3.94Å; I36-M38 HydrophobicContact CG1-CE 3.6Å; I36-M38 HydrophobicContact CG2-CE 3.36Å; I36-M38 PolarHBondContact O-N 3.43Å; I36-V41 HydrophobicContact CD1-CG2 3.53Å; I36-V41 HydrophobicContact CG1-CG2 3.71Å | ||
| 37 | D | 84.1 | Confident | 76 | Confident | 83 Ų | 83 | 115.2 Ų | 115.2 | 44% | 0.444 | 62% | 0.623 | S | S | . | * | trans | -66.1 | 101.7 | 175 | -174.7 | -9.4 | 0 | 0 | 0 | 108.4 | T35 E39 L40 V41 | T35-D37 PolarHBondContact O-N 2.65Å; D37-E39 PolarHBondContact O-N 2.85Å; D37-E39 VanDerWaalsContact OD1-CB 3.25Å; D37-E39 WeakPolarHBondContact OD1-CB 3.42Å; D37-E39 PolarHBondContact OD1-N 3.21Å; D37-L40 HydrophobicContact CB-CB 4.2Å; D37-L40 HydrophobicContact CB-CD1 3.93Å; D37-L40 HydrophobicContact CB-CG 3.95Å; D37-L40 WeakPolarHBondContact O-CB 3.42Å; D37-L40 PolarHBondContact O-N 3.42Å; D37-L40 WeakPolarHBondContact OD2-CG 3.35Å; D37-V41 PolarHBondContact O-N 3.25Å; D37-V41 VanDerWaalsContact O-N 3.17Å | ||
| 38 | M | 90.1 | Very high | 77.8 | Confident | 93 Ų | 93 | 113.7 Ų | 113.7 | 46% | 0.458 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -60.1 | -26.2 | 178.6 | -70 | -67.9 | 85.6 | 0 | 0 | 111.8 | I36 V41 K42 | I36-M38 HydrophobicContact CB-CE 3.97Å; I36-M38 HydrophobicContact CD1-CE 3.94Å; I36-M38 HydrophobicContact CG1-CE 3.6Å; I36-M38 HydrophobicContact CG2-CE 3.36Å; I36-M38 PolarHBondContact O-N 3.43Å; M38-V41 HydrophobicContact CE-CB 4.14Å; M38-V41 HydrophobicContact CE-CG2 3.78Å; M38-V41 PolarHBondContact O-N 3.48Å; M38-K42 WeakPolarHBondContact O-CB 3.48Å; M38-K42 WeakPolarHBondContact O-CG 3.46Å; M38-K42 PolarHBondContact O-N 3.05Å |
| 39 | E | 89.4 | Confident | 79.7 | Confident | 89 Ų | 89 | 112.1 Ų | 112.1 | 42% | 0.416 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -67.9 | -38.7 | 175 | -64 | -59 | 116.1 | 0 | 0 | 110.9 | D37 K42 R43 | D37-E39 PolarHBondContact O-N 2.85Å; D37-E39 VanDerWaalsContact OD1-CB 3.25Å; D37-E39 WeakPolarHBondContact OD1-CB 3.42Å; D37-E39 PolarHBondContact OD1-N 3.21Å; E39-K42 PolarHBondContact O-N 3.3Å; E39-K42 IonicContact OE1-NZ 3.64Å; E39-K42 PolarHBondContact OE1-NZ 3.36Å; E39-R43 WeakPolarHBondContact O-CB 3.5Å; E39-R43 WeakPolarHBondContact O-CG 3.4Å; E39-R43 PolarHBondContact O-N 3.04Å |
| 40 | L | 89.4 | Confident | 81.9 | Confident | 92 Ų | 92 | 115.6 Ų | 115.6 | 48% | 0.482 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -66.5 | -39 | 173.6 | -67.2 | 179.5 | 0 | 0 | 0 | 112.3 | D37 R43 K44 | D37-L40 HydrophobicContact CB-CB 4.2Å; D37-L40 HydrophobicContact CB-CD1 3.93Å; D37-L40 HydrophobicContact CB-CG 3.95Å; D37-L40 WeakPolarHBondContact O-CB 3.42Å; D37-L40 PolarHBondContact O-N 3.42Å; D37-L40 WeakPolarHBondContact OD2-CG 3.35Å; L40-R43 PolarHBondContact O-N 2.87Å; L40-K44 WeakPolarHBondContact O-CG 3.47Å; L40-K44 PolarHBondContact O-N 3.45Å |
| 41 | V | 93.5 | Very high | 83.8 | Confident | 62 Ų | 62 | 109 Ų | 109 | 38% | 0.376 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.4 | -45.3 | 176.3 | 175.2 | 0 | 0 | 0 | 0 | 111.1 | I36 D37 M38 R43 K44 R45 | I36-V41 HydrophobicContact CD1-CG2 3.53Å; I36-V41 HydrophobicContact CG1-CG2 3.71Å; D37-V41 PolarHBondContact O-N 3.25Å; D37-V41 VanDerWaalsContact O-N 3.17Å; M38-V41 HydrophobicContact CE-CB 4.14Å; M38-V41 HydrophobicContact CE-CG2 3.78Å; M38-V41 PolarHBondContact O-N 3.48Å; V41-R43 PolarHBondContact O-N 3.16Å; V41-K44 PolarHBondContact O-N 2.87Å; V41-R45 WeakPolarHBondContact O-CB 3.43Å; V41-R45 PolarHBondContact O-N 3.18Å |
| 42 | K | 94.6 | Very high | 86.1 | Confident | 111 Ų | 111 | 109.6 Ų | 109.6 | 48% | 0.483 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -59.2 | -46.4 | 175.5 | -72.3 | 171 | -169.3 | 169.7 | 0 | 111.1 | M38 E39 K44 R45 I46 | M38-K42 WeakPolarHBondContact O-CB 3.48Å; M38-K42 WeakPolarHBondContact O-CG 3.46Å; M38-K42 PolarHBondContact O-N 3.05Å; E39-K42 PolarHBondContact O-N 3.3Å; E39-K42 IonicContact OE1-NZ 3.64Å; E39-K42 PolarHBondContact OE1-NZ 3.36Å; K42-K44 PolarHBondContact O-N 2.79Å; K42-R45 PolarHBondContact O-N 2.97Å; K42-I46 VanDerWaalsContact O-CG1 3.25Å; K42-I46 WeakPolarHBondContact O-CG1 3.26Å; K42-I46 PolarHBondContact O-N 2.88Å |
| 43 | R | 95.1 | Very high | 88 | Confident | 164 Ų | 164 | 107.2 Ų | 107.2 | 62% | 0.619 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -59.2 | -46.3 | 177.2 | -73.4 | 173.1 | -168.7 | -164.2 | 4.4 | 112.2 | E39 L40 V41 R45 I46 E47 | E39-R43 WeakPolarHBondContact O-CB 3.5Å; E39-R43 WeakPolarHBondContact O-CG 3.4Å; E39-R43 PolarHBondContact O-N 3.04Å; L40-R43 PolarHBondContact O-N 2.87Å; V41-R43 PolarHBondContact O-N 3.16Å; R43-R45 VanDerWaalsContact C-N 3.32Å; R43-R45 PolarHBondContact O-N 3.43Å; R43-I46 PolarHBondContact O-N 2.88Å; R43-E47 PolarHBondContact O-N 3.49Å; R43-E47 VanDerWaalsContact O-N 3.11Å |
| 44 | K | 96.8 | Very high | 89.9 | Confident | 161 Ų | 161 | 104.1 Ų | 104.1 | 70% | 0.7 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.5 | -40.9 | 175.5 | -74.9 | -177.7 | 177 | -174.7 | 0 | 112 | L40 V41 K42 E47 A48 | L40-K44 WeakPolarHBondContact O-CG 3.47Å; L40-K44 PolarHBondContact O-N 3.45Å; V41-K44 PolarHBondContact O-N 2.87Å; K42-K44 PolarHBondContact O-N 2.79Å; K44-E47 PolarHBondContact O-N 2.93Å; K44-A48 WeakPolarHBondContact O-CB 3.24Å; K44-A48 PolarHBondContact O-N 3.42Å |
| 45 | R | 97.5 | Very high | 91.8 | Very high | 172 Ų | 172 | 97.3 Ų | 97.3 | 65% | 0.649 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -66 | -39.3 | 177.3 | -171.1 | 174.6 | -174.4 | -91.2 | -0.3 | 111.9 | V41 K42 R43 A48 I49 | V41-R45 WeakPolarHBondContact O-CB 3.43Å; V41-R45 PolarHBondContact O-N 3.18Å; K42-R45 PolarHBondContact O-N 2.97Å; R43-R45 VanDerWaalsContact C-N 3.32Å; R43-R45 PolarHBondContact O-N 3.43Å; R45-A48 PolarHBondContact O-N 3.21Å; R45-I49 HydrophobicContact CG-CD1 3.81Å; R45-I49 HydrophobicContact CG-CG1 4.37Å; R45-I49 WeakPolarHBondContact O-CB 3.44Å; R45-I49 VanDerWaalsContact O-CG1 3.24Å; R45-I49 WeakPolarHBondContact O-CG1 3.4Å; R45-I49 PolarHBondContact O-N 3.19Å |
| 46 | I | 97.3 | Very high | 93.5 | Very high | 113 Ų | 113 | 94.1 Ų | 94.1 | 58% | 0.579 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -60.2 | -47.8 | 175.6 | -70.6 | 162.4 | 0 | 0 | 0 | 110.3 | K42 R43 A48 I49 R50 | K42-I46 VanDerWaalsContact O-CG1 3.25Å; K42-I46 WeakPolarHBondContact O-CG1 3.26Å; K42-I46 PolarHBondContact O-N 2.88Å; R43-I46 PolarHBondContact O-N 2.88Å; I46-A48 PolarHBondContact O-N 3.47Å; I46-I49 PolarHBondContact O-N 3.24Å; I46-R50 WeakPolarHBondContact O-CB 3.39Å; I46-R50 PolarHBondContact O-N 2.86Å |
| 47 | E | 97.3 | Very high | 95 | Very high | 110 Ų | 110 | 93.3 Ų | 93.3 | 51% | 0.514 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -66.4 | -38.5 | -179.9 | -165.6 | 58.7 | -147.2 | 0 | 0 | 112 | R43 K44 R50 G51 | R43-E47 PolarHBondContact O-N 3.49Å; R43-E47 VanDerWaalsContact O-N 3.11Å; K44-E47 PolarHBondContact O-N 2.93Å; E47-R50 WeakPolarHBondContact O-CB 3.41Å; E47-R50 PolarHBondContact O-N 3.2Å; E47-R50 IonicContact OE1-NH1 3.8Å; E47-R50 IonicContact OE2-NH1 2.77Å; E47-G51 PolarHBondContact O-N 3.31Å; E47-G51 VanDerWaalsContact O-N 3.12Å |
| 48 | A | 97.5 | Very high | 95.5 | Very high | 65 Ų | 65 | 98 Ų | 98 | 54% | 0.537 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -62.6 | -44.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | K44 R45 I46 R50 G51 Q52 | K44-A48 WeakPolarHBondContact O-CB 3.24Å; K44-A48 PolarHBondContact O-N 3.42Å; R45-A48 PolarHBondContact O-N 3.21Å; I46-A48 PolarHBondContact O-N 3.47Å; A48-R50 VanDerWaalsContact C-N 3.33Å; A48-R50 PolarHBondContact O-N 2.87Å; A48-G51 PolarHBondContact O-N 3.08Å; A48-Q52 WeakPolarHBondContact O-CB 3.22Å; A48-Q52 PolarHBondContact O-N 3.35Å |
| 49 | I | 97.8 | Very high | 95.7 | Very high | 52 Ų | 52 | 96.7 Ų | 96.7 | 27% | 0.267 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -65.7 | -38.1 | 177.9 | -71 | 170.4 | 0 | 0 | 0 | 110.8 | R45 I46 G51 Q52 I53 | R45-I49 HydrophobicContact CG-CD1 3.81Å; R45-I49 HydrophobicContact CG-CG1 4.37Å; R45-I49 WeakPolarHBondContact O-CB 3.44Å; R45-I49 VanDerWaalsContact O-CG1 3.24Å; R45-I49 WeakPolarHBondContact O-CG1 3.4Å; R45-I49 PolarHBondContact O-N 3.19Å; I46-I49 PolarHBondContact O-N 3.24Å; I49-G51 VanDerWaalsContact C-N 3.35Å; I49-G51 PolarHBondContact O-N 3.31Å; I49-Q52 WeakPolarHBondContact O-CB 3.25Å; I49-Q52 PolarHBondContact O-N 3.12Å; I49-I53 HydrophobicContact CG2-CD1 3.7Å; I49-I53 HydrophobicContact CG2-CG1 4.18Å; I49-I53 WeakPolarHBondContact O-CG1 3.42Å; I49-I53 PolarHBondContact O-N 3.47Å |
| 50 | R | 97 | Very high | 95.9 | Very high | 135 Ų | 135 | 97.6 Ų | 97.6 | 51% | 0.509 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -57.4 | -49.2 | 175.4 | -175.4 | -173.3 | -177.6 | -167.9 | 1.8 | 111.1 | I46 E47 A48 Q52 I53 L54 | I46-R50 WeakPolarHBondContact O-CB 3.39Å; I46-R50 PolarHBondContact O-N 2.86Å; E47-R50 WeakPolarHBondContact O-CB 3.41Å; E47-R50 PolarHBondContact O-N 3.2Å; E47-R50 IonicContact OE1-NH1 3.8Å; E47-R50 IonicContact OE2-NH1 2.77Å; A48-R50 VanDerWaalsContact C-N 3.33Å; A48-R50 PolarHBondContact O-N 2.87Å; R50-Q52 VanDerWaalsContact C-N 3.34Å; R50-I53 PolarHBondContact O-N 2.9Å; R50-L54 WeakPolarHBondContact O-CG 3.2Å; R50-L54 PolarHBondContact O-N 3.31Å |
| 51 | G | 96.4 | Very high | 96.1 | Very high | 39 Ų | 39 | 96.9 Ų | 96.9 | 40% | 0.402 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.1 | -41.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | E47 A48 I49 L54 S55 | E47-G51 PolarHBondContact O-N 3.31Å; E47-G51 VanDerWaalsContact O-N 3.12Å; A48-G51 PolarHBondContact O-N 3.08Å; I49-G51 VanDerWaalsContact C-N 3.35Å; I49-G51 PolarHBondContact O-N 3.31Å; G51-L54 PolarHBondContact O-N 2.84Å; G51-S55 WeakPolarHBondContact O-CB 3.42Å; G51-S55 PolarHBondContact O-N 3.49Å; G51-S55 PolarHBondContact O-OG 3.36Å |
| 52 | Q | 97 | Very high | 96.1 | Very high | 93 Ų | 93 | 97.9 Ų | 97.9 | 44% | 0.435 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.8 | -41.7 | 178.9 | -173.5 | -178.8 | 1.6 | 0 | 0 | 113.1 | A48 I49 R50 S55 K56 | A48-Q52 WeakPolarHBondContact O-CB 3.22Å; A48-Q52 PolarHBondContact O-N 3.35Å; I49-Q52 WeakPolarHBondContact O-CB 3.25Å; I49-Q52 PolarHBondContact O-N 3.12Å; R50-Q52 VanDerWaalsContact C-N 3.34Å; Q52-S55 WeakPolarHBondContact CA-OG 3.47Å; Q52-S55 PolarHBondContact O-OG 2.88Å; Q52-K56 HydrophobicContact CG-CD 4.36Å; Q52-K56 VanDerWaalsContact O-CB 3.31Å; Q52-K56 WeakPolarHBondContact O-CB 3.25Å; Q52-K56 VanDerWaalsContact O-CG 3.23Å; Q52-K56 WeakPolarHBondContact O-CG 3.39Å; Q52-K56 PolarHBondContact O-N 2.89Å |
| 53 | I | 97 | Very high | 96 | Very high | 91 Ų | 91 | 97 Ų | 97 | 47% | 0.467 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.3 | -47.3 | 177.9 | -68.6 | 167.9 | 0 | 0 | 0 | 109.8 | I49 R50 S55 K56 L57 | I49-I53 HydrophobicContact CG2-CD1 3.7Å; I49-I53 HydrophobicContact CG2-CG1 4.18Å; I49-I53 WeakPolarHBondContact O-CG1 3.42Å; I49-I53 PolarHBondContact O-N 3.47Å; R50-I53 PolarHBondContact O-N 2.9Å; I53-S55 PolarHBondContact O-N 3.41Å; I53-K56 PolarHBondContact O-N 3.43Å; I53-L57 HydrophobicContact CG2-CD1 3.9Å; I53-L57 WeakPolarHBondContact O-CB 3.37Å; I53-L57 WeakPolarHBondContact O-CG 3.41Å; I53-L57 PolarHBondContact O-N 3.11Å |
| 54 | L | 97.3 | Very high | 95.8 | Very high | 30 Ų | 30 | 94 Ų | 94 | 16% | 0.157 | 51% | 0.505 | C | S | . | . | H | α-helix | trans | -63.4 | -42 | 179.7 | -70.9 | 178 | 0 | 0 | 0 | 112.1 | R50 G51 L57 R58 L59 | R50-L54 WeakPolarHBondContact O-CG 3.2Å; R50-L54 PolarHBondContact O-N 3.31Å; G51-L54 PolarHBondContact O-N 2.84Å; L54-L57 CarbonylContact O-C 3.59Å; L54-L57 PolarHBondContact O-N 3.28Å; L54-R58 PolarHBondContact O-N 2.9Å; L54-L59 WeakPolarHBondContact CB-O 3.03Å; L54-L59 HydrophobicContact CD2-CB 3.99Å; L54-L59 PolarHBondContact O-N 3.45Å |
| 55 | S | 96.6 | Very high | 95.3 | Very high | 41 Ų | 41 | 94.2 Ų | 94.2 | 29% | 0.287 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66 | -41 | 176.7 | 67.2 | 0 | 0 | 0 | 0 | 112.2 | G51 Q52 I53 L57 R58 Y103 Y104 | G51-S55 WeakPolarHBondContact O-CB 3.42Å; G51-S55 PolarHBondContact O-N 3.49Å; G51-S55 PolarHBondContact O-OG 3.36Å; Q52-S55 WeakPolarHBondContact CA-OG 3.47Å; Q52-S55 PolarHBondContact O-OG 2.88Å; I53-S55 PolarHBondContact O-N 3.41Å; S55-L57 VanDerWaalsContact C-N 3.32Å; S55-L57 PolarHBondContact O-N 3.02Å; S55-R58 PolarHBondContact O-N 3.48Å; S55-Y103 PolarHBondContact OG-OH 2.86Å; S55-Y104 WeakPolarHBondContact O-CD1 3.47Å; S55-Y104 WeakPolarHBondContact O-CE1 3.49Å |
| 56 | K | 96.8 | Very high | 94.5 | Very high | 73 Ų | 73 | 89.8 Ų | 89.8 | 32% | 0.317 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.2 | -38.6 | 175.4 | -78.8 | -174.1 | 164.8 | -73.4 | 0 | 112.4 | Q52 I53 R58 Y103 A105 | Q52-K56 HydrophobicContact CG-CD 4.36Å; Q52-K56 VanDerWaalsContact O-CB 3.31Å; Q52-K56 WeakPolarHBondContact O-CB 3.25Å; Q52-K56 VanDerWaalsContact O-CG 3.23Å; Q52-K56 WeakPolarHBondContact O-CG 3.39Å; Q52-K56 PolarHBondContact O-N 2.89Å; I53-K56 PolarHBondContact O-N 3.43Å; K56-R58 VanDerWaalsContact C-N 3.32Å; K56-Y103 WeakPolarHBondContact CG-O 3.44Å; K56-Y103 PolarHBondContact NZ-O 3.4Å; K56-A105 PolarHBondContact O-N 3.39Å |
| 57 | L | 96 | Very high | 93.7 | Very high | 91 Ų | 91 | 93 Ų | 93 | 48% | 0.476 | 53% | 0.529 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84 | -3.6 | 178 | -64.4 | 176.1 | 0 | 0 | 0 | 113.7 | I53 L54 S55 L59 A105 | I53-L57 HydrophobicContact CG2-CD1 3.9Å; I53-L57 WeakPolarHBondContact O-CB 3.37Å; I53-L57 WeakPolarHBondContact O-CG 3.41Å; I53-L57 PolarHBondContact O-N 3.11Å; L54-L57 CarbonylContact O-C 3.59Å; L54-L57 PolarHBondContact O-N 3.28Å; S55-L57 VanDerWaalsContact C-N 3.32Å; S55-L57 PolarHBondContact O-N 3.02Å; L57-L59 VanDerWaalsContact C-N 3.26Å; L57-L59 HydrophobicContact CB-CD1 3.93Å; L57-L59 HydrophobicContact CB-CG 3.92Å; L57-L59 HydrophobicContact CD1-CD1 4.18Å; L57-L59 PolarHBondContact O-N 2.84Å; L57-A105 HydrophobicContact CD2-CB 3.82Å |
| 58 | R | 95.5 | Very high | 93.2 | Very high | 180 Ų | 180 | 92.6 Ų | 92.6 | 68% | 0.679 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.8 | 36 | -174.3 | -56.8 | 179.9 | 172.2 | 173.6 | -2.2 | 113.3 | L54 S55 K56 Y104 | L54-R58 PolarHBondContact O-N 2.9Å; S55-R58 PolarHBondContact O-N 3.48Å; K56-R58 VanDerWaalsContact C-N 3.32Å; R58-Y104 HydrophobicContact CG-CD1 3.42Å; R58-Y104 VanDerWaalsContact CG-CD1 3.42Å; R58-Y104 HydrophobicContact CG-CE1 3.56Å; R58-Y104 HydrophobicContact CG-CG 4.32Å; R58-Y104 VanDerWaalsContact NE-CD1 3.28Å |
| 59 | L | 94.8 | Very high | 92.7 | Very high | 67 Ų | 67 | 94.5 Ų | 94.5 | 35% | 0.351 | 54% | 0.541 | S | S | . | . | trans | -107 | 136.8 | 178.4 | -62.1 | 177.5 | 0 | 0 | 0 | 110.4 | L54 L57 | L54-L59 WeakPolarHBondContact CB-O 3.03Å; L54-L59 HydrophobicContact CD2-CB 3.99Å; L54-L59 PolarHBondContact O-N 3.45Å; L57-L59 VanDerWaalsContact C-N 3.26Å; L57-L59 HydrophobicContact CB-CD1 3.93Å; L57-L59 HydrophobicContact CB-CG 3.92Å; L57-L59 HydrophobicContact CD1-CD1 4.18Å; L57-L59 PolarHBondContact O-N 2.84Å | ||
| 60 | A | 93.6 | Very high | 92.2 | Very high | 108 Ų | 108 | 98.5 Ų | 98.5 | 89% | 0.893 | 57% | 0.57 | S | S | * | * | S | Bend | trans | -79.2 | -30.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 61 | S | 93.4 | Very high | 91.8 | Very high | 77 Ų | 77 | 94.8 Ų | 94.8 | 54% | 0.538 | 57% | 0.574 | S | S | . | * | S | Bend | trans | -147.4 | 160.5 | 179.8 | 59.5 | 0 | 0 | 0 | 0 | 110.4 | ||
| 62 | P | 93.4 | Very high | 91.5 | Very high | 82 Ų | 82 | 99.2 Ų | 99.2 | 53% | 0.532 | 60% | 0.595 | S | S | . | * | P | Polyproline II helix | trans | -56 | 138.6 | 172.7 | -23.6 | 34.2 | 0 | 0 | 0 | 111.5 | ||
| 63 | P | 91.9 | Very high | 91.3 | Very high | 93 Ų | 93 | 99.9 Ų | 99.9 | 60% | 0.604 | 60% | 0.601 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 153.2 | 177.9 | 30.1 | -33 | 0 | 0 | 0 | 110.9 | ||
| 64 | S | 90.6 | Very high | 91.2 | Very high | 101 Ų | 101 | 99.7 Ų | 99.7 | 71% | 0.706 | 61% | 0.606 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 132.2 | 175.3 | 51.1 | 0 | 0 | 0 | 0 | 111 | G66 | S64-G66 VanDerWaalsContact C-N 3.33Š|
| 65 | Q | 87.2 | Confident | 91 | Very high | 165 Ų | 165 | 106.3 Ų | 106.3 | 77% | 0.771 | 64% | 0.636 | S | S | * | * | trans | -88 | 3 | 177.9 | -65.4 | -174.6 | -11.5 | 0 | 0 | 113.8 | E67 V68 | Q65-E67 PolarHBondContact O-N 3.18Å; Q65-V68 HydrophobicContact CB-CG2 4.43Å; Q65-V68 WeakPolarHBondContact O-CB 3.43Å; Q65-V68 PolarHBondContact O-N 3.34Å; Q65-V68 VanDerWaalsContact O-N 3.1Å | ||
| 66 | G | 80.1 | Confident | 90.8 | Very high | 79 Ų | 79 | 107.1 Ų | 107.1 | 81% | 0.814 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | -22.8 | -172.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | S64 | S64-G66 VanDerWaalsContact C-N 3.33Š|
| 67 | E | 80.2 | Confident | 90.7 | Very high | 182 Ų | 182 | 107 Ų | 107 | 85% | 0.85 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.7 | -2.5 | 179.1 | -65 | 178.7 | 180 | 0 | 0 | 113 | Q65 P69 | Q65-E67 PolarHBondContact O-N 3.18Å; E67-P69 WeakPolarHBondContact O-CD 3.27Å |
| 68 | V | 86.9 | Confident | 90.6 | Very high | 100 Ų | 100 | 106.3 Ų | 106.3 | 61% | 0.606 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -77.7 | 121.4 | -178.9 | -178.3 | 0 | 0 | 0 | 0 | 108.8 | Q65 | Q65-V68 HydrophobicContact CB-CG2 4.43Å; Q65-V68 WeakPolarHBondContact O-CB 3.43Å; Q65-V68 PolarHBondContact O-N 3.34Å; Q65-V68 VanDerWaalsContact O-N 3.1Å |
| 69 | P | 87.8 | Confident | 90.5 | Very high | 106 Ų | 106 | 99.2 Ų | 99.2 | 69% | 0.688 | 63% | 0.627 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 132.3 | 179.7 | 24.7 | -32.6 | 0 | 0 | 0 | 110.1 | E67 | E67-P69 WeakPolarHBondContact O-CD 3.27Š|
| 70 | P | 86.4 | Confident | 90.5 | Very high | 136 Ų | 136 | 97.7 Ų | 97.7 | 88% | 0.883 | 62% | 0.619 | S | S | * | * | S | Bend | trans | -70.5 | 132.6 | 174.3 | 29.4 | -33.2 | 0 | 0 | 0 | 109.4 | ||
| 71 | G | 88.1 | Confident | 90.6 | Very high | 57 Ų | 57 | 99.6 Ų | 99.6 | 59% | 0.588 | 60% | 0.604 | S | S | * | * | S | Bend | trans | 141.7 | -175 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 72 | P | 91.5 | Very high | 90.6 | Very high | 132 Ų | 132 | 99.4 Ų | 99.4 | 86% | 0.857 | 60% | 0.597 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 145.3 | 175 | 28.1 | -33.2 | 0 | 0 | 0 | 110.8 | ||
| 73 | L | 93.2 | Very high | 90.4 | Very high | 107 Ų | 107 | 97.9 Ų | 97.9 | 56% | 0.56 | 59% | 0.588 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 148.1 | 174.1 | -83.6 | 74.4 | 0 | 0 | 0 | 110.3 | E75 V77 L78 | L73-E75 PolarHBondContact O-N 2.98Å; L73-V77 HydrophobicContact CD2-CG1 4.11Å; L73-L78 HydrophobicContact CB-CD2 4.19Å; L73-L78 HydrophobicContact CB-CG 4.15Å |
| 74 | P | 94.1 | Very high | 90.4 | Very high | 86 Ų | 86 | 95.8 Ų | 95.8 | 56% | 0.558 | 57% | 0.574 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 139.3 | 174.4 | -23.5 | 33.1 | 0 | 0 | 0 | 112 | A76 V77 L78 | P74-A76 PolarHBondContact O-N 3.47Å; P74-A76 VanDerWaalsContact O-N 3.17Å; P74-V77 HydrophobicContact CB-CG2 4.21Å; P74-V77 HydrophobicContact CG-CG2 4.34Å; P74-V77 WeakPolarHBondContact O-CB 3.38Å; P74-V77 PolarHBondContact O-N 2.89Å; P74-L78 PolarHBondContact O-N 3.48Å; P74-L78 VanDerWaalsContact O-N 3.16Å |
| 75 | E | 93.8 | Very high | 90.3 | Very high | 169 Ų | 169 | 97.5 Ų | 97.5 | 79% | 0.79 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -55.5 | -37.2 | -178.9 | -173.2 | -174.6 | -177.4 | 0 | 0 | 112.3 | L73 V77 L78 A79 | L73-E75 PolarHBondContact O-N 2.98Å; E75-V77 VanDerWaalsContact C-N 3.28Å; E75-V77 PolarHBondContact O-N 3.48Å; E75-L78 PolarHBondContact O-N 3.35Å; E75-A79 WeakPolarHBondContact O-CB 3.29Å; E75-A79 PolarHBondContact O-N 3.17Å |
| 76 | A | 92.1 | Very high | 90.4 | Very high | 59 Ų | 59 | 93.7 Ų | 93.7 | 49% | 0.488 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -59.4 | -37.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113 | P74 L80 | P74-A76 PolarHBondContact O-N 3.47Å; P74-A76 VanDerWaalsContact O-N 3.17Å; A76-L80 WeakPolarHBondContact O-CB 3.18Å; A76-L80 PolarHBondContact O-N 3.46Å; A76-L80 VanDerWaalsContact O-N 3.09Å |
| 77 | V | 94.1 | Very high | 90.4 | Very high | 69 Ų | 69 | 98.5 Ų | 98.5 | 42% | 0.418 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -72 | -43.1 | 177.4 | 178.7 | 0 | 0 | 0 | 0 | 110.2 | L73 P74 E75 L80 Y81 | L73-V77 HydrophobicContact CD2-CG1 4.11Å; P74-V77 HydrophobicContact CB-CG2 4.21Å; P74-V77 HydrophobicContact CG-CG2 4.34Å; P74-V77 WeakPolarHBondContact O-CB 3.38Å; P74-V77 PolarHBondContact O-N 2.89Å; E75-V77 VanDerWaalsContact C-N 3.28Å; E75-V77 PolarHBondContact O-N 3.48Å; V77-L80 PolarHBondContact O-N 2.94Å; V77-Y81 WeakPolarHBondContact O-CB 3.35Å; V77-Y81 PolarHBondContact O-N 3.04Å |
| 78 | L | 94.5 | Very high | 90.2 | Very high | 78 Ų | 78 | 95.4 Ų | 95.4 | 41% | 0.408 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.9 | -44.7 | 176.6 | -68.5 | 173.6 | 0 | 0 | 0 | 111.8 | L73 P74 E75 L80 Y81 N82 | L73-L78 HydrophobicContact CB-CD2 4.19Å; L73-L78 HydrophobicContact CB-CG 4.15Å; P74-L78 PolarHBondContact O-N 3.48Å; P74-L78 VanDerWaalsContact O-N 3.16Å; E75-L78 PolarHBondContact O-N 3.35Å; L78-L80 VanDerWaalsContact C-N 3.34Å; L78-L80 PolarHBondContact O-N 2.93Å; L78-Y81 PolarHBondContact O-N 3.22Å; L78-N82 WeakPolarHBondContact O-CB 3.37Å; L78-N82 VanDerWaalsContact O-CG 3.23Å; L78-N82 PolarHBondContact O-N 2.93Å; L78-N82 PolarHBondContact O-ND2 3.31Å |
| 79 | A | 93 | Very high | 89.6 | Confident | 31 Ų | 31 | 94.6 Ų | 94.6 | 26% | 0.256 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.8 | -38.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | E75 S83 R110 | E75-A79 WeakPolarHBondContact O-CB 3.29Å; E75-A79 PolarHBondContact O-N 3.17Å; A79-S83 WeakPolarHBondContact O-CB 3.28Å; A79-S83 PolarHBondContact O-N 2.72Å; A79-S83 PolarHBondContact O-OG 3.15Å; A79-R110 VanDerWaalsContact CB-NH1 3.26Å |
| 80 | L | 94.9 | Very high | 88.4 | Confident | 35 Ų | 35 | 92.3 Ų | 92.3 | 18% | 0.183 | 54% | 0.536 | C | S | . | . | H | α-helix | trans | -64.1 | -47.2 | 173.5 | -178.1 | 64.1 | 0 | 0 | 0 | 111.8 | A76 V77 L78 S83 T84 V108 R110 | A76-L80 WeakPolarHBondContact O-CB 3.18Å; A76-L80 PolarHBondContact O-N 3.46Å; A76-L80 VanDerWaalsContact O-N 3.09Å; V77-L80 PolarHBondContact O-N 2.94Å; L78-L80 VanDerWaalsContact C-N 3.34Å; L78-L80 PolarHBondContact O-N 2.93Å; L80-S83 PolarHBondContact O-N 3.08Å; L80-S83 PolarHBondContact O-OG 2.83Å; L80-T84 PolarHBondContact O-N 3.13Å; L80-T84 PolarHBondContact O-OG1 2.64Å; L80-V108 HydrophobicContact CD1-CG1 3.96Å; L80-V108 WeakPolarHBondContact CD2-O 3.46Å; L80-V108 HydrophobicContact CG-CG1 4.42Å; L80-R110 HydrophobicContact CD1-CB 3.8Å; L80-R110 HydrophobicContact CD1-CG 3.9Å |
| 81 | Y | 94.5 | Very high | 87 | Confident | 147 Ų | 147 | 92.3 Ų | 92.3 | 58% | 0.576 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -59.1 | -48.1 | 176.9 | 174.9 | -98.7 | 0 | 0 | 0 | 111.8 | V77 L78 S83 T84 R85 | V77-Y81 WeakPolarHBondContact O-CB 3.35Å; V77-Y81 PolarHBondContact O-N 3.04Å; L78-Y81 PolarHBondContact O-N 3.22Å; Y81-S83 PolarHBondContact O-N 3.31Å; Y81-T84 PolarHBondContact O-N 3.18Å; Y81-T84 VanDerWaalsContact O-N 3.16Å; Y81-R85 WeakPolarHBondContact O-CB 3.32Å; Y81-R85 PolarHBondContact O-N 2.87Å |
| 82 | N | 93.3 | Very high | 85.4 | Confident | 73 Ų | 73 | 95.5 Ų | 95.5 | 39% | 0.39 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.6 | -45.2 | 178.9 | -70.8 | -16 | 0 | 0 | 0 | 111.3 | L78 T84 R85 D86 | L78-N82 WeakPolarHBondContact O-CB 3.37Å; L78-N82 VanDerWaalsContact O-CG 3.23Å; L78-N82 PolarHBondContact O-N 2.93Å; L78-N82 PolarHBondContact O-ND2 3.31Å; N82-T84 VanDerWaalsContact C-N 3.27Å; N82-T84 PolarHBondContact O-N 2.65Å; N82-R85 PolarHBondContact O-N 2.94Å; N82-D86 WeakPolarHBondContact O-CB 3.49Å; N82-D86 PolarHBondContact O-N 2.77Å |
| 83 | S | 91.1 | Very high | 83.8 | Confident | 51 Ų | 51 | 93 Ų | 93 | 36% | 0.357 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.7 | -36 | 176.4 | 71.2 | 0 | 0 | 0 | 0 | 113.1 | A79 L80 Y81 R87 | A79-S83 WeakPolarHBondContact O-CB 3.28Å; A79-S83 PolarHBondContact O-N 2.72Å; A79-S83 PolarHBondContact O-OG 3.15Å; L80-S83 PolarHBondContact O-N 3.08Å; L80-S83 PolarHBondContact O-OG 2.83Å; Y81-S83 PolarHBondContact O-N 3.31Å; S83-R87 WeakPolarHBondContact O-CG 3.36Å; S83-R87 PolarHBondContact O-N 2.92Å |
| 84 | T | 91 | Very high | 81.8 | Confident | 48 Ų | 48 | 95.4 Ų | 95.4 | 29% | 0.294 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -71.5 | -45.3 | 177.6 | -53.5 | 0 | 0 | 0 | 0 | 110.7 | L80 Y81 N82 D86 R87 V88 | L80-T84 PolarHBondContact O-N 3.13Å; L80-T84 PolarHBondContact O-OG1 2.64Å; Y81-T84 PolarHBondContact O-N 3.18Å; Y81-T84 VanDerWaalsContact O-N 3.16Å; N82-T84 VanDerWaalsContact C-N 3.27Å; N82-T84 PolarHBondContact O-N 2.65Å; T84-D86 VanDerWaalsContact C-N 3.35Å; T84-D86 PolarHBondContact O-N 2.76Å; T84-R87 PolarHBondContact O-N 2.97Å; T84-V88 WeakPolarHBondContact O-CG2 3.36Å; T84-V88 PolarHBondContact O-N 3.26Å; T84-V88 VanDerWaalsContact O-N 3.08Å |
| 85 | R | 89.5 | Confident | 79.9 | Confident | 138 Ų | 138 | 97 Ų | 97 | 52% | 0.521 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.4 | -44.6 | 178.7 | -169.8 | -165.8 | 75.5 | 154.2 | 3.5 | 111.4 | Y81 N82 V88 A89 | Y81-R85 WeakPolarHBondContact O-CB 3.32Å; Y81-R85 PolarHBondContact O-N 2.87Å; N82-R85 PolarHBondContact O-N 2.94Å; R85-V88 PolarHBondContact O-N 2.91Å; R85-A89 VanDerWaalsContact O-CB 3.26Å; R85-A89 WeakPolarHBondContact O-CB 2.94Å; R85-A89 PolarHBondContact O-N 2.9Å |
| 86 | D | 87.4 | Confident | 78.2 | Confident | 84 Ų | 84 | 96.1 Ų | 96.1 | 45% | 0.449 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -71.2 | -32.4 | -176 | -63.4 | -16.8 | 0 | 0 | 0 | 111.5 | N82 T84 G90 | N82-D86 WeakPolarHBondContact O-CB 3.49Å; N82-D86 PolarHBondContact O-N 2.77Å; T84-D86 VanDerWaalsContact C-N 3.35Å; T84-D86 PolarHBondContact O-N 2.76Å; D86-G90 WeakPolarHBondContact O-CA 3.25Å; D86-G90 PolarHBondContact O-N 3.49Å |
| 87 | R | 81.3 | Confident | 76.5 | Confident | 181 Ų | 181 | 99 Ų | 99 | 68% | 0.683 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -61.5 | -52 | 168 | -72.4 | 171.7 | 69.9 | 99.3 | 6.7 | 111.3 | S83 T84 A89 G90 E91 | S83-R87 WeakPolarHBondContact O-CG 3.36Å; S83-R87 PolarHBondContact O-N 2.92Å; T84-R87 PolarHBondContact O-N 2.97Å; R87-A89 VanDerWaalsContact C-N 3.28Å; R87-A89 PolarHBondContact O-N 2.76Å; R87-G90 PolarHBondContact O-N 2.93Å; R87-E91 PolarHBondContact O-N 3.46Å |
| 88 | V | 75.4 | Confident | 74.8 | Confident | 116 Ų | 116 | 103.2 Ų | 103.2 | 70% | 0.703 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -62.7 | -33.6 | 179.5 | 174.3 | 0 | 0 | 0 | 0 | 112.5 | T84 R85 | T84-V88 WeakPolarHBondContact O-CG2 3.36Å; T84-V88 PolarHBondContact O-N 3.26Å; T84-V88 VanDerWaalsContact O-N 3.08Å; R85-V88 PolarHBondContact O-N 2.91Å |
| 89 | A | 74.9 | Confident | 73.6 | Confident | 84 Ų | 84 | 104.9 Ų | 104.9 | 69% | 0.694 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -83.2 | -26.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | R85 R87 | R85-A89 VanDerWaalsContact O-CB 3.26Å; R85-A89 WeakPolarHBondContact O-CB 2.94Å; R85-A89 PolarHBondContact O-N 2.9Å; R87-A89 VanDerWaalsContact C-N 3.28Å; R87-A89 PolarHBondContact O-N 2.76Å |
| 90 | G | 63.1 | Low | 72.7 | Confident | 58 Ų | 58 | 112.5 Ų | 112.5 | 60% | 0.598 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -90.1 | -6.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | D86 R87 S92 | D86-G90 WeakPolarHBondContact O-CA 3.25Å; D86-G90 PolarHBondContact O-N 3.49Å; R87-G90 PolarHBondContact O-N 2.93Å; G90-S92 VanDerWaalsContact C-N 3.34Å; G90-S92 PolarHBondContact O-N 2.83Å |
| 91 | E | 56.3 | Low | 71.7 | Confident | 135 Ų | 135 | 114.9 Ų | 114.9 | 63% | 0.631 | 64% | 0.642 | S | S | * | * | trans | -74.3 | 82 | -178.4 | -147.4 | 100.6 | -177.8 | 0 | 0 | 111.8 | R87 | R87-E91 PolarHBondContact O-N 3.46Š| ||
| 92 | S | 55.3 | Low | 71.3 | Confident | 125 Ų | 125 | 112.8 Ų | 112.8 | 87% | 0.874 | 64% | 0.641 | S | S | * | * | trans | -118.3 | 14.5 | 154.4 | -164.9 | 0 | 0 | 0 | 0 | 111.8 | G90 | G90-S92 VanDerWaalsContact C-N 3.34Å; G90-S92 PolarHBondContact O-N 2.83Å | ||
| 93 | A | 56.6 | Low | 71.2 | Confident | 78 Ų | 78 | 115.1 Ų | 115.1 | 65% | 0.645 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -125.4 | 103.6 | -175.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 94 | E | 52.2 | Low | 71.3 | Confident | 158 Ų | 158 | 117.7 Ų | 117.7 | 74% | 0.738 | 65% | 0.648 | S | S | * | * | trans | 66.6 | 107.8 | 170.8 | -63.2 | -65.3 | 127.1 | 0 | 0 | 116.2 | E96 | E94-E96 VanDerWaalsContact C-N 3.25Å; E94-E96 PolarHBondContact O-N 3.47Å | ||
| 95 | P | 54.7 | Low | 71.4 | Confident | 121 Ų | 121 | 118.2 Ų | 118.2 | 79% | 0.786 | 66% | 0.656 | S | S | * | * | trans | -67 | 92.9 | 162.5 | 29.9 | -29.5 | 0 | 0 | 0 | 107.4 | ||||
| 96 | E | 56.8 | Low | 71.5 | Confident | 150 Ų | 150 | 118.6 Ų | 118.6 | 70% | 0.701 | 66% | 0.662 | S | S | * | * | trans | -47.2 | 138.6 | 154.3 | -91 | -77.9 | 148 | 0 | 0 | 107.1 | E94 E98 | E94-E96 VanDerWaalsContact C-N 3.25Å; E94-E96 PolarHBondContact O-N 3.47Å; E96-E98 PolarHBondContact O-N 3.3Å | ||
| 97 | P | 56.1 | Low | 71.6 | Confident | 118 Ų | 118 | 123 Ų | 123 | 77% | 0.766 | 68% | 0.68 | S | S | * | * | trans | -68.1 | 72.5 | 176.2 | 28.7 | -33.7 | 0 | 0 | 0 | 109.1 | ||||
| 98 | E | 59.5 | Low | 72.2 | Confident | 158 Ų | 158 | 118 Ų | 118 | 74% | 0.738 | 67% | 0.669 | S | S | * | * | trans | -69 | 131.4 | 173.3 | -79.2 | -149 | 148.4 | 0 | 0 | 107.8 | E96 | E96-E98 PolarHBondContact O-N 3.3Š| ||
| 99 | P | 69.6 | Low | 72.9 | Confident | 113 Ų | 113 | 117.5 Ų | 117.5 | 73% | 0.734 | 67% | 0.666 | S | S | * | * | trans | -56.5 | 151.6 | 167.7 | 26.8 | -33.7 | 0 | 0 | 0 | 109.4 | A101 | P99-A101 PolarHBondContact O-N 2.83Š| ||
| 100 | E | 73.3 | Confident | 73.6 | Confident | 191 Ų | 191 | 119 Ų | 119 | 89% | 0.893 | 65% | 0.654 | S | S | * | * | trans | -44 | 117.9 | 177.7 | -64.5 | -180 | -178.4 | 0 | 0 | 110.6 | D102 | E100-D102 PolarHBondContact O-N 3.45Š| ||
| 101 | A | 74.4 | Confident | 74.9 | Confident | 86 Ų | 86 | 123 Ų | 123 | 71% | 0.711 | 67% | 0.666 | S | S | * | * | trans | -59.3 | 130 | -175.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | P99 Y103 | P99-A101 PolarHBondContact O-N 2.83Å; A101-Y103 PolarHBondContact O-N 3.31Å | ||
| 102 | D | 86 | Confident | 76.4 | Confident | 102 Ų | 102 | 123.2 Ų | 123.2 | 55% | 0.545 | 67% | 0.671 | S | S | . | * | trans | -53.5 | 138.1 | 178.6 | -65.2 | -59.1 | 0 | 0 | 0 | 111 | E100 Y104 K106 | E100-D102 PolarHBondContact O-N 3.45Å; D102-Y104 PolarHBondContact O-N 3.34Å; D102-K106 WeakPolarHBondContact OD2-CE 3.4Å; D102-K106 IonicContact OD2-NZ 2.77Å; D102-K106 PolarHBondContact OD2-NZ 2.81Å | ||
| 103 | Y | 90.8 | Very high | 78.1 | Confident | 123 Ų | 123 | 126 Ų | 126 | 48% | 0.482 | 67% | 0.673 | S | S | . | * | S | Bend | trans | -57.9 | -33.9 | -179.3 | 175.8 | -100.7 | 0 | 0 | 0 | 112.9 | S55 K56 A101 | S55-Y103 PolarHBondContact OG-OH 2.86Å; K56-Y103 WeakPolarHBondContact CG-O 3.44Å; K56-Y103 PolarHBondContact NZ-O 3.4Å; A101-Y103 PolarHBondContact O-N 3.31Å |
| 104 | Y | 93.9 | Very high | 79.7 | Confident | 105 Ų | 105 | 128.9 Ų | 128.9 | 41% | 0.412 | 68% | 0.682 | S | S | . | * | S | Bend | trans | -82.9 | 153 | -176.4 | -64.4 | -73.1 | 0 | 0 | 0 | 113 | S55 R58 D102 | S55-Y104 WeakPolarHBondContact O-CD1 3.47Å; S55-Y104 WeakPolarHBondContact O-CE1 3.49Å; R58-Y104 HydrophobicContact CG-CD1 3.42Å; R58-Y104 VanDerWaalsContact CG-CD1 3.42Å; R58-Y104 HydrophobicContact CG-CE1 3.56Å; R58-Y104 HydrophobicContact CG-CG 4.32Å; R58-Y104 VanDerWaalsContact NE-CD1 3.28Å; D102-Y104 PolarHBondContact O-N 3.34Å |
| 105 | A | 91.6 | Very high | 81.3 | Confident | 58 Ų | 58 | 129.7 Ų | 129.7 | 48% | 0.479 | 69% | 0.686 | S | S | . | * | trans | -63.7 | 144.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | K56 L57 | K56-A105 PolarHBondContact O-N 3.39Å; L57-A105 HydrophobicContact CD2-CB 3.82Å | ||
| 106 | K | 92.1 | Very high | 82.4 | Confident | 147 Ų | 147 | 129.6 Ų | 129.6 | 64% | 0.639 | 68% | 0.683 | S | S | * | * | trans | -107.4 | 140.6 | 172.6 | -64.4 | -173.7 | 179.7 | -175.8 | 0 | 109.4 | D102 | D102-K106 WeakPolarHBondContact OD2-CE 3.4Å; D102-K106 IonicContact OD2-NZ 2.77Å; D102-K106 PolarHBondContact OD2-NZ 2.81Å | ||
| 107 | E | 90.9 | Very high | 82.9 | Confident | 176 Ų | 176 | 130.5 Ų | 130.5 | 82% | 0.822 | 69% | 0.687 | S | S | * | * | trans | -72.6 | 131.4 | 170.4 | -173.2 | 178.5 | 174.7 | 0 | 0 | 109.3 | T109 | E107-T109 HydrophobicContact CG-CG2 4.37Š| ||
| 108 | V | 92.1 | Very high | 82.9 | Confident | 76 Ų | 76 | 132 Ų | 132 | 46% | 0.461 | 69% | 0.689 | S | S | . | * | trans | -100.9 | 128.3 | 178.2 | -170.2 | 0 | 0 | 0 | 0 | 108.1 | L80 | L80-V108 HydrophobicContact CD1-CG1 3.96Å; L80-V108 WeakPolarHBondContact CD2-O 3.46Å; L80-V108 HydrophobicContact CG-CG1 4.42Å | ||
| 109 | T | 91.4 | Very high | 82.3 | Confident | 105 Ų | 105 | 127.3 Ų | 127.3 | 64% | 0.644 | 68% | 0.682 | S | S | * | * | trans | -132.7 | 155 | 173.6 | 56.7 | 0 | 0 | 0 | 0 | 109.3 | E107 | E107-T109 HydrophobicContact CG-CG2 4.37Š| ||
| 110 | R | 88.9 | Confident | 81.4 | Confident | 116 Ų | 116 | 131.4 Ų | 131.4 | 44% | 0.438 | 69% | 0.692 | S | S | . | * | trans | -126.2 | 140.7 | 176.7 | 67.4 | -179.8 | -173.2 | 166.1 | 5.6 | 110.5 | A79 L80 | A79-R110 VanDerWaalsContact CB-NH1 3.26Å; L80-R110 HydrophobicContact CD1-CB 3.8Å; L80-R110 HydrophobicContact CD1-CG 3.9Å | ||
| 111 | V | 90.5 | Very high | 80 | Confident | 141 Ų | 141 | 130.4 Ų | 130.4 | 86% | 0.855 | 69% | 0.691 | S | S | * | * | trans | -118.2 | 128.5 | 174.1 | -176.2 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 112 | L | 87.9 | Confident | 78.4 | Confident | 140 Ų | 140 | 130 Ų | 130 | 73% | 0.733 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -85.5 | 145.2 | 177.7 | -59.2 | 178.3 | 0 | 0 | 0 | 109.8 | ||
| 113 | M | 90.6 | Very high | 76 | Confident | 183 Ų | 183 | 128.9 Ų | 128.9 | 90% | 0.901 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 151.6 | 173.1 | 61.7 | -169.7 | 177.1 | 0 | 0 | 111.2 | ||
| 114 | V | 90.6 | Very high | 73.8 | Confident | 140 Ų | 140 | 128.3 Ų | 128.3 | 85% | 0.848 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 137 | 175 | -179.6 | 0 | 0 | 0 | 0 | 109.3 | T116 | V114-T116 PolarHBondContact O-N 3.11Š|
| 115 | E | 85.1 | Confident | 71.3 | Confident | 175 Ų | 175 | 126.8 Ų | 126.8 | 82% | 0.818 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 124.9 | -179.1 | -167.6 | 159.9 | -157.3 | 0 | 0 | 111.1 | H117 | E115-H117 PolarHBondContact O-N 2.89Å; E115-H117 VanDerWaalsContact O-N 3.14Å |
| 116 | T | 79.4 | Confident | 68.9 | Low | 119 Ų | 119 | 132.9 Ų | 132.9 | 73% | 0.73 | 76% | 0.764 | S | S | * | * | trans | -75.4 | 101.8 | 173.6 | -47.5 | 0 | 0 | 0 | 0 | 108.3 | V114 N118 | V114-T116 PolarHBondContact O-N 3.11Å; T116-N118 VanDerWaalsContact C-N 3.35Å; T116-N118 PolarHBondContact O-N 3.41Å | ||
| 117 | H | 65.6 | Low | 67.1 | Low | 169 Ų | 169 | 131.9 Ų | 131.9 | 78% | 0.782 | 77% | 0.772 | S | S | * | * | trans | -67.7 | 95.7 | 165.9 | 63.5 | -77 | 0 | 0 | 0 | 108 | E115 G119 | E115-H117 PolarHBondContact O-N 2.89Å; E115-H117 VanDerWaalsContact O-N 3.14Å; H117-G119 PolarHBondContact O-N 3.31Å | ||
| 118 | N | 57.4 | Low | 64.8 | Low | 150 Ų | 150 | 127.1 Ų | 127.1 | 80% | 0.802 | 77% | 0.771 | S | S | * | * | trans | -68.4 | 104.2 | 162 | -90.5 | 5.6 | 0 | 0 | 0 | 106.5 | T116 E120 | T116-N118 VanDerWaalsContact C-N 3.35Å; T116-N118 PolarHBondContact O-N 3.41Å; N118-E120 PolarHBondContact O-N 3.03Å | ||
| 119 | G | 47.1 | Very low | 62.3 | Low | 58 Ų | 58 | 127.1 Ų | 127.1 | 60% | 0.598 | 79% | 0.786 | S | S | * | * | trans | -50.6 | 124 | -178.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | H117 L121 | H117-G119 PolarHBondContact O-N 3.31Å; G119-L121 VanDerWaalsContact C-N 3.31Å; G119-L121 PolarHBondContact O-N 3.38Å | ||
| 120 | E | 49.1 | Very low | 60 | Low | 200 Ų | 200 | 125.9 Ų | 125.9 | 94% | 0.935 | 79% | 0.794 | S | S | * | * | trans | -55.4 | 95 | 158 | -171.1 | 149.2 | 98.9 | 0 | 0 | 108.6 | N118 | N118-E120 PolarHBondContact O-N 3.03Š| ||
| 121 | L | 44.4 | Very low | 58.3 | Low | 169 Ų | 169 | 126.3 Ų | 126.3 | 89% | 0.885 | 81% | 0.812 | S | S | * | * | trans | -111.4 | 109 | 163.3 | -92.9 | 155.2 | 0 | 0 | 0 | 106.4 | G119 | G119-L121 VanDerWaalsContact C-N 3.31Å; G119-L121 PolarHBondContact O-N 3.38Å | ||
| 122 | G | 42 | Very low | 56.4 | Low | 79 Ų | 79 | 125.7 Ų | 125.7 | 81% | 0.814 | 81% | 0.811 | S | S | * | * | trans | -61.5 | 159.4 | -170.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 123 | G | 34 | Very low | 54.2 | Low | 78 Ų | 78 | 123 Ų | 123 | 80% | 0.804 | 82% | 0.817 | S | S | * | * | trans | -171 | 91.5 | 169.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 124 | A | 46.1 | Very low | 51.9 | Low | 111 Ų | 111 | 118.1 Ų | 118.1 | 92% | 0.917 | 81% | 0.813 | S | S | * | * | trans | -63.1 | 140.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 125 | G | 40.5 | Very low | 49.9 | Very low | 72 Ų | 72 | 116.6 Ų | 116.6 | 74% | 0.742 | 82% | 0.815 | S | S | * | * | trans | 108 | 97.6 | 153.9 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 126 | E | 42.1 | Very low | 47.9 | Very low | 187 Ų | 187 | 111.8 Ų | 111.8 | 87% | 0.874 | 81% | 0.813 | S | S | * | * | 166.3 | 139.9 | 108.2 | -94.2 | -141.8 | 93.8 | 0 | 0 | 112.5 | G128 | E126-G128 PolarHBondContact O-N 3.23Š| |||
| 127 | P | 53.6 | Low | 46.6 | Very low | 125 Ų | 125 | 112.7 Ų | 112.7 | 81% | 0.812 | 82% | 0.818 | S | S | * | * | trans | -88.4 | 96 | 169.6 | 33.5 | -28 | 0 | 0 | 0 | 110.6 | ||||
| 128 | G | 41.9 | Very low | 46.2 | Very low | 77 Ų | 77 | 110.9 Ų | 110.9 | 79% | 0.794 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -83.7 | 116.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | E126 | E126-G128 PolarHBondContact O-N 3.23Š|
| 129 | G | 39.3 | Very low | 45.9 | Very low | 75 Ų | 75 | 106.9 Ų | 106.9 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 151.3 | -172.4 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||
| 130 | G | 42.9 | Very low | 46.4 | Very low | 79 Ų | 79 | 110 Ų | 110 | 81% | 0.814 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 156.3 | 166 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 131 | P | 53.8 | Low | 46.6 | Very low | 126 Ų | 126 | 112.6 Ų | 112.6 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -96.5 | 158.3 | 162.1 | 34.2 | -25.8 | 0 | 0 | 0 | 111.7 | ||
| 132 | P | 50.5 | Low | 47.4 | Very low | 127 Ų | 127 | 111 Ų | 111 | 83% | 0.825 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -89 | 152.2 | -165.7 | 35 | -35.1 | 0 | 0 | 0 | 114.1 | ||
| 133 | G | 41.8 | Very low | 47.9 | Very low | 85 Ų | 85 | 114.2 Ų | 114.2 | 88% | 0.876 | 86% | 0.856 | S | S | * | * | trans | 77.3 | 111.4 | 136.5 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 134 | G | 42.1 | Very low | 48.6 | Very low | 79 Ų | 79 | 116.1 Ų | 116.1 | 81% | 0.814 | 86% | 0.859 | S | S | * | * | trans | -145.2 | 111.3 | 155.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 135 | A | 48.5 | Very low | 48.8 | Very low | 108 Ų | 108 | 116.3 Ų | 116.3 | 89% | 0.893 | 86% | 0.856 | S | S | * | * | trans | -65.7 | 155.5 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 136 | G | 43.3 | Very low | 49.2 | Very low | 74 Ų | 74 | 118.8 Ų | 118.8 | 76% | 0.763 | 86% | 0.862 | S | S | * | * | trans | -75.6 | 172.1 | -164.9 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 137 | V | 53 | Low | 49.6 | Very low | 138 Ų | 138 | 114.8 Ų | 114.8 | 84% | 0.836 | 86% | 0.862 | S | S | * | * | trans | -146.4 | 124.1 | 152.8 | -174.5 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 138 | P | 56.1 | Low | 49.4 | Very low | 131 Ų | 131 | 114.1 Ų | 114.1 | 85% | 0.851 | 87% | 0.865 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 125.2 | 171.7 | 30.5 | -30 | 0 | 0 | 0 | 111.4 | ||
| 139 | G | 51.4 | Low | 49.9 | Very low | 66 Ų | 66 | 116.6 Ų | 116.6 | 68% | 0.68 | 87% | 0.87 | S | S | * | * | P | Polyproline II helix | trans | -85.6 | 159.4 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 140 | P | 57.6 | Low | 50.6 | Low | 124 Ų | 124 | 119.6 Ų | 119.6 | 81% | 0.805 | 88% | 0.876 | S | S | * | * | P | Polyproline II helix | trans | -82.6 | 145.3 | -151.9 | 32.6 | -34.3 | 0 | 0 | 0 | 113.7 | ||
| 141 | R | 53.9 | Low | 51.2 | Low | 254 Ų | 254 | 122.7 Ų | 122.7 | 96% | 0.958 | 88% | 0.881 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 128.1 | 162.6 | -66 | -175.9 | -169.9 | -145.6 | 1.8 | 108.7 | ||
| 142 | V | 61.3 | Low | 51 | Low | 137 Ų | 137 | 122.4 Ų | 122.4 | 83% | 0.83 | 89% | 0.886 | S | S | * | * | trans | -107.1 | 125.8 | 163.6 | -170 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 143 | G | 52.9 | Low | 51.1 | Low | 146 Ų | 146 | 122 Ų | 122 | 100% | 1.505 | 89% | 0.892 | S | S | * | * | trans | -82.3 | 0 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.2 |
Retrieved 143 of 143 residues in 73 ms
(Link to these results)