| 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 | 34.2 | Very low | 36.9 | Very low | 236 Ų | 236 | 154.6 Ų | 154.6 | 100% | 1.163 | 84% | 0.835 | S | S | * | * | 0 | 88.6 | 0 | -114.3 | 90.6 | 148.5 | 0 | 0 | 108.1 | |||||
| 2 | F | 25 | Very low | 37.2 | Very low | 217 Ų | 217 | 152.5 Ų | 152.5 | 95% | 0.952 | 83% | 0.83 | S | S | * | * | trans | -124.6 | 107.9 | 157.9 | -122.1 | -93.3 | 0 | 0 | 0 | 105.1 | ||||
| 3 | S | 28.1 | Very low | 38 | Very low | 108 Ų | 108 | 149.5 Ų | 149.5 | 76% | 0.755 | 82% | 0.82 | S | S | * | * | trans | -63.8 | 132 | -177.8 | -72.6 | 0 | 0 | 0 | 0 | 110.4 | A5 | S3-A5 PolarHBondContact O-N 3.37Š| ||
| 4 | V | 39.7 | Very low | 38.5 | Very low | 136 Ų | 136 | 145.6 Ų | 145.6 | 82% | 0.824 | 81% | 0.809 | S | S | * | * | trans | -25.6 | 113.8 | 149.4 | 176 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 5 | A | 37.5 | Very low | 38.8 | Very low | 89 Ų | 89 | 142.7 Ų | 142.7 | 74% | 0.736 | 80% | 0.803 | S | S | * | * | trans | -140.8 | 75.9 | 156.8 | 0 | 0 | 0 | 0 | 0 | 107 | S3 | S3-A5 PolarHBondContact O-N 3.37Š| ||
| 6 | N | 42 | Very low | 39.1 | Very low | 150 Ų | 150 | 141 Ų | 141 | 80% | 0.802 | 80% | 0.803 | S | S | * | * | trans | -154.2 | 76.5 | 170.6 | -112 | -70.9 | 0 | 0 | 0 | 108.1 | ||||
| 7 | E | 45.7 | Very low | 39.4 | Very low | 184 Ų | 184 | 144.8 Ų | 144.8 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | trans | -130.1 | 13.1 | 172 | -166 | 157.8 | 82.9 | 0 | 0 | 113 | ||||
| 8 | E | 40.1 | Very low | 39.6 | Very low | 181 Ų | 181 | 148 Ų | 148 | 85% | 0.846 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -136 | 55.9 | -176.3 | -82.2 | -89.4 | 84.6 | 0 | 0 | 112.1 | ||
| 9 | F | 35.8 | Very low | 40 | Very low | 171 Ų | 171 | 152.5 Ų | 152.5 | 75% | 0.75 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -147.2 | 35.6 | 164.8 | -135.3 | -91.7 | 0 | 0 | 0 | 114 | ||
| 10 | S | 36.4 | Very low | 39.9 | Very low | 113 Ų | 113 | 150 Ų | 150 | 79% | 0.79 | 80% | 0.804 | S | S | * | * | S | Bend | trans | -114.1 | 3.6 | 178.7 | -163.4 | 0 | 0 | 0 | 0 | 115.6 | ||
| 11 | V | 41.1 | Very low | 40.4 | Very low | 116 Ų | 116 | 146 Ų | 146 | 70% | 0.703 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -136.8 | -2 | -173.4 | 127.9 | 0 | 0 | 0 | 0 | 118.1 | T13 | V11-T13 VanDerWaalsContact C-N 3.28Å; V11-T13 PolarHBondContact O-N 2.93Å |
| 12 | V | 40.7 | Very low | 41.1 | Very low | 129 Ų | 129 | 142.8 Ų | 142.8 | 78% | 0.782 | 79% | 0.786 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.6 | 13.1 | -179.6 | 89.8 | 0 | 0 | 0 | 0 | 115.1 | ||
| 13 | T | 47.5 | Very low | 42.2 | Very low | 113 Ų | 113 | 139.9 Ų | 139.9 | 69% | 0.693 | 78% | 0.78 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.1 | 8.1 | 171.3 | 57.6 | 0 | 0 | 0 | 0 | 113.9 | V11 | V11-T13 VanDerWaalsContact C-N 3.28Å; V11-T13 PolarHBondContact O-N 2.93Å |
| 14 | S | 45.5 | Very low | 43 | Very low | 95 Ų | 95 | 140.7 Ų | 140.7 | 66% | 0.664 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -112.2 | -4.2 | -176.6 | -150.8 | 0 | 0 | 0 | 0 | 116.4 | ||
| 15 | S | 42.5 | Very low | 43.4 | Very low | 103 Ų | 103 | 143.5 Ų | 143.5 | 72% | 0.72 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -121.2 | -6.6 | -171 | -56.7 | 0 | 0 | 0 | 0 | 118.2 | ||
| 16 | S | 44 | Very low | 43.7 | Very low | 115 Ų | 115 | 147.3 Ų | 147.3 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -108.7 | -19.1 | 176.8 | -88 | 0 | 0 | 0 | 0 | 116 | ||
| 17 | W | 44.7 | Very low | 44.1 | Very low | 205 Ų | 205 | 144.7 Ų | 144.7 | 78% | 0.777 | 80% | 0.801 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.1 | -15.4 | -178.9 | -86.3 | 65.8 | 0 | 0 | 0 | 114.1 | V32 I36 | W17-V32 HydrophobicContact CZ3-CG1 4.32Å; W17-I36 HydrophobicContact CZ3-CD1 4.42Å |
| 18 | F | 42.1 | Very low | 44.4 | Very low | 203 Ų | 203 | 137.7 Ų | 137.7 | 89% | 0.89 | 78% | 0.779 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.8 | 34.9 | -179 | -121.5 | -85.3 | 0 | 0 | 0 | 114.4 | ||
| 19 | R | 47.2 | Very low | 44.8 | Very low | 233 Ų | 233 | 133.3 Ų | 133.3 | 88% | 0.879 | 77% | 0.767 | S | S | * | * | trans | -145.6 | 50.4 | 164.8 | -149.3 | 152.7 | 70.8 | -143.6 | 4.8 | 114.1 | ||||
| 20 | C | 37.9 | Very low | 45.6 | Very low | 102 Ų | 102 | 129.1 Ų | 129.1 | 69% | 0.689 | 76% | 0.763 | S | S | * | * | trans | -110 | 91.5 | 156.9 | -155.4 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 21 | G | 50 | Low | 46.5 | Very low | 68 Ų | 68 | 129.8 Ų | 129.8 | 70% | 0.701 | 76% | 0.758 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.4 | 139.8 | 164.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||
| 22 | N | 49.8 | Very low | 47.3 | Very low | 168 Ų | 168 | 127.5 Ų | 127.5 | 90% | 0.898 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 83.7 | 23.2 | 166 | -83.7 | -0.1 | 0 | 0 | 0 | 122.1 | ||
| 23 | L | 49 | Very low | 48.1 | Very low | 155 Ų | 155 | 125 Ų | 125 | 81% | 0.812 | 73% | 0.732 | S | S | * | * | trans | -106.9 | 31.7 | 173.9 | -134.7 | 73.9 | 0 | 0 | 0 | 116.4 | K25 | L23-K25 PolarHBondContact O-N 3.23Š| ||
| 24 | C | 44.1 | Very low | 48.6 | Very low | 126 Ų | 126 | 126.4 Ų | 126.4 | 85% | 0.851 | 73% | 0.726 | S | S | * | * | trans | -95.2 | 49.1 | 175.3 | -82.3 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 25 | K | 47.2 | Very low | 49.3 | Very low | 195 Ų | 195 | 127.6 Ų | 127.6 | 85% | 0.848 | 72% | 0.724 | S | S | * | * | trans | -147.4 | 14.1 | 178.8 | -126.9 | 148 | -172 | 165.1 | 0 | 122.4 | L23 | L23-K25 PolarHBondContact O-N 3.23Š| ||
| 26 | L | 44.3 | Very low | 50.3 | Low | 168 Ų | 168 | 126.8 Ų | 126.8 | 88% | 0.88 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -138.1 | 102.1 | 167.1 | -79.6 | 121.2 | 0 | 0 | 0 | 111.3 | G28 | L26-G28 PolarHBondContact O-N 2.85Š|
| 27 | G | 50.4 | Low | 50.8 | Low | 96 Ų | 96 | 123.9 Ų | 123.9 | 99% | 0.99 | 69% | 0.694 | S | S | * | * | S | Bend | trans | 33.2 | 29 | 140.6 | 0 | 0 | 0 | 0 | 0 | 122 | ||
| 28 | G | 52.8 | Low | 51.2 | Low | 37 Ų | 37 | 116.5 Ų | 116.5 | 38% | 0.381 | 67% | 0.671 | S | S | . | * | trans | -135.6 | 10.5 | -174.9 | 0 | 0 | 0 | 0 | 0 | 115 | L26 A30 | L26-G28 PolarHBondContact O-N 2.85Å; G28-A30 VanDerWaalsContact C-N 3.27Å; G28-A30 PolarHBondContact O-N 2.82Å | ||
| 29 | C | 47.1 | Very low | 51.9 | Low | 89 Ų | 89 | 112.7 Ų | 112.7 | 60% | 0.601 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -70.2 | -17.6 | -172.1 | -55.9 | 0 | 0 | 0 | 0 | 114.4 | S33 | C29-S33 WeakPolarHBondContact O-CB 3.23Å; C29-S33 PolarHBondContact O-N 3.47Å; C29-S33 PolarHBondContact O-OG 3.14Å |
| 30 | A | 52.4 | Low | 52.1 | Low | 82 Ų | 82 | 105 Ų | 105 | 68% | 0.678 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -72.1 | -40.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | G28 Y34 | G28-A30 VanDerWaalsContact C-N 3.27Å; G28-A30 PolarHBondContact O-N 2.82Å; A30-Y34 WeakPolarHBondContact O-CB 3.47Å; A30-Y34 PolarHBondContact O-N 3.31Å |
| 31 | L | 55.6 | Low | 52.8 | Low | 128 Ų | 128 | 104.9 Ų | 104.9 | 67% | 0.67 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -70.5 | -35.4 | -180 | -79 | 168.4 | 0 | 0 | 0 | 112.2 | Y34 L35 | L31-Y34 PolarHBondContact O-N 3.26Å; L31-L35 WeakPolarHBondContact O-CB 3.34Å; L31-L35 WeakPolarHBondContact O-CG 3.38Å; L31-L35 PolarHBondContact O-N 2.83Å |
| 32 | V | 59.1 | Low | 52.9 | Low | 68 Ų | 68 | 105.3 Ų | 105.3 | 41% | 0.412 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -72 | -40.6 | 178.4 | -170.5 | 0 | 0 | 0 | 0 | 110.7 | W17 L35 I36 | W17-V32 HydrophobicContact CZ3-CG1 4.32Å; V32-L35 PolarHBondContact O-N 2.74Å; V32-I36 HydrophobicContact CG1-CD1 3.88Å; V32-I36 WeakPolarHBondContact O-CB 3.13Å; V32-I36 VanDerWaalsContact O-CG1 3.23Å; V32-I36 WeakPolarHBondContact O-CG1 3.26Å; V32-I36 PolarHBondContact O-N 3.35Å |
| 33 | S | 57.8 | Low | 52.7 | Low | 77 Ų | 77 | 102.4 Ų | 102.4 | 54% | 0.538 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -63.8 | -40 | 172 | -63.8 | 0 | 0 | 0 | 0 | 112.4 | C29 A37 | C29-S33 WeakPolarHBondContact O-CB 3.23Å; C29-S33 PolarHBondContact O-N 3.47Å; C29-S33 PolarHBondContact O-OG 3.14Å; S33-A37 VanDerWaalsContact O-CB 3.24Å; S33-A37 WeakPolarHBondContact O-CB 3.43Å; S33-A37 PolarHBondContact O-N 3.13Å |
| 34 | Y | 57.3 | Low | 52.6 | Low | 142 Ų | 142 | 99.2 Ų | 99.2 | 56% | 0.557 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -66.8 | -43 | 176.2 | -166.7 | -105.1 | 0 | 0 | 0 | 111.6 | A30 L31 A37 V38 | A30-Y34 WeakPolarHBondContact O-CB 3.47Å; A30-Y34 PolarHBondContact O-N 3.31Å; L31-Y34 PolarHBondContact O-N 3.26Å; Y34-A37 PolarHBondContact O-N 2.81Å; Y34-V38 HydrophobicContact CD1-CG2 4.07Å; Y34-V38 HydrophobicContact CE1-CG2 3.9Å; Y34-V38 HydrophobicContact CG-CG2 4.48Å; Y34-V38 WeakPolarHBondContact O-CB 3.4Å; Y34-V38 WeakPolarHBondContact O-CG2 3.23Å; Y34-V38 PolarHBondContact O-N 3.18Å |
| 35 | L | 60.6 | Low | 52.5 | Low | 119 Ų | 119 | 97 Ų | 97 | 62% | 0.623 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -64.4 | -39.8 | 175.1 | -83.1 | 163.7 | 0 | 0 | 0 | 112.8 | L31 V32 F39 | L31-L35 WeakPolarHBondContact O-CB 3.34Å; L31-L35 WeakPolarHBondContact O-CG 3.38Å; L31-L35 PolarHBondContact O-N 2.83Å; V32-L35 PolarHBondContact O-N 2.74Å; L35-F39 WeakPolarHBondContact O-CB 3.39Å; L35-F39 PolarHBondContact O-N 3.34Å |
| 36 | I | 62 | Low | 52.3 | Low | 87 Ų | 87 | 91.1 Ų | 91.1 | 45% | 0.446 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -68.9 | -39.5 | 175.7 | -68.7 | 166.3 | 0 | 0 | 0 | 111 | W17 V32 F39 S40 | W17-I36 HydrophobicContact CZ3-CD1 4.42Å; V32-I36 HydrophobicContact CG1-CD1 3.88Å; V32-I36 WeakPolarHBondContact O-CB 3.13Å; V32-I36 VanDerWaalsContact O-CG1 3.23Å; V32-I36 WeakPolarHBondContact O-CG1 3.26Å; V32-I36 PolarHBondContact O-N 3.35Å; I36-F39 PolarHBondContact O-N 3.34Å; I36-S40 VanDerWaalsContact O-CB 3.32Å; I36-S40 WeakPolarHBondContact O-CB 3.5Å; I36-S40 PolarHBondContact O-N 3.3Å; I36-S40 PolarHBondContact O-OG 3.39Å |
| 37 | A | 55.2 | Low | 52.2 | Low | 54 Ų | 54 | 87 Ų | 87 | 45% | 0.446 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -65.8 | -42.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | S33 Y34 S40 V41 | S33-A37 VanDerWaalsContact O-CB 3.24Å; S33-A37 WeakPolarHBondContact O-CB 3.43Å; S33-A37 PolarHBondContact O-N 3.13Å; Y34-A37 PolarHBondContact O-N 2.81Å; A37-S40 PolarHBondContact O-N 2.7Å; A37-V41 WeakPolarHBondContact O-CB 3.49Å; A37-V41 PolarHBondContact O-N 3.13Å |
| 38 | V | 54.3 | Low | 52.5 | Low | 50 Ų | 50 | 90.1 Ų | 90.1 | 30% | 0.303 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.7 | -43.6 | 175.3 | 172 | 0 | 0 | 0 | 0 | 110.7 | Y34 S40 V41 T42 | Y34-V38 HydrophobicContact CD1-CG2 4.07Å; Y34-V38 HydrophobicContact CE1-CG2 3.9Å; Y34-V38 HydrophobicContact CG-CG2 4.48Å; Y34-V38 WeakPolarHBondContact O-CB 3.4Å; Y34-V38 WeakPolarHBondContact O-CG2 3.23Å; Y34-V38 PolarHBondContact O-N 3.18Å; V38-S40 VanDerWaalsContact C-N 3.33Å; V38-S40 PolarHBondContact O-N 3.33Å; V38-V41 PolarHBondContact O-N 3.44Å; V38-T42 PolarHBondContact O-N 3.47Å; V38-T42 PolarHBondContact O-OG1 2.89Å |
| 39 | F | 56 | Low | 52.1 | Low | 122 Ų | 122 | 94.5 Ų | 94.5 | 54% | 0.535 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.2 | -36.1 | 175.9 | -167.8 | -101.5 | 0 | 0 | 0 | 112.6 | L35 I36 M43 | L35-F39 WeakPolarHBondContact O-CB 3.39Å; L35-F39 PolarHBondContact O-N 3.34Å; I36-F39 PolarHBondContact O-N 3.34Å; F39-M43 HydrophobicContact CZ-CE 4.06Å; F39-M43 PolarHBondContact O-N 3Å |
| 40 | S | 50.8 | Low | 52.5 | Low | 72 Ų | 72 | 93.6 Ų | 93.6 | 50% | 0.503 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -69.5 | -37.9 | 174 | -58.2 | 0 | 0 | 0 | 0 | 112.3 | I36 A37 V38 | I36-S40 VanDerWaalsContact O-CB 3.32Å; I36-S40 WeakPolarHBondContact O-CB 3.5Å; I36-S40 PolarHBondContact O-N 3.3Å; I36-S40 PolarHBondContact O-OG 3.39Å; A37-S40 PolarHBondContact O-N 2.7Å; V38-S40 VanDerWaalsContact C-N 3.33Å; V38-S40 PolarHBondContact O-N 3.33Å |
| 41 | V | 52.4 | Low | 52.6 | Low | 99 Ų | 99 | 96.9 Ų | 96.9 | 60% | 0.6 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -64.8 | -39 | 174.4 | 143.1 | 0 | 0 | 0 | 0 | 111.6 | A37 V38 M43 | A37-V41 WeakPolarHBondContact O-CB 3.49Å; A37-V41 PolarHBondContact O-N 3.13Å; V38-V41 PolarHBondContact O-N 3.44Å; V41-M43 PolarHBondContact O-N 2.69Å |
| 42 | T | 51.7 | Low | 52.7 | Low | 78 Ų | 78 | 95.3 Ų | 95.3 | 48% | 0.479 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -69 | -32.2 | -179.9 | -52.2 | 0 | 0 | 0 | 0 | 112.9 | V38 S45 | V38-T42 PolarHBondContact O-N 3.47Å; V38-T42 PolarHBondContact O-OG1 2.89Å; T42-S45 PolarHBondContact O-N 2.82Å |
| 43 | M | 46.9 | Very low | 52.4 | Low | 106 Ų | 106 | 93.9 Ų | 93.9 | 52% | 0.522 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -78.1 | -19.8 | -179.6 | -76.1 | -68.8 | 172 | 0 | 0 | 114.3 | F39 V41 S45 A46 | F39-M43 HydrophobicContact CZ-CE 4.06Å; F39-M43 PolarHBondContact O-N 3Å; V41-M43 PolarHBondContact O-N 2.69Å; M43-S45 PolarHBondContact O-N 3Å; M43-A46 PolarHBondContact O-N 3.44Å; M43-A46 HydrophobicContact SD-CB 4.29Å |
| 44 | A | 45.6 | Very low | 52.7 | Low | 88 Ų | 88 | 94.7 Ų | 94.7 | 73% | 0.727 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.9 | -19.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 45 | S | 44 | Very low | 53.1 | Low | 80 Ų | 80 | 95.7 Ų | 95.7 | 56% | 0.559 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97 | 17.7 | 175.7 | -154.1 | 0 | 0 | 0 | 0 | 112.4 | T42 M43 E85 | T42-S45 PolarHBondContact O-N 2.82Å; M43-S45 PolarHBondContact O-N 3Å; S45-E85 PolarHBondContact OG-OE1 3Å |
| 46 | A | 43.1 | Very low | 53.3 | Low | 71 Ų | 71 | 96 Ų | 96 | 59% | 0.587 | 56% | 0.559 | S | S | * | * | trans | -107.8 | 22 | -179 | 0 | 0 | 0 | 0 | 0 | 114 | M43 | M43-A46 PolarHBondContact O-N 3.44Å; M43-A46 HydrophobicContact SD-CB 4.29Å | ||
| 47 | A | 41.1 | Very low | 53.5 | Low | 81 Ų | 81 | 95.7 Ų | 95.7 | 67% | 0.669 | 56% | 0.562 | S | S | * | * | trans | -108.1 | 85.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | T49 | A47-T49 PolarHBondContact O-N 2.94Š| ||
| 48 | N | 55.8 | Low | 54.1 | Low | 163 Ų | 163 | 95.4 Ų | 95.4 | 87% | 0.872 | 55% | 0.552 | S | S | * | * | trans | -70.7 | 86.5 | 170.9 | -168.8 | -3.7 | 0 | 0 | 0 | 110.4 | ||||
| 49 | T | 46.4 | Very low | 54.8 | Low | 128 Ų | 128 | 97.5 Ų | 97.5 | 79% | 0.785 | 56% | 0.561 | S | S | * | * | trans | -148.1 | 5.9 | 170.2 | 52.6 | 0 | 0 | 0 | 0 | 118.4 | A47 | A47-T49 PolarHBondContact O-N 2.94Š| ||
| 50 | N | 54.3 | Low | 55.3 | Low | 71 Ų | 71 | 95.8 Ų | 95.8 | 38% | 0.38 | 56% | 0.561 | S | S | . | * | trans | -151.7 | 99.5 | 171.5 | -159.6 | 24.6 | 0 | 0 | 0 | 111.4 | N52 A53 V54 | N50-N52 WeakPolarHBondContact ND2-CB 3.29Å; N50-N52 PolarHBondContact O-N 3.42Å; N50-N52 VanDerWaalsContact OD1-CB 3.3Å; N50-N52 WeakPolarHBondContact OD1-CB 3.44Å; N50-N52 PolarHBondContact OD1-N 3.17Å; N50-N52 PolarHBondContact OD1-ND2 3.46Å; N50-N52 VanDerWaalsContact OD1-ND2 3.11Å; N50-A53 HydrophobicContact CB-CB 3.77Å; N50-A53 PolarHBondContact ND2-N 2.92Å; N50-A53 PolarHBondContact O-N 2.83Å; N50-V54 PolarHBondContact O-N 3.26Å; N50-V54 VanDerWaalsContact O-N 3.12Å | ||
| 51 | M | 54.2 | Low | 56 | Low | 150 Ų | 150 | 95 Ų | 95 | 74% | 0.739 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -53 | -23.7 | 166.3 | -66.4 | -152.9 | -154.6 | 0 | 0 | 111.3 | R55 | M51-R55 WeakPolarHBondContact O-CB 3.43Å; M51-R55 WeakPolarHBondContact O-CG 3.47Å; M51-R55 PolarHBondContact O-N 3.09Å |
| 52 | N | 57.3 | Low | 56.8 | Low | 95 Ų | 95 | 91.2 Ų | 91.2 | 51% | 0.508 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -71.2 | -38.2 | 172.9 | -48.5 | -34.4 | 0 | 0 | 0 | 112 | N50 R55 E56 | N50-N52 WeakPolarHBondContact ND2-CB 3.29Å; N50-N52 PolarHBondContact O-N 3.42Å; N50-N52 VanDerWaalsContact OD1-CB 3.3Å; N50-N52 WeakPolarHBondContact OD1-CB 3.44Å; N50-N52 PolarHBondContact OD1-N 3.17Å; N50-N52 PolarHBondContact OD1-ND2 3.46Å; N50-N52 VanDerWaalsContact OD1-ND2 3.11Å; N52-R55 PolarHBondContact O-N 2.85Å; N52-E56 WeakPolarHBondContact O-CB 3.38Å; N52-E56 VanDerWaalsContact O-CG 3.23Å; N52-E56 WeakPolarHBondContact O-CG 3.46Å; N52-E56 PolarHBondContact O-N 3.46Å |
| 53 | A | 53.6 | Low | 57.4 | Low | 39 Ų | 39 | 92.5 Ų | 92.5 | 32% | 0.322 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -68.1 | -37 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | N50 R55 T57 | N50-A53 HydrophobicContact CB-CB 3.77Å; N50-A53 PolarHBondContact ND2-N 2.92Å; N50-A53 PolarHBondContact O-N 2.83Å; A53-R55 VanDerWaalsContact C-N 3.35Å; A53-T57 VanDerWaalsContact O-CB 3.23Å; A53-T57 WeakPolarHBondContact O-CB 3.26Å; A53-T57 PolarHBondContact O-N 3.28Å; A53-T57 PolarHBondContact O-OG1 2.94Å |
| 54 | V | 63.5 | Low | 58.3 | Low | 94 Ų | 94 | 91.4 Ų | 91.4 | 57% | 0.57 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.2 | -42.9 | 172.9 | 177.3 | 0 | 0 | 0 | 0 | 110.3 | N50 M58 | N50-V54 PolarHBondContact O-N 3.26Å; N50-V54 VanDerWaalsContact O-N 3.12Å; V54-M58 VanDerWaalsContact O-CB 3.23Å; V54-M58 WeakPolarHBondContact O-CB 3.35Å; V54-M58 PolarHBondContact O-N 3.4Å |
| 55 | R | 66.3 | Low | 59.2 | Low | 163 Ų | 163 | 88 Ų | 88 | 62% | 0.615 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.5 | -49.4 | 175.5 | -80.2 | 177.5 | 144.3 | 127.1 | 2.1 | 112.4 | M51 N52 A53 T57 M58 D59 | M51-R55 WeakPolarHBondContact O-CB 3.43Å; M51-R55 WeakPolarHBondContact O-CG 3.47Å; M51-R55 PolarHBondContact O-N 3.09Å; N52-R55 PolarHBondContact O-N 2.85Å; A53-R55 VanDerWaalsContact C-N 3.35Å; R55-T57 VanDerWaalsContact C-N 3.32Å; R55-T57 PolarHBondContact O-N 3.37Å; R55-M58 CarbonylContact O-C 3.58Å; R55-M58 WeakPolarHBondContact O-CB 3.4Å; R55-M58 PolarHBondContact O-N 3Å; R55-M58 VanDerWaalsContact O-N 3.15Å; R55-D59 WeakPolarHBondContact O-CB 3.31Å; R55-D59 PolarHBondContact O-N 3.43Å |
| 56 | E | 65.6 | Low | 60.2 | Low | 124 Ų | 124 | 92.4 Ų | 92.4 | 58% | 0.579 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -59.4 | -43.5 | 177 | -74.1 | 172.1 | 146.4 | 0 | 0 | 111.4 | N52 D59 V60 | N52-E56 WeakPolarHBondContact O-CB 3.38Å; N52-E56 VanDerWaalsContact O-CG 3.23Å; N52-E56 WeakPolarHBondContact O-CG 3.46Å; N52-E56 PolarHBondContact O-N 3.46Å; E56-D59 PolarHBondContact O-N 3.42Å; E56-V60 WeakPolarHBondContact O-CB 3.23Å; E56-V60 VanDerWaalsContact O-CG2 3.25Å; E56-V60 WeakPolarHBondContact O-CG2 3.45Å; E56-V60 PolarHBondContact O-N 2.81Å |
| 57 | T | 66 | Low | 61 | Low | 82 Ų | 82 | 96 Ų | 96 | 50% | 0.503 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.6 | -44.6 | 175.3 | -57.6 | 0 | 0 | 0 | 0 | 110.8 | A53 R55 D59 V60 L61 | A53-T57 VanDerWaalsContact O-CB 3.23Å; A53-T57 WeakPolarHBondContact O-CB 3.26Å; A53-T57 PolarHBondContact O-N 3.28Å; A53-T57 PolarHBondContact O-OG1 2.94Å; R55-T57 VanDerWaalsContact C-N 3.32Å; R55-T57 PolarHBondContact O-N 3.37Å; T57-D59 PolarHBondContact O-N 3.32Å; T57-V60 PolarHBondContact O-N 3.13Å; T57-L61 HydrophobicContact CG2-CD1 3.73Å; T57-L61 WeakPolarHBondContact O-CD1 3.31Å; T57-L61 PolarHBondContact O-N 2.97Å |
| 58 | M | 68.1 | Low | 61.9 | Low | 48 Ų | 48 | 96.5 Ų | 96.5 | 24% | 0.236 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -63.2 | -41.4 | 177.5 | -166.2 | 69.1 | 76.5 | 0 | 0 | 111.9 | V54 R55 L61 L62 L77 | V54-M58 VanDerWaalsContact O-CB 3.23Å; V54-M58 WeakPolarHBondContact O-CB 3.35Å; V54-M58 PolarHBondContact O-N 3.4Å; R55-M58 CarbonylContact O-C 3.58Å; R55-M58 WeakPolarHBondContact O-CB 3.4Å; R55-M58 PolarHBondContact O-N 3Å; R55-M58 VanDerWaalsContact O-N 3.15Å; M58-L61 PolarHBondContact O-N 3.12Å; M58-L62 WeakPolarHBondContact O-CB 3.21Å; M58-L62 VanDerWaalsContact O-CG 3.29Å; M58-L62 WeakPolarHBondContact O-CG 3.35Å; M58-L62 PolarHBondContact O-N 3.18Å; M58-L77 HydrophobicContact SD-CB 4.29Å; M58-L77 HydrophobicContact SD-CD2 3.31Å; M58-L77 WeakPolarHBondContact SD-CD2 3.33Å; M58-L77 HydrophobicContact SD-CG 4.31Å |
| 59 | D | 68.1 | Low | 62.2 | Low | 93 Ų | 93 | 95.7 Ų | 95.7 | 50% | 0.497 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.5 | -42.8 | 175.6 | -86.4 | -52.9 | 0 | 0 | 0 | 111.7 | R55 E56 T57 L61 L62 E63 | R55-D59 WeakPolarHBondContact O-CB 3.31Å; R55-D59 PolarHBondContact O-N 3.43Å; E56-D59 PolarHBondContact O-N 3.42Å; T57-D59 PolarHBondContact O-N 3.32Å; D59-L61 PolarHBondContact O-N 3.32Å; D59-L62 WeakPolarHBondContact O-CB 3.39Å; D59-L62 PolarHBondContact O-N 2.83Å; D59-E63 PolarHBondContact O-N 3.31Å |
| 60 | V | 66.6 | Low | 63.1 | Low | 87 Ų | 87 | 90.1 Ų | 90.1 | 53% | 0.527 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -62.7 | -42.4 | 174.1 | 171.1 | 0 | 0 | 0 | 0 | 111 | E56 T57 L62 E63 I64 | E56-V60 WeakPolarHBondContact O-CB 3.23Å; E56-V60 VanDerWaalsContact O-CG2 3.25Å; E56-V60 WeakPolarHBondContact O-CG2 3.45Å; E56-V60 PolarHBondContact O-N 2.81Å; T57-V60 PolarHBondContact O-N 3.13Å; V60-L62 VanDerWaalsContact C-N 3.35Å; V60-L62 PolarHBondContact O-N 3.35Å; V60-E63 WeakPolarHBondContact O-CB 3.46Å; V60-E63 PolarHBondContact O-N 3.29Å; V60-I64 HydrophobicContact CG1-CD1 4.09Å; V60-I64 VanDerWaalsContact O-CG1 3.3Å; V60-I64 WeakPolarHBondContact O-CG1 3.29Å; V60-I64 PolarHBondContact O-N 3.4Å |
| 61 | L | 65.9 | Low | 63.5 | Low | 56 Ų | 56 | 89 Ų | 89 | 29% | 0.293 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -67.6 | -33.3 | 176.4 | -90 | 77.6 | 0 | 0 | 0 | 112.7 | T57 M58 D59 S65 L77 V81 | T57-L61 HydrophobicContact CG2-CD1 3.73Å; T57-L61 WeakPolarHBondContact O-CD1 3.31Å; T57-L61 PolarHBondContact O-N 2.97Å; M58-L61 PolarHBondContact O-N 3.12Å; D59-L61 PolarHBondContact O-N 3.32Å; L61-S65 WeakPolarHBondContact O-CB 3.48Å; L61-S65 PolarHBondContact O-N 3.37Å; L61-S65 PolarHBondContact O-OG 3.4Å; L61-L77 HydrophobicContact CB-CD1 4.28Å; L61-L77 HydrophobicContact CB-CD2 3.67Å; L61-L77 HydrophobicContact CD2-CD2 3.84Å; L61-L77 HydrophobicContact CG-CD2 4.42Å; L61-V81 HydrophobicContact CD2-CG2 3.49Å; L61-V81 VanDerWaalsContact CD2-CG2 3.49Å |
| 62 | L | 68.8 | Low | 64 | Low | 18 Ų | 18 | 83.1 Ų | 83.1 | 9% | 0.094 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -66.6 | -41 | 172.3 | -77.9 | 166.8 | 0 | 0 | 0 | 111.4 | M58 D59 V60 S65 R66 M74 L77 | M58-L62 WeakPolarHBondContact O-CB 3.21Å; M58-L62 VanDerWaalsContact O-CG 3.29Å; M58-L62 WeakPolarHBondContact O-CG 3.35Å; M58-L62 PolarHBondContact O-N 3.18Å; D59-L62 WeakPolarHBondContact O-CB 3.39Å; D59-L62 PolarHBondContact O-N 2.83Å; V60-L62 VanDerWaalsContact C-N 3.35Å; V60-L62 PolarHBondContact O-N 3.35Å; L62-S65 CarbonylContact O-C 3.58Å; L62-S65 WeakPolarHBondContact O-CB 3.47Å; L62-S65 PolarHBondContact O-N 2.93Å; L62-S65 VanDerWaalsContact O-N 3.17Å; L62-R66 WeakPolarHBondContact O-CG 3.15Å; L62-R66 PolarHBondContact O-N 3.15Å; L62-M74 HydrophobicContact CD1-CE 4.02Å; L62-M74 HydrophobicContact CD1-CG 3.94Å; L62-M74 HydrophobicContact CD2-CG 4.43Å; L62-L77 HydrophobicContact CB-CD1 4.48Å; L62-L77 HydrophobicContact CD2-CD1 3.59Å; L62-L77 HydrophobicContact CG-CD1 3.86Å |
| 63 | E | 64.7 | Low | 64.6 | Low | 105 Ų | 105 | 83.4 Ų | 83.4 | 49% | 0.491 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -62 | -43.8 | 175.6 | -160.1 | 79 | 168.5 | 0 | 0 | 110.7 | D59 V60 S65 R66 L67 | D59-E63 PolarHBondContact O-N 3.31Å; V60-E63 WeakPolarHBondContact O-CB 3.46Å; V60-E63 PolarHBondContact O-N 3.29Å; E63-S65 VanDerWaalsContact C-N 3.31Å; E63-S65 PolarHBondContact O-N 2.94Å; E63-R66 WeakPolarHBondContact O-CB 3.46Å; E63-R66 PolarHBondContact O-N 3.42Å; E63-R66 IonicContact OE2-NH1 3.15Å; E63-R66 PolarHBondContact OE2-NH1 3.31Å; E63-R66 VanDerWaalsContact OE2-NH1 3.15Å; E63-L67 WeakPolarHBondContact O-CG 3.31Å; E63-L67 PolarHBondContact O-N 3.07Å |
| 64 | I | 65.9 | Low | 65.1 | Low | 83 Ų | 83 | 87.3 Ų | 87.3 | 43% | 0.426 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -61.5 | -40.6 | 173.2 | -64.9 | 164.2 | 0 | 0 | 0 | 110.9 | V60 L67 L68 | V60-I64 HydrophobicContact CG1-CD1 4.09Å; V60-I64 VanDerWaalsContact O-CG1 3.3Å; V60-I64 WeakPolarHBondContact O-CG1 3.29Å; V60-I64 PolarHBondContact O-N 3.4Å; I64-L67 PolarHBondContact O-N 3.46Å; I64-L68 HydrophobicContact CG2-CD1 3.91Å; I64-L68 WeakPolarHBondContact O-CB 3.42Å; I64-L68 WeakPolarHBondContact O-CG 3.35Å; I64-L68 PolarHBondContact O-N 3.14Å |
| 65 | S | 63.7 | Low | 65.4 | Low | 17 Ų | 17 | 89.8 Ų | 89.8 | 12% | 0.119 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -67.2 | -34.1 | 177.5 | -61.6 | 0 | 0 | 0 | 0 | 112.8 | L61 L62 E63 L68 N69 T70 L77 | L61-S65 WeakPolarHBondContact O-CB 3.48Å; L61-S65 PolarHBondContact O-N 3.37Å; L61-S65 PolarHBondContact O-OG 3.4Å; L62-S65 CarbonylContact O-C 3.58Å; L62-S65 WeakPolarHBondContact O-CB 3.47Å; L62-S65 PolarHBondContact O-N 2.93Å; L62-S65 VanDerWaalsContact O-N 3.17Å; E63-S65 VanDerWaalsContact C-N 3.31Å; E63-S65 PolarHBondContact O-N 2.94Å; S65-L68 PolarHBondContact O-N 3.35Å; S65-N69 PolarHBondContact O-N 3.44Å; S65-N69 VanDerWaalsContact O-N 3.09Å; S65-T70 PolarHBondContact O-N 3.33Å; S65-T70 VanDerWaalsContact O-N 3.1Å; S65-T70 PolarHBondContact O-OG1 2.95Å; S65-L77 WeakPolarHBondContact OG-CD1 3.46Å |
| 66 | R | 66 | Low | 65.6 | Low | 173 Ų | 173 | 84.2 Ų | 84.2 | 65% | 0.653 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -66.6 | -43.8 | 171.1 | -74.8 | 174.5 | 179.4 | 158.4 | -0.3 | 111.4 | L62 E63 L68 N69 | L62-R66 WeakPolarHBondContact O-CG 3.15Å; L62-R66 PolarHBondContact O-N 3.15Å; E63-R66 WeakPolarHBondContact O-CB 3.46Å; E63-R66 PolarHBondContact O-N 3.42Å; E63-R66 IonicContact OE2-NH1 3.15Å; E63-R66 PolarHBondContact OE2-NH1 3.31Å; E63-R66 VanDerWaalsContact OE2-NH1 3.15Å; R66-L68 VanDerWaalsContact C-N 3.28Å; R66-L68 PolarHBondContact O-N 3.46Å; R66-N69 WeakPolarHBondContact O-CA 3.27Å; R66-N69 PolarHBondContact O-N 2.98Å |
| 67 | L | 60.1 | Low | 65.8 | Low | 145 Ų | 145 | 78.5 Ų | 78.5 | 76% | 0.759 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -61.2 | -37.6 | 175.3 | -68.8 | 172.2 | 0 | 0 | 0 | 112 | E63 I64 N69 | E63-L67 WeakPolarHBondContact O-CG 3.31Å; E63-L67 PolarHBondContact O-N 3.07Å; I64-L67 PolarHBondContact O-N 3.46Å; L67-N69 PolarHBondContact O-N 3.02Å |
| 68 | L | 59.8 | Low | 65.9 | Low | 93 Ų | 93 | 76.8 Ų | 76.8 | 49% | 0.487 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.5 | -0.9 | 176 | -68.1 | 168.3 | 0 | 0 | 0 | 113.9 | I64 S65 R66 T70 | I64-L68 HydrophobicContact CG2-CD1 3.91Å; I64-L68 WeakPolarHBondContact O-CB 3.42Å; I64-L68 WeakPolarHBondContact O-CG 3.35Å; I64-L68 PolarHBondContact O-N 3.14Å; S65-L68 PolarHBondContact O-N 3.35Å; R66-L68 VanDerWaalsContact C-N 3.28Å; R66-L68 PolarHBondContact O-N 3.46Å; L68-T70 HydrophobicContact CB-CG2 3.97Å; L68-T70 PolarHBondContact O-N 3.31Å |
| 69 | N | 61.3 | Low | 66.1 | Low | 146 Ų | 146 | 78.8 Ų | 78.8 | 78% | 0.781 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.4 | 35.1 | -178.4 | -153.7 | 46.1 | 0 | 0 | 0 | 113.8 | S65 R66 L67 | S65-N69 PolarHBondContact O-N 3.44Å; S65-N69 VanDerWaalsContact O-N 3.09Å; R66-N69 WeakPolarHBondContact O-CA 3.27Å; R66-N69 PolarHBondContact O-N 2.98Å; L67-N69 PolarHBondContact O-N 3.02Å |
| 70 | T | 64.8 | Low | 66.2 | Low | 10 Ų | 10 | 75.2 Ų | 75.2 | 6% | 0.061 | 40% | 0.399 | C | S | . | . | trans | -81.4 | -20.1 | -179.4 | 58.3 | 0 | 0 | 0 | 0 | 112.4 | S65 L68 L72 K98 R101 | S65-T70 PolarHBondContact O-N 3.33Å; S65-T70 VanDerWaalsContact O-N 3.1Å; S65-T70 PolarHBondContact O-OG1 2.95Å; L68-T70 HydrophobicContact CB-CG2 3.97Å; L68-T70 PolarHBondContact O-N 3.31Å; T70-L72 PolarHBondContact O-N 3.2Å; T70-K98 HydrophobicContact CG2-CG 4.29Å; T70-R101 WeakPolarHBondContact O-CD 3.22Å; T70-R101 PolarHBondContact O-NE 3.11Å; T70-R101 PolarHBondContact O-NH1 2.87Å | ||
| 71 | G | 63.3 | Low | 66.4 | Low | 48 Ų | 48 | 73.1 Ų | 73.1 | 50% | 0.495 | 39% | 0.387 | S | S | . | . | trans | 65 | 13.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | R101 | G71-R101 VanDerWaalsContact CA-NH1 3.29Å; G71-R101 PolarHBondContact O-NH1 3.43Å; G71-R101 PolarHBondContact O-NH2 3.45Å | ||
| 72 | L | 65.3 | Low | 66.5 | Low | 26 Ų | 26 | 79 Ų | 79 | 14% | 0.136 | 41% | 0.405 | C | S | . | . | trans | -55.1 | 133.4 | -177 | -80.2 | 161 | 0 | 0 | 0 | 112 | T70 I97 | T70-L72 PolarHBondContact O-N 3.2Å; L72-I97 HydrophobicContact CD1-CD1 3.97Å; L72-I97 HydrophobicContact CD1-CG2 3.99Å; L72-I97 HydrophobicContact CD2-CD1 4.24Å; L72-I97 HydrophobicContact CD2-CG2 3.62Å; L72-I97 HydrophobicContact CG-CG2 3.85Å | ||
| 73 | D | 69.4 | Low | 66.3 | Low | 102 Ų | 102 | 80.8 Ų | 80.8 | 55% | 0.545 | 42% | 0.415 | S | S | . | . | trans | -78.2 | 156.5 | 176.2 | -166.3 | -89.9 | 0 | 0 | 0 | 110.8 | E75 S76 L77 | D73-E75 PolarHBondContact O-N 3.01Å; D73-E75 VanDerWaalsContact O-N 3.13Å; D73-E75 PolarHBondContact OD1-N 3.12Å; D73-S76 WeakPolarHBondContact O-CB 3.3Å; D73-S76 PolarHBondContact O-N 2.78Å; D73-L77 PolarHBondContact O-N 3.41Å | ||
| 74 | M | 64.1 | Low | 66.3 | Low | 121 Ų | 121 | 78.1 Ų | 78.1 | 60% | 0.596 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -52.3 | -37.4 | -178.7 | -76.4 | -173.1 | -166.7 | 0 | 0 | 112.5 | L62 L77 S78 | L62-M74 HydrophobicContact CD1-CE 4.02Å; L62-M74 HydrophobicContact CD1-CG 3.94Å; L62-M74 HydrophobicContact CD2-CG 4.43Å; M74-L77 PolarHBondContact O-N 2.84Å; M74-S78 PolarHBondContact O-N 3.47Å; M74-S78 VanDerWaalsContact O-N 3.13Å |
| 75 | E | 70.1 | Confident | 66.3 | Low | 145 Ų | 145 | 78.5 Ų | 78.5 | 68% | 0.678 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -67.8 | -45.8 | 178.4 | -164.2 | 178 | 111.9 | 0 | 0 | 111.4 | D73 L77 S78 I79 | D73-E75 PolarHBondContact O-N 3.01Å; D73-E75 VanDerWaalsContact O-N 3.13Å; D73-E75 PolarHBondContact OD1-N 3.12Å; E75-L77 VanDerWaalsContact C-N 3.29Å; E75-L77 PolarHBondContact O-N 2.77Å; E75-S78 PolarHBondContact O-N 3.26Å; E75-S78 PolarHBondContact O-OG 2.86Å; E75-I79 WeakPolarHBondContact O-CG1 3.42Å; E75-I79 PolarHBondContact O-N 3.35Å |
| 76 | S | 69.8 | Low | 66.2 | Low | 47 Ų | 47 | 85.1 Ų | 85.1 | 33% | 0.329 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -64.1 | -36.4 | 177.3 | -58.9 | 0 | 0 | 0 | 0 | 111.9 | D73 I79 C80 | D73-S76 WeakPolarHBondContact O-CB 3.3Å; D73-S76 PolarHBondContact O-N 2.78Å; S76-I79 PolarHBondContact O-N 2.92Å; S76-C80 PolarHBondContact O-N 2.92Å; S76-C80 PolarHBondContact O-SG 3.15Å |
| 77 | L | 69.2 | Low | 66 | Low | 4 Ų | 4 | 78.6 Ų | 78.6 | 2% | 0.021 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -67.9 | -39.5 | 179.9 | -155.3 | 150.2 | 0 | 0 | 0 | 111.5 | M58 L61 L62 S65 D73 M74 E75 I79 C80 V81 | M58-L77 HydrophobicContact SD-CB 4.29Å; M58-L77 HydrophobicContact SD-CD2 3.31Å; M58-L77 WeakPolarHBondContact SD-CD2 3.33Å; M58-L77 HydrophobicContact SD-CG 4.31Å; L61-L77 HydrophobicContact CB-CD1 4.28Å; L61-L77 HydrophobicContact CB-CD2 3.67Å; L61-L77 HydrophobicContact CD2-CD2 3.84Å; L61-L77 HydrophobicContact CG-CD2 4.42Å; L62-L77 HydrophobicContact CB-CD1 4.48Å; L62-L77 HydrophobicContact CD2-CD1 3.59Å; L62-L77 HydrophobicContact CG-CD1 3.86Å; S65-L77 WeakPolarHBondContact OG-CD1 3.46Å; D73-L77 PolarHBondContact O-N 3.41Å; M74-L77 PolarHBondContact O-N 2.84Å; E75-L77 VanDerWaalsContact C-N 3.29Å; E75-L77 PolarHBondContact O-N 2.77Å; L77-I79 VanDerWaalsContact C-N 3.27Å; L77-I79 PolarHBondContact O-N 3.5Å; L77-C80 WeakPolarHBondContact O-CB 3.47Å; L77-C80 PolarHBondContact O-N 3.15Å; L77-C80 VanDerWaalsContact O-N 3.12Å; L77-V81 HydrophobicContact CD2-CG2 3.95Å; L77-V81 WeakPolarHBondContact O-CG2 3.45Å; L77-V81 PolarHBondContact O-N 3.01Å |
| 78 | S | 69.1 | Low | 66.1 | Low | 46 Ų | 46 | 74.9 Ų | 74.9 | 32% | 0.322 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -59 | -39.1 | 174.1 | 79.6 | 0 | 0 | 0 | 0 | 112.4 | M74 E75 V81 R82 | M74-S78 PolarHBondContact O-N 3.47Å; M74-S78 VanDerWaalsContact O-N 3.13Å; E75-S78 PolarHBondContact O-N 3.26Å; E75-S78 PolarHBondContact O-OG 2.86Å; S78-V81 PolarHBondContact O-N 2.72Å; S78-R82 WeakPolarHBondContact O-CG 3.4Å; S78-R82 PolarHBondContact O-N 2.88Å |
| 79 | I | 72.8 | Confident | 66.3 | Low | 90 Ų | 90 | 75.8 Ų | 75.8 | 46% | 0.462 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -68.1 | -41.6 | 176.4 | -62.5 | 163.5 | 0 | 0 | 0 | 110 | E75 S76 L77 V81 R82 L83 | E75-I79 WeakPolarHBondContact O-CG1 3.42Å; E75-I79 PolarHBondContact O-N 3.35Å; S76-I79 PolarHBondContact O-N 2.92Å; L77-I79 VanDerWaalsContact C-N 3.27Å; L77-I79 PolarHBondContact O-N 3.5Å; I79-V81 VanDerWaalsContact C-N 3.33Å; I79-V81 PolarHBondContact O-N 3.4Å; I79-R82 PolarHBondContact O-N 3.34Å; I79-L83 HydrophobicContact CG2-CD1 3.96Å; I79-L83 HydrophobicContact CG2-CG 4.37Å; I79-L83 WeakPolarHBondContact O-CB 3.3Å; I79-L83 VanDerWaalsContact O-CG 3.29Å; I79-L83 WeakPolarHBondContact O-CG 3.5Å; I79-L83 PolarHBondContact O-N 2.86Å |
| 80 | C | 69.7 | Low | 66.5 | Low | 17 Ų | 17 | 73.1 Ų | 73.1 | 12% | 0.115 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -61.1 | -40.4 | 176.7 | -65.4 | 0 | 0 | 0 | 0 | 112.3 | S76 L77 L83 C84 L93 I97 | S76-C80 PolarHBondContact O-N 2.92Å; S76-C80 PolarHBondContact O-SG 3.15Å; L77-C80 WeakPolarHBondContact O-CB 3.47Å; L77-C80 PolarHBondContact O-N 3.15Å; L77-C80 VanDerWaalsContact O-N 3.12Å; C80-L83 PolarHBondContact O-N 3.26Å; C80-C84 WeakPolarHBondContact O-CB 3.23Å; C80-C84 PolarHBondContact O-N 2.9Å; C80-C84 PolarHBondContact O-SG 3.3Å; C80-C84 VanDerWaalsContact O-SG 3.4Å; C80-L93 HydrophobicContact CB-CD2 3.79Å; C80-I97 WeakPolarHBondContact SG-CD1 3.43Å |
| 81 | V | 70.4 | Confident | 66.4 | Low | 44 Ų | 44 | 80.5 Ų | 80.5 | 27% | 0.267 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.3 | -47.3 | 175.7 | 172.5 | 0 | 0 | 0 | 0 | 110.5 | L61 L77 S78 I79 L83 C84 E85 | L61-V81 HydrophobicContact CD2-CG2 3.49Å; L61-V81 VanDerWaalsContact CD2-CG2 3.49Å; L77-V81 HydrophobicContact CD2-CG2 3.95Å; L77-V81 WeakPolarHBondContact O-CG2 3.45Å; L77-V81 PolarHBondContact O-N 3.01Å; S78-V81 PolarHBondContact O-N 2.72Å; I79-V81 VanDerWaalsContact C-N 3.33Å; I79-V81 PolarHBondContact O-N 3.4Å; V81-L83 VanDerWaalsContact C-N 3.26Å; V81-L83 PolarHBondContact O-N 3.5Å; V81-C84 CarbonylContact O-C 3.58Å; V81-C84 WeakPolarHBondContact O-CB 3.36Å; V81-C84 PolarHBondContact O-N 3.17Å; V81-C84 VanDerWaalsContact O-N 3.13Å; V81-E85 HydrophobicContact CG1-CG 4.45Å; V81-E85 WeakPolarHBondContact O-CG 3.45Å; V81-E85 PolarHBondContact O-N 2.83Å |
| 82 | R | 68.7 | Low | 66.8 | Low | 179 Ų | 179 | 80.8 Ų | 80.8 | 68% | 0.675 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -61.9 | -34.9 | 177.4 | -67.2 | -176.6 | 70.5 | -166 | -0 | 112.9 | S78 I79 Q86 | S78-R82 WeakPolarHBondContact O-CG 3.4Å; S78-R82 PolarHBondContact O-N 2.88Å; I79-R82 PolarHBondContact O-N 3.34Å; R82-Q86 WeakPolarHBondContact O-CG 3.44Å; R82-Q86 PolarHBondContact O-N 2.91Å |
| 83 | L | 64.3 | Low | 67 | Low | 56 Ų | 56 | 80.7 Ų | 80.7 | 29% | 0.293 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -70.9 | -40.8 | 174.6 | -74.8 | 175.2 | 0 | 0 | 0 | 111.6 | I79 C80 V81 E85 Q86 I88 L93 | I79-L83 HydrophobicContact CG2-CD1 3.96Å; I79-L83 HydrophobicContact CG2-CG 4.37Å; I79-L83 WeakPolarHBondContact O-CB 3.3Å; I79-L83 VanDerWaalsContact O-CG 3.29Å; I79-L83 WeakPolarHBondContact O-CG 3.5Å; I79-L83 PolarHBondContact O-N 2.86Å; C80-L83 PolarHBondContact O-N 3.26Å; V81-L83 VanDerWaalsContact C-N 3.26Å; V81-L83 PolarHBondContact O-N 3.5Å; L83-E85 VanDerWaalsContact C-N 3.33Å; L83-Q86 WeakPolarHBondContact O-CB 3.03Å; L83-Q86 PolarHBondContact O-N 2.82Å; L83-Q86 VanDerWaalsContact O-N 3.15Å; L83-I88 HydrophobicContact CB-CD1 4.04Å; L83-I88 HydrophobicContact CD2-CD1 3.92Å; L83-I88 HydrophobicContact CG-CD1 4.49Å; L83-I88 VanDerWaalsContact O-CB 3.31Å; L83-I88 WeakPolarHBondContact O-CB 3.49Å; L83-I88 VanDerWaalsContact O-CG1 3.27Å; L83-I88 WeakPolarHBondContact O-CG1 3.23Å; L83-I88 PolarHBondContact O-N 3.49Å; L83-L93 HydrophobicContact CD1-CD1 4.26Å |
| 84 | C | 65.1 | Low | 67.1 | Low | 48 Ų | 48 | 77.7 Ų | 77.7 | 32% | 0.324 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -63.8 | -37.1 | 172.1 | -77.2 | 0 | 0 | 0 | 0 | 112 | C80 V81 Q86 G87 | C80-C84 WeakPolarHBondContact O-CB 3.23Å; C80-C84 PolarHBondContact O-N 2.9Å; C80-C84 PolarHBondContact O-SG 3.3Å; C80-C84 VanDerWaalsContact O-SG 3.4Å; V81-C84 CarbonylContact O-C 3.58Å; V81-C84 WeakPolarHBondContact O-CB 3.36Å; V81-C84 PolarHBondContact O-N 3.17Å; V81-C84 VanDerWaalsContact O-N 3.13Å; C84-Q86 PolarHBondContact O-N 2.94Å; C84-G87 PolarHBondContact O-N 3.42Å |
| 85 | E | 65.1 | Low | 67.5 | Low | 91 Ų | 91 | 74.4 Ų | 74.4 | 43% | 0.425 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -62.6 | -25.9 | 173.6 | -73.8 | 178 | 144.7 | 0 | 0 | 112.4 | S45 V81 L83 G87 | S45-E85 PolarHBondContact OG-OE1 3Å; V81-E85 HydrophobicContact CG1-CG 4.45Å; V81-E85 WeakPolarHBondContact O-CG 3.45Å; V81-E85 PolarHBondContact O-N 2.83Å; L83-E85 VanDerWaalsContact C-N 3.33Å; E85-G87 PolarHBondContact O-N 3.23Å |
| 86 | Q | 62.2 | Low | 67.7 | Low | 156 Ų | 156 | 71.5 Ų | 71.5 | 73% | 0.729 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.3 | 4.7 | 172 | -68.3 | -170.8 | -12.1 | 0 | 0 | 113.6 | R82 L83 C84 | R82-Q86 WeakPolarHBondContact O-CG 3.44Å; R82-Q86 PolarHBondContact O-N 2.91Å; L83-Q86 WeakPolarHBondContact O-CB 3.03Å; L83-Q86 PolarHBondContact O-N 2.82Å; L83-Q86 VanDerWaalsContact O-N 3.15Å; C84-Q86 PolarHBondContact O-N 2.94Å |
| 87 | G | 61.9 | Low | 67.9 | Low | 36 Ų | 36 | 70.2 Ų | 70.2 | 37% | 0.371 | 39% | 0.39 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 86.9 | 19.4 | 178 | 0 | 0 | 0 | 0 | 0 | 113.9 | C84 E85 | C84-G87 PolarHBondContact O-N 3.42Å; E85-G87 PolarHBondContact O-N 3.23Å |
| 88 | I | 60.9 | Low | 68.1 | Low | 67 Ų | 67 | 74.5 Ų | 74.5 | 34% | 0.344 | 41% | 0.409 | S | S | . | . | trans | -75 | 132 | 175.1 | -60.9 | -172.1 | 0 | 0 | 0 | 109.9 | L83 P90 L93 | L83-I88 HydrophobicContact CB-CD1 4.04Å; L83-I88 HydrophobicContact CD2-CD1 3.92Å; L83-I88 HydrophobicContact CG-CD1 4.49Å; L83-I88 VanDerWaalsContact O-CB 3.31Å; L83-I88 WeakPolarHBondContact O-CB 3.49Å; L83-I88 VanDerWaalsContact O-CG1 3.27Å; L83-I88 WeakPolarHBondContact O-CG1 3.23Å; L83-I88 PolarHBondContact O-N 3.49Å; I88-P90 WeakPolarHBondContact O-CD 3.49Å; I88-L93 HydrophobicContact CG2-CB 4.33Å; I88-L93 HydrophobicContact CG2-CD1 4.3Å | ||
| 89 | N | 65.3 | Low | 68.4 | Low | 113 Ų | 113 | 78.1 Ų | 78.1 | 60% | 0.604 | 42% | 0.42 | S | S | * | . | trans | -63 | 121.9 | 178.1 | -69.2 | -44.5 | 0 | 0 | 0 | 110.4 | E91 A92 L93 | N89-E91 PolarHBondContact O-N 3.18Å; N89-A92 HydrophobicContact CB-CB 4.13Å; N89-A92 PolarHBondContact O-N 3.1Å; N89-L93 PolarHBondContact O-N 3.4Å | ||
| 90 | P | 65.4 | Low | 68.5 | Low | 90 Ų | 90 | 79.1 Ų | 79.1 | 58% | 0.584 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -63.8 | -28.7 | -177.9 | 24.8 | -33.9 | 0 | 0 | 0 | 112.2 | I88 L93 S94 | I88-P90 WeakPolarHBondContact O-CD 3.49Å; P90-L93 PolarHBondContact O-N 3.03Å; P90-S94 WeakPolarHBondContact O-CB 3.4Å; P90-S94 PolarHBondContact O-N 3.09Å |
| 91 | E | 62 | Low | 68.5 | Low | 165 Ų | 165 | 82 Ų | 82 | 77% | 0.771 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -64.9 | -47.8 | 175.7 | -164.2 | 179.3 | 126 | 0 | 0 | 111.6 | N89 S94 A95 | N89-E91 PolarHBondContact O-N 3.18Å; E91-S94 PolarHBondContact O-N 3.44Å; E91-S94 PolarHBondContact O-OG 3.41Å; E91-A95 PolarHBondContact O-N 3.34Å |
| 92 | A | 72.5 | Confident | 68.5 | Low | 54 Ų | 54 | 86.1 Ų | 86.1 | 45% | 0.446 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -65.2 | -40.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | N89 S94 A95 V96 | N89-A92 HydrophobicContact CB-CB 4.13Å; N89-A92 PolarHBondContact O-N 3.1Å; A92-S94 VanDerWaalsContact C-N 3.33Å; A92-S94 PolarHBondContact O-N 3.33Å; A92-A95 PolarHBondContact O-N 3.48Å; A92-V96 WeakPolarHBondContact O-CG2 3.41Å; A92-V96 PolarHBondContact O-N 2.95Å; A92-V96 VanDerWaalsContact O-N 3.14Å |
| 93 | L | 69.4 | Low | 68.6 | Low | 24 Ų | 24 | 79.8 Ų | 79.8 | 13% | 0.126 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -61.1 | -42 | 177.4 | -168.3 | 71.4 | 0 | 0 | 0 | 111.4 | C80 L83 I88 N89 P90 A95 V96 I97 | C80-L93 HydrophobicContact CB-CD2 3.79Å; L83-L93 HydrophobicContact CD1-CD1 4.26Å; I88-L93 HydrophobicContact CG2-CB 4.33Å; I88-L93 HydrophobicContact CG2-CD1 4.3Å; N89-L93 PolarHBondContact O-N 3.4Å; P90-L93 PolarHBondContact O-N 3.03Å; L93-A95 VanDerWaalsContact C-N 3.34Å; L93-A95 PolarHBondContact O-N 3.23Å; L93-V96 PolarHBondContact O-N 3.48Å; L93-I97 HydrophobicContact CD1-CD1 4.35Å; L93-I97 HydrophobicContact CD2-CD1 4.29Å; L93-I97 HydrophobicContact CG-CD1 3.77Å; L93-I97 HydrophobicContact CG-CG1 4.5Å; L93-I97 WeakPolarHBondContact O-CB 3.44Å; L93-I97 WeakPolarHBondContact O-CD1 3.22Å; L93-I97 VanDerWaalsContact O-CG1 3.22Å; L93-I97 WeakPolarHBondContact O-CG1 3.49Å; L93-I97 PolarHBondContact O-N 3.22Å |
| 94 | S | 71.4 | Confident | 68.7 | Low | 38 Ų | 38 | 79.4 Ų | 79.4 | 27% | 0.266 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.9 | -38 | 178.7 | 79.9 | 0 | 0 | 0 | 0 | 113.1 | P90 E91 A92 K98 | P90-S94 WeakPolarHBondContact O-CB 3.4Å; P90-S94 PolarHBondContact O-N 3.09Å; E91-S94 PolarHBondContact O-N 3.44Å; E91-S94 PolarHBondContact O-OG 3.41Å; A92-S94 VanDerWaalsContact C-N 3.33Å; A92-S94 PolarHBondContact O-N 3.33Å; S94-K98 WeakPolarHBondContact O-CB 3.4Å; S94-K98 VanDerWaalsContact O-CG 3.3Å; S94-K98 WeakPolarHBondContact O-CG 3.14Å; S94-K98 PolarHBondContact O-N 3.22Å; S94-K98 VanDerWaalsContact O-N 3.07Å |
| 95 | A | 73.3 | Confident | 68.6 | Low | 53 Ų | 53 | 82.8 Ų | 82.8 | 44% | 0.438 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -68 | -46.6 | 178 | 0 | 0 | 0 | 0 | 0 | 111.2 | E91 A92 L93 I97 K98 E99 | E91-A95 PolarHBondContact O-N 3.34Å; A92-A95 PolarHBondContact O-N 3.48Å; L93-A95 VanDerWaalsContact C-N 3.34Å; L93-A95 PolarHBondContact O-N 3.23Å; A95-I97 PolarHBondContact O-N 3.39Å; A95-K98 PolarHBondContact O-N 3.23Å; A95-E99 WeakPolarHBondContact O-CG 3.48Å; A95-E99 PolarHBondContact O-N 2.95Å |
| 96 | V | 74.1 | Confident | 68.4 | Low | 83 Ų | 83 | 83.1 Ų | 83.1 | 50% | 0.503 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -62.7 | -42.2 | 178 | 174.7 | 0 | 0 | 0 | 0 | 111.2 | A92 L93 E99 L100 | A92-V96 WeakPolarHBondContact O-CG2 3.41Å; A92-V96 PolarHBondContact O-N 2.95Å; A92-V96 VanDerWaalsContact O-N 3.14Å; L93-V96 PolarHBondContact O-N 3.48Å; V96-E99 PolarHBondContact O-N 3.42Å; V96-L100 HydrophobicContact CG1-CD1 3.8Å; V96-L100 HydrophobicContact CG1-CG 4.17Å; V96-L100 VanDerWaalsContact O-CB 3.31Å; V96-L100 WeakPolarHBondContact O-CB 3.33Å; V96-L100 VanDerWaalsContact O-CG 3.26Å; V96-L100 WeakPolarHBondContact O-CG 3.43Å; V96-L100 PolarHBondContact O-N 2.76Å |
| 97 | I | 74.2 | Confident | 68.2 | Low | 21 Ų | 21 | 81.1 Ų | 81.1 | 11% | 0.108 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -64.5 | -41.9 | 177.8 | -71.6 | 167.9 | 0 | 0 | 0 | 111.8 | L72 C80 L93 A95 L100 R101 | L72-I97 HydrophobicContact CD1-CD1 3.97Å; L72-I97 HydrophobicContact CD1-CG2 3.99Å; L72-I97 HydrophobicContact CD2-CD1 4.24Å; L72-I97 HydrophobicContact CD2-CG2 3.62Å; L72-I97 HydrophobicContact CG-CG2 3.85Å; C80-I97 WeakPolarHBondContact SG-CD1 3.43Å; L93-I97 HydrophobicContact CD1-CD1 4.35Å; L93-I97 HydrophobicContact CD2-CD1 4.29Å; L93-I97 HydrophobicContact CG-CD1 3.77Å; L93-I97 HydrophobicContact CG-CG1 4.5Å; L93-I97 WeakPolarHBondContact O-CB 3.44Å; L93-I97 WeakPolarHBondContact O-CD1 3.22Å; L93-I97 VanDerWaalsContact O-CG1 3.22Å; L93-I97 WeakPolarHBondContact O-CG1 3.49Å; L93-I97 PolarHBondContact O-N 3.22Å; A95-I97 PolarHBondContact O-N 3.39Å; I97-L100 PolarHBondContact O-N 2.87Å; I97-R101 WeakPolarHBondContact O-CB 3.34Å; I97-R101 WeakPolarHBondContact O-CG 3.49Å; I97-R101 PolarHBondContact O-N 2.89Å |
| 98 | K | 73.1 | Confident | 67.8 | Low | 94 Ų | 94 | 86.1 Ų | 86.1 | 41% | 0.409 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -61.8 | -45.6 | 176.8 | -78.9 | 174.3 | 177.5 | 179.2 | 0 | 111.3 | T70 S94 A95 R101 K102 | T70-K98 HydrophobicContact CG2-CG 4.29Å; S94-K98 WeakPolarHBondContact O-CB 3.4Å; S94-K98 VanDerWaalsContact O-CG 3.3Å; S94-K98 WeakPolarHBondContact O-CG 3.14Å; S94-K98 PolarHBondContact O-N 3.22Å; S94-K98 VanDerWaalsContact O-N 3.07Å; A95-K98 PolarHBondContact O-N 3.23Å; K98-R101 PolarHBondContact O-N 3.48Å; K98-K102 WeakPolarHBondContact O-CB 3.48Å; K98-K102 PolarHBondContact O-N 3Å |
| 99 | E | 74.4 | Confident | 67.4 | Low | 121 Ų | 121 | 88.3 Ų | 88.3 | 57% | 0.565 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -66.4 | -43.3 | 177.4 | -71.2 | -58.9 | 131.9 | 0 | 0 | 112 | A95 V96 R101 K102 A103 | A95-E99 WeakPolarHBondContact O-CG 3.48Å; A95-E99 PolarHBondContact O-N 2.95Å; V96-E99 PolarHBondContact O-N 3.42Å; E99-R101 VanDerWaalsContact C-N 3.34Å; E99-R101 PolarHBondContact O-N 2.85Å; E99-K102 PolarHBondContact O-N 2.96Å; E99-A103 VanDerWaalsContact O-CB 3.26Å; E99-A103 WeakPolarHBondContact O-CB 3.3Å; E99-A103 PolarHBondContact O-N 3.29Å |
| 100 | L | 74.2 | Confident | 66.6 | Low | 112 Ų | 112 | 87 Ų | 87 | 59% | 0.586 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -62.9 | -38.5 | 176.6 | -76.5 | 176.9 | 0 | 0 | 0 | 112.4 | V96 I97 S104 | V96-L100 HydrophobicContact CG1-CD1 3.8Å; V96-L100 HydrophobicContact CG1-CG 4.17Å; V96-L100 VanDerWaalsContact O-CB 3.31Å; V96-L100 WeakPolarHBondContact O-CB 3.33Å; V96-L100 VanDerWaalsContact O-CG 3.26Å; V96-L100 WeakPolarHBondContact O-CG 3.43Å; V96-L100 PolarHBondContact O-N 2.76Å; I97-L100 PolarHBondContact O-N 2.87Å; L100-S104 WeakPolarHBondContact O-CB 3.33Å; L100-S104 PolarHBondContact O-N 3.26Å |
| 101 | R | 71.7 | Confident | 65.7 | Low | 78 Ų | 78 | 90.3 Ų | 90.3 | 29% | 0.294 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -68.3 | -46 | 175.7 | -80.8 | -174 | 150.9 | -129.6 | -6.1 | 112.2 | T70 G71 I97 K98 E99 A103 S104 E105 | T70-R101 WeakPolarHBondContact O-CD 3.22Å; T70-R101 PolarHBondContact O-NE 3.11Å; T70-R101 PolarHBondContact O-NH1 2.87Å; G71-R101 VanDerWaalsContact CA-NH1 3.29Å; G71-R101 PolarHBondContact O-NH1 3.43Å; G71-R101 PolarHBondContact O-NH2 3.45Å; I97-R101 WeakPolarHBondContact O-CB 3.34Å; I97-R101 WeakPolarHBondContact O-CG 3.49Å; I97-R101 PolarHBondContact O-N 2.89Å; K98-R101 PolarHBondContact O-N 3.48Å; E99-R101 VanDerWaalsContact C-N 3.34Å; E99-R101 PolarHBondContact O-N 2.85Å; R101-A103 VanDerWaalsContact C-N 3.31Å; R101-A103 PolarHBondContact O-N 3.37Å; R101-S104 PolarHBondContact O-N 3.18Å; R101-E105 WeakPolarHBondContact O-CB 3.25Å; R101-E105 WeakPolarHBondContact O-CG 3.39Å; R101-E105 PolarHBondContact O-N 2.9Å |
| 102 | K | 69.8 | Low | 64.8 | Low | 130 Ų | 130 | 89.4 Ų | 89.4 | 57% | 0.565 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -60.1 | -42.6 | 176.1 | -171.7 | -178.2 | 178.9 | -171.2 | 0 | 111.8 | K98 E99 T106 | K98-K102 WeakPolarHBondContact O-CB 3.48Å; K98-K102 PolarHBondContact O-N 3Å; E99-K102 PolarHBondContact O-N 2.96Å; K102-T106 WeakPolarHBondContact O-CB 3.5Å; K102-T106 PolarHBondContact O-N 2.92Å; K102-T106 VanDerWaalsContact O-N 3.14Å; K102-T106 PolarHBondContact O-OG1 3.18Å |
| 103 | A | 70.8 | Confident | 63.3 | Low | 46 Ų | 46 | 92.5 Ų | 92.5 | 38% | 0.38 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.6 | -42.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | E99 R101 T106 L107 | E99-A103 VanDerWaalsContact O-CB 3.26Å; E99-A103 WeakPolarHBondContact O-CB 3.3Å; E99-A103 PolarHBondContact O-N 3.29Å; R101-A103 VanDerWaalsContact C-N 3.31Å; R101-A103 PolarHBondContact O-N 3.37Å; A103-T106 PolarHBondContact O-N 2.94Å; A103-L107 WeakPolarHBondContact O-CB 3.32Å; A103-L107 VanDerWaalsContact O-CG 3.23Å; A103-L107 WeakPolarHBondContact O-CG 3.42Å; A103-L107 PolarHBondContact O-N 2.94Å |
| 104 | S | 66.7 | Low | 62 | Low | 47 Ų | 47 | 97.2 Ų | 97.2 | 33% | 0.329 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.9 | -42.3 | 178.7 | -178.3 | 0 | 0 | 0 | 0 | 112.6 | L100 R101 T106 L107 K108 | L100-S104 WeakPolarHBondContact O-CB 3.33Å; L100-S104 PolarHBondContact O-N 3.26Å; R101-S104 PolarHBondContact O-N 3.18Å; S104-T106 VanDerWaalsContact C-N 3.3Å; S104-T106 PolarHBondContact O-N 2.9Å; S104-L107 PolarHBondContact O-N 2.75Å; S104-K108 WeakPolarHBondContact O-CB 3.24Å; S104-K108 VanDerWaalsContact O-CG 3.23Å; S104-K108 WeakPolarHBondContact O-CG 3.44Å; S104-K108 PolarHBondContact O-N 3.26Å; S104-K108 WeakPolarHBondContact OG-CE 3.34Å |
| 105 | E | 62.7 | Low | 60.5 | Low | 120 Ų | 120 | 106.5 Ų | 106.5 | 56% | 0.561 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -62.2 | -40 | 173.9 | -73.6 | 171.3 | -174.3 | 0 | 0 | 111.3 | R101 | R101-E105 WeakPolarHBondContact O-CB 3.25Å; R101-E105 WeakPolarHBondContact O-CG 3.39Å; R101-E105 PolarHBondContact O-N 2.9Å |
| 106 | T | 60.1 | Low | 59.8 | Low | 97 Ų | 97 | 109.2 Ų | 109.2 | 60% | 0.595 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -68 | -36.7 | 175.4 | -53.1 | 0 | 0 | 0 | 0 | 111.9 | K102 A103 S104 | K102-T106 WeakPolarHBondContact O-CB 3.5Å; K102-T106 PolarHBondContact O-N 2.92Å; K102-T106 VanDerWaalsContact O-N 3.14Å; K102-T106 PolarHBondContact O-OG1 3.18Å; A103-T106 PolarHBondContact O-N 2.94Å; S104-T106 VanDerWaalsContact C-N 3.3Å; S104-T106 PolarHBondContact O-N 2.9Å |
| 107 | L | 57.9 | Low | 59.1 | Low | 115 Ų | 115 | 110.5 Ų | 110.5 | 60% | 0.602 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -76 | -34.3 | 179.3 | -75 | 168.2 | 0 | 0 | 0 | 113.1 | A103 S104 V109 S110 E111 | A103-L107 WeakPolarHBondContact O-CB 3.32Å; A103-L107 VanDerWaalsContact O-CG 3.23Å; A103-L107 WeakPolarHBondContact O-CG 3.42Å; A103-L107 PolarHBondContact O-N 2.94Å; S104-L107 PolarHBondContact O-N 2.75Å; L107-V109 PolarHBondContact O-N 2.7Å; L107-S110 WeakPolarHBondContact O-CB 3.23Å; L107-S110 PolarHBondContact O-N 3.02Å; L107-E111 PolarHBondContact O-N 3.46Å |
| 108 | K | 54.7 | Low | 58.2 | Low | 140 Ų | 140 | 115.5 Ų | 115.5 | 61% | 0.609 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -61.3 | -27.4 | 174.5 | -74.8 | 172.2 | -173 | -179.6 | 0 | 112.6 | S104 S110 | S104-K108 WeakPolarHBondContact O-CB 3.24Å; S104-K108 VanDerWaalsContact O-CG 3.23Å; S104-K108 WeakPolarHBondContact O-CG 3.44Å; S104-K108 PolarHBondContact O-N 3.26Å; S104-K108 WeakPolarHBondContact OG-CE 3.34Å; K108-S110 VanDerWaalsContact C-N 3.3Å |
| 109 | V | 52.8 | Low | 57.3 | Low | 113 Ų | 113 | 116.8 Ų | 116.8 | 69% | 0.685 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -69.8 | -27.7 | 173.3 | 174.8 | 0 | 0 | 0 | 0 | 111.8 | L107 | L107-V109 PolarHBondContact O-N 2.7Å |
| 110 | S | 47.3 | Very low | 56.3 | Low | 86 Ų | 86 | 116.5 Ų | 116.5 | 60% | 0.601 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -81.1 | -21.3 | 177.7 | -171.3 | 0 | 0 | 0 | 0 | 113.7 | L107 K108 | L107-S110 WeakPolarHBondContact O-CB 3.23Å; L107-S110 PolarHBondContact O-N 3.02Å; K108-S110 VanDerWaalsContact C-N 3.3Å |
| 111 | E | 47.3 | Very low | 55.1 | Low | 159 Ų | 159 | 116.8 Ų | 116.8 | 74% | 0.743 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.8 | -1 | -176.4 | -139.7 | 173 | 131.2 | 0 | 0 | 113.4 | L107 | L107-E111 PolarHBondContact O-N 3.46Š|
| 112 | N | 41.7 | Very low | 53.9 | Low | 146 Ų | 146 | 119.6 Ų | 119.6 | 78% | 0.781 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.3 | 11.3 | 178.7 | -144.2 | 52.1 | 0 | 0 | 0 | 114.2 | ||
| 113 | C | 41.7 | Very low | 52.7 | Low | 119 Ų | 119 | 118.8 Ų | 118.8 | 80% | 0.804 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -110 | 15.9 | 173 | -78.7 | 0 | 0 | 0 | 0 | 113.5 | ||
| 114 | T | 43.1 | Very low | 51.2 | Low | 123 Ų | 123 | 124.8 Ų | 124.8 | 76% | 0.755 | 69% | 0.692 | S | S | * | * | trans | -121.8 | 41.5 | 177.6 | 8.5 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 115 | N | 38.1 | Very low | 49.8 | Very low | 233 Ų | 233 | 131.9 Ų | 131.9 | 100% | 1.246 | 73% | 0.726 | S | S | * | * | trans | -131.1 | 0 | 159.3 | -144.1 | -19 | 0 | 0 | 0 | 109.7 |
Retrieved 115 of 115 residues in 107.1 ms
(Link to these results)