| 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 | 53.1 | Low | 56.6 | Low | 243 Ų | 243 | 134.5 Ų | 134.5 | 100% | 1.197 | 83% | 0.825 | S | S | * | * | 0 | 96.2 | 0 | -73.8 | 171.8 | 160.5 | 0 | 0 | 107.9 | |||||
| 2 | M | 49.2 | Very low | 56.4 | Low | 189 Ų | 189 | 131.3 Ų | 131.3 | 93% | 0.931 | 81% | 0.812 | S | S | * | * | trans | -103 | 103.9 | 178.9 | -74.2 | -71 | 168.9 | 0 | 0 | 107.6 | S4 | M2-S4 PolarHBondContact O-N 3.36Š| ||
| 3 | A | 58.3 | Low | 55.7 | Low | 102 Ų | 102 | 129 Ų | 129 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | trans | -75.1 | 102.9 | 176 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 4 | S | 61.3 | Low | 55.2 | Low | 111 Ų | 111 | 127.9 Ų | 127.9 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 133.7 | 168 | -65.5 | 0 | 0 | 0 | 0 | 109.7 | M2 | M2-S4 PolarHBondContact O-N 3.36Š|
| 5 | P | 65.4 | Low | 55.2 | Low | 113 Ų | 113 | 126.7 Ų | 126.7 | 73% | 0.734 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 147.2 | 179.1 | 29 | -32.7 | 0 | 0 | 0 | 111.3 | ||
| 6 | P | 57.9 | Low | 54.7 | Low | 125 Ų | 125 | 125.7 Ų | 125.7 | 81% | 0.812 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 138.4 | -177.3 | 29.3 | -33.5 | 0 | 0 | 0 | 111.6 | ||
| 7 | T | 56.7 | Low | 54.6 | Low | 127 Ų | 127 | 125 Ų | 125 | 78% | 0.779 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 125.3 | 168.4 | 44.9 | 0 | 0 | 0 | 0 | 109.5 | S9 | T7-S9 PolarHBondContact O-N 2.69Š|
| 8 | P | 63.3 | Low | 54.1 | Low | 121 Ų | 121 | 123.2 Ų | 123.2 | 79% | 0.786 | 76% | 0.764 | S | S | * | * | trans | -74 | 112.1 | 170.6 | 26.6 | -29.2 | 0 | 0 | 0 | 109.4 | T10 | P8-T10 PolarHBondContact O-N 2.97Š| ||
| 9 | S | 50.1 | Low | 54.2 | Low | 104 Ų | 104 | 123.3 Ų | 123.3 | 73% | 0.727 | 77% | 0.767 | S | S | * | * | trans | -49.6 | 124.1 | 164.4 | -62.5 | 0 | 0 | 0 | 0 | 110.3 | T7 V11 | T7-S9 PolarHBondContact O-N 2.69Å; S9-V11 VanDerWaalsContact C-N 3.31Å; S9-V11 PolarHBondContact O-N 3.03Å | ||
| 10 | T | 55.8 | Low | 53.9 | Low | 130 Ų | 130 | 122 Ų | 122 | 80% | 0.798 | 76% | 0.762 | S | S | * | * | trans | -62.5 | 88.6 | 171.7 | -55.5 | 0 | 0 | 0 | 0 | 109.7 | P8 S12 | P8-T10 PolarHBondContact O-N 2.97Å; T10-S12 VanDerWaalsContact C-N 3.28Å; T10-S12 PolarHBondContact O-N 2.82Å; T10-S12 VanDerWaalsContact O-N 3.13Å | ||
| 11 | V | 51.4 | Low | 53.4 | Low | 115 Ų | 115 | 121.9 Ų | 121.9 | 70% | 0.697 | 77% | 0.766 | S | S | * | * | trans | -81.3 | 83.7 | 164.7 | -179.7 | 0 | 0 | 0 | 0 | 107 | S9 T13 | S9-V11 VanDerWaalsContact C-N 3.31Å; S9-V11 PolarHBondContact O-N 3.03Å; V11-T13 WeakPolarHBondContact CG1-OG1 3.33Å; V11-T13 PolarHBondContact O-N 3.2Å | ||
| 12 | S | 54.8 | Low | 53.1 | Low | 95 Ų | 95 | 115.9 Ų | 115.9 | 66% | 0.664 | 74% | 0.743 | S | S | * | * | trans | -74.5 | 77.9 | 160.9 | -87.2 | 0 | 0 | 0 | 0 | 108.1 | T10 T14 | T10-S12 VanDerWaalsContact C-N 3.28Å; T10-S12 PolarHBondContact O-N 2.82Å; T10-S12 VanDerWaalsContact O-N 3.13Å; S12-T14 PolarHBondContact O-N 3.34Å | ||
| 13 | T | 47.2 | Very low | 52.8 | Low | 102 Ų | 102 | 110.7 Ų | 110.7 | 63% | 0.626 | 74% | 0.738 | S | S | * | * | trans | -77.3 | 85.8 | 160.6 | -49.5 | 0 | 0 | 0 | 0 | 107.3 | V11 V15 | V11-T13 WeakPolarHBondContact CG1-OG1 3.33Å; V11-T13 PolarHBondContact O-N 3.2Å; T13-V15 HydrophobicContact CG2-CG2 3.46Å; T13-V15 VanDerWaalsContact CG2-CG2 3.46Å; T13-V15 PolarHBondContact O-N 3.38Å | ||
| 14 | T | 47.9 | Very low | 52.1 | Low | 114 Ų | 114 | 109 Ų | 109 | 70% | 0.699 | 73% | 0.73 | S | S | * | * | trans | -70.8 | 84.7 | 158.7 | 46.6 | 0 | 0 | 0 | 0 | 107.3 | S12 T16 | S12-T14 PolarHBondContact O-N 3.34Å; T14-T16 PolarHBondContact O-N 2.9Å | ||
| 15 | V | 55.2 | Low | 51.4 | Low | 109 Ų | 109 | 109.2 Ų | 109.2 | 66% | 0.661 | 73% | 0.732 | S | S | * | * | trans | -73.4 | 80.6 | 157.8 | -151.7 | 0 | 0 | 0 | 0 | 105.7 | T13 T17 | T13-V15 HydrophobicContact CG2-CG2 3.46Å; T13-V15 VanDerWaalsContact CG2-CG2 3.46Å; T13-V15 PolarHBondContact O-N 3.38Å; V15-T17 HydrophobicContact CG1-CG2 3.92Å; V15-T17 PolarHBondContact O-N 3.24Å | ||
| 16 | T | 47 | Very low | 50.6 | Low | 111 Ų | 111 | 113.3 Ų | 113.3 | 68% | 0.681 | 74% | 0.741 | S | S | * | * | trans | -70 | 81.5 | 163.7 | -56 | 0 | 0 | 0 | 0 | 105.7 | T14 S18 | T14-T16 PolarHBondContact O-N 2.9Å; T16-S18 PolarHBondContact O-N 2.69Å | ||
| 17 | T | 53 | Low | 50.4 | Low | 114 Ų | 114 | 115.1 Ų | 115.1 | 70% | 0.699 | 74% | 0.744 | S | S | * | * | trans | -70.6 | 90.3 | 161.4 | 51.6 | 0 | 0 | 0 | 0 | 106.2 | V15 | V15-T17 HydrophobicContact CG1-CG2 3.92Å; V15-T17 PolarHBondContact O-N 3.24Å | ||
| 18 | S | 46.2 | Very low | 50.7 | Low | 93 Ų | 93 | 112 Ų | 112 | 65% | 0.65 | 74% | 0.737 | S | S | * | * | trans | -46.6 | 124 | 160.4 | -53.1 | 0 | 0 | 0 | 0 | 107.5 | T16 S20 | T16-S18 PolarHBondContact O-N 2.69Å; S18-S20 PolarHBondContact O-N 2.98Å | ||
| 19 | P | 56.6 | Low | 51.1 | Low | 124 Ų | 124 | 110.6 Ų | 110.6 | 81% | 0.805 | 73% | 0.728 | S | S | * | * | trans | -61.6 | 114.8 | 173.7 | 24 | -29.9 | 0 | 0 | 0 | 106.9 | S21 | P19-S21 PolarHBondContact O-N 3.45Š| ||
| 20 | S | 47 | Very low | 52.7 | Low | 97 Ų | 97 | 108.9 Ų | 108.9 | 68% | 0.678 | 71% | 0.71 | S | S | * | * | trans | -54.5 | 116.4 | 168 | 62 | 0 | 0 | 0 | 0 | 106.8 | S18 T22 | S18-S20 PolarHBondContact O-N 2.98Å; S20-T22 PolarHBondContact O-N 3.21Å | ||
| 21 | S | 44.7 | Very low | 54.3 | Low | 121 Ų | 121 | 107.6 Ų | 107.6 | 85% | 0.846 | 70% | 0.704 | S | S | * | * | trans | -67.5 | 72 | 170.2 | 56.2 | 0 | 0 | 0 | 0 | 108.6 | P19 G23 | P19-S21 PolarHBondContact O-N 3.45Å; S21-G23 VanDerWaalsContact C-N 3.27Å; S21-G23 PolarHBondContact O-N 3.47Å; S21-G23 VanDerWaalsContact O-N 3.1Å | ||
| 22 | T | 47.1 | Very low | 56.2 | Low | 116 Ų | 116 | 109.3 Ų | 109.3 | 71% | 0.712 | 71% | 0.705 | S | S | * | * | trans | -80.5 | 89.4 | 166.5 | -52 | 0 | 0 | 0 | 0 | 105.9 | S20 G24 | S20-T22 PolarHBondContact O-N 3.21Å; T22-G24 PolarHBondContact O-N 3.38Å | ||
| 23 | G | 41.4 | Very low | 58 | Low | 80 Ų | 80 | 108.6 Ų | 108.6 | 83% | 0.825 | 69% | 0.693 | S | S | * | * | trans | -52.6 | 121.1 | 158.4 | 0 | 0 | 0 | 0 | 0 | 108.1 | S21 | S21-G23 VanDerWaalsContact C-N 3.27Å; S21-G23 PolarHBondContact O-N 3.47Å; S21-G23 VanDerWaalsContact O-N 3.1Å | ||
| 24 | G | 44 | Very low | 60.2 | Low | 66 Ų | 66 | 105.8 Ų | 105.8 | 68% | 0.68 | 68% | 0.68 | S | S | * | * | trans | -162.3 | 88.4 | -175.6 | 0 | 0 | 0 | 0 | 0 | 109 | T22 | T22-G24 PolarHBondContact O-N 3.38Š| ||
| 25 | S | 46.8 | Very low | 62.4 | Low | 117 Ų | 117 | 103.2 Ų | 103.2 | 82% | 0.818 | 67% | 0.67 | S | S | * | * | trans | 40.8 | 122.3 | 153.1 | -55.6 | 0 | 0 | 0 | 0 | 119.4 | L27 | S25-L27 VanDerWaalsContact C-N 3.33Å; S25-L27 PolarHBondContact O-N 3.5Å | ||
| 26 | E | 49.4 | Very low | 64.3 | Low | 198 Ų | 198 | 101.7 Ų | 101.7 | 93% | 0.925 | 66% | 0.656 | S | S | * | * | trans | -41 | 81.2 | 166.9 | -61 | 178.7 | 137.2 | 0 | 0 | 114.4 | ||||
| 27 | L | 53.7 | Low | 66.6 | Low | 164 Ų | 164 | 103.8 Ų | 103.8 | 86% | 0.859 | 65% | 0.651 | S | S | * | * | trans | -123.1 | 90.5 | 145.3 | -72.3 | 171.2 | 0 | 0 | 0 | 104.2 | S25 | S25-L27 VanDerWaalsContact C-N 3.33Å; S25-L27 PolarHBondContact O-N 3.5Å | ||
| 28 | G | 63.2 | Low | 68.7 | Low | 62 Ų | 62 | 104.7 Ų | 104.7 | 64% | 0.639 | 65% | 0.646 | S | S | * | * | trans | -44.8 | 137.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 108.6 | D30 | G28-D30 PolarHBondContact O-N 3.39Å; G28-D30 VanDerWaalsContact O-N 3.07Å | ||
| 29 | P | 70.3 | Confident | 71.1 | Confident | 91 Ų | 91 | 107 Ų | 107 | 59% | 0.591 | 64% | 0.64 | S | S | * | * | trans | -51.1 | 126 | -176.5 | 21.1 | -32.1 | 0 | 0 | 0 | 108.4 | P31 | P29-P31 VanDerWaalsContact O-N 3.08Š| ||
| 30 | D | 84.9 | Confident | 73.1 | Confident | 67 Ų | 67 | 106.3 Ų | 106.3 | 36% | 0.358 | 62% | 0.624 | S | S | . | * | trans | -41.3 | 121.7 | 178.6 | 168.9 | 0.8 | 0 | 0 | 0 | 108.5 | G28 Q32 L33 A34 | G28-D30 PolarHBondContact O-N 3.39Å; G28-D30 VanDerWaalsContact O-N 3.07Å; D30-Q32 PolarHBondContact O-N 3.13Å; D30-Q32 WeakPolarHBondContact OD1-CB 3.35Å; D30-Q32 PolarHBondContact OD1-N 3.13Å; D30-L33 HydrophobicContact CB-CB 4.16Å; D30-L33 HydrophobicContact CB-CD1 3.94Å; D30-L33 HydrophobicContact CB-CG 3.91Å; D30-L33 WeakPolarHBondContact O-CA 3.27Å; D30-L33 WeakPolarHBondContact O-CB 3.47Å; D30-L33 PolarHBondContact O-N 2.99Å; D30-A34 PolarHBondContact O-N 3.17Å | ||
| 31 | P | 88.3 | Confident | 75.4 | Confident | 103 Ų | 103 | 111 Ų | 111 | 67% | 0.669 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -52.9 | -30.3 | -176.3 | 20.6 | -33.3 | 0 | 0 | 0 | 112.3 | P29 A35 | P29-P31 VanDerWaalsContact O-N 3.08Å; P31-A35 VanDerWaalsContact O-CB 3.29Å; P31-A35 WeakPolarHBondContact O-CB 3.49Å; P31-A35 PolarHBondContact O-N 2.93Å |
| 32 | Q | 91.1 | Very high | 78 | Confident | 152 Ų | 152 | 112 Ų | 112 | 71% | 0.71 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -67.9 | -47.2 | 174.8 | -59.7 | -170.4 | -68 | 0 | 0 | 111.8 | D30 A34 A35 E36 | D30-Q32 PolarHBondContact O-N 3.13Å; D30-Q32 WeakPolarHBondContact OD1-CB 3.35Å; D30-Q32 PolarHBondContact OD1-N 3.13Å; Q32-A34 VanDerWaalsContact C-N 3.32Å; Q32-A34 PolarHBondContact O-N 3.27Å; Q32-A35 PolarHBondContact O-N 3.06Å; Q32-E36 WeakPolarHBondContact O-CB 3.05Å; Q32-E36 PolarHBondContact O-N 2.96Å |
| 33 | L | 92.9 | Very high | 80.4 | Confident | 80 Ų | 80 | 110.3 Ų | 110.3 | 42% | 0.419 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -62.4 | -39.6 | 175.1 | -65.1 | -179.4 | 0 | 0 | 0 | 111.8 | D30 E36 R37 | D30-L33 HydrophobicContact CB-CB 4.16Å; D30-L33 HydrophobicContact CB-CD1 3.94Å; D30-L33 HydrophobicContact CB-CG 3.91Å; D30-L33 WeakPolarHBondContact O-CA 3.27Å; D30-L33 WeakPolarHBondContact O-CB 3.47Å; D30-L33 PolarHBondContact O-N 2.99Å; L33-E36 PolarHBondContact O-N 3.48Å; L33-R37 WeakPolarHBondContact O-CB 3.32Å; L33-R37 VanDerWaalsContact O-CG 3.27Å; L33-R37 WeakPolarHBondContact O-CG 3.07Å; L33-R37 PolarHBondContact O-N 3.33Å |
| 34 | A | 93 | Very high | 83.1 | Confident | 42 Ų | 42 | 110.1 Ų | 110.1 | 35% | 0.347 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -64.3 | -43.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | D30 Q32 R37 K38 | D30-A34 PolarHBondContact O-N 3.17Å; Q32-A34 VanDerWaalsContact C-N 3.32Å; Q32-A34 PolarHBondContact O-N 3.27Å; A34-R37 PolarHBondContact O-N 3.36Å; A34-K38 WeakPolarHBondContact O-CB 3.48Å; A34-K38 PolarHBondContact O-N 2.97Å |
| 35 | A | 94.3 | Very high | 85.7 | Confident | 61 Ų | 61 | 112 Ų | 112 | 50% | 0.504 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -62.5 | -42.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | P31 Q32 K38 R39 | P31-A35 VanDerWaalsContact O-CB 3.29Å; P31-A35 WeakPolarHBondContact O-CB 3.49Å; P31-A35 PolarHBondContact O-N 2.93Å; Q32-A35 PolarHBondContact O-N 3.06Å; A35-K38 PolarHBondContact O-N 3.44Å; A35-R39 PolarHBondContact O-N 3.01Å |
| 36 | E | 95.9 | Very high | 88.1 | Confident | 76 Ų | 76 | 114 Ų | 114 | 36% | 0.355 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -65.1 | -45.1 | 177.8 | -162 | -162.1 | 164.1 | 0 | 0 | 111.9 | Q32 L33 K38 R39 K40 | Q32-E36 WeakPolarHBondContact O-CB 3.05Å; Q32-E36 PolarHBondContact O-N 2.96Å; L33-E36 PolarHBondContact O-N 3.48Å; E36-K38 VanDerWaalsContact C-N 3.32Å; E36-K38 PolarHBondContact O-N 3.36Å; E36-R39 WeakPolarHBondContact O-CB 3.44Å; E36-R39 PolarHBondContact O-N 3.44Å; E36-K40 HydrophobicContact CG-CD 4.48Å; E36-K40 WeakPolarHBondContact O-CG 3.26Å; E36-K40 PolarHBondContact O-N 3.07Å; E36-K40 WeakPolarHBondContact OE1-CE 3.39Å; E36-K40 IonicContact OE1-NZ 2.67Å; E36-K40 PolarHBondContact OE1-NZ 2.99Å |
| 37 | R | 95.9 | Very high | 90.5 | Very high | 155 Ų | 155 | 107.9 Ų | 107.9 | 59% | 0.585 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -58.8 | -42.6 | 173.9 | -74.1 | 173.8 | -176.6 | -179.3 | 2.5 | 111.3 | L33 A34 K40 R41 | L33-R37 WeakPolarHBondContact O-CB 3.32Å; L33-R37 VanDerWaalsContact O-CG 3.27Å; L33-R37 WeakPolarHBondContact O-CG 3.07Å; L33-R37 PolarHBondContact O-N 3.33Å; A34-R37 PolarHBondContact O-N 3.36Å; R37-K40 PolarHBondContact O-N 2.62Å; R37-R41 WeakPolarHBondContact O-CB 3.42Å; R37-R41 VanDerWaalsContact O-CG 3.32Å; R37-R41 WeakPolarHBondContact O-CG 3.41Å; R37-R41 PolarHBondContact O-N 3.22Å |
| 38 | K | 96.1 | Very high | 92.6 | Very high | 134 Ų | 134 | 102.8 Ų | 102.8 | 58% | 0.583 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -64 | -41.7 | 175.9 | -173.6 | 176 | -177.9 | 178.3 | 0 | 111.6 | A34 A35 E36 R41 K42 | A34-K38 WeakPolarHBondContact O-CB 3.48Å; A34-K38 PolarHBondContact O-N 2.97Å; A35-K38 PolarHBondContact O-N 3.44Å; E36-K38 VanDerWaalsContact C-N 3.32Å; E36-K38 PolarHBondContact O-N 3.36Å; K38-R41 PolarHBondContact O-N 3.5Å; K38-K42 WeakPolarHBondContact O-CG 3.29Å; K38-K42 PolarHBondContact O-N 3.29Å |
| 39 | R | 96.6 | Very high | 94.3 | Very high | 140 Ų | 140 | 101.3 Ų | 101.3 | 53% | 0.528 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.7 | -51 | 174.7 | -171 | -173.5 | 69.7 | 79.4 | -3.2 | 111.2 | A35 E36 R41 K42 E43 | A35-R39 PolarHBondContact O-N 3.01Å; E36-R39 WeakPolarHBondContact O-CB 3.44Å; E36-R39 PolarHBondContact O-N 3.44Å; R39-R41 PolarHBondContact O-N 2.91Å; R39-K42 PolarHBondContact O-N 2.95Å; R39-E43 IonicContact NH1-OE2 3.55Å; R39-E43 PolarHBondContact O-N 3.42Å; R39-E43 VanDerWaalsContact O-N 3.07Å |
| 40 | K | 97.6 | Very high | 95.6 | Very high | 111 Ų | 111 | 102.9 Ų | 102.9 | 48% | 0.483 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59 | -41.7 | 177.1 | -74.7 | 172.6 | 167.3 | 164.8 | 0 | 112.3 | E36 R37 E43 S44 | E36-K40 HydrophobicContact CG-CD 4.48Å; E36-K40 WeakPolarHBondContact O-CG 3.26Å; E36-K40 PolarHBondContact O-N 3.07Å; E36-K40 WeakPolarHBondContact OE1-CE 3.39Å; E36-K40 IonicContact OE1-NZ 2.67Å; E36-K40 PolarHBondContact OE1-NZ 2.99Å; R37-K40 PolarHBondContact O-N 2.62Å; K40-E43 PolarHBondContact O-N 3.31Å; K40-S44 WeakPolarHBondContact O-CB 3.45Å; K40-S44 PolarHBondContact O-N 3.02Å |
| 41 | R | 96.9 | Very high | 96.3 | Very high | 195 Ų | 195 | 107.9 Ų | 107.9 | 74% | 0.736 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.8 | -42.9 | 176 | -76.7 | 178.7 | -179 | -171.3 | 1.1 | 112.8 | R37 K38 R39 E43 S44 N45 | R37-R41 WeakPolarHBondContact O-CB 3.42Å; R37-R41 VanDerWaalsContact O-CG 3.32Å; R37-R41 WeakPolarHBondContact O-CG 3.41Å; R37-R41 PolarHBondContact O-N 3.22Å; K38-R41 PolarHBondContact O-N 3.5Å; R39-R41 PolarHBondContact O-N 2.91Å; R41-E43 VanDerWaalsContact C-N 3.35Å; R41-S44 PolarHBondContact O-N 3.39Å; R41-N45 VanDerWaalsContact O-CB 3.27Å; R41-N45 WeakPolarHBondContact O-CB 3.34Å; R41-N45 PolarHBondContact O-N 3.46Å |
| 42 | K | 97.9 | Very high | 96.8 | Very high | 141 Ų | 141 | 105.1 Ų | 105.1 | 61% | 0.613 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.8 | -43.5 | 176.5 | -75.3 | -179.8 | 175.1 | -171.4 | 0 | 111.5 | K38 R39 R46 | K38-K42 WeakPolarHBondContact O-CG 3.29Å; K38-K42 PolarHBondContact O-N 3.29Å; R39-K42 PolarHBondContact O-N 2.95Å; K42-R46 WeakPolarHBondContact O-CB 3.45Å; K42-R46 PolarHBondContact O-N 2.84Å |
| 43 | E | 97.9 | Very high | 97.2 | Very high | 82 Ų | 82 | 107 Ų | 107 | 38% | 0.383 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.6 | -46.3 | 177.5 | -175.2 | 172.2 | -170.6 | 0 | 0 | 112.1 | R39 K40 R41 N45 R46 L47 | R39-E43 IonicContact NH1-OE2 3.55Å; R39-E43 PolarHBondContact O-N 3.42Å; R39-E43 VanDerWaalsContact O-N 3.07Å; K40-E43 PolarHBondContact O-N 3.31Å; R41-E43 VanDerWaalsContact C-N 3.35Å; E43-N45 PolarHBondContact O-N 3.09Å; E43-R46 WeakPolarHBondContact O-CB 3.38Å; E43-R46 PolarHBondContact O-N 3.2Å; E43-L47 HydrophobicContact CG-CD1 4.35Å; E43-L47 WeakPolarHBondContact O-CG 3.42Å; E43-L47 PolarHBondContact O-N 3.04Å |
| 44 | S | 98.4 | Very high | 97.4 | Very high | 75 Ų | 75 | 105.1 Ų | 105.1 | 52% | 0.524 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.2 | -44.2 | 175.9 | 178.9 | 0 | 0 | 0 | 0 | 112.3 | K40 R41 R46 L47 S48 | K40-S44 WeakPolarHBondContact O-CB 3.45Å; K40-S44 PolarHBondContact O-N 3.02Å; R41-S44 PolarHBondContact O-N 3.39Å; S44-R46 PolarHBondContact O-N 3.1Å; S44-L47 PolarHBondContact O-N 3.46Å; S44-S48 WeakPolarHBondContact O-CB 3.37Å; S44-S48 PolarHBondContact O-N 3.42Å; S44-S48 PolarHBondContact O-OG 3.26Å |
| 45 | N | 98.5 | Very high | 97.7 | Very high | 107 Ų | 107 | 109.7 Ų | 109.7 | 57% | 0.572 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.9 | -40.1 | 176 | -177.5 | -92.6 | 0 | 0 | 0 | 112.1 | R41 E43 S48 A49 | R41-N45 VanDerWaalsContact O-CB 3.27Å; R41-N45 WeakPolarHBondContact O-CB 3.34Å; R41-N45 PolarHBondContact O-N 3.46Å; E43-N45 PolarHBondContact O-N 3.09Å; N45-S48 WeakPolarHBondContact CA-OG 3.33Å; N45-S48 PolarHBondContact O-N 3.34Å; N45-S48 PolarHBondContact O-OG 2.96Å; N45-S48 VanDerWaalsContact O-OG 3.11Å; N45-A49 WeakPolarHBondContact O-CB 3.45Å; N45-A49 PolarHBondContact O-N 3Å |
| 46 | R | 98.5 | Very high | 97.9 | Very high | 159 Ų | 159 | 113.1 Ų | 113.1 | 60% | 0.6 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -59.2 | -49.8 | 174.5 | -178.3 | -179.6 | 69.5 | 175.5 | 0.8 | 111 | K42 E43 S44 A49 Q50 | K42-R46 WeakPolarHBondContact O-CB 3.45Å; K42-R46 PolarHBondContact O-N 2.84Å; E43-R46 WeakPolarHBondContact O-CB 3.38Å; E43-R46 PolarHBondContact O-N 3.2Å; S44-R46 PolarHBondContact O-N 3.1Å; R46-A49 PolarHBondContact O-N 3.44Å; R46-Q50 WeakPolarHBondContact O-CB 3.28Å; R46-Q50 PolarHBondContact O-N 3.23Å |
| 47 | L | 98.4 | Very high | 98 | Very high | 69 Ų | 69 | 114.3 Ų | 114.3 | 36% | 0.361 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66.5 | -39.4 | 179.6 | -67.9 | 173.5 | 0 | 0 | 0 | 111.9 | E43 S44 Q50 R51 | E43-L47 HydrophobicContact CG-CD1 4.35Å; E43-L47 WeakPolarHBondContact O-CG 3.42Å; E43-L47 PolarHBondContact O-N 3.04Å; S44-L47 PolarHBondContact O-N 3.46Å; L47-Q50 PolarHBondContact O-N 2.79Å; L47-R51 WeakPolarHBondContact O-CB 3.32Å; L47-R51 VanDerWaalsContact O-CG 3.25Å; L47-R51 WeakPolarHBondContact O-CG 3.44Å; L47-R51 PolarHBondContact O-N 3.23Å |
| 48 | S | 98.5 | Very high | 98.2 | Very high | 57 Ų | 57 | 115.5 Ų | 115.5 | 40% | 0.399 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -70.6 | -36.9 | 178.6 | 71.6 | 0 | 0 | 0 | 0 | 112.3 | S44 N45 R51 S52 | S44-S48 WeakPolarHBondContact O-CB 3.37Å; S44-S48 PolarHBondContact O-N 3.42Å; S44-S48 PolarHBondContact O-OG 3.26Å; N45-S48 WeakPolarHBondContact CA-OG 3.33Å; N45-S48 PolarHBondContact O-N 3.34Å; N45-S48 PolarHBondContact O-OG 2.96Å; N45-S48 VanDerWaalsContact O-OG 3.11Å; S48-R51 PolarHBondContact O-N 2.97Å; S48-S52 VanDerWaalsContact O-CB 3.28Å; S48-S52 WeakPolarHBondContact O-CB 3.43Å; S48-S52 PolarHBondContact O-N 3.39Å |
| 49 | A | 98.4 | Very high | 98.3 | Very high | 30 Ų | 30 | 115.1 Ų | 115.1 | 25% | 0.248 | 52% | 0.519 | C | S | . | . | H | α-helix | trans | -63.6 | -44.5 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | N45 R46 S52 R53 | N45-A49 WeakPolarHBondContact O-CB 3.45Å; N45-A49 PolarHBondContact O-N 3Å; R46-A49 PolarHBondContact O-N 3.44Å; A49-S52 PolarHBondContact O-N 2.94Å; A49-R53 WeakPolarHBondContact O-CB 3.49Å; A49-R53 VanDerWaalsContact O-CG 3.31Å; A49-R53 WeakPolarHBondContact O-CG 3.41Å; A49-R53 PolarHBondContact O-N 3.37Å |
| 50 | Q | 98.6 | Very high | 98.4 | Very high | 124 Ų | 124 | 113.2 Ų | 113.2 | 58% | 0.579 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -60.4 | -47.6 | 174.8 | -173.2 | -176.3 | 15.9 | 0 | 0 | 111.4 | R46 L47 S52 R53 A54 | R46-Q50 WeakPolarHBondContact O-CB 3.28Å; R46-Q50 PolarHBondContact O-N 3.23Å; L47-Q50 PolarHBondContact O-N 2.79Å; Q50-S52 VanDerWaalsContact C-N 3.33Å; Q50-S52 PolarHBondContact O-N 2.73Å; Q50-R53 PolarHBondContact O-N 3.01Å; Q50-A54 WeakPolarHBondContact O-CB 3.35Å; Q50-A54 PolarHBondContact O-N 3.31Å |
| 51 | R | 98.7 | Very high | 98.5 | Very high | 173 Ų | 173 | 111.7 Ų | 111.7 | 65% | 0.653 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -60.6 | -41.3 | 176 | -72.9 | 174.5 | -178.7 | -162 | 0.9 | 112 | L47 S48 A54 R55 | L47-R51 WeakPolarHBondContact O-CB 3.32Å; L47-R51 VanDerWaalsContact O-CG 3.25Å; L47-R51 WeakPolarHBondContact O-CG 3.44Å; L47-R51 PolarHBondContact O-N 3.23Å; S48-R51 PolarHBondContact O-N 2.97Å; R51-A54 PolarHBondContact O-N 2.93Å; R51-R55 WeakPolarHBondContact O-CG 3.32Å; R51-R55 PolarHBondContact O-N 3.5Å |
| 52 | S | 98.8 | Very high | 98.5 | Very high | 45 Ų | 45 | 106.7 Ų | 106.7 | 32% | 0.315 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.2 | -46.7 | 177.7 | -171.7 | 0 | 0 | 0 | 0 | 111.5 | S48 A49 Q50 R55 K56 | S48-S52 VanDerWaalsContact O-CB 3.28Å; S48-S52 WeakPolarHBondContact O-CB 3.43Å; S48-S52 PolarHBondContact O-N 3.39Å; A49-S52 PolarHBondContact O-N 2.94Å; Q50-S52 VanDerWaalsContact C-N 3.33Å; Q50-S52 PolarHBondContact O-N 2.73Å; S52-R55 PolarHBondContact O-N 2.99Å; S52-K56 PolarHBondContact O-N 2.96Å |
| 53 | R | 98.6 | Very high | 98.6 | Very high | 190 Ų | 190 | 104.5 Ų | 104.5 | 72% | 0.717 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.2 | -45.3 | 174.4 | -70.8 | 173.6 | -174.3 | 177.5 | 1.1 | 111.5 | A49 Q50 R55 K56 Q57 | A49-R53 WeakPolarHBondContact O-CB 3.49Å; A49-R53 VanDerWaalsContact O-CG 3.31Å; A49-R53 WeakPolarHBondContact O-CG 3.41Å; A49-R53 PolarHBondContact O-N 3.37Å; Q50-R53 PolarHBondContact O-N 3.01Å; R53-R55 PolarHBondContact O-N 2.92Å; R53-K56 PolarHBondContact O-N 3.35Å; R53-Q57 WeakPolarHBondContact O-CB 3.38Å; R53-Q57 PolarHBondContact O-N 3.21Å |
| 54 | A | 98.6 | Very high | 98.6 | Very high | 41 Ų | 41 | 105.1 Ų | 105.1 | 34% | 0.339 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.8 | -40.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q50 R51 Q57 R58 | Q50-A54 WeakPolarHBondContact O-CB 3.35Å; Q50-A54 PolarHBondContact O-N 3.31Å; R51-A54 PolarHBondContact O-N 2.93Å; A54-Q57 PolarHBondContact O-N 3.36Å; A54-R58 WeakPolarHBondContact O-CG 3.47Å; A54-R58 PolarHBondContact O-N 3.43Å |
| 55 | R | 98.7 | Very high | 98.6 | Very high | 138 Ų | 138 | 104.3 Ų | 104.3 | 52% | 0.521 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.3 | -46.7 | 174.2 | -75.3 | -170 | -59.3 | -93.8 | 1.8 | 111.8 | R51 S52 R53 Q57 R58 Q59 | R51-R55 WeakPolarHBondContact O-CG 3.32Å; R51-R55 PolarHBondContact O-N 3.5Å; S52-R55 PolarHBondContact O-N 2.99Å; R53-R55 PolarHBondContact O-N 2.92Å; R55-Q57 VanDerWaalsContact C-N 3.33Å; R55-Q57 PolarHBondContact O-N 2.84Å; R55-R58 PolarHBondContact O-N 3.21Å; R55-Q59 WeakPolarHBondContact O-CG 3.4Å; R55-Q59 PolarHBondContact O-N 3.37Å |
| 56 | K | 98.6 | Very high | 98.7 | Very high | 134 Ų | 134 | 103.6 Ų | 103.6 | 58% | 0.583 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.4 | -41.5 | 177 | -72.4 | -174.7 | 177.6 | -171.1 | 0 | 111.8 | S52 R53 Q59 L60 | S52-K56 PolarHBondContact O-N 2.96Å; R53-K56 PolarHBondContact O-N 3.35Å; K56-Q59 PolarHBondContact O-N 2.95Å; K56-L60 WeakPolarHBondContact O-CG 3.47Å; K56-L60 PolarHBondContact O-N 3.3Å |
| 57 | Q | 98.6 | Very high | 98.7 | Very high | 101 Ų | 101 | 98.8 Ų | 98.8 | 47% | 0.472 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.3 | -48.2 | 175.9 | -172.5 | 60.3 | 48.4 | 0 | 0 | 111.3 | R53 A54 R55 Q59 L60 D61 | R53-Q57 WeakPolarHBondContact O-CB 3.38Å; R53-Q57 PolarHBondContact O-N 3.21Å; A54-Q57 PolarHBondContact O-N 3.36Å; R55-Q57 VanDerWaalsContact C-N 3.33Å; R55-Q57 PolarHBondContact O-N 2.84Å; Q57-Q59 VanDerWaalsContact C-N 3.29Å; Q57-Q59 PolarHBondContact O-N 3.43Å; Q57-L60 WeakPolarHBondContact O-CB 3.37Å; Q57-L60 PolarHBondContact O-N 2.88Å; Q57-D61 PolarHBondContact NE2-OD1 3.47Å; Q57-D61 PolarHBondContact O-N 3.33Å |
| 58 | R | 98.7 | Very high | 98.7 | Very high | 179 Ų | 179 | 98.2 Ų | 98.2 | 68% | 0.675 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -58.7 | -39.2 | 176.6 | -71.4 | 172.9 | -173.8 | 176.9 | -0.3 | 113 | A54 R55 L60 D61 D62 | A54-R58 WeakPolarHBondContact O-CG 3.47Å; A54-R58 PolarHBondContact O-N 3.43Å; R55-R58 PolarHBondContact O-N 3.21Å; R58-L60 VanDerWaalsContact C-N 3.35Å; R58-D61 PolarHBondContact O-N 2.96Å; R58-D62 VanDerWaalsContact O-CB 3.3Å; R58-D62 WeakPolarHBondContact O-CB 3.41Å; R58-D62 PolarHBondContact O-N 3.45Å |
| 59 | Q | 98.7 | Very high | 98.7 | Very high | 126 Ų | 126 | 98.5 Ų | 98.5 | 59% | 0.589 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.4 | -39.2 | 175.9 | -71.6 | 178.1 | -56.9 | 0 | 0 | 111.8 | R55 K56 Q57 L63 | R55-Q59 WeakPolarHBondContact O-CG 3.4Å; R55-Q59 PolarHBondContact O-N 3.37Å; K56-Q59 PolarHBondContact O-N 2.95Å; Q57-Q59 VanDerWaalsContact C-N 3.29Å; Q57-Q59 PolarHBondContact O-N 3.43Å; Q59-L63 WeakPolarHBondContact O-CB 3.43Å; Q59-L63 VanDerWaalsContact O-CG 3.25Å; Q59-L63 WeakPolarHBondContact O-CG 3.26Å; Q59-L63 PolarHBondContact O-N 3.38Å |
| 60 | L | 98.8 | Very high | 98.7 | Very high | 101 Ų | 101 | 101.7 Ų | 101.7 | 53% | 0.529 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.2 | -47 | 174.3 | -68.5 | 174.1 | 0 | 0 | 0 | 110.9 | K56 Q57 R58 D62 L63 T64 | K56-L60 WeakPolarHBondContact O-CG 3.47Å; K56-L60 PolarHBondContact O-N 3.3Å; Q57-L60 WeakPolarHBondContact O-CB 3.37Å; Q57-L60 PolarHBondContact O-N 2.88Å; R58-L60 VanDerWaalsContact C-N 3.35Å; L60-D62 VanDerWaalsContact C-N 3.34Å; L60-D62 PolarHBondContact O-N 3Å; L60-L63 PolarHBondContact O-N 3.04Å; L60-T64 WeakPolarHBondContact O-CG2 3.41Å; L60-T64 PolarHBondContact O-N 3Å; L60-T64 PolarHBondContact O-OG1 3.38Å |
| 61 | D | 98.7 | Very high | 98.7 | Very high | 79 Ų | 79 | 104.3 Ų | 104.3 | 42% | 0.422 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -58.4 | -46.8 | 178.7 | -59.4 | -23.4 | 0 | 0 | 0 | 110.7 | Q57 R58 T64 A65 | Q57-D61 PolarHBondContact NE2-OD1 3.47Å; Q57-D61 PolarHBondContact O-N 3.33Å; R58-D61 PolarHBondContact O-N 2.96Å; D61-T64 WeakPolarHBondContact CA-OG1 3.32Å; D61-T64 PolarHBondContact O-N 3.5Å; D61-T64 PolarHBondContact O-OG1 3.31Å; D61-A65 PolarHBondContact O-N 2.96Å |
| 62 | D | 98.8 | Very high | 98.7 | Very high | 89 Ų | 89 | 99.3 Ų | 99.3 | 48% | 0.476 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.4 | -46.5 | 176.7 | -177.5 | 60.8 | 0 | 0 | 0 | 112.3 | R58 L60 T64 A65 Q66 | R58-D62 VanDerWaalsContact O-CB 3.3Å; R58-D62 WeakPolarHBondContact O-CB 3.41Å; R58-D62 PolarHBondContact O-N 3.45Å; L60-D62 VanDerWaalsContact C-N 3.34Å; L60-D62 PolarHBondContact O-N 3Å; D62-T64 VanDerWaalsContact C-N 3.32Å; D62-T64 PolarHBondContact O-N 3.14Å; D62-A65 PolarHBondContact O-N 3.45Å; D62-Q66 WeakPolarHBondContact O-CG 3.42Å; D62-Q66 PolarHBondContact O-N 2.67Å; D62-Q66 PolarHBondContact OD2-NE2 3.37Å |
| 63 | L | 98.8 | Very high | 98.7 | Very high | 96 Ų | 96 | 105.2 Ų | 105.2 | 50% | 0.503 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.8 | -40.2 | 175.3 | -75.1 | 170.4 | 0 | 0 | 0 | 111.9 | Q59 L60 Q66 V67 | Q59-L63 WeakPolarHBondContact O-CB 3.43Å; Q59-L63 VanDerWaalsContact O-CG 3.25Å; Q59-L63 WeakPolarHBondContact O-CG 3.26Å; Q59-L63 PolarHBondContact O-N 3.38Å; L60-L63 PolarHBondContact O-N 3.04Å; L63-Q66 PolarHBondContact O-N 3.25Å; L63-V67 WeakPolarHBondContact O-CB 3.46Å; L63-V67 VanDerWaalsContact O-CG2 3.27Å; L63-V67 WeakPolarHBondContact O-CG2 3.44Å; L63-V67 PolarHBondContact O-N 3.02Å |
| 64 | T | 98.8 | Very high | 98.7 | Very high | 94 Ų | 94 | 100.4 Ų | 100.4 | 58% | 0.577 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.2 | -39.8 | 176.3 | 59.9 | 0 | 0 | 0 | 0 | 112.3 | L60 D61 D62 V67 A68 | L60-T64 WeakPolarHBondContact O-CG2 3.41Å; L60-T64 PolarHBondContact O-N 3Å; L60-T64 PolarHBondContact O-OG1 3.38Å; D61-T64 WeakPolarHBondContact CA-OG1 3.32Å; D61-T64 PolarHBondContact O-N 3.5Å; D61-T64 PolarHBondContact O-OG1 3.31Å; D62-T64 VanDerWaalsContact C-N 3.32Å; D62-T64 PolarHBondContact O-N 3.14Å; T64-V67 PolarHBondContact O-N 3.02Å; T64-A68 PolarHBondContact O-N 3.48Å |
| 65 | A | 98.7 | Very high | 98.7 | Very high | 59 Ų | 59 | 100.2 Ų | 100.2 | 49% | 0.488 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.3 | -44.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | D61 D62 V67 A68 A69 | D61-A65 PolarHBondContact O-N 2.96Å; D62-A65 PolarHBondContact O-N 3.45Å; A65-V67 PolarHBondContact O-N 2.89Å; A65-A68 PolarHBondContact O-N 2.85Å; A65-A69 WeakPolarHBondContact O-CB 3.37Å; A65-A69 PolarHBondContact O-N 3.33Å |
| 66 | Q | 98.8 | Very high | 98.7 | Very high | 92 Ų | 92 | 96.6 Ų | 96.6 | 43% | 0.43 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.1 | -45.1 | 175.5 | -72.7 | -175.8 | 56.9 | 0 | 0 | 111.7 | D62 L63 A68 A69 L70 | D62-Q66 WeakPolarHBondContact O-CG 3.42Å; D62-Q66 PolarHBondContact O-N 2.67Å; D62-Q66 PolarHBondContact OD2-NE2 3.37Å; L63-Q66 PolarHBondContact O-N 3.25Å; Q66-A68 VanDerWaalsContact C-N 3.34Å; Q66-A68 PolarHBondContact O-N 3.34Å; Q66-A69 PolarHBondContact O-N 3.05Å; Q66-L70 WeakPolarHBondContact O-CB 3.45Å; Q66-L70 VanDerWaalsContact O-CG 3.31Å; Q66-L70 WeakPolarHBondContact O-CG 3.41Å; Q66-L70 PolarHBondContact O-N 3.39Å |
| 67 | V | 98.8 | Very high | 98.8 | Very high | 58 Ų | 58 | 95.4 Ų | 95.4 | 35% | 0.352 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.5 | -41.5 | 177.1 | 169.4 | 0 | 0 | 0 | 0 | 111.3 | L63 T64 A65 L70 R71 | L63-V67 WeakPolarHBondContact O-CB 3.46Å; L63-V67 VanDerWaalsContact O-CG2 3.27Å; L63-V67 WeakPolarHBondContact O-CG2 3.44Å; L63-V67 PolarHBondContact O-N 3.02Å; T64-V67 PolarHBondContact O-N 3.02Å; A65-V67 PolarHBondContact O-N 2.89Å; V67-L70 PolarHBondContact O-N 2.85Å; V67-R71 WeakPolarHBondContact O-CG 3.41Å; V67-R71 PolarHBondContact O-N 3.47Å |
| 68 | A | 98.7 | Very high | 98.8 | Very high | 57 Ų | 57 | 95.1 Ų | 95.1 | 47% | 0.471 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.9 | -44.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | T64 A65 Q66 R71 A72 | T64-A68 PolarHBondContact O-N 3.48Å; A65-A68 PolarHBondContact O-N 2.85Å; Q66-A68 VanDerWaalsContact C-N 3.34Å; Q66-A68 PolarHBondContact O-N 3.34Å; A68-R71 PolarHBondContact O-N 3.06Å; A68-A72 PolarHBondContact O-N 3.32Å |
| 69 | A | 98.8 | Very high | 98.8 | Very high | 62 Ų | 62 | 89 Ų | 89 | 51% | 0.512 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.7 | -42.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A65 Q66 A72 R73 | A65-A69 WeakPolarHBondContact O-CB 3.37Å; A65-A69 PolarHBondContact O-N 3.33Å; Q66-A69 PolarHBondContact O-N 3.05Å; A69-A72 PolarHBondContact O-N 3.46Å; A69-R73 WeakPolarHBondContact O-CB 3.35Å; A69-R73 PolarHBondContact O-N 2.97Å |
| 70 | L | 98.8 | Very high | 98.8 | Very high | 98 Ų | 98 | 85.9 Ų | 85.9 | 51% | 0.513 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.2 | -41.5 | 176.1 | -73.2 | 172.3 | 0 | 0 | 0 | 111.9 | Q66 V67 R73 N74 | Q66-L70 WeakPolarHBondContact O-CB 3.45Å; Q66-L70 VanDerWaalsContact O-CG 3.31Å; Q66-L70 WeakPolarHBondContact O-CG 3.41Å; Q66-L70 PolarHBondContact O-N 3.39Å; V67-L70 PolarHBondContact O-N 2.85Å; L70-R73 PolarHBondContact O-N 3.38Å; L70-N74 WeakPolarHBondContact O-CB 3.41Å; L70-N74 VanDerWaalsContact O-CG 3.24Å; L70-N74 PolarHBondContact O-N 2.91Å; L70-N74 PolarHBondContact O-OD1 2.74Å |
| 71 | R | 98.8 | Very high | 98.8 | Very high | 178 Ų | 178 | 84 Ų | 84 | 67% | 0.672 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.2 | -44.3 | 174.9 | -75.7 | 178.4 | -179.1 | 136.1 | 3.3 | 112.2 | V67 A68 N74 G75 | V67-R71 WeakPolarHBondContact O-CG 3.41Å; V67-R71 PolarHBondContact O-N 3.47Å; A68-R71 PolarHBondContact O-N 3.06Å; R71-N74 PolarHBondContact O-N 3.24Å; R71-G75 PolarHBondContact O-N 3.49Å |
| 72 | A | 98.8 | Very high | 98.8 | Very high | 68 Ų | 68 | 87.7 Ų | 87.7 | 56% | 0.562 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -62.5 | -43.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | A68 A69 G75 A76 | A68-A72 PolarHBondContact O-N 3.32Å; A69-A72 PolarHBondContact O-N 3.46Å; A72-G75 PolarHBondContact O-N 3.01Å; A72-A76 PolarHBondContact O-N 3.02Å |
| 73 | R | 98.8 | Very high | 98.8 | Very high | 170 Ų | 170 | 85.8 Ų | 85.8 | 64% | 0.642 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -62.6 | -45.3 | 176.7 | -176.1 | 176.2 | 178.9 | 165.4 | 1 | 112.1 | A69 L70 G75 A76 M77 | A69-R73 WeakPolarHBondContact O-CB 3.35Å; A69-R73 PolarHBondContact O-N 2.97Å; L70-R73 PolarHBondContact O-N 3.38Å; R73-G75 VanDerWaalsContact C-N 3.35Å; R73-G75 PolarHBondContact O-N 3.26Å; R73-A76 PolarHBondContact O-N 3.42Å; R73-M77 HydrophobicContact CG-SD 4.17Å; R73-M77 WeakPolarHBondContact O-CG 3.35Å; R73-M77 PolarHBondContact O-N 2.89Å |
| 74 | N | 98.7 | Very high | 98.8 | Very high | 89 Ų | 89 | 83.6 Ų | 83.6 | 48% | 0.476 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61 | -44.9 | 177 | -72.7 | -6.1 | 0 | 0 | 0 | 111 | L70 R71 A76 M77 D78 | L70-N74 WeakPolarHBondContact O-CB 3.41Å; L70-N74 VanDerWaalsContact O-CG 3.24Å; L70-N74 PolarHBondContact O-N 2.91Å; L70-N74 PolarHBondContact O-OD1 2.74Å; R71-N74 PolarHBondContact O-N 3.24Å; N74-A76 VanDerWaalsContact C-N 3.33Å; N74-A76 PolarHBondContact O-N 3.31Å; N74-M77 PolarHBondContact O-N 3.06Å; N74-D78 PolarHBondContact O-N 2.79Å |
| 75 | G | 98.7 | Very high | 98.8 | Very high | 37 Ų | 37 | 81.8 Ų | 81.8 | 38% | 0.381 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -60 | -40 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | R71 A72 R73 D78 A79 | R71-G75 PolarHBondContact O-N 3.49Å; A72-G75 PolarHBondContact O-N 3.01Å; R73-G75 VanDerWaalsContact C-N 3.35Å; R73-G75 PolarHBondContact O-N 3.26Å; G75-D78 PolarHBondContact O-N 3.21Å; G75-A79 PolarHBondContact O-N 3.23Å; G75-A79 VanDerWaalsContact O-N 3.07Å |
| 76 | A | 98.8 | Very high | 98.8 | Very high | 62 Ų | 62 | 86.2 Ų | 86.2 | 51% | 0.512 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.6 | -41.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | A72 R73 N74 A79 A80 | A72-A76 PolarHBondContact O-N 3.02Å; R73-A76 PolarHBondContact O-N 3.42Å; N74-A76 VanDerWaalsContact C-N 3.33Å; N74-A76 PolarHBondContact O-N 3.31Å; A76-A79 PolarHBondContact O-N 3.42Å; A76-A80 PolarHBondContact O-N 3.11Å |
| 77 | M | 98.7 | Very high | 98.8 | Very high | 109 Ų | 109 | 89.7 Ų | 89.7 | 54% | 0.537 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.3 | -42.3 | 175.3 | -73.2 | 179 | 60.3 | 0 | 0 | 111.8 | R73 N74 A79 A80 A81 | R73-M77 HydrophobicContact CG-SD 4.17Å; R73-M77 WeakPolarHBondContact O-CG 3.35Å; R73-M77 PolarHBondContact O-N 2.89Å; N74-M77 PolarHBondContact O-N 3.06Å; M77-A79 VanDerWaalsContact C-N 3.32Å; M77-A79 PolarHBondContact O-N 3.33Å; M77-A80 PolarHBondContact O-N 3.49Å; M77-A81 WeakPolarHBondContact O-CB 3.35Å; M77-A81 PolarHBondContact O-N 2.74Å |
| 78 | D | 98.8 | Very high | 98.8 | Very high | 95 Ų | 95 | 90.5 Ų | 90.5 | 51% | 0.508 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.7 | -35.8 | 176.5 | -71.8 | -21.1 | 0 | 0 | 0 | 112.3 | N74 G75 R82 | N74-D78 PolarHBondContact O-N 2.79Å; G75-D78 PolarHBondContact O-N 3.21Å; D78-R82 WeakPolarHBondContact O-CB 3.47Å; D78-R82 WeakPolarHBondContact O-CG 3.31Å; D78-R82 PolarHBondContact O-N 3.27Å; D78-R82 VanDerWaalsContact O-N 3.12Å; D78-R82 PolarHBondContact O-NE 2.9Å; D78-R82 VanDerWaalsContact O-NE 3.09Å |
| 79 | A | 98.7 | Very high | 98.8 | Very high | 49 Ų | 49 | 92.2 Ų | 92.2 | 41% | 0.405 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.9 | -44.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | G75 A76 M77 R82 D83 | G75-A79 PolarHBondContact O-N 3.23Å; G75-A79 VanDerWaalsContact O-N 3.07Å; A76-A79 PolarHBondContact O-N 3.42Å; M77-A79 VanDerWaalsContact C-N 3.32Å; M77-A79 PolarHBondContact O-N 3.33Å; A79-R82 PolarHBondContact O-N 3.09Å; A79-D83 PolarHBondContact O-N 3.41Å |
| 80 | A | 98.8 | Very high | 98.8 | Very high | 62 Ų | 62 | 92.2 Ų | 92.2 | 51% | 0.512 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.6 | -42.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | A76 M77 R82 D83 A84 | A76-A80 PolarHBondContact O-N 3.11Å; M77-A80 PolarHBondContact O-N 3.49Å; A80-R82 PolarHBondContact O-N 2.91Å; A80-D83 PolarHBondContact O-N 3.49Å; A80-A84 WeakPolarHBondContact O-CB 3.48Å; A80-A84 PolarHBondContact O-N 3.33Å |
| 81 | A | 98.8 | Very high | 98.8 | Very high | 60 Ų | 60 | 91 Ų | 91 | 50% | 0.496 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | M77 A84 A85 | M77-A81 WeakPolarHBondContact O-CB 3.35Å; M77-A81 PolarHBondContact O-N 2.74Å; A81-A84 PolarHBondContact O-N 3.12Å; A81-A85 WeakPolarHBondContact O-CB 3.44Å; A81-A85 PolarHBondContact O-N 3.37Å |
| 82 | R | 98.8 | Very high | 98.8 | Very high | 157 Ų | 157 | 88.7 Ų | 88.7 | 59% | 0.592 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.2 | -39.1 | 175 | -77.5 | -178.8 | -76.3 | -172.1 | -3.6 | 112.4 | D78 A79 A80 A85 R86 | D78-R82 WeakPolarHBondContact O-CB 3.47Å; D78-R82 WeakPolarHBondContact O-CG 3.31Å; D78-R82 PolarHBondContact O-N 3.27Å; D78-R82 VanDerWaalsContact O-N 3.12Å; D78-R82 PolarHBondContact O-NE 2.9Å; D78-R82 VanDerWaalsContact O-NE 3.09Å; A79-R82 PolarHBondContact O-N 3.09Å; A80-R82 PolarHBondContact O-N 2.91Å; R82-A85 PolarHBondContact O-N 2.98Å; R82-R86 WeakPolarHBondContact O-CG 3.48Å; R82-R86 PolarHBondContact O-N 3.38Å; R82-R86 VanDerWaalsContact O-N 3.11Å |
| 83 | D | 98.8 | Very high | 98.8 | Very high | 49 Ų | 49 | 88.4 Ų | 88.4 | 26% | 0.262 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.2 | -45 | 175.5 | -167.2 | 59.5 | 0 | 0 | 0 | 112.2 | A79 A80 A85 R86 R87 | A79-D83 PolarHBondContact O-N 3.41Å; A80-D83 PolarHBondContact O-N 3.49Å; D83-A85 VanDerWaalsContact C-N 3.32Å; D83-A85 PolarHBondContact O-N 3.07Å; D83-R86 PolarHBondContact O-N 3.44Å; D83-R86 IonicContact OD1-CZ 3.63Å; D83-R86 IonicContact OD1-NE 3.77Å; D83-R86 IonicContact OD1-NH2 2.74Å; D83-R86 PolarHBondContact OD1-NH2 3.49Å; D83-R87 WeakPolarHBondContact O-CG 3.34Å; D83-R87 PolarHBondContact O-N 3.49Å; D83-R87 IonicContact OD2-CZ 3.19Å; D83-R87 IonicContact OD2-NE 2.79Å; D83-R87 PolarHBondContact OD2-NE 3.18Å; D83-R87 IonicContact OD2-NH2 2.74Å; D83-R87 PolarHBondContact OD2-NH2 2.91Å |
| 84 | A | 98.8 | Very high | 98.8 | Very high | 50 Ų | 50 | 86 Ų | 86 | 41% | 0.413 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -58.4 | -44.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | A80 A81 R86 R87 C88 | A80-A84 WeakPolarHBondContact O-CB 3.48Å; A80-A84 PolarHBondContact O-N 3.33Å; A81-A84 PolarHBondContact O-N 3.12Å; A84-R86 PolarHBondContact O-N 2.84Å; A84-R87 PolarHBondContact O-N 3.36Å; A84-C88 PolarHBondContact O-N 3.43Å; A84-C88 PolarHBondContact O-SG 2.98Å |
| 85 | A | 98.8 | Very high | 98.8 | Very high | 56 Ų | 56 | 85.4 Ų | 85.4 | 46% | 0.463 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.6 | -43.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | A81 R82 D83 C88 V89 | A81-A85 WeakPolarHBondContact O-CB 3.44Å; A81-A85 PolarHBondContact O-N 3.37Å; R82-A85 PolarHBondContact O-N 2.98Å; D83-A85 VanDerWaalsContact C-N 3.32Å; D83-A85 PolarHBondContact O-N 3.07Å; A85-C88 PolarHBondContact O-N 3.38Å; A85-V89 WeakPolarHBondContact O-CG2 3.25Å; A85-V89 PolarHBondContact O-N 2.99Å |
| 86 | R | 98.8 | Very high | 98.8 | Very high | 153 Ų | 153 | 86.5 Ų | 86.5 | 58% | 0.577 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.4 | -43.8 | 174.9 | -73.1 | -170.7 | -59.2 | -98.5 | 1.2 | 112.3 | R82 D83 A84 C88 V89 A90 | R82-R86 WeakPolarHBondContact O-CG 3.48Å; R82-R86 PolarHBondContact O-N 3.38Å; R82-R86 VanDerWaalsContact O-N 3.11Å; D83-R86 PolarHBondContact O-N 3.44Å; D83-R86 IonicContact OD1-CZ 3.63Å; D83-R86 IonicContact OD1-NE 3.77Å; D83-R86 IonicContact OD1-NH2 2.74Å; D83-R86 PolarHBondContact OD1-NH2 3.49Å; A84-R86 PolarHBondContact O-N 2.84Å; R86-C88 VanDerWaalsContact C-N 3.35Å; R86-V89 PolarHBondContact O-N 3.26Å; R86-A90 PolarHBondContact O-N 2.99Å |
| 87 | R | 98.8 | Very high | 98.8 | Very high | 165 Ų | 165 | 90.4 Ų | 90.4 | 62% | 0.623 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.2 | -41.7 | 177.1 | -66.6 | 176.9 | -164.9 | -130.1 | 4.2 | 111.5 | D83 A84 V89 A90 V91 | D83-R87 WeakPolarHBondContact O-CG 3.34Å; D83-R87 PolarHBondContact O-N 3.49Å; D83-R87 IonicContact OD2-CZ 3.19Å; D83-R87 IonicContact OD2-NE 2.79Å; D83-R87 PolarHBondContact OD2-NE 3.18Å; D83-R87 IonicContact OD2-NH2 2.74Å; D83-R87 PolarHBondContact OD2-NH2 2.91Å; A84-R87 PolarHBondContact O-N 3.36Å; R87-V89 VanDerWaalsContact C-N 3.35Å; R87-V89 PolarHBondContact O-N 2.88Å; R87-A90 PolarHBondContact O-N 3.33Å; R87-V91 WeakPolarHBondContact O-CG2 3.27Å; R87-V91 PolarHBondContact O-N 2.96Å |
| 88 | C | 98.8 | Very high | 98.8 | Very high | 75 Ų | 75 | 89.6 Ų | 89.6 | 51% | 0.507 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.7 | -44.3 | 175.8 | -71.8 | 0 | 0 | 0 | 0 | 111.8 | A84 A85 R86 A90 V91 Q92 | A84-C88 PolarHBondContact O-N 3.43Å; A84-C88 PolarHBondContact O-SG 2.98Å; A85-C88 PolarHBondContact O-N 3.38Å; R86-C88 VanDerWaalsContact C-N 3.35Å; C88-A90 PolarHBondContact O-N 2.87Å; C88-V91 PolarHBondContact O-N 3.45Å; C88-Q92 WeakPolarHBondContact O-CB 3.39Å; C88-Q92 VanDerWaalsContact O-CG 3.26Å; C88-Q92 WeakPolarHBondContact O-CG 3.41Å; C88-Q92 PolarHBondContact O-N 3.49Å |
| 89 | V | 98.8 | Very high | 98.8 | Very high | 93 Ų | 93 | 91.1 Ų | 91.1 | 56% | 0.564 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.4 | -42.3 | 176.3 | 172 | 0 | 0 | 0 | 0 | 111.4 | A85 R86 R87 Q92 A93 | A85-V89 WeakPolarHBondContact O-CG2 3.25Å; A85-V89 PolarHBondContact O-N 2.99Å; R86-V89 PolarHBondContact O-N 3.26Å; R87-V89 VanDerWaalsContact C-N 3.35Å; R87-V89 PolarHBondContact O-N 2.88Å; V89-Q92 PolarHBondContact O-N 2.92Å; V89-A93 PolarHBondContact O-N 2.92Å |
| 90 | A | 98.7 | Very high | 98.8 | Very high | 61 Ų | 61 | 91.8 Ų | 91.8 | 50% | 0.504 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.5 | -46.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | R86 R87 C88 Q92 A93 E94 | R86-A90 PolarHBondContact O-N 2.99Å; R87-A90 PolarHBondContact O-N 3.33Å; C88-A90 PolarHBondContact O-N 2.87Å; A90-Q92 VanDerWaalsContact C-N 3.34Å; A90-Q92 PolarHBondContact O-N 3.36Å; A90-A93 PolarHBondContact O-N 3.3Å; A90-E94 PolarHBondContact O-N 3.48Å |
| 91 | V | 98.8 | Very high | 98.8 | Very high | 74 Ų | 74 | 94.5 Ų | 94.5 | 45% | 0.448 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.7 | -37.8 | 177 | 171.6 | 0 | 0 | 0 | 0 | 111.6 | R87 C88 A93 E94 N95 | R87-V91 WeakPolarHBondContact O-CG2 3.27Å; R87-V91 PolarHBondContact O-N 2.96Å; C88-V91 PolarHBondContact O-N 3.45Å; V91-A93 VanDerWaalsContact C-N 3.34Å; V91-A93 PolarHBondContact O-N 3.26Å; V91-E94 PolarHBondContact O-N 3Å; V91-N95 WeakPolarHBondContact O-CB 3.45Å; V91-N95 VanDerWaalsContact O-CG 3.32Å; V91-N95 PolarHBondContact O-N 2.88Å; V91-N95 PolarHBondContact O-ND2 2.7Å |
| 92 | Q | 98.8 | Very high | 98.8 | Very high | 128 Ų | 128 | 95.2 Ų | 95.2 | 60% | 0.598 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.8 | -40.8 | 174.7 | -76.5 | 172.3 | -13.7 | 0 | 0 | 112.1 | C88 V89 A90 N95 A96 | C88-Q92 WeakPolarHBondContact O-CB 3.39Å; C88-Q92 VanDerWaalsContact O-CG 3.26Å; C88-Q92 WeakPolarHBondContact O-CG 3.41Å; C88-Q92 PolarHBondContact O-N 3.49Å; V89-Q92 PolarHBondContact O-N 2.92Å; A90-Q92 VanDerWaalsContact C-N 3.34Å; A90-Q92 PolarHBondContact O-N 3.36Å; Q92-N95 PolarHBondContact O-N 3.46Å; Q92-A96 WeakPolarHBondContact O-CB 3.5Å; Q92-A96 PolarHBondContact O-N 3.37Å |
| 93 | A | 98.8 | Very high | 98.8 | Very high | 63 Ų | 63 | 92.6 Ų | 92.6 | 52% | 0.521 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65 | -42.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | V89 A90 V91 A96 M97 | V89-A93 PolarHBondContact O-N 2.92Å; A90-A93 PolarHBondContact O-N 3.3Å; V91-A93 VanDerWaalsContact C-N 3.34Å; V91-A93 PolarHBondContact O-N 3.26Å; A93-A96 PolarHBondContact O-N 2.79Å; A93-M97 PolarHBondContact O-N 3.2Å |
| 94 | E | 98.8 | Very high | 98.8 | Very high | 119 Ų | 119 | 93.5 Ų | 93.5 | 56% | 0.556 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.4 | -45.7 | 175 | -173.9 | 176.3 | -175.5 | 0 | 0 | 111.6 | A90 V91 A96 M97 L98 | A90-E94 PolarHBondContact O-N 3.48Å; V91-E94 PolarHBondContact O-N 3Å; E94-A96 VanDerWaalsContact C-N 3.31Å; E94-A96 PolarHBondContact O-N 2.86Å; E94-M97 WeakPolarHBondContact O-CB 3.3Å; E94-M97 PolarHBondContact O-N 2.95Å; E94-M97 VanDerWaalsContact O-N 3.14Å; E94-L98 HydrophobicContact CG-CD1 4.28Å; E94-L98 WeakPolarHBondContact O-CG 3.42Å; E94-L98 PolarHBondContact O-N 3.44Å |
| 95 | N | 98.8 | Very high | 98.8 | Very high | 77 Ų | 77 | 94.7 Ų | 94.7 | 41% | 0.412 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59.9 | -40.9 | 175.4 | -76 | -25 | 0 | 0 | 0 | 112 | V91 Q92 M97 L98 H99 | V91-N95 WeakPolarHBondContact O-CB 3.45Å; V91-N95 VanDerWaalsContact O-CG 3.32Å; V91-N95 PolarHBondContact O-N 2.88Å; V91-N95 PolarHBondContact O-ND2 2.7Å; Q92-N95 PolarHBondContact O-N 3.46Å; N95-M97 VanDerWaalsContact C-N 3.33Å; N95-M97 PolarHBondContact O-N 3.38Å; N95-L98 PolarHBondContact O-N 3.43Å; N95-H99 WeakPolarHBondContact O-CB 3.35Å; N95-H99 PolarHBondContact O-CD2 2.96Å; N95-H99 PolarHBondContact O-N 3.26Å |
| 96 | A | 98.8 | Very high | 98.8 | Very high | 60 Ų | 60 | 95.5 Ų | 95.5 | 50% | 0.496 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.5 | -41.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q92 A93 E94 H99 A100 | Q92-A96 WeakPolarHBondContact O-CB 3.5Å; Q92-A96 PolarHBondContact O-N 3.37Å; A93-A96 PolarHBondContact O-N 2.79Å; E94-A96 VanDerWaalsContact C-N 3.31Å; E94-A96 PolarHBondContact O-N 2.86Å; A96-H99 PolarHBondContact O-N 3.44Å; A96-A100 WeakPolarHBondContact O-CB 3.33Å; A96-A100 PolarHBondContact O-N 2.98Å |
| 97 | M | 98.7 | Very high | 98.7 | Very high | 144 Ų | 144 | 91.1 Ų | 91.1 | 71% | 0.709 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -64.4 | -44.9 | 174.8 | 178.6 | -178.4 | 155.9 | 0 | 0 | 111.8 | A93 E94 N95 A100 R101 | A93-M97 PolarHBondContact O-N 3.2Å; E94-M97 WeakPolarHBondContact O-CB 3.3Å; E94-M97 PolarHBondContact O-N 2.95Å; E94-M97 VanDerWaalsContact O-N 3.14Å; N95-M97 VanDerWaalsContact C-N 3.33Å; N95-M97 PolarHBondContact O-N 3.38Å; M97-A100 PolarHBondContact O-N 3.25Å; M97-R101 PolarHBondContact O-N 2.87Å |
| 98 | L | 98.8 | Very high | 98.7 | Very high | 91 Ų | 91 | 90 Ų | 90 | 48% | 0.476 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.1 | -44.8 | 176.3 | -70.7 | 174.1 | 0 | 0 | 0 | 110.9 | E94 N95 A100 R101 T102 | E94-L98 HydrophobicContact CG-CD1 4.28Å; E94-L98 WeakPolarHBondContact O-CG 3.42Å; E94-L98 PolarHBondContact O-N 3.44Å; N95-L98 PolarHBondContact O-N 3.43Å; L98-A100 PolarHBondContact O-N 2.87Å; L98-R101 PolarHBondContact O-N 2.92Å; L98-T102 WeakPolarHBondContact O-CG2 3.48Å; L98-T102 PolarHBondContact O-N 3.31Å; L98-T102 PolarHBondContact O-OG1 3.01Å |
| 99 | H | 98.8 | Very high | 98.7 | Very high | 127 Ų | 127 | 91.9 Ų | 91.9 | 59% | 0.588 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -59 | -46.6 | 174.8 | -80.5 | -57.5 | 0 | 0 | 0 | 112.1 | N95 A96 R101 T102 V103 | N95-H99 WeakPolarHBondContact O-CB 3.35Å; N95-H99 PolarHBondContact O-CD2 2.96Å; N95-H99 PolarHBondContact O-N 3.26Å; A96-H99 PolarHBondContact O-N 3.44Å; H99-R101 VanDerWaalsContact C-N 3.29Å; H99-R101 PolarHBondContact O-N 2.73Å; H99-T102 WeakPolarHBondContact CA-OG1 3.42Å; H99-T102 PolarHBondContact O-N 3.47Å; H99-T102 PolarHBondContact O-OG1 3.28Å; H99-V103 WeakPolarHBondContact O-CG2 3.43Å; H99-V103 PolarHBondContact O-N 3.03Å |
| 100 | A | 98.7 | Very high | 98.7 | Very high | 63 Ų | 63 | 92.3 Ų | 92.3 | 52% | 0.521 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58.9 | -42.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | A96 M97 L98 V103 E104 | A96-A100 WeakPolarHBondContact O-CB 3.33Å; A96-A100 PolarHBondContact O-N 2.98Å; M97-A100 PolarHBondContact O-N 3.25Å; L98-A100 PolarHBondContact O-N 2.87Å; A100-V103 PolarHBondContact O-N 3.42Å; A100-E104 PolarHBondContact O-N 3.21Å |
| 101 | R | 98.6 | Very high | 98.7 | Very high | 120 Ų | 120 | 93 Ų | 93 | 45% | 0.453 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.3 | -38.8 | 177.4 | -174.3 | 55.8 | 172.6 | -166.5 | -1.7 | 112.5 | M97 L98 H99 V103 E104 L105 | M97-R101 PolarHBondContact O-N 2.87Å; L98-R101 PolarHBondContact O-N 2.92Å; H99-R101 VanDerWaalsContact C-N 3.29Å; H99-R101 PolarHBondContact O-N 2.73Å; R101-V103 VanDerWaalsContact C-N 3.34Å; R101-E104 VanDerWaalsContact CD-OE2 3.28Å; R101-E104 WeakPolarHBondContact CD-OE2 3.18Å; R101-E104 IonicContact CZ-OE2 3.63Å; R101-E104 IonicContact NE-OE2 3.84Å; R101-E104 VanDerWaalsContact NH1-CD 3.29Å; R101-E104 IonicContact NH1-OE1 3.23Å; R101-E104 PolarHBondContact NH1-OE1 3.31Å; R101-E104 IonicContact NH1-OE2 2.73Å; R101-E104 PolarHBondContact NH1-OE2 3.06Å; R101-E104 PolarHBondContact O-N 3.03Å; R101-L105 HydrophobicContact CG-CD1 4.02Å; R101-L105 HydrophobicContact CG-CG 4.38Å; R101-L105 WeakPolarHBondContact O-CB 3.28Å; R101-L105 VanDerWaalsContact O-CG 3.32Å; R101-L105 WeakPolarHBondContact O-CG 3.46Å; R101-L105 PolarHBondContact O-N 3.46Å |
| 102 | T | 98.8 | Very high | 98.7 | Very high | 75 Ų | 75 | 94.2 Ų | 94.2 | 46% | 0.46 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.4 | -43.4 | 175 | 55.6 | 0 | 0 | 0 | 0 | 111.3 | L98 H99 E104 L105 S106 | L98-T102 WeakPolarHBondContact O-CG2 3.48Å; L98-T102 PolarHBondContact O-N 3.31Å; L98-T102 PolarHBondContact O-OG1 3.01Å; H99-T102 WeakPolarHBondContact CA-OG1 3.42Å; H99-T102 PolarHBondContact O-N 3.47Å; H99-T102 PolarHBondContact O-OG1 3.28Å; T102-E104 PolarHBondContact O-N 2.87Å; T102-L105 PolarHBondContact O-N 3.35Å; T102-S106 VanDerWaalsContact O-CB 3.32Å; T102-S106 WeakPolarHBondContact O-CB 3.31Å; T102-S106 PolarHBondContact O-N 2.89Å; T102-S106 PolarHBondContact O-OG 2.87Å |
| 103 | V | 98.8 | Very high | 98.6 | Very high | 101 Ų | 101 | 91.1 Ų | 91.1 | 61% | 0.612 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.7 | -45.7 | 177.8 | 170.7 | 0 | 0 | 0 | 0 | 110.9 | H99 A100 R101 S106 A107 | H99-V103 WeakPolarHBondContact O-CG2 3.43Å; H99-V103 PolarHBondContact O-N 3.03Å; A100-V103 PolarHBondContact O-N 3.42Å; R101-V103 VanDerWaalsContact C-N 3.34Å; V103-S106 PolarHBondContact O-N 3.04Å; V103-A107 WeakPolarHBondContact O-CB 3.4Å; V103-A107 PolarHBondContact O-N 3.46Å |
| 104 | E | 98.7 | Very high | 98.6 | Very high | 68 Ų | 68 | 91.4 Ų | 91.4 | 32% | 0.318 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.5 | -49.5 | 177.2 | -175.8 | -163.9 | 171.9 | 0 | 0 | 111.9 | A100 R101 T102 A107 R108 | A100-E104 PolarHBondContact O-N 3.21Å; R101-E104 VanDerWaalsContact CD-OE2 3.28Å; R101-E104 WeakPolarHBondContact CD-OE2 3.18Å; R101-E104 IonicContact CZ-OE2 3.63Å; R101-E104 IonicContact NE-OE2 3.84Å; R101-E104 VanDerWaalsContact NH1-CD 3.29Å; R101-E104 IonicContact NH1-OE1 3.23Å; R101-E104 PolarHBondContact NH1-OE1 3.31Å; R101-E104 IonicContact NH1-OE2 2.73Å; R101-E104 PolarHBondContact NH1-OE2 3.06Å; R101-E104 PolarHBondContact O-N 3.03Å; T102-E104 PolarHBondContact O-N 2.87Å; E104-A107 PolarHBondContact O-N 3.45Å; E104-R108 WeakPolarHBondContact O-CG 3.34Å; E104-R108 PolarHBondContact O-N 3.29Å; E104-R108 IonicContact OE1-CZ 3.18Å; E104-R108 IonicContact OE1-NE 3.22Å; E104-R108 PolarHBondContact OE1-NE 2.96Å; E104-R108 IonicContact OE1-NH2 2.62Å; E104-R108 PolarHBondContact OE1-NH2 3.49Å |
| 105 | L | 98.7 | Very high | 98.5 | Very high | 75 Ų | 75 | 90.5 Ų | 90.5 | 39% | 0.393 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.7 | -39.6 | -178.8 | -69.5 | 176.2 | 0 | 0 | 0 | 111.9 | R101 T102 A107 R108 L109 | R101-L105 HydrophobicContact CG-CD1 4.02Å; R101-L105 HydrophobicContact CG-CG 4.38Å; R101-L105 WeakPolarHBondContact O-CB 3.28Å; R101-L105 VanDerWaalsContact O-CG 3.32Å; R101-L105 WeakPolarHBondContact O-CG 3.46Å; R101-L105 PolarHBondContact O-N 3.46Å; T102-L105 PolarHBondContact O-N 3.35Å; L105-A107 VanDerWaalsContact C-N 3.35Å; L105-R108 PolarHBondContact O-N 3.35Å; L105-L109 WeakPolarHBondContact O-CG 3.4Å; L105-L109 PolarHBondContact O-N 2.94Å |
| 106 | S | 98.7 | Very high | 98.4 | Very high | 74 Ų | 74 | 90.7 Ų | 90.7 | 52% | 0.517 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61 | -42.6 | 173.9 | -68.8 | 0 | 0 | 0 | 0 | 111.9 | T102 V103 L109 Q110 | T102-S106 VanDerWaalsContact O-CB 3.32Å; T102-S106 WeakPolarHBondContact O-CB 3.31Å; T102-S106 PolarHBondContact O-N 2.89Å; T102-S106 PolarHBondContact O-OG 2.87Å; V103-S106 PolarHBondContact O-N 3.04Å; S106-L109 PolarHBondContact O-N 2.88Å; S106-Q110 PolarHBondContact O-N 3.45Å |
| 107 | A | 98.6 | Very high | 98.3 | Very high | 61 Ų | 61 | 93 Ų | 93 | 50% | 0.504 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.4 | -41.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | V103 E104 L105 Q110 S111 | V103-A107 WeakPolarHBondContact O-CB 3.4Å; V103-A107 PolarHBondContact O-N 3.46Å; E104-A107 PolarHBondContact O-N 3.45Å; L105-A107 VanDerWaalsContact C-N 3.35Å; A107-Q110 PolarHBondContact O-N 3.43Å; A107-S111 PolarHBondContact O-N 2.85Å |
| 108 | R | 98.4 | Very high | 98.1 | Very high | 142 Ų | 142 | 90.4 Ų | 90.4 | 54% | 0.536 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.4 | -43.8 | 174.8 | -71.3 | 173.1 | -176.9 | -136 | 1.6 | 111.7 | E104 L105 S111 L112 | E104-R108 WeakPolarHBondContact O-CG 3.34Å; E104-R108 PolarHBondContact O-N 3.29Å; E104-R108 IonicContact OE1-CZ 3.18Å; E104-R108 IonicContact OE1-NE 3.22Å; E104-R108 PolarHBondContact OE1-NE 2.96Å; E104-R108 IonicContact OE1-NH2 2.62Å; E104-R108 PolarHBondContact OE1-NH2 3.49Å; L105-R108 PolarHBondContact O-N 3.35Å; R108-S111 PolarHBondContact O-N 2.84Å; R108-L112 WeakPolarHBondContact O-CG 3.45Å; R108-L112 PolarHBondContact O-N 3.28Å; R108-L112 VanDerWaalsContact O-N 3.09Å |
| 109 | L | 98.7 | Very high | 97.9 | Very high | 114 Ų | 114 | 91 Ų | 91 | 60% | 0.597 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.2 | -44.3 | 176 | -75.4 | 173.5 | 0 | 0 | 0 | 111.5 | L105 S106 S111 L112 V113 | L105-L109 WeakPolarHBondContact O-CG 3.4Å; L105-L109 PolarHBondContact O-N 2.94Å; S106-L109 PolarHBondContact O-N 2.88Å; L109-S111 VanDerWaalsContact C-N 3.34Å; L109-S111 PolarHBondContact O-N 2.97Å; L109-L112 PolarHBondContact O-N 3.5Å; L109-V113 WeakPolarHBondContact O-CG2 3.25Å; L109-V113 PolarHBondContact O-N 3.41Å |
| 110 | Q | 98.5 | Very high | 97.6 | Very high | 101 Ų | 101 | 90.8 Ų | 90.8 | 47% | 0.472 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.5 | -44.8 | 177.1 | -171.8 | 60.2 | 45.7 | 0 | 0 | 111.5 | S106 A107 L112 V113 D114 | S106-Q110 PolarHBondContact O-N 3.45Å; A107-Q110 PolarHBondContact O-N 3.43Å; Q110-L112 VanDerWaalsContact C-N 3.28Å; Q110-L112 PolarHBondContact O-N 2.83Å; Q110-V113 WeakPolarHBondContact O-CB 3.27Å; Q110-V113 PolarHBondContact O-N 3.4Å; Q110-V113 VanDerWaalsContact O-N 3.1Å; Q110-D114 PolarHBondContact NE2-OD1 2.86Å; Q110-D114 PolarHBondContact O-N 3.3Å |
| 111 | S | 98.4 | Very high | 97.3 | Very high | 76 Ų | 76 | 90.4 Ų | 90.4 | 53% | 0.531 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.4 | -37.8 | 176.4 | 175.7 | 0 | 0 | 0 | 0 | 112.9 | A107 R108 L109 L115 | A107-S111 PolarHBondContact O-N 2.85Å; R108-S111 PolarHBondContact O-N 2.84Å; L109-S111 VanDerWaalsContact C-N 3.34Å; L109-S111 PolarHBondContact O-N 2.97Å; S111-L115 WeakPolarHBondContact O-CB 3.4Å; S111-L115 PolarHBondContact O-N 3.34Å |
| 112 | L | 98.4 | Very high | 96.8 | Very high | 99 Ų | 99 | 85.9 Ų | 85.9 | 52% | 0.518 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -69.3 | -39.1 | 174.9 | -68.9 | 173.9 | 0 | 0 | 0 | 112 | R108 L109 Q110 L115 I116 | R108-L112 WeakPolarHBondContact O-CG 3.45Å; R108-L112 PolarHBondContact O-N 3.28Å; R108-L112 VanDerWaalsContact O-N 3.09Å; L109-L112 PolarHBondContact O-N 3.5Å; Q110-L112 VanDerWaalsContact C-N 3.28Å; Q110-L112 PolarHBondContact O-N 2.83Å; L112-L115 PolarHBondContact O-N 3.25Å; L112-I116 VanDerWaalsContact O-CG1 3.29Å; L112-I116 WeakPolarHBondContact O-CG1 3.35Å; L112-I116 PolarHBondContact O-N 3.13Å |
| 113 | V | 98.1 | Very high | 96.2 | Very high | 63 Ų | 63 | 87 Ų | 87 | 38% | 0.382 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62 | -46 | 174.6 | 169.5 | 0 | 0 | 0 | 0 | 110.6 | L109 Q110 L115 I116 Q117 | L109-V113 WeakPolarHBondContact O-CG2 3.25Å; L109-V113 PolarHBondContact O-N 3.41Å; Q110-V113 WeakPolarHBondContact O-CB 3.27Å; Q110-V113 PolarHBondContact O-N 3.4Å; Q110-V113 VanDerWaalsContact O-N 3.1Å; V113-L115 VanDerWaalsContact C-N 3.34Å; V113-L115 PolarHBondContact O-N 3.2Å; V113-I116 PolarHBondContact O-N 3.07Å; V113-Q117 WeakPolarHBondContact O-CG 3.37Å; V113-Q117 PolarHBondContact O-N 2.94Å |
| 114 | D | 97.6 | Very high | 95.5 | Very high | 69 Ų | 69 | 84 Ų | 84 | 37% | 0.369 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.4 | -42.1 | 178.3 | -62 | -18.3 | 0 | 0 | 0 | 110.9 | Q110 I116 Q117 C118 | Q110-D114 PolarHBondContact NE2-OD1 2.86Å; Q110-D114 PolarHBondContact O-N 3.3Å; D114-I116 VanDerWaalsContact C-N 3.35Å; D114-I116 PolarHBondContact O-N 3.25Å; D114-Q117 PolarHBondContact O-N 3.5Å; D114-C118 PolarHBondContact O-N 3.02Å; D114-C118 PolarHBondContact O-SG 3.11Å; D114-C118 VanDerWaalsContact O-SG 3.34Å |
| 115 | L | 97 | Very high | 94.6 | Very high | 100 Ų | 100 | 87 Ų | 87 | 52% | 0.524 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.5 | -44.5 | 175.2 | -173.7 | 77.2 | 0 | 0 | 0 | 111.7 | S111 L112 V113 Q117 C118 M119 | S111-L115 WeakPolarHBondContact O-CB 3.4Å; S111-L115 PolarHBondContact O-N 3.34Å; L112-L115 PolarHBondContact O-N 3.25Å; V113-L115 VanDerWaalsContact C-N 3.34Å; V113-L115 PolarHBondContact O-N 3.2Å; L115-Q117 VanDerWaalsContact C-N 3.34Å; L115-C118 PolarHBondContact O-N 3.32Å; L115-M119 HydrophobicContact CG-CE 4.37Å; L115-M119 WeakPolarHBondContact O-CG 3.45Å; L115-M119 PolarHBondContact O-N 2.85Å |
| 116 | I | 96.7 | Very high | 93.6 | Very high | 81 Ų | 81 | 91.1 Ų | 91.1 | 42% | 0.415 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62 | -43.8 | 177.5 | -69.2 | 164.7 | 0 | 0 | 0 | 110.7 | L112 V113 D114 M119 Q120 | L112-I116 VanDerWaalsContact O-CG1 3.29Å; L112-I116 WeakPolarHBondContact O-CG1 3.35Å; L112-I116 PolarHBondContact O-N 3.13Å; V113-I116 PolarHBondContact O-N 3.07Å; D114-I116 VanDerWaalsContact C-N 3.35Å; D114-I116 PolarHBondContact O-N 3.25Å; I116-M119 HydrophobicContact CB-CE 4.47Å; I116-M119 HydrophobicContact CG1-CE 4.08Å; I116-M119 PolarHBondContact O-N 2.91Å; I116-Q120 HydrophobicContact CG2-CG 4.46Å; I116-Q120 WeakPolarHBondContact O-CG 3.14Å; I116-Q120 PolarHBondContact O-N 2.98Å |
| 117 | Q | 96 | Very high | 92.6 | Very high | 109 Ų | 109 | 94.3 Ų | 94.3 | 51% | 0.509 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.4 | -41.6 | 177.4 | -69.6 | 174.2 | 12.3 | 0 | 0 | 111.8 | V113 D114 L115 M119 Q120 A121 | V113-Q117 WeakPolarHBondContact O-CG 3.37Å; V113-Q117 PolarHBondContact O-N 2.94Å; D114-Q117 PolarHBondContact O-N 3.5Å; L115-Q117 VanDerWaalsContact C-N 3.34Å; Q117-M119 PolarHBondContact O-N 3.42Å; Q117-Q120 PolarHBondContact O-N 2.91Å; Q117-A121 WeakPolarHBondContact O-CB 3.32Å; Q117-A121 PolarHBondContact O-N 3.42Å |
| 118 | C | 95 | Very high | 91.5 | Very high | 90 Ų | 90 | 100 Ų | 100 | 61% | 0.608 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.2 | -42.7 | 174.5 | -71.7 | 0 | 0 | 0 | 0 | 112.3 | D114 L115 A121 G122 | D114-C118 PolarHBondContact O-N 3.02Å; D114-C118 PolarHBondContact O-SG 3.11Å; D114-C118 VanDerWaalsContact O-SG 3.34Å; L115-C118 PolarHBondContact O-N 3.32Å; C118-A121 PolarHBondContact O-N 3.41Å; C118-G122 PolarHBondContact O-N 3.45Å |
| 119 | M | 94.4 | Very high | 90.3 | Very high | 103 Ų | 103 | 100.3 Ų | 100.3 | 51% | 0.507 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.5 | -44.6 | 176.5 | -70.3 | -174.1 | -62 | 0 | 0 | 111.7 | L115 I116 Q117 A121 G122 D123 | L115-M119 HydrophobicContact CG-CE 4.37Å; L115-M119 WeakPolarHBondContact O-CG 3.45Å; L115-M119 PolarHBondContact O-N 2.85Å; I116-M119 HydrophobicContact CB-CE 4.47Å; I116-M119 HydrophobicContact CG1-CE 4.08Å; I116-M119 PolarHBondContact O-N 2.91Å; Q117-M119 PolarHBondContact O-N 3.42Å; M119-A121 VanDerWaalsContact C-N 3.34Å; M119-A121 PolarHBondContact O-N 2.93Å; M119-G122 PolarHBondContact O-N 3.02Å; M119-G122 VanDerWaalsContact O-N 3.17Å; M119-D123 PolarHBondContact O-N 3.07Å |
| 120 | Q | 93.4 | Very high | 88.7 | Confident | 123 Ų | 123 | 102.6 Ų | 102.6 | 58% | 0.575 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.2 | -38.5 | 177.7 | -72.1 | 173.7 | -11.4 | 0 | 0 | 112.7 | I116 Q117 D123 A124 | I116-Q120 HydrophobicContact CG2-CG 4.46Å; I116-Q120 WeakPolarHBondContact O-CG 3.14Å; I116-Q120 PolarHBondContact O-N 2.98Å; Q117-Q120 PolarHBondContact O-N 2.91Å; Q120-D123 PolarHBondContact O-N 2.93Å; Q120-A124 PolarHBondContact O-N 3.41Å |
| 121 | A | 91.3 | Very high | 86.9 | Confident | 55 Ų | 55 | 103.2 Ų | 103.2 | 46% | 0.455 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.5 | -39.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q117 C118 M119 A124 M125 | Q117-A121 WeakPolarHBondContact O-CB 3.32Å; Q117-A121 PolarHBondContact O-N 3.42Å; C118-A121 PolarHBondContact O-N 3.41Å; M119-A121 VanDerWaalsContact C-N 3.34Å; M119-A121 PolarHBondContact O-N 2.93Å; A121-A124 PolarHBondContact O-N 3.32Å; A121-M125 WeakPolarHBondContact O-CG 3.45Å; A121-M125 PolarHBondContact O-N 2.97Å |
| 122 | G | 88.9 | Confident | 85 | Confident | 24 Ų | 24 | 104.7 Ų | 104.7 | 25% | 0.247 | 54% | 0.54 | C | S | . | . | H | α-helix | trans | -59 | -50.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | C118 M119 A124 M125 Y126 | C118-G122 PolarHBondContact O-N 3.45Å; M119-G122 PolarHBondContact O-N 3.02Å; M119-G122 VanDerWaalsContact O-N 3.17Å; G122-A124 VanDerWaalsContact C-N 3.32Å; G122-A124 PolarHBondContact O-N 3.46Å; G122-M125 PolarHBondContact O-N 3.2Å; G122-M125 VanDerWaalsContact O-N 3.13Å; G122-Y126 WeakPolarHBondContact O-CD2 3.5Å; G122-Y126 PolarHBondContact O-N 2.89Å |
| 123 | D | 86.9 | Confident | 83.2 | Confident | 100 Ų | 100 | 108.3 Ų | 108.3 | 54% | 0.535 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -58.6 | -42.8 | 177.4 | -77.9 | -12 | 0 | 0 | 0 | 112.1 | M119 Q120 Y126 Q127 | M119-D123 PolarHBondContact O-N 3.07Å; Q120-D123 PolarHBondContact O-N 2.93Å; D123-Y126 PolarHBondContact O-N 3.47Å; D123-Q127 VanDerWaalsContact O-CG 3.32Å; D123-Q127 WeakPolarHBondContact O-CG 3.41Å; D123-Q127 PolarHBondContact O-N 2.94Å |
| 124 | A | 83.9 | Confident | 81.4 | Confident | 37 Ų | 37 | 111 Ų | 111 | 31% | 0.306 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -61.4 | -44.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q120 A121 G122 Q127 Y128 | Q120-A124 PolarHBondContact O-N 3.41Å; A121-A124 PolarHBondContact O-N 3.32Å; G122-A124 VanDerWaalsContact C-N 3.32Å; G122-A124 PolarHBondContact O-N 3.46Å; A124-Q127 WeakPolarHBondContact O-CB 3.29Å; A124-Q127 PolarHBondContact O-N 2.93Å; A124-Y128 WeakPolarHBondContact O-CD2 3.42Å; A124-Y128 PolarHBondContact O-N 2.9Å |
| 125 | M | 79.5 | Confident | 79.4 | Confident | 132 Ų | 132 | 112.4 Ų | 112.4 | 65% | 0.65 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -62.7 | -41.8 | 176.5 | -74.1 | -173.1 | 70.3 | 0 | 0 | 112.6 | A121 G122 Q127 Y128 Q129 | A121-M125 WeakPolarHBondContact O-CG 3.45Å; A121-M125 PolarHBondContact O-N 2.97Å; G122-M125 PolarHBondContact O-N 3.2Å; G122-M125 VanDerWaalsContact O-N 3.13Å; M125-Q127 VanDerWaalsContact C-N 3.29Å; M125-Q127 PolarHBondContact O-N 2.67Å; M125-Y128 PolarHBondContact O-N 3.29Å; M125-Q129 PolarHBondContact O-N 3.44Å; M125-Q129 VanDerWaalsContact O-N 3.13Å |
| 126 | Y | 78.2 | Confident | 77.5 | Confident | 160 Ų | 160 | 111.6 Ų | 111.6 | 63% | 0.627 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -61.9 | -38 | 174.2 | -76.9 | -66.4 | 0 | 0 | 0 | 111.7 | G122 D123 Q129 Q130 | G122-Y126 WeakPolarHBondContact O-CD2 3.5Å; G122-Y126 PolarHBondContact O-N 2.89Å; D123-Y126 PolarHBondContact O-N 3.47Å; Y126-Q129 PolarHBondContact O-N 2.91Å; Y126-Q130 VanDerWaalsContact O-CG 3.27Å; Y126-Q130 WeakPolarHBondContact O-CG 3.48Å; Y126-Q130 PolarHBondContact O-N 2.89Å |
| 127 | Q | 76.7 | Confident | 75.5 | Confident | 141 Ų | 141 | 112.2 Ų | 112.2 | 66% | 0.659 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -65.2 | -38.9 | 175.1 | -70.9 | 172.3 | 13.5 | 0 | 0 | 112.7 | D123 A124 M125 Q129 Q130 | D123-Q127 VanDerWaalsContact O-CG 3.32Å; D123-Q127 WeakPolarHBondContact O-CG 3.41Å; D123-Q127 PolarHBondContact O-N 2.94Å; A124-Q127 WeakPolarHBondContact O-CB 3.29Å; A124-Q127 PolarHBondContact O-N 2.93Å; M125-Q127 VanDerWaalsContact C-N 3.29Å; M125-Q127 PolarHBondContact O-N 2.67Å; Q127-Q129 PolarHBondContact O-N 3.43Å; Q127-Q130 PolarHBondContact O-N 3.03Å |
| 128 | Y | 75.1 | Confident | 73.7 | Confident | 180 Ų | 180 | 112.8 Ų | 112.8 | 71% | 0.706 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -66.4 | -33.8 | 175.3 | -75.8 | -71.9 | 0 | 0 | 0 | 113.3 | A124 M125 Q130 L131 | A124-Y128 WeakPolarHBondContact O-CD2 3.42Å; A124-Y128 PolarHBondContact O-N 2.9Å; M125-Y128 PolarHBondContact O-N 3.29Å; Y128-Q130 PolarHBondContact O-N 2.93Å; Y128-L131 HydrophobicContact CD1-CD1 4.17Å; Y128-L131 VanDerWaalsContact O-CD1 3.26Å; Y128-L131 WeakPolarHBondContact O-CD1 3.27Å; Y128-L131 PolarHBondContact O-N 2.9Å |
| 129 | Q | 72.9 | Confident | 71.7 | Confident | 149 Ų | 149 | 119 Ų | 119 | 70% | 0.696 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -70.2 | -18.7 | 174.9 | -76.3 | -177.7 | -23.1 | 0 | 0 | 113.3 | M125 Y126 Q127 | M125-Q129 PolarHBondContact O-N 3.44Å; M125-Q129 VanDerWaalsContact O-N 3.13Å; Y126-Q129 PolarHBondContact O-N 2.91Å; Q127-Q129 PolarHBondContact O-N 3.43Å |
| 130 | Q | 65.4 | Low | 69.7 | Low | 162 Ų | 162 | 119.5 Ų | 119.5 | 76% | 0.757 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.6 | 6.9 | 179.8 | -65.1 | -75.9 | 12.4 | 0 | 0 | 113.5 | Y126 Q127 Y128 P132 | Y126-Q130 VanDerWaalsContact O-CG 3.27Å; Y126-Q130 WeakPolarHBondContact O-CG 3.48Å; Y126-Q130 PolarHBondContact O-N 2.89Å; Q127-Q130 PolarHBondContact O-N 3.03Å; Y128-Q130 PolarHBondContact O-N 2.93Å; Q130-P132 WeakPolarHBondContact O-CD 3.17Å |
| 131 | L | 60.1 | Low | 67.7 | Low | 115 Ų | 115 | 123.4 Ų | 123.4 | 60% | 0.602 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -60.2 | 126.6 | 169.4 | -87.4 | 94 | 0 | 0 | 0 | 108.3 | Y128 L133 | Y128-L131 HydrophobicContact CD1-CD1 4.17Å; Y128-L131 VanDerWaalsContact O-CD1 3.26Å; Y128-L131 WeakPolarHBondContact O-CD1 3.27Å; Y128-L131 PolarHBondContact O-N 2.9Å; L131-L133 PolarHBondContact O-N 2.99Å |
| 132 | P | 59.8 | Low | 65.9 | Low | 107 Ų | 107 | 135 Ų | 135 | 70% | 0.695 | 67% | 0.666 | S | S | * | * | trans | -55.1 | 134.4 | 175 | 2 | 0 | 0 | 0 | 0 | 107.5 | Q130 V134 | Q130-P132 WeakPolarHBondContact O-CD 3.17Å; P132-V134 PolarHBondContact O-N 2.92Å | ||
| 133 | L | 59.6 | Low | 64.7 | Low | 175 Ų | 175 | 140.6 Ų | 140.6 | 92% | 0.916 | 69% | 0.687 | S | S | * | * | trans | -51.1 | 95.5 | 157.5 | -76.7 | 155.8 | 0 | 0 | 0 | 105.2 | L131 D135 | L131-L133 PolarHBondContact O-N 2.99Å; L133-D135 VanDerWaalsContact C-N 3.32Å; L133-D135 PolarHBondContact O-N 3.01Å | ||
| 134 | V | 61.4 | Low | 63.6 | Low | 118 Ų | 118 | 142.7 Ų | 142.7 | 72% | 0.715 | 70% | 0.695 | S | S | * | * | trans | -60.3 | 110.1 | 171.9 | -151.9 | 0 | 0 | 0 | 0 | 102.3 | P132 A136 I138 | P132-V134 PolarHBondContact O-N 2.92Å; V134-A136 PolarHBondContact O-N 2.78Å; V134-I138 HydrophobicContact CG1-CD1 4.49Å | ||
| 135 | D | 55.4 | Low | 62.4 | Low | 99 Ų | 99 | 148.6 Ų | 148.6 | 53% | 0.529 | 72% | 0.716 | S | S | . | * | trans | -47.2 | 120.5 | -165.9 | -166.4 | 3.1 | 0 | 0 | 0 | 108.3 | L133 T137 I138 | L133-D135 VanDerWaalsContact C-N 3.32Å; L133-D135 PolarHBondContact O-N 3.01Å; D135-T137 WeakPolarHBondContact CB-OG1 3.48Å; D135-T137 PolarHBondContact O-N 3.1Å; D135-T137 WeakPolarHBondContact OD1-CG2 3.48Å; D135-T137 PolarHBondContact OD1-OG1 3.07Å; D135-T137 WeakPolarHBondContact OD2-CG2 3.41Å; D135-T137 PolarHBondContact OD2-OG1 3.25Å; D135-I138 PolarHBondContact O-N 2.77Å | ||
| 136 | A | 56 | Low | 61.4 | Low | 84 Ų | 84 | 149.6 Ų | 149.6 | 69% | 0.694 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.9 | 0.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | V134 I138 | V134-A136 PolarHBondContact O-N 2.78Å; A136-I138 VanDerWaalsContact C-N 3.35Å |
| 137 | T | 55.3 | Low | 60.4 | Low | 93 Ų | 93 | 148.9 Ų | 148.9 | 57% | 0.571 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.7 | -15.3 | 167.7 | 62.8 | 0 | 0 | 0 | 0 | 114.4 | D135 | D135-T137 WeakPolarHBondContact CB-OG1 3.48Å; D135-T137 PolarHBondContact O-N 3.1Å; D135-T137 WeakPolarHBondContact OD1-CG2 3.48Å; D135-T137 PolarHBondContact OD1-OG1 3.07Å; D135-T137 WeakPolarHBondContact OD2-CG2 3.41Å; D135-T137 PolarHBondContact OD2-OG1 3.25Å |
| 138 | I | 58.5 | Low | 59.3 | Low | 122 Ų | 122 | 149.5 Ų | 149.5 | 63% | 0.626 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.7 | -29.2 | 177.3 | -56.9 | -179.2 | 0 | 0 | 0 | 112.1 | V134 D135 A136 | V134-I138 HydrophobicContact CG1-CD1 4.49Å; D135-I138 PolarHBondContact O-N 2.77Å; A136-I138 VanDerWaalsContact C-N 3.35Å |
| 139 | Y | 53.4 | Low | 58.2 | Low | 220 Ų | 220 | 147.3 Ų | 147.3 | 86% | 0.863 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.6 | 51.4 | 176.3 | -71.2 | -76.5 | 0 | 0 | 0 | 111.8 | ||
| 140 | N | 52 | Low | 57 | Low | 114 Ų | 114 | 147.2 Ų | 147.2 | 61% | 0.61 | 74% | 0.735 | S | S | * | * | trans | -161.6 | 90.2 | 166.8 | -120.2 | -16.7 | 0 | 0 | 0 | 109.8 | ||||
| 141 | Y | 52.4 | Low | 56.3 | Low | 205 Ų | 205 | 145.9 Ų | 145.9 | 80% | 0.804 | 73% | 0.733 | S | S | * | * | 164.1 | 139.3 | 111 | -102.6 | -94.1 | 0 | 0 | 0 | 110.2 | |||||
| 142 | Y | 52.2 | Low | 56 | Low | 299 Ų | 299 | 148.7 Ų | 148.7 | 100% | 1.173 | 75% | 0.745 | S | S | * | * | trans | -41.9 | 0 | 164 | -73.5 | -94.5 | 0 | 0 | 0 | 113.8 |
Retrieved 142 of 142 residues in 84.5 ms
(Link to these results)