| 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 | 46.5 | Very low | 59.2 | Low | 245 Ų | 245 | 137.5 Ų | 137.5 | 100% | 1.207 | 82% | 0.82 | S | S | * | * | 0 | 100.3 | 0 | -70.5 | 154.6 | 96.8 | 0 | 0 | 106.2 | |||||
| 2 | G | 57.6 | Low | 59.2 | Low | 79 Ų | 79 | 136.6 Ų | 136.6 | 81% | 0.814 | 82% | 0.82 | S | S | * | * | 60.9 | 118 | 81.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | |||||
| 3 | S | 51 | Low | 59.5 | Low | 107 Ų | 107 | 136.2 Ų | 136.2 | 75% | 0.748 | 82% | 0.819 | S | S | * | * | cis | -162.7 | 150.7 | 12.3 | 39.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 4 | K | 61.3 | Low | 59.9 | Low | 214 Ų | 214 | 132.6 Ų | 132.6 | 93% | 0.93 | 81% | 0.812 | S | S | * | * | trans | -65.9 | 126.3 | 171.5 | -55.7 | 173.8 | -177.4 | 175.5 | 0 | 109.1 | ||||
| 5 | V | 59.3 | Low | 60.4 | Low | 129 Ų | 129 | 139.4 Ų | 139.4 | 78% | 0.782 | 82% | 0.816 | S | S | * | * | trans | -124.7 | 98.4 | 163.9 | -41.1 | 0 | 0 | 0 | 0 | 108.7 | S7 | V5-S7 PolarHBondContact O-N 3.39Š| ||
| 6 | S | 62 | Low | 60.7 | Low | 99 Ų | 99 | 139.3 Ų | 139.3 | 69% | 0.692 | 82% | 0.818 | S | S | * | * | trans | -78.5 | 108.2 | 168.8 | 176.6 | 0 | 0 | 0 | 0 | 106.7 | K8 | S6-K8 PolarHBondContact O-N 3.07Š| ||
| 7 | S | 60 | Low | 61.2 | Low | 108 Ų | 108 | 140.2 Ų | 140.2 | 76% | 0.755 | 82% | 0.816 | S | S | * | * | trans | -71.8 | 98.1 | 171.9 | -173.4 | 0 | 0 | 0 | 0 | 108.5 | V5 | V5-S7 PolarHBondContact O-N 3.39Š| ||
| 8 | K | 62.8 | Low | 61.9 | Low | 187 Ų | 187 | 141.6 Ų | 141.6 | 81% | 0.813 | 81% | 0.814 | S | S | * | * | trans | -92.6 | 92.5 | 166.9 | -66.5 | -136.3 | 179.7 | -175.7 | 0 | 108.1 | S6 A10 | S6-K8 PolarHBondContact O-N 3.07Å; K8-A10 PolarHBondContact O-N 3.24Å | ||
| 9 | M | 61.5 | Low | 62.6 | Low | 171 Ų | 171 | 139.3 Ų | 139.3 | 84% | 0.842 | 81% | 0.813 | S | S | * | * | trans | -75.3 | 101.5 | 166.2 | -80.4 | -92.9 | -54.4 | 0 | 0 | 108.5 | A11 | M9-A11 PolarHBondContact O-N 3.39Š| ||
| 10 | A | 64.8 | Low | 63.6 | Low | 94 Ų | 94 | 138.3 Ų | 138.3 | 78% | 0.777 | 81% | 0.808 | S | S | * | * | trans | -76 | 109.9 | 166.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | K8 | K8-A10 PolarHBondContact O-N 3.24Š| ||
| 11 | A | 64.4 | Low | 64.7 | Low | 80 Ų | 80 | 142.3 Ų | 142.3 | 66% | 0.661 | 81% | 0.81 | S | S | * | * | trans | -67.7 | 135.7 | 171.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | M9 T13 | M9-A11 PolarHBondContact O-N 3.39Å; A11-T13 PolarHBondContact O-N 2.91Å | ||
| 12 | P | 59 | Low | 66.6 | Low | 126 Ų | 126 | 136 Ų | 136 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | -74.1 | 101.5 | 174.3 | 29.4 | -29.5 | 0 | 0 | 0 | 108.3 | A14 | P12-A14 VanDerWaalsContact C-N 3.33Å; P12-A14 PolarHBondContact O-N 3.04Å | ||
| 13 | T | 63.3 | Low | 68.1 | Low | 132 Ų | 132 | 140 Ų | 140 | 81% | 0.81 | 79% | 0.785 | S | S | * | * | trans | -65.1 | 95.5 | 167.6 | -51.7 | 0 | 0 | 0 | 0 | 108.1 | A11 R15 | A11-T13 PolarHBondContact O-N 2.91Å; T13-R15 PolarHBondContact O-N 3.27Å | ||
| 14 | A | 64.5 | Low | 69.8 | Low | 86 Ų | 86 | 138.6 Ų | 138.6 | 71% | 0.711 | 78% | 0.779 | S | S | * | * | trans | -61.3 | 116.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | P12 V16 | P12-A14 VanDerWaalsContact C-N 3.33Å; P12-A14 PolarHBondContact O-N 3.04Å; A14-V16 PolarHBondContact O-N 3.14Å | ||
| 15 | R | 67.6 | Low | 71.1 | Confident | 234 Ų | 234 | 133.6 Ų | 133.6 | 88% | 0.883 | 77% | 0.768 | S | S | * | * | trans | -72.6 | 113.3 | 174.2 | -66 | -178.8 | -179.3 | -174.9 | -0.1 | 108.2 | T13 I17 | T13-R15 PolarHBondContact O-N 3.27Å; R15-I17 PolarHBondContact O-N 3.17Å; R15-I17 VanDerWaalsContact O-N 3.14Å | ||
| 16 | V | 65.2 | Low | 72.6 | Confident | 138 Ų | 138 | 134.8 Ų | 134.8 | 84% | 0.836 | 77% | 0.77 | S | S | * | * | trans | -69.7 | 105.1 | 172.5 | 179 | 0 | 0 | 0 | 0 | 107.8 | A14 Q18 | A14-V16 PolarHBondContact O-N 3.14Å; V16-Q18 PolarHBondContact O-N 3.29Å | ||
| 17 | I | 70.1 | Confident | 73.9 | Confident | 154 Ų | 154 | 136.7 Ų | 136.7 | 79% | 0.79 | 77% | 0.77 | S | S | * | * | trans | -81.5 | 102.8 | 172.9 | -58.6 | 175.9 | 0 | 0 | 0 | 106.9 | R15 A19 | R15-I17 PolarHBondContact O-N 3.17Å; R15-I17 VanDerWaalsContact O-N 3.14Å; I17-A19 PolarHBondContact O-N 3.11Å; I17-A19 VanDerWaalsContact O-N 3.11Å | ||
| 18 | Q | 72.9 | Confident | 75.4 | Confident | 166 Ų | 166 | 141 Ų | 141 | 78% | 0.776 | 78% | 0.776 | S | S | * | * | trans | -71.2 | 104 | 170.4 | -172.3 | 175.4 | -17.3 | 0 | 0 | 108.2 | V16 V20 | V16-Q18 PolarHBondContact O-N 3.29Å; Q18-V20 PolarHBondContact O-N 3.08Å; Q18-V20 VanDerWaalsContact O-N 3.08Å | ||
| 19 | A | 76.3 | Confident | 76.5 | Confident | 97 Ų | 97 | 139.9 Ų | 139.9 | 80% | 0.802 | 77% | 0.771 | S | S | * | * | trans | -70.1 | 102.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | I17 | I17-A19 PolarHBondContact O-N 3.11Å; I17-A19 VanDerWaalsContact O-N 3.11Å | ||
| 20 | V | 82.6 | Confident | 77.8 | Confident | 119 Ų | 119 | 136.3 Ų | 136.3 | 72% | 0.721 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 121.5 | 172.4 | 179.2 | 0 | 0 | 0 | 0 | 108.5 | Q18 P22 | Q18-V20 PolarHBondContact O-N 3.08Å; Q18-V20 VanDerWaalsContact O-N 3.08Å; V20-P22 WeakPolarHBondContact O-CD 3.44Å |
| 21 | R | 85.1 | Confident | 78.8 | Confident | 224 Ų | 224 | 136.5 Ų | 136.5 | 85% | 0.845 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 121.8 | 176.1 | -177.1 | 177.6 | 177.1 | 175.7 | 0.1 | 109.3 | ||
| 22 | P | 86.6 | Confident | 79.7 | Confident | 111 Ų | 111 | 141.5 Ų | 141.5 | 72% | 0.721 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 139.5 | 175.1 | 26.8 | -33.3 | 0 | 0 | 0 | 110.3 | V20 A24 | V20-P22 WeakPolarHBondContact O-CD 3.44Å; P22-A24 PolarHBondContact O-N 3.47Å |
| 23 | H | 88.9 | Confident | 80.8 | Confident | 165 Ų | 165 | 143.3 Ų | 143.3 | 76% | 0.764 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 125.4 | 178.4 | 178.8 | 70.5 | 0 | 0 | 0 | 110.6 | ||
| 24 | A | 87.4 | Confident | 81.6 | Confident | 76 Ų | 76 | 144 Ų | 144 | 63% | 0.628 | 75% | 0.746 | S | S | * | * | trans | -92 | 113.7 | 172.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | P22 | P22-A24 PolarHBondContact O-N 3.47Š| ||
| 25 | P | 88.4 | Confident | 82.1 | Confident | 109 Ų | 109 | 144.6 Ų | 144.6 | 71% | 0.708 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 146.6 | -178.8 | 28 | -34.2 | 0 | 0 | 0 | 111.3 | ||
| 26 | L | 91.4 | Very high | 82.4 | Confident | 155 Ų | 155 | 138.8 Ų | 138.8 | 81% | 0.812 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 148.9 | 174.7 | -62.1 | 175.4 | 0 | 0 | 0 | 111.1 | ||
| 27 | I | 89 | Confident | 82.8 | Confident | 138 Ų | 138 | 143.5 Ų | 143.5 | 71% | 0.708 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 139.5 | 171.4 | 60.5 | 171 | 0 | 0 | 0 | 110.2 | F29 | I27-F29 HydrophobicContact CD1-CE1 4.48Å; I27-F29 HydrophobicContact CD1-CE2 4.31Å; I27-F29 HydrophobicContact CD1-CZ 3.89Å |
| 28 | K | 90.8 | Very high | 82.7 | Confident | 198 Ų | 198 | 141.1 Ų | 141.1 | 86% | 0.861 | 73% | 0.727 | S | S | * | * | trans | -104.3 | 130.7 | 175.6 | -63.4 | -179.3 | -177.3 | 178.8 | 0 | 109 | ||||
| 29 | F | 87.7 | Confident | 82.9 | Confident | 165 Ų | 165 | 137.3 Ų | 137.3 | 72% | 0.724 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 140.9 | 172.2 | -68 | -78.1 | 0 | 0 | 0 | 110.3 | I27 | I27-F29 HydrophobicContact CD1-CE1 4.48Å; I27-F29 HydrophobicContact CD1-CE2 4.31Å; I27-F29 HydrophobicContact CD1-CZ 3.89Å |
| 30 | P | 87.1 | Confident | 82.7 | Confident | 95 Ų | 95 | 137.6 Ų | 137.6 | 62% | 0.617 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 142.4 | 174.3 | -23.5 | 33.5 | 0 | 0 | 0 | 111.9 | R32 | P30-R32 PolarHBondContact O-N 2.94Š|
| 31 | N | 85.9 | Confident | 82.4 | Confident | 98 Ų | 98 | 138.1 Ų | 138.1 | 52% | 0.524 | 70% | 0.698 | S | S | . | * | P | Polyproline II helix | trans | -66.5 | 122.7 | 170.5 | -172.2 | -7 | 0 | 0 | 0 | 108.9 | Q33 | N31-Q33 PolarHBondContact ND2-OE1 2.82Å; N31-Q33 VanDerWaalsContact OD1-CB 3.3Å; N31-Q33 WeakPolarHBondContact OD1-CB 3.46Å; N31-Q33 VanDerWaalsContact OD1-CD 3.26Å; N31-Q33 WeakPolarHBondContact OD1-CG 3.14Å; N31-Q33 PolarHBondContact OD1-N 3.23Å |
| 32 | R | 83 | Confident | 81.7 | Confident | 186 Ų | 186 | 131.8 Ų | 131.8 | 70% | 0.702 | 68% | 0.678 | S | S | * | * | trans | -102.4 | 13.7 | -178.4 | -58.1 | -173.4 | -179.3 | -173 | -1 | 113.2 | P30 D34 I35 | P30-R32 PolarHBondContact O-N 2.94Å; R32-D34 VanDerWaalsContact C-N 3.33Å; R32-I35 HydrophobicContact CG-CD1 4.43Å; R32-I35 PolarHBondContact O-N 3.38Å | ||
| 33 | Q | 82.3 | Confident | 81 | Confident | 163 Ų | 163 | 128.6 Ų | 128.6 | 76% | 0.762 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -64.6 | -36.6 | -179.6 | -74 | 165.5 | 11.9 | 0 | 0 | 112.4 | N31 | N31-Q33 PolarHBondContact ND2-OE1 2.82Å; N31-Q33 VanDerWaalsContact OD1-CB 3.3Å; N31-Q33 WeakPolarHBondContact OD1-CB 3.46Å; N31-Q33 VanDerWaalsContact OD1-CD 3.26Å; N31-Q33 WeakPolarHBondContact OD1-CG 3.14Å; N31-Q33 PolarHBondContact OD1-N 3.23Å |
| 34 | D | 81 | Confident | 80.2 | Confident | 146 Ų | 146 | 123.9 Ų | 123.9 | 78% | 0.781 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -93 | -4.2 | -178.9 | -51.9 | -48.3 | 0 | 0 | 0 | 113.5 | R32 P36 | R32-D34 VanDerWaalsContact C-N 3.33Å; D34-P36 WeakPolarHBondContact O-CD 3.42Å |
| 35 | I | 75.3 | Confident | 79.4 | Confident | 100 Ų | 100 | 126.4 Ų | 126.4 | 51% | 0.513 | 64% | 0.638 | S | S | . | * | S | Bend | trans | -91.6 | 110.4 | 179 | -58.4 | 172.9 | 0 | 0 | 0 | 107.3 | R32 R37 | R32-I35 HydrophobicContact CG-CD1 4.43Å; R32-I35 PolarHBondContact O-N 3.38Å; I35-R37 PolarHBondContact O-N 3.18Å |
| 36 | P | 72.5 | Confident | 78.6 | Confident | 112 Ų | 112 | 128.9 Ų | 128.9 | 73% | 0.727 | 64% | 0.644 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 129.1 | 175.5 | 23.9 | -32 | 0 | 0 | 0 | 108.4 | D34 P38 | D34-P36 WeakPolarHBondContact O-CD 3.42Å; P36-P38 WeakPolarHBondContact O-CD 3.1Å; P36-P38 VanDerWaalsContact O-N 3.1Å |
| 37 | R | 73.6 | Confident | 77.6 | Confident | 237 Ų | 237 | 127.6 Ų | 127.6 | 89% | 0.894 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 122.3 | 176.8 | -71.7 | -175.1 | 178.5 | -176 | 0.2 | 107.5 | I35 N39 | I35-R37 PolarHBondContact O-N 3.18Å; R37-N39 PolarHBondContact O-N 2.84Å; R37-N39 VanDerWaalsContact O-N 3.13Å |
| 38 | P | 68.4 | Low | 76.3 | Confident | 104 Ų | 104 | 124 Ų | 124 | 68% | 0.675 | 64% | 0.635 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 125.1 | 179.6 | 23.2 | -31.8 | 0 | 0 | 0 | 108 | P36 V40 | P36-P38 WeakPolarHBondContact O-CD 3.1Å; P36-P38 VanDerWaalsContact O-N 3.1Å; P38-V40 PolarHBondContact O-N 2.8Å; P38-V40 VanDerWaalsContact O-N 3.14Å |
| 39 | N | 76.9 | Confident | 74.9 | Confident | 86 Ų | 86 | 119.4 Ų | 119.4 | 46% | 0.46 | 62% | 0.619 | S | S | . | * | P | Polyproline II helix | trans | -57.9 | 121.8 | 174.7 | 179.6 | -2.7 | 0 | 0 | 0 | 107.3 | R37 Q41 E42 A43 | R37-N39 PolarHBondContact O-N 2.84Å; R37-N39 VanDerWaalsContact O-N 3.13Å; N39-Q41 PolarHBondContact O-N 3.19Å; N39-Q41 VanDerWaalsContact O-N 3.1Å; N39-Q41 PolarHBondContact OD1-N 3.27Å; N39-Q41 VanDerWaalsContact OD1-N 3.1Å; N39-E42 HydrophobicContact CB-CB 4.3Å; N39-E42 HydrophobicContact CB-CG 4.07Å; N39-E42 PolarHBondContact O-N 3.03Å; N39-A43 PolarHBondContact O-N 3.44Å |
| 40 | V | 72.5 | Confident | 73.6 | Confident | 102 Ų | 102 | 118.6 Ų | 118.6 | 62% | 0.618 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -53.2 | -36.1 | -177.8 | -179.3 | 0 | 0 | 0 | 0 | 110.2 | P38 A43 L44 | P38-V40 PolarHBondContact O-N 2.8Å; P38-V40 VanDerWaalsContact O-N 3.14Å; V40-A43 PolarHBondContact O-N 3.3Å; V40-L44 HydrophobicContact CG1-CD1 3.5Å; V40-L44 WeakPolarHBondContact O-CB 3.3Å; V40-L44 WeakPolarHBondContact O-CD1 3.34Å; V40-L44 PolarHBondContact O-N 3.45Å |
| 41 | Q | 75.9 | Confident | 72.4 | Confident | 131 Ų | 131 | 119.3 Ų | 119.3 | 61% | 0.612 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -66.2 | -41 | 177.8 | -57.8 | -168.8 | 21.6 | 0 | 0 | 113.1 | N39 L44 K45 | N39-Q41 PolarHBondContact O-N 3.19Å; N39-Q41 VanDerWaalsContact O-N 3.1Å; N39-Q41 PolarHBondContact OD1-N 3.27Å; N39-Q41 VanDerWaalsContact OD1-N 3.1Å; Q41-L44 PolarHBondContact O-N 3.32Å; Q41-K45 VanDerWaalsContact O-CG 3.29Å; Q41-K45 WeakPolarHBondContact O-CG 3.46Å; Q41-K45 PolarHBondContact O-N 3.23Å |
| 42 | E | 71.1 | Confident | 71 | Confident | 90 Ų | 90 | 119.4 Ų | 119.4 | 42% | 0.421 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -71.5 | -36.6 | 177 | -63.4 | -56.3 | 141.6 | 0 | 0 | 111.3 | N39 L44 K45 L46 | N39-E42 HydrophobicContact CB-CB 4.3Å; N39-E42 HydrophobicContact CB-CG 4.07Å; N39-E42 PolarHBondContact O-N 3.03Å; E42-L44 PolarHBondContact O-N 3Å; E42-K45 PolarHBondContact O-N 3.12Å; E42-K45 IonicContact OE1-NZ 2.74Å; E42-K45 PolarHBondContact OE1-NZ 3.37Å; E42-K45 IonicContact OE2-NZ 3.68Å; E42-L46 WeakPolarHBondContact O-CG 3.3Å; E42-L46 PolarHBondContact O-N 3.46Å |
| 43 | A | 72.1 | Confident | 69.9 | Low | 45 Ų | 45 | 119.2 Ų | 119.2 | 37% | 0.372 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -63.6 | -39.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | N39 V40 L46 L47 | N39-A43 PolarHBondContact O-N 3.44Å; V40-A43 PolarHBondContact O-N 3.3Å; A43-L46 PolarHBondContact O-N 3.45Å; A43-L47 WeakPolarHBondContact O-CB 3.33Å; A43-L47 PolarHBondContact O-N 3.42Å; A43-L47 VanDerWaalsContact O-N 3.08Å |
| 44 | L | 72.6 | Confident | 68.1 | Low | 65 Ų | 65 | 119.2 Ų | 119.2 | 34% | 0.34 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -66 | -38.4 | 173.9 | -94.8 | 112.6 | 0 | 0 | 0 | 112.6 | V40 Q41 E42 L47 G48 L49 | V40-L44 HydrophobicContact CG1-CD1 3.5Å; V40-L44 WeakPolarHBondContact O-CB 3.3Å; V40-L44 WeakPolarHBondContact O-CD1 3.34Å; V40-L44 PolarHBondContact O-N 3.45Å; Q41-L44 PolarHBondContact O-N 3.32Å; E42-L44 PolarHBondContact O-N 3Å; L44-L47 CarbonylContact O-C 3.6Å; L44-L47 PolarHBondContact O-N 3.46Å; L44-G48 PolarHBondContact O-N 3.14Å; L44-L49 HydrophobicContact CD2-CB 4.09Å; L44-L49 HydrophobicContact CD2-CD1 4.45Å; L44-L49 PolarHBondContact O-N 3.32Å |
| 45 | K | 70.6 | Confident | 66.9 | Low | 129 Ų | 129 | 119.5 Ų | 119.5 | 56% | 0.561 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -62.8 | -44.7 | 174.5 | -71.5 | 170.3 | -169.7 | 174.2 | 0 | 111.7 | Q41 E42 L47 G48 | Q41-K45 VanDerWaalsContact O-CG 3.29Å; Q41-K45 WeakPolarHBondContact O-CG 3.46Å; Q41-K45 PolarHBondContact O-N 3.23Å; E42-K45 PolarHBondContact O-N 3.12Å; E42-K45 IonicContact OE1-NZ 2.74Å; E42-K45 PolarHBondContact OE1-NZ 3.37Å; E42-K45 IonicContact OE2-NZ 3.68Å; K45-L47 PolarHBondContact O-N 3.15Å; K45-G48 PolarHBondContact O-N 2.85Å; K45-G48 VanDerWaalsContact O-N 3.1Å |
| 46 | L | 70.5 | Confident | 65.3 | Low | 161 Ų | 161 | 118.5 Ų | 118.5 | 84% | 0.843 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -63.3 | -31.5 | 175.5 | -71.7 | 175 | 0 | 0 | 0 | 112.6 | E42 A43 G48 | E42-L46 WeakPolarHBondContact O-CG 3.3Å; E42-L46 PolarHBondContact O-N 3.46Å; A43-L46 PolarHBondContact O-N 3.45Å; L46-G48 PolarHBondContact O-N 2.97Å |
| 47 | L | 70.5 | Confident | 64 | Low | 128 Ų | 128 | 119 Ų | 119 | 67% | 0.67 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.6 | 2.3 | 177 | -158.6 | 60.3 | 0 | 0 | 0 | 113.1 | A43 L44 K45 L49 | A43-L47 WeakPolarHBondContact O-CB 3.33Å; A43-L47 PolarHBondContact O-N 3.42Å; A43-L47 VanDerWaalsContact O-N 3.08Å; L44-L47 CarbonylContact O-C 3.6Å; L44-L47 PolarHBondContact O-N 3.46Å; K45-L47 PolarHBondContact O-N 3.15Å; L47-L49 HydrophobicContact CB-CG 4.39Å; L47-L49 HydrophobicContact CD2-CD1 3.84Å; L47-L49 HydrophobicContact CD2-CG 4.38Å; L47-L49 HydrophobicContact CG-CD1 4.28Å; L47-L49 HydrophobicContact CG-CG 4.27Å; L47-L49 PolarHBondContact O-N 2.92Å |
| 48 | G | 61.5 | Low | 62.9 | Low | 63 Ų | 63 | 113.6 Ų | 113.6 | 65% | 0.649 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 67.2 | 13.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | L44 K45 L46 N50 | L44-G48 PolarHBondContact O-N 3.14Å; K45-G48 PolarHBondContact O-N 2.85Å; K45-G48 VanDerWaalsContact O-N 3.1Å; L46-G48 PolarHBondContact O-N 2.97Å; G48-N50 PolarHBondContact O-N 3.25Å; G48-N50 VanDerWaalsContact O-N 3.11Å |
| 49 | L | 61.1 | Low | 61.8 | Low | 101 Ų | 101 | 114.1 Ų | 114.1 | 53% | 0.529 | 65% | 0.654 | S | S | . | * | trans | -86.3 | 79.3 | -179.7 | -63.8 | -178.7 | 0 | 0 | 0 | 109.8 | L44 L47 V51 | L44-L49 HydrophobicContact CD2-CB 4.09Å; L44-L49 HydrophobicContact CD2-CD1 4.45Å; L44-L49 PolarHBondContact O-N 3.32Å; L47-L49 HydrophobicContact CB-CG 4.39Å; L47-L49 HydrophobicContact CD2-CD1 3.84Å; L47-L49 HydrophobicContact CD2-CG 4.38Å; L47-L49 HydrophobicContact CG-CD1 4.28Å; L47-L49 HydrophobicContact CG-CG 4.27Å; L47-L49 PolarHBondContact O-N 2.92Å; L49-V51 PolarHBondContact O-N 3.44Å | ||
| 50 | N | 61.9 | Low | 60.1 | Low | 149 Ų | 149 | 114.8 Ų | 114.8 | 80% | 0.797 | 67% | 0.671 | S | S | * | * | trans | -74 | 101.8 | 166.3 | -169.2 | 34.7 | 0 | 0 | 0 | 108.6 | G48 P52 | G48-N50 PolarHBondContact O-N 3.25Å; G48-N50 VanDerWaalsContact O-N 3.11Å; N50-P52 WeakPolarHBondContact O-CD 3.35Å | ||
| 51 | V | 60.9 | Low | 59.2 | Low | 110 Ų | 110 | 115.7 Ų | 115.7 | 67% | 0.667 | 68% | 0.682 | S | S | * | * | trans | -79.5 | 114.8 | 170.5 | 179.3 | 0 | 0 | 0 | 0 | 107.4 | L49 Q53 | L49-V51 PolarHBondContact O-N 3.44Å; V51-Q53 PolarHBondContact O-N 3.18Å | ||
| 52 | P | 57.4 | Low | 58 | Low | 100 Ų | 100 | 115.4 Ų | 115.4 | 65% | 0.649 | 69% | 0.689 | S | S | * | * | trans | -70.6 | 122.2 | 178.1 | 25.3 | -26.6 | 0 | 0 | 0 | 109.4 | N50 H54 | N50-P52 WeakPolarHBondContact O-CD 3.35Å; P52-H54 PolarHBondContact O-N 2.87Å | ||
| 53 | Q | 58.7 | Low | 57.1 | Low | 182 Ų | 182 | 117 Ų | 117 | 85% | 0.85 | 71% | 0.71 | S | S | * | * | trans | -69.5 | 96.9 | 167.8 | -174.7 | 159.2 | -41.6 | 0 | 0 | 108.1 | V51 N55 | V51-Q53 PolarHBondContact O-N 3.18Å; Q53-N55 PolarHBondContact O-N 3.33Å | ||
| 54 | H | 44.5 | Very low | 55.9 | Low | 162 Ų | 162 | 120.2 Ų | 120.2 | 75% | 0.75 | 73% | 0.73 | S | S | * | * | trans | -76.5 | 109.6 | 179.5 | 80.4 | -83 | 0 | 0 | 0 | 109.8 | P52 | P52-H54 PolarHBondContact O-N 2.87Š| ||
| 55 | N | 56.6 | Low | 55.2 | Low | 152 Ų | 152 | 126.8 Ų | 126.8 | 81% | 0.813 | 75% | 0.75 | S | S | * | * | trans | -103.9 | 103.5 | 155.1 | -92.7 | 46.8 | 0 | 0 | 0 | 106.2 | Q53 | Q53-N55 PolarHBondContact O-N 3.33Š| ||
| 56 | A | 41.5 | Very low | 54.2 | Low | 79 Ų | 79 | 125.2 Ų | 125.2 | 65% | 0.653 | 75% | 0.753 | S | S | * | * | trans | -137.2 | 138.4 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 57 | P | 46 | Very low | 53.5 | Low | 122 Ų | 122 | 126.6 Ų | 126.6 | 79% | 0.792 | 76% | 0.755 | S | S | * | * | trans | -76.1 | 142.5 | -176.5 | 30.7 | -32.5 | 0 | 0 | 0 | 111.7 | S59 | P57-S59 PolarHBondContact O-N 3.43Š| ||
| 58 | S | 50.4 | Low | 52.8 | Low | 124 Ų | 124 | 125.3 Ų | 125.3 | 87% | 0.867 | 75% | 0.753 | S | S | * | * | trans | -53.3 | 123.1 | 179.7 | -45.3 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 59 | S | 43.9 | Very low | 52.5 | Low | 116 Ų | 116 | 127.3 Ų | 127.3 | 81% | 0.811 | 75% | 0.754 | S | S | * | * | trans | -140.1 | 121 | 163.4 | -78.5 | 0 | 0 | 0 | 0 | 110.2 | P57 | P57-S59 PolarHBondContact O-N 3.43Š| ||
| 60 | A | 42.6 | Very low | 52.4 | Low | 100 Ų | 100 | 130.5 Ų | 130.5 | 83% | 0.826 | 77% | 0.771 | S | S | * | * | trans | 38.1 | 117 | 160 | 0 | 0 | 0 | 0 | 0 | 119.6 | T62 | A60-T62 PolarHBondContact O-N 2.9Š| ||
| 61 | S | 53.1 | Low | 52.2 | Low | 121 Ų | 121 | 128.9 Ų | 128.9 | 85% | 0.846 | 77% | 0.767 | S | S | * | * | trans | -56.4 | 111.6 | 168.7 | 47.1 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 62 | T | 49.4 | Very low | 52.2 | Low | 125 Ų | 125 | 129.1 Ų | 129.1 | 77% | 0.767 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -128.9 | 115.2 | 139.4 | 47.8 | 0 | 0 | 0 | 0 | 106.1 | A60 S64 | A60-T62 PolarHBondContact O-N 2.9Å; T62-S64 PolarHBondContact O-N 3.34Å |
| 63 | S | 53 | Low | 52.2 | Low | 123 Ų | 123 | 128.8 Ų | 128.8 | 86% | 0.86 | 77% | 0.77 | S | S | * | * | trans | -13.4 | 91 | -176.5 | 59.1 | 0 | 0 | 0 | 0 | 114.7 | R65 | S63-R65 VanDerWaalsContact C-N 3.25Å; S63-R65 PolarHBondContact O-N 2.82Å | ||
| 64 | S | 46.9 | Very low | 52.2 | Low | 112 Ų | 112 | 129.1 Ų | 129.1 | 78% | 0.783 | 78% | 0.777 | S | S | * | * | trans | -77 | 79 | 177.3 | 50.7 | 0 | 0 | 0 | 0 | 109.1 | T62 P66 | T62-S64 PolarHBondContact O-N 3.34Å; S64-P66 WeakPolarHBondContact O-CD 3.21Å | ||
| 65 | R | 58.1 | Low | 53.2 | Low | 203 Ų | 203 | 123.7 Ų | 123.7 | 77% | 0.766 | 77% | 0.765 | S | S | * | * | trans | -54.6 | 125.4 | 150.1 | -174.5 | 175.9 | 180 | 175.1 | 0.7 | 104.8 | S63 Q67 | S63-R65 VanDerWaalsContact C-N 3.25Å; S63-R65 PolarHBondContact O-N 2.82Å; R65-Q67 PolarHBondContact O-N 3.47Å | ||
| 66 | P | 49.3 | Very low | 53.9 | Low | 97 Ų | 97 | 122.5 Ų | 122.5 | 63% | 0.63 | 76% | 0.763 | S | S | * | * | trans | -53.8 | 117.9 | 171 | 21.6 | -29.5 | 0 | 0 | 0 | 105 | S64 V68 | S64-P66 WeakPolarHBondContact O-CD 3.21Å; P66-V68 HydrophobicContact CB-CG2 4.47Å; P66-V68 HydrophobicContact CG-CG2 4.42Å; P66-V68 PolarHBondContact O-N 2.69Å | ||
| 67 | Q | 55.1 | Low | 55.4 | Low | 190 Ų | 190 | 124 Ų | 124 | 89% | 0.888 | 77% | 0.766 | S | S | * | * | trans | -65.3 | 82.9 | 164.4 | -67.5 | -152.4 | -19.7 | 0 | 0 | 104.1 | R65 P69 | R65-Q67 PolarHBondContact O-N 3.47Å; Q67-P69 WeakPolarHBondContact O-CD 3.43Å | ||
| 68 | V | 56.6 | Low | 56.9 | Low | 101 Ų | 101 | 123 Ų | 123 | 61% | 0.612 | 75% | 0.754 | S | S | * | * | trans | -53.9 | 115.8 | 168.2 | 179.4 | 0 | 0 | 0 | 0 | 102.2 | P66 L70 | P66-V68 HydrophobicContact CB-CG2 4.47Å; P66-V68 HydrophobicContact CG-CG2 4.42Å; P66-V68 PolarHBondContact O-N 2.69Å; V68-L70 PolarHBondContact O-N 2.98Å | ||
| 69 | P | 56.4 | Low | 58.5 | Low | 104 Ų | 104 | 120.3 Ų | 120.3 | 68% | 0.675 | 74% | 0.735 | S | S | * | * | trans | -50.2 | 117.7 | 171.2 | -21.5 | 32.1 | 0 | 0 | 0 | 104.5 | Q67 T71 | Q67-P69 WeakPolarHBondContact O-CD 3.43Å; P69-T71 PolarHBondContact O-N 3.22Å | ||
| 70 | L | 59 | Low | 60.4 | Low | 168 Ų | 168 | 121.5 Ų | 121.5 | 88% | 0.88 | 73% | 0.732 | S | S | * | * | trans | -61.5 | 90.8 | 172.4 | -73 | 164 | 0 | 0 | 0 | 103.5 | V68 P72 | V68-L70 PolarHBondContact O-N 2.98Å; L70-P72 WeakPolarHBondContact O-CD 3.39Å | ||
| 71 | T | 57.4 | Low | 62.4 | Low | 116 Ų | 116 | 119.3 Ų | 119.3 | 71% | 0.712 | 71% | 0.714 | S | S | * | * | trans | -52.6 | 119.3 | 167.8 | 33.6 | 0 | 0 | 0 | 0 | 103.1 | P69 S73 | P69-T71 PolarHBondContact O-N 3.22Å; T71-S73 VanDerWaalsContact C-N 3.33Å; T71-S73 PolarHBondContact O-N 3.44Å | ||
| 72 | P | 60.2 | Low | 64 | Low | 114 Ų | 114 | 115.7 Ų | 115.7 | 74% | 0.74 | 69% | 0.689 | S | S | * | * | trans | -54.2 | 112 | 174.7 | 20.8 | -29.5 | 0 | 0 | 0 | 104.4 | L70 L74 | L70-P72 WeakPolarHBondContact O-CD 3.39Å; P72-L74 PolarHBondContact O-N 2.96Å | ||
| 73 | S | 57.8 | Low | 65.9 | Low | 93 Ų | 93 | 110.8 Ų | 110.8 | 65% | 0.65 | 66% | 0.658 | S | S | * | * | trans | -52.6 | 120.9 | 179.2 | 53.2 | 0 | 0 | 0 | 0 | 104.8 | T71 G75 | T71-S73 VanDerWaalsContact C-N 3.33Å; T71-S73 PolarHBondContact O-N 3.44Å; S73-G75 PolarHBondContact O-N 3.17Å | ||
| 74 | L | 58.3 | Low | 67.6 | Low | 189 Ų | 189 | 111.4 Ų | 111.4 | 99% | 0.99 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -73.3 | 58.3 | -176.2 | -152.6 | 93.1 | 0 | 0 | 0 | 109.1 | P72 | P72-L74 PolarHBondContact O-N 2.96Š|
| 75 | G | 65.2 | Low | 69.7 | Low | 48 Ų | 48 | 113.8 Ų | 113.8 | 50% | 0.495 | 65% | 0.646 | S | S | . | * | S | Bend | trans | -160.9 | 152.1 | -167.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | S73 | S73-G75 PolarHBondContact O-N 3.17Š|
| 76 | T | 70.9 | Confident | 71.2 | Confident | 127 Ų | 127 | 108 Ų | 108 | 78% | 0.779 | 63% | 0.63 | S | S | * | * | P | Polyproline II helix | trans | -56 | 128.5 | 179.6 | -39.8 | 0 | 0 | 0 | 0 | 109.1 | D78 | T76-D78 PolarHBondContact O-N 3.4Š|
| 77 | P | 73.5 | Confident | 73.5 | Confident | 111 Ų | 111 | 106.8 Ų | 106.8 | 72% | 0.721 | 62% | 0.622 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 127.1 | 176 | 23.5 | -32.5 | 0 | 0 | 0 | 108.8 | S79 | P77-S79 PolarHBondContact O-N 3.21Š|
| 78 | D | 76.8 | Confident | 75.2 | Confident | 102 Ų | 102 | 101.1 Ų | 101.1 | 55% | 0.545 | 61% | 0.608 | S | S | . | * | P | Polyproline II helix | trans | -61 | 123.1 | 178.8 | -74.1 | -27.2 | 0 | 0 | 0 | 109 | T76 R92 | T76-D78 PolarHBondContact O-N 3.4Å; D78-R92 IonicContact OD2-CZ 3.16Å; D78-R92 IonicContact OD2-NH1 2.69Å; D78-R92 PolarHBondContact OD2-NH1 2.88Å; D78-R92 IonicContact OD2-NH2 2.82Å; D78-R92 PolarHBondContact OD2-NH2 2.92Å |
| 79 | S | 85.3 | Confident | 77.1 | Confident | 66 Ų | 66 | 106.1 Ų | 106.1 | 46% | 0.462 | 62% | 0.616 | S | S | . | * | trans | -113.5 | 153.6 | 176.7 | 174.5 | 0 | 0 | 0 | 0 | 109.6 | P77 A81 S82 V83 | P77-S79 PolarHBondContact O-N 3.21Å; S79-A81 PolarHBondContact O-N 3.45Å; S79-A81 VanDerWaalsContact O-N 3.14Å; S79-S82 PolarHBondContact N-OG 2.83Å; S79-S82 PolarHBondContact O-N 3.19Å; S79-S82 PolarHBondContact O-OG 2.96Å; S79-V83 PolarHBondContact O-N 3.26Å; S79-V83 VanDerWaalsContact O-N 3.15Å | ||
| 80 | L | 82.9 | Confident | 78.8 | Confident | 142 Ų | 142 | 108.5 Ų | 108.5 | 74% | 0.743 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -59 | -31.8 | 179.4 | -60.6 | -151.1 | 0 | 0 | 0 | 111.8 | V83 Q84 | L80-V83 PolarHBondContact O-N 3.45Å; L80-Q84 WeakPolarHBondContact O-CG 3.26Å; L80-Q84 PolarHBondContact O-N 2.78Å; L80-Q84 VanDerWaalsContact O-N 3.12Å |
| 81 | A | 84.9 | Confident | 80.4 | Confident | 54 Ų | 54 | 106.2 Ų | 106.2 | 45% | 0.446 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -64.8 | -39.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | S79 Q84 Q85 | S79-A81 PolarHBondContact O-N 3.45Å; S79-A81 VanDerWaalsContact O-N 3.14Å; A81-Q84 PolarHBondContact O-N 2.97Å; A81-Q85 WeakPolarHBondContact O-CG 3.44Å; A81-Q85 PolarHBondContact O-N 2.9Å |
| 82 | S | 87.4 | Confident | 82 | Confident | 45 Ų | 45 | 108.4 Ų | 108.4 | 32% | 0.315 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -70.2 | -36.9 | 178.5 | 67.6 | 0 | 0 | 0 | 0 | 111.4 | S79 Q84 Q85 | S79-S82 PolarHBondContact N-OG 2.83Å; S79-S82 PolarHBondContact O-N 3.19Å; S79-S82 PolarHBondContact O-OG 2.96Å; S82-Q84 VanDerWaalsContact C-N 3.34Å; S82-Q84 PolarHBondContact O-N 2.66Å; S82-Q85 PolarHBondContact O-N 2.68Å |
| 83 | V | 88.2 | Confident | 83.3 | Confident | 22 Ų | 22 | 113.6 Ų | 113.6 | 13% | 0.133 | 59% | 0.592 | C | S | . | * | H | α-helix | trans | -65.7 | -36.6 | 176.3 | 179.7 | 0 | 0 | 0 | 0 | 111.6 | S79 L80 Q85 L86 R91 R92 | S79-V83 PolarHBondContact O-N 3.26Å; S79-V83 VanDerWaalsContact O-N 3.15Å; L80-V83 PolarHBondContact O-N 3.45Å; V83-Q85 VanDerWaalsContact C-N 3.27Å; V83-Q85 PolarHBondContact O-N 3.21Å; V83-L86 PolarHBondContact O-N 2.69Å; V83-R91 HydrophobicContact CG1-CB 4.36Å; V83-R91 WeakPolarHBondContact O-CG 3.28Å; V83-R92 HydrophobicContact CG1-CG 4.03Å; V83-R92 HydrophobicContact CG2-CG 4.34Å |
| 84 | Q | 88.8 | Confident | 84.7 | Confident | 136 Ų | 136 | 114.7 Ų | 114.7 | 64% | 0.636 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -64.7 | -31.1 | 177.8 | -75.9 | 178.3 | 1 | 0 | 0 | 113 | L80 A81 S82 L86 R91 | L80-Q84 WeakPolarHBondContact O-CG 3.26Å; L80-Q84 PolarHBondContact O-N 2.78Å; L80-Q84 VanDerWaalsContact O-N 3.12Å; A81-Q84 PolarHBondContact O-N 2.97Å; S82-Q84 VanDerWaalsContact C-N 3.34Å; S82-Q84 PolarHBondContact O-N 2.66Å; Q84-L86 VanDerWaalsContact C-N 3.29Å; Q84-L86 PolarHBondContact O-N 3.45Å; Q84-R91 PolarHBondContact O-NE 3.1Å; Q84-R91 PolarHBondContact O-NH2 3.14Å |
| 85 | Q | 91.3 | Very high | 86.2 | Confident | 162 Ų | 162 | 110.5 Ų | 110.5 | 76% | 0.757 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -71.4 | -22.6 | 178.8 | -67.9 | 169.4 | -6.6 | 0 | 0 | 113.1 | A81 S82 V83 | A81-Q85 WeakPolarHBondContact O-CG 3.44Å; A81-Q85 PolarHBondContact O-N 2.9Å; S82-Q85 PolarHBondContact O-N 2.68Å; V83-Q85 VanDerWaalsContact C-N 3.27Å; V83-Q85 PolarHBondContact O-N 3.21Å |
| 86 | L | 90.4 | Very high | 87.5 | Confident | 80 Ų | 80 | 112.1 Ų | 112.1 | 42% | 0.419 | 58% | 0.576 | S | S | . | * | S | Bend | trans | -71 | 149.2 | 179.8 | -64.7 | 175.6 | 0 | 0 | 0 | 111.9 | V83 Q84 R91 | V83-L86 PolarHBondContact O-N 2.69Å; Q84-L86 VanDerWaalsContact C-N 3.29Å; Q84-L86 PolarHBondContact O-N 3.45Å; L86-R91 HydrophobicContact CB-CG 4.35Å; L86-R91 PolarHBondContact O-NE 3.1Å; L86-R91 PolarHBondContact O-NH2 2.96Å |
| 87 | P | 96 | Very high | 88.6 | Confident | 72 Ų | 72 | 112.7 Ų | 112.7 | 47% | 0.468 | 57% | 0.573 | S | S | . | * | trans | -55.8 | 146.8 | 170.7 | -24.5 | 32.8 | 0 | 0 | 0 | 112.1 | R89 Y90 R91 | P87-R89 HydrophobicContact CB-CG 4.28Å; P87-R89 PolarHBondContact O-N 2.91Å; P87-Y90 HydrophobicContact CB-CD2 3.92Å; P87-Y90 HydrophobicContact CB-CE2 4.39Å; P87-Y90 HydrophobicContact CG-CD2 4Å; P87-Y90 HydrophobicContact CG-CE2 4.38Å; P87-Y90 PolarHBondContact O-N 3.5Å; P87-R91 PolarHBondContact O-N 2.96Å | ||
| 88 | A | 92.2 | Very high | 89.5 | Confident | 72 Ų | 72 | 112.9 Ų | 112.9 | 60% | 0.595 | 57% | 0.568 | S | S | * | * | G | 310 helix | trans | -51.2 | -37.8 | -173.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | Y90 R91 | A88-Y90 PolarHBondContact O-N 3.46Å; A88-R91 PolarHBondContact O-N 3.4Å |
| 89 | R | 95.4 | Very high | 90.3 | Very high | 206 Ų | 206 | 112.3 Ų | 112.3 | 78% | 0.777 | 56% | 0.562 | S | S | * | * | G | 310 helix | trans | -63.2 | -16.4 | 177.6 | 69.2 | -149.8 | -67 | -171.8 | -2 | 115.1 | P87 | P87-R89 HydrophobicContact CB-CG 4.28Å; P87-R89 PolarHBondContact O-N 2.91Å |
| 90 | Y | 93.3 | Very high | 90.7 | Very high | 153 Ų | 153 | 112.8 Ų | 112.8 | 60% | 0.6 | 56% | 0.558 | S | S | * | * | G | 310 helix | trans | -114.4 | -0.2 | 179.8 | -55.5 | -62 | 0 | 0 | 0 | 112.9 | P87 A88 R92 | P87-Y90 HydrophobicContact CB-CD2 3.92Å; P87-Y90 HydrophobicContact CB-CE2 4.39Å; P87-Y90 HydrophobicContact CG-CD2 4Å; P87-Y90 HydrophobicContact CG-CE2 4.38Å; P87-Y90 PolarHBondContact O-N 3.5Å; A88-Y90 PolarHBondContact O-N 3.46Å; Y90-R92 PolarHBondContact O-N 3.13Å |
| 91 | R | 92.9 | Very high | 91.2 | Very high | 120 Ų | 120 | 109.5 Ų | 109.5 | 45% | 0.453 | 54% | 0.541 | S | S | . | . | P | Polyproline II helix | trans | -76.1 | 123.4 | 177.2 | -63.9 | -170.9 | -178.1 | 116.8 | -0.3 | 109.6 | V83 Q84 L86 P87 A88 | V83-R91 HydrophobicContact CG1-CB 4.36Å; V83-R91 WeakPolarHBondContact O-CG 3.28Å; Q84-R91 PolarHBondContact O-NE 3.1Å; Q84-R91 PolarHBondContact O-NH2 3.14Å; L86-R91 HydrophobicContact CB-CG 4.35Å; L86-R91 PolarHBondContact O-NE 3.1Å; L86-R91 PolarHBondContact O-NH2 2.96Å; P87-R91 PolarHBondContact O-N 2.96Å; A88-R91 PolarHBondContact O-N 3.4Å |
| 92 | R | 89.8 | Confident | 91.7 | Very high | 162 Ų | 162 | 111.9 Ų | 111.9 | 61% | 0.611 | 54% | 0.54 | S | S | * | . | P | Polyproline II helix | trans | -73.1 | 154.9 | 171.3 | 51.5 | 175.9 | 76.6 | 150.7 | 12.4 | 111.3 | D78 V83 Y90 | D78-R92 IonicContact OD2-CZ 3.16Å; D78-R92 IonicContact OD2-NH1 2.69Å; D78-R92 PolarHBondContact OD2-NH1 2.88Å; D78-R92 IonicContact OD2-NH2 2.82Å; D78-R92 PolarHBondContact OD2-NH2 2.92Å; V83-R92 HydrophobicContact CG1-CG 4.03Å; V83-R92 HydrophobicContact CG2-CG 4.34Å; Y90-R92 PolarHBondContact O-N 3.13Å |
| 93 | R | 87.9 | Confident | 91.9 | Very high | 223 Ų | 223 | 114.6 Ų | 114.6 | 84% | 0.842 | 55% | 0.549 | S | S | * | . | P | Polyproline II helix | trans | -79.2 | 145.7 | 176.5 | -67.6 | -71.3 | -179.5 | 151.7 | 0.1 | 110.4 | ||
| 94 | P | 87.1 | Confident | 92.1 | Very high | 116 Ų | 116 | 120 Ų | 120 | 75% | 0.753 | 57% | 0.573 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 136.4 | 168.3 | -16.4 | 30 | 0 | 0 | 0 | 110.3 | ||
| 95 | L | 89.7 | Confident | 92.4 | Very high | 102 Ų | 102 | 120.3 Ų | 120.3 | 53% | 0.534 | 57% | 0.568 | S | S | . | * | P | Polyproline II helix | trans | -84.1 | 134.7 | 173.1 | -79.8 | 165.6 | 0 | 0 | 0 | 109.9 | E99 M100 I103 | L95-E99 HydrophobicContact CD2-CB 4.43Å; L95-E99 HydrophobicContact CD2-CG 3.76Å; L95-M100 HydrophobicContact CB-CG 4.07Å; L95-I103 HydrophobicContact CD2-CD1 3.93Å |
| 96 | T | 93.8 | Very high | 92.4 | Very high | 82 Ų | 82 | 115.9 Ų | 115.9 | 50% | 0.503 | 57% | 0.566 | S | S | . | * | P | Polyproline II helix | trans | -84.5 | 158.5 | 171.4 | 66.1 | 0 | 0 | 0 | 0 | 110.4 | D98 E99 M100 | T96-D98 VanDerWaalsContact C-N 3.34Å; T96-D98 PolarHBondContact O-N 3.36Å; T96-E99 PolarHBondContact O-N 2.89Å; T96-E99 VanDerWaalsContact OG1-CB 3.3Å; T96-E99 WeakPolarHBondContact OG1-CB 3.48Å; T96-E99 PolarHBondContact OG1-N 3.19Å; T96-M100 WeakPolarHBondContact O-CG 3.38Å; T96-M100 PolarHBondContact O-N 3.11Å |
| 97 | L | 93.3 | Very high | 92.3 | Very high | 138 Ų | 138 | 112.7 Ų | 112.7 | 72% | 0.723 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -61 | -42.4 | 179.5 | -67.2 | 177.2 | 0 | 0 | 0 | 112.3 | E99 M100 D101 | L97-E99 VanDerWaalsContact C-N 3.31Å; L97-E99 PolarHBondContact O-N 3.2Å; L97-M100 HydrophobicContact CD2-SD 4.16Å; L97-M100 WeakPolarHBondContact O-CB 3.33Å; L97-M100 PolarHBondContact O-N 3.28Å; L97-M100 VanDerWaalsContact O-N 3.17Å; L97-D101 PolarHBondContact O-N 3.1Å |
| 98 | D | 92.9 | Very high | 91.9 | Very high | 116 Ų | 116 | 114 Ų | 114 | 62% | 0.62 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -61.1 | -40.5 | 177.1 | -176.3 | 49 | 0 | 0 | 0 | 112 | T96 D101 Y102 | T96-D98 VanDerWaalsContact C-N 3.34Å; T96-D98 PolarHBondContact O-N 3.36Å; D98-D101 PolarHBondContact O-N 3.41Å; D98-Y102 WeakPolarHBondContact O-CB 3.19Å; D98-Y102 PolarHBondContact O-N 3.38Å |
| 99 | E | 92.3 | Very high | 91.2 | Very high | 89 Ų | 89 | 122.2 Ų | 122.2 | 42% | 0.416 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -66.7 | -40.3 | 175 | -173.7 | 176.2 | -172.9 | 0 | 0 | 111.7 | L95 T96 L97 D101 Y102 I103 | L95-E99 HydrophobicContact CD2-CB 4.43Å; L95-E99 HydrophobicContact CD2-CG 3.76Å; T96-E99 PolarHBondContact O-N 2.89Å; T96-E99 VanDerWaalsContact OG1-CB 3.3Å; T96-E99 WeakPolarHBondContact OG1-CB 3.48Å; T96-E99 PolarHBondContact OG1-N 3.19Å; L97-E99 VanDerWaalsContact C-N 3.31Å; L97-E99 PolarHBondContact O-N 3.2Å; E99-D101 VanDerWaalsContact C-N 3.3Å; E99-D101 PolarHBondContact O-N 3.08Å; E99-Y102 PolarHBondContact O-N 3.26Å; E99-I103 HydrophobicContact CG-CD1 3.87Å; E99-I103 HydrophobicContact CG-CG1 4.42Å; E99-I103 WeakPolarHBondContact O-CB 3.49Å; E99-I103 WeakPolarHBondContact O-CG1 3.45Å; E99-I103 PolarHBondContact O-N 3.2Å |
| 100 | M | 93.6 | Very high | 90.9 | Very high | 77 Ų | 77 | 118.1 Ų | 118.1 | 38% | 0.379 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -57.5 | -46.3 | 173.8 | -70.1 | 177 | 67.5 | 0 | 0 | 110.8 | L95 T96 L97 I103 Q104 | L95-M100 HydrophobicContact CB-CG 4.07Å; T96-M100 WeakPolarHBondContact O-CG 3.38Å; T96-M100 PolarHBondContact O-N 3.11Å; L97-M100 HydrophobicContact CD2-SD 4.16Å; L97-M100 WeakPolarHBondContact O-CB 3.33Å; L97-M100 PolarHBondContact O-N 3.28Å; L97-M100 VanDerWaalsContact O-N 3.17Å; M100-I103 PolarHBondContact O-N 3.06Å; M100-Q104 WeakPolarHBondContact O-CB 3.12Å; M100-Q104 VanDerWaalsContact O-CG 3.26Å; M100-Q104 WeakPolarHBondContact O-CG 3.32Å; M100-Q104 PolarHBondContact O-N 3.29Å |
| 101 | D | 94.3 | Very high | 90.8 | Very high | 72 Ų | 72 | 116.2 Ų | 116.2 | 39% | 0.385 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -69.5 | -39.2 | -179.4 | -60.9 | -27.7 | 0 | 0 | 0 | 111.5 | L97 D98 E99 Q104 R105 | L97-D101 PolarHBondContact O-N 3.1Å; D98-D101 PolarHBondContact O-N 3.41Å; E99-D101 VanDerWaalsContact C-N 3.3Å; E99-D101 PolarHBondContact O-N 3.08Å; D101-Q104 PolarHBondContact O-N 2.98Å; D101-R105 WeakPolarHBondContact O-CB 3.35Å; D101-R105 VanDerWaalsContact O-CG 3.28Å; D101-R105 WeakPolarHBondContact O-CG 3.29Å; D101-R105 PolarHBondContact O-N 3.26Å |
| 102 | Y | 94.3 | Very high | 90.7 | Very high | 105 Ų | 105 | 116 Ų | 116 | 41% | 0.412 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -61.5 | -43.4 | 175.2 | -177.1 | -94 | 0 | 0 | 0 | 112.2 | D98 E99 Q104 R105 G106 G107 P108 | D98-Y102 WeakPolarHBondContact O-CB 3.19Å; D98-Y102 PolarHBondContact O-N 3.38Å; E99-Y102 PolarHBondContact O-N 3.26Å; Y102-Q104 VanDerWaalsContact C-N 3.35Å; Y102-R105 PolarHBondContact O-N 2.74Å; Y102-G106 PolarHBondContact O-N 3.37Å; Y102-G107 VanDerWaalsContact CE2-C 3.4Å; Y102-G107 PolarHBondContact O-N 3.28Å; Y102-P108 HydrophobicContact CE2-CB 4.29Å; Y102-P108 HydrophobicContact CE2-CG 4.34Å; Y102-P108 WeakPolarHBondContact OH-CD 3.43Å; Y102-P108 WeakPolarHBondContact OH-CG 3.49Å |
| 103 | I | 93 | Very high | 90.8 | Very high | 101 Ų | 101 | 113.3 Ų | 113.3 | 52% | 0.518 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -64.6 | -40.6 | 175.2 | -68.3 | 167 | 0 | 0 | 0 | 110.9 | L95 E99 M100 G106 | L95-I103 HydrophobicContact CD2-CD1 3.93Å; E99-I103 HydrophobicContact CG-CD1 3.87Å; E99-I103 HydrophobicContact CG-CG1 4.42Å; E99-I103 WeakPolarHBondContact O-CB 3.49Å; E99-I103 WeakPolarHBondContact O-CG1 3.45Å; E99-I103 PolarHBondContact O-N 3.2Å; M100-I103 PolarHBondContact O-N 3.06Å; I103-G106 PolarHBondContact O-N 3.04Å |
| 104 | Q | 92.3 | Very high | 90.9 | Very high | 135 Ų | 135 | 106.4 Ų | 106.4 | 63% | 0.631 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -68.7 | -39.3 | 178.6 | -75.3 | -178.7 | 17.8 | 0 | 0 | 112.7 | M100 D101 Y102 G106 | M100-Q104 WeakPolarHBondContact O-CB 3.12Å; M100-Q104 VanDerWaalsContact O-CG 3.26Å; M100-Q104 WeakPolarHBondContact O-CG 3.32Å; M100-Q104 PolarHBondContact O-N 3.29Å; D101-Q104 PolarHBondContact O-N 2.98Å; Y102-Q104 VanDerWaalsContact C-N 3.35Å; Q104-G106 VanDerWaalsContact C-N 3.32Å |
| 105 | R | 93.8 | Very high | 91.2 | Very high | 143 Ų | 143 | 105.8 Ų | 105.8 | 54% | 0.54 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -69.4 | -29.3 | 175.4 | -71.9 | -173.2 | -55.6 | -99.5 | -0.8 | 112.6 | D101 Y102 | D101-R105 WeakPolarHBondContact O-CB 3.35Å; D101-R105 VanDerWaalsContact O-CG 3.28Å; D101-R105 WeakPolarHBondContact O-CG 3.29Å; D101-R105 PolarHBondContact O-N 3.26Å; Y102-R105 PolarHBondContact O-N 2.74Å |
| 106 | G | 93.2 | Very high | 91.3 | Very high | 69 Ų | 69 | 106.1 Ų | 106.1 | 71% | 0.711 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 98.3 | 17 | 174.8 | 0 | 0 | 0 | 0 | 0 | 115 | Y102 I103 Q104 | Y102-G106 PolarHBondContact O-N 3.37Å; I103-G106 PolarHBondContact O-N 3.04Å; Q104-G106 VanDerWaalsContact C-N 3.32Å |
| 107 | G | 88.3 | Confident | 91.1 | Very high | 13 Ų | 13 | 107.9 Ų | 107.9 | 13% | 0.134 | 56% | 0.559 | C | S | . | * | S | Bend | trans | 124.4 | -166.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | Y102 | Y102-G107 VanDerWaalsContact CE2-C 3.4Å; Y102-G107 PolarHBondContact O-N 3.28Å |
| 108 | P | 87.6 | Confident | 90.9 | Very high | 101 Ų | 101 | 105.4 Ų | 105.4 | 66% | 0.656 | 55% | 0.545 | S | S | * | . | trans | -81.6 | 152.2 | 173.4 | 23.7 | -8.2 | 0 | 0 | 0 | 110.6 | Y102 | Y102-P108 HydrophobicContact CE2-CB 4.29Å; Y102-P108 HydrophobicContact CE2-CG 4.34Å; Y102-P108 WeakPolarHBondContact OH-CD 3.43Å; Y102-P108 WeakPolarHBondContact OH-CG 3.49Å | ||
| 109 | E | 75.6 | Confident | 90.7 | Very high | 244 Ų | 244 | 104.5 Ų | 104.5 | 100% | 1.14 | 54% | 0.538 | S | S | * | . | trans | -72.3 | 0 | 173 | -57.5 | -68.4 | 140.9 | 0 | 0 | 112.5 |
Retrieved 109 of 109 residues in 135.7 ms
(Link to these results)