| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.5 | Very low | 49.2 | Very low | 240 Ų | 240 | 133.1 Ų | 133.1 | 100% | 1.182 | 82% | 0.824 | S | S | * | * | 0 | 110.2 | 0 | -68.1 | 168.9 | 77.6 | 0 | 0 | 106.7 | |||||
| 2 | S | 41 | Very low | 49.7 | Very low | 128 Ų | 128 | 134.2 Ų | 134.2 | 90% | 0.895 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -91.8 | 125.2 | -172.5 | -53.7 | 0 | 0 | 0 | 0 | 110.4 | ||
| 3 | V | 55.8 | Low | 49.9 | Very low | 134 Ų | 134 | 132.8 Ų | 132.8 | 81% | 0.812 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 135.3 | 170.1 | -88 | 0 | 0 | 0 | 0 | 110 | ||
| 4 | P | 51.3 | Low | 50.4 | Low | 126 Ų | 126 | 130.2 Ų | 130.2 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -80 | 125.7 | 171.8 | 30 | -29.6 | 0 | 0 | 0 | 110.3 | S6 | P4-S6 PolarHBondContact O-N 2.93Š|
| 5 | S | 45.8 | Very low | 50.5 | Low | 120 Ų | 120 | 129.5 Ų | 129.5 | 84% | 0.839 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -60 | 123.8 | 170.8 | -55 | 0 | 0 | 0 | 0 | 110.2 | L7 | S5-L7 PolarHBondContact O-N 3.04Š|
| 6 | S | 50.8 | Low | 50.7 | Low | 105 Ų | 105 | 127.9 Ų | 127.9 | 73% | 0.734 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 132.6 | 178.6 | 67.3 | 0 | 0 | 0 | 0 | 111 | P4 S8 | P4-S6 PolarHBondContact O-N 2.93Å; S6-S8 PolarHBondContact O-N 3.02Å |
| 7 | L | 50 | Low | 50.7 | Low | 143 Ų | 143 | 129.6 Ų | 129.6 | 75% | 0.749 | 78% | 0.784 | S | S | * | * | trans | -39.5 | 105.9 | 166.2 | -98.9 | 68.2 | 0 | 0 | 0 | 111.2 | S5 Q9 | S5-L7 PolarHBondContact O-N 3.04Å; L7-Q9 HydrophobicContact CB-CB 4.46Å; L7-Q9 PolarHBondContact O-N 3.07Å | ||
| 8 | S | 51.2 | Low | 50.9 | Low | 122 Ų | 122 | 127.3 Ų | 127.3 | 85% | 0.853 | 79% | 0.791 | S | S | * | * | trans | -76.5 | 71.1 | 157.5 | -64.8 | 0 | 0 | 0 | 0 | 107.5 | S6 S10 | S6-S8 PolarHBondContact O-N 3.02Å; S8-S10 VanDerWaalsContact C-N 3.26Å; S8-S10 PolarHBondContact O-N 2.85Å | ||
| 9 | Q | 50.6 | Low | 51.2 | Low | 154 Ų | 154 | 123.2 Ų | 123.2 | 72% | 0.72 | 78% | 0.776 | S | S | * | * | trans | -78.8 | 85.8 | 174.4 | -163.6 | 154 | 23.5 | 0 | 0 | 107.4 | L7 A11 | L7-Q9 HydrophobicContact CB-CB 4.46Å; L7-Q9 PolarHBondContact O-N 3.07Å; Q9-A11 VanDerWaalsContact C-N 3.35Å; Q9-A11 PolarHBondContact O-N 2.81Å | ||
| 10 | S | 52.4 | Low | 51.1 | Low | 96 Ų | 96 | 123.4 Ų | 123.4 | 67% | 0.671 | 78% | 0.779 | S | S | * | * | trans | -55.9 | 102.8 | 165.5 | -176.6 | 0 | 0 | 0 | 0 | 107.2 | S8 I12 | S8-S10 VanDerWaalsContact C-N 3.26Å; S8-S10 PolarHBondContact O-N 2.85Å; S10-I12 PolarHBondContact O-N 2.89Å | ||
| 11 | A | 53.6 | Low | 51.2 | Low | 96 Ų | 96 | 121.3 Ų | 121.3 | 79% | 0.793 | 77% | 0.773 | S | S | * | * | trans | -70.4 | 81.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 108.7 | Q9 N13 | Q9-A11 VanDerWaalsContact C-N 3.35Å; Q9-A11 PolarHBondContact O-N 2.81Å; A11-N13 PolarHBondContact O-N 2.87Å; A11-N13 VanDerWaalsContact O-N 3.16Å | ||
| 12 | I | 55.5 | Low | 52.1 | Low | 146 Ų | 146 | 117.1 Ų | 117.1 | 75% | 0.749 | 75% | 0.754 | S | S | * | * | trans | -73.4 | 104.5 | 170.3 | -61.3 | 173.1 | 0 | 0 | 0 | 106.3 | S10 A14 | S10-I12 PolarHBondContact O-N 2.89Å; I12-A14 PolarHBondContact O-N 3.27Å; I12-A14 VanDerWaalsContact O-N 3.14Å | ||
| 13 | N | 51.6 | Low | 52.7 | Low | 116 Ų | 116 | 115.4 Ų | 115.4 | 62% | 0.62 | 74% | 0.742 | S | S | * | * | trans | -68.7 | 106.5 | 174.2 | -177.4 | -3.8 | 0 | 0 | 0 | 109.3 | A11 N15 S16 | A11-N13 PolarHBondContact O-N 2.87Å; A11-N13 VanDerWaalsContact O-N 3.16Å; N13-N15 PolarHBondContact O-N 2.77Å; N13-N15 VanDerWaalsContact O-N 3.09Å; N13-N15 WeakPolarHBondContact OD1-CB 3.48Å; N13-N15 PolarHBondContact OD1-N 3.13Å; N13-S16 PolarHBondContact O-N 2.58Å | ||
| 14 | A | 57.6 | Low | 52.7 | Low | 97 Ų | 97 | 115.2 Ų | 115.2 | 80% | 0.802 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | -3.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | I12 S16 | I12-A14 PolarHBondContact O-N 3.27Å; I12-A14 VanDerWaalsContact O-N 3.14Å; A14-S16 VanDerWaalsContact C-N 3.32Å |
| 15 | N | 51.8 | Low | 53.1 | Low | 120 Ų | 120 | 115 Ų | 115 | 64% | 0.642 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.8 | 5.7 | 176.2 | -124.9 | 4.3 | 0 | 0 | 0 | 113.3 | N13 H17 | N13-N15 PolarHBondContact O-N 2.77Å; N13-N15 VanDerWaalsContact O-N 3.09Å; N13-N15 WeakPolarHBondContact OD1-CB 3.48Å; N13-N15 PolarHBondContact OD1-N 3.13Å; N15-H17 VanDerWaalsContact C-N 3.25Å; N15-H17 PolarHBondContact O-N 3.38Å |
| 16 | S | 53.3 | Low | 53.6 | Low | 103 Ų | 103 | 114.1 Ų | 114.1 | 72% | 0.72 | 72% | 0.715 | S | S | * | * | trans | -75.7 | 74.9 | 175.7 | 174.4 | 0 | 0 | 0 | 0 | 110.7 | N13 A14 G18 | N13-S16 PolarHBondContact O-N 2.58Å; A14-S16 VanDerWaalsContact C-N 3.32Å; S16-G18 PolarHBondContact O-N 3.03Å | ||
| 17 | H | 51.4 | Low | 54 | Low | 157 Ų | 157 | 112.9 Ų | 112.9 | 73% | 0.727 | 71% | 0.705 | S | S | * | * | trans | -66.5 | 127.6 | 169 | -68.8 | -71.6 | 0 | 0 | 0 | 109.9 | N15 G19 | N15-H17 VanDerWaalsContact C-N 3.25Å; N15-H17 PolarHBondContact O-N 3.38Å; H17-G19 VanDerWaalsContact C-N 3.29Å; H17-G19 PolarHBondContact O-N 3.06Å | ||
| 18 | G | 54.3 | Low | 54.5 | Low | 88 Ų | 88 | 114 Ų | 114 | 91% | 0.907 | 71% | 0.711 | S | S | * | * | trans | -64.9 | 71.8 | -173.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | S16 | S16-G18 PolarHBondContact O-N 3.03Š| ||
| 19 | G | 57 | Low | 55 | Low | 50 Ų | 50 | 117.2 Ų | 117.2 | 52% | 0.515 | 71% | 0.712 | S | S | . | * | S | Bend | trans | -83.5 | 167.2 | 151.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | H17 A21 | H17-G19 VanDerWaalsContact C-N 3.29Å; H17-G19 PolarHBondContact O-N 3.06Å; G19-A21 PolarHBondContact O-N 3.46Å |
| 20 | P | 48.3 | Very low | 55.6 | Low | 127 Ų | 127 | 110.7 Ų | 110.7 | 83% | 0.825 | 68% | 0.684 | S | S | * | * | trans | -55.3 | 111.1 | 178.5 | 23.8 | -31.9 | 0 | 0 | 0 | 108.5 | L22 | P20-L22 PolarHBondContact O-N 3.2Š| ||
| 21 | A | 53.3 | Low | 56.4 | Low | 80 Ų | 80 | 108.9 Ų | 108.9 | 66% | 0.661 | 68% | 0.675 | S | S | * | * | trans | -63.4 | 102.5 | -176.5 | 0 | 0 | 0 | 0 | 0 | 108.2 | G19 S23 | G19-A21 PolarHBondContact O-N 3.46Å; A21-S23 PolarHBondContact O-N 3.19Å | ||
| 22 | L | 57 | Low | 56.7 | Low | 151 Ų | 151 | 110.7 Ų | 110.7 | 79% | 0.791 | 67% | 0.667 | S | S | * | * | trans | -73.8 | 49.5 | 158.1 | -60.2 | -178.7 | 0 | 0 | 0 | 108.4 | P20 F24 | P20-L22 PolarHBondContact O-N 3.2Å; L22-F24 PolarHBondContact O-N 3.26Å | ||
| 23 | S | 54.5 | Low | 57.4 | Low | 92 Ų | 92 | 109 Ų | 109 | 64% | 0.643 | 66% | 0.659 | S | S | * | * | trans | -77.6 | 80.5 | 170.9 | 58.2 | 0 | 0 | 0 | 0 | 106.7 | A21 P25 | A21-S23 PolarHBondContact O-N 3.19Å; S23-P25 VanDerWaalsContact O-CD 3.27Å; S23-P25 WeakPolarHBondContact O-CD 3.48Å | ||
| 24 | F | 55.1 | Low | 58.2 | Low | 130 Ų | 130 | 109.4 Ų | 109.4 | 57% | 0.57 | 66% | 0.657 | S | S | * | * | trans | -62.4 | 120.6 | 148.8 | -80.5 | -84.3 | 0 | 0 | 0 | 105.7 | L22 L26 | L22-F24 PolarHBondContact O-N 3.26Å; F24-L26 HydrophobicContact CB-CG 4.45Å; F24-L26 PolarHBondContact O-N 3.33Å | ||
| 25 | P | 60 | Low | 58.7 | Low | 121 Ų | 121 | 108.9 Ų | 108.9 | 79% | 0.786 | 64% | 0.64 | S | S | * | * | trans | -67.8 | 83.2 | 169.5 | 27.7 | -30.4 | 0 | 0 | 0 | 106.7 | S23 P27 | S23-P25 VanDerWaalsContact O-CD 3.27Å; S23-P25 WeakPolarHBondContact O-CD 3.48Å; P25-P27 VanDerWaalsContact O-CD 3.28Å; P25-P27 WeakPolarHBondContact O-CD 3.38Å | ||
| 26 | L | 56.3 | Low | 59.7 | Low | 102 Ų | 102 | 108.8 Ų | 108.8 | 53% | 0.534 | 64% | 0.639 | S | S | . | * | trans | -69 | 119.7 | 167.9 | -73.6 | 165.5 | 0 | 0 | 0 | 105.1 | F24 L28 | F24-L26 HydrophobicContact CB-CG 4.45Å; F24-L26 PolarHBondContact O-N 3.33Å; L26-L28 HydrophobicContact CB-CD2 4.16Å; L26-L28 PolarHBondContact O-N 3.37Å | ||
| 27 | P | 59.7 | Low | 60.1 | Low | 80 Ų | 80 | 110.1 Ų | 110.1 | 52% | 0.519 | 64% | 0.638 | S | S | . | * | trans | -68.7 | 87.4 | 174.4 | 28.3 | -31.8 | 0 | 0 | 0 | 107.4 | P25 H29 A30 | P25-P27 VanDerWaalsContact O-CD 3.28Å; P25-P27 WeakPolarHBondContact O-CD 3.38Å; P27-H29 PolarHBondContact O-N 2.77Å; P27-A30 HydrophobicContact CB-CB 3.97Å; P27-A30 HydrophobicContact CG-CB 3.89Å; P27-A30 WeakPolarHBondContact O-CB 3.44Å; P27-A30 PolarHBondContact O-N 3.02Å | ||
| 28 | L | 60.5 | Low | 60.9 | Low | 167 Ų | 167 | 104.9 Ų | 104.9 | 87% | 0.874 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | -11.1 | 179.8 | -62.2 | 179.8 | 0 | 0 | 0 | 112.4 | L26 | L26-L28 HydrophobicContact CB-CD2 4.16Å; L26-L28 PolarHBondContact O-N 3.37Å |
| 29 | H | 61.5 | Low | 61.2 | Low | 189 Ų | 189 | 110.5 Ų | 110.5 | 88% | 0.875 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.7 | 6.2 | 173.8 | -153.6 | 68.8 | 0 | 0 | 0 | 113.4 | P27 | P27-H29 PolarHBondContact O-N 2.77Š|
| 30 | A | 63.8 | Low | 61.4 | Low | 17 Ų | 17 | 114.5 Ų | 114.5 | 14% | 0.14 | 63% | 0.63 | C | S | . | * | S | Bend | trans | -69.3 | 136.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | P27 Q34 L35 | P27-A30 HydrophobicContact CB-CB 3.97Å; P27-A30 HydrophobicContact CG-CB 3.89Å; P27-A30 WeakPolarHBondContact O-CB 3.44Å; P27-A30 PolarHBondContact O-N 3.02Å; A30-Q34 HydrophobicContact CB-CB 4.01Å; A30-L35 HydrophobicContact CB-CD2 3.97Å; A30-L35 HydrophobicContact CB-CG 4.04Å |
| 31 | A | 67.9 | Low | 61.8 | Low | 57 Ų | 57 | 116.4 Ų | 116.4 | 47% | 0.471 | 63% | 0.628 | S | S | . | * | trans | -60.3 | 149 | 172.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | N33 Q34 L35 | A31-N33 PolarHBondContact O-N 2.95Å; A31-Q34 HydrophobicContact CB-CG 4.45Å; A31-Q34 WeakPolarHBondContact O-CA 3.34Å; A31-Q34 WeakPolarHBondContact O-CB 3.49Å; A31-Q34 PolarHBondContact O-N 3.16Å; A31-L35 PolarHBondContact O-N 3.43Å | ||
| 32 | H | 59.5 | Low | 61.8 | Low | 135 Ų | 135 | 116.8 Ų | 116.8 | 63% | 0.625 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -46.1 | -43.1 | -176.5 | 177.9 | 73.5 | 0 | 0 | 0 | 113.7 | Q34 L35 L36 | H32-Q34 VanDerWaalsContact C-N 3.32Å; H32-Q34 PolarHBondContact O-N 3.07Å; H32-L35 PolarHBondContact O-N 3.02Å; H32-L36 WeakPolarHBondContact NE2-CD1 3.16Å; H32-L36 PolarHBondContact O-N 3.34Å |
| 33 | N | 70.4 | Confident | 61.4 | Low | 110 Ų | 110 | 114.4 Ų | 114.4 | 59% | 0.588 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -65.2 | -29.6 | 177.7 | -74.8 | -53.3 | 0 | 0 | 0 | 114.1 | A31 N37 | A31-N33 PolarHBondContact O-N 2.95Å; N33-N37 WeakPolarHBondContact O-CB 3.35Å; N33-N37 PolarHBondContact O-N 3.36Å; N33-N37 PolarHBondContact O-ND2 2.89Å |
| 34 | Q | 68.6 | Low | 61.4 | Low | 125 Ų | 125 | 114.2 Ų | 114.2 | 58% | 0.584 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -74.5 | -31.9 | 177.2 | -67.1 | 175.8 | -10.4 | 0 | 0 | 111.6 | A30 A31 H32 A38 | A30-Q34 HydrophobicContact CB-CB 4.01Å; A31-Q34 HydrophobicContact CB-CG 4.45Å; A31-Q34 WeakPolarHBondContact O-CA 3.34Å; A31-Q34 WeakPolarHBondContact O-CB 3.49Å; A31-Q34 PolarHBondContact O-N 3.16Å; H32-Q34 VanDerWaalsContact C-N 3.32Å; H32-Q34 PolarHBondContact O-N 3.07Å; Q34-A38 WeakPolarHBondContact O-CB 3.28Å; Q34-A38 PolarHBondContact O-N 3.05Å |
| 35 | L | 69.4 | Low | 61.7 | Low | 85 Ų | 85 | 113.3 Ų | 113.3 | 45% | 0.445 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -69.2 | -40.9 | 173.2 | -66 | 171.8 | 0 | 0 | 0 | 111.7 | A30 A31 H32 N37 A38 | A30-L35 HydrophobicContact CB-CD2 3.97Å; A30-L35 HydrophobicContact CB-CG 4.04Å; A31-L35 PolarHBondContact O-N 3.43Å; H32-L35 PolarHBondContact O-N 3.02Å; L35-N37 VanDerWaalsContact C-N 3.32Å; L35-N37 PolarHBondContact O-N 2.82Å; L35-A38 PolarHBondContact O-N 2.82Å |
| 36 | L | 70.8 | Confident | 61.5 | Low | 118 Ų | 118 | 113.1 Ų | 113.1 | 62% | 0.618 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -65 | -35.5 | 176.9 | -72 | 177.3 | 0 | 0 | 0 | 112.8 | H32 | H32-L36 WeakPolarHBondContact NE2-CD1 3.16Å; H32-L36 PolarHBondContact O-N 3.34Å |
| 37 | N | 63.5 | Low | 61.6 | Low | 132 Ų | 132 | 111.8 Ų | 111.8 | 71% | 0.706 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -91.4 | -4.4 | -179.1 | -69.2 | -60.6 | 0 | 0 | 0 | 113.5 | N33 L35 K39 | N33-N37 WeakPolarHBondContact O-CB 3.35Å; N33-N37 PolarHBondContact O-N 3.36Å; N33-N37 PolarHBondContact O-ND2 2.89Å; L35-N37 VanDerWaalsContact C-N 3.32Å; L35-N37 PolarHBondContact O-N 2.82Å; N37-K39 PolarHBondContact O-N 2.94Å |
| 38 | A | 67.2 | Low | 61.7 | Low | 46 Ų | 46 | 117.6 Ų | 117.6 | 38% | 0.38 | 64% | 0.643 | S | S | . | * | trans | -67.7 | 109.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | Q34 L35 L40 | Q34-A38 WeakPolarHBondContact O-CB 3.28Å; Q34-A38 PolarHBondContact O-N 3.05Å; L35-A38 PolarHBondContact O-N 2.82Å; A38-L40 PolarHBondContact O-N 3.36Å | ||
| 39 | K | 59.9 | Low | 61.9 | Low | 206 Ų | 206 | 115 Ų | 115 | 90% | 0.896 | 63% | 0.63 | S | S | * | * | trans | -62.8 | 92.1 | 163.7 | -96.7 | 179.2 | 172.1 | 178 | 0 | 107.7 | N37 Q41 | N37-K39 PolarHBondContact O-N 2.94Å; K39-Q41 PolarHBondContact O-N 3.37Å | ||
| 40 | L | 61.4 | Low | 62.2 | Low | 135 Ų | 135 | 110.5 Ų | 110.5 | 71% | 0.707 | 61% | 0.612 | S | S | * | * | trans | -63.8 | 100.8 | 169.9 | -64.6 | 175.8 | 0 | 0 | 0 | 106.9 | A38 A42 | A38-L40 PolarHBondContact O-N 3.36Å; L40-A42 PolarHBondContact O-N 2.94Å | ||
| 41 | Q | 58.3 | Low | 62.2 | Low | 167 Ų | 167 | 118 Ų | 118 | 78% | 0.78 | 64% | 0.636 | S | S | * | * | trans | -68.3 | 87.7 | 166.3 | -67 | -169.2 | 15.8 | 0 | 0 | 106.9 | K39 T43 | K39-Q41 PolarHBondContact O-N 3.37Å; Q41-T43 VanDerWaalsContact C-N 3.28Å; Q41-T43 PolarHBondContact O-N 3.21Å | ||
| 42 | A | 52.4 | Low | 61.9 | Low | 87 Ų | 87 | 119.4 Ų | 119.4 | 72% | 0.719 | 64% | 0.643 | S | S | * | * | trans | -73.5 | 85.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | L40 A44 | L40-A42 PolarHBondContact O-N 2.94Å; A42-A44 PolarHBondContact O-N 2.92Å | ||
| 43 | T | 49.2 | Very low | 61.9 | Low | 101 Ų | 101 | 117.3 Ų | 117.3 | 62% | 0.62 | 65% | 0.649 | S | S | * | * | trans | -69.3 | 90.1 | 156.6 | -62.7 | 0 | 0 | 0 | 0 | 106.3 | Q41 V45 | Q41-T43 VanDerWaalsContact C-N 3.28Å; Q41-T43 PolarHBondContact O-N 3.21Å; T43-V45 VanDerWaalsContact C-N 3.27Å; T43-V45 HydrophobicContact CG2-CG2 4.05Å; T43-V45 PolarHBondContact O-N 3.48Å | ||
| 44 | A | 53.3 | Low | 61.8 | Low | 89 Ų | 89 | 117.1 Ų | 117.1 | 74% | 0.736 | 65% | 0.646 | S | S | * | * | trans | -68.2 | 87.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | A42 V46 | A42-A44 PolarHBondContact O-N 2.92Å; A44-V46 PolarHBondContact O-N 2.97Å | ||
| 45 | V | 61.1 | Low | 61.6 | Low | 110 Ų | 110 | 113.9 Ų | 113.9 | 67% | 0.667 | 65% | 0.646 | S | S | * | * | trans | -75.4 | 104.7 | 161.5 | -177.9 | 0 | 0 | 0 | 0 | 105.9 | T43 P47 | T43-V45 VanDerWaalsContact C-N 3.27Å; T43-V45 HydrophobicContact CG2-CG2 4.05Å; T43-V45 PolarHBondContact O-N 3.48Å; V45-P47 WeakPolarHBondContact O-CD 3.46Å; V45-P47 VanDerWaalsContact O-N 3.12Å | ||
| 46 | V | 57.1 | Low | 61.2 | Low | 117 Ų | 117 | 116.7 Ų | 116.7 | 71% | 0.709 | 66% | 0.657 | S | S | * | * | trans | -55.1 | 115.7 | 171.6 | 175.6 | 0 | 0 | 0 | 0 | 107.5 | A44 K48 | A44-V46 PolarHBondContact O-N 2.97Å; V46-K48 PolarHBondContact O-N 2.85Å | ||
| 47 | P | 57.2 | Low | 60.7 | Low | 75 Ų | 75 | 114.1 Ų | 114.1 | 49% | 0.487 | 66% | 0.659 | S | S | . | * | trans | -63 | 113 | 176.7 | -18.9 | 32.1 | 0 | 0 | 0 | 107.6 | V45 D49 L50 | V45-P47 WeakPolarHBondContact O-CD 3.46Å; V45-P47 VanDerWaalsContact O-N 3.12Å; P47-D49 PolarHBondContact O-N 2.75Å; P47-L50 HydrophobicContact CB-CD1 4.34Å; P47-L50 HydrophobicContact CG-CD1 4.04Å; P47-L50 PolarHBondContact O-N 2.73Å | ||
| 48 | K | 63.5 | Low | 60 | Low | 202 Ų | 202 | 112.4 Ų | 112.4 | 88% | 0.878 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.3 | -19 | -179 | -89.4 | 173.2 | 174.5 | 172.8 | 0 | 112.8 | V46 | V46-K48 PolarHBondContact O-N 2.85Š|
| 49 | D | 64.5 | Low | 59.5 | Low | 113 Ų | 113 | 115.9 Ų | 115.9 | 60% | 0.604 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.1 | 39.7 | -175.7 | -57.2 | -49.6 | 0 | 0 | 0 | 113.6 | P47 R51 S52 A53 | P47-D49 PolarHBondContact O-N 2.75Å; D49-R51 PolarHBondContact O-N 3.02Å; D49-S52 PolarHBondContact O-N 2.84Å; D49-A53 PolarHBondContact O-N 3.26Å; D49-A53 VanDerWaalsContact O-N 3.09Å |
| 50 | L | 67.5 | Low | 59.1 | Low | 93 Ų | 93 | 112.2 Ų | 112.2 | 49% | 0.487 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -54.3 | -37.2 | 177.4 | -157.3 | 106 | 0 | 0 | 0 | 112.3 | P47 S52 A53 M54 | P47-L50 HydrophobicContact CB-CD1 4.34Å; P47-L50 HydrophobicContact CG-CD1 4.04Å; P47-L50 PolarHBondContact O-N 2.73Å; L50-S52 PolarHBondContact O-N 3.37Å; L50-A53 PolarHBondContact O-N 2.84Å; L50-M54 HydrophobicContact CD2-CE 3.97Å; L50-M54 HydrophobicContact CD2-SD 3.87Å; L50-M54 VanDerWaalsContact O-CG 3.28Å; L50-M54 WeakPolarHBondContact O-CG 3.33Å; L50-M54 PolarHBondContact O-N 2.79Å |
| 51 | R | 63.5 | Low | 58.9 | Low | 174 Ų | 174 | 112.9 Ų | 112.9 | 66% | 0.657 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -62.8 | -37.5 | 176.1 | -98.1 | 173.3 | 78.6 | -131.2 | 7.5 | 113.4 | D49 M54 G55 E56 | D49-R51 PolarHBondContact O-N 3.02Å; R51-M54 HydrophobicContact CG-CE 4.26Å; R51-M54 PolarHBondContact O-N 2.95Å; R51-G55 PolarHBondContact O-N 3.09Å; R51-E56 PolarHBondContact O-N 3.45Å |
| 52 | S | 61.1 | Low | 59 | Low | 88 Ų | 88 | 110.3 Ų | 110.3 | 62% | 0.615 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -72.7 | -37.1 | 177.2 | -57.2 | 0 | 0 | 0 | 0 | 111.2 | D49 L50 M54 G55 | D49-S52 PolarHBondContact O-N 2.84Å; L50-S52 PolarHBondContact O-N 3.37Å; S52-M54 VanDerWaalsContact C-N 3.32Å; S52-G55 PolarHBondContact O-N 2.67Å |
| 53 | A | 60.3 | Low | 59.5 | Low | 90 Ų | 90 | 109.1 Ų | 109.1 | 74% | 0.744 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -67.2 | -31.4 | 174 | 0 | 0 | 0 | 0 | 0 | 112.9 | D49 L50 G55 | D49-A53 PolarHBondContact O-N 3.26Å; D49-A53 VanDerWaalsContact O-N 3.09Å; L50-A53 PolarHBondContact O-N 2.84Å; A53-G55 VanDerWaalsContact C-N 3.25Å; A53-G55 PolarHBondContact O-N 3.28Å |
| 54 | M | 68.4 | Low | 60 | Low | 106 Ų | 106 | 108.5 Ų | 108.5 | 52% | 0.522 | 66% | 0.662 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.3 | -1.7 | 174.6 | -68 | -173.5 | -47.3 | 0 | 0 | 113.7 | L50 R51 S52 E56 | L50-M54 HydrophobicContact CD2-CE 3.97Å; L50-M54 HydrophobicContact CD2-SD 3.87Å; L50-M54 VanDerWaalsContact O-CG 3.28Å; L50-M54 WeakPolarHBondContact O-CG 3.33Å; L50-M54 PolarHBondContact O-N 2.79Å; R51-M54 HydrophobicContact CG-CE 4.26Å; R51-M54 PolarHBondContact O-N 2.95Å; S52-M54 VanDerWaalsContact C-N 3.32Å; M54-E56 HydrophobicContact CB-CG 4.41Å; M54-E56 PolarHBondContact O-N 2.66Å |
| 55 | G | 63.8 | Low | 60.4 | Low | 57 Ų | 57 | 110 Ų | 110 | 59% | 0.588 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 71.6 | 10.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | R51 S52 A53 G57 | R51-G55 PolarHBondContact O-N 3.09Å; S52-G55 PolarHBondContact O-N 2.67Å; A53-G55 VanDerWaalsContact C-N 3.25Å; A53-G55 PolarHBondContact O-N 3.28Å; G55-G57 PolarHBondContact O-N 3.1Å; G55-G57 VanDerWaalsContact O-N 3.14Å |
| 56 | E | 60.9 | Low | 60.3 | Low | 144 Ų | 144 | 108.5 Ų | 108.5 | 67% | 0.673 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | 22.4 | -174.6 | -67.1 | -161.3 | 151.7 | 0 | 0 | 114.2 | R51 M54 | R51-E56 PolarHBondContact O-N 3.45Å; M54-E56 HydrophobicContact CB-CG 4.41Å; M54-E56 PolarHBondContact O-N 2.66Å |
| 57 | G | 59.8 | Low | 60.8 | Low | 64 Ų | 64 | 106 Ų | 106 | 66% | 0.66 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -148 | 15.9 | -161.8 | 0 | 0 | 0 | 0 | 0 | 119.2 | G55 | G55-G57 PolarHBondContact O-N 3.1Å; G55-G57 VanDerWaalsContact O-N 3.14Å |
| 58 | S | 49.4 | Very low | 62.1 | Low | 97 Ų | 97 | 111.2 Ų | 111.2 | 68% | 0.678 | 67% | 0.669 | S | S | * | * | trans | -120.3 | 128.6 | 176.4 | 65.7 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 59 | V | 57.4 | Low | 63.1 | Low | 119 Ų | 119 | 108.7 Ų | 108.7 | 72% | 0.721 | 65% | 0.654 | S | S | * | * | trans | -31.3 | 146.5 | 150.6 | 173.7 | 0 | 0 | 0 | 0 | 110.9 | E61 | V59-E61 PolarHBondContact O-N 3.31Š| ||
| 60 | P | 51.9 | Low | 64.2 | Low | 129 Ų | 129 | 107.2 Ų | 107.2 | 84% | 0.838 | 65% | 0.646 | S | S | * | * | trans | -64.4 | 86.3 | 179.5 | 26.8 | -34.5 | 0 | 0 | 0 | 110.7 | ||||
| 61 | E | 57.2 | Low | 65.3 | Low | 148 Ų | 148 | 110.3 Ų | 110.3 | 69% | 0.692 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 150.6 | 163.4 | -88.1 | -72.6 | 128.1 | 0 | 0 | 109.4 | V59 G63 | V59-E61 PolarHBondContact O-N 3.31Å; E61-G63 PolarHBondContact O-N 3.47Å |
| 62 | P | 59.8 | Low | 66.5 | Low | 114 Ų | 114 | 106.7 Ų | 106.7 | 74% | 0.74 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -55.8 | 122.6 | 172.7 | -11.9 | 26.4 | 0 | 0 | 0 | 107.2 | ||
| 63 | G | 62.5 | Low | 67.9 | Low | 61 Ų | 61 | 103.8 Ų | 103.8 | 63% | 0.629 | 63% | 0.629 | S | S | * | * | P | Polyproline II helix | trans | -46.3 | 151.2 | -166.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | E61 A65 | E61-G63 PolarHBondContact O-N 3.47Å; G63-A65 PolarHBondContact O-N 2.69Å |
| 64 | P | 60.6 | Low | 69.4 | Low | 89 Ų | 89 | 105.5 Ų | 105.5 | 58% | 0.578 | 62% | 0.622 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 145.3 | -164.9 | 19.5 | -31.3 | 0 | 0 | 0 | 110.5 | N66 A67 | P64-N66 PolarHBondContact O-N 2.91Å; P64-A67 PolarHBondContact O-N 2.95Å |
| 65 | A | 60 | Low | 70.5 | Confident | 119 Ų | 119 | 102 Ų | 102 | 98% | 0.983 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.7 | 5.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | G63 | G63-A65 PolarHBondContact O-N 2.69Š|
| 66 | N | 59.7 | Low | 71.7 | Confident | 79 Ų | 79 | 105.6 Ų | 105.6 | 42% | 0.422 | 61% | 0.607 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -114.7 | 22 | -178.6 | -132.7 | -23.4 | 0 | 0 | 0 | 115 | P64 K68 W69 L70 | P64-N66 PolarHBondContact O-N 2.91Å; N66-K68 PolarHBondContact O-N 2.94Å; N66-W69 HydrophobicContact CB-CG 4.35Å; N66-W69 PolarHBondContact ND2-NE1 2.95Å; N66-W69 PolarHBondContact O-N 3.39Å; N66-W69 PolarHBondContact OD1-NE1 3.27Å; N66-L70 PolarHBondContact O-N 2.97Å |
| 67 | A | 68.6 | Low | 73 | Confident | 64 Ų | 64 | 104.9 Ų | 104.9 | 53% | 0.529 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -51.2 | -26.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | P64 K71 | P64-A67 PolarHBondContact O-N 2.95Å; A67-K71 VanDerWaalsContact O-CB 3.3Å; A67-K71 WeakPolarHBondContact O-CB 3.5Å; A67-K71 PolarHBondContact O-N 2.9Å |
| 68 | K | 84.6 | Confident | 74.5 | Confident | 186 Ų | 186 | 108.4 Ų | 108.4 | 81% | 0.809 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -67.7 | -46.5 | 175.7 | -66.4 | -175.3 | -178.6 | 179.1 | 0 | 112.6 | N66 E72 | N66-K68 PolarHBondContact O-N 2.94Å; K68-E72 VanDerWaalsContact O-CB 3.29Å; K68-E72 WeakPolarHBondContact O-CB 3.27Å; K68-E72 PolarHBondContact O-N 3.44Å |
| 69 | W | 84.1 | Confident | 76.3 | Confident | 149 Ų | 149 | 110.9 Ų | 110.9 | 56% | 0.564 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -71.6 | -32.8 | 175.5 | 78.1 | -134.2 | 0 | 0 | 0 | 112 | N66 K71 E72 G73 | N66-W69 HydrophobicContact CB-CG 4.35Å; N66-W69 PolarHBondContact ND2-NE1 2.95Å; N66-W69 PolarHBondContact O-N 3.39Å; N66-W69 PolarHBondContact OD1-NE1 3.27Å; W69-K71 VanDerWaalsContact C-N 3.33Å; W69-K71 PolarHBondContact O-N 3.09Å; W69-E72 PolarHBondContact O-N 2.9Å; W69-G73 WeakPolarHBondContact O-CA 3.26Å; W69-G73 PolarHBondContact O-N 2.92Å |
| 70 | L | 87.8 | Confident | 77.5 | Confident | 82 Ų | 82 | 108.3 Ų | 108.3 | 43% | 0.429 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -64.3 | -44.4 | -179.6 | -174.5 | 63.9 | 0 | 0 | 0 | 110.4 | N66 Q74 | N66-L70 PolarHBondContact O-N 2.97Å; L70-Q74 PolarHBondContact O-N 3.2Å |
| 71 | K | 90.7 | Very high | 78.8 | Confident | 158 Ų | 158 | 106.5 Ų | 106.5 | 69% | 0.687 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -68.1 | -43.3 | 175.4 | -172.5 | 177.4 | -179.4 | -179.6 | 0 | 112.3 | A67 W69 Q74 N75 | A67-K71 VanDerWaalsContact O-CB 3.3Å; A67-K71 WeakPolarHBondContact O-CB 3.5Å; A67-K71 PolarHBondContact O-N 2.9Å; W69-K71 VanDerWaalsContact C-N 3.33Å; W69-K71 PolarHBondContact O-N 3.09Å; K71-Q74 PolarHBondContact O-N 2.86Å; K71-N75 WeakPolarHBondContact O-CB 3.28Å; K71-N75 PolarHBondContact O-N 3.16Å |
| 72 | E | 88.1 | Confident | 79.8 | Confident | 98 Ų | 98 | 104.6 Ų | 104.6 | 46% | 0.458 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -67.1 | -39.1 | 178.5 | -175 | 54.5 | -150 | 0 | 0 | 111.8 | K68 W69 N75 Q76 | K68-E72 VanDerWaalsContact O-CB 3.29Å; K68-E72 WeakPolarHBondContact O-CB 3.27Å; K68-E72 PolarHBondContact O-N 3.44Å; W69-E72 PolarHBondContact O-N 2.9Å; E72-N75 CarbonylContact O-C 3.58Å; E72-N75 WeakPolarHBondContact O-CA 3.27Å; E72-N75 WeakPolarHBondContact O-CB 3.43Å; E72-N75 PolarHBondContact O-N 3.42Å; E72-N75 VanDerWaalsContact O-N 3.12Å; E72-Q76 WeakPolarHBondContact O-CB 3.27Å; E72-Q76 PolarHBondContact O-N 3Å |
| 73 | G | 90.6 | Very high | 80.4 | Confident | 26 Ų | 26 | 101.4 Ų | 101.4 | 27% | 0.268 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -61.5 | -45.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | W69 N75 Q76 L77 | W69-G73 WeakPolarHBondContact O-CA 3.26Å; W69-G73 PolarHBondContact O-N 2.92Å; G73-N75 VanDerWaalsContact C-N 3.3Å; G73-N75 PolarHBondContact O-N 2.82Å; G73-Q76 PolarHBondContact O-N 2.88Å; G73-L77 WeakPolarHBondContact O-CG 3.42Å; G73-L77 PolarHBondContact O-N 3.34Å |
| 74 | Q | 90.9 | Very high | 80.3 | Confident | 127 Ų | 127 | 106.9 Ų | 106.9 | 59% | 0.593 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -61.1 | -38.5 | 171.5 | -89.8 | -174.9 | -15.8 | 0 | 0 | 112.8 | L70 K71 R78 | L70-Q74 PolarHBondContact O-N 3.2Å; K71-Q74 PolarHBondContact O-N 2.86Å; Q74-R78 WeakPolarHBondContact O-CB 3.23Å; Q74-R78 PolarHBondContact O-N 2.88Å |
| 75 | N | 91.6 | Very high | 80.6 | Confident | 32 Ų | 32 | 111.3 Ų | 111.3 | 17% | 0.171 | 58% | 0.578 | C | S | . | * | H | α-helix | trans | -65.1 | -41.8 | 177 | -172.7 | 51.2 | 0 | 0 | 0 | 111.8 | K71 E72 G73 R78 R79 | K71-N75 WeakPolarHBondContact O-CB 3.28Å; K71-N75 PolarHBondContact O-N 3.16Å; E72-N75 CarbonylContact O-C 3.58Å; E72-N75 WeakPolarHBondContact O-CA 3.27Å; E72-N75 WeakPolarHBondContact O-CB 3.43Å; E72-N75 PolarHBondContact O-N 3.42Å; E72-N75 VanDerWaalsContact O-N 3.12Å; G73-N75 VanDerWaalsContact C-N 3.3Å; G73-N75 PolarHBondContact O-N 2.82Å; N75-R78 PolarHBondContact O-N 2.9Å; N75-R78 PolarHBondContact OD1-NH1 3.13Å; N75-R79 WeakPolarHBondContact O-CB 3.21Å; N75-R79 VanDerWaalsContact O-CG 3.31Å; N75-R79 WeakPolarHBondContact O-CG 3.41Å; N75-R79 PolarHBondContact O-N 3.13Å |
| 76 | Q | 90.2 | Very high | 80.9 | Confident | 133 Ų | 133 | 110.6 Ų | 110.6 | 62% | 0.621 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -65.8 | -43 | 176.7 | -169.9 | 165.1 | 29.4 | 0 | 0 | 111.7 | E72 G73 R79 A80 | E72-Q76 WeakPolarHBondContact O-CB 3.27Å; E72-Q76 PolarHBondContact O-N 3Å; G73-Q76 PolarHBondContact O-N 2.88Å; Q76-R79 PolarHBondContact O-N 3.24Å; Q76-A80 WeakPolarHBondContact O-CB 3.2Å; Q76-A80 PolarHBondContact O-N 3.4Å |
| 77 | L | 88.4 | Confident | 81.4 | Confident | 128 Ų | 128 | 115.4 Ų | 115.4 | 67% | 0.67 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -61 | -44.8 | 174.4 | -72.7 | 172.8 | 0 | 0 | 0 | 112 | G73 R79 A80 A81 | G73-L77 WeakPolarHBondContact O-CG 3.42Å; G73-L77 PolarHBondContact O-N 3.34Å; L77-R79 VanDerWaalsContact C-N 3.33Å; L77-R79 PolarHBondContact O-N 3.41Å; L77-A80 PolarHBondContact O-N 3.36Å; L77-A81 WeakPolarHBondContact O-CB 3.18Å; L77-A81 PolarHBondContact O-N 3.09Å |
| 78 | R | 90.6 | Very high | 81.3 | Confident | 139 Ų | 139 | 119 Ų | 119 | 53% | 0.525 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -61.1 | -44.6 | 176.6 | -162.8 | -170.6 | -30.6 | 93.7 | 6.4 | 111.3 | Q74 N75 A80 A81 T82 | Q74-R78 WeakPolarHBondContact O-CB 3.23Å; Q74-R78 PolarHBondContact O-N 2.88Å; N75-R78 PolarHBondContact O-N 2.9Å; N75-R78 PolarHBondContact OD1-NH1 3.13Å; R78-A80 VanDerWaalsContact C-N 3.35Å; R78-A81 PolarHBondContact O-N 2.79Å; R78-T82 WeakPolarHBondContact O-CG2 3.46Å; R78-T82 PolarHBondContact O-N 3.02Å; R78-T82 VanDerWaalsContact O-N 3.07Å; R78-T82 PolarHBondContact O-OG1 2.96Å; R78-T82 VanDerWaalsContact O-OG1 3.09Å |
| 79 | R | 86.8 | Confident | 80.6 | Confident | 149 Ų | 149 | 115.6 Ų | 115.6 | 56% | 0.562 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -61.7 | -42.1 | 176.7 | -75.5 | 176.3 | 178.9 | -177.3 | 0.5 | 111.6 | N75 Q76 L77 T82 A83 | N75-R79 WeakPolarHBondContact O-CB 3.21Å; N75-R79 VanDerWaalsContact O-CG 3.31Å; N75-R79 WeakPolarHBondContact O-CG 3.41Å; N75-R79 PolarHBondContact O-N 3.13Å; Q76-R79 PolarHBondContact O-N 3.24Å; L77-R79 VanDerWaalsContact C-N 3.33Å; L77-R79 PolarHBondContact O-N 3.41Å; R79-T82 WeakPolarHBondContact CA-OG1 3.49Å; R79-T82 PolarHBondContact O-N 3.2Å; R79-T82 PolarHBondContact O-OG1 3.42Å; R79-A83 WeakPolarHBondContact O-CA 3.45Å; R79-A83 WeakPolarHBondContact O-CB 3.41Å; R79-A83 PolarHBondContact O-N 3.09Å |
| 80 | A | 82.6 | Confident | 79.6 | Confident | 65 Ų | 65 | 115.2 Ų | 115.2 | 54% | 0.537 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -65.4 | -41 | 177 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q76 L77 R78 T82 A83 | Q76-A80 WeakPolarHBondContact O-CB 3.2Å; Q76-A80 PolarHBondContact O-N 3.4Å; L77-A80 PolarHBondContact O-N 3.36Å; R78-A80 VanDerWaalsContact C-N 3.35Å; A80-T82 VanDerWaalsContact C-N 3.3Å; A80-T82 PolarHBondContact O-N 3.1Å; A80-A83 PolarHBondContact O-N 2.98Å |
| 81 | A | 80 | Confident | 78.4 | Confident | 90 Ų | 90 | 117.7 Ų | 117.7 | 74% | 0.744 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -65.3 | -33 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | L77 R78 | L77-A81 WeakPolarHBondContact O-CB 3.18Å; L77-A81 PolarHBondContact O-N 3.09Å; R78-A81 PolarHBondContact O-N 2.79Å |
| 82 | T | 77.7 | Confident | 76.5 | Confident | 109 Ų | 109 | 115.1 Ų | 115.1 | 67% | 0.669 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -86.7 | -22.6 | 175.1 | 55.5 | 0 | 0 | 0 | 0 | 113.6 | R78 R79 A80 H84 | R78-T82 WeakPolarHBondContact O-CG2 3.46Å; R78-T82 PolarHBondContact O-N 3.02Å; R78-T82 VanDerWaalsContact O-N 3.07Å; R78-T82 PolarHBondContact O-OG1 2.96Å; R78-T82 VanDerWaalsContact O-OG1 3.09Å; R79-T82 WeakPolarHBondContact CA-OG1 3.49Å; R79-T82 PolarHBondContact O-N 3.2Å; R79-T82 PolarHBondContact O-OG1 3.42Å; A80-T82 VanDerWaalsContact C-N 3.3Å; A80-T82 PolarHBondContact O-N 3.1Å; T82-H84 PolarHBondContact O-N 3.31Å; T82-H84 VanDerWaalsContact O-N 3.12Å |
| 83 | A | 71.6 | Confident | 74.7 | Confident | 47 Ų | 47 | 115 Ų | 115 | 39% | 0.388 | 60% | 0.596 | S | S | . | * | trans | -77.9 | 100 | 177.6 | 0 | 0 | 0 | 0 | 0 | 107.5 | R79 A80 R85 | R79-A83 WeakPolarHBondContact O-CA 3.45Å; R79-A83 WeakPolarHBondContact O-CB 3.41Å; R79-A83 PolarHBondContact O-N 3.09Å; A80-A83 PolarHBondContact O-N 2.98Å; A83-R85 PolarHBondContact O-N 3.01Å | ||
| 84 | H | 61.1 | Low | 72.5 | Confident | 176 Ų | 176 | 117.8 Ų | 117.8 | 82% | 0.815 | 61% | 0.609 | S | S | * | * | trans | -66.1 | 19.3 | 175.5 | -148.5 | -84.6 | 0 | 0 | 0 | 113.6 | T82 | T82-H84 PolarHBondContact O-N 3.31Å; T82-H84 VanDerWaalsContact O-N 3.12Å | ||
| 85 | R | 67 | Low | 70.5 | Confident | 181 Ų | 181 | 120 Ų | 120 | 68% | 0.683 | 62% | 0.624 | S | S | * | * | S | Bend | trans | -128.8 | 106.8 | -171.9 | -169.5 | 174.7 | -179.7 | 109.2 | -1.6 | 109 | A83 Q87 | A83-R85 PolarHBondContact O-N 3.01Å; R85-Q87 PolarHBondContact O-N 2.88Å; R85-Q87 VanDerWaalsContact O-N 3.09Å |
| 86 | D | 67.1 | Low | 68.5 | Low | 104 Ų | 104 | 122 Ų | 122 | 56% | 0.556 | 65% | 0.645 | S | S | * | * | trans | -64.7 | 108.3 | 169.8 | -178.6 | 6.9 | 0 | 0 | 0 | 109.3 | N88 R89 | D86-N88 PolarHBondContact O-N 3.21Å; D86-N88 WeakPolarHBondContact OD1-CB 3.16Å; D86-N88 PolarHBondContact OD1-N 2.92Å; D86-R89 HydrophobicContact CB-CB 4.39Å; D86-R89 VanDerWaalsContact O-CB 3.27Å; D86-R89 WeakPolarHBondContact O-CB 3.45Å; D86-R89 PolarHBondContact O-N 3.17Å | ||
| 87 | Q | 70 | Confident | 66.5 | Low | 181 Ų | 181 | 119.5 Ų | 119.5 | 85% | 0.846 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.1 | -11.3 | 178.9 | -65.5 | -165.7 | -23.6 | 0 | 0 | 113 | R85 R89 | R85-Q87 PolarHBondContact O-N 2.88Å; R85-Q87 VanDerWaalsContact O-N 3.09Å; Q87-R89 VanDerWaalsContact C-N 3.34Å |
| 88 | N | 66.8 | Low | 64.4 | Low | 140 Ų | 140 | 122.7 Ų | 122.7 | 75% | 0.749 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.9 | 2.7 | 172.9 | -61.5 | -51.1 | 0 | 0 | 0 | 112.6 | D86 N90 | D86-N88 PolarHBondContact O-N 3.21Å; D86-N88 WeakPolarHBondContact OD1-CB 3.16Å; D86-N88 PolarHBondContact OD1-N 2.92Å; N88-N90 PolarHBondContact O-N 3.25Å |
| 89 | R | 68.9 | Low | 62.2 | Low | 113 Ų | 113 | 120.6 Ų | 120.6 | 43% | 0.426 | 66% | 0.657 | S | S | . | * | S | Bend | trans | -67.7 | 101.6 | 171.1 | -171.3 | 169.7 | 170.4 | 159.1 | -0.9 | 107.9 | D86 Q87 V91 E97 | D86-R89 HydrophobicContact CB-CB 4.39Å; D86-R89 VanDerWaalsContact O-CB 3.27Å; D86-R89 WeakPolarHBondContact O-CB 3.45Å; D86-R89 PolarHBondContact O-N 3.17Å; Q87-R89 VanDerWaalsContact C-N 3.34Å; R89-V91 PolarHBondContact O-N 3.21Å; R89-E97 IonicContact CZ-OE2 3.69Å; R89-E97 IonicContact NH1-OE2 3.87Å; R89-E97 IonicContact NH2-OE1 3.95Å; R89-E97 IonicContact NH2-OE2 2.66Å; R89-E97 PolarHBondContact NH2-OE2 3.33Å |
| 90 | N | 63 | Low | 60.3 | Low | 141 Ų | 141 | 117.6 Ų | 117.6 | 75% | 0.754 | 66% | 0.659 | S | S | * | * | trans | -45.7 | 133.1 | 167.5 | -72.4 | -44.3 | 0 | 0 | 0 | 108.2 | N88 T92 | N88-N90 PolarHBondContact O-N 3.25Å; N90-T92 PolarHBondContact O-N 2.79Å | ||
| 91 | V | 62.6 | Low | 58.5 | Low | 135 Ų | 135 | 120.6 Ų | 120.6 | 82% | 0.818 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -66.8 | 76.8 | -175.9 | -173.1 | 0 | 0 | 0 | 0 | 109.5 | R89 | R89-V91 PolarHBondContact O-N 3.21Š|
| 92 | T | 50.5 | Low | 56.9 | Low | 103 Ų | 103 | 125 Ų | 125 | 63% | 0.632 | 67% | 0.667 | S | S | * | * | trans | -118.5 | 60.3 | 160.3 | -40.4 | 0 | 0 | 0 | 0 | 105.3 | N90 T94 | N90-T92 PolarHBondContact O-N 2.79Å; T92-T94 PolarHBondContact O-N 3.44Å; T92-T94 VanDerWaalsContact O-N 3.1Å | ||
| 93 | L | 50.4 | Low | 55.3 | Low | 95 Ų | 95 | 124.1 Ų | 124.1 | 50% | 0.497 | 67% | 0.67 | S | S | . | * | trans | -74.5 | 90.7 | 162 | -72.8 | 171.4 | 0 | 0 | 0 | 105.8 | L95 | L93-L95 PolarHBondContact O-N 2.85Š| ||
| 94 | T | 45.1 | Very low | 54.1 | Low | 86 Ų | 86 | 127.9 Ų | 127.9 | 53% | 0.528 | 68% | 0.68 | S | S | . | * | trans | -57.3 | 123.2 | 149.9 | 43.2 | 0 | 0 | 0 | 0 | 106.2 | T92 A96 E97 | T92-T94 PolarHBondContact O-N 3.44Å; T92-T94 VanDerWaalsContact O-N 3.1Å; T94-A96 PolarHBondContact O-N 2.92Å; T94-E97 PolarHBondContact O-N 3.3Å | ||
| 95 | L | 49.4 | Very low | 53.4 | Low | 173 Ų | 173 | 126.3 Ų | 126.3 | 91% | 0.906 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.3 | 5.9 | -179.6 | -151 | 85.6 | 0 | 0 | 0 | 115.3 | L93 | L93-L95 PolarHBondContact O-N 2.85Š|
| 96 | A | 48.6 | Very low | 52.9 | Low | 75 Ų | 75 | 119.3 Ų | 119.3 | 62% | 0.62 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90 | -9.6 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | T94 | T94-A96 PolarHBondContact O-N 2.92Š|
| 97 | E | 48.1 | Very low | 52.3 | Low | 80 Ų | 80 | 120.6 Ų | 120.6 | 37% | 0.374 | 68% | 0.678 | S | S | . | * | S | Bend | trans | -105.9 | 5.4 | -178.7 | -81.7 | 171.7 | 128.5 | 0 | 0 | 114.9 | R89 T94 A99 | R89-E97 IonicContact CZ-OE2 3.69Å; R89-E97 IonicContact NH1-OE2 3.87Å; R89-E97 IonicContact NH2-OE1 3.95Å; R89-E97 IonicContact NH2-OE2 2.66Å; R89-E97 PolarHBondContact NH2-OE2 3.33Å; T94-E97 PolarHBondContact O-N 3.3Å; E97-A99 PolarHBondContact O-N 3.27Å |
| 98 | E | 44.4 | Very low | 51.9 | Low | 195 Ų | 195 | 116.1 Ų | 116.1 | 91% | 0.911 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.9 | -4.2 | 169.1 | -100 | -113.3 | 132.5 | 0 | 0 | 113.4 | ||
| 99 | A | 45.2 | Very low | 51.9 | Low | 95 Ų | 95 | 111.4 Ų | 111.4 | 79% | 0.785 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.3 | 6.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | E97 | E97-A99 PolarHBondContact O-N 3.27Š|
| 100 | S | 47.2 | Very low | 51.9 | Low | 86 Ų | 86 | 111.7 Ų | 111.7 | 60% | 0.601 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -131.8 | 10.8 | -166.7 | -61.5 | 0 | 0 | 0 | 0 | 117.1 | ||
| 101 | Q | 44.7 | Very low | 52.3 | Low | 128 Ų | 128 | 114 Ų | 114 | 60% | 0.598 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -129.4 | 36.8 | 179.2 | -73.1 | 179.8 | 11 | 0 | 0 | 114.6 | ||
| 102 | E | 44.8 | Very low | 53 | Low | 183 Ų | 183 | 108.6 Ų | 108.6 | 86% | 0.855 | 64% | 0.635 | S | S | * | * | trans | -123.6 | 47.6 | 155.6 | -148.7 | 105.8 | -157.9 | 0 | 0 | 109.2 | E104 | E102-E104 PolarHBondContact O-N 3.29Å; E102-E104 VanDerWaalsContact O-N 3.11Å | ||
| 103 | A | 45.3 | Very low | 54.4 | Low | 89 Ų | 89 | 107.9 Ų | 107.9 | 74% | 0.736 | 63% | 0.626 | S | S | * | * | trans | -84.7 | 71.6 | 159.6 | 0 | 0 | 0 | 0 | 0 | 107.5 | T105 | A103-T105 PolarHBondContact O-N 2.75Š| ||
| 104 | E | 46.6 | Very low | 55.9 | Low | 126 Ų | 126 | 109.5 Ų | 109.5 | 59% | 0.589 | 63% | 0.633 | S | S | * | * | trans | -43.3 | 114.2 | 170.6 | -153.6 | -99.7 | 144.9 | 0 | 0 | 109.5 | E102 A106 | E102-E104 PolarHBondContact O-N 3.29Å; E102-E104 VanDerWaalsContact O-N 3.11Å; E104-A106 PolarHBondContact O-N 3.31Å; E104-A106 VanDerWaalsContact OE1-CB 3.25Å; E104-A106 WeakPolarHBondContact OE1-CB 3.48Å; E104-A106 WeakPolarHBondContact OE2-CB 3.39Å | ||
| 105 | T | 45.3 | Very low | 57.7 | Low | 144 Ų | 144 | 111 Ų | 111 | 88% | 0.883 | 63% | 0.634 | S | S | * | * | trans | -75.9 | 37.8 | 177.6 | 57.3 | 0 | 0 | 0 | 0 | 111.8 | A103 | A103-T105 PolarHBondContact O-N 2.75Š| ||
| 106 | A | 56.9 | Low | 59.4 | Low | 33 Ų | 33 | 106.9 Ų | 106.9 | 27% | 0.273 | 61% | 0.612 | S | S | . | * | S | Bend | trans | -75.6 | 153.2 | 165.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | E104 L108 | E104-A106 PolarHBondContact O-N 3.31Å; E104-A106 VanDerWaalsContact OE1-CB 3.25Å; E104-A106 WeakPolarHBondContact OE1-CB 3.48Å; E104-A106 WeakPolarHBondContact OE2-CB 3.39Å; A106-L108 VanDerWaalsContact C-N 3.29Å; A106-L108 PolarHBondContact O-N 3.35Å |
| 107 | P | 53.7 | Low | 61.1 | Low | 131 Ų | 131 | 109.5 Ų | 109.5 | 85% | 0.851 | 61% | 0.607 | S | S | * | * | trans | -59.1 | 99.2 | 161.7 | 11.3 | -8 | 0 | 0 | 0 | 108.5 | G109 | P107-G109 PolarHBondContact O-N 2.91Š| ||
| 108 | L | 61.9 | Low | 62.9 | Low | 88 Ų | 88 | 108.2 Ų | 108.2 | 46% | 0.461 | 61% | 0.607 | S | S | . | * | trans | -58.4 | 110.5 | 174.8 | -73.4 | 142.7 | 0 | 0 | 0 | 107.5 | A106 L116 | A106-L108 VanDerWaalsContact C-N 3.29Å; A106-L108 PolarHBondContact O-N 3.35Å; L108-L116 HydrophobicContact CD1-CD1 3.41Å; L108-L116 VanDerWaalsContact CD1-CD1 3.41Å | ||
| 109 | G | 67.6 | Low | 64.9 | Low | 41 Ų | 41 | 103.9 Ų | 103.9 | 42% | 0.423 | 59% | 0.587 | S | S | . | * | trans | -55.4 | 170.3 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | P107 K111 G112 L113 | P107-G109 PolarHBondContact O-N 2.91Å; G109-K111 PolarHBondContact O-N 3.42Å; G109-G112 WeakPolarHBondContact O-CA 3.41Å; G109-G112 PolarHBondContact O-N 2.96Å; G109-L113 PolarHBondContact O-N 3.12Å | ||
| 110 | P | 68.1 | Low | 66.9 | Low | 118 Ų | 118 | 104.8 Ų | 104.8 | 77% | 0.766 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -51.4 | -30.4 | -172 | -27.3 | 32.8 | 0 | 0 | 0 | 115.1 | M114 | P110-M114 WeakPolarHBondContact O-CG 3.48Å; P110-M114 PolarHBondContact O-N 3.11Å |
| 111 | K | 72.6 | Confident | 68.7 | Low | 191 Ų | 191 | 106.2 Ų | 106.2 | 83% | 0.83 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -74.6 | -34.6 | 176.2 | -68.1 | 175.2 | 179.1 | 174.6 | 0 | 113.6 | G109 H115 | G109-K111 PolarHBondContact O-N 3.42Å; K111-H115 PolarHBondContact O-N 3.14Å; K111-H115 VanDerWaalsContact O-N 3.17Å |
| 112 | G | 76.4 | Confident | 70.4 | Confident | 20 Ų | 20 | 105 Ų | 105 | 21% | 0.206 | 57% | 0.572 | C | S | . | * | H | α-helix | trans | -70.7 | -36.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | G109 H115 L116 | G109-G112 WeakPolarHBondContact O-CA 3.41Å; G109-G112 PolarHBondContact O-N 2.96Å; G112-H115 WeakPolarHBondContact O-CB 3.08Å; G112-H115 PolarHBondContact O-N 3.37Å; G112-L116 PolarHBondContact O-N 3.21Å; G112-L116 VanDerWaalsContact O-N 3.1Å |
| 113 | L | 80.9 | Confident | 72 | Confident | 88 Ų | 88 | 99.8 Ų | 99.8 | 46% | 0.461 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -65.8 | -39.7 | 175.8 | -158.3 | 116.7 | 0 | 0 | 0 | 112.1 | G109 H115 L116 Y117 | G109-L113 PolarHBondContact O-N 3.12Å; L113-H115 VanDerWaalsContact C-N 3.35Å; L113-L116 WeakPolarHBondContact O-CB 3.28Å; L113-L116 PolarHBondContact O-N 3.03Å; L113-Y117 HydrophobicContact CD2-CD2 4.24Å; L113-Y117 HydrophobicContact CD2-CE2 3.48Å; L113-Y117 VanDerWaalsContact CD2-CE2 3.48Å; L113-Y117 HydrophobicContact CG-CE2 4.13Å; L113-Y117 WeakPolarHBondContact O-CD2 3.48Å; L113-Y117 PolarHBondContact O-N 3.09Å |
| 114 | M | 80.3 | Confident | 73.7 | Confident | 130 Ų | 130 | 98.4 Ų | 98.4 | 64% | 0.64 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64.4 | -36.4 | 172.8 | -72.6 | -62.8 | -61.8 | 0 | 0 | 113 | P110 L116 Y117 S118 | P110-M114 WeakPolarHBondContact O-CG 3.48Å; P110-M114 PolarHBondContact O-N 3.11Å; M114-L116 VanDerWaalsContact C-N 3.33Å; M114-Y117 PolarHBondContact O-N 3.45Å; M114-S118 PolarHBondContact O-N 3.46Å; M114-S118 VanDerWaalsContact O-N 3.13Å |
| 115 | H | 84.5 | Confident | 75 | Confident | 118 Ų | 118 | 98.5 Ų | 98.5 | 55% | 0.546 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -63.3 | -42.9 | 175.8 | -161.1 | 64 | 0 | 0 | 0 | 111.1 | K111 G112 L113 Y117 S118 E119 | K111-H115 PolarHBondContact O-N 3.14Å; K111-H115 VanDerWaalsContact O-N 3.17Å; G112-H115 WeakPolarHBondContact O-CB 3.08Å; G112-H115 PolarHBondContact O-N 3.37Å; L113-H115 VanDerWaalsContact C-N 3.35Å; H115-Y117 PolarHBondContact O-N 3.22Å; H115-S118 WeakPolarHBondContact O-CB 2.94Å; H115-S118 PolarHBondContact O-N 2.95Å; H115-S118 VanDerWaalsContact O-N 3.13Å; H115-E119 IonicContact CD2-OE2 3.02Å; H115-E119 PolarHBondContact CD2-OE2 3.26Å; H115-E119 IonicContact CG-OE2 3.95Å; H115-E119 IonicContact NE2-OE2 3.55Å; H115-E119 WeakPolarHBondContact O-CG 3.25Å; H115-E119 PolarHBondContact O-N 3.31Å |
| 116 | L | 84.4 | Confident | 76.2 | Confident | 86 Ų | 86 | 96.5 Ų | 96.5 | 45% | 0.45 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.2 | -42 | 176.6 | -117.8 | 144 | 0 | 0 | 0 | 113 | L108 G112 L113 M114 E119 L120 | L108-L116 HydrophobicContact CD1-CD1 3.41Å; L108-L116 VanDerWaalsContact CD1-CD1 3.41Å; G112-L116 PolarHBondContact O-N 3.21Å; G112-L116 VanDerWaalsContact O-N 3.1Å; L113-L116 WeakPolarHBondContact O-CB 3.28Å; L113-L116 PolarHBondContact O-N 3.03Å; M114-L116 VanDerWaalsContact C-N 3.33Å; L116-E119 PolarHBondContact O-N 3.46Å; L116-L120 VanDerWaalsContact O-CB 3.27Å; L116-L120 WeakPolarHBondContact O-CB 3.45Å; L116-L120 PolarHBondContact O-N 2.79Å |
| 117 | Y | 84.4 | Confident | 76.9 | Confident | 129 Ų | 129 | 97.9 Ų | 97.9 | 51% | 0.506 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.7 | -44.3 | 173.9 | -74.8 | -62.7 | 0 | 0 | 0 | 111.8 | L113 M114 H115 E119 L120 E121 | L113-Y117 HydrophobicContact CD2-CD2 4.24Å; L113-Y117 HydrophobicContact CD2-CE2 3.48Å; L113-Y117 VanDerWaalsContact CD2-CE2 3.48Å; L113-Y117 HydrophobicContact CG-CE2 4.13Å; L113-Y117 WeakPolarHBondContact O-CD2 3.48Å; L113-Y117 PolarHBondContact O-N 3.09Å; M114-Y117 PolarHBondContact O-N 3.45Å; H115-Y117 PolarHBondContact O-N 3.22Å; Y117-E119 VanDerWaalsContact C-N 3.35Å; Y117-E119 PolarHBondContact O-N 3.4Å; Y117-L120 PolarHBondContact O-N 2.8Å; Y117-E121 WeakPolarHBondContact O-CB 3.41Å; Y117-E121 WeakPolarHBondContact O-CG 3.35Å; Y117-E121 PolarHBondContact O-N 3.01Å |
| 118 | S | 86.2 | Confident | 77.5 | Confident | 54 Ų | 54 | 95.4 Ų | 95.4 | 38% | 0.378 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.3 | -42 | 176.4 | -177.4 | 0 | 0 | 0 | 0 | 112.3 | M114 H115 L122 | M114-S118 PolarHBondContact O-N 3.46Å; M114-S118 VanDerWaalsContact O-N 3.13Å; H115-S118 WeakPolarHBondContact O-CB 2.94Å; H115-S118 PolarHBondContact O-N 2.95Å; H115-S118 VanDerWaalsContact O-N 3.13Å; S118-L122 WeakPolarHBondContact O-CB 3.49Å; S118-L122 WeakPolarHBondContact O-CD1 3.47Å; S118-L122 VanDerWaalsContact O-CG 3.23Å; S118-L122 WeakPolarHBondContact O-CG 3.36Å; S118-L122 PolarHBondContact O-N 2.88Å; S118-L122 VanDerWaalsContact O-N 3.09Å |
| 119 | E | 86.6 | Confident | 77.4 | Confident | 104 Ų | 104 | 97.5 Ų | 97.5 | 49% | 0.486 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -67 | -39.9 | 177.1 | -73.1 | -173.9 | 77.8 | 0 | 0 | 111.8 | H115 L116 Y117 L122 S123 | H115-E119 IonicContact CD2-OE2 3.02Å; H115-E119 PolarHBondContact CD2-OE2 3.26Å; H115-E119 IonicContact CG-OE2 3.95Å; H115-E119 IonicContact NE2-OE2 3.55Å; H115-E119 WeakPolarHBondContact O-CG 3.25Å; H115-E119 PolarHBondContact O-N 3.31Å; L116-E119 PolarHBondContact O-N 3.46Å; Y117-E119 VanDerWaalsContact C-N 3.35Å; Y117-E119 PolarHBondContact O-N 3.4Å; E119-L122 PolarHBondContact O-N 3.4Å; E119-S123 VanDerWaalsContact O-CB 3.26Å; E119-S123 WeakPolarHBondContact O-CB 3.48Å; E119-S123 PolarHBondContact O-N 3.33Å |
| 120 | L | 86.6 | Confident | 76.9 | Confident | 113 Ų | 113 | 105.9 Ų | 105.9 | 59% | 0.592 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -67 | -40.5 | 178.4 | -162.3 | 75.5 | 0 | 0 | 0 | 111.6 | L116 Y117 S123 A124 | L116-L120 VanDerWaalsContact O-CB 3.27Å; L116-L120 WeakPolarHBondContact O-CB 3.45Å; L116-L120 PolarHBondContact O-N 2.79Å; Y117-L120 PolarHBondContact O-N 2.8Å; L120-S123 PolarHBondContact O-N 2.73Å; L120-A124 VanDerWaalsContact O-CB 3.28Å; L120-A124 WeakPolarHBondContact O-CB 3.31Å; L120-A124 PolarHBondContact O-N 3.48Å |
| 121 | E | 84.3 | Confident | 76.3 | Confident | 117 Ų | 117 | 102.3 Ų | 102.3 | 55% | 0.547 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62 | -44.9 | 174.7 | -73.6 | 160.9 | -175.8 | 0 | 0 | 111.2 | Y117 H125 | Y117-E121 WeakPolarHBondContact O-CB 3.41Å; Y117-E121 WeakPolarHBondContact O-CG 3.35Å; Y117-E121 PolarHBondContact O-N 3.01Å; E121-H125 WeakPolarHBondContact O-CB 3.48Å; E121-H125 PolarHBondContact O-N 3.29Å; E121-H125 PolarHBondContact O-ND1 2.89Å |
| 122 | L | 80.3 | Confident | 75.5 | Confident | 103 Ų | 103 | 101.6 Ų | 101.6 | 54% | 0.539 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.6 | -44 | 175.4 | -72.1 | 166 | 0 | 0 | 0 | 111.6 | S118 E119 H125 N126 | S118-L122 WeakPolarHBondContact O-CB 3.49Å; S118-L122 WeakPolarHBondContact O-CD1 3.47Å; S118-L122 VanDerWaalsContact O-CG 3.23Å; S118-L122 WeakPolarHBondContact O-CG 3.36Å; S118-L122 PolarHBondContact O-N 2.88Å; S118-L122 VanDerWaalsContact O-N 3.09Å; E119-L122 PolarHBondContact O-N 3.4Å; L122-H125 PolarHBondContact O-N 2.8Å; L122-N126 WeakPolarHBondContact O-CB 3.5Å; L122-N126 PolarHBondContact O-N 3.12Å; L122-N126 PolarHBondContact O-ND2 2.92Å; L122-N126 VanDerWaalsContact O-ND2 3.09Å |
| 123 | S | 79.8 | Confident | 74.5 | Confident | 73 Ų | 73 | 109.7 Ų | 109.7 | 51% | 0.51 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -63.5 | -44.7 | 178.3 | -175.7 | 0 | 0 | 0 | 0 | 111.9 | E119 L120 N126 A127 | E119-S123 VanDerWaalsContact O-CB 3.26Å; E119-S123 WeakPolarHBondContact O-CB 3.48Å; E119-S123 PolarHBondContact O-N 3.33Å; L120-S123 PolarHBondContact O-N 2.73Å; S123-N126 PolarHBondContact O-N 3.4Å; S123-A127 WeakPolarHBondContact O-CB 3.29Å; S123-A127 PolarHBondContact O-N 3.43Å |
| 124 | A | 79.7 | Confident | 73 | Confident | 59 Ų | 59 | 108 Ų | 108 | 49% | 0.488 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -63.9 | -42.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L120 A127 A128 | L120-A124 VanDerWaalsContact O-CB 3.28Å; L120-A124 WeakPolarHBondContact O-CB 3.31Å; L120-A124 PolarHBondContact O-N 3.48Å; A124-A127 PolarHBondContact O-N 3.05Å; A124-A128 WeakPolarHBondContact O-CB 3.3Å; A124-A128 PolarHBondContact O-N 3.46Å |
| 125 | H | 75.2 | Confident | 71.9 | Confident | 129 Ų | 129 | 107.6 Ų | 107.6 | 60% | 0.597 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -63.5 | -41.4 | 174 | -79.8 | 82.1 | 0 | 0 | 0 | 111.8 | E121 L122 A128 N129 | E121-H125 WeakPolarHBondContact O-CB 3.48Å; E121-H125 PolarHBondContact O-N 3.29Å; E121-H125 PolarHBondContact O-ND1 2.89Å; L122-H125 PolarHBondContact O-N 2.8Å; H125-A128 PolarHBondContact O-N 2.96Å; H125-N129 VanDerWaalsContact O-CG 3.28Å; H125-N129 PolarHBondContact O-N 3.42Å; H125-N129 PolarHBondContact O-ND2 3.41Å |
| 126 | N | 70.6 | Confident | 70.2 | Confident | 102 Ų | 102 | 106 Ų | 106 | 55% | 0.545 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -67.6 | -35.9 | 177.4 | -70.9 | -25.7 | 0 | 0 | 0 | 112.5 | L122 S123 N129 R130 | L122-N126 WeakPolarHBondContact O-CB 3.5Å; L122-N126 PolarHBondContact O-N 3.12Å; L122-N126 PolarHBondContact O-ND2 2.92Å; L122-N126 VanDerWaalsContact O-ND2 3.09Å; S123-N126 PolarHBondContact O-N 3.4Å; N126-N129 PolarHBondContact O-N 3Å; N126-R130 PolarHBondContact O-N 3.09Å; N126-R130 VanDerWaalsContact O-N 3.07Å |
| 127 | A | 70.9 | Confident | 68.9 | Low | 61 Ų | 61 | 108.9 Ų | 108.9 | 50% | 0.504 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -67.9 | -39.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | S123 A124 N129 R130 | S123-A127 WeakPolarHBondContact O-CB 3.29Å; S123-A127 PolarHBondContact O-N 3.43Å; A124-A127 PolarHBondContact O-N 3.05Å; A127-N129 VanDerWaalsContact C-N 3.27Å; A127-N129 PolarHBondContact O-N 2.93Å; A127-R130 WeakPolarHBondContact O-CB 3.36Å; A127-R130 PolarHBondContact O-N 3.07Å; A127-R130 VanDerWaalsContact O-N 3.16Å |
| 128 | A | 65.4 | Low | 67.7 | Low | 80 Ų | 80 | 109.3 Ų | 109.3 | 66% | 0.661 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -65.2 | -31.4 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | A124 H125 | A124-A128 WeakPolarHBondContact O-CB 3.3Å; A124-A128 PolarHBondContact O-N 3.46Å; H125-A128 PolarHBondContact O-N 2.96Å |
| 129 | N | 60.2 | Low | 66.2 | Low | 132 Ų | 132 | 112.7 Ų | 112.7 | 71% | 0.706 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -76.6 | -19.4 | 173.6 | -70 | -29.1 | 0 | 0 | 0 | 113.5 | H125 N126 A127 G131 | H125-N129 VanDerWaalsContact O-CG 3.28Å; H125-N129 PolarHBondContact O-N 3.42Å; H125-N129 PolarHBondContact O-ND2 3.41Å; N126-N129 PolarHBondContact O-N 3Å; A127-N129 VanDerWaalsContact C-N 3.27Å; A127-N129 PolarHBondContact O-N 2.93Å; N129-G131 PolarHBondContact O-N 3.14Å |
| 130 | R | 58 | Low | 64.6 | Low | 217 Ų | 217 | 114.5 Ų | 114.5 | 82% | 0.819 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -77.5 | 65.9 | 164.3 | -82.6 | -168.6 | -171.9 | -104.7 | 3.2 | 109.3 | N126 A127 | N126-R130 PolarHBondContact O-N 3.09Å; N126-R130 VanDerWaalsContact O-N 3.07Å; A127-R130 WeakPolarHBondContact O-CB 3.36Å; A127-R130 PolarHBondContact O-N 3.07Å; A127-R130 VanDerWaalsContact O-N 3.16Å |
| 131 | G | 54.8 | Low | 63.2 | Low | 42 Ų | 42 | 114.6 Ų | 114.6 | 43% | 0.433 | 66% | 0.658 | S | S | . | * | trans | -41.1 | 144.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112 | N129 H133 | N129-G131 PolarHBondContact O-N 3.14Å; G131-H133 PolarHBondContact O-CD2 3.49Å; G131-H133 VanDerWaalsContact O-CD2 3.27Å; G131-H133 PolarHBondContact O-N 2.61Å | ||
| 132 | L | 55.6 | Low | 61.6 | Low | 176 Ų | 176 | 118.5 Ų | 118.5 | 92% | 0.921 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -23.8 | 56.8 | -179.3 | -143.3 | 100.2 | 0 | 0 | 0 | 117.6 | G134 | L132-G134 PolarHBondContact O-N 3.05Å; L132-G134 VanDerWaalsContact O-N 3.13Å |
| 133 | H | 56.7 | Low | 60.5 | Low | 190 Ų | 190 | 119.8 Ų | 119.8 | 88% | 0.88 | 68% | 0.68 | S | S | * | * | trans | -86.8 | 46.9 | 160.4 | -72 | -74.4 | 0 | 0 | 0 | 107.3 | G131 | G131-H133 PolarHBondContact O-CD2 3.49Å; G131-H133 VanDerWaalsContact O-CD2 3.27Å; G131-H133 PolarHBondContact O-N 2.61Å | ||
| 134 | G | 49.4 | Very low | 58.7 | Low | 53 Ų | 53 | 124.5 Ų | 124.5 | 55% | 0.546 | 69% | 0.694 | S | S | . | * | trans | -64.4 | 133.4 | 159.4 | 0 | 0 | 0 | 0 | 0 | 106.6 | L132 A136 | L132-G134 PolarHBondContact O-N 3.05Å; L132-G134 VanDerWaalsContact O-N 3.13Å; G134-A136 PolarHBondContact O-N 3Å | ||
| 135 | S | 56.8 | Low | 56.8 | Low | 121 Ų | 121 | 129 Ų | 129 | 85% | 0.846 | 75% | 0.747 | S | S | * | * | trans | -33.7 | 107.5 | 165.2 | -62.4 | 0 | 0 | 0 | 0 | 109.4 | L137 | S135-L137 PolarHBondContact O-N 3.02Š| ||
| 136 | A | 49 | Very low | 55.9 | Low | 84 Ų | 84 | 129.1 Ų | 129.1 | 69% | 0.694 | 75% | 0.754 | S | S | * | * | trans | -54.2 | 109.6 | 169.1 | 0 | 0 | 0 | 0 | 0 | 105.5 | G134 I138 | G134-A136 PolarHBondContact O-N 3Å; A136-I138 PolarHBondContact O-N 3.18Å | ||
| 137 | L | 56.2 | Low | 55.2 | Low | 148 Ų | 148 | 130.5 Ų | 130.5 | 78% | 0.775 | 77% | 0.765 | S | S | * | * | trans | -60.2 | 99.7 | 166.3 | -137.5 | 90.7 | 0 | 0 | 0 | 104.3 | S135 I139 | S135-L137 PolarHBondContact O-N 3.02Å; L137-I139 HydrophobicContact CB-CG1 4.48Å; L137-I139 HydrophobicContact CD2-CD1 4.04Å; L137-I139 HydrophobicContact CD2-CG1 3.91Å; L137-I139 PolarHBondContact O-N 2.96Å | ||
| 138 | I | 59.4 | Low | 54.3 | Low | 138 Ų | 138 | 134.3 Ų | 134.3 | 71% | 0.708 | 78% | 0.779 | S | S | * | * | trans | -72.1 | 81 | 173.3 | -54.5 | 177.6 | 0 | 0 | 0 | 105.6 | A136 N140 | A136-I138 PolarHBondContact O-N 3.18Å; I138-N140 PolarHBondContact O-N 3.07Å; I138-N140 VanDerWaalsContact O-N 3.07Å | ||
| 139 | I | 54.7 | Low | 53.6 | Low | 124 Ų | 124 | 137.5 Ų | 137.5 | 64% | 0.636 | 79% | 0.786 | S | S | * | * | trans | -73.7 | 91 | 161.2 | -57.4 | 172.4 | 0 | 0 | 0 | 104.7 | L137 T141 | L137-I139 HydrophobicContact CB-CG1 4.48Å; L137-I139 HydrophobicContact CD2-CD1 4.04Å; L137-I139 HydrophobicContact CD2-CG1 3.91Å; L137-I139 PolarHBondContact O-N 2.96Å; I139-T141 VanDerWaalsContact C-N 3.31Å; I139-T141 HydrophobicContact CG2-CG2 4.01Å; I139-T141 PolarHBondContact O-N 2.73Å | ||
| 140 | N | 52.9 | Low | 53.2 | Low | 142 Ų | 142 | 137.9 Ų | 137.9 | 76% | 0.759 | 79% | 0.791 | S | S | * | * | trans | -70.1 | 95.6 | 162.1 | -96.7 | 7 | 0 | 0 | 0 | 106.9 | I138 Q142 | I138-N140 PolarHBondContact O-N 3.07Å; I138-N140 VanDerWaalsContact O-N 3.07Å; N140-Q142 PolarHBondContact O-N 2.7Å | ||
| 141 | T | 58.4 | Low | 52.9 | Low | 116 Ų | 116 | 132.6 Ų | 132.6 | 71% | 0.712 | 79% | 0.79 | S | S | * | * | trans | -70.8 | 91.6 | 156.2 | 52.3 | 0 | 0 | 0 | 0 | 106.5 | I139 E143 | I139-T141 VanDerWaalsContact C-N 3.31Å; I139-T141 HydrophobicContact CG2-CG2 4.01Å; I139-T141 PolarHBondContact O-N 2.73Å; T141-E143 PolarHBondContact O-N 3.06Å | ||
| 142 | Q | 49.6 | Very low | 52.8 | Low | 199 Ų | 199 | 139.1 Ų | 139.1 | 93% | 0.93 | 82% | 0.815 | S | S | * | * | trans | -65 | 95.7 | 162.6 | -173.8 | 177 | 23.5 | 0 | 0 | 106.8 | N140 | N140-Q142 PolarHBondContact O-N 2.7Š| ||
| 143 | E | 57.4 | Low | 52.5 | Low | 129 Ų | 129 | 136.2 Ų | 136.2 | 60% | 0.603 | 81% | 0.807 | S | S | * | * | trans | -121.5 | 134.6 | 171 | -160.9 | -92.8 | 156.5 | 0 | 0 | 106.8 | T141 | T141-E143 PolarHBondContact O-N 3.06Š| ||
| 144 | Q | 42.1 | Very low | 52.2 | Low | 172 Ų | 172 | 131.8 Ų | 131.8 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | trans | 77.7 | 120.5 | 173.3 | -79.1 | 163.9 | 25.9 | 0 | 0 | 120.3 | ||||
| 145 | G | 40.5 | Very low | 52.4 | Low | 155 Ų | 155 | 138.9 Ų | 138.9 | 100% | 1.598 | 82% | 0.824 | S | S | * | * | trans | 158.6 | 0 | 166.3 | 0 | 0 | 0 | 0 | 0 | 112.4 |
Retrieved 145 of 145 residues in 64.2 ms
(Link to these results)