| 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 | I | 43.8 | Very low | 63.5 | Low | 198 Ų | 198 | 113.4 Ų | 113.4 | 100% | 1.015 | 62% | 0.623 | S | S | * | * | 0 | 106.5 | 0 | -62.5 | 162.2 | 0 | 0 | 0 | 104.9 | N3 | I1-N3 PolarHBondContact O-N 3.03Š| |||
| 2 | S | 49.9 | Very low | 64.7 | Low | 105 Ų | 105 | 109.3 Ų | 109.3 | 73% | 0.734 | 61% | 0.609 | S | S | * | * | trans | -58.3 | 130.2 | -169.7 | 38.6 | 0 | 0 | 0 | 0 | 110.6 | M4 | S2-M4 VanDerWaalsContact C-N 3.33Å; S2-M4 PolarHBondContact O-N 3.27Å | ||
| 3 | N | 48.8 | Very low | 65.9 | Low | 163 Ų | 163 | 107.2 Ų | 107.2 | 87% | 0.872 | 59% | 0.594 | S | S | * | * | trans | -55 | 101.1 | 161.8 | -80.9 | -12.5 | 0 | 0 | 0 | 106.9 | I1 D5 | I1-N3 PolarHBondContact O-N 3.03Å; N3-D5 PolarHBondContact O-N 2.84Å; N3-D5 VanDerWaalsContact O-N 3.12Å | ||
| 4 | M | 58.8 | Low | 66.5 | Low | 154 Ų | 154 | 107.9 Ų | 107.9 | 76% | 0.759 | 60% | 0.596 | S | S | * | * | trans | -61.7 | 115 | 158.2 | -85.8 | 168.6 | 77.1 | 0 | 0 | 104.9 | S2 L6 V9 | S2-M4 VanDerWaalsContact C-N 3.33Å; S2-M4 PolarHBondContact O-N 3.27Å; M4-L6 PolarHBondContact O-N 3.4Å; M4-V9 HydrophobicContact CE-CG2 4.33Å | ||
| 5 | D | 65.1 | Low | 67.2 | Low | 86 Ų | 86 | 104.9 Ų | 104.9 | 46% | 0.46 | 59% | 0.585 | S | S | . | * | trans | -61.7 | 106.1 | -177.3 | -175.4 | 20 | 0 | 0 | 0 | 107.8 | N3 E7 D8 V9 | N3-D5 PolarHBondContact O-N 2.84Å; N3-D5 VanDerWaalsContact O-N 3.12Å; D5-E7 PolarHBondContact O-N 3Å; D5-E7 VanDerWaalsContact O-N 3.13Å; D5-D8 HydrophobicContact CB-CB 4.06Å; D5-D8 WeakPolarHBondContact O-CB 3.33Å; D5-D8 PolarHBondContact O-N 3.18Å; D5-V9 PolarHBondContact O-N 3.47Å | ||
| 6 | L | 63.1 | Low | 67.4 | Low | 100 Ų | 100 | 104.5 Ų | 104.5 | 52% | 0.524 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -60.1 | -25.5 | -175 | -176 | 65.1 | 0 | 0 | 0 | 110.5 | M4 T10 | M4-L6 PolarHBondContact O-N 3.4Å; L6-T10 VanDerWaalsContact O-CB 3.3Å; L6-T10 WeakPolarHBondContact O-CB 3.39Å; L6-T10 PolarHBondContact O-N 3.34Å; L6-T10 PolarHBondContact O-OG1 3.1Å |
| 7 | E | 66.9 | Low | 67.2 | Low | 151 Ų | 151 | 109.4 Ų | 109.4 | 71% | 0.706 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -66.1 | -39.8 | 174.3 | -58.3 | -174.6 | 171.7 | 0 | 0 | 111.2 | D5 T10 A11 | D5-E7 PolarHBondContact O-N 3Å; D5-E7 VanDerWaalsContact O-N 3.13Å; E7-T10 PolarHBondContact O-N 3Å; E7-A11 VanDerWaalsContact O-CB 3.32Å; E7-A11 WeakPolarHBondContact O-CB 3.45Å; E7-A11 PolarHBondContact O-N 3.49Å |
| 8 | D | 76.7 | Confident | 66.5 | Low | 114 Ų | 114 | 110.9 Ų | 110.9 | 61% | 0.61 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -71.6 | -41.3 | -178.8 | -134.6 | 24.3 | 0 | 0 | 0 | 112 | D5 T10 A11 S12 | D5-D8 HydrophobicContact CB-CB 4.06Å; D5-D8 WeakPolarHBondContact O-CB 3.33Å; D5-D8 PolarHBondContact O-N 3.18Å; D8-T10 VanDerWaalsContact C-N 3.33Å; D8-A11 PolarHBondContact O-N 3.13Å; D8-S12 WeakPolarHBondContact O-CB 3.21Å; D8-S12 PolarHBondContact O-N 2.93Å |
| 9 | V | 72.3 | Confident | 66.2 | Low | 62 Ų | 62 | 111.1 Ų | 111.1 | 38% | 0.376 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -65.7 | -39.6 | 172.8 | 177.7 | 0 | 0 | 0 | 0 | 110.9 | M4 D5 S12 I13 | M4-V9 HydrophobicContact CE-CG2 4.33Å; D5-V9 PolarHBondContact O-N 3.47Å; V9-S12 PolarHBondContact O-N 3.34Å; V9-I13 HydrophobicContact CG1-CD1 4.13Å; V9-I13 VanDerWaalsContact O-CG1 3.31Å; V9-I13 WeakPolarHBondContact O-CG1 3.37Å; V9-I13 PolarHBondContact O-N 2.97Å |
| 10 | T | 74.9 | Confident | 65.3 | Low | 69 Ų | 69 | 112 Ų | 112 | 42% | 0.423 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -66.4 | -40.2 | 176.6 | -55.9 | 0 | 0 | 0 | 0 | 110.9 | L6 E7 D8 I13 L14 | L6-T10 VanDerWaalsContact O-CB 3.3Å; L6-T10 WeakPolarHBondContact O-CB 3.39Å; L6-T10 PolarHBondContact O-N 3.34Å; L6-T10 PolarHBondContact O-OG1 3.1Å; E7-T10 PolarHBondContact O-N 3Å; D8-T10 VanDerWaalsContact C-N 3.33Å; T10-I13 PolarHBondContact O-N 2.99Å; T10-L14 HydrophobicContact CG2-CD1 4.2Å; T10-L14 VanDerWaalsContact O-CG 3.31Å; T10-L14 WeakPolarHBondContact O-CG 3.46Å; T10-L14 PolarHBondContact O-N 3.28Å |
| 11 | A | 77.6 | Confident | 64.2 | Low | 45 Ų | 45 | 114.6 Ų | 114.6 | 37% | 0.372 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -64.1 | -45 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | E7 D8 I13 L14 S15 | E7-A11 VanDerWaalsContact O-CB 3.32Å; E7-A11 WeakPolarHBondContact O-CB 3.45Å; E7-A11 PolarHBondContact O-N 3.49Å; D8-A11 PolarHBondContact O-N 3.13Å; A11-I13 VanDerWaalsContact C-N 3.34Å; A11-I13 PolarHBondContact O-N 3.4Å; A11-L14 PolarHBondContact O-N 3.34Å; A11-L14 VanDerWaalsContact O-N 3.16Å; A11-S15 PolarHBondContact O-N 3.44Å; A11-S15 PolarHBondContact O-OG 3.49Å |
| 12 | S | 78.9 | Confident | 64.4 | Low | 65 Ų | 65 | 110.1 Ų | 110.1 | 46% | 0.455 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -58 | -45.9 | 176.2 | -174.3 | 0 | 0 | 0 | 0 | 111.9 | D8 V9 S15 D16 | D8-S12 WeakPolarHBondContact O-CB 3.21Å; D8-S12 PolarHBondContact O-N 2.93Å; V9-S12 PolarHBondContact O-N 3.34Å; S12-S15 PolarHBondContact O-N 3.39Å; S12-D16 PolarHBondContact O-N 3.39Å |
| 13 | I | 79.1 | Confident | 64.1 | Low | 82 Ų | 82 | 108.2 Ų | 108.2 | 42% | 0.421 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -61.5 | -48.6 | 176.2 | -67.1 | 166.7 | 0 | 0 | 0 | 109.4 | V9 T10 A11 S15 D16 W17 | V9-I13 HydrophobicContact CG1-CD1 4.13Å; V9-I13 VanDerWaalsContact O-CG1 3.31Å; V9-I13 WeakPolarHBondContact O-CG1 3.37Å; V9-I13 PolarHBondContact O-N 2.97Å; T10-I13 PolarHBondContact O-N 2.99Å; A11-I13 VanDerWaalsContact C-N 3.34Å; A11-I13 PolarHBondContact O-N 3.4Å; I13-S15 VanDerWaalsContact C-N 3.27Å; I13-S15 PolarHBondContact O-N 2.72Å; I13-D16 PolarHBondContact O-N 2.85Å; I13-D16 VanDerWaalsContact O-N 3.14Å; I13-W17 PolarHBondContact O-N 3.08Å; I13-W17 VanDerWaalsContact O-N 3.14Å |
| 14 | L | 75.5 | Confident | 63.8 | Low | 117 Ų | 117 | 105.9 Ų | 105.9 | 61% | 0.613 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -59.7 | -36.5 | 179.8 | -72 | 170.1 | 0 | 0 | 0 | 112.8 | T10 A11 W17 E18 | T10-L14 HydrophobicContact CG2-CD1 4.2Å; T10-L14 VanDerWaalsContact O-CG 3.31Å; T10-L14 WeakPolarHBondContact O-CG 3.46Å; T10-L14 PolarHBondContact O-N 3.28Å; A11-L14 PolarHBondContact O-N 3.34Å; A11-L14 VanDerWaalsContact O-N 3.16Å; L14-W17 PolarHBondContact O-N 3.07Å; L14-E18 PolarHBondContact O-N 2.94Å |
| 15 | S | 76.4 | Confident | 63.2 | Low | 63 Ų | 63 | 102 Ų | 102 | 44% | 0.441 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -66.9 | -40.1 | 174.4 | -63.9 | 0 | 0 | 0 | 0 | 113 | A11 S12 I13 W17 E18 I19 | A11-S15 PolarHBondContact O-N 3.44Å; A11-S15 PolarHBondContact O-OG 3.49Å; S12-S15 PolarHBondContact O-N 3.39Å; I13-S15 VanDerWaalsContact C-N 3.27Å; I13-S15 PolarHBondContact O-N 2.72Å; S15-W17 PolarHBondContact O-N 3.08Å; S15-E18 PolarHBondContact O-N 3.43Å; S15-I19 PolarHBondContact O-N 2.78Å |
| 16 | D | 69.9 | Low | 61.9 | Low | 98 Ų | 98 | 106.3 Ų | 106.3 | 52% | 0.524 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -63.4 | -33.1 | 176.4 | -71.9 | -17.5 | 0 | 0 | 0 | 112.1 | S12 I13 | S12-D16 PolarHBondContact O-N 3.39Å; I13-D16 PolarHBondContact O-N 2.85Å; I13-D16 VanDerWaalsContact O-N 3.14Å |
| 17 | W | 63.8 | Low | 61.1 | Low | 187 Ų | 187 | 107.7 Ų | 107.7 | 71% | 0.708 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -72.4 | -28.8 | 176.3 | -80.8 | 77.9 | 0 | 0 | 0 | 113 | I13 L14 S15 | I13-W17 PolarHBondContact O-N 3.08Å; I13-W17 VanDerWaalsContact O-N 3.14Å; L14-W17 PolarHBondContact O-N 3.07Å; S15-W17 PolarHBondContact O-N 3.08Å |
| 18 | E | 54.8 | Low | 59.8 | Low | 138 Ų | 138 | 105.8 Ų | 105.8 | 65% | 0.645 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -74.1 | -27.2 | 177.5 | -158.2 | 169.5 | -157.1 | 0 | 0 | 112.5 | L14 S15 L20 E21 S22 | L14-E18 PolarHBondContact O-N 2.94Å; S15-E18 PolarHBondContact O-N 3.43Å; E18-L20 VanDerWaalsContact C-N 3.34Å; E18-L20 PolarHBondContact O-N 2.92Å; E18-E21 PolarHBondContact O-N 2.95Å; E18-S22 PolarHBondContact O-N 3.29Å; E18-S22 PolarHBondContact O-OG 3.03Å |
| 19 | I | 60.9 | Low | 58 | Low | 114 Ų | 114 | 108 Ų | 108 | 59% | 0.585 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -65.5 | -36.6 | 175.7 | -68.4 | 169.7 | 0 | 0 | 0 | 111.6 | S15 S22 A23 | S15-I19 PolarHBondContact O-N 2.78Å; I19-S22 PolarHBondContact O-N 3.42Å; I19-A23 PolarHBondContact O-N 3.27Å |
| 20 | L | 47.8 | Very low | 56.4 | Low | 128 Ų | 128 | 110.1 Ų | 110.1 | 67% | 0.67 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -74.6 | -29.3 | -177.8 | -169.2 | 63.4 | 0 | 0 | 0 | 112.7 | E18 S22 A23 | E18-L20 VanDerWaalsContact C-N 3.34Å; E18-L20 PolarHBondContact O-N 2.92Å; L20-S22 VanDerWaalsContact C-N 3.28Å; L20-A23 PolarHBondContact O-N 3.27Å |
| 21 | E | 43.8 | Very low | 54.5 | Low | 168 Ų | 168 | 113.1 Ų | 113.1 | 79% | 0.785 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -71.7 | -27.6 | 175.9 | -136.8 | 172.9 | 146.1 | 0 | 0 | 111.6 | E18 | E18-E21 PolarHBondContact O-N 2.95Å |
| 22 | S | 46.4 | Very low | 52.8 | Low | 103 Ų | 103 | 116 Ų | 116 | 72% | 0.72 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -79.7 | -17.3 | 177.9 | -59.6 | 0 | 0 | 0 | 0 | 114.1 | E18 I19 L20 | E18-S22 PolarHBondContact O-N 3.29Å; E18-S22 PolarHBondContact O-OG 3.03Å; I19-S22 PolarHBondContact O-N 3.42Å; L20-S22 VanDerWaalsContact C-N 3.28Å |
| 23 | A | 45.4 | Very low | 51 | Low | 66 Ų | 66 | 118.7 Ų | 118.7 | 55% | 0.545 | 68% | 0.677 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.9 | -7.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114 | I19 L20 G25 | I19-A23 PolarHBondContact O-N 3.27Å; L20-A23 PolarHBondContact O-N 3.27Å; A23-G25 PolarHBondContact O-N 3.09Å |
| 24 | S | 41.8 | Very low | 49.4 | Very low | 113 Ų | 113 | 124.2 Ų | 124.2 | 79% | 0.79 | 70% | 0.701 | S | S | * | * | trans | -81 | 57.6 | 175.2 | 178.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 25 | G | 46.4 | Very low | 47.9 | Very low | 72 Ų | 72 | 124 Ų | 124 | 74% | 0.742 | 71% | 0.71 | S | S | * | * | trans | -124.3 | 29 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | A23 | A23-G25 PolarHBondContact O-N 3.09Š| ||
| 26 | E | 36.7 | Very low | 46.7 | Very low | 178 Ų | 178 | 126.7 Ų | 126.7 | 83% | 0.832 | 73% | 0.725 | S | S | * | * | trans | -145.5 | 129.2 | 174 | 50.9 | -175.6 | 119 | 0 | 0 | 112.5 | P28 | E26-P28 WeakPolarHBondContact O-CD 3.44Š| ||
| 27 | N | 47.3 | Very low | 45.8 | Very low | 128 Ų | 128 | 129.9 Ų | 129.9 | 68% | 0.684 | 74% | 0.742 | S | S | * | * | trans | -66.9 | 122.4 | 179.8 | 170.1 | 22.6 | 0 | 0 | 0 | 111.5 | E29 | N27-E29 PolarHBondContact OD1-N 2.96Š| ||
| 28 | P | 39.3 | Very low | 44.6 | Very low | 111 Ų | 111 | 128.6 Ų | 128.6 | 72% | 0.721 | 75% | 0.749 | S | S | * | * | trans | -100.2 | 106.6 | 153.9 | 30.3 | -18.5 | 0 | 0 | 0 | 109.5 | E26 S30 | E26-P28 WeakPolarHBondContact O-CD 3.44Å; P28-S30 PolarHBondContact O-N 3.41Å | ||
| 29 | E | 39.3 | Very low | 44.5 | Very low | 162 Ų | 162 | 126.8 Ų | 126.8 | 76% | 0.757 | 75% | 0.751 | S | S | * | * | trans | -57.8 | 102.2 | 165 | -141.3 | 151.6 | 118.3 | 0 | 0 | 108.3 | N27 V31 | N27-E29 PolarHBondContact OD1-N 2.96Å; E29-V31 PolarHBondContact O-N 3.47Å | ||
| 30 | S | 37.7 | Very low | 44.1 | Very low | 106 Ų | 106 | 126 Ų | 126 | 74% | 0.741 | 76% | 0.756 | S | S | * | * | trans | -90 | 97.1 | 176.8 | 46.8 | 0 | 0 | 0 | 0 | 109.2 | P28 C32 | P28-S30 PolarHBondContact O-N 3.41Å; S30-C32 PolarHBondContact O-N 3.25Å; S30-C32 VanDerWaalsContact O-N 3.15Å | ||
| 31 | V | 36.2 | Very low | 44 | Very low | 131 Ų | 131 | 127.1 Ų | 127.1 | 79% | 0.794 | 76% | 0.762 | S | S | * | * | trans | -72.2 | 100.8 | 166.8 | -176.5 | 0 | 0 | 0 | 0 | 107.3 | E29 P33 | E29-V31 PolarHBondContact O-N 3.47Å; V31-P33 WeakPolarHBondContact O-CD 3.27Å | ||
| 32 | C | 41.4 | Very low | 44.4 | Very low | 107 Ų | 107 | 125 Ų | 125 | 72% | 0.723 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -73 | 122.1 | 168.1 | -82.2 | 0 | 0 | 0 | 0 | 109.1 | S30 E34 | S30-C32 PolarHBondContact O-N 3.25Å; S30-C32 VanDerWaalsContact O-N 3.15Å; C32-E34 PolarHBondContact O-N 3.3Å |
| 33 | P | 42.1 | Very low | 44.4 | Very low | 120 Ų | 120 | 125.4 Ų | 125.4 | 78% | 0.779 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -71 | 124.5 | 171.4 | 27.4 | -28.8 | 0 | 0 | 0 | 109.3 | V31 | V31-P33 WeakPolarHBondContact O-CD 3.27Š|
| 34 | E | 43.5 | Very low | 44.4 | Very low | 199 Ų | 199 | 126.9 Ų | 126.9 | 93% | 0.93 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -61 | 132.5 | 172 | -58.6 | -134.1 | 118.6 | 0 | 0 | 110.1 | C32 | C32-E34 PolarHBondContact O-N 3.3Š|
| 35 | S | 45.3 | Very low | 44.8 | Very low | 113 Ų | 113 | 127.3 Ų | 127.3 | 79% | 0.79 | 77% | 0.774 | S | S | * | * | trans | -146 | 145.6 | 158 | 57.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 36 | P | 50.8 | Low | 44.3 | Very low | 118 Ų | 118 | 132.7 Ų | 132.7 | 77% | 0.766 | 78% | 0.779 | S | S | * | * | trans | -99 | 143.4 | -149.9 | 2.9 | 19.5 | 0 | 0 | 0 | 112.2 | ||||
| 37 | L | 51 | Low | 44.5 | Very low | 166 Ų | 166 | 130.8 Ų | 130.8 | 87% | 0.869 | 77% | 0.773 | S | S | * | * | trans | 26.2 | 104.1 | 147.3 | -68.5 | 148.4 | 0 | 0 | 0 | 117.3 | ||||
| 38 | D | 37.8 | Very low | 44.1 | Very low | 159 Ų | 159 | 130.1 Ų | 130.1 | 85% | 0.85 | 78% | 0.777 | S | S | * | * | -146 | 133.2 | 118.9 | -153.6 | -4.1 | 0 | 0 | 0 | 110.5 | |||||
| 39 | S | 53.1 | Low | 44.2 | Very low | 100 Ų | 100 | 132.9 Ų | 132.9 | 70% | 0.699 | 78% | 0.778 | S | S | * | * | trans | -113.4 | 106.6 | -164.3 | 47.6 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 40 | S | 52.8 | Low | 44.2 | Very low | 97 Ų | 97 | 130.5 Ų | 130.5 | 68% | 0.678 | 78% | 0.777 | S | S | * | * | trans | -162.3 | 104.1 | 175.9 | -179.6 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 41 | L | 45.7 | Very low | 44.4 | Very low | 152 Ų | 152 | 133.3 Ų | 133.3 | 80% | 0.796 | 78% | 0.782 | S | S | * | * | trans | 66.8 | 82.6 | 145.3 | -53.9 | 171.2 | 0 | 0 | 0 | 119 | S43 | L41-S43 PolarHBondContact O-N 3.43Š| ||
| 42 | C | 52.5 | Low | 44.5 | Very low | 124 Ų | 124 | 132.2 Ų | 132.2 | 84% | 0.838 | 78% | 0.78 | S | S | * | * | trans | -81.8 | 98 | 147.4 | -175.3 | 0 | 0 | 0 | 0 | 108.2 | S44 | C42-S44 PolarHBondContact O-N 3.01Š| ||
| 43 | S | 46.1 | Very low | 44.6 | Very low | 111 Ų | 111 | 136.5 Ų | 136.5 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | -67.1 | 101.1 | 173.7 | -68.2 | 0 | 0 | 0 | 0 | 110.4 | L41 | L41-S43 PolarHBondContact O-N 3.43Š| ||
| 44 | S | 45.5 | Very low | 44.5 | Very low | 97 Ų | 97 | 139.5 Ų | 139.5 | 68% | 0.678 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -87.9 | 128.3 | 157.1 | -88.1 | 0 | 0 | 0 | 0 | 108.2 | C42 E46 | C42-S44 PolarHBondContact O-N 3.01Å; S44-E46 PolarHBondContact O-N 3.07Å |
| 45 | P | 49.8 | Very low | 44.5 | Very low | 123 Ų | 123 | 138.8 Ų | 138.8 | 80% | 0.799 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 118.4 | 173.6 | 28.4 | -31.2 | 0 | 0 | 0 | 109.2 | I47 | P45-I47 PolarHBondContact O-N 3.44Š|
| 46 | E | 35.8 | Very low | 44.6 | Very low | 184 Ų | 184 | 141.7 Ų | 141.7 | 86% | 0.86 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -71 | 119 | 169.6 | -63.8 | -111.6 | 125 | 0 | 0 | 108.7 | S44 C48 | S44-E46 PolarHBondContact O-N 3.07Å; E46-C48 PolarHBondContact O-N 2.93Å |
| 47 | I | 41.9 | Very low | 44.3 | Very low | 139 Ų | 139 | 144.3 Ų | 144.3 | 71% | 0.713 | 79% | 0.791 | S | S | * | * | trans | -80.2 | 95.6 | 157.7 | 51.8 | 176.8 | 0 | 0 | 0 | 107.6 | P45 F49 | P45-I47 PolarHBondContact O-N 3.44Å; I47-F49 HydrophobicContact CB-CE2 4.4Å; I47-F49 HydrophobicContact CD1-CD2 4.43Å; I47-F49 HydrophobicContact CD1-CE2 3.51Å; I47-F49 HydrophobicContact CD1-CZ 4.09Å; I47-F49 HydrophobicContact CG1-CD2 4.4Å; I47-F49 HydrophobicContact CG1-CE2 3.93Å; I47-F49 PolarHBondContact O-N 2.95Å | ||
| 48 | C | 38.2 | Very low | 44.2 | Very low | 113 Ų | 113 | 142.8 Ų | 142.8 | 76% | 0.764 | 78% | 0.783 | S | S | * | * | trans | -66.4 | 105.7 | 167.6 | -170.8 | 0 | 0 | 0 | 0 | 108 | E46 P50 | E46-C48 PolarHBondContact O-N 2.93Å; C48-P50 WeakPolarHBondContact O-CD 3.46Å | ||
| 49 | F | 41.1 | Very low | 44.7 | Very low | 170 Ų | 170 | 143 Ų | 143 | 75% | 0.746 | 78% | 0.784 | S | S | * | * | trans | -85.2 | 115.5 | 163.2 | -76.1 | -82.2 | 0 | 0 | 0 | 107.7 | I47 I51 | I47-F49 HydrophobicContact CB-CE2 4.4Å; I47-F49 HydrophobicContact CD1-CD2 4.43Å; I47-F49 HydrophobicContact CD1-CE2 3.51Å; I47-F49 HydrophobicContact CD1-CZ 4.09Å; I47-F49 HydrophobicContact CG1-CD2 4.4Å; I47-F49 HydrophobicContact CG1-CE2 3.93Å; I47-F49 PolarHBondContact O-N 2.95Å; F49-I51 PolarHBondContact O-N 2.91Å | ||
| 50 | P | 39.1 | Very low | 44.2 | Very low | 111 Ų | 111 | 143.9 Ų | 143.9 | 72% | 0.721 | 79% | 0.79 | S | S | * | * | trans | -68.2 | 128.9 | 170.8 | 27.5 | -30.8 | 0 | 0 | 0 | 109.2 | C48 S52 | C48-P50 WeakPolarHBondContact O-CD 3.46Å; P50-S52 PolarHBondContact O-N 3.46Å; P50-S52 VanDerWaalsContact O-N 3.08Å | ||
| 51 | I | 43.8 | Very low | 43.5 | Very low | 165 Ų | 165 | 149 Ų | 149 | 85% | 0.846 | 80% | 0.8 | S | S | * | * | trans | -60.6 | 101.3 | 167.5 | -163.1 | 167.9 | 0 | 0 | 0 | 108.8 | F49 | F49-I51 PolarHBondContact O-N 2.91Š| ||
| 52 | S | 36.4 | Very low | 43 | Very low | 109 Ų | 109 | 144.4 Ų | 144.4 | 76% | 0.762 | 79% | 0.79 | S | S | * | * | trans | -89.1 | 112.6 | 161.1 | 55.8 | 0 | 0 | 0 | 0 | 107.9 | P50 E54 | P50-S52 PolarHBondContact O-N 3.46Å; P50-S52 VanDerWaalsContact O-N 3.08Å; S52-E54 PolarHBondContact O-N 2.86Å | ||
| 53 | K | 45.2 | Very low | 42.6 | Very low | 196 Ų | 196 | 145.2 Ų | 145.2 | 85% | 0.852 | 80% | 0.795 | S | S | * | * | trans | -57.1 | 115.1 | 161.2 | -79.6 | 175.9 | 169.4 | 175.3 | 0 | 108 | ||||
| 54 | E | 39 | Very low | 42.6 | Very low | 183 Ų | 183 | 144.7 Ų | 144.7 | 86% | 0.855 | 80% | 0.798 | S | S | * | * | 173.9 | 114.7 | 129.5 | -93.4 | 172.7 | -168.7 | 0 | 0 | 111 | S52 | S52-E54 PolarHBondContact O-N 2.86Š| |||
| 55 | E | 44.3 | Very low | 42.5 | Very low | 185 Ų | 185 | 143.7 Ų | 143.7 | 86% | 0.864 | 80% | 0.803 | S | S | * | * | trans | 36.6 | 92 | 144 | -120.5 | -175.9 | 165.7 | 0 | 0 | 119.9 | ||||
| 56 | I | 47.5 | Very low | 42.6 | Very low | 173 Ų | 173 | 149.1 Ų | 149.1 | 89% | 0.887 | 81% | 0.808 | S | S | * | * | trans | -135.4 | 116.1 | 138.5 | -55.5 | 179.1 | 0 | 0 | 0 | 108.6 | ||||
| 57 | K | 44.1 | Very low | 43 | Very low | 173 Ų | 173 | 150.5 Ų | 150.5 | 75% | 0.752 | 81% | 0.811 | S | S | * | * | trans | -72.4 | 144.2 | 175.9 | -164.4 | 175.8 | 178.4 | -179.6 | 0 | 109.8 | ||||
| 58 | D | 47.9 | Very low | 43.3 | Very low | 134 Ų | 134 | 152.8 Ų | 152.8 | 72% | 0.717 | 82% | 0.818 | S | S | * | * | trans | 69.7 | 97.5 | 166.5 | -63.2 | -32.5 | 0 | 0 | 0 | 118.2 | ||||
| 59 | L | 48 | Very low | 43.7 | Very low | 165 Ų | 165 | 154.1 Ų | 154.1 | 86% | 0.864 | 82% | 0.823 | S | S | * | * | -167.7 | 69.3 | 125.6 | -93 | 159.8 | 0 | 0 | 0 | 108.7 | F61 | L59-F61 PolarHBondContact O-N 3.43Š| |||
| 60 | S | 43.2 | Very low | 44 | Very low | 118 Ų | 118 | 151.1 Ų | 151.1 | 83% | 0.825 | 82% | 0.82 | S | S | * | * | trans | -76.4 | 92.7 | 165.6 | -177.4 | 0 | 0 | 0 | 0 | 108.4 | G62 | S60-G62 PolarHBondContact O-N 3.16Š| ||
| 61 | F | 39.1 | Very low | 44.6 | Very low | 204 Ų | 204 | 152.5 Ų | 152.5 | 90% | 0.895 | 83% | 0.829 | S | S | * | * | trans | -79.9 | 81.1 | 170.5 | -137.7 | -92.9 | 0 | 0 | 0 | 108.8 | L59 | L59-F61 PolarHBondContact O-N 3.43Š| ||
| 62 | G | 35 | Very low | 44.6 | Very low | 56 Ų | 56 | 146.9 Ų | 146.9 | 58% | 0.577 | 81% | 0.813 | S | S | * | * | trans | -69.2 | 141 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | S60 | S60-G62 PolarHBondContact O-N 3.16Š| ||
| 63 | C | 43.1 | Very low | 45.6 | Very low | 140 Ų | 140 | 151.6 Ų | 151.6 | 95% | 0.946 | 82% | 0.823 | S | S | * | * | trans | -111 | 70.1 | 155.5 | -158.6 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 64 | A | 46.8 | Very low | 45.9 | Very low | 101 Ų | 101 | 152.9 Ų | 152.9 | 84% | 0.835 | 82% | 0.822 | S | S | * | * | trans | -99.3 | 90.9 | 172 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 65 | G | 43.6 | Very low | 46.7 | Very low | 76 Ų | 76 | 152.8 Ų | 152.8 | 78% | 0.784 | 82% | 0.822 | S | S | * | * | trans | -109.3 | 102 | 163.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 66 | R | 52.7 | Low | 47.2 | Very low | 237 Ų | 237 | 149.2 Ų | 149.2 | 89% | 0.894 | 82% | 0.817 | S | S | * | * | trans | -92.4 | 133.9 | 164.4 | -71.3 | -176.8 | -179.1 | -123.8 | 2.2 | 108.4 | ||||
| 67 | K | 44.1 | Very low | 47.9 | Very low | 213 Ų | 213 | 149.6 Ų | 149.6 | 93% | 0.926 | 81% | 0.813 | S | S | * | * | trans | -170 | 133.5 | 135.3 | -100.2 | 171 | -168.5 | -168.5 | 0 | 110 | ||||
| 68 | E | 47.9 | Very low | 49 | Very low | 187 Ų | 187 | 147.9 Ų | 147.9 | 87% | 0.874 | 82% | 0.817 | S | S | * | * | trans | -72.2 | 150.9 | -172 | -63.5 | 162.2 | 153.8 | 0 | 0 | 113.2 | ||||
| 69 | T | 46.5 | Very low | 50.5 | Low | 141 Ų | 141 | 150.9 Ų | 150.9 | 87% | 0.865 | 82% | 0.823 | S | S | * | * | trans | -179.6 | 167.5 | 147.3 | 44.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 70 | P | 46.9 | Very low | 52.2 | Low | 106 Ų | 106 | 147.5 Ų | 147.5 | 69% | 0.688 | 80% | 0.804 | S | S | * | * | -85.7 | 176.2 | -102.5 | 30.6 | -9.6 | 0 | 0 | 0 | 115.5 | G72 | P70-G72 VanDerWaalsContact C-N 3.29Å; P70-G72 PolarHBondContact O-N 2.92Å | |||
| 71 | P | 50.8 | Low | 54.5 | Low | 140 Ų | 140 | 144.8 Ų | 144.8 | 91% | 0.909 | 79% | 0.785 | S | S | * | * | trans | -79.1 | 76.9 | 177.3 | 34.6 | -33.3 | 0 | 0 | 0 | 110.5 | ||||
| 72 | G | 45.5 | Very low | 57.1 | Low | 48 Ų | 48 | 139 Ų | 139 | 50% | 0.495 | 77% | 0.766 | S | S | . | * | trans | -95.2 | 120.5 | 163.6 | 0 | 0 | 0 | 0 | 0 | 108.7 | P70 R74 | P70-G72 VanDerWaalsContact C-N 3.29Å; P70-G72 PolarHBondContact O-N 2.92Å; G72-R74 VanDerWaalsContact C-N 3.32Å; G72-R74 PolarHBondContact O-N 3.26Å | ||
| 73 | Q | 55.5 | Low | 60 | Low | 208 Ų | 208 | 145 Ų | 145 | 97% | 0.972 | 78% | 0.776 | S | S | * | * | trans | -49.6 | 92 | 172.6 | -74.3 | 171.5 | -26.9 | 0 | 0 | 110.6 | ||||
| 74 | R | 52.2 | Low | 62.5 | Low | 223 Ų | 223 | 145.2 Ų | 145.2 | 84% | 0.842 | 76% | 0.758 | S | S | * | * | trans | -99.9 | 107.5 | 168.1 | -68.7 | -175.7 | -169.6 | 173.9 | 4.7 | 105.5 | G72 S76 | G72-R74 VanDerWaalsContact C-N 3.32Å; G72-R74 PolarHBondContact O-N 3.26Å; R74-S76 PolarHBondContact O-N 2.66Å | ||
| 75 | Q | 55.4 | Low | 64.9 | Low | 180 Ų | 180 | 147.3 Ų | 147.3 | 84% | 0.841 | 74% | 0.744 | S | S | * | * | trans | -32.3 | 112.6 | 167.9 | -66.7 | 178.1 | -23.5 | 0 | 0 | 108.9 | K77 | Q75-K77 PolarHBondContact O-N 3.1Š| ||
| 76 | S | 54.8 | Low | 67.4 | Low | 111 Ų | 111 | 149.7 Ų | 149.7 | 78% | 0.776 | 74% | 0.736 | S | S | * | * | trans | -69.7 | 78.9 | -174.1 | 44.8 | 0 | 0 | 0 | 0 | 108.5 | R74 T78 | R74-S76 PolarHBondContact O-N 2.66Å; S76-T78 PolarHBondContact O-N 3.15Å | ||
| 77 | K | 63.3 | Low | 69.6 | Low | 181 Ų | 181 | 145.2 Ų | 145.2 | 79% | 0.787 | 72% | 0.723 | S | S | * | * | trans | -52.9 | 110.9 | 169.7 | -73.5 | -176.6 | 177.9 | 179.6 | 0 | 106.7 | Q75 K79 | Q75-K77 PolarHBondContact O-N 3.1Å; K77-K79 VanDerWaalsContact C-N 3.33Å; K77-K79 PolarHBondContact O-N 3.21Å | ||
| 78 | T | 66.3 | Low | 72.1 | Confident | 137 Ų | 137 | 137.1 Ų | 137.1 | 84% | 0.84 | 70% | 0.696 | S | S | * | * | trans | -62.1 | 95.5 | -176.4 | -40.5 | 0 | 0 | 0 | 0 | 108 | S76 M80 | S76-T78 PolarHBondContact O-N 3.15Å; T78-M80 PolarHBondContact O-N 3.32Å | ||
| 79 | K | 79.5 | Confident | 74.5 | Confident | 197 Ų | 197 | 131.9 Ų | 131.9 | 86% | 0.857 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 124.9 | 178.2 | -72.4 | 178.9 | 179.1 | 175.6 | 0 | 107.8 | K77 S81 | K77-K79 VanDerWaalsContact C-N 3.33Å; K77-K79 PolarHBondContact O-N 3.21Å; K79-S81 PolarHBondContact O-N 2.97Å |
| 80 | M | 84.1 | Confident | 77 | Confident | 93 Ų | 93 | 129.4 Ų | 129.4 | 46% | 0.458 | 66% | 0.659 | S | S | . | * | P | Polyproline II helix | trans | -54.1 | 134.6 | 178.1 | -65.4 | -74.9 | -76.8 | 0 | 0 | 110.7 | T78 R84 R85 | T78-M80 PolarHBondContact O-N 3.32Å; M80-R84 HydrophobicContact CE-CB 4.07Å; M80-R84 VanDerWaalsContact CE-NE 3.31Å; M80-R84 VanDerWaalsContact CE-NH2 3.29Å; M80-R84 PolarHBondContact SD-NH1 3.37Å; M80-R85 HydrophobicContact CB-CG 4.21Å |
| 81 | S | 92.3 | Very high | 79.5 | Confident | 61 Ų | 61 | 131 Ų | 131 | 43% | 0.427 | 65% | 0.651 | S | S | . | * | P | Polyproline II helix | trans | -60.4 | 151.3 | 179.3 | 73.7 | 0 | 0 | 0 | 0 | 111.6 | K79 K83 R84 R85 | K79-S81 PolarHBondContact O-N 2.97Å; S81-K83 PolarHBondContact O-N 3.46Å; S81-R84 PolarHBondContact O-N 3.21Å; S81-R84 WeakPolarHBondContact OG-CG 3.43Å; S81-R84 PolarHBondContact OG-N 3.5Å; S81-R85 PolarHBondContact O-N 3.4Å |
| 82 | V | 93.7 | Very high | 81.7 | Confident | 82 Ų | 82 | 128.3 Ų | 128.3 | 50% | 0.497 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -53.2 | -44 | 177.1 | 180 | 0 | 0 | 0 | 0 | 110.8 | R84 R85 M86 | V82-R84 VanDerWaalsContact C-N 3.34Å; V82-R84 PolarHBondContact O-N 3.01Å; V82-R85 WeakPolarHBondContact O-CB 3.41Å; V82-R85 PolarHBondContact O-N 3.01Å; V82-R85 VanDerWaalsContact O-N 3.14Å; V82-M86 HydrophobicContact CG1-CE 4.25Å; V82-M86 HydrophobicContact CG1-CG 4.36Å; V82-M86 WeakPolarHBondContact O-CG 3.48Å; V82-M86 PolarHBondContact O-N 3.47Å |
| 83 | K | 94.4 | Very high | 84.3 | Confident | 182 Ų | 182 | 131.7 Ų | 131.7 | 79% | 0.791 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -58.1 | -42.6 | 177.5 | -65.7 | -175.1 | 179.1 | -176 | 0 | 112.4 | S81 M86 K87 | S81-K83 PolarHBondContact O-N 3.46Å; K83-M86 PolarHBondContact O-N 3.15Å; K83-K87 PolarHBondContact O-N 3.12Å; K83-K87 VanDerWaalsContact O-N 3.13Å |
| 84 | R | 96.4 | Very high | 86.3 | Confident | 146 Ų | 146 | 126.6 Ų | 126.6 | 55% | 0.551 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -66.7 | -39.8 | 176.6 | -71.8 | 177.4 | 76.2 | -170 | 2.6 | 111.8 | M80 S81 V82 A88 | M80-R84 HydrophobicContact CE-CB 4.07Å; M80-R84 VanDerWaalsContact CE-NE 3.31Å; M80-R84 VanDerWaalsContact CE-NH2 3.29Å; M80-R84 PolarHBondContact SD-NH1 3.37Å; S81-R84 PolarHBondContact O-N 3.21Å; S81-R84 WeakPolarHBondContact OG-CG 3.43Å; S81-R84 PolarHBondContact OG-N 3.5Å; V82-R84 VanDerWaalsContact C-N 3.34Å; V82-R84 PolarHBondContact O-N 3.01Å; R84-A88 WeakPolarHBondContact O-CB 3.49Å; R84-A88 PolarHBondContact O-N 3.06Å |
| 85 | R | 96.7 | Very high | 88.5 | Confident | 145 Ų | 145 | 123.4 Ų | 123.4 | 55% | 0.547 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -61.6 | -47.1 | 175.2 | -68.3 | -170.6 | -69.9 | 147.9 | -1.8 | 111.4 | M80 S81 V82 K87 A88 S89 | M80-R85 HydrophobicContact CB-CG 4.21Å; S81-R85 PolarHBondContact O-N 3.4Å; V82-R85 WeakPolarHBondContact O-CB 3.41Å; V82-R85 PolarHBondContact O-N 3.01Å; V82-R85 VanDerWaalsContact O-N 3.14Å; R85-K87 PolarHBondContact O-N 3.38Å; R85-A88 WeakPolarHBondContact O-CB 3.49Å; R85-A88 PolarHBondContact O-N 2.79Å; R85-A88 VanDerWaalsContact O-N 3.14Å; R85-S89 PolarHBondContact O-N 2.7Å; R85-S89 PolarHBondContact O-OG 3.17Å |
| 86 | M | 97.1 | Very high | 90.6 | Very high | 126 Ų | 126 | 118.2 Ų | 118.2 | 62% | 0.621 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -59 | -47 | 177.8 | -66.8 | -61.7 | -172.2 | 0 | 0 | 112.5 | V82 K83 A88 S89 E90 | V82-M86 HydrophobicContact CG1-CE 4.25Å; V82-M86 HydrophobicContact CG1-CG 4.36Å; V82-M86 WeakPolarHBondContact O-CG 3.48Å; V82-M86 PolarHBondContact O-N 3.47Å; K83-M86 PolarHBondContact O-N 3.15Å; M86-A88 VanDerWaalsContact C-N 3.28Å; M86-A88 PolarHBondContact O-N 3.09Å; M86-S89 PolarHBondContact O-N 3.02Å; M86-E90 PolarHBondContact O-N 3.27Å |
| 87 | K | 97.9 | Very high | 92.7 | Very high | 143 Ų | 143 | 118 Ų | 118 | 62% | 0.622 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -60.9 | -38.3 | 176.4 | -171.2 | 179.2 | -177.3 | 176.1 | 0 | 111.8 | K83 R85 R91 | K83-K87 PolarHBondContact O-N 3.12Å; K83-K87 VanDerWaalsContact O-N 3.13Å; R85-K87 PolarHBondContact O-N 3.38Å; K87-R91 WeakPolarHBondContact O-CG 3.36Å; K87-R91 PolarHBondContact O-N 3.07Å; K87-R91 PolarHBondContact O-NE 2.95Å |
| 88 | A | 97.4 | Very high | 94.4 | Very high | 43 Ų | 43 | 113 Ų | 113 | 36% | 0.355 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -66.5 | -43.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | R84 R85 M86 E90 R91 E92 | R84-A88 WeakPolarHBondContact O-CB 3.49Å; R84-A88 PolarHBondContact O-N 3.06Å; R85-A88 WeakPolarHBondContact O-CB 3.49Å; R85-A88 PolarHBondContact O-N 2.79Å; R85-A88 VanDerWaalsContact O-N 3.14Å; M86-A88 VanDerWaalsContact C-N 3.28Å; M86-A88 PolarHBondContact O-N 3.09Å; A88-E90 PolarHBondContact O-N 3.33Å; A88-R91 PolarHBondContact O-N 3.38Å; A88-E92 PolarHBondContact O-N 3.14Å |
| 89 | S | 98.1 | Very high | 95.9 | Very high | 77 Ų | 77 | 110.7 Ų | 110.7 | 54% | 0.538 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.8 | -41.3 | 177.1 | -62.3 | 0 | 0 | 0 | 0 | 112.7 | R85 M86 R91 E92 K93 | R85-S89 PolarHBondContact O-N 2.7Å; R85-S89 PolarHBondContact O-OG 3.17Å; M86-S89 PolarHBondContact O-N 3.02Å; S89-R91 VanDerWaalsContact C-N 3.34Å; S89-R91 PolarHBondContact O-N 3.16Å; S89-E92 PolarHBondContact O-N 3.48Å; S89-K93 WeakPolarHBondContact O-CB 3.27Å; S89-K93 PolarHBondContact O-N 2.88Å |
| 90 | E | 98.6 | Very high | 96.8 | Very high | 89 Ų | 89 | 103 Ų | 103 | 42% | 0.416 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.1 | -38.6 | 177.2 | -174 | 54.6 | -140 | 0 | 0 | 111.7 | M86 A88 E92 K93 M94 R97 | M86-E90 PolarHBondContact O-N 3.27Å; A88-E90 PolarHBondContact O-N 3.33Å; E90-E92 PolarHBondContact O-N 2.89Å; E90-K93 WeakPolarHBondContact O-CB 3.41Å; E90-K93 PolarHBondContact O-N 3.48Å; E90-M94 WeakPolarHBondContact O-CG 3.44Å; E90-M94 PolarHBondContact O-N 3.46Å; E90-R97 IonicContact OE1-NH2 2.89Å; E90-R97 PolarHBondContact OE1-NH2 3.08Å |
| 91 | R | 98.6 | Very high | 97.4 | Very high | 139 Ų | 139 | 104.1 Ų | 104.1 | 53% | 0.525 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.6 | -44.1 | 173.2 | -74.3 | -175.6 | -62.7 | -128.5 | -1 | 112 | K87 A88 S89 K93 M94 R95 | K87-R91 WeakPolarHBondContact O-CG 3.36Å; K87-R91 PolarHBondContact O-N 3.07Å; K87-R91 PolarHBondContact O-NE 2.95Å; A88-R91 PolarHBondContact O-N 3.38Å; S89-R91 VanDerWaalsContact C-N 3.34Å; S89-R91 PolarHBondContact O-N 3.16Å; R91-K93 VanDerWaalsContact C-N 3.28Å; R91-K93 PolarHBondContact O-N 3.01Å; R91-M94 WeakPolarHBondContact O-CB 3.12Å; R91-M94 PolarHBondContact O-N 3.34Å; R91-R95 PolarHBondContact O-N 3.23Å |
| 92 | E | 98.6 | Very high | 97.7 | Very high | 83 Ų | 83 | 103.7 Ų | 103.7 | 39% | 0.388 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65 | -35.8 | 177.3 | -171.5 | 55.8 | -149.5 | 0 | 0 | 111.6 | A88 S89 E90 M94 R95 M96 | A88-E92 PolarHBondContact O-N 3.14Å; S89-E92 PolarHBondContact O-N 3.48Å; E90-E92 PolarHBondContact O-N 2.89Å; E92-M94 PolarHBondContact O-N 3.31Å; E92-R95 WeakPolarHBondContact O-CB 3.39Å; E92-R95 PolarHBondContact O-N 3.46Å; E92-R95 IonicContact OE1-CZ 3.83Å; E92-R95 IonicContact OE1-NH1 2.76Å; E92-R95 PolarHBondContact OE1-NH1 3.47Å; E92-R95 WeakPolarHBondContact OE2-CD 3.44Å; E92-R95 IonicContact OE2-NH1 3.8Å; E92-M96 HydrophobicContact CG-CG 4.46Å; E92-M96 WeakPolarHBondContact O-CB 3.42Å; E92-M96 WeakPolarHBondContact O-CG 3.34Å; E92-M96 PolarHBondContact O-N 3.24Å; E92-M96 WeakPolarHBondContact OE1-CE 3.49Å |
| 93 | K | 98.6 | Very high | 97.9 | Very high | 120 Ų | 120 | 100.8 Ų | 100.8 | 52% | 0.522 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.9 | -41.9 | 172.9 | -174.9 | -172.9 | 172.6 | -172.5 | 0 | 112.1 | S89 E90 R91 R97 | S89-K93 WeakPolarHBondContact O-CB 3.27Å; S89-K93 PolarHBondContact O-N 2.88Å; E90-K93 WeakPolarHBondContact O-CB 3.41Å; E90-K93 PolarHBondContact O-N 3.48Å; R91-K93 VanDerWaalsContact C-N 3.28Å; R91-K93 PolarHBondContact O-N 3.01Å; K93-R97 WeakPolarHBondContact O-CG 3.45Å; K93-R97 PolarHBondContact O-N 2.7Å; K93-R97 PolarHBondContact O-NE 3.46Å |
| 94 | M | 98.7 | Very high | 98 | Very high | 101 Ų | 101 | 97.4 Ų | 97.4 | 50% | 0.498 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63 | -45.1 | 173.3 | -67.8 | -67.7 | -38 | 0 | 0 | 111.1 | E90 R91 E92 M96 R97 S98 | E90-M94 WeakPolarHBondContact O-CG 3.44Å; E90-M94 PolarHBondContact O-N 3.46Å; R91-M94 WeakPolarHBondContact O-CB 3.12Å; R91-M94 PolarHBondContact O-N 3.34Å; E92-M94 PolarHBondContact O-N 3.31Å; M94-M96 PolarHBondContact O-N 3.29Å; M94-R97 WeakPolarHBondContact O-CB 3.38Å; M94-R97 PolarHBondContact O-N 3.48Å; M94-R97 PolarHBondContact SD-NH1 3.07Å; M94-R97 PolarHBondContact SD-NH2 3.23Å; M94-S98 PolarHBondContact O-N 3.4Å; M94-S98 VanDerWaalsContact O-N 3.08Å |
| 95 | R | 98.6 | Very high | 98 | Very high | 155 Ų | 155 | 95.1 Ų | 95.1 | 59% | 0.585 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -57.8 | -47.6 | 177.1 | -177.6 | -176.2 | 170.4 | -103.5 | -2.3 | 111.7 | R91 E92 R97 S98 L99 | R91-R95 PolarHBondContact O-N 3.23Å; E92-R95 WeakPolarHBondContact O-CB 3.39Å; E92-R95 PolarHBondContact O-N 3.46Å; E92-R95 IonicContact OE1-CZ 3.83Å; E92-R95 IonicContact OE1-NH1 2.76Å; E92-R95 PolarHBondContact OE1-NH1 3.47Å; E92-R95 WeakPolarHBondContact OE2-CD 3.44Å; E92-R95 IonicContact OE2-NH1 3.8Å; R95-R97 VanDerWaalsContact C-N 3.33Å; R95-R97 PolarHBondContact O-N 3.03Å; R95-S98 PolarHBondContact O-N 2.98Å; R95-L99 PolarHBondContact O-N 2.93Å; R95-L99 VanDerWaalsContact O-N 3.08Å |
| 96 | M | 98.8 | Very high | 98.1 | Very high | 72 Ų | 72 | 90.6 Ų | 90.6 | 36% | 0.355 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -66.4 | -32 | 178.1 | -71.7 | -62.9 | 92.8 | 0 | 0 | 113.4 | E92 M94 L99 A100 | E92-M96 HydrophobicContact CG-CG 4.46Å; E92-M96 WeakPolarHBondContact O-CB 3.42Å; E92-M96 WeakPolarHBondContact O-CG 3.34Å; E92-M96 PolarHBondContact O-N 3.24Å; E92-M96 WeakPolarHBondContact OE1-CE 3.49Å; M94-M96 PolarHBondContact O-N 3.29Å; M96-L99 HydrophobicContact CE-CB 4.33Å; M96-L99 HydrophobicContact CE-CD2 3.68Å; M96-L99 PolarHBondContact O-N 3.37Å; M96-L99 HydrophobicContact SD-CD2 4.2Å; M96-A100 PolarHBondContact O-N 3.26Å |
| 97 | R | 98.6 | Very high | 98 | Very high | 106 Ų | 106 | 86.7 Ų | 86.7 | 40% | 0.4 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -64.7 | -48.1 | 173 | -83.6 | -179 | -86 | 146.4 | -12.6 | 112.1 | E90 K93 M94 R95 L99 A100 E101 | E90-R97 IonicContact OE1-NH2 2.89Å; E90-R97 PolarHBondContact OE1-NH2 3.08Å; K93-R97 WeakPolarHBondContact O-CG 3.45Å; K93-R97 PolarHBondContact O-N 2.7Å; K93-R97 PolarHBondContact O-NE 3.46Å; M94-R97 WeakPolarHBondContact O-CB 3.38Å; M94-R97 PolarHBondContact O-N 3.48Å; M94-R97 PolarHBondContact SD-NH1 3.07Å; M94-R97 PolarHBondContact SD-NH2 3.23Å; R95-R97 VanDerWaalsContact C-N 3.33Å; R95-R97 PolarHBondContact O-N 3.03Å; R97-L99 VanDerWaalsContact C-N 3.3Å; R97-L99 PolarHBondContact O-N 2.89Å; R97-A100 PolarHBondContact O-N 3.21Å; R97-A100 VanDerWaalsContact O-N 3.15Å; R97-E101 PolarHBondContact O-N 3.48Å |
| 98 | S | 98.7 | Very high | 97.8 | Very high | 76 Ų | 76 | 86.2 Ų | 86.2 | 53% | 0.531 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -59.7 | -40.8 | 175.9 | 174.4 | 0 | 0 | 0 | 0 | 112 | M94 R95 A100 E101 A102 | M94-S98 PolarHBondContact O-N 3.4Å; M94-S98 VanDerWaalsContact O-N 3.08Å; R95-S98 PolarHBondContact O-N 2.98Å; S98-A100 PolarHBondContact O-N 3.45Å; S98-E101 PolarHBondContact O-N 3.06Å; S98-A102 PolarHBondContact O-N 3.08Å |
| 99 | L | 98.4 | Very high | 97.7 | Very high | 88 Ų | 88 | 92.6 Ų | 92.6 | 46% | 0.461 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.7 | -41.3 | 175.2 | 178.8 | 60.9 | 0 | 0 | 0 | 112.6 | R95 M96 R97 L103 | R95-L99 PolarHBondContact O-N 2.93Å; R95-L99 VanDerWaalsContact O-N 3.08Å; M96-L99 HydrophobicContact CE-CB 4.33Å; M96-L99 HydrophobicContact CE-CD2 3.68Å; M96-L99 PolarHBondContact O-N 3.37Å; M96-L99 HydrophobicContact SD-CD2 4.2Å; R97-L99 VanDerWaalsContact C-N 3.3Å; R97-L99 PolarHBondContact O-N 2.89Å; L99-L103 WeakPolarHBondContact O-CB 3.39Å; L99-L103 PolarHBondContact O-N 3.13Å; L99-L103 VanDerWaalsContact O-N 3.12Å |
| 100 | A | 97.9 | Very high | 97.6 | Very high | 35 Ų | 35 | 89.6 Ų | 89.6 | 29% | 0.289 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -64.1 | -43.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | M96 R97 S98 L103 H104 | M96-A100 PolarHBondContact O-N 3.26Å; R97-A100 PolarHBondContact O-N 3.21Å; R97-A100 VanDerWaalsContact O-N 3.15Å; S98-A100 PolarHBondContact O-N 3.45Å; A100-L103 PolarHBondContact O-N 3.41Å; A100-H104 PolarHBondContact O-CD2 3.12Å; A100-H104 PolarHBondContact O-N 3.5Å |
| 101 | E | 98.3 | Very high | 97.3 | Very high | 117 Ų | 117 | 86.9 Ų | 86.9 | 55% | 0.547 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -59.4 | -49.6 | 177.5 | -175.5 | 178.3 | -178.2 | 0 | 0 | 112.1 | R97 S98 L103 H104 Q105 | R97-E101 PolarHBondContact O-N 3.48Å; S98-E101 PolarHBondContact O-N 3.06Å; E101-L103 PolarHBondContact O-N 2.83Å; E101-H104 WeakPolarHBondContact O-CA 3.22Å; E101-H104 WeakPolarHBondContact O-CB 3.41Å; E101-H104 PolarHBondContact O-N 3.27Å; E101-Q105 WeakPolarHBondContact O-CG 3.46Å; E101-Q105 PolarHBondContact O-N 3.32Å |
| 102 | A | 98.4 | Very high | 96.8 | Very high | 52 Ų | 52 | 85.5 Ų | 85.5 | 43% | 0.43 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -58.6 | -37.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | S98 Q105 L106 | S98-A102 PolarHBondContact O-N 3.08Å; A102-Q105 PolarHBondContact O-N 3.48Å; A102-L106 WeakPolarHBondContact O-CB 3.49Å; A102-L106 PolarHBondContact O-N 2.93Å |
| 103 | L | 97.3 | Very high | 96.2 | Very high | 21 Ų | 21 | 88.2 Ų | 88.2 | 11% | 0.11 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -70.5 | -31.1 | 176.6 | -166.3 | 145.2 | 0 | 0 | 0 | 112.3 | L99 A100 E101 R107 K123 T126 | L99-L103 WeakPolarHBondContact O-CB 3.39Å; L99-L103 PolarHBondContact O-N 3.13Å; L99-L103 VanDerWaalsContact O-N 3.12Å; A100-L103 PolarHBondContact O-N 3.41Å; E101-L103 PolarHBondContact O-N 2.83Å; L103-R107 WeakPolarHBondContact O-CG 3.43Å; L103-R107 PolarHBondContact O-N 3.5Å; L103-K123 HydrophobicContact CD1-CB 3.96Å; L103-K123 HydrophobicContact CD1-CD 4.36Å; L103-K123 HydrophobicContact CD1-CG 3.86Å; L103-K123 HydrophobicContact CD2-CG 4.2Å; L103-T126 HydrophobicContact CD2-CG2 4.35Å; L103-T126 HydrophobicContact CG-CG2 4.41Å |
| 104 | H | 96.2 | Very high | 95.6 | Very high | 111 Ų | 111 | 83.9 Ų | 83.9 | 51% | 0.514 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -67.3 | -48.3 | 170.5 | -79.2 | -75.3 | 0 | 0 | 0 | 111.4 | A100 E101 L106 R107 D108 | A100-H104 PolarHBondContact O-CD2 3.12Å; A100-H104 PolarHBondContact O-N 3.5Å; E101-H104 WeakPolarHBondContact O-CA 3.22Å; E101-H104 WeakPolarHBondContact O-CB 3.41Å; E101-H104 PolarHBondContact O-N 3.27Å; H104-L106 PolarHBondContact O-N 3.2Å; H104-R107 PolarHBondContact CE1-NH1 3.29Å; H104-R107 PolarHBondContact ND1-NH1 2.77Å; H104-R107 WeakPolarHBondContact O-CB 3.5Å; H104-R107 PolarHBondContact O-N 2.93Å; H104-D108 PolarHBondContact O-N 3.19Å |
| 105 | Q | 97.4 | Very high | 94.9 | Very high | 99 Ų | 99 | 81.1 Ų | 81.1 | 46% | 0.463 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -56.5 | -39.3 | 175.6 | -68.4 | 173.4 | -1.1 | 0 | 0 | 111.8 | E101 A102 R107 D108 Y109 | E101-Q105 WeakPolarHBondContact O-CG 3.46Å; E101-Q105 PolarHBondContact O-N 3.32Å; A102-Q105 PolarHBondContact O-N 3.48Å; Q105-R107 PolarHBondContact O-N 2.98Å; Q105-D108 WeakPolarHBondContact O-CB 3.46Å; Q105-D108 PolarHBondContact O-N 3.47Å; Q105-D108 VanDerWaalsContact O-N 3.09Å; Q105-Y109 WeakPolarHBondContact O-CD2 3.43Å |
| 106 | L | 97.3 | Very high | 93.7 | Very high | 50 Ų | 50 | 81.7 Ų | 81.7 | 26% | 0.262 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -58.4 | -35.1 | 175.6 | -177.9 | 57.7 | 0 | 0 | 0 | 112.9 | A102 H104 D108 Y109 T126 L127 T130 | A102-L106 WeakPolarHBondContact O-CB 3.49Å; A102-L106 PolarHBondContact O-N 2.93Å; H104-L106 PolarHBondContact O-N 3.2Å; L106-D108 VanDerWaalsContact C-N 3.28Å; L106-D108 PolarHBondContact O-N 3.27Å; L106-Y109 PolarHBondContact O-N 3.49Å; L106-T126 HydrophobicContact CB-CG2 4.42Å; L106-T126 HydrophobicContact CD2-CG2 3.97Å; L106-T126 HydrophobicContact CG-CG2 4.06Å; L106-L127 HydrophobicContact CD2-CD2 4.35Å; L106-T130 HydrophobicContact CD1-CG2 3.8Å; L106-T130 HydrophobicContact CD2-CG2 4.33Å; L106-T130 HydrophobicContact CG-CG2 4.47Å |
| 107 | R | 95.5 | Very high | 92.3 | Very high | 44 Ų | 44 | 89.5 Ų | 89.5 | 17% | 0.166 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -68.7 | -28.3 | 178.1 | -65.2 | 176.6 | -175.7 | 123.3 | -14.4 | 112.5 | L103 H104 Q105 Y109 L110 L121 T126 | L103-R107 WeakPolarHBondContact O-CG 3.43Å; L103-R107 PolarHBondContact O-N 3.5Å; H104-R107 PolarHBondContact CE1-NH1 3.29Å; H104-R107 PolarHBondContact ND1-NH1 2.77Å; H104-R107 WeakPolarHBondContact O-CB 3.5Å; H104-R107 PolarHBondContact O-N 2.93Å; Q105-R107 PolarHBondContact O-N 2.98Å; R107-Y109 PolarHBondContact O-N 3.25Å; R107-L110 PolarHBondContact O-N 2.98Å; R107-L110 VanDerWaalsContact O-N 3.08Å; R107-L121 VanDerWaalsContact CZ-O 3.32Å; R107-L121 PolarHBondContact NE-O 3.45Å; R107-L121 PolarHBondContact NH2-O 3.42Å; R107-T126 HydrophobicContact CG-CG2 3.57Å; R107-T126 PolarHBondContact NE-OG1 3.07Å; R107-T126 VanDerWaalsContact NE-OG1 3.09Å |
| 108 | D | 94.4 | Very high | 91 | Very high | 133 Ų | 133 | 88 Ų | 88 | 71% | 0.711 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -67.6 | -21.2 | 179.5 | -59.5 | -27.2 | 0 | 0 | 0 | 112 | H104 Q105 L106 | H104-D108 PolarHBondContact O-N 3.19Å; Q105-D108 WeakPolarHBondContact O-CB 3.46Å; Q105-D108 PolarHBondContact O-N 3.47Å; Q105-D108 VanDerWaalsContact O-N 3.09Å; L106-D108 VanDerWaalsContact C-N 3.28Å; L106-D108 PolarHBondContact O-N 3.27Å |
| 109 | Y | 95.7 | Very high | 90.3 | Very high | 177 Ų | 177 | 90.6 Ų | 90.6 | 69% | 0.694 | 47% | 0.466 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.4 | -8.5 | 174.3 | -63 | -72.4 | 0 | 0 | 0 | 113.9 | Q105 L106 R107 Y133 | Q105-Y109 WeakPolarHBondContact O-CD2 3.43Å; L106-Y109 PolarHBondContact O-N 3.49Å; R107-Y109 PolarHBondContact O-N 3.25Å; Y109-Y133 WeakPolarHBondContact O-CE1 3.47Å |
| 110 | L | 94.6 | Very high | 89.6 | Confident | 14 Ų | 14 | 91.3 Ų | 91.3 | 7% | 0.073 | 48% | 0.476 | C | S | . | . | S | Bend | trans | -85.2 | 137 | 179.6 | -67.8 | 177.5 | 0 | 0 | 0 | 110.8 | R107 L121 T126 Y133 | R107-L110 PolarHBondContact O-N 2.98Å; R107-L110 VanDerWaalsContact O-N 3.08Å; L110-L121 HydrophobicContact CD1-CD1 3.75Å; L110-T126 HydrophobicContact CD1-CG2 4.14Å; L110-Y133 HydrophobicContact CD2-CD1 4.4Å |
| 111 | P | 92.3 | Very high | 89.4 | Confident | 31 Ų | 31 | 90.1 Ų | 90.1 | 20% | 0.201 | 47% | 0.465 | C | S | . | . | trans | -55.5 | 143.2 | 174.3 | -27.5 | 33.7 | 0 | 0 | 0 | 112.8 | D113 Y114 Y133 | P111-D113 PolarHBondContact O-N 3.16Å; P111-Y114 HydrophobicContact CB-CD2 3.86Å; P111-Y114 HydrophobicContact CB-CE2 4.11Å; P111-Y114 HydrophobicContact CG-CD2 3.99Å; P111-Y114 HydrophobicContact CG-CE2 3.86Å; P111-Y114 PolarHBondContact O-N 2.98Å; P111-Y114 VanDerWaalsContact O-N 3.08Å; P111-Y133 HydrophobicContact CG-CD2 3.85Å; P111-Y133 HydrophobicContact CG-CE1 4.35Å; P111-Y133 HydrophobicContact CG-CE2 3.47Å; P111-Y133 VanDerWaalsContact CG-CE2 3.47Å; P111-Y133 HydrophobicContact CG-CG 4.46Å | ||
| 112 | P | 87.6 | Confident | 89.3 | Confident | 110 Ų | 110 | 87.9 Ų | 87.9 | 71% | 0.714 | 46% | 0.459 | S | S | * | . | G | 310 helix | trans | -55.4 | -28.9 | -179.7 | -27.2 | 34.7 | 0 | 0 | 0 | 114.4 | Y114 S115 | P112-Y114 PolarHBondContact O-N 2.99Å; P112-Y114 VanDerWaalsContact O-N 3.16Å; P112-S115 PolarHBondContact O-N 2.76Å |
| 113 | D | 86.1 | Confident | 89.2 | Confident | 141 Ų | 141 | 91.4 Ų | 91.4 | 75% | 0.754 | 47% | 0.465 | S | S | * | . | G | 310 helix | trans | -58.5 | -27.3 | 179.2 | -64.6 | -15.8 | 0 | 0 | 0 | 113.4 | P111 | P111-D113 PolarHBondContact O-N 3.16Š|
| 114 | Y | 87.4 | Confident | 89.2 | Confident | 29 Ų | 29 | 95.3 Ų | 95.3 | 11% | 0.114 | 49% | 0.485 | C | S | . | . | G | 310 helix | trans | -74.5 | -28.5 | 175.9 | -70.9 | -75.6 | 0 | 0 | 0 | 112.3 | P111 P112 K116 Y129 E132 K136 | P111-Y114 HydrophobicContact CB-CD2 3.86Å; P111-Y114 HydrophobicContact CB-CE2 4.11Å; P111-Y114 HydrophobicContact CG-CD2 3.99Å; P111-Y114 HydrophobicContact CG-CE2 3.86Å; P111-Y114 PolarHBondContact O-N 2.98Å; P111-Y114 VanDerWaalsContact O-N 3.08Å; P112-Y114 PolarHBondContact O-N 2.99Å; P112-Y114 VanDerWaalsContact O-N 3.16Å; Y114-K116 PolarHBondContact O-N 3.48Å; Y114-K116 VanDerWaalsContact O-N 3.15Å; Y114-Y129 AromaticContact CD1-CD1 3.57Å; Y114-Y129 HydrophobicContact CD1-CD1 3.57Å; Y114-Y129 AromaticContact CD1-CD2 3.79Å; Y114-Y129 HydrophobicContact CD1-CD2 3.79Å; Y114-Y129 HydrophobicContact CD1-CE1 4.05Å; Y114-Y129 HydrophobicContact CD1-CE2 4.22Å; Y114-Y129 AromaticContact CD1-CG 3.44Å; Y114-Y129 HydrophobicContact CD1-CG 3.44Å; Y114-Y129 VanDerWaalsContact CD1-CG 3.44Å; Y114-Y129 AromaticContact CE1-CD1 3.9Å; Y114-Y129 HydrophobicContact CE1-CD1 3.9Å; Y114-Y129 HydrophobicContact CE1-CG 4.07Å; Y114-Y129 HydrophobicContact CG-CD2 4.15Å; Y114-Y129 HydrophobicContact CG-CG 4.1Å; Y114-E132 PolarHBondContact OH-OE1 3.14Å; Y114-K136 PolarHBondContact OH-NZ 3.28Å |
| 115 | S | 82.5 | Confident | 89.2 | Confident | 43 Ų | 43 | 93.5 Ų | 93.5 | 30% | 0.301 | 48% | 0.477 | S | S | . | . | S | Bend | trans | -89.2 | 72.2 | 178.2 | -65.1 | 0 | 0 | 0 | 0 | 110.5 | P112 R117 | P112-S115 PolarHBondContact O-N 2.76Å; S115-R117 PolarHBondContact O-N 3.42Å |
| 116 | K | 73.6 | Confident | 89.2 | Confident | 167 Ų | 167 | 88.8 Ų | 88.8 | 73% | 0.726 | 46% | 0.455 | S | S | * | . | G | 310 helix | trans | -57.9 | 125 | -179.7 | -59.8 | -164.6 | -178.9 | -169.9 | 0 | 110.7 | Y114 G118 | Y114-K116 PolarHBondContact O-N 3.48Å; Y114-K116 VanDerWaalsContact O-N 3.15Å; K116-G118 PolarHBondContact O-N 3.05Å |
| 117 | R | 70.3 | Confident | 89.2 | Confident | 236 Ų | 236 | 90.6 Ų | 90.6 | 89% | 0.891 | 46% | 0.464 | S | S | * | . | G | 310 helix | trans | 67.7 | 27.7 | 168 | -155.6 | -169.6 | -74.8 | -178.1 | -5.5 | 115.2 | S115 Q119 | S115-R117 PolarHBondContact O-N 3.42Å; R117-Q119 PolarHBondContact O-N 3.01Å; R117-Q119 VanDerWaalsContact O-N 3.1Å |
| 118 | G | 70.9 | Confident | 89.2 | Confident | 74 Ų | 74 | 94.6 Ų | 94.6 | 76% | 0.763 | 48% | 0.483 | S | S | * | . | G | 310 helix | trans | 65.7 | 14.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | K116 | K116-G118 PolarHBondContact O-N 3.05Š|
| 119 | Q | 84 | Confident | 89.3 | Confident | 130 Ų | 130 | 90.8 Ų | 90.8 | 61% | 0.607 | 46% | 0.459 | S | S | * | . | P | Polyproline II helix | trans | -84.5 | 138.2 | 174.2 | -68.4 | -64.7 | -33.4 | 0 | 0 | 109.7 | R117 L121 | R117-Q119 PolarHBondContact O-N 3.01Å; R117-Q119 VanDerWaalsContact O-N 3.1Å; Q119-L121 PolarHBondContact O-N 3.32Å |
| 120 | P | 84.9 | Confident | 89.4 | Confident | 104 Ų | 104 | 83.4 Ų | 83.4 | 68% | 0.675 | 43% | 0.432 | S | S | * | . | P | Polyproline II helix | trans | -67.2 | 134.4 | 176.8 | 27.7 | -33.2 | 0 | 0 | 0 | 110.4 | ||
| 121 | L | 92.8 | Very high | 89.6 | Confident | 10 Ų | 10 | 86.9 Ų | 86.9 | 5% | 0.052 | 45% | 0.45 | C | S | . | . | P | Polyproline II helix | trans | -62.2 | 140.5 | 177.4 | -66.2 | 175.8 | 0 | 0 | 0 | 111.4 | R107 L110 Q119 Q125 T126 Y129 | R107-L121 VanDerWaalsContact CZ-O 3.32Å; R107-L121 PolarHBondContact NE-O 3.45Å; R107-L121 PolarHBondContact NH2-O 3.42Å; L110-L121 HydrophobicContact CD1-CD1 3.75Å; Q119-L121 PolarHBondContact O-N 3.32Å; L121-Q125 HydrophobicContact CB-CB 4.47Å; L121-Q125 HydrophobicContact CD2-CB 4.31Å; L121-T126 WeakPolarHBondContact CB-OG1 3.38Å; L121-Y129 HydrophobicContact CD1-CD2 4.09Å; L121-Y129 HydrophobicContact CD2-CD2 3.96Å; L121-Y129 HydrophobicContact CD2-CE2 3.68Å |
| 122 | T | 95.6 | Very high | 89.8 | Confident | 69 Ų | 69 | 89 Ų | 89 | 42% | 0.423 | 46% | 0.457 | S | S | . | . | P | Polyproline II helix | trans | -68.3 | 164.1 | 167.7 | 63.9 | 0 | 0 | 0 | 0 | 111 | I124 Q125 T126 | T122-I124 VanDerWaalsContact C-N 3.33Å; T122-I124 PolarHBondContact O-N 2.81Å; T122-I124 WeakPolarHBondContact OG1-CG2 3.47Å; T122-Q125 PolarHBondContact O-N 2.87Å; T122-Q125 WeakPolarHBondContact OG1-CB 3.38Å; T122-Q125 VanDerWaalsContact OG1-CD 3.27Å; T122-Q125 WeakPolarHBondContact OG1-CG 3.46Å; T122-Q125 PolarHBondContact OG1-N 3.36Å; T122-Q125 PolarHBondContact OG1-OE1 3.17Å; T122-T126 PolarHBondContact O-N 3.34Å; T122-T126 PolarHBondContact O-OG1 3.08Å |
| 123 | K | 97.3 | Very high | 90.3 | Very high | 127 Ų | 127 | 87.3 Ų | 87.3 | 55% | 0.552 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -56.4 | -47.6 | 177.6 | -64.4 | -174.6 | 179.7 | -178.9 | 0 | 111.5 | L103 Q125 T126 L127 | L103-K123 HydrophobicContact CD1-CB 3.96Å; L103-K123 HydrophobicContact CD1-CD 4.36Å; L103-K123 HydrophobicContact CD1-CG 3.86Å; L103-K123 HydrophobicContact CD2-CG 4.2Å; K123-Q125 PolarHBondContact O-N 2.91Å; K123-T126 PolarHBondContact O-N 2.64Å; K123-L127 WeakPolarHBondContact O-CG 3.33Å; K123-L127 PolarHBondContact O-N 3.37Å; K123-L127 VanDerWaalsContact O-N 3.16Å |
| 124 | I | 97.2 | Very high | 90.8 | Very high | 103 Ų | 103 | 85 Ų | 85 | 53% | 0.528 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -66 | -39.3 | -179.2 | -171.7 | 60.5 | 0 | 0 | 0 | 112.3 | T122 L127 K128 | T122-I124 VanDerWaalsContact C-N 3.33Å; T122-I124 PolarHBondContact O-N 2.81Å; T122-I124 WeakPolarHBondContact OG1-CG2 3.47Å; I124-L127 PolarHBondContact O-N 3.48Å; I124-K128 HydrophobicContact CG1-CD 4.42Å; I124-K128 WeakPolarHBondContact O-CG 3.39Å; I124-K128 PolarHBondContact O-N 3.35Å |
| 125 | Q | 95.7 | Very high | 91.3 | Very high | 73 Ų | 73 | 87.6 Ų | 87.6 | 34% | 0.341 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -64.6 | -43.7 | 175.8 | -75.1 | 168.5 | -46.5 | 0 | 0 | 111.7 | L121 T122 K123 L127 K128 Y129 | L121-Q125 HydrophobicContact CB-CB 4.47Å; L121-Q125 HydrophobicContact CD2-CB 4.31Å; T122-Q125 PolarHBondContact O-N 2.87Å; T122-Q125 WeakPolarHBondContact OG1-CB 3.38Å; T122-Q125 VanDerWaalsContact OG1-CD 3.27Å; T122-Q125 WeakPolarHBondContact OG1-CG 3.46Å; T122-Q125 PolarHBondContact OG1-N 3.36Å; T122-Q125 PolarHBondContact OG1-OE1 3.17Å; K123-Q125 PolarHBondContact O-N 2.91Å; Q125-L127 VanDerWaalsContact C-N 3.3Å; Q125-L127 PolarHBondContact O-N 3.33Å; Q125-K128 PolarHBondContact O-N 3.41Å; Q125-Y129 HydrophobicContact CB-CD2 4.38Å; Q125-Y129 HydrophobicContact CB-CE2 4.12Å; Q125-Y129 WeakPolarHBondContact O-CB 3.4Å; Q125-Y129 WeakPolarHBondContact O-CD2 3.41Å; Q125-Y129 VanDerWaalsContact O-CG 3.3Å; Q125-Y129 PolarHBondContact O-N 3.14Å |
| 126 | T | 96.7 | Very high | 91.9 | Very high | 0 Ų | 0 | 90 Ų | 90 | 0% | 0 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -56.5 | -46.9 | 178.5 | -53.1 | 0 | 0 | 0 | 0 | 110.6 | L103 L106 R107 L110 L121 T122 K123 T130 | L103-T126 HydrophobicContact CD2-CG2 4.35Å; L103-T126 HydrophobicContact CG-CG2 4.41Å; L106-T126 HydrophobicContact CB-CG2 4.42Å; L106-T126 HydrophobicContact CD2-CG2 3.97Å; L106-T126 HydrophobicContact CG-CG2 4.06Å; R107-T126 HydrophobicContact CG-CG2 3.57Å; R107-T126 PolarHBondContact NE-OG1 3.07Å; R107-T126 VanDerWaalsContact NE-OG1 3.09Å; L110-T126 HydrophobicContact CD1-CG2 4.14Å; L121-T126 WeakPolarHBondContact CB-OG1 3.38Å; T122-T126 PolarHBondContact O-N 3.34Å; T122-T126 PolarHBondContact O-OG1 3.08Å; K123-T126 PolarHBondContact O-N 2.64Å; T126-T130 WeakPolarHBondContact O-CB 3.46Å; T126-T130 PolarHBondContact O-N 3.36Å; T126-T130 PolarHBondContact O-OG1 3.36Å |
| 127 | L | 98.1 | Very high | 93 | Very high | 88 Ų | 88 | 85.3 Ų | 85.3 | 46% | 0.461 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -65.4 | -46.1 | 178.7 | -63.8 | 175.9 | 0 | 0 | 0 | 112.1 | L106 K123 I124 Q125 Y129 T130 I131 | L106-L127 HydrophobicContact CD2-CD2 4.35Å; K123-L127 WeakPolarHBondContact O-CG 3.33Å; K123-L127 PolarHBondContact O-N 3.37Å; K123-L127 VanDerWaalsContact O-N 3.16Å; I124-L127 PolarHBondContact O-N 3.48Å; Q125-L127 VanDerWaalsContact C-N 3.3Å; Q125-L127 PolarHBondContact O-N 3.33Å; L127-Y129 PolarHBondContact O-N 3.17Å; L127-T130 PolarHBondContact O-N 3.3Å; L127-I131 WeakPolarHBondContact O-CG1 3.31Å; L127-I131 PolarHBondContact O-N 3.14Å |
| 128 | K | 96.6 | Very high | 94.3 | Very high | 127 Ų | 127 | 77 Ų | 77 | 55% | 0.552 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -59.4 | -47.8 | 178 | -75.7 | -173.7 | 172.8 | -164.8 | 0 | 112.2 | I124 Q125 T130 I131 E132 | I124-K128 HydrophobicContact CG1-CD 4.42Å; I124-K128 WeakPolarHBondContact O-CG 3.39Å; I124-K128 PolarHBondContact O-N 3.35Å; Q125-K128 PolarHBondContact O-N 3.41Å; K128-T130 VanDerWaalsContact C-N 3.34Å; K128-T130 PolarHBondContact O-N 3.47Å; K128-I131 PolarHBondContact O-N 3.06Å; K128-E132 PolarHBondContact O-N 2.92Å; K128-E132 VanDerWaalsContact O-N 3.14Å |
| 129 | Y | 96.4 | Very high | 95.5 | Very high | 54 Ų | 54 | 77.5 Ų | 77.5 | 21% | 0.212 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -69.3 | -31.6 | -179.5 | -63.7 | -27.8 | 0 | 0 | 0 | 113 | Y114 L121 Q125 L127 E132 Y133 | Y114-Y129 AromaticContact CD1-CD1 3.57Å; Y114-Y129 HydrophobicContact CD1-CD1 3.57Å; Y114-Y129 AromaticContact CD1-CD2 3.79Å; Y114-Y129 HydrophobicContact CD1-CD2 3.79Å; Y114-Y129 HydrophobicContact CD1-CE1 4.05Å; Y114-Y129 HydrophobicContact CD1-CE2 4.22Å; Y114-Y129 AromaticContact CD1-CG 3.44Å; Y114-Y129 HydrophobicContact CD1-CG 3.44Å; Y114-Y129 VanDerWaalsContact CD1-CG 3.44Å; Y114-Y129 AromaticContact CE1-CD1 3.9Å; Y114-Y129 HydrophobicContact CE1-CD1 3.9Å; Y114-Y129 HydrophobicContact CE1-CG 4.07Å; Y114-Y129 HydrophobicContact CG-CD2 4.15Å; Y114-Y129 HydrophobicContact CG-CG 4.1Å; L121-Y129 HydrophobicContact CD1-CD2 4.09Å; L121-Y129 HydrophobicContact CD2-CD2 3.96Å; L121-Y129 HydrophobicContact CD2-CE2 3.68Å; Q125-Y129 HydrophobicContact CB-CD2 4.38Å; Q125-Y129 HydrophobicContact CB-CE2 4.12Å; Q125-Y129 WeakPolarHBondContact O-CB 3.4Å; Q125-Y129 WeakPolarHBondContact O-CD2 3.41Å; Q125-Y129 VanDerWaalsContact O-CG 3.3Å; Q125-Y129 PolarHBondContact O-N 3.14Å; L127-Y129 PolarHBondContact O-N 3.17Å; Y129-E132 PolarHBondContact O-N 3.13Å; Y129-Y133 VanDerWaalsContact O-CB 3.27Å; Y129-Y133 WeakPolarHBondContact O-CB 3.46Å; Y129-Y133 PolarHBondContact O-N 3.17Å |
| 130 | T | 97.6 | Very high | 96.2 | Very high | 22 Ų | 22 | 76.8 Ų | 76.8 | 14% | 0.135 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -61.7 | -47.5 | 173.5 | -59.5 | 0 | 0 | 0 | 0 | 111.3 | L106 T126 L127 K128 E132 Y133 I134 | L106-T130 HydrophobicContact CD1-CG2 3.8Å; L106-T130 HydrophobicContact CD2-CG2 4.33Å; L106-T130 HydrophobicContact CG-CG2 4.47Å; T126-T130 WeakPolarHBondContact O-CB 3.46Å; T126-T130 PolarHBondContact O-N 3.36Å; T126-T130 PolarHBondContact O-OG1 3.36Å; L127-T130 PolarHBondContact O-N 3.3Å; K128-T130 VanDerWaalsContact C-N 3.34Å; K128-T130 PolarHBondContact O-N 3.47Å; T130-E132 VanDerWaalsContact C-N 3.35Å; T130-E132 PolarHBondContact O-N 3.21Å; T130-Y133 PolarHBondContact O-N 2.88Å; T130-I134 HydrophobicContact CG2-CD1 3.92Å; T130-I134 WeakPolarHBondContact O-CG1 3.4Å; T130-I134 PolarHBondContact O-N 2.88Å |
| 131 | I | 97.9 | Very high | 96.7 | Very high | 86 Ų | 86 | 78.2 Ų | 78.2 | 44% | 0.441 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -59.8 | -47.9 | 177.9 | -65.1 | 165.8 | 0 | 0 | 0 | 110.1 | L127 K128 Y133 I134 N135 | L127-I131 WeakPolarHBondContact O-CG1 3.31Å; L127-I131 PolarHBondContact O-N 3.14Å; K128-I131 PolarHBondContact O-N 3.06Å; I131-Y133 VanDerWaalsContact C-N 3.31Å; I131-Y133 PolarHBondContact O-N 3.45Å; I131-I134 PolarHBondContact O-N 3.18Å; I131-N135 VanDerWaalsContact O-CG 3.31Å; I131-N135 PolarHBondContact O-N 3.21Å; I131-N135 VanDerWaalsContact O-N 3.07Å; I131-N135 PolarHBondContact O-ND2 3.02Å |
| 132 | E | 96.8 | Very high | 96.8 | Very high | 77 Ų | 77 | 81.5 Ų | 81.5 | 36% | 0.36 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -60.2 | -40.7 | 178.1 | -167.1 | -168.2 | 141.6 | 0 | 0 | 112.2 | Y114 K128 Y129 T130 N135 K136 | Y114-E132 PolarHBondContact OH-OE1 3.14Å; K128-E132 PolarHBondContact O-N 2.92Å; K128-E132 VanDerWaalsContact O-N 3.14Å; Y129-E132 PolarHBondContact O-N 3.13Å; T130-E132 VanDerWaalsContact C-N 3.35Å; T130-E132 PolarHBondContact O-N 3.21Å; E132-N135 PolarHBondContact O-N 3.15Å; E132-K136 WeakPolarHBondContact O-CG 3.3Å; E132-K136 PolarHBondContact O-N 3.21Å; E132-K136 WeakPolarHBondContact OE1-CE 3.32Å; E132-K136 IonicContact OE1-NZ 2.66Å; E132-K136 PolarHBondContact OE1-NZ 3.47Å |
| 133 | Y | 97.3 | Very high | 96.3 | Very high | 74 Ų | 74 | 85.1 Ų | 85.1 | 29% | 0.29 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -69 | -43.2 | -179.1 | -174 | -129.4 | 0 | 0 | 0 | 112.2 | Y109 L110 P111 Y129 T130 I131 N135 K136 L137 | Y109-Y133 WeakPolarHBondContact O-CE1 3.47Å; L110-Y133 HydrophobicContact CD2-CD1 4.4Å; P111-Y133 HydrophobicContact CG-CD2 3.85Å; P111-Y133 HydrophobicContact CG-CE1 4.35Å; P111-Y133 HydrophobicContact CG-CE2 3.47Å; P111-Y133 VanDerWaalsContact CG-CE2 3.47Å; P111-Y133 HydrophobicContact CG-CG 4.46Å; Y129-Y133 VanDerWaalsContact O-CB 3.27Å; Y129-Y133 WeakPolarHBondContact O-CB 3.46Å; Y129-Y133 PolarHBondContact O-N 3.17Å; T130-Y133 PolarHBondContact O-N 2.88Å; I131-Y133 VanDerWaalsContact C-N 3.31Å; I131-Y133 PolarHBondContact O-N 3.45Å; Y133-N135 VanDerWaalsContact C-N 3.31Å; Y133-N135 PolarHBondContact O-N 3.38Å; Y133-K136 PolarHBondContact O-N 2.92Å; Y133-L137 HydrophobicContact CD1-CD1 4.1Å; Y133-L137 HydrophobicContact CD2-CD1 4.49Å; Y133-L137 HydrophobicContact CD2-CG 4.28Å; Y133-L137 HydrophobicContact CE1-CD1 3.68Å; Y133-L137 HydrophobicContact CE1-CG 4.42Å; Y133-L137 HydrophobicContact CE2-CD1 4.09Å; Y133-L137 HydrophobicContact CE2-CD2 3.99Å; Y133-L137 HydrophobicContact CE2-CG 3.94Å; Y133-L137 HydrophobicContact CG-CD1 4.48Å; Y133-L137 WeakPolarHBondContact O-CG 3.44Å; Y133-L137 PolarHBondContact O-N 3.38Å |
| 134 | I | 97.8 | Very high | 94.6 | Very high | 93 Ų | 93 | 85.5 Ų | 85.5 | 48% | 0.477 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -58.8 | -44.5 | 174.4 | -68.9 | 169.1 | 0 | 0 | 0 | 110.6 | T130 I131 L137 S138 | T130-I134 HydrophobicContact CG2-CD1 3.92Å; T130-I134 WeakPolarHBondContact O-CG1 3.4Å; T130-I134 PolarHBondContact O-N 2.88Å; I131-I134 PolarHBondContact O-N 3.18Å; I134-L137 PolarHBondContact O-N 3.34Å; I134-S138 WeakPolarHBondContact O-CB 3.45Å; I134-S138 PolarHBondContact O-N 3.22Å; I134-S138 PolarHBondContact O-OG 3.06Å |
| 135 | N | 97.2 | Very high | 94.5 | Very high | 83 Ų | 83 | 84.6 Ų | 84.6 | 44% | 0.444 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -61.6 | -47.6 | 178 | -70.1 | -15 | 0 | 0 | 0 | 111.3 | I131 E132 Y133 L137 S138 D139 | I131-N135 VanDerWaalsContact O-CG 3.31Å; I131-N135 PolarHBondContact O-N 3.21Å; I131-N135 VanDerWaalsContact O-N 3.07Å; I131-N135 PolarHBondContact O-ND2 3.02Å; E132-N135 PolarHBondContact O-N 3.15Å; Y133-N135 VanDerWaalsContact C-N 3.31Å; Y133-N135 PolarHBondContact O-N 3.38Å; N135-L137 PolarHBondContact O-N 3.45Å; N135-S138 WeakPolarHBondContact O-CB 3.47Å; N135-S138 PolarHBondContact O-N 3.38Å; N135-S138 VanDerWaalsContact O-N 3.13Å; N135-D139 PolarHBondContact O-N 3.28Å |
| 136 | K | 95.9 | Very high | 94.4 | Very high | 92 Ų | 92 | 85.2 Ų | 85.2 | 40% | 0.4 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -59.2 | -43.9 | 177.5 | -75 | 177.4 | -177.2 | 175.9 | 0 | 112.8 | Y114 E132 Y133 S138 D139 I140 | Y114-K136 PolarHBondContact OH-NZ 3.28Å; E132-K136 WeakPolarHBondContact O-CG 3.3Å; E132-K136 PolarHBondContact O-N 3.21Å; E132-K136 WeakPolarHBondContact OE1-CE 3.32Å; E132-K136 IonicContact OE1-NZ 2.66Å; E132-K136 PolarHBondContact OE1-NZ 3.47Å; Y133-K136 PolarHBondContact O-N 2.92Å; K136-S138 VanDerWaalsContact C-N 3.32Å; K136-D139 PolarHBondContact O-N 3.19Å; K136-I140 VanDerWaalsContact O-CG1 3.27Å; K136-I140 WeakPolarHBondContact O-CG1 3.31Å; K136-I140 PolarHBondContact O-N 3.47Å |
| 137 | L | 97 | Very high | 94.3 | Very high | 70 Ų | 70 | 89.9 Ų | 89.9 | 37% | 0.366 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.2 | -40.2 | 176.7 | -69.1 | 178.1 | 0 | 0 | 0 | 111.4 | Y133 I134 N135 I140 L141 | Y133-L137 HydrophobicContact CD1-CD1 4.1Å; Y133-L137 HydrophobicContact CD2-CD1 4.49Å; Y133-L137 HydrophobicContact CD2-CG 4.28Å; Y133-L137 HydrophobicContact CE1-CD1 3.68Å; Y133-L137 HydrophobicContact CE1-CG 4.42Å; Y133-L137 HydrophobicContact CE2-CD1 4.09Å; Y133-L137 HydrophobicContact CE2-CD2 3.99Å; Y133-L137 HydrophobicContact CE2-CG 3.94Å; Y133-L137 HydrophobicContact CG-CD1 4.48Å; Y133-L137 WeakPolarHBondContact O-CG 3.44Å; Y133-L137 PolarHBondContact O-N 3.38Å; I134-L137 PolarHBondContact O-N 3.34Å; N135-L137 PolarHBondContact O-N 3.45Å; L137-I140 PolarHBondContact O-N 3.48Å; L137-L141 WeakPolarHBondContact O-CG 3.36Å; L137-L141 PolarHBondContact O-N 3.02Å |
| 138 | S | 97.3 | Very high | 94 | Very high | 61 Ų | 61 | 90.1 Ų | 90.1 | 43% | 0.427 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.6 | -40.1 | 176.6 | -55.5 | 0 | 0 | 0 | 0 | 111.9 | I134 N135 K136 L141 S142 | I134-S138 WeakPolarHBondContact O-CB 3.45Å; I134-S138 PolarHBondContact O-N 3.22Å; I134-S138 PolarHBondContact O-OG 3.06Å; N135-S138 WeakPolarHBondContact O-CB 3.47Å; N135-S138 PolarHBondContact O-N 3.38Å; N135-S138 VanDerWaalsContact O-N 3.13Å; K136-S138 VanDerWaalsContact C-N 3.32Å; S138-L141 PolarHBondContact O-N 3.42Å; S138-S142 WeakPolarHBondContact O-CB 3.38Å; S138-S142 PolarHBondContact O-N 3Å; S138-S142 PolarHBondContact O-OG 2.89Å |
| 139 | D | 96.5 | Very high | 93.9 | Very high | 84 Ų | 84 | 87.8 Ų | 87.8 | 45% | 0.449 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62 | -47.7 | 173.7 | -69.3 | -19.9 | 0 | 0 | 0 | 110.8 | N135 K136 L141 S142 H143 | N135-D139 PolarHBondContact O-N 3.28Å; K136-D139 PolarHBondContact O-N 3.19Å; D139-L141 VanDerWaalsContact C-N 3.3Å; D139-L141 PolarHBondContact O-N 3.25Å; D139-S142 WeakPolarHBondContact CA-OG 3.38Å; D139-S142 PolarHBondContact O-N 3.2Å; D139-S142 PolarHBondContact O-OG 2.73Å; D139-H143 PolarHBondContact O-N 2.97Å; D139-H143 VanDerWaalsContact O-N 3.1Å; D139-H143 PolarHBondContact O-ND1 3.14Å |
| 140 | I | 96.8 | Very high | 93.7 | Very high | 115 Ų | 115 | 90 Ų | 90 | 59% | 0.59 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -58.7 | -43.7 | 178.1 | -68.6 | 164.2 | 0 | 0 | 0 | 111.2 | K136 L137 S142 H143 A144 | K136-I140 VanDerWaalsContact O-CG1 3.27Å; K136-I140 WeakPolarHBondContact O-CG1 3.31Å; K136-I140 PolarHBondContact O-N 3.47Å; L137-I140 PolarHBondContact O-N 3.48Å; I140-S142 VanDerWaalsContact C-N 3.33Å; I140-S142 PolarHBondContact O-N 2.81Å; I140-H143 PolarHBondContact O-N 2.76Å; I140-A144 WeakPolarHBondContact O-CB 3.49Å; I140-A144 PolarHBondContact O-N 2.91Å |
| 141 | L | 96.8 | Very high | 93.4 | Very high | 134 Ų | 134 | 94.9 Ų | 94.9 | 70% | 0.702 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -71 | -24.8 | -179.9 | -70 | 174.5 | 0 | 0 | 0 | 113.7 | L137 S138 D139 | L137-L141 WeakPolarHBondContact O-CG 3.36Å; L137-L141 PolarHBondContact O-N 3.02Å; S138-L141 PolarHBondContact O-N 3.42Å; D139-L141 VanDerWaalsContact C-N 3.3Å; D139-L141 PolarHBondContact O-N 3.25Å |
| 142 | S | 93.7 | Very high | 93.1 | Very high | 80 Ų | 80 | 95.5 Ų | 95.5 | 56% | 0.559 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -85.3 | -21.9 | 177.6 | 55.6 | 0 | 0 | 0 | 0 | 113.7 | S138 D139 I140 | S138-S142 WeakPolarHBondContact O-CB 3.38Å; S138-S142 PolarHBondContact O-N 3Å; S138-S142 PolarHBondContact O-OG 2.89Å; D139-S142 WeakPolarHBondContact CA-OG 3.38Å; D139-S142 PolarHBondContact O-N 3.2Å; D139-S142 PolarHBondContact O-OG 2.73Å; I140-S142 VanDerWaalsContact C-N 3.33Å; I140-S142 PolarHBondContact O-N 2.81Å |
| 143 | H | 85.9 | Confident | 92.8 | Very high | 145 Ų | 145 | 97.1 Ų | 97.1 | 67% | 0.671 | 54% | 0.54 | S | S | * | . | trans | -96.9 | 1.3 | 176.1 | -63.2 | 70.5 | 0 | 0 | 0 | 112.8 | D139 I140 | D139-H143 PolarHBondContact O-N 2.97Å; D139-H143 VanDerWaalsContact O-N 3.1Å; D139-H143 PolarHBondContact O-ND1 3.14Å; I140-H143 PolarHBondContact O-N 2.76Å | ||
| 144 | A | 61.1 | Low | 92.4 | Very high | 134 Ų | 134 | 99.2 Ų | 99.2 | 100% | 1.107 | 56% | 0.563 | S | S | * | * | trans | -90.6 | 0 | 173 | 0 | 0 | 0 | 0 | 0 | 111 | I140 | I140-A144 WeakPolarHBondContact O-CB 3.49Å; I140-A144 PolarHBondContact O-N 2.91Å |
Retrieved 144 of 144 residues in 138 ms
(Link to these results)