| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 46.7 | Very low | 63.3 | Low | 245 Ų | 245 | 150.5 Ų | 150.5 | 100% | 1.207 | 86% | 0.86 | S | S | * | * | 0 | 113.7 | 0 | -84 | -80.7 | -179 | 0 | 0 | 107.9 | |||||
| 2 | A | 50.8 | Low | 63.4 | Low | 102 Ų | 102 | 148.3 Ų | 148.3 | 84% | 0.843 | 86% | 0.855 | S | S | * | * | trans | 45.6 | 93.4 | 170.2 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 3 | A | 58.4 | Low | 63.8 | Low | 97 Ų | 97 | 143.2 Ų | 143.2 | 80% | 0.802 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 138.5 | 159.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||
| 4 | P | 64 | Low | 63.6 | Low | 123 Ų | 123 | 142.2 Ų | 142.2 | 80% | 0.799 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 134.8 | -172.9 | 28.7 | -32.2 | 0 | 0 | 0 | 112 | R6 | P4-R6 PolarHBondContact O-N 3.34Š|
| 5 | L | 61 | Low | 62.9 | Low | 177 Ų | 177 | 148.7 Ų | 148.7 | 93% | 0.927 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 121 | 176.2 | -68.3 | 168.6 | 0 | 0 | 0 | 110.2 | ||
| 6 | R | 70.8 | Confident | 62.3 | Low | 236 Ų | 236 | 154.6 Ų | 154.6 | 89% | 0.891 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 143.4 | 173.7 | -82.3 | -171.7 | 172.9 | -153.2 | -0.9 | 110.8 | P4 | P4-R6 PolarHBondContact O-N 3.34Š|
| 7 | P | 67.9 | Low | 61.5 | Low | 122 Ų | 122 | 154.8 Ų | 154.8 | 79% | 0.792 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 143 | -178.9 | -1.3 | 13.7 | 0 | 0 | 0 | 111.8 | ||
| 8 | V | 72.1 | Confident | 61 | Low | 137 Ų | 137 | 152.6 Ų | 152.6 | 83% | 0.83 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 128.9 | 176.4 | 174.3 | 0 | 0 | 0 | 0 | 109.9 | ||
| 9 | P | 71.9 | Confident | 60.2 | Low | 105 Ų | 105 | 151.8 Ų | 151.8 | 68% | 0.682 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 147.6 | 177.9 | 27.7 | -32.4 | 0 | 0 | 0 | 111.4 | ||
| 10 | P | 66.9 | Low | 59.7 | Low | 126 Ų | 126 | 150.8 Ų | 150.8 | 82% | 0.818 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 141.4 | -176.9 | 27.8 | -33.1 | 0 | 0 | 0 | 111 | ||
| 11 | Q | 66.3 | Low | 59.2 | Low | 186 Ų | 186 | 147.4 Ų | 147.4 | 87% | 0.869 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 142.1 | 179.5 | -66.4 | -165.2 | 26.2 | 0 | 0 | 111.4 | A13 | Q11-A13 PolarHBondContact O-N 3.42Š|
| 12 | P | 64.2 | Low | 59.4 | Low | 124 Ų | 124 | 140.3 Ų | 140.3 | 81% | 0.805 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 127.9 | -178.3 | 27.4 | -31.3 | 0 | 0 | 0 | 110.3 | ||
| 13 | A | 68.6 | Low | 59.5 | Low | 82 Ų | 82 | 143 Ų | 143 | 68% | 0.678 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 146.8 | 171 | 0 | 0 | 0 | 0 | 0 | 110.9 | Q11 R15 | Q11-A13 PolarHBondContact O-N 3.42Å; A13-R15 PolarHBondContact O-N 3.46Å |
| 14 | P | 60.2 | Low | 59.3 | Low | 129 Ų | 129 | 140.6 Ų | 140.6 | 84% | 0.838 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 116.5 | -177.1 | 25.1 | -32.2 | 0 | 0 | 0 | 109.4 | R16 | P14-R16 PolarHBondContact O-N 3.08Å; P14-R16 VanDerWaalsContact O-N 3.08Å |
| 15 | R | 53.4 | Low | 59.1 | Low | 240 Ų | 240 | 140.8 Ų | 140.8 | 91% | 0.906 | 78% | 0.779 | S | S | * | * | trans | -59.2 | 112.6 | 171.6 | -78.9 | -177.5 | 171.2 | 173.9 | -2.6 | 108 | A13 L17 | A13-R15 PolarHBondContact O-N 3.46Å; R15-L17 PolarHBondContact O-N 3.04Å; R15-L17 VanDerWaalsContact O-N 3.13Å | ||
| 16 | R | 54.2 | Low | 59.9 | Low | 243 Ų | 243 | 137.7 Ų | 137.7 | 92% | 0.917 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 118.4 | 160.7 | -82.1 | -174.7 | 175.8 | -160.6 | -0.9 | 107.3 | P14 | P14-R16 PolarHBondContact O-N 3.08Å; P14-R16 VanDerWaalsContact O-N 3.08Å |
| 17 | L | 48.9 | Very low | 60.5 | Low | 158 Ų | 158 | 130.9 Ų | 130.9 | 83% | 0.827 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 136.5 | 171.1 | -85.4 | 104.7 | 0 | 0 | 0 | 109 | R15 T19 | R15-L17 PolarHBondContact O-N 3.04Å; R15-L17 VanDerWaalsContact O-N 3.13Å; L17-T19 PolarHBondContact O-N 3.38Å |
| 18 | P | 52.5 | Low | 61.4 | Low | 114 Ų | 114 | 128.7 Ų | 128.7 | 74% | 0.74 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 122.4 | 168.4 | 27 | -28.9 | 0 | 0 | 0 | 107.8 | T20 | P18-T20 PolarHBondContact O-N 2.86Å; P18-T20 VanDerWaalsContact O-N 3.07Å |
| 19 | T | 44.8 | Very low | 62.1 | Low | 139 Ų | 139 | 126.7 Ų | 126.7 | 85% | 0.853 | 72% | 0.72 | S | S | * | * | trans | -48.8 | 115.1 | 170.8 | -32 | 0 | 0 | 0 | 0 | 108.4 | L17 A21 | L17-T19 PolarHBondContact O-N 3.38Å; T19-A21 PolarHBondContact O-N 3.31Å | ||
| 20 | T | 49.7 | Very low | 62.8 | Low | 130 Ų | 130 | 125.2 Ų | 125.2 | 80% | 0.798 | 71% | 0.709 | S | S | * | * | trans | -60 | 104.7 | 175.3 | 45.8 | 0 | 0 | 0 | 0 | 108.7 | P18 | P18-T20 PolarHBondContact O-N 2.86Å; P18-T20 VanDerWaalsContact O-N 3.07Å | ||
| 21 | A | 50.9 | Low | 63.7 | Low | 81 Ų | 81 | 124.3 Ų | 124.3 | 67% | 0.669 | 70% | 0.697 | S | S | * | * | trans | -63 | 132.2 | 170.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | T19 L23 | T19-A21 PolarHBondContact O-N 3.31Å; A21-L23 PolarHBondContact O-N 3.32Å | ||
| 22 | P | 49.8 | Very low | 64.7 | Low | 95 Ų | 95 | 121.2 Ų | 121.2 | 62% | 0.617 | 68% | 0.683 | S | S | * | * | trans | -77.4 | 94.1 | -173.7 | 30.6 | -31.7 | 0 | 0 | 0 | 109.9 | G24 | P22-G24 PolarHBondContact O-N 2.89Š| ||
| 23 | L | 53.8 | Low | 65.7 | Low | 158 Ų | 158 | 120.8 Ų | 120.8 | 83% | 0.827 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.8 | 4.8 | 170.8 | -85.9 | 161.5 | 0 | 0 | 0 | 114.4 | A21 | A21-L23 PolarHBondContact O-N 3.32Š|
| 24 | G | 53.5 | Low | 66.4 | Low | 48 Ų | 48 | 121.2 Ų | 121.2 | 50% | 0.495 | 66% | 0.66 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -102 | -14.1 | -176.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | P22 | P22-G24 PolarHBondContact O-N 2.89Š|
| 25 | H | 60.6 | Low | 67.6 | Low | 126 Ų | 126 | 121 Ų | 121 | 58% | 0.583 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -72.4 | -39.3 | 177.3 | -95.2 | 72.6 | 0 | 0 | 0 | 111.6 | T27 S28 D29 | H25-T27 PolarHBondContact O-N 3.21Å; H25-S28 PolarHBondContact O-N 2.86Å; H25-D29 WeakPolarHBondContact O-CB 3.47Å; H25-D29 VanDerWaalsContact O-CG 3.32Å; H25-D29 PolarHBondContact O-N 3.42Å; H25-D29 VanDerWaalsContact O-N 3.13Å |
| 26 | D | 76 | Confident | 69.2 | Low | 113 Ų | 113 | 111.5 Ų | 111.5 | 60% | 0.604 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -66.2 | -37.2 | -172.9 | -66.7 | -29.1 | 0 | 0 | 0 | 113.8 | V30 | D26-V30 VanDerWaalsContact O-CB 3.32Å; D26-V30 WeakPolarHBondContact O-CB 3.37Å; D26-V30 WeakPolarHBondContact O-CG2 3.47Å; D26-V30 PolarHBondContact O-N 3.17Å |
| 27 | T | 85 | Confident | 70.6 | Confident | 92 Ų | 92 | 104.4 Ų | 104.4 | 56% | 0.564 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -72.5 | -41.5 | -179.2 | 20.7 | 0 | 0 | 0 | 0 | 112.5 | H25 V30 L31 | H25-T27 PolarHBondContact O-N 3.21Å; T27-V30 PolarHBondContact O-N 3.44Å; T27-L31 WeakPolarHBondContact O-CB 3.44Å; T27-L31 VanDerWaalsContact O-CG 3.28Å; T27-L31 WeakPolarHBondContact O-CG 3.47Å; T27-L31 PolarHBondContact O-N 2.99Å |
| 28 | S | 85.8 | Confident | 72.2 | Confident | 76 Ų | 76 | 102.9 Ų | 102.9 | 53% | 0.531 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -65.7 | -42.8 | 178.2 | -169.5 | 0 | 0 | 0 | 0 | 111.1 | H25 L31 Q32 | H25-S28 PolarHBondContact O-N 2.86Å; S28-L31 PolarHBondContact O-N 3.3Å; S28-Q32 WeakPolarHBondContact O-CB 3.32Å; S28-Q32 PolarHBondContact O-N 3.07Å |
| 29 | D | 87.8 | Confident | 73.8 | Confident | 95 Ų | 95 | 104.1 Ų | 104.1 | 51% | 0.508 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -65.5 | -40.8 | 178.2 | -70.6 | -24.5 | 0 | 0 | 0 | 111.9 | H25 Q32 Q33 | H25-D29 WeakPolarHBondContact O-CB 3.47Å; H25-D29 VanDerWaalsContact O-CG 3.32Å; H25-D29 PolarHBondContact O-N 3.42Å; H25-D29 VanDerWaalsContact O-N 3.13Å; D29-Q32 PolarHBondContact O-N 3.32Å; D29-Q33 WeakPolarHBondContact O-CB 3.14Å; D29-Q33 PolarHBondContact O-N 3.38Å |
| 30 | V | 85.6 | Confident | 75.6 | Confident | 74 Ų | 74 | 99.1 Ų | 99.1 | 45% | 0.448 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -64 | -43.7 | 174.8 | 169.1 | 0 | 0 | 0 | 0 | 111.2 | D26 T27 Q33 I34 | D26-V30 VanDerWaalsContact O-CB 3.32Å; D26-V30 WeakPolarHBondContact O-CB 3.37Å; D26-V30 WeakPolarHBondContact O-CG2 3.47Å; D26-V30 PolarHBondContact O-N 3.17Å; T27-V30 PolarHBondContact O-N 3.44Å; V30-Q33 PolarHBondContact O-N 2.94Å; V30-I34 HydrophobicContact CG1-CD1 3.76Å; V30-I34 HydrophobicContact CG1-CG1 4.42Å; V30-I34 VanDerWaalsContact O-CG1 3.23Å; V30-I34 WeakPolarHBondContact O-CG1 3.44Å; V30-I34 PolarHBondContact O-N 3Å |
| 31 | L | 85.9 | Confident | 77.5 | Confident | 107 Ų | 107 | 95.2 Ų | 95.2 | 56% | 0.56 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63.1 | -44.4 | 176.7 | -72.9 | 173.6 | 0 | 0 | 0 | 111.4 | T27 S28 Q33 I34 M35 | T27-L31 WeakPolarHBondContact O-CB 3.44Å; T27-L31 VanDerWaalsContact O-CG 3.28Å; T27-L31 WeakPolarHBondContact O-CG 3.47Å; T27-L31 PolarHBondContact O-N 2.99Å; S28-L31 PolarHBondContact O-N 3.3Å; L31-Q33 VanDerWaalsContact C-N 3.3Å; L31-Q33 PolarHBondContact O-N 3.18Å; L31-I34 PolarHBondContact O-N 3.07Å; L31-M35 VanDerWaalsContact O-CG 3.31Å; L31-M35 WeakPolarHBondContact O-CG 3.21Å; L31-M35 PolarHBondContact O-N 3.24Å |
| 32 | Q | 86.8 | Confident | 79.3 | Confident | 122 Ų | 122 | 97.5 Ų | 97.5 | 57% | 0.57 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -59.7 | -42.9 | 175 | -171.5 | 65.5 | 27.9 | 0 | 0 | 111.2 | S28 D29 I34 M35 A36 | S28-Q32 WeakPolarHBondContact O-CB 3.32Å; S28-Q32 PolarHBondContact O-N 3.07Å; D29-Q32 PolarHBondContact O-N 3.32Å; Q32-I34 VanDerWaalsContact C-N 3.35Å; Q32-I34 PolarHBondContact O-N 3Å; Q32-M35 PolarHBondContact O-N 3.5Å; Q32-A36 WeakPolarHBondContact O-CB 3.41Å; Q32-A36 PolarHBondContact O-N 3.22Å |
| 33 | Q | 85.3 | Confident | 81.1 | Confident | 114 Ų | 114 | 99.1 Ų | 99.1 | 53% | 0.533 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64 | -39.7 | 177 | -170.6 | 177.8 | 38.5 | 0 | 0 | 111.9 | D29 V30 L31 A36 I37 | D29-Q33 WeakPolarHBondContact O-CB 3.14Å; D29-Q33 PolarHBondContact O-N 3.38Å; V30-Q33 PolarHBondContact O-N 2.94Å; L31-Q33 VanDerWaalsContact C-N 3.3Å; L31-Q33 PolarHBondContact O-N 3.18Å; Q33-A36 PolarHBondContact O-N 3.2Å; Q33-I37 WeakPolarHBondContact O-CG1 3.3Å; Q33-I37 PolarHBondContact O-N 3.45Å |
| 34 | I | 83.9 | Confident | 82.8 | Confident | 91 Ų | 91 | 96.2 Ų | 96.2 | 47% | 0.467 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.7 | -44.6 | 176.5 | -70.2 | 164.7 | 0 | 0 | 0 | 110.7 | V30 L31 Q32 A36 I37 | V30-I34 HydrophobicContact CG1-CD1 3.76Å; V30-I34 HydrophobicContact CG1-CG1 4.42Å; V30-I34 VanDerWaalsContact O-CG1 3.23Å; V30-I34 WeakPolarHBondContact O-CG1 3.44Å; V30-I34 PolarHBondContact O-N 3Å; L31-I34 PolarHBondContact O-N 3.07Å; Q32-I34 VanDerWaalsContact C-N 3.35Å; Q32-I34 PolarHBondContact O-N 3Å; I34-A36 VanDerWaalsContact C-N 3.3Å; I34-A36 PolarHBondContact O-N 3.07Å; I34-I37 VanDerWaalsContact O-CB 3.28Å; I34-I37 WeakPolarHBondContact O-CB 3.37Å; I34-I37 WeakPolarHBondContact O-CG1 3.42Å; I34-I37 PolarHBondContact O-N 2.9Å |
| 35 | M | 85.4 | Confident | 84.3 | Confident | 126 Ų | 126 | 95.9 Ų | 95.9 | 62% | 0.621 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -60.8 | -41.3 | 178.1 | -71.2 | 177.4 | 66.1 | 0 | 0 | 111.4 | L31 Q32 I37 T38 | L31-M35 VanDerWaalsContact O-CG 3.31Å; L31-M35 WeakPolarHBondContact O-CG 3.21Å; L31-M35 PolarHBondContact O-N 3.24Å; Q32-M35 PolarHBondContact O-N 3.5Å; M35-I37 PolarHBondContact O-N 3.13Å; M35-T38 PolarHBondContact O-N 3.05Å; M35-T38 PolarHBondContact O-OG1 3.23Å |
| 36 | A | 86.9 | Confident | 85.5 | Confident | 39 Ų | 39 | 94.3 Ų | 94.3 | 32% | 0.322 | 52% | 0.515 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.4 | -2.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | Q32 Q33 I34 Q40 | Q32-A36 WeakPolarHBondContact O-CB 3.41Å; Q32-A36 PolarHBondContact O-N 3.22Å; Q33-A36 PolarHBondContact O-N 3.2Å; I34-A36 VanDerWaalsContact C-N 3.3Å; I34-A36 PolarHBondContact O-N 3.07Å; A36-Q40 PolarHBondContact O-NE2 3Å; A36-Q40 VanDerWaalsContact O-NE2 3.14Å |
| 37 | I | 83.3 | Confident | 86 | Confident | 94 Ų | 94 | 91.9 Ų | 91.9 | 48% | 0.482 | 51% | 0.511 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -31.3 | 171.1 | -61.2 | 174.9 | 0 | 0 | 0 | 111.2 | Q33 I34 M35 D39 Q40 | Q33-I37 WeakPolarHBondContact O-CG1 3.3Å; Q33-I37 PolarHBondContact O-N 3.45Å; I34-I37 VanDerWaalsContact O-CB 3.28Å; I34-I37 WeakPolarHBondContact O-CB 3.37Å; I34-I37 WeakPolarHBondContact O-CG1 3.42Å; I34-I37 PolarHBondContact O-N 2.9Å; M35-I37 PolarHBondContact O-N 3.13Å; I37-D39 PolarHBondContact O-N 3.24Å; I37-Q40 VanDerWaalsContact CA-NE2 3.3Å; I37-Q40 PolarHBondContact O-N 3.28Å |
| 38 | T | 83.1 | Confident | 86 | Confident | 126 Ų | 126 | 92.3 Ų | 92.3 | 77% | 0.773 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.8 | -26.1 | -178.8 | -40 | 0 | 0 | 0 | 0 | 112.4 | M35 | M35-T38 PolarHBondContact O-N 3.05Å; M35-T38 PolarHBondContact O-OG1 3.23Å |
| 39 | D | 85.9 | Confident | 85.9 | Confident | 141 Ų | 141 | 93.2 Ų | 93.2 | 75% | 0.754 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.5 | 0.4 | -176.6 | -54.8 | -48.4 | 0 | 0 | 0 | 113.5 | I37 | I37-D39 PolarHBondContact O-N 3.24Š|
| 40 | Q | 83.4 | Confident | 85.9 | Confident | 33 Ų | 33 | 94.8 Ų | 94.8 | 15% | 0.154 | 50% | 0.501 | C | S | . | . | trans | -71 | 137.3 | -179.2 | -93.6 | 155.7 | 61.2 | 0 | 0 | 112.5 | A36 I37 E44 R48 | A36-Q40 PolarHBondContact O-NE2 3Å; A36-Q40 VanDerWaalsContact O-NE2 3.14Å; I37-Q40 VanDerWaalsContact CA-NE2 3.3Å; I37-Q40 PolarHBondContact O-N 3.28Å; Q40-E44 HydrophobicContact CB-CB 4.4Å; Q40-E44 HydrophobicContact CG-CB 4.17Å; Q40-E44 WeakPolarHBondContact CG-OE2 3.48Å; Q40-R48 VanDerWaalsContact OE1-CD 3.31Å; Q40-R48 VanDerWaalsContact OE1-CZ 3.27Å | ||
| 41 | S | 88.6 | Confident | 86 | Confident | 48 Ų | 48 | 94.3 Ų | 94.3 | 34% | 0.336 | 50% | 0.504 | S | S | . | . | trans | -63.4 | 155.2 | 168.2 | 66.3 | 0 | 0 | 0 | 0 | 111.3 | D43 E44 A45 | S41-D43 PolarHBondContact O-N 3.24Å; S41-E44 PolarHBondContact O-N 2.93Å; S41-E44 WeakPolarHBondContact OG-CB 3.48Å; S41-E44 VanDerWaalsContact OG-CD 3.22Å; S41-E44 WeakPolarHBondContact OG-CG 3.46Å; S41-E44 PolarHBondContact OG-N 2.96Å; S41-E44 PolarHBondContact OG-OE1 3.37Å; S41-A45 PolarHBondContact O-N 2.81Å | ||
| 42 | L | 88.2 | Confident | 85.9 | Confident | 129 Ų | 129 | 95 Ų | 95 | 68% | 0.675 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -56.8 | -38.6 | 176.4 | 179.8 | 62.2 | 0 | 0 | 0 | 111.3 | A45 Q46 | L42-A45 PolarHBondContact O-N 2.95Å; L42-Q46 WeakPolarHBondContact O-CG 3.26Å; L42-Q46 PolarHBondContact O-N 3.13Å |
| 43 | D | 88.9 | Confident | 85.7 | Confident | 129 Ų | 129 | 92.2 Ų | 92.2 | 69% | 0.69 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -66.7 | -43.9 | 178.9 | -68.8 | -27.4 | 0 | 0 | 0 | 111.9 | S41 A45 Q46 A47 | S41-D43 PolarHBondContact O-N 3.24Å; D43-A45 VanDerWaalsContact C-N 3.32Å; D43-A45 PolarHBondContact O-N 3.33Å; D43-Q46 PolarHBondContact O-N 3.45Å; D43-A47 WeakPolarHBondContact O-CB 3.46Å; D43-A47 PolarHBondContact O-N 3.36Å |
| 44 | E | 89.1 | Confident | 85.7 | Confident | 97 Ų | 97 | 91 Ų | 91 | 45% | 0.453 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.4 | -42 | 173.6 | -77.5 | 164.5 | -123.7 | 0 | 0 | 111.9 | Q40 S41 A47 R48 | Q40-E44 HydrophobicContact CB-CB 4.4Å; Q40-E44 HydrophobicContact CG-CB 4.17Å; Q40-E44 WeakPolarHBondContact CG-OE2 3.48Å; S41-E44 PolarHBondContact O-N 2.93Å; S41-E44 WeakPolarHBondContact OG-CB 3.48Å; S41-E44 VanDerWaalsContact OG-CD 3.22Å; S41-E44 WeakPolarHBondContact OG-CG 3.46Å; S41-E44 PolarHBondContact OG-N 2.96Å; S41-E44 PolarHBondContact OG-OE1 3.37Å; E44-A47 PolarHBondContact O-N 2.71Å; E44-R48 WeakPolarHBondContact O-CG 3.38Å; E44-R48 PolarHBondContact O-N 3.43Å |
| 45 | A | 84.9 | Confident | 85.9 | Confident | 41 Ų | 41 | 91.3 Ų | 91.3 | 34% | 0.339 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.1 | -41.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | S41 L42 D43 K49 | S41-A45 PolarHBondContact O-N 2.81Å; L42-A45 PolarHBondContact O-N 2.95Å; D43-A45 VanDerWaalsContact C-N 3.32Å; D43-A45 PolarHBondContact O-N 3.33Å; A45-K49 VanDerWaalsContact O-CB 3.3Å; A45-K49 WeakPolarHBondContact O-CB 3.09Å; A45-K49 PolarHBondContact O-N 2.92Å |
| 46 | Q | 85.5 | Confident | 86.2 | Confident | 94 Ų | 94 | 97 Ų | 97 | 44% | 0.439 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.4 | -40.7 | 174.2 | -68.9 | -54.3 | -47.6 | 0 | 0 | 111.9 | L42 D43 K49 H50 | L42-Q46 WeakPolarHBondContact O-CG 3.26Å; L42-Q46 PolarHBondContact O-N 3.13Å; D43-Q46 PolarHBondContact O-N 3.45Å; Q46-K49 WeakPolarHBondContact O-CB 3.43Å; Q46-K49 PolarHBondContact O-N 3.2Å; Q46-H50 WeakPolarHBondContact O-CB 3.28Å; Q46-H50 PolarHBondContact O-N 2.73Å |
| 47 | A | 87.9 | Confident | 86.2 | Confident | 61 Ų | 61 | 100.2 Ų | 100.2 | 50% | 0.504 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.5 | -45.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | D43 E44 H50 A51 | D43-A47 WeakPolarHBondContact O-CB 3.46Å; D43-A47 PolarHBondContact O-N 3.36Å; E44-A47 PolarHBondContact O-N 2.71Å; A47-H50 PolarHBondContact O-N 2.9Å; A47-A51 PolarHBondContact O-N 3.1Å |
| 48 | R | 84.6 | Confident | 86.3 | Confident | 102 Ų | 102 | 98.9 Ų | 98.9 | 39% | 0.385 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.1 | -42.5 | 174.7 | -71 | -175.8 | -173.5 | -165.1 | 8.7 | 112.2 | Q40 E44 H50 A51 L52 | Q40-R48 VanDerWaalsContact OE1-CD 3.31Å; Q40-R48 VanDerWaalsContact OE1-CZ 3.27Å; E44-R48 WeakPolarHBondContact O-CG 3.38Å; E44-R48 PolarHBondContact O-N 3.43Å; R48-H50 VanDerWaalsContact C-N 3.3Å; R48-H50 PolarHBondContact O-N 2.85Å; R48-A51 PolarHBondContact O-N 3.33Å; R48-L52 WeakPolarHBondContact O-CB 3.45Å; R48-L52 WeakPolarHBondContact O-CG 3.36Å; R48-L52 PolarHBondContact O-N 3.04Å |
| 49 | K | 83.7 | Confident | 86.4 | Confident | 95 Ų | 95 | 97.2 Ų | 97.2 | 41% | 0.413 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58.4 | -42.3 | 173.4 | 176.6 | -172.5 | 168.9 | -168.5 | 0 | 111.4 | A45 Q46 N53 | A45-K49 VanDerWaalsContact O-CB 3.3Å; A45-K49 WeakPolarHBondContact O-CB 3.09Å; A45-K49 PolarHBondContact O-N 2.92Å; Q46-K49 WeakPolarHBondContact O-CB 3.43Å; Q46-K49 PolarHBondContact O-N 3.2Å; K49-N53 WeakPolarHBondContact O-CB 3.39Å; K49-N53 PolarHBondContact O-N 3.49Å; K49-N53 PolarHBondContact O-ND2 3.45Å |
| 50 | H | 86.4 | Confident | 86.5 | Confident | 128 Ų | 128 | 93.2 Ų | 93.2 | 59% | 0.593 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.9 | -47 | 176.9 | -171.6 | 64.5 | 0 | 0 | 0 | 111.6 | Q46 A47 R48 L52 N53 C54 | Q46-H50 WeakPolarHBondContact O-CB 3.28Å; Q46-H50 PolarHBondContact O-N 2.73Å; A47-H50 PolarHBondContact O-N 2.9Å; R48-H50 VanDerWaalsContact C-N 3.3Å; R48-H50 PolarHBondContact O-N 2.85Å; H50-L52 VanDerWaalsContact C-N 3.35Å; H50-L52 PolarHBondContact O-N 2.99Å; H50-N53 WeakPolarHBondContact O-CB 3.23Å; H50-N53 PolarHBondContact O-N 3.16Å; H50-C54 PolarHBondContact O-N 3.32Å; H50-C54 PolarHBondContact O-SG 3.3Å; H50-C54 VanDerWaalsContact O-SG 3.42Å |
| 51 | A | 88 | Confident | 86.6 | Confident | 64 Ų | 64 | 96 Ų | 96 | 53% | 0.529 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -57.8 | -44.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | A47 R48 N53 C54 H55 | A47-A51 PolarHBondContact O-N 3.1Å; R48-A51 PolarHBondContact O-N 3.33Å; A51-N53 VanDerWaalsContact C-N 3.35Å; A51-N53 PolarHBondContact O-N 2.87Å; A51-C54 PolarHBondContact O-N 3.12Å; A51-H55 PolarHBondContact O-N 3.14Å |
| 52 | L | 83.7 | Confident | 86.4 | Confident | 121 Ų | 121 | 96.3 Ų | 96.3 | 63% | 0.634 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.3 | -38.3 | 174.6 | -73.9 | 171.4 | 0 | 0 | 0 | 112.3 | R48 H50 C54 H55 | R48-L52 WeakPolarHBondContact O-CB 3.45Å; R48-L52 WeakPolarHBondContact O-CG 3.36Å; R48-L52 PolarHBondContact O-N 3.04Å; H50-L52 VanDerWaalsContact C-N 3.35Å; H50-L52 PolarHBondContact O-N 2.99Å; L52-C54 VanDerWaalsContact C-N 3.28Å; L52-C54 PolarHBondContact O-N 3.3Å; L52-H55 WeakPolarHBondContact O-CB 3.44Å; L52-H55 PolarHBondContact O-N 3.37Å |
| 53 | N | 82.6 | Confident | 86.1 | Confident | 63 Ų | 63 | 93.6 Ų | 93.6 | 34% | 0.337 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.8 | -31.2 | 177 | -84 | -32.8 | 0 | 0 | 0 | 113 | K49 H50 A51 K58 | K49-N53 WeakPolarHBondContact O-CB 3.39Å; K49-N53 PolarHBondContact O-N 3.49Å; K49-N53 PolarHBondContact O-ND2 3.45Å; H50-N53 WeakPolarHBondContact O-CB 3.23Å; H50-N53 PolarHBondContact O-N 3.16Å; A51-N53 VanDerWaalsContact C-N 3.35Å; A51-N53 PolarHBondContact O-N 2.87Å; N53-K58 VanDerWaalsContact O-CD 3.32Å; N53-K58 WeakPolarHBondContact O-CD 3.28Å; N53-K58 PolarHBondContact OD1-NZ 2.88Å |
| 54 | C | 86.5 | Confident | 86 | Confident | 89 Ų | 89 | 91 Ų | 91 | 60% | 0.601 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.9 | -1.9 | 178.2 | -63.7 | 0 | 0 | 0 | 0 | 113.8 | H50 A51 L52 R56 | H50-C54 PolarHBondContact O-N 3.32Å; H50-C54 PolarHBondContact O-SG 3.3Å; H50-C54 VanDerWaalsContact O-SG 3.42Å; A51-C54 PolarHBondContact O-N 3.12Å; L52-C54 VanDerWaalsContact C-N 3.28Å; L52-C54 PolarHBondContact O-N 3.3Å; C54-R56 PolarHBondContact O-N 3.35Å |
| 55 | H | 87.5 | Confident | 85.8 | Confident | 97 Ų | 97 | 90.6 Ų | 90.6 | 45% | 0.449 | 49% | 0.486 | S | S | . | . | trans | -67.6 | 131.2 | -175.5 | -168.4 | -93.9 | 0 | 0 | 0 | 112.2 | A51 L52 M57 K58 | A51-H55 PolarHBondContact O-N 3.14Å; L52-H55 WeakPolarHBondContact O-CB 3.44Å; L52-H55 PolarHBondContact O-N 3.37Å; H55-M57 VanDerWaalsContact C-N 3.26Å; H55-M57 PolarHBondContact ND1-N 3.5Å; H55-M57 VanDerWaalsContact ND1-N 3.2Å; H55-M57 PolarHBondContact O-N 3.21Å; H55-K58 WeakPolarHBondContact O-CB 3.32Å; H55-K58 PolarHBondContact O-N 3.05Å | ||
| 56 | R | 91 | Very high | 85.5 | Confident | 247 Ų | 247 | 90.2 Ų | 90.2 | 93% | 0.932 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.4 | -33.2 | -174.8 | -166.4 | 176.8 | 173.1 | 170.8 | -1.6 | 113.6 | C54 | C54-R56 PolarHBondContact O-N 3.35Š|
| 57 | M | 88.5 | Confident | 85.3 | Confident | 106 Ų | 106 | 90.8 Ų | 90.8 | 52% | 0.522 | 48% | 0.483 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | -2.1 | 177.6 | -59.2 | -177.1 | 65.9 | 0 | 0 | 114.1 | H55 S59 A60 L61 | H55-M57 VanDerWaalsContact C-N 3.26Å; H55-M57 PolarHBondContact ND1-N 3.5Å; H55-M57 VanDerWaalsContact ND1-N 3.2Å; H55-M57 PolarHBondContact O-N 3.21Å; M57-S59 VanDerWaalsContact C-N 3.27Å; M57-S59 PolarHBondContact O-N 3.42Å; M57-A60 PolarHBondContact O-N 2.85Å; M57-L61 HydrophobicContact CB-CD1 4.06Å; M57-L61 HydrophobicContact CB-CG 4.19Å; M57-L61 PolarHBondContact O-N 3.04Å |
| 58 | K | 85.1 | Confident | 85.1 | Confident | 65 Ų | 65 | 92 Ų | 92 | 28% | 0.283 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -50.4 | -49.2 | -176 | 176.6 | -170.8 | 168.5 | 81.6 | 0 | 111.3 | N53 H55 A60 F62 R170 | N53-K58 VanDerWaalsContact O-CD 3.32Å; N53-K58 WeakPolarHBondContact O-CD 3.28Å; N53-K58 PolarHBondContact OD1-NZ 2.88Å; H55-K58 WeakPolarHBondContact O-CB 3.32Å; H55-K58 PolarHBondContact O-N 3.05Å; K58-A60 PolarHBondContact O-N 3.38Å; K58-F62 WeakPolarHBondContact O-CB 3.27Å; K58-F62 PolarHBondContact O-N 3.41Å; K58-R170 PolarHBondContact NZ-O 3.18Å |
| 59 | S | 84.2 | Confident | 84.9 | Confident | 91 Ų | 91 | 90.4 Ų | 90.4 | 64% | 0.636 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -61.9 | -42.7 | -178.9 | -170.1 | 0 | 0 | 0 | 0 | 112.6 | M57 S63 | M57-S59 VanDerWaalsContact C-N 3.27Å; M57-S59 PolarHBondContact O-N 3.42Å; S59-S63 PolarHBondContact O-N 2.89Å; S59-S63 VanDerWaalsContact O-N 3.1Å; S59-S63 PolarHBondContact O-OG 3.28Å |
| 60 | A | 87.3 | Confident | 84.3 | Confident | 58 Ų | 58 | 88.6 Ų | 88.6 | 48% | 0.479 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -69.8 | -47.6 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | M57 K58 F62 S63 V64 | M57-A60 PolarHBondContact O-N 2.85Å; K58-A60 PolarHBondContact O-N 3.38Å; A60-F62 VanDerWaalsContact C-N 3.32Å; A60-F62 PolarHBondContact O-N 3.2Å; A60-S63 PolarHBondContact O-N 3.49Å; A60-V64 WeakPolarHBondContact O-CG2 3.32Å; A60-V64 PolarHBondContact O-N 3.27Å; A60-V64 VanDerWaalsContact O-N 3.12Å |
| 61 | L | 86 | Confident | 83.9 | Confident | 90 Ų | 90 | 89.7 Ų | 89.7 | 47% | 0.471 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.4 | -42 | 176.5 | -70.2 | 172.8 | 0 | 0 | 0 | 111.2 | M57 S63 V64 L65 | M57-L61 HydrophobicContact CB-CD1 4.06Å; M57-L61 HydrophobicContact CB-CG 4.19Å; M57-L61 PolarHBondContact O-N 3.04Å; L61-S63 PolarHBondContact O-N 3.05Å; L61-V64 PolarHBondContact O-N 3.49Å; L61-L65 WeakPolarHBondContact O-CB 3.48Å; L61-L65 VanDerWaalsContact O-CG 3.26Å; L61-L65 WeakPolarHBondContact O-CG 3.49Å; L61-L65 PolarHBondContact O-N 2.89Å |
| 62 | F | 84.1 | Confident | 83.2 | Confident | 56 Ų | 56 | 91.2 Ų | 91.2 | 25% | 0.246 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -61.2 | -45.1 | 177.8 | -171.9 | -89 | 0 | 0 | 0 | 112 | K58 A60 V64 L65 C66 S169 P173 | K58-F62 WeakPolarHBondContact O-CB 3.27Å; K58-F62 PolarHBondContact O-N 3.41Å; A60-F62 VanDerWaalsContact C-N 3.32Å; A60-F62 PolarHBondContact O-N 3.2Å; F62-V64 PolarHBondContact O-N 3.34Å; F62-L65 PolarHBondContact O-N 2.98Å; F62-C66 WeakPolarHBondContact CE1-SG 3.07Å; F62-C66 WeakPolarHBondContact O-CB 3.36Å; F62-C66 PolarHBondContact O-N 3.42Å; F62-C66 PolarHBondContact O-SG 3.47Å; F62-C66 VanDerWaalsContact O-SG 3.41Å; F62-S169 WeakPolarHBondContact CE2-O 3.33Å; F62-S169 WeakPolarHBondContact CZ-O 3.39Å; F62-P173 HydrophobicContact CD2-CG 4.38Å; F62-P173 HydrophobicContact CE2-CG 4.31Å |
| 63 | S | 83.4 | Confident | 82.2 | Confident | 71 Ų | 71 | 88 Ų | 88 | 50% | 0.497 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -59.6 | -45.1 | 176 | -67.8 | 0 | 0 | 0 | 0 | 112.2 | S59 A60 L61 C66 E67 | S59-S63 PolarHBondContact O-N 2.89Å; S59-S63 VanDerWaalsContact O-N 3.1Å; S59-S63 PolarHBondContact O-OG 3.28Å; A60-S63 PolarHBondContact O-N 3.49Å; L61-S63 PolarHBondContact O-N 3.05Å; S63-C66 WeakPolarHBondContact O-CB 3.45Å; S63-C66 PolarHBondContact O-N 3.45Å; S63-E67 WeakPolarHBondContact O-CB 3.18Å; S63-E67 PolarHBondContact O-N 3.02Å |
| 64 | V | 85.6 | Confident | 80.8 | Confident | 74 Ų | 74 | 91.3 Ų | 91.3 | 45% | 0.448 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.2 | -43.2 | 177.4 | 174.2 | 0 | 0 | 0 | 0 | 111.2 | A60 L61 F62 C66 E67 I68 | A60-V64 WeakPolarHBondContact O-CG2 3.32Å; A60-V64 PolarHBondContact O-N 3.27Å; A60-V64 VanDerWaalsContact O-N 3.12Å; L61-V64 PolarHBondContact O-N 3.49Å; F62-V64 PolarHBondContact O-N 3.34Å; V64-C66 PolarHBondContact O-N 3.46Å; V64-E67 PolarHBondContact O-N 3.07Å; V64-I68 HydrophobicContact CG1-CD1 3.72Å; V64-I68 HydrophobicContact CG1-CG1 4.27Å; V64-I68 VanDerWaalsContact O-CG1 3.29Å; V64-I68 WeakPolarHBondContact O-CG1 3.08Å; V64-I68 PolarHBondContact O-N 3.5Å |
| 65 | L | 84.7 | Confident | 79.1 | Confident | 90 Ų | 90 | 92.3 Ų | 92.3 | 47% | 0.471 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.5 | -37.5 | 177.4 | -69.7 | 172.2 | 0 | 0 | 0 | 112.4 | L61 F62 E67 K69 P173 | L61-L65 WeakPolarHBondContact O-CB 3.48Å; L61-L65 VanDerWaalsContact O-CG 3.26Å; L61-L65 WeakPolarHBondContact O-CG 3.49Å; L61-L65 PolarHBondContact O-N 2.89Å; F62-L65 PolarHBondContact O-N 2.98Å; L65-E67 VanDerWaalsContact C-N 3.34Å; L65-K69 VanDerWaalsContact O-CB 3.24Å; L65-K69 WeakPolarHBondContact O-CB 3.42Å; L65-K69 PolarHBondContact O-N 3.25Å; L65-P173 HydrophobicContact CB-CB 4.42Å; L65-P173 HydrophobicContact CB-CG 3.57Å; L65-P173 HydrophobicContact CD1-CG 4.16Å |
| 66 | C | 79.3 | Confident | 77.5 | Confident | 33 Ų | 33 | 90.4 Ų | 90.4 | 22% | 0.223 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -61.6 | -42.9 | 171.6 | -79.6 | 0 | 0 | 0 | 0 | 111.5 | F62 S63 V64 K69 G70 | F62-C66 WeakPolarHBondContact CE1-SG 3.07Å; F62-C66 WeakPolarHBondContact O-CB 3.36Å; F62-C66 PolarHBondContact O-N 3.42Å; F62-C66 PolarHBondContact O-SG 3.47Å; F62-C66 VanDerWaalsContact O-SG 3.41Å; S63-C66 WeakPolarHBondContact O-CB 3.45Å; S63-C66 PolarHBondContact O-N 3.45Å; V64-C66 PolarHBondContact O-N 3.46Å; C66-K69 PolarHBondContact O-N 2.89Å; C66-G70 PolarHBondContact O-N 2.83Å |
| 67 | E | 81.4 | Confident | 75.3 | Confident | 105 Ų | 105 | 87 Ų | 87 | 49% | 0.491 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66.5 | -45.3 | 177.9 | -173.4 | 179.2 | 174.4 | 0 | 0 | 111.8 | S63 V64 L65 G70 K71 | S63-E67 WeakPolarHBondContact O-CB 3.18Å; S63-E67 PolarHBondContact O-N 3.02Å; V64-E67 PolarHBondContact O-N 3.07Å; L65-E67 VanDerWaalsContact C-N 3.34Å; E67-G70 PolarHBondContact O-N 2.88Å; E67-K71 HydrophobicContact CG-CD 4.21Å; E67-K71 WeakPolarHBondContact O-CG 3.47Å; E67-K71 PolarHBondContact O-N 3.48Å; E67-K71 VanDerWaalsContact OE1-CE 3.26Å; E67-K71 WeakPolarHBondContact OE1-CE 3.36Å; E67-K71 IonicContact OE1-NZ 3.38Å; E67-K71 PolarHBondContact OE1-NZ 2.9Å |
| 68 | I | 83.6 | Confident | 73.5 | Confident | 87 Ų | 87 | 89.8 Ų | 89.8 | 45% | 0.446 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.3 | -48.7 | 174 | -67.5 | 168.4 | 0 | 0 | 0 | 109.6 | V64 G70 K71 T72 | V64-I68 HydrophobicContact CG1-CD1 3.72Å; V64-I68 HydrophobicContact CG1-CG1 4.27Å; V64-I68 VanDerWaalsContact O-CG1 3.29Å; V64-I68 WeakPolarHBondContact O-CG1 3.08Å; V64-I68 PolarHBondContact O-N 3.5Å; I68-G70 VanDerWaalsContact C-N 3.28Å; I68-G70 PolarHBondContact O-N 3.32Å; I68-K71 PolarHBondContact O-N 3.35Å; I68-K71 VanDerWaalsContact O-N 3.11Å; I68-T72 VanDerWaalsContact O-CB 3.27Å; I68-T72 WeakPolarHBondContact O-CB 3.4Å; I68-T72 PolarHBondContact O-N 2.96Å; I68-T72 PolarHBondContact O-OG1 3.07Å |
| 69 | K | 79.5 | Confident | 71.7 | Confident | 69 Ų | 69 | 94.8 Ų | 94.8 | 30% | 0.3 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -57 | -43.8 | 176.7 | -171.7 | -177.3 | -174.1 | -174.5 | 0 | 111.1 | L65 C66 K71 T72 A73 P173 E178 | L65-K69 VanDerWaalsContact O-CB 3.24Å; L65-K69 WeakPolarHBondContact O-CB 3.42Å; L65-K69 PolarHBondContact O-N 3.25Å; C66-K69 PolarHBondContact O-N 2.89Å; K69-K71 VanDerWaalsContact C-N 3.34Å; K69-K71 PolarHBondContact O-N 3.21Å; K69-T72 PolarHBondContact O-N 2.96Å; K69-A73 WeakPolarHBondContact O-CB 3.48Å; K69-A73 PolarHBondContact O-N 2.6Å; K69-P173 HydrophobicContact CD-CB 4.39Å; K69-P173 PolarHBondContact NZ-O 2.95Å; K69-E178 IonicContact NZ-OE1 3.75Å; K69-E178 PolarHBondContact NZ-OE1 3.41Å; K69-E178 IonicContact NZ-OE2 3.38Å; K69-E178 PolarHBondContact NZ-OE2 3.47Å |
| 70 | G | 72.6 | Confident | 69.8 | Low | 56 Ų | 56 | 98.9 Ų | 98.9 | 58% | 0.577 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63.1 | -37.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | C66 E67 I68 | C66-G70 PolarHBondContact O-N 2.83Å; E67-G70 PolarHBondContact O-N 2.88Å; I68-G70 VanDerWaalsContact C-N 3.28Å; I68-G70 PolarHBondContact O-N 3.32Å |
| 71 | K | 76.8 | Confident | 67.9 | Low | 151 Ų | 151 | 104.8 Ų | 104.8 | 66% | 0.657 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -80.2 | -31.2 | 178.7 | -69.4 | 175 | -176.4 | 175.5 | 0 | 113.4 | E67 I68 K69 | E67-K71 HydrophobicContact CG-CD 4.21Å; E67-K71 WeakPolarHBondContact O-CG 3.47Å; E67-K71 PolarHBondContact O-N 3.48Å; E67-K71 VanDerWaalsContact OE1-CE 3.26Å; E67-K71 WeakPolarHBondContact OE1-CE 3.36Å; E67-K71 IonicContact OE1-NZ 3.38Å; E67-K71 PolarHBondContact OE1-NZ 2.9Å; I68-K71 PolarHBondContact O-N 3.35Å; I68-K71 VanDerWaalsContact O-N 3.11Å; K69-K71 VanDerWaalsContact C-N 3.34Å; K69-K71 PolarHBondContact O-N 3.21Å |
| 72 | T | 73.9 | Confident | 66.2 | Low | 97 Ų | 97 | 106.7 Ų | 106.7 | 60% | 0.595 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -98.1 | -11.5 | -174.6 | -49.9 | 0 | 0 | 0 | 0 | 112.8 | I68 K69 V74 | I68-T72 VanDerWaalsContact O-CB 3.27Å; I68-T72 WeakPolarHBondContact O-CB 3.4Å; I68-T72 PolarHBondContact O-N 2.96Å; I68-T72 PolarHBondContact O-OG1 3.07Å; K69-T72 PolarHBondContact O-N 2.96Å; T72-V74 PolarHBondContact O-N 2.82Å |
| 73 | A | 62.4 | Low | 65.2 | Low | 53 Ų | 53 | 108.6 Ų | 108.6 | 44% | 0.438 | 59% | 0.587 | S | S | . | * | trans | -69.4 | 69.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | K69 S75 | K69-A73 WeakPolarHBondContact O-CB 3.48Å; K69-A73 PolarHBondContact O-N 2.6Å; A73-S75 PolarHBondContact O-N 3.48Å | ||
| 74 | V | 53.9 | Low | 64.2 | Low | 132 Ų | 132 | 111.1 Ų | 111.1 | 80% | 0.8 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | 67.3 | 164 | -174 | 0 | 0 | 0 | 0 | 107.3 | T72 | T72-V74 PolarHBondContact O-N 2.82Š|
| 75 | S | 51.1 | Low | 63.8 | Low | 111 Ų | 111 | 110 Ų | 110 | 78% | 0.776 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -176.4 | 13.9 | 165.6 | -118.7 | 0 | 0 | 0 | 0 | 116.4 | A73 Q77 | A73-S75 PolarHBondContact O-N 3.48Å; S75-Q77 PolarHBondContact O-N 2.83Å |
| 76 | I | 53.6 | Low | 63.7 | Low | 56 Ų | 56 | 109.5 Ų | 109.5 | 29% | 0.287 | 60% | 0.602 | S | S | . | * | trans | -79.2 | 80.3 | 157 | -49.5 | 176.4 | 0 | 0 | 0 | 104.7 | F78 | I76-F78 VanDerWaalsContact O-CD2 3.26Å; I76-F78 WeakPolarHBondContact O-CD2 3.48Å; I76-F78 PolarHBondContact O-N 3.3Å | ||
| 77 | Q | 44.5 | Very low | 63.9 | Low | 176 Ų | 176 | 112.4 Ų | 112.4 | 82% | 0.822 | 61% | 0.613 | S | S | * | * | trans | -55.8 | 99.3 | 161 | -92.9 | -179.6 | -32 | 0 | 0 | 105 | S75 Q79 | S75-Q77 PolarHBondContact O-N 2.83Å; Q77-Q79 VanDerWaalsContact C-N 3.26Å; Q77-Q79 PolarHBondContact O-N 3.24Å | ||
| 78 | F | 50.3 | Low | 64.2 | Low | 164 Ų | 164 | 108.8 Ų | 108.8 | 72% | 0.719 | 60% | 0.597 | S | S | * | * | trans | -57.6 | 99.7 | 169 | -77.8 | -90.7 | 0 | 0 | 0 | 105.3 | I76 E80 | I76-F78 VanDerWaalsContact O-CD2 3.26Å; I76-F78 WeakPolarHBondContact O-CD2 3.48Å; I76-F78 PolarHBondContact O-N 3.3Å; F78-E80 VanDerWaalsContact C-N 3.26Å; F78-E80 PolarHBondContact O-N 3.36Å | ||
| 79 | Q | 46.7 | Very low | 64.3 | Low | 171 Ų | 171 | 109.9 Ų | 109.9 | 80% | 0.799 | 60% | 0.603 | S | S | * | * | trans | -67.2 | 102.3 | 165.3 | -157 | 165.4 | 46.1 | 0 | 0 | 104.2 | Q77 E81 | Q77-Q79 VanDerWaalsContact C-N 3.26Å; Q77-Q79 PolarHBondContact O-N 3.24Å; Q79-E81 PolarHBondContact O-N 2.89Å | ||
| 80 | E | 46 | Very low | 64.8 | Low | 176 Ų | 176 | 113.5 Ų | 113.5 | 82% | 0.822 | 62% | 0.615 | S | S | * | * | trans | -35.7 | 129.9 | 168.8 | -170 | 170.2 | 175.2 | 0 | 0 | 109.1 | F78 D82 | F78-E80 VanDerWaalsContact C-N 3.26Å; F78-E80 PolarHBondContact O-N 3.36Å; E80-D82 PolarHBondContact O-N 2.86Å | ||
| 81 | E | 45.8 | Very low | 65.6 | Low | 182 Ų | 182 | 110.9 Ų | 110.9 | 85% | 0.85 | 59% | 0.588 | S | S | * | * | trans | -50.1 | 104.1 | -179.2 | -167.6 | -163.4 | 149.6 | 0 | 0 | 108.7 | Q79 | Q79-E81 PolarHBondContact O-N 2.89Š| ||
| 82 | D | 51.7 | Low | 66.2 | Low | 131 Ų | 131 | 105.5 Ų | 105.5 | 70% | 0.701 | 57% | 0.566 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 126.2 | -175.5 | -140.1 | -53.7 | 0 | 0 | 0 | 107.5 | E80 | E80-D82 PolarHBondContact O-N 2.86Š|
| 83 | P | 62.4 | Low | 67.1 | Low | 95 Ų | 95 | 105.3 Ų | 105.3 | 62% | 0.617 | 56% | 0.561 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 149.2 | -176 | 18.1 | -32 | 0 | 0 | 0 | 111.2 | D85 | P83-D85 PolarHBondContact O-N 3.33Š|
| 84 | P | 63.2 | Low | 68.3 | Low | 124 Ų | 124 | 105.8 Ų | 105.8 | 81% | 0.805 | 56% | 0.555 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 117.1 | -175.8 | 20 | -32.4 | 0 | 0 | 0 | 109.5 | A86 | P84-A86 PolarHBondContact O-N 3.48Š|
| 85 | D | 76 | Confident | 70 | Confident | 51 Ų | 51 | 99.5 Ų | 99.5 | 27% | 0.273 | 52% | 0.517 | S | S | . | . | trans | -60.1 | 100.5 | -167.9 | -173 | -27.5 | 0 | 0 | 0 | 110.1 | P83 Q87 L88 L89 R195 | P83-D85 PolarHBondContact O-N 3.33Å; D85-Q87 PolarHBondContact O-N 3.49Å; D85-Q87 VanDerWaalsContact O-N 3.12Å; D85-Q87 WeakPolarHBondContact OD1-CA 3.26Å; D85-Q87 VanDerWaalsContact OD1-CB 3.26Å; D85-Q87 WeakPolarHBondContact OD1-CB 3.31Å; D85-Q87 PolarHBondContact OD1-N 2.88Å; D85-L88 HydrophobicContact CB-CB 3.88Å; D85-L88 WeakPolarHBondContact O-CA 3.49Å; D85-L88 WeakPolarHBondContact O-CB 3.35Å; D85-L88 PolarHBondContact O-N 3.25Å; D85-L88 PolarHBondContact OD1-N 3.3Å; D85-L89 PolarHBondContact O-N 2.72Å; D85-L89 VanDerWaalsContact O-N 3.07Å; D85-R195 WeakPolarHBondContact OD2-CD 3.29Å; D85-R195 IonicContact OD2-CZ 2.63Å; D85-R195 VanDerWaalsContact OD2-CZ 3.27Å; D85-R195 IonicContact OD2-NE 3.7Å; D85-R195 PolarHBondContact OD2-NE 3.38Å; D85-R195 IonicContact OD2-NH1 3Å; D85-R195 PolarHBondContact OD2-NH1 2.67Å | ||
| 86 | A | 83.4 | Confident | 71.9 | Confident | 79 Ų | 79 | 97.7 Ų | 97.7 | 65% | 0.653 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -58.4 | -29 | -176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | P84 R90 | P84-A86 PolarHBondContact O-N 3.48Å; A86-R90 WeakPolarHBondContact O-CB 3.29Å; A86-R90 PolarHBondContact O-N 3.27Å |
| 87 | Q | 83.8 | Confident | 73.4 | Confident | 94 Ų | 94 | 99 Ų | 99 | 44% | 0.439 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -71.2 | -41.8 | 175.6 | -176.8 | 176.9 | -26.4 | 0 | 0 | 111.1 | D85 R90 L91 | D85-Q87 PolarHBondContact O-N 3.49Å; D85-Q87 VanDerWaalsContact O-N 3.12Å; D85-Q87 WeakPolarHBondContact OD1-CA 3.26Å; D85-Q87 VanDerWaalsContact OD1-CB 3.26Å; D85-Q87 WeakPolarHBondContact OD1-CB 3.31Å; D85-Q87 PolarHBondContact OD1-N 2.88Å; Q87-R90 WeakPolarHBondContact O-CB 3.36Å; Q87-R90 PolarHBondContact O-N 3.48Å; Q87-L91 HydrophobicContact CG-CD1 4.36Å; Q87-L91 VanDerWaalsContact O-CG 3.3Å; Q87-L91 WeakPolarHBondContact O-CG 3.29Å; Q87-L91 PolarHBondContact O-N 2.91Å |
| 88 | L | 86.2 | Confident | 75.2 | Confident | 30 Ų | 30 | 92 Ų | 92 | 16% | 0.157 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -61.3 | -46.3 | 176 | -178.1 | 61.8 | 0 | 0 | 0 | 111.3 | D85 R90 L91 D92 R195 K198 | D85-L88 HydrophobicContact CB-CB 3.88Å; D85-L88 WeakPolarHBondContact O-CA 3.49Å; D85-L88 WeakPolarHBondContact O-CB 3.35Å; D85-L88 PolarHBondContact O-N 3.25Å; D85-L88 PolarHBondContact OD1-N 3.3Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 3.49Å; L88-L91 WeakPolarHBondContact O-CB 3.28Å; L88-L91 PolarHBondContact O-N 2.97Å; L88-L91 VanDerWaalsContact O-N 3.16Å; L88-D92 PolarHBondContact O-N 2.94Å; L88-R195 HydrophobicContact CB-CG 4.07Å; L88-R195 HydrophobicContact CD1-CG 3.68Å; L88-R195 HydrophobicContact CD2-CG 4.47Å; L88-R195 HydrophobicContact CG-CG 4.28Å; L88-K198 HydrophobicContact CD1-CD 3.61Å |
| 89 | L | 86.4 | Confident | 76.7 | Confident | 110 Ų | 110 | 85.6 Ų | 85.6 | 58% | 0.576 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -62 | -40.6 | 177.3 | -173.3 | 68.6 | 0 | 0 | 0 | 111.9 | D85 L91 D92 N93 | D85-L89 PolarHBondContact O-N 2.72Å; D85-L89 VanDerWaalsContact O-N 3.07Å; L89-L91 VanDerWaalsContact C-N 3.32Å; L89-L91 PolarHBondContact O-N 3.45Å; L89-D92 PolarHBondContact O-N 2.88Å; L89-N93 PolarHBondContact O-N 3.15Å; L89-N93 PolarHBondContact O-ND2 3.32Å |
| 90 | R | 89.9 | Confident | 78.2 | Confident | 145 Ų | 145 | 77.5 Ų | 77.5 | 55% | 0.547 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -60.4 | -43 | 174.6 | -175.9 | -176.8 | 72.5 | 179.4 | 1.9 | 111.6 | A86 Q87 L88 M94 | A86-R90 WeakPolarHBondContact O-CB 3.29Å; A86-R90 PolarHBondContact O-N 3.27Å; Q87-R90 WeakPolarHBondContact O-CB 3.36Å; Q87-R90 PolarHBondContact O-N 3.48Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 3.49Å; R90-M94 WeakPolarHBondContact O-CB 3.43Å; R90-M94 PolarHBondContact O-N 3.29Å |
| 91 | L | 90 | Very high | 79.4 | Confident | 1 Ų | 1 | 69.7 Ų | 69.7 | 1% | 0.005 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -66.1 | -41 | 177.3 | -70.5 | 171.4 | 0 | 0 | 0 | 111.6 | Q87 L88 L89 M94 L95 K198 Q199 C202 | Q87-L91 HydrophobicContact CG-CD1 4.36Å; Q87-L91 VanDerWaalsContact O-CG 3.3Å; Q87-L91 WeakPolarHBondContact O-CG 3.29Å; Q87-L91 PolarHBondContact O-N 2.91Å; L88-L91 WeakPolarHBondContact O-CB 3.28Å; L88-L91 PolarHBondContact O-N 2.97Å; L88-L91 VanDerWaalsContact O-N 3.16Å; L89-L91 VanDerWaalsContact C-N 3.32Å; L89-L91 PolarHBondContact O-N 3.45Å; L91-M94 WeakPolarHBondContact O-CB 3.39Å; L91-M94 PolarHBondContact O-N 3.39Å; L91-L95 WeakPolarHBondContact O-CG 3.42Å; L91-L95 PolarHBondContact O-N 2.63Å; L91-K198 HydrophobicContact CB-CB 4.04Å; L91-K198 HydrophobicContact CD1-CB 4.14Å; L91-Q199 HydrophobicContact CD1-CB 4.05Å; L91-Q199 HydrophobicContact CD2-CB 4.47Å; L91-C202 HydrophobicContact CD2-CB 4.05Å |
| 92 | D | 89.8 | Confident | 80.3 | Confident | 38 Ų | 38 | 71 Ų | 71 | 20% | 0.203 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -60.2 | -47.3 | 175.2 | -82.8 | -40.9 | 0 | 0 | 0 | 112.4 | L88 L89 M94 L95 L96 K198 | L88-D92 PolarHBondContact O-N 2.94Å; L89-D92 PolarHBondContact O-N 2.88Å; D92-M94 VanDerWaalsContact C-N 3.27Å; D92-M94 PolarHBondContact O-N 3.2Å; D92-L95 PolarHBondContact O-N 3Å; D92-L96 VanDerWaalsContact O-CB 3.32Å; D92-L96 WeakPolarHBondContact O-CB 3.44Å; D92-L96 WeakPolarHBondContact O-CG 3.24Å; D92-L96 PolarHBondContact O-N 2.95Å; D92-K198 WeakPolarHBondContact OD1-CD 3.42Å; D92-K198 WeakPolarHBondContact OD1-CE 3.38Å; D92-K198 IonicContact OD1-NZ 3.5Å; D92-K198 PolarHBondContact OD1-NZ 2.87Å; D92-K198 IonicContact OD2-NZ 2.6Å; D92-K198 PolarHBondContact OD2-NZ 3.43Å |
| 93 | N | 91.3 | Very high | 80.4 | Confident | 92 Ų | 92 | 69.7 Ų | 69.7 | 49% | 0.492 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -60.2 | -38.3 | 175.6 | -70.8 | -31.5 | 0 | 0 | 0 | 112 | L89 A97 | L89-N93 PolarHBondContact O-N 3.15Å; L89-N93 PolarHBondContact O-ND2 3.32Å; N93-A97 WeakPolarHBondContact O-CB 3.3Å; N93-A97 PolarHBondContact O-N 3.4Å |
| 94 | M | 88.1 | Confident | 79.9 | Confident | 63 Ų | 63 | 74.3 Ų | 74.3 | 31% | 0.31 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -66.4 | -44.8 | 177.2 | -169.1 | -178.3 | -53.5 | 0 | 0 | 112.1 | R90 L91 D92 A97 E98 C202 M206 | R90-M94 WeakPolarHBondContact O-CB 3.43Å; R90-M94 PolarHBondContact O-N 3.29Å; L91-M94 WeakPolarHBondContact O-CB 3.39Å; L91-M94 PolarHBondContact O-N 3.39Å; D92-M94 VanDerWaalsContact C-N 3.27Å; D92-M94 PolarHBondContact O-N 3.2Å; M94-A97 PolarHBondContact O-N 3.22Å; M94-E98 PolarHBondContact O-N 2.89Å; M94-C202 HydrophobicContact SD-CB 3.5Å; M94-C202 VanDerWaalsContact SD-CB 3.5Å; M94-C202 PolarHBondContact SD-SG 2.88Å; M94-M206 HydrophobicContact CG-CE 4.16Å; M94-M206 HydrophobicContact SD-CE 3.98Å |
| 95 | L | 90.5 | Very high | 78.9 | Confident | 1 Ų | 1 | 78.1 Ų | 78.1 | 1% | 0.005 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -69.5 | -36.2 | 177.9 | -67.8 | 178.3 | 0 | 0 | 0 | 112.4 | L91 D92 E98 G99 V100 S101 Y143 K198 T201 C202 | L91-L95 WeakPolarHBondContact O-CG 3.42Å; L91-L95 PolarHBondContact O-N 2.63Å; D92-L95 PolarHBondContact O-N 3Å; L95-E98 PolarHBondContact O-N 2.84Å; L95-G99 PolarHBondContact O-N 3.11Å; L95-V100 HydrophobicContact CB-CB 4.22Å; L95-V100 HydrophobicContact CD2-CB 3.99Å; L95-V100 HydrophobicContact CD2-CG1 3.97Å; L95-V100 HydrophobicContact CD2-CG2 4.4Å; L95-V100 PolarHBondContact O-N 3.46Å; L95-S101 VanDerWaalsContact CB-OG 3.29Å; L95-S101 WeakPolarHBondContact CB-OG 3.33Å; L95-S101 PolarHBondContact O-N 3.26Å; L95-Y143 HydrophobicContact CD1-CE2 4.04Å; L95-K198 HydrophobicContact CD1-CB 3.84Å; L95-K198 HydrophobicContact CD1-CD 4.33Å; L95-K198 HydrophobicContact CD1-CG 3.71Å; L95-T201 HydrophobicContact CD2-CG2 3.56Å; L95-C202 VanDerWaalsContact CD2-SG 3.52Å |
| 96 | L | 90 | Very high | 77.1 | Confident | 72 Ų | 72 | 87.4 Ų | 87.4 | 38% | 0.377 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.3 | -44.4 | 174.4 | -76.4 | 167.3 | 0 | 0 | 0 | 111.3 | D92 E98 G99 S101 P103 | D92-L96 VanDerWaalsContact O-CB 3.32Å; D92-L96 WeakPolarHBondContact O-CB 3.44Å; D92-L96 WeakPolarHBondContact O-CG 3.24Å; D92-L96 PolarHBondContact O-N 2.95Å; L96-E98 PolarHBondContact O-N 3.11Å; L96-G99 PolarHBondContact O-N 2.94Å; L96-S101 WeakPolarHBondContact CD2-O 3.27Å; L96-P103 HydrophobicContact CD2-CB 4.41Å |
| 97 | A | 84.8 | Confident | 74.7 | Confident | 85 Ų | 85 | 86.9 Ų | 86.9 | 70% | 0.702 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -61.4 | -33.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | N93 M94 G99 | N93-A97 WeakPolarHBondContact O-CB 3.3Å; N93-A97 PolarHBondContact O-N 3.4Å; M94-A97 PolarHBondContact O-N 3.22Å; A97-G99 VanDerWaalsContact C-N 3.29Å |
| 98 | E | 82.9 | Confident | 72.3 | Confident | 29 Ų | 29 | 94.4 Ų | 94.4 | 14% | 0.136 | 46% | 0.463 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.7 | 2.3 | 177.5 | -61.9 | -70.4 | 164.1 | 0 | 0 | 112.5 | M94 L95 L96 V100 R140 V205 R209 | M94-E98 PolarHBondContact O-N 2.89Å; L95-E98 PolarHBondContact O-N 2.84Å; L96-E98 PolarHBondContact O-N 3.11Å; E98-V100 HydrophobicContact CB-CG2 4.03Å; E98-V100 PolarHBondContact O-N 3.32Å; E98-R140 PolarHBondContact O-NH2 2.87Å; E98-V205 HydrophobicContact CB-CG1 4.03Å; E98-V205 HydrophobicContact CG-CG1 3.6Å; E98-R209 VanDerWaalsContact OE1-CD 3.3Å; E98-R209 WeakPolarHBondContact OE1-CD 3.44Å; E98-R209 IonicContact OE1-CZ 3.21Å; E98-R209 IonicContact OE1-NE 2.69Å; E98-R209 IonicContact OE1-NH1 2.52Å; E98-R209 PolarHBondContact OE1-NH1 2.89Å; E98-R209 IonicContact OE2-NH1 3.29Å; E98-R209 PolarHBondContact OE2-NH1 3.47Å |
| 99 | G | 81.9 | Confident | 69.6 | Low | 29 Ų | 29 | 96.9 Ų | 96.9 | 30% | 0.299 | 50% | 0.495 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 65.2 | 21.3 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | L95 L96 A97 R140 | L95-G99 PolarHBondContact O-N 3.11Å; L96-G99 PolarHBondContact O-N 2.94Å; A97-G99 VanDerWaalsContact C-N 3.29Å; G99-R140 VanDerWaalsContact O-CD 3.29Å; G99-R140 WeakPolarHBondContact O-CD 3.02Å; G99-R140 PolarHBondContact O-NE 3.36Å |
| 100 | V | 78 | Confident | 67.1 | Low | 0 Ų | 0 | 96.2 Ų | 96.2 | 0% | 0 | 51% | 0.506 | C | S | . | . | trans | -80.8 | -44.3 | 179.2 | 179.1 | 0 | 0 | 0 | 0 | 111.5 | L95 E98 L136 R140 Y143 H144 T201 V205 | L95-V100 HydrophobicContact CB-CB 4.22Å; L95-V100 HydrophobicContact CD2-CB 3.99Å; L95-V100 HydrophobicContact CD2-CG1 3.97Å; L95-V100 HydrophobicContact CD2-CG2 4.4Å; L95-V100 PolarHBondContact O-N 3.46Å; E98-V100 HydrophobicContact CB-CG2 4.03Å; E98-V100 PolarHBondContact O-N 3.32Å; V100-L136 HydrophobicContact CG2-CD1 4.38Å; V100-R140 HydrophobicContact CB-CG 4.17Å; V100-R140 HydrophobicContact CG1-CG 4.19Å; V100-R140 HydrophobicContact CG2-CG 3.91Å; V100-Y143 HydrophobicContact CG1-CD1 3.72Å; V100-Y143 HydrophobicContact CG1-CE1 4.44Å; V100-Y143 HydrophobicContact CG1-CG 3.96Å; V100-H144 PolarHBondContact O-CE1 2.89Å; V100-H144 PolarHBondContact O-NE2 3.34Å; V100-H144 VanDerWaalsContact O-NE2 3.11Å; V100-T201 HydrophobicContact CG1-CG2 3.72Å; V100-V205 HydrophobicContact CG2-CG2 3.97Å | ||
| 101 | S | 72 | Confident | 64.5 | Low | 13 Ų | 13 | 93.8 Ų | 93.8 | 9% | 0.091 | 52% | 0.517 | C | S | . | . | S | Bend | trans | -89.1 | 135.3 | 167.7 | -63.1 | 0 | 0 | 0 | 0 | 108.6 | L95 L96 | L95-S101 VanDerWaalsContact CB-OG 3.29Å; L95-S101 WeakPolarHBondContact CB-OG 3.33Å; L95-S101 PolarHBondContact O-N 3.26Å; L96-S101 WeakPolarHBondContact CD2-O 3.27Å |
| 102 | R | 63.9 | Low | 61.7 | Low | 209 Ų | 209 | 98.8 Ų | 98.8 | 79% | 0.789 | 56% | 0.558 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 136.5 | 168.8 | -69.8 | -172.5 | 176.6 | -165.2 | -0.1 | 108.5 | E104 | R102-E104 PolarHBondContact O-N 2.78Å; R102-E104 VanDerWaalsContact O-N 3.17Å |
| 103 | P | 55.1 | Low | 58.9 | Low | 104 Ų | 104 | 100.3 Ų | 100.3 | 68% | 0.675 | 58% | 0.583 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 121.5 | 163.5 | 24.2 | -28.7 | 0 | 0 | 0 | 107.5 | L96 K105 | L96-P103 HydrophobicContact CD2-CB 4.41Å; P103-K105 PolarHBondContact O-N 2.77Å |
| 104 | E | 50.6 | Low | 56.1 | Low | 191 Ų | 191 | 102.1 Ų | 102.1 | 89% | 0.893 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 125.4 | 173.4 | -116.9 | -150.4 | 119.7 | 0 | 0 | 108.3 | R102 R106 | R102-E104 PolarHBondContact O-N 2.78Å; R102-E104 VanDerWaalsContact O-N 3.17Å; E104-R106 VanDerWaalsContact C-N 3.27Å; E104-R106 PolarHBondContact O-N 2.97Å |
| 105 | K | 41.5 | Very low | 53.4 | Low | 204 Ų | 204 | 105.3 Ų | 105.3 | 89% | 0.887 | 63% | 0.626 | S | S | * | * | trans | -70.9 | 78.4 | -169.5 | -172.1 | -179.3 | -179.8 | -177.9 | 0 | 110.2 | P103 G107 | P103-K105 PolarHBondContact O-N 2.77Å; K105-G107 PolarHBondContact O-N 2.91Å | ||
| 106 | R | 38.3 | Very low | 50.7 | Low | 247 Ų | 247 | 110 Ų | 110 | 93% | 0.932 | 66% | 0.664 | S | S | * | * | trans | -87.8 | 96.6 | 163 | -136.1 | -179.8 | -158.2 | -120.7 | 5 | 108.5 | E104 | E104-R106 VanDerWaalsContact C-N 3.27Å; E104-R106 PolarHBondContact O-N 2.97Å | ||
| 107 | G | 34.5 | Very low | 48.1 | Very low | 67 Ų | 67 | 113 Ų | 113 | 69% | 0.691 | 69% | 0.686 | S | S | * | * | S | Bend | trans | 74.9 | 108.8 | 155.8 | 0 | 0 | 0 | 0 | 0 | 117.9 | K105 | K105-G107 PolarHBondContact O-N 2.91Š|
| 108 | R | 32.8 | Very low | 45.8 | Very low | 253 Ų | 253 | 115.1 Ų | 115.1 | 96% | 0.955 | 69% | 0.693 | S | S | * | * | trans | 64.6 | 97 | 134.1 | -141.7 | 169.6 | -157.9 | -132.1 | 2.6 | 118.4 | ||||
| 109 | G | 29 | Very low | 43.4 | Very low | 81 Ų | 81 | 117.7 Ų | 117.7 | 84% | 0.835 | 73% | 0.727 | S | S | * | * | trans | 70.3 | 95.1 | 132.2 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 110 | A | 34.2 | Very low | 41.3 | Very low | 96 Ų | 96 | 119.8 Ų | 119.8 | 79% | 0.793 | 75% | 0.748 | S | S | * | * | trans | -161.8 | 102.2 | 143.5 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 111 | A | 34.8 | Very low | 39.6 | Very low | 94 Ų | 94 | 125.9 Ų | 125.9 | 78% | 0.777 | 79% | 0.79 | S | S | * | * | 66.8 | 97.5 | 114 | 0 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 112 | A | 31 | Very low | 38.2 | Very low | 107 Ų | 107 | 130.5 Ų | 130.5 | 88% | 0.884 | 82% | 0.819 | S | S | * | * | 55.6 | 104.5 | 82.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 113 | G | 32.8 | Very low | 37.7 | Very low | 70 Ų | 70 | 126.6 Ų | 126.6 | 72% | 0.722 | 81% | 0.814 | S | S | * | * | trans | -170.4 | 35.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | T115 | G113-T115 PolarHBondContact O-N 2.86Š| ||
| 114 | S | 31.1 | Very low | 37.6 | Very low | 130 Ų | 130 | 127 Ų | 127 | 91% | 0.909 | 81% | 0.81 | S | S | * | * | trans | -78.6 | 89.1 | 163.4 | -65.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 115 | T | 32.8 | Very low | 37.8 | Very low | 130 Ų | 130 | 123 Ų | 123 | 80% | 0.798 | 80% | 0.795 | S | S | * | * | trans | -106.8 | 96.7 | 164.5 | 11.4 | 0 | 0 | 0 | 0 | 108 | G113 | G113-T115 PolarHBondContact O-N 2.86Š| ||
| 116 | A | 33 | Very low | 38.7 | Very low | 98 Ų | 98 | 117 Ų | 117 | 81% | 0.81 | 78% | 0.779 | S | S | * | * | trans | -73.8 | 124.1 | 166.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 117 | T | 35.2 | Very low | 39.8 | Very low | 136 Ų | 136 | 110 Ų | 110 | 83% | 0.834 | 76% | 0.76 | S | S | * | * | trans | -110 | 112.1 | 163.7 | -31.8 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 118 | P | 36.6 | Very low | 41.5 | Very low | 130 Ų | 130 | 110.6 Ų | 110.6 | 84% | 0.844 | 74% | 0.744 | S | S | * | * | trans | -87.8 | 113.6 | 178.8 | 31.6 | -26.6 | 0 | 0 | 0 | 109.2 | ||||
| 119 | G | 33.4 | Very low | 43.6 | Very low | 82 Ų | 82 | 104 Ų | 104 | 85% | 0.845 | 72% | 0.724 | S | S | * | * | trans | 176.3 | 82.6 | 178 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 120 | G | 37.1 | Very low | 46.3 | Very low | 73 Ų | 73 | 102.9 Ų | 102.9 | 75% | 0.753 | 70% | 0.704 | S | S | * | * | S | Bend | trans | 178.7 | 122.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 121 | C | 42.7 | Very low | 48.8 | Very low | 129 Ų | 129 | 101.9 Ų | 101.9 | 87% | 0.872 | 69% | 0.685 | S | S | * | * | trans | -44 | 133.5 | -170.4 | -54.1 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 122 | P | 42.8 | Very low | 51.4 | Low | 109 Ų | 109 | 99.4 Ų | 99.4 | 71% | 0.708 | 66% | 0.656 | S | S | * | * | trans | -92.5 | 127 | -171.6 | 35.1 | -30.4 | 0 | 0 | 0 | 111.4 | ||||
| 123 | N | 52.8 | Low | 54.2 | Low | 127 Ų | 127 | 102.9 Ų | 102.9 | 68% | 0.679 | 65% | 0.646 | S | S | * | * | S | Bend | 165.1 | -22.3 | 123.7 | -93.5 | -9.6 | 0 | 0 | 0 | 115.1 | |||
| 124 | D | 52.1 | Low | 57 | Low | 112 Ų | 112 | 102.3 Ų | 102.3 | 60% | 0.599 | 64% | 0.635 | S | S | * | * | S | Bend | trans | -95.1 | -50.1 | -175.1 | -151.1 | 13.5 | 0 | 0 | 0 | 111.8 | S126 I127 | D124-S126 PolarHBondContact O-N 3.23Å; D124-I127 PolarHBondContact O-N 2.95Å |
| 125 | N | 55 | Low | 60 | Low | 108 Ų | 108 | 100.1 Ų | 100.1 | 58% | 0.578 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -68.2 | -23 | 177.9 | -58.1 | -36.1 | 0 | 0 | 0 | 113.1 | H129 | N125-H129 WeakPolarHBondContact O-CB 3.43Å; N125-H129 PolarHBondContact O-CD2 2.87Å; N125-H129 PolarHBondContact O-N 3.34Å |
| 126 | S | 60.6 | Low | 62.8 | Low | 79 Ų | 79 | 94.7 Ų | 94.7 | 55% | 0.552 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -67.6 | -39.1 | -179.1 | -172 | 0 | 0 | 0 | 0 | 111.5 | D124 S130 | D124-S126 PolarHBondContact O-N 3.23Å; S126-S130 VanDerWaalsContact O-CB 3.32Å; S126-S130 WeakPolarHBondContact O-CB 3.39Å; S126-S130 PolarHBondContact O-N 2.74Å; S126-S130 PolarHBondContact O-OG 3.49Å |
| 127 | I | 61.7 | Low | 65.6 | Low | 100 Ų | 100 | 93.3 Ų | 93.3 | 51% | 0.513 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -67.2 | -48.7 | 179.3 | -61.9 | 170.6 | 0 | 0 | 0 | 109 | D124 H129 S130 D131 | D124-I127 PolarHBondContact O-N 2.95Å; I127-H129 VanDerWaalsContact C-N 3.34Å; I127-H129 PolarHBondContact O-N 3.42Å; I127-S130 WeakPolarHBondContact CA-OG 3.4Å; I127-S130 PolarHBondContact O-N 2.9Å; I127-S130 PolarHBondContact O-OG 3.05Å; I127-D131 PolarHBondContact O-N 3.16Å |
| 128 | E | 69.5 | Low | 68.5 | Low | 79 Ų | 79 | 91.5 Ų | 91.5 | 37% | 0.369 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.2 | -41.4 | 177.2 | -63.1 | -172 | 161.1 | 0 | 0 | 112.6 | S130 D131 Y132 F212 | E128-S130 VanDerWaalsContact C-N 3.34Å; E128-D131 PolarHBondContact O-N 3.03Å; E128-Y132 WeakPolarHBondContact O-CB 3.4Å; E128-Y132 PolarHBondContact O-N 3.45Å; E128-F212 HydrophobicContact CB-CE1 4.44Å; E128-F212 WeakPolarHBondContact O-CE1 3.2Å |
| 129 | H | 78 | Confident | 71.3 | Confident | 113 Ų | 113 | 86.5 Ų | 86.5 | 52% | 0.523 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -67 | -35 | 174.9 | -77.3 | -54.6 | 0 | 0 | 0 | 112.7 | N125 I127 R133 | N125-H129 WeakPolarHBondContact O-CB 3.43Å; N125-H129 PolarHBondContact O-CD2 2.87Å; N125-H129 PolarHBondContact O-N 3.34Å; I127-H129 VanDerWaalsContact C-N 3.34Å; I127-H129 PolarHBondContact O-N 3.42Å; H129-R133 WeakPolarHBondContact O-CB 3.24Å; H129-R133 VanDerWaalsContact O-CG 3.29Å; H129-R133 WeakPolarHBondContact O-CG 3.4Å; H129-R133 PolarHBondContact O-N 2.9Å; H129-R133 VanDerWaalsContact O-N 3.08Å |
| 130 | S | 84.6 | Confident | 74.2 | Confident | 59 Ų | 59 | 86.8 Ų | 86.8 | 41% | 0.413 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -67.6 | -43 | 175.3 | 73.7 | 0 | 0 | 0 | 0 | 111.5 | S126 I127 E128 R133 A134 | S126-S130 VanDerWaalsContact O-CB 3.32Å; S126-S130 WeakPolarHBondContact O-CB 3.39Å; S126-S130 PolarHBondContact O-N 2.74Å; S126-S130 PolarHBondContact O-OG 3.49Å; I127-S130 WeakPolarHBondContact CA-OG 3.4Å; I127-S130 PolarHBondContact O-N 2.9Å; I127-S130 PolarHBondContact O-OG 3.05Å; E128-S130 VanDerWaalsContact C-N 3.34Å; S130-R133 PolarHBondContact O-N 3.33Å; S130-A134 WeakPolarHBondContact O-CB 3.39Å; S130-A134 PolarHBondContact O-N 2.89Å |
| 131 | D | 87.1 | Confident | 77 | Confident | 74 Ų | 74 | 90 Ų | 90 | 40% | 0.396 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65.2 | -42.8 | 177.4 | -73.1 | -23.2 | 0 | 0 | 0 | 111.7 | I127 E128 A134 K135 F212 | I127-D131 PolarHBondContact O-N 3.16Å; E128-D131 PolarHBondContact O-N 3.03Å; D131-A134 PolarHBondContact O-N 3.4Å; D131-K135 WeakPolarHBondContact O-CB 3.29Å; D131-K135 VanDerWaalsContact O-CG 3.26Å; D131-K135 WeakPolarHBondContact O-CG 3.42Å; D131-K135 PolarHBondContact O-N 2.88Å; D131-F212 HydrophobicContact CB-CE1 4.35Å; D131-F212 HydrophobicContact CB-CZ 4.04Å |
| 132 | Y | 89.5 | Confident | 79.5 | Confident | 43 Ų | 43 | 86.9 Ų | 86.9 | 17% | 0.169 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -59.9 | -47.2 | 175 | 176.7 | -100.9 | 0 | 0 | 0 | 111.2 | E128 K135 L136 L208 R209 F212 | E128-Y132 WeakPolarHBondContact O-CB 3.4Å; E128-Y132 PolarHBondContact O-N 3.45Å; Y132-K135 PolarHBondContact O-N 2.71Å; Y132-L136 HydrophobicContact CE1-CD2 4.23Å; Y132-L136 WeakPolarHBondContact O-CB 3.31Å; Y132-L136 PolarHBondContact O-N 3.47Å; Y132-L208 HydrophobicContact CD2-CD1 4.4Å; Y132-L208 HydrophobicContact CD2-CD2 3.98Å; Y132-L208 HydrophobicContact CD2-CG 3.83Å; Y132-L208 HydrophobicContact CE2-CD2 3.83Å; Y132-L208 HydrophobicContact CE2-CG 3.76Å; Y132-R209 HydrophobicContact CE2-CG 4.3Å; Y132-F212 HydrophobicContact CD2-CB 4.08Å; Y132-F212 HydrophobicContact CD2-CD1 4.24Å; Y132-F212 AromaticContact CD2-CD2 3.61Å; Y132-F212 HydrophobicContact CD2-CD2 3.61Å; Y132-F212 HydrophobicContact CD2-CE2 4.05Å; Y132-F212 AromaticContact CD2-CG 3.7Å; Y132-F212 HydrophobicContact CD2-CG 3.7Å; Y132-F212 HydrophobicContact CE2-CD2 4.5Å; Y132-F212 HydrophobicContact CG-CD1 4.43Å; Y132-F212 HydrophobicContact CG-CD2 4.44Å; Y132-F212 HydrophobicContact CG-CG 4.32Å |
| 133 | R | 89.3 | Confident | 82 | Confident | 179 Ų | 179 | 82.1 Ų | 82.1 | 68% | 0.675 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -65.4 | -41.4 | 179.2 | -75.8 | 179.5 | -178.9 | 150.8 | 1 | 112.2 | H129 S130 L136 S137 | H129-R133 WeakPolarHBondContact O-CB 3.24Å; H129-R133 VanDerWaalsContact O-CG 3.29Å; H129-R133 WeakPolarHBondContact O-CG 3.4Å; H129-R133 PolarHBondContact O-N 2.9Å; H129-R133 VanDerWaalsContact O-N 3.08Å; S130-R133 PolarHBondContact O-N 3.33Å; R133-L136 PolarHBondContact O-N 3.22Å; R133-S137 WeakPolarHBondContact O-CB 3.05Å; R133-S137 PolarHBondContact O-N 2.95Å |
| 134 | A | 92.1 | Very high | 84 | Confident | 59 Ų | 59 | 79.7 Ų | 79.7 | 49% | 0.488 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -62.3 | -47.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | S130 D131 S137 Q138 | S130-A134 WeakPolarHBondContact O-CB 3.39Å; S130-A134 PolarHBondContact O-N 2.89Å; D131-A134 PolarHBondContact O-N 3.4Å; A134-S137 WeakPolarHBondContact O-CB 3.42Å; A134-S137 PolarHBondContact O-N 3.5Å; A134-Q138 PolarHBondContact O-N 3.35Å |
| 135 | K | 92.9 | Very high | 86.1 | Confident | 84 Ų | 84 | 76.3 Ų | 76.3 | 37% | 0.365 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.3 | -40.7 | 176.8 | -71.9 | 177.9 | -176.3 | -174.2 | 0 | 112.4 | D131 Y132 Q138 I139 L208 F212 | D131-K135 WeakPolarHBondContact O-CB 3.29Å; D131-K135 VanDerWaalsContact O-CG 3.26Å; D131-K135 WeakPolarHBondContact O-CG 3.42Å; D131-K135 PolarHBondContact O-N 2.88Å; Y132-K135 PolarHBondContact O-N 2.71Å; K135-Q138 WeakPolarHBondContact O-CB 3.33Å; K135-Q138 PolarHBondContact O-N 3.45Å; K135-I139 WeakPolarHBondContact O-CG1 3.45Å; K135-I139 PolarHBondContact O-N 3.18Å; K135-L208 HydrophobicContact CB-CD1 3.66Å; K135-L208 HydrophobicContact CB-CD2 3.96Å; K135-L208 HydrophobicContact CB-CG 4.5Å; K135-L208 HydrophobicContact CD-CD1 3.74Å; K135-L208 HydrophobicContact CG-CD1 4.33Å; K135-F212 HydrophobicContact CD-CE2 4.18Å; K135-F212 HydrophobicContact CD-CZ 4.42Å |
| 136 | L | 92.5 | Very high | 88 | Confident | 16 Ų | 16 | 73.2 Ų | 73.2 | 8% | 0.084 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -63.2 | -44.4 | 174.7 | -174 | 62.2 | 0 | 0 | 0 | 110.5 | V100 Y132 R133 Q138 I139 R140 V205 L208 | V100-L136 HydrophobicContact CG2-CD1 4.38Å; Y132-L136 HydrophobicContact CE1-CD2 4.23Å; Y132-L136 WeakPolarHBondContact O-CB 3.31Å; Y132-L136 PolarHBondContact O-N 3.47Å; R133-L136 PolarHBondContact O-N 3.22Å; L136-Q138 VanDerWaalsContact C-N 3.29Å; L136-Q138 PolarHBondContact O-N 3.47Å; L136-I139 PolarHBondContact O-N 2.96Å; L136-R140 WeakPolarHBondContact O-CG 3.38Å; L136-R140 PolarHBondContact O-N 3.34Å; L136-V205 HydrophobicContact CD1-CG1 4.31Å; L136-V205 HydrophobicContact CD1-CG2 4.15Å; L136-L208 HydrophobicContact CB-CD2 4Å; L136-L208 HydrophobicContact CD1-CD2 4.4Å |
| 137 | S | 92.8 | Very high | 89.6 | Confident | 68 Ų | 68 | 70.6 Ų | 70.6 | 48% | 0.476 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -59.1 | -40 | 175 | -168 | 0 | 0 | 0 | 0 | 112.3 | R133 A134 R140 Q141 | R133-S137 WeakPolarHBondContact O-CB 3.05Å; R133-S137 PolarHBondContact O-N 2.95Å; A134-S137 WeakPolarHBondContact O-CB 3.42Å; A134-S137 PolarHBondContact O-N 3.5Å; S137-R140 WeakPolarHBondContact O-CB 3.43Å; S137-R140 PolarHBondContact O-N 2.9Å; S137-Q141 PolarHBondContact O-N 3.21Å |
| 138 | Q | 95.8 | Very high | 91.2 | Very high | 99 Ų | 99 | 72.1 Ų | 72.1 | 46% | 0.463 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -62.6 | -44.8 | 175.1 | -174.3 | -178.7 | 0.4 | 0 | 0 | 111.7 | A134 K135 L136 R140 Q141 I142 | A134-Q138 PolarHBondContact O-N 3.35Å; K135-Q138 WeakPolarHBondContact O-CB 3.33Å; K135-Q138 PolarHBondContact O-N 3.45Å; L136-Q138 VanDerWaalsContact C-N 3.29Å; L136-Q138 PolarHBondContact O-N 3.47Å; Q138-R140 VanDerWaalsContact C-N 3.29Å; Q138-R140 PolarHBondContact O-N 3.38Å; Q138-Q141 PolarHBondContact O-N 2.96Å; Q138-I142 HydrophobicContact CG-CD1 3.99Å; Q138-I142 WeakPolarHBondContact O-CG1 3.19Å; Q138-I142 PolarHBondContact O-N 2.93Å |
| 139 | I | 95.1 | Very high | 92.4 | Very high | 25 Ų | 25 | 74.2 Ų | 74.2 | 13% | 0.128 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -58.7 | -42.9 | 175.2 | -66.9 | 168.3 | 0 | 0 | 0 | 110.6 | K135 L136 I142 Y143 T201 A204 V205 L208 | K135-I139 WeakPolarHBondContact O-CG1 3.45Å; K135-I139 PolarHBondContact O-N 3.18Å; L136-I139 PolarHBondContact O-N 2.96Å; I139-I142 PolarHBondContact O-N 3.25Å; I139-Y143 WeakPolarHBondContact O-CB 3.48Å; I139-Y143 PolarHBondContact O-N 3.15Å; I139-T201 HydrophobicContact CG2-CG2 3.78Å; I139-A204 HydrophobicContact CD1-CB 4.08Å; I139-A204 HydrophobicContact CG1-CB 4.38Å; I139-A204 HydrophobicContact CG2-CB 4.43Å; I139-V205 HydrophobicContact CD1-CG2 4.39Å; I139-V205 HydrophobicContact CG2-CG2 3.95Å; I139-L208 HydrophobicContact CD1-CB 4.31Å; I139-L208 HydrophobicContact CD1-CD2 3.91Å |
| 140 | R | 94.2 | Very high | 93.1 | Very high | 87 Ų | 87 | 71.4 Ų | 71.4 | 33% | 0.328 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -61.5 | -45.3 | 176.9 | -62.7 | -173.8 | -176.1 | 169.8 | -6.2 | 112.6 | E98 G99 V100 L136 S137 Q138 Y143 H144 | E98-R140 PolarHBondContact O-NH2 2.87Å; G99-R140 VanDerWaalsContact O-CD 3.29Å; G99-R140 WeakPolarHBondContact O-CD 3.02Å; G99-R140 PolarHBondContact O-NE 3.36Å; V100-R140 HydrophobicContact CB-CG 4.17Å; V100-R140 HydrophobicContact CG1-CG 4.19Å; V100-R140 HydrophobicContact CG2-CG 3.91Å; L136-R140 WeakPolarHBondContact O-CG 3.38Å; L136-R140 PolarHBondContact O-N 3.34Å; S137-R140 WeakPolarHBondContact O-CB 3.43Å; S137-R140 PolarHBondContact O-N 2.9Å; Q138-R140 VanDerWaalsContact C-N 3.29Å; Q138-R140 PolarHBondContact O-N 3.38Å; R140-Y143 PolarHBondContact O-N 3.41Å; R140-H144 PolarHBondContact O-CD2 3.21Å; R140-H144 PolarHBondContact O-N 3.14Å |
| 141 | Q | 95.4 | Very high | 93.5 | Very high | 140 Ų | 140 | 72 Ų | 72 | 65% | 0.654 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -63.2 | -45 | 179.4 | -176.7 | 178.4 | -12.9 | 0 | 0 | 111.3 | S137 Q138 H144 S145 | S137-Q141 PolarHBondContact O-N 3.21Å; Q138-Q141 PolarHBondContact O-N 2.96Å; Q141-H144 PolarHBondContact O-N 2.72Å; Q141-S145 VanDerWaalsContact O-CB 3.3Å; Q141-S145 WeakPolarHBondContact O-CB 3.5Å; Q141-S145 PolarHBondContact O-N 2.91Å; Q141-S145 PolarHBondContact O-OG 3Å |
| 142 | I | 95.4 | Very high | 94 | Very high | 65 Ų | 65 | 72.1 Ų | 72.1 | 33% | 0.333 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -60.1 | -50.7 | 177 | -67.1 | 166.7 | 0 | 0 | 0 | 109.8 | Q138 I139 H144 S145 E146 L330 | Q138-I142 HydrophobicContact CG-CD1 3.99Å; Q138-I142 WeakPolarHBondContact O-CG1 3.19Å; Q138-I142 PolarHBondContact O-N 2.93Å; I139-I142 PolarHBondContact O-N 3.25Å; I142-H144 PolarHBondContact O-N 2.82Å; I142-S145 WeakPolarHBondContact CA-OG 3.26Å; I142-S145 PolarHBondContact O-N 3.41Å; I142-S145 PolarHBondContact O-OG 3.43Å; I142-E146 HydrophobicContact CG2-CG 4.21Å; I142-E146 WeakPolarHBondContact O-CB 3.22Å; I142-E146 WeakPolarHBondContact O-CG 3.35Å; I142-E146 PolarHBondContact O-N 3.18Å; I142-L330 HydrophobicContact CG2-CD1 4.06Å |
| 143 | Y | 96 | Very high | 94.2 | Very high | 8 Ų | 8 | 72.6 Ų | 72.6 | 3% | 0.031 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -53.5 | -51.9 | 178.7 | 172.3 | -110.4 | 0 | 0 | 0 | 112.4 | L95 V100 I139 R140 E146 L147 L197 K198 T201 | L95-Y143 HydrophobicContact CD1-CE2 4.04Å; V100-Y143 HydrophobicContact CG1-CD1 3.72Å; V100-Y143 HydrophobicContact CG1-CE1 4.44Å; V100-Y143 HydrophobicContact CG1-CG 3.96Å; I139-Y143 WeakPolarHBondContact O-CB 3.48Å; I139-Y143 PolarHBondContact O-N 3.15Å; R140-Y143 PolarHBondContact O-N 3.41Å; Y143-E146 PolarHBondContact O-N 2.7Å; Y143-L147 HydrophobicContact CE1-CD2 4.46Å; Y143-L147 VanDerWaalsContact O-CB 3.27Å; Y143-L147 WeakPolarHBondContact O-CB 3.3Å; Y143-L147 PolarHBondContact O-N 3.48Å; Y143-L197 HydrophobicContact CD2-CD1 4.42Å; Y143-L197 HydrophobicContact CD2-CD2 4.07Å; Y143-L197 HydrophobicContact CD2-CG 3.91Å; Y143-L197 HydrophobicContact CE2-CD2 4.05Å; Y143-L197 HydrophobicContact CE2-CG 4.03Å; Y143-K198 HydrophobicContact CE2-CG 3.92Å; Y143-K198 WeakPolarHBondContact OH-CE 3.39Å; Y143-T201 HydrophobicContact CD2-CG2 4.05Å; Y143-T201 WeakPolarHBondContact CD2-OG1 3.4Å; Y143-T201 HydrophobicContact CG-CG2 4.07Å |
| 144 | H | 94.7 | Very high | 94.5 | Very high | 76 Ų | 76 | 65.1 Ų | 65.1 | 35% | 0.352 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -65.5 | -40.8 | 179.8 | -73.5 | -54.9 | 0 | 0 | 0 | 112.7 | V100 R140 Q141 I142 L147 E148 | V100-H144 PolarHBondContact O-CE1 2.89Å; V100-H144 PolarHBondContact O-NE2 3.34Å; V100-H144 VanDerWaalsContact O-NE2 3.11Å; R140-H144 PolarHBondContact O-CD2 3.21Å; R140-H144 PolarHBondContact O-N 3.14Å; Q141-H144 PolarHBondContact O-N 2.72Å; I142-H144 PolarHBondContact O-N 2.82Å; H144-L147 PolarHBondContact O-N 3.38Å; H144-E148 WeakPolarHBondContact O-CB 3.48Å; H144-E148 PolarHBondContact O-N 3.41Å |
| 145 | S | 95.9 | Very high | 94.6 | Very high | 41 Ų | 41 | 68 Ų | 68 | 29% | 0.287 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -65.8 | -38.8 | 179.3 | 70.3 | 0 | 0 | 0 | 0 | 112.8 | Q141 I142 K149 | Q141-S145 VanDerWaalsContact O-CB 3.3Å; Q141-S145 WeakPolarHBondContact O-CB 3.5Å; Q141-S145 PolarHBondContact O-N 2.91Å; Q141-S145 PolarHBondContact O-OG 3Å; I142-S145 WeakPolarHBondContact CA-OG 3.26Å; I142-S145 PolarHBondContact O-N 3.41Å; I142-S145 PolarHBondContact O-OG 3.43Å; S145-K149 VanDerWaalsContact O-CG 3.3Å; S145-K149 WeakPolarHBondContact O-CG 3.38Å; S145-K149 PolarHBondContact O-N 2.8Å |
| 146 | E | 95.7 | Very high | 94.8 | Very high | 43 Ų | 43 | 69.5 Ų | 69.5 | 20% | 0.201 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -73.1 | -41.5 | 177.3 | -68.5 | -59.9 | 120.2 | 0 | 0 | 110.7 | I142 Y143 E148 K149 Y150 L197 | I142-E146 HydrophobicContact CG2-CG 4.21Å; I142-E146 WeakPolarHBondContact O-CB 3.22Å; I142-E146 WeakPolarHBondContact O-CG 3.35Å; I142-E146 PolarHBondContact O-N 3.18Å; Y143-E146 PolarHBondContact O-N 2.7Å; E146-E148 VanDerWaalsContact C-N 3.34Å; E146-E148 PolarHBondContact O-N 3.25Å; E146-K149 PolarHBondContact O-N 2.99Å; E146-K149 IonicContact OE1-NZ 3.27Å; E146-K149 PolarHBondContact OE1-NZ 3.28Å; E146-Y150 HydrophobicContact CB-CD2 4.4Å; E146-Y150 HydrophobicContact CB-CE2 4.08Å; E146-Y150 WeakPolarHBondContact O-CB 3.3Å; E146-Y150 WeakPolarHBondContact O-CD2 3.3Å; E146-Y150 PolarHBondContact O-N 3Å; E146-L197 HydrophobicContact CB-CD1 3.91Å; E146-L197 HydrophobicContact CB-CD2 4.12Å |
| 147 | L | 93.6 | Very high | 94.9 | Very high | 25 Ų | 25 | 74 Ų | 74 | 13% | 0.131 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -57.5 | -46.5 | 175.5 | -172.2 | 72.3 | 0 | 0 | 0 | 111.4 | Y143 H144 K149 Y150 E151 Q194 L197 | Y143-L147 HydrophobicContact CE1-CD2 4.46Å; Y143-L147 VanDerWaalsContact O-CB 3.27Å; Y143-L147 WeakPolarHBondContact O-CB 3.3Å; Y143-L147 PolarHBondContact O-N 3.48Å; H144-L147 PolarHBondContact O-N 3.38Å; L147-K149 PolarHBondContact O-N 3.45Å; L147-Y150 PolarHBondContact O-N 3.49Å; L147-E151 HydrophobicContact CG-CG 4.48Å; L147-E151 WeakPolarHBondContact O-CB 3.5Å; L147-E151 WeakPolarHBondContact O-CG 2.96Å; L147-E151 PolarHBondContact O-N 2.91Å; L147-Q194 HydrophobicContact CD1-CG 4.19Å; L147-L197 HydrophobicContact CB-CD2 3.97Å; L147-L197 HydrophobicContact CD1-CD2 4.14Å |
| 148 | E | 94.5 | Very high | 95.1 | Very high | 132 Ų | 132 | 72 Ų | 72 | 62% | 0.617 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -62.3 | -43.4 | 179.1 | -176.6 | 174.5 | -153.5 | 0 | 0 | 112.4 | H144 E146 Y150 E151 Q152 | H144-E148 WeakPolarHBondContact O-CB 3.48Å; H144-E148 PolarHBondContact O-N 3.41Å; E146-E148 VanDerWaalsContact C-N 3.34Å; E146-E148 PolarHBondContact O-N 3.25Å; E148-Y150 VanDerWaalsContact C-N 3.34Å; E148-Y150 PolarHBondContact O-N 3.22Å; E148-E151 PolarHBondContact O-N 2.92Å; E148-Q152 WeakPolarHBondContact O-CB 3.38Å; E148-Q152 PolarHBondContact O-N 3.31Å |
| 149 | K | 94.6 | Very high | 95.1 | Very high | 122 Ų | 122 | 70.9 Ų | 70.9 | 53% | 0.53 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -59.2 | -46.1 | 175 | -72.2 | 170.8 | -169.3 | 171.2 | 0 | 111.5 | S145 E146 L147 Q152 A153 | S145-K149 VanDerWaalsContact O-CG 3.3Å; S145-K149 WeakPolarHBondContact O-CG 3.38Å; S145-K149 PolarHBondContact O-N 2.8Å; E146-K149 PolarHBondContact O-N 2.99Å; E146-K149 IonicContact OE1-NZ 3.27Å; E146-K149 PolarHBondContact OE1-NZ 3.28Å; L147-K149 PolarHBondContact O-N 3.45Å; K149-Q152 PolarHBondContact O-N 3.41Å; K149-A153 WeakPolarHBondContact O-CB 3.27Å; K149-A153 PolarHBondContact O-N 2.94Å |
| 150 | Y | 93.6 | Very high | 95.2 | Very high | 55 Ų | 55 | 75.3 Ų | 75.3 | 22% | 0.216 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -63 | -49.3 | 178.6 | -73.1 | -46 | 0 | 0 | 0 | 110.6 | E146 L147 E148 Q152 A153 C154 F190 I193 L197 | E146-Y150 HydrophobicContact CB-CD2 4.4Å; E146-Y150 HydrophobicContact CB-CE2 4.08Å; E146-Y150 WeakPolarHBondContact O-CB 3.3Å; E146-Y150 WeakPolarHBondContact O-CD2 3.3Å; E146-Y150 PolarHBondContact O-N 3Å; L147-Y150 PolarHBondContact O-N 3.49Å; E148-Y150 VanDerWaalsContact C-N 3.34Å; E148-Y150 PolarHBondContact O-N 3.22Å; Y150-Q152 VanDerWaalsContact C-N 3.29Å; Y150-Q152 PolarHBondContact O-N 2.86Å; Y150-A153 PolarHBondContact O-N 3.46Å; Y150-C154 WeakPolarHBondContact O-CB 3.48Å; Y150-C154 PolarHBondContact O-N 2.84Å; Y150-F190 WeakPolarHBondContact O-CE2 3.39Å; Y150-I193 HydrophobicContact CD1-CG2 3.91Å; Y150-I193 HydrophobicContact CD2-CG2 4.15Å; Y150-I193 HydrophobicContact CE1-CG2 3.9Å; Y150-I193 HydrophobicContact CE2-CG2 4.14Å; Y150-I193 HydrophobicContact CG-CG2 4.06Å; Y150-L197 HydrophobicContact CD2-CD2 3.98Å; Y150-L197 HydrophobicContact CE2-CD2 4.16Å |
| 151 | E | 93.8 | Very high | 95.2 | Very high | 71 Ų | 71 | 72 Ų | 72 | 33% | 0.332 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -60.5 | -40.1 | 179.1 | -73.9 | 179.6 | -180 | 0 | 0 | 112 | L147 E148 C154 R155 F190 | L147-E151 HydrophobicContact CG-CG 4.48Å; L147-E151 WeakPolarHBondContact O-CB 3.5Å; L147-E151 WeakPolarHBondContact O-CG 2.96Å; L147-E151 PolarHBondContact O-N 2.91Å; E148-E151 PolarHBondContact O-N 2.92Å; E151-C154 WeakPolarHBondContact O-CB 3.49Å; E151-C154 PolarHBondContact O-N 3.46Å; E151-R155 WeakPolarHBondContact O-CG 3.5Å; E151-R155 PolarHBondContact O-N 3.15Å; E151-R155 IonicContact OE2-NH1 3.01Å; E151-F190 HydrophobicContact CB-CZ 4.41Å; E151-F190 HydrophobicContact CG-CE1 4.24Å; E151-F190 HydrophobicContact CG-CZ 4.01Å |
| 152 | Q | 95.6 | Very high | 95.2 | Very high | 77 Ų | 77 | 66.6 Ų | 66.6 | 36% | 0.36 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -62.9 | -48.4 | 175.3 | -176.2 | 60.6 | 20.6 | 0 | 0 | 111.6 | E148 K149 Y150 C154 R155 E156 | E148-Q152 WeakPolarHBondContact O-CB 3.38Å; E148-Q152 PolarHBondContact O-N 3.31Å; K149-Q152 PolarHBondContact O-N 3.41Å; Y150-Q152 VanDerWaalsContact C-N 3.29Å; Y150-Q152 PolarHBondContact O-N 2.86Å; Q152-C154 VanDerWaalsContact C-N 3.27Å; Q152-C154 PolarHBondContact O-N 3.16Å; Q152-R155 PolarHBondContact O-N 3.46Å; Q152-E156 WeakPolarHBondContact CG-OE1 3.38Å; Q152-E156 PolarHBondContact NE2-OE1 3.11Å; Q152-E156 WeakPolarHBondContact O-CG 3.37Å; Q152-E156 PolarHBondContact O-N 3.23Å |
| 153 | A | 94.3 | Very high | 95.1 | Very high | 53 Ų | 53 | 67.2 Ų | 67.2 | 44% | 0.438 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -60.1 | -38.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | K149 Y150 F157 | K149-A153 WeakPolarHBondContact O-CB 3.27Å; K149-A153 PolarHBondContact O-N 2.94Å; Y150-A153 PolarHBondContact O-N 3.46Å; A153-F157 VanDerWaalsContact O-CB 3.22Å; A153-F157 WeakPolarHBondContact O-CB 3.46Å; A153-F157 PolarHBondContact O-N 3.43Å |
| 154 | C | 95.2 | Very high | 95 | Very high | 22 Ų | 22 | 70.8 Ų | 70.8 | 15% | 0.149 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -63.6 | -45.9 | 175.3 | -172.3 | 0 | 0 | 0 | 0 | 111.8 | Y150 E151 Q152 T158 F190 | Y150-C154 WeakPolarHBondContact O-CB 3.48Å; Y150-C154 PolarHBondContact O-N 2.84Å; E151-C154 WeakPolarHBondContact O-CB 3.49Å; E151-C154 PolarHBondContact O-N 3.46Å; Q152-C154 VanDerWaalsContact C-N 3.27Å; Q152-C154 PolarHBondContact O-N 3.16Å; C154-T158 WeakPolarHBondContact O-CB 3.42Å; C154-T158 PolarHBondContact O-N 3.45Å; C154-T158 PolarHBondContact O-OG1 2.92Å; C154-F190 HydrophobicContact CB-CD1 4.39Å; C154-F190 HydrophobicContact CB-CD2 3.49Å; C154-F190 VanDerWaalsContact CB-CD2 3.49Å; C154-F190 HydrophobicContact CB-CE1 4.49Å; C154-F190 HydrophobicContact CB-CE2 3.61Å; C154-F190 HydrophobicContact CB-CG 3.9Å; C154-F190 HydrophobicContact CB-CZ 4.13Å |
| 155 | R | 95.2 | Very high | 95 | Very high | 118 Ų | 118 | 67.9 Ų | 67.9 | 45% | 0.445 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61 | -47.7 | 176.1 | -74.2 | -173.1 | -66 | -95.8 | 4 | 111.6 | E151 Q152 T159 | E151-R155 WeakPolarHBondContact O-CG 3.5Å; E151-R155 PolarHBondContact O-N 3.15Å; E151-R155 IonicContact OE2-NH1 3.01Å; Q152-R155 PolarHBondContact O-N 3.46Å; R155-T159 VanDerWaalsContact O-CB 3.28Å; R155-T159 WeakPolarHBondContact O-CB 3.36Å; R155-T159 PolarHBondContact O-N 3.14Å; R155-T159 PolarHBondContact O-OG1 2.78Å |
| 156 | E | 96.4 | Very high | 94.7 | Very high | 116 Ų | 116 | 72.7 Ų | 72.7 | 54% | 0.542 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62.1 | -48.5 | 179.5 | -73.5 | 175.5 | -170.5 | 0 | 0 | 111.5 | Q152 T159 H160 | Q152-E156 WeakPolarHBondContact CG-OE1 3.38Å; Q152-E156 PolarHBondContact NE2-OE1 3.11Å; Q152-E156 WeakPolarHBondContact O-CG 3.37Å; Q152-E156 PolarHBondContact O-N 3.23Å; E156-T159 PolarHBondContact O-N 2.98Å; E156-H160 WeakPolarHBondContact O-CB 3.45Å; E156-H160 PolarHBondContact O-N 3.17Å |
| 157 | F | 96.1 | Very high | 94.4 | Very high | 111 Ų | 111 | 75.2 Ų | 75.2 | 49% | 0.487 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -66.2 | -43.7 | -179.4 | -172.3 | -117.4 | 0 | 0 | 0 | 112.3 | A153 T159 H160 V161 I186 | A153-F157 VanDerWaalsContact O-CB 3.22Å; A153-F157 WeakPolarHBondContact O-CB 3.46Å; A153-F157 PolarHBondContact O-N 3.43Å; F157-T159 VanDerWaalsContact C-N 3.3Å; F157-T159 PolarHBondContact O-N 2.84Å; F157-H160 PolarHBondContact O-N 3.41Å; F157-V161 HydrophobicContact CD1-CG2 4.41Å; F157-V161 HydrophobicContact CD2-CG2 4.33Å; F157-V161 HydrophobicContact CE1-CG2 4.06Å; F157-V161 HydrophobicContact CE2-CG2 3.96Å; F157-V161 HydrophobicContact CZ-CG2 3.81Å; F157-V161 WeakPolarHBondContact O-CG2 3.21Å; F157-V161 PolarHBondContact O-N 3.16Å; F157-I186 HydrophobicContact CD1-CD1 3.78Å; F157-I186 HydrophobicContact CD1-CG1 3.99Å; F157-I186 HydrophobicContact CD1-CG2 3.76Å; F157-I186 HydrophobicContact CE1-CD1 3.67Å; F157-I186 HydrophobicContact CE1-CG1 3.73Å; F157-I186 HydrophobicContact CE1-CG2 4.3Å |
| 158 | T | 96.1 | Very high | 94.1 | Very high | 26 Ų | 26 | 76.6 Ų | 76.6 | 16% | 0.16 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -61.2 | -41.6 | 176.2 | -59.1 | 0 | 0 | 0 | 0 | 111.2 | C154 T162 V183 | C154-T158 WeakPolarHBondContact O-CB 3.42Å; C154-T158 PolarHBondContact O-N 3.45Å; C154-T158 PolarHBondContact O-OG1 2.92Å; T158-T162 VanDerWaalsContact O-CB 3.24Å; T158-T162 WeakPolarHBondContact O-CB 3.41Å; T158-T162 PolarHBondContact O-N 3.43Å; T158-T162 PolarHBondContact O-OG1 2.86Å; T158-V183 HydrophobicContact CG2-CG1 3.82Å; T158-V183 HydrophobicContact CG2-CG2 4.09Å |
| 159 | T | 96.2 | Very high | 93.6 | Very high | 76 Ų | 76 | 72.1 Ų | 72.1 | 47% | 0.466 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -63.8 | -46.1 | 175.8 | -59.7 | 0 | 0 | 0 | 0 | 110.8 | R155 E156 F157 T162 N163 | R155-T159 VanDerWaalsContact O-CB 3.28Å; R155-T159 WeakPolarHBondContact O-CB 3.36Å; R155-T159 PolarHBondContact O-N 3.14Å; R155-T159 PolarHBondContact O-OG1 2.78Å; E156-T159 PolarHBondContact O-N 2.98Å; F157-T159 VanDerWaalsContact C-N 3.3Å; F157-T159 PolarHBondContact O-N 2.84Å; T159-T162 PolarHBondContact O-N 3.47Å; T159-N163 WeakPolarHBondContact O-CB 3.34Å; T159-N163 VanDerWaalsContact O-CG 3.24Å; T159-N163 PolarHBondContact O-N 3.39Å; T159-N163 PolarHBondContact O-ND2 3.11Å |
| 160 | H | 95.8 | Very high | 93 | Very high | 118 Ų | 118 | 73.4 Ų | 73.4 | 55% | 0.546 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -59.9 | -49.3 | 178 | -178.4 | 74.1 | 0 | 0 | 0 | 112.1 | E156 F157 T162 N163 L164 | E156-H160 WeakPolarHBondContact O-CB 3.45Å; E156-H160 PolarHBondContact O-N 3.17Å; F157-H160 PolarHBondContact O-N 3.41Å; H160-T162 PolarHBondContact O-N 2.97Å; H160-N163 PolarHBondContact O-N 3.08Å; H160-L164 WeakPolarHBondContact O-CB 3.29Å; H160-L164 PolarHBondContact O-N 2.85Å |
| 161 | V | 95.1 | Very high | 92.2 | Very high | 17 Ų | 17 | 74.9 Ų | 74.9 | 10% | 0.103 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -63.6 | -42.1 | 178.8 | 170.6 | 0 | 0 | 0 | 0 | 111.2 | F157 N163 L164 L165 M182 I186 | F157-V161 HydrophobicContact CD1-CG2 4.41Å; F157-V161 HydrophobicContact CD2-CG2 4.33Å; F157-V161 HydrophobicContact CE1-CG2 4.06Å; F157-V161 HydrophobicContact CE2-CG2 3.96Å; F157-V161 HydrophobicContact CZ-CG2 3.81Å; F157-V161 WeakPolarHBondContact O-CG2 3.21Å; F157-V161 PolarHBondContact O-N 3.16Å; V161-N163 PolarHBondContact O-N 3.03Å; V161-L164 PolarHBondContact O-N 3.19Å; V161-L165 HydrophobicContact CG1-CD1 3.83Å; V161-L165 HydrophobicContact CG1-CG 4.31Å; V161-L165 WeakPolarHBondContact O-CB 3.12Å; V161-L165 VanDerWaalsContact O-CG 3.3Å; V161-L165 WeakPolarHBondContact O-CG 3.41Å; V161-L165 PolarHBondContact O-N 2.97Å; V161-M182 HydrophobicContact CG1-CB 4.4Å; V161-I186 HydrophobicContact CB-CD1 3.93Å; V161-I186 HydrophobicContact CG1-CD1 4.01Å; V161-I186 HydrophobicContact CG2-CD1 3.84Å |
| 162 | T | 94.4 | Very high | 91.6 | Very high | 26 Ų | 26 | 77.3 Ų | 77.3 | 16% | 0.16 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -61.5 | -45.3 | 176.9 | -61.6 | 0 | 0 | 0 | 0 | 111.4 | T158 T159 H160 L165 R166 M179 | T158-T162 VanDerWaalsContact O-CB 3.24Å; T158-T162 WeakPolarHBondContact O-CB 3.41Å; T158-T162 PolarHBondContact O-N 3.43Å; T158-T162 PolarHBondContact O-OG1 2.86Å; T159-T162 PolarHBondContact O-N 3.47Å; H160-T162 PolarHBondContact O-N 2.97Å; T162-L165 PolarHBondContact O-N 3.25Å; T162-R166 WeakPolarHBondContact O-CB 3.45Å; T162-R166 VanDerWaalsContact O-CG 3.29Å; T162-R166 WeakPolarHBondContact O-CG 3.32Å; T162-R166 PolarHBondContact O-N 2.97Å; T162-M179 HydrophobicContact CG2-SD 4.01Å |
| 163 | N | 95.2 | Very high | 90.8 | Very high | 79 Ų | 79 | 75 Ų | 75 | 42% | 0.422 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -64.6 | -43.1 | 176.4 | -71.9 | -22.4 | 0 | 0 | 0 | 111.6 | T159 H160 V161 L165 R166 E167 | T159-N163 WeakPolarHBondContact O-CB 3.34Å; T159-N163 VanDerWaalsContact O-CG 3.24Å; T159-N163 PolarHBondContact O-N 3.39Å; T159-N163 PolarHBondContact O-ND2 3.11Å; H160-N163 PolarHBondContact O-N 3.08Å; V161-N163 PolarHBondContact O-N 3.03Å; N163-L165 PolarHBondContact O-N 2.96Å; N163-R166 PolarHBondContact O-N 3.42Å; N163-E167 WeakPolarHBondContact O-CG 3.42Å; N163-E167 PolarHBondContact O-N 3.42Å |
| 164 | L | 94.1 | Very high | 90.2 | Very high | 83 Ų | 83 | 73.1 Ų | 73.1 | 44% | 0.435 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.2 | -45.8 | 176.5 | 179.8 | 63.2 | 0 | 0 | 0 | 111.7 | H160 V161 R166 E167 Q168 | H160-L164 WeakPolarHBondContact O-CB 3.29Å; H160-L164 PolarHBondContact O-N 2.85Å; V161-L164 PolarHBondContact O-N 3.19Å; L164-R166 VanDerWaalsContact C-N 3.34Å; L164-R166 PolarHBondContact O-N 3.37Å; L164-E167 PolarHBondContact O-N 3.36Å; L164-Q168 WeakPolarHBondContact O-CB 3.44Å; L164-Q168 WeakPolarHBondContact O-CG 3.34Å; L164-Q168 PolarHBondContact O-N 2.95Å |
| 165 | L | 92.6 | Very high | 89.6 | Confident | 15 Ų | 15 | 73.6 Ų | 73.6 | 8% | 0.079 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -66.9 | -34.6 | 178.1 | -70.2 | 173.3 | 0 | 0 | 0 | 112.1 | V161 T162 N163 Q168 S169 V174 M179 M182 | V161-L165 HydrophobicContact CG1-CD1 3.83Å; V161-L165 HydrophobicContact CG1-CG 4.31Å; V161-L165 WeakPolarHBondContact O-CB 3.12Å; V161-L165 VanDerWaalsContact O-CG 3.3Å; V161-L165 WeakPolarHBondContact O-CG 3.41Å; V161-L165 PolarHBondContact O-N 2.97Å; T162-L165 PolarHBondContact O-N 3.25Å; N163-L165 PolarHBondContact O-N 2.96Å; L165-Q168 PolarHBondContact O-N 3.19Å; L165-S169 WeakPolarHBondContact O-CB 3.29Å; L165-S169 PolarHBondContact O-N 3.28Å; L165-V174 HydrophobicContact CD2-CG1 4.38Å; L165-M179 HydrophobicContact CB-CE 4.01Å; L165-M179 HydrophobicContact CB-CG 4.32Å; L165-M179 HydrophobicContact CD1-CB 4.29Å; L165-M179 HydrophobicContact CD1-CG 4Å; L165-M182 HydrophobicContact CD1-CB 3.89Å; L165-M182 HydrophobicContact CD1-CG 4.02Å |
| 166 | R | 90.5 | Very high | 89 | Confident | 142 Ų | 142 | 72.7 Ų | 72.7 | 54% | 0.536 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -66 | -38.4 | 171.1 | -76.1 | 176.6 | -179.6 | -176.9 | 0 | 112.8 | T162 N163 L164 S169 M179 | T162-R166 WeakPolarHBondContact O-CB 3.45Å; T162-R166 VanDerWaalsContact O-CG 3.29Å; T162-R166 WeakPolarHBondContact O-CG 3.32Å; T162-R166 PolarHBondContact O-N 2.97Å; N163-R166 PolarHBondContact O-N 3.42Å; L164-R166 VanDerWaalsContact C-N 3.34Å; L164-R166 PolarHBondContact O-N 3.37Å; R166-S169 PolarHBondContact O-N 3.42Å; R166-S169 PolarHBondContact O-OG 3.01Å; R166-M179 HydrophobicContact CG-CE 3.75Å; R166-M179 HydrophobicContact CG-SD 4.37Å |
| 167 | E | 88.7 | Confident | 88.4 | Confident | 96 Ų | 96 | 75.5 Ų | 75.5 | 45% | 0.449 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -70.4 | -38.6 | 174.6 | -71.8 | -54.8 | 118.3 | 0 | 0 | 111.5 | N163 L164 S169 R170 | N163-E167 WeakPolarHBondContact O-CG 3.42Å; N163-E167 PolarHBondContact O-N 3.42Å; L164-E167 PolarHBondContact O-N 3.36Å; E167-S169 VanDerWaalsContact C-N 3.31Å; E167-S169 PolarHBondContact O-N 2.86Å; E167-R170 VanDerWaalsContact CD-NH1 3.27Å; E167-R170 WeakPolarHBondContact O-CB 3.48Å; E167-R170 PolarHBondContact O-N 2.93Å; E167-R170 IonicContact OE1-CZ 3.64Å; E167-R170 IonicContact OE1-NE 2.75Å; E167-R170 PolarHBondContact OE1-NE 3.12Å; E167-R170 IonicContact OE1-NH1 3.04Å; E167-R170 PolarHBondContact OE1-NH1 3.3Å; E167-R170 IonicContact OE1-NH2 3.34Å; E167-R170 PolarHBondContact OE1-NH2 3.06Å; E167-R170 IonicContact OE2-CZ 3.42Å; E167-R170 IonicContact OE2-NE 2.72Å; E167-R170 IonicContact OE2-NH1 2.71Å; E167-R170 PolarHBondContact OE2-NH1 2.63Å |
| 168 | Q | 87.8 | Confident | 87.8 | Confident | 53 Ų | 53 | 72.5 Ų | 72.5 | 25% | 0.248 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -64.7 | -34.5 | 174.1 | -74.4 | -174.2 | -4.6 | 0 | 0 | 112.7 | L164 L165 R170 V171 R172 V174 | L164-Q168 WeakPolarHBondContact O-CB 3.44Å; L164-Q168 WeakPolarHBondContact O-CG 3.34Å; L164-Q168 PolarHBondContact O-N 2.95Å; L165-Q168 PolarHBondContact O-N 3.19Å; Q168-R170 PolarHBondContact O-N 3.26Å; Q168-R170 VanDerWaalsContact O-N 3.07Å; Q168-V171 VanDerWaalsContact O-CG2 3.27Å; Q168-V171 WeakPolarHBondContact O-CG2 3.48Å; Q168-V171 PolarHBondContact O-N 2.78Å; Q168-R172 PolarHBondContact O-N 3.1Å; Q168-V174 HydrophobicContact CB-CG2 4.15Å |
| 169 | S | 85.3 | Confident | 87.5 | Confident | 38 Ų | 38 | 73 Ų | 73 | 27% | 0.266 | 36% | 0.356 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.4 | -16.1 | 178.3 | 78.8 | 0 | 0 | 0 | 0 | 113 | F62 L165 R166 E167 R172 | F62-S169 WeakPolarHBondContact CE2-O 3.33Å; F62-S169 WeakPolarHBondContact CZ-O 3.39Å; L165-S169 WeakPolarHBondContact O-CB 3.29Å; L165-S169 PolarHBondContact O-N 3.28Å; R166-S169 PolarHBondContact O-N 3.42Å; R166-S169 PolarHBondContact O-OG 3.01Å; E167-S169 VanDerWaalsContact C-N 3.31Å; E167-S169 PolarHBondContact O-N 2.86Å; S169-R172 WeakPolarHBondContact CA-O 3.49Å |
| 170 | R | 81.2 | Confident | 87.2 | Confident | 149 Ų | 149 | 74.9 Ų | 74.9 | 56% | 0.562 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74 | -30.1 | 173.6 | -60.8 | 177 | 172.7 | 176.4 | -4.6 | 113.5 | K58 E167 Q168 | K58-R170 PolarHBondContact NZ-O 3.18Å; E167-R170 VanDerWaalsContact CD-NH1 3.27Å; E167-R170 WeakPolarHBondContact O-CB 3.48Å; E167-R170 PolarHBondContact O-N 2.93Å; E167-R170 IonicContact OE1-CZ 3.64Å; E167-R170 IonicContact OE1-NE 2.75Å; E167-R170 PolarHBondContact OE1-NE 3.12Å; E167-R170 IonicContact OE1-NH1 3.04Å; E167-R170 PolarHBondContact OE1-NH1 3.3Å; E167-R170 IonicContact OE1-NH2 3.34Å; E167-R170 PolarHBondContact OE1-NH2 3.06Å; E167-R170 IonicContact OE2-CZ 3.42Å; E167-R170 IonicContact OE2-NE 2.72Å; E167-R170 IonicContact OE2-NH1 2.71Å; E167-R170 PolarHBondContact OE2-NH1 2.63Å; Q168-R170 PolarHBondContact O-N 3.26Å; Q168-R170 VanDerWaalsContact O-N 3.07Å |
| 171 | V | 76.4 | Confident | 86.8 | Confident | 87 Ų | 87 | 73.1 Ų | 73.1 | 53% | 0.527 | 35% | 0.351 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110 | -22.6 | -172.7 | -65.9 | 0 | 0 | 0 | 0 | 113.5 | Q168 | Q168-V171 VanDerWaalsContact O-CG2 3.27Å; Q168-V171 WeakPolarHBondContact O-CG2 3.48Å; Q168-V171 PolarHBondContact O-N 2.78Å |
| 172 | R | 81 | Confident | 86.6 | Confident | 122 Ų | 122 | 75.9 Ų | 75.9 | 46% | 0.46 | 36% | 0.364 | S | S | . | . | S | Bend | trans | -143.8 | 152.6 | 176.3 | 70.8 | -179.1 | -174.5 | 172.9 | 3.9 | 111.4 | Q168 S169 V174 | Q168-R172 PolarHBondContact O-N 3.1Å; S169-R172 WeakPolarHBondContact CA-O 3.49Å; R172-V174 HydrophobicContact CG-CG2 4.06Å; R172-V174 PolarHBondContact O-N 2.71Å |
| 173 | P | 79.2 | Confident | 86.5 | Confident | 28 Ų | 28 | 75.7 Ų | 75.7 | 18% | 0.182 | 36% | 0.363 | C | S | . | . | trans | -57.4 | 110.8 | 172.3 | -24.9 | 34.4 | 0 | 0 | 0 | 112.1 | F62 L65 K69 | F62-P173 HydrophobicContact CD2-CG 4.38Å; F62-P173 HydrophobicContact CE2-CG 4.31Å; L65-P173 HydrophobicContact CB-CB 4.42Å; L65-P173 HydrophobicContact CB-CG 3.57Å; L65-P173 HydrophobicContact CD1-CG 4.16Å; K69-P173 HydrophobicContact CD-CB 4.39Å; K69-P173 PolarHBondContact NZ-O 2.95Å | ||
| 174 | V | 82.6 | Confident | 86.4 | Confident | 13 Ų | 13 | 75.9 Ų | 75.9 | 8% | 0.079 | 36% | 0.364 | C | S | . | . | trans | -119.7 | 119.7 | 169.1 | -179.1 | 0 | 0 | 0 | 0 | 106.7 | L165 Q168 R172 E178 | L165-V174 HydrophobicContact CD2-CG1 4.38Å; Q168-V174 HydrophobicContact CB-CG2 4.15Å; R172-V174 HydrophobicContact CG-CG2 4.06Å; R172-V174 PolarHBondContact O-N 2.71Å; V174-E178 HydrophobicContact CG1-CG 4.45Å | ||
| 175 | S | 81.4 | Confident | 86.2 | Confident | 33 Ų | 33 | 74.5 Ų | 74.5 | 23% | 0.231 | 36% | 0.359 | C | S | . | . | trans | -80.4 | 152 | -178.6 | 72.3 | 0 | 0 | 0 | 0 | 111 | R177 E178 M179 | S175-R177 PolarHBondContact O-N 2.89Å; S175-E178 PolarHBondContact N-OE2 2.85Å; S175-E178 WeakPolarHBondContact O-CB 3.35Å; S175-E178 PolarHBondContact O-N 3.29Å; S175-E178 VanDerWaalsContact O-N 3.15Å; S175-E178 VanDerWaalsContact OG-CB 3.29Å; S175-E178 WeakPolarHBondContact OG-CB 3.48Å; S175-E178 PolarHBondContact OG-N 3.26Å; S175-E178 VanDerWaalsContact OG-N 3.11Å; S175-M179 PolarHBondContact O-N 3.38Å | ||
| 176 | C | 83.9 | Confident | 86.2 | Confident | 99 Ų | 99 | 74.7 Ų | 74.7 | 67% | 0.669 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -57.6 | -37.9 | 173.6 | -61.1 | 0 | 0 | 0 | 0 | 111.7 | E178 M179 E180 | C176-E178 VanDerWaalsContact C-N 3.32Å; C176-E178 PolarHBondContact O-N 3Å; C176-M179 WeakPolarHBondContact O-CB 3.3Å; C176-M179 PolarHBondContact O-N 2.86Å; C176-M179 VanDerWaalsContact O-N 3.16Å; C176-E180 WeakPolarHBondContact O-CG 3.43Å; C176-E180 PolarHBondContact O-N 3.19Å |
| 177 | R | 82.7 | Confident | 86.3 | Confident | 174 Ų | 174 | 72.5 Ų | 72.5 | 66% | 0.657 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -61.2 | -38.2 | 176.9 | -66.9 | -174.2 | 178.1 | -150.3 | -1.7 | 113 | S175 E180 H181 | S175-R177 PolarHBondContact O-N 2.89Å; R177-E180 PolarHBondContact O-N 3.34Å; R177-H181 VanDerWaalsContact O-CB 3.31Å; R177-H181 WeakPolarHBondContact O-CB 3.48Å; R177-H181 PolarHBondContact O-N 3.36Å |
| 178 | E | 84.4 | Confident | 86.3 | Confident | 48 Ų | 48 | 71.4 Ų | 71.4 | 22% | 0.224 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -67.6 | -38.4 | 176.1 | 179.4 | -179.7 | -169.9 | 0 | 0 | 111.4 | K69 V174 S175 C176 H181 M182 | K69-E178 IonicContact NZ-OE1 3.75Å; K69-E178 PolarHBondContact NZ-OE1 3.41Å; K69-E178 IonicContact NZ-OE2 3.38Å; K69-E178 PolarHBondContact NZ-OE2 3.47Å; V174-E178 HydrophobicContact CG1-CG 4.45Å; S175-E178 PolarHBondContact N-OE2 2.85Å; S175-E178 WeakPolarHBondContact O-CB 3.35Å; S175-E178 PolarHBondContact O-N 3.29Å; S175-E178 VanDerWaalsContact O-N 3.15Å; S175-E178 VanDerWaalsContact OG-CB 3.29Å; S175-E178 WeakPolarHBondContact OG-CB 3.48Å; S175-E178 PolarHBondContact OG-N 3.26Å; S175-E178 VanDerWaalsContact OG-N 3.11Å; C176-E178 VanDerWaalsContact C-N 3.32Å; C176-E178 PolarHBondContact O-N 3Å; E178-H181 PolarHBondContact O-N 3.39Å; E178-M182 WeakPolarHBondContact O-CG 2.8Å; E178-M182 PolarHBondContact O-N 3.29Å |
| 179 | M | 88.3 | Confident | 86.5 | Confident | 36 Ų | 36 | 76 Ų | 76 | 18% | 0.177 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -64.1 | -46.9 | 173.8 | -170.6 | -177.9 | -60 | 0 | 0 | 111.7 | T162 L165 R166 S175 C176 H181 M182 V183 | T162-M179 HydrophobicContact CG2-SD 4.01Å; L165-M179 HydrophobicContact CB-CE 4.01Å; L165-M179 HydrophobicContact CB-CG 4.32Å; L165-M179 HydrophobicContact CD1-CB 4.29Å; L165-M179 HydrophobicContact CD1-CG 4Å; R166-M179 HydrophobicContact CG-CE 3.75Å; R166-M179 HydrophobicContact CG-SD 4.37Å; S175-M179 PolarHBondContact O-N 3.38Å; C176-M179 WeakPolarHBondContact O-CB 3.3Å; C176-M179 PolarHBondContact O-N 2.86Å; C176-M179 VanDerWaalsContact O-N 3.16Å; M179-H181 PolarHBondContact O-N 2.94Å; M179-M182 PolarHBondContact O-N 3.02Å; M179-V183 WeakPolarHBondContact O-CG2 3.32Å; M179-V183 PolarHBondContact O-N 2.74Å |
| 180 | E | 89.6 | Confident | 86.8 | Confident | 117 Ų | 117 | 75.6 Ų | 75.6 | 55% | 0.547 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -59.8 | -44.6 | 175 | -71.7 | 166.8 | -176.2 | 0 | 0 | 111.6 | C176 R177 M182 V183 N184 | C176-E180 WeakPolarHBondContact O-CG 3.43Å; C176-E180 PolarHBondContact O-N 3.19Å; R177-E180 PolarHBondContact O-N 3.34Å; E180-M182 VanDerWaalsContact C-N 3.34Å; E180-M182 PolarHBondContact O-N 3.38Å; E180-V183 PolarHBondContact O-N 2.87Å; E180-N184 WeakPolarHBondContact O-CB 3.39Å; E180-N184 PolarHBondContact O-N 3.33Å; E180-N184 PolarHBondContact O-ND2 2.98Å |
| 181 | H | 88.5 | Confident | 87.2 | Confident | 80 Ų | 80 | 70.6 Ų | 70.6 | 37% | 0.37 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -61 | -41.7 | 178 | -178.1 | 71.8 | 0 | 0 | 0 | 112.6 | R177 E178 M179 N184 T185 | R177-H181 VanDerWaalsContact O-CB 3.31Å; R177-H181 WeakPolarHBondContact O-CB 3.48Å; R177-H181 PolarHBondContact O-N 3.36Å; E178-H181 PolarHBondContact O-N 3.39Å; M179-H181 PolarHBondContact O-N 2.94Å; H181-N184 PolarHBondContact O-N 3.31Å; H181-T185 PolarHBondContact O-N 3.48Å; H181-T185 PolarHBondContact O-OG1 2.71Å |
| 182 | M | 91.1 | Very high | 87.8 | Confident | 76 Ų | 76 | 68.3 Ų | 68.3 | 37% | 0.374 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -63.1 | -43.8 | 175.1 | -75.7 | -56.6 | -43.5 | 0 | 0 | 111.8 | V161 L165 E178 M179 E180 T185 I186 | V161-M182 HydrophobicContact CG1-CB 4.4Å; L165-M182 HydrophobicContact CD1-CB 3.89Å; L165-M182 HydrophobicContact CD1-CG 4.02Å; E178-M182 WeakPolarHBondContact O-CG 2.8Å; E178-M182 PolarHBondContact O-N 3.29Å; M179-M182 PolarHBondContact O-N 3.02Å; E180-M182 VanDerWaalsContact C-N 3.34Å; E180-M182 PolarHBondContact O-N 3.38Å; M182-T185 WeakPolarHBondContact O-CB 3.5Å; M182-T185 PolarHBondContact O-N 2.95Å; M182-I186 VanDerWaalsContact O-CG1 3.3Å; M182-I186 WeakPolarHBondContact O-CG1 3.5Å; M182-I186 PolarHBondContact O-N 3.33Å; M182-I186 VanDerWaalsContact O-N 3.14Å |
| 183 | V | 93.1 | Very high | 88.3 | Confident | 22 Ų | 22 | 64.6 Ų | 64.6 | 13% | 0.133 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -63.1 | -43.6 | 175.6 | 172.2 | 0 | 0 | 0 | 0 | 111.2 | T158 M179 E180 T185 I186 Q187 | T158-V183 HydrophobicContact CG2-CG1 3.82Å; T158-V183 HydrophobicContact CG2-CG2 4.09Å; M179-V183 WeakPolarHBondContact O-CG2 3.32Å; M179-V183 PolarHBondContact O-N 2.74Å; E180-V183 PolarHBondContact O-N 2.87Å; V183-T185 VanDerWaalsContact C-N 3.32Å; V183-T185 PolarHBondContact O-N 2.92Å; V183-I186 WeakPolarHBondContact O-CB 3.41Å; V183-I186 PolarHBondContact O-N 2.82Å; V183-I186 VanDerWaalsContact O-N 3.15Å; V183-Q187 HydrophobicContact CG1-CG 4.44Å; V183-Q187 WeakPolarHBondContact O-CG 3.49Å; V183-Q187 PolarHBondContact O-N 3.18Å |
| 184 | N | 91.4 | Very high | 88.9 | Confident | 82 Ų | 82 | 65.2 Ų | 65.2 | 44% | 0.439 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -62.3 | -39.3 | 177.1 | -69 | -15.9 | 0 | 0 | 0 | 111.6 | E180 H181 I186 Q187 S188 | E180-N184 WeakPolarHBondContact O-CB 3.39Å; E180-N184 PolarHBondContact O-N 3.33Å; E180-N184 PolarHBondContact O-ND2 2.98Å; H181-N184 PolarHBondContact O-N 3.31Å; N184-I186 VanDerWaalsContact C-N 3.31Å; N184-I186 PolarHBondContact O-N 2.99Å; N184-Q187 PolarHBondContact O-N 3.4Å; N184-S188 PolarHBondContact O-N 3.2Å; N184-S188 PolarHBondContact O-OG 3.45Å; N184-S188 VanDerWaalsContact O-OG 3.14Å |
| 185 | T | 91.4 | Very high | 89.3 | Confident | 55 Ų | 55 | 68.2 Ų | 68.2 | 34% | 0.337 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -60.2 | -42.1 | 174.7 | -59.7 | 0 | 0 | 0 | 0 | 111.4 | H181 M182 V183 S188 K189 | H181-T185 PolarHBondContact O-N 3.48Å; H181-T185 PolarHBondContact O-OG1 2.71Å; M182-T185 WeakPolarHBondContact O-CB 3.5Å; M182-T185 PolarHBondContact O-N 2.95Å; V183-T185 VanDerWaalsContact C-N 3.32Å; V183-T185 PolarHBondContact O-N 2.92Å; T185-S188 PolarHBondContact O-N 3.3Å; T185-K189 WeakPolarHBondContact O-CG 3.35Å; T185-K189 PolarHBondContact O-N 3.04Å; T185-K189 VanDerWaalsContact O-N 3.11Å |
| 186 | I | 91.8 | Very high | 89.9 | Confident | 18 Ų | 18 | 71.5 Ų | 71.5 | 9% | 0.092 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -63.1 | -47.7 | 175.9 | -64.3 | 168.2 | 0 | 0 | 0 | 110.5 | F157 V161 M182 V183 N184 S188 K189 F190 | F157-I186 HydrophobicContact CD1-CD1 3.78Å; F157-I186 HydrophobicContact CD1-CG1 3.99Å; F157-I186 HydrophobicContact CD1-CG2 3.76Å; F157-I186 HydrophobicContact CE1-CD1 3.67Å; F157-I186 HydrophobicContact CE1-CG1 3.73Å; F157-I186 HydrophobicContact CE1-CG2 4.3Å; V161-I186 HydrophobicContact CB-CD1 3.93Å; V161-I186 HydrophobicContact CG1-CD1 4.01Å; V161-I186 HydrophobicContact CG2-CD1 3.84Å; M182-I186 VanDerWaalsContact O-CG1 3.3Å; M182-I186 WeakPolarHBondContact O-CG1 3.5Å; M182-I186 PolarHBondContact O-N 3.33Å; M182-I186 VanDerWaalsContact O-N 3.14Å; V183-I186 WeakPolarHBondContact O-CB 3.41Å; V183-I186 PolarHBondContact O-N 2.82Å; V183-I186 VanDerWaalsContact O-N 3.15Å; N184-I186 VanDerWaalsContact C-N 3.31Å; N184-I186 PolarHBondContact O-N 2.99Å; I186-S188 VanDerWaalsContact C-N 3.34Å; I186-S188 PolarHBondContact O-N 3.31Å; I186-K189 PolarHBondContact O-N 2.85Å; I186-F190 PolarHBondContact O-N 3.34Å |
| 187 | Q | 91.7 | Very high | 90.4 | Very high | 97 Ų | 97 | 67.6 Ų | 67.6 | 45% | 0.453 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -60.8 | -41.2 | 178.2 | -70.3 | 177.6 | 0.3 | 0 | 0 | 111.9 | V183 N184 K189 F190 S191 | V183-Q187 HydrophobicContact CG1-CG 4.44Å; V183-Q187 WeakPolarHBondContact O-CG 3.49Å; V183-Q187 PolarHBondContact O-N 3.18Å; N184-Q187 PolarHBondContact O-N 3.4Å; Q187-K189 PolarHBondContact O-N 3.28Å; Q187-F190 WeakPolarHBondContact O-CB 3.44Å; Q187-F190 PolarHBondContact O-N 3.05Å; Q187-F190 VanDerWaalsContact O-N 3.16Å; Q187-S191 PolarHBondContact O-N 2.97Å; Q187-S191 PolarHBondContact O-OG 2.91Å |
| 188 | S | 90.3 | Very high | 90.9 | Very high | 73 Ų | 73 | 59.9 Ų | 59.9 | 51% | 0.51 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -62.7 | -41 | 175.8 | -66.2 | 0 | 0 | 0 | 0 | 112.6 | N184 T185 I186 F190 S191 A192 | N184-S188 PolarHBondContact O-N 3.2Å; N184-S188 PolarHBondContact O-OG 3.45Å; N184-S188 VanDerWaalsContact O-OG 3.14Å; T185-S188 PolarHBondContact O-N 3.3Å; I186-S188 VanDerWaalsContact C-N 3.34Å; I186-S188 PolarHBondContact O-N 3.31Å; S188-F190 VanDerWaalsContact C-N 3.32Å; S188-S191 PolarHBondContact O-N 3.31Å; S188-A192 PolarHBondContact O-N 2.9Å |
| 189 | K | 90.7 | Very high | 91.4 | Very high | 148 Ų | 148 | 60.1 Ų | 60.1 | 64% | 0.643 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -64.2 | -40 | 173.4 | -67.4 | -66.2 | -179.4 | -176.5 | 0 | 111.3 | T185 I186 Q187 A192 I193 | T185-K189 WeakPolarHBondContact O-CG 3.35Å; T185-K189 PolarHBondContact O-N 3.04Å; T185-K189 VanDerWaalsContact O-N 3.11Å; I186-K189 PolarHBondContact O-N 2.85Å; Q187-K189 PolarHBondContact O-N 3.28Å; K189-A192 WeakPolarHBondContact O-CB 3.26Å; K189-A192 PolarHBondContact O-N 3.47Å; K189-I193 PolarHBondContact O-N 3.22Å |
| 190 | F | 91.7 | Very high | 91.7 | Very high | 30 Ų | 30 | 60.5 Ų | 60.5 | 13% | 0.132 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -64.3 | -44.3 | 177.2 | -168.9 | -101.8 | 0 | 0 | 0 | 112.7 | Y150 E151 C154 I186 Q187 S188 A192 I193 Q194 | Y150-F190 WeakPolarHBondContact O-CE2 3.39Å; E151-F190 HydrophobicContact CB-CZ 4.41Å; E151-F190 HydrophobicContact CG-CE1 4.24Å; E151-F190 HydrophobicContact CG-CZ 4.01Å; C154-F190 HydrophobicContact CB-CD1 4.39Å; C154-F190 HydrophobicContact CB-CD2 3.49Å; C154-F190 VanDerWaalsContact CB-CD2 3.49Å; C154-F190 HydrophobicContact CB-CE1 4.49Å; C154-F190 HydrophobicContact CB-CE2 3.61Å; C154-F190 HydrophobicContact CB-CG 3.9Å; C154-F190 HydrophobicContact CB-CZ 4.13Å; I186-F190 PolarHBondContact O-N 3.34Å; Q187-F190 WeakPolarHBondContact O-CB 3.44Å; Q187-F190 PolarHBondContact O-N 3.05Å; Q187-F190 VanDerWaalsContact O-N 3.16Å; S188-F190 VanDerWaalsContact C-N 3.32Å; F190-A192 PolarHBondContact O-N 3.16Å; F190-I193 WeakPolarHBondContact O-CB 3.38Å; F190-I193 PolarHBondContact O-N 3.42Å; F190-Q194 PolarHBondContact O-N 3.07Å |
| 191 | S | 89.4 | Confident | 92 | Very high | 44 Ų | 44 | 55.5 Ų | 55.5 | 31% | 0.308 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -56.8 | -37.6 | 174.1 | -67.4 | 0 | 0 | 0 | 0 | 111.9 | Q187 S188 Q194 R195 | Q187-S191 PolarHBondContact O-N 2.97Å; Q187-S191 PolarHBondContact O-OG 2.91Å; S188-S191 PolarHBondContact O-N 3.31Å; S191-Q194 PolarHBondContact O-N 3.21Å; S191-R195 WeakPolarHBondContact O-CG 3.32Å; S191-R195 PolarHBondContact O-N 3.12Å |
| 192 | A | 90.5 | Very high | 92.3 | Very high | 40 Ų | 40 | 51.9 Ų | 51.9 | 33% | 0.331 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -64.3 | -42.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | S188 K189 F190 R195 Q196 | S188-A192 PolarHBondContact O-N 2.9Å; K189-A192 WeakPolarHBondContact O-CB 3.26Å; K189-A192 PolarHBondContact O-N 3.47Å; F190-A192 PolarHBondContact O-N 3.16Å; A192-R195 WeakPolarHBondContact O-CB 3.35Å; A192-R195 PolarHBondContact O-N 2.81Å; A192-Q196 PolarHBondContact O-N 2.98Å; A192-Q196 VanDerWaalsContact O-N 3.1Å |
| 193 | I | 91.8 | Very high | 92.5 | Very high | 44 Ų | 44 | 53.1 Ų | 53.1 | 23% | 0.226 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.7 | -44.8 | 175.3 | -63.6 | 168.2 | 0 | 0 | 0 | 110.3 | Y150 K189 F190 R195 Q196 L197 | Y150-I193 HydrophobicContact CD1-CG2 3.91Å; Y150-I193 HydrophobicContact CD2-CG2 4.15Å; Y150-I193 HydrophobicContact CE1-CG2 3.9Å; Y150-I193 HydrophobicContact CE2-CG2 4.14Å; Y150-I193 HydrophobicContact CG-CG2 4.06Å; K189-I193 PolarHBondContact O-N 3.22Å; F190-I193 WeakPolarHBondContact O-CB 3.38Å; F190-I193 PolarHBondContact O-N 3.42Å; I193-R195 VanDerWaalsContact C-N 3.31Å; I193-R195 PolarHBondContact O-N 3.22Å; I193-Q196 WeakPolarHBondContact O-CB 3.43Å; I193-Q196 PolarHBondContact O-N 3.33Å; I193-Q196 VanDerWaalsContact O-N 3.12Å; I193-L197 PolarHBondContact O-N 3.05Å |
| 194 | Q | 91.2 | Very high | 92.6 | Very high | 40 Ų | 40 | 54 Ų | 54 | 19% | 0.187 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -59.4 | -40.9 | 177.2 | -175.5 | 176 | -71.1 | 0 | 0 | 111.9 | L147 F190 S191 L197 K198 | L147-Q194 HydrophobicContact CD1-CG 4.19Å; F190-Q194 PolarHBondContact O-N 3.07Å; S191-Q194 PolarHBondContact O-N 3.21Å; Q194-L197 PolarHBondContact O-N 2.94Å; Q194-K198 HydrophobicContact CG-CD 4.45Å; Q194-K198 WeakPolarHBondContact O-CG 3.47Å; Q194-K198 PolarHBondContact O-N 3.01Å |
| 195 | R | 90.4 | Very high | 92.7 | Very high | 76 Ų | 76 | 50.1 Ų | 50.1 | 29% | 0.287 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -59.2 | -47.1 | 173.1 | -77.8 | -177.6 | -54.8 | -123.9 | 1.3 | 112.1 | D85 L88 S191 A192 I193 L197 K198 Q199 | D85-R195 WeakPolarHBondContact OD2-CD 3.29Å; D85-R195 IonicContact OD2-CZ 2.63Å; D85-R195 VanDerWaalsContact OD2-CZ 3.27Å; D85-R195 IonicContact OD2-NE 3.7Å; D85-R195 PolarHBondContact OD2-NE 3.38Å; D85-R195 IonicContact OD2-NH1 3Å; D85-R195 PolarHBondContact OD2-NH1 2.67Å; L88-R195 HydrophobicContact CB-CG 4.07Å; L88-R195 HydrophobicContact CD1-CG 3.68Å; L88-R195 HydrophobicContact CD2-CG 4.47Å; L88-R195 HydrophobicContact CG-CG 4.28Å; S191-R195 WeakPolarHBondContact O-CG 3.32Å; S191-R195 PolarHBondContact O-N 3.12Å; A192-R195 WeakPolarHBondContact O-CB 3.35Å; A192-R195 PolarHBondContact O-N 2.81Å; I193-R195 VanDerWaalsContact C-N 3.31Å; I193-R195 PolarHBondContact O-N 3.22Å; R195-L197 VanDerWaalsContact C-N 3.35Å; R195-L197 PolarHBondContact O-N 3.44Å; R195-K198 PolarHBondContact O-N 2.85Å; R195-Q199 WeakPolarHBondContact O-CB 3.46Å; R195-Q199 PolarHBondContact O-N 2.93Å |
| 196 | Q | 93.6 | Very high | 92.6 | Very high | 102 Ų | 102 | 51.5 Ų | 51.5 | 48% | 0.477 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -62.7 | -42.3 | -180 | -172.9 | 176.7 | -8.1 | 0 | 0 | 111.7 | A192 I193 Q199 S200 | A192-Q196 PolarHBondContact O-N 2.98Å; A192-Q196 VanDerWaalsContact O-N 3.1Å; I193-Q196 WeakPolarHBondContact O-CB 3.43Å; I193-Q196 PolarHBondContact O-N 3.33Å; I193-Q196 VanDerWaalsContact O-N 3.12Å; Q196-Q199 PolarHBondContact O-N 3.45Å; Q196-S200 WeakPolarHBondContact O-CB 3.44Å; Q196-S200 PolarHBondContact O-N 2.85Å |
| 197 | L | 94.2 | Very high | 92.7 | Very high | 17 Ų | 17 | 54 Ų | 54 | 9% | 0.089 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -60.6 | -47.3 | 175.3 | 177.7 | 63 | 0 | 0 | 0 | 111.5 | Y143 E146 L147 Y150 I193 Q194 R195 S200 T201 | Y143-L197 HydrophobicContact CD2-CD1 4.42Å; Y143-L197 HydrophobicContact CD2-CD2 4.07Å; Y143-L197 HydrophobicContact CD2-CG 3.91Å; Y143-L197 HydrophobicContact CE2-CD2 4.05Å; Y143-L197 HydrophobicContact CE2-CG 4.03Å; E146-L197 HydrophobicContact CB-CD1 3.91Å; E146-L197 HydrophobicContact CB-CD2 4.12Å; L147-L197 HydrophobicContact CB-CD2 3.97Å; L147-L197 HydrophobicContact CD1-CD2 4.14Å; Y150-L197 HydrophobicContact CD2-CD2 3.98Å; Y150-L197 HydrophobicContact CE2-CD2 4.16Å; I193-L197 PolarHBondContact O-N 3.05Å; Q194-L197 PolarHBondContact O-N 2.94Å; R195-L197 VanDerWaalsContact C-N 3.35Å; R195-L197 PolarHBondContact O-N 3.44Å; L197-S200 PolarHBondContact O-N 2.94Å; L197-T201 WeakPolarHBondContact O-CB 3.43Å; L197-T201 PolarHBondContact O-N 3.08Å; L197-T201 PolarHBondContact O-OG1 2.93Å |
| 198 | K | 94.1 | Very high | 92.6 | Very high | 13 Ų | 13 | 50 Ų | 50 | 6% | 0.057 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.6 | -42.1 | 178.2 | -70.3 | -178.6 | -174.3 | 178.1 | 0 | 111.8 | L88 L91 D92 L95 Y143 Q194 R195 T201 C202 | L88-K198 HydrophobicContact CD1-CD 3.61Å; L91-K198 HydrophobicContact CB-CB 4.04Å; L91-K198 HydrophobicContact CD1-CB 4.14Å; D92-K198 WeakPolarHBondContact OD1-CD 3.42Å; D92-K198 WeakPolarHBondContact OD1-CE 3.38Å; D92-K198 IonicContact OD1-NZ 3.5Å; D92-K198 PolarHBondContact OD1-NZ 2.87Å; D92-K198 IonicContact OD2-NZ 2.6Å; D92-K198 PolarHBondContact OD2-NZ 3.43Å; L95-K198 HydrophobicContact CD1-CB 3.84Å; L95-K198 HydrophobicContact CD1-CD 4.33Å; L95-K198 HydrophobicContact CD1-CG 3.71Å; Y143-K198 HydrophobicContact CE2-CG 3.92Å; Y143-K198 WeakPolarHBondContact OH-CE 3.39Å; Q194-K198 HydrophobicContact CG-CD 4.45Å; Q194-K198 WeakPolarHBondContact O-CG 3.47Å; Q194-K198 PolarHBondContact O-N 3.01Å; R195-K198 PolarHBondContact O-N 2.85Å; K198-T201 PolarHBondContact O-N 3.21Å; K198-C202 WeakPolarHBondContact O-CB 3.33Å; K198-C202 PolarHBondContact O-N 3.44Å; K198-C202 PolarHBondContact O-SG 3.31Å; K198-C202 VanDerWaalsContact O-SG 3.33Å |
| 199 | Q | 94.5 | Very high | 92.6 | Very high | 53 Ų | 53 | 51 Ų | 51 | 25% | 0.248 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -59.2 | -51.6 | 175.9 | -179.3 | 64.6 | 42.7 | 0 | 0 | 111.6 | L91 R195 Q196 T201 C202 E203 | L91-Q199 HydrophobicContact CD1-CB 4.05Å; L91-Q199 HydrophobicContact CD2-CB 4.47Å; R195-Q199 WeakPolarHBondContact O-CB 3.46Å; R195-Q199 PolarHBondContact O-N 2.93Å; Q196-Q199 PolarHBondContact O-N 3.45Å; Q199-T201 VanDerWaalsContact C-N 3.29Å; Q199-T201 PolarHBondContact O-N 3Å; Q199-C202 WeakPolarHBondContact O-CB 3.3Å; Q199-C202 PolarHBondContact O-N 3.44Å; Q199-E203 PolarHBondContact NE2-OE1 3.38Å; Q199-E203 WeakPolarHBondContact O-CG 3.33Å; Q199-E203 PolarHBondContact O-N 3.46Å |
| 200 | S | 94.8 | Very high | 92.4 | Very high | 44 Ų | 44 | 46.7 Ų | 46.7 | 31% | 0.308 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -60.7 | -38.7 | 178.3 | 179.8 | 0 | 0 | 0 | 0 | 112.1 | Q196 L197 E203 A204 | Q196-S200 WeakPolarHBondContact O-CB 3.44Å; Q196-S200 PolarHBondContact O-N 2.85Å; L197-S200 PolarHBondContact O-N 2.94Å; S200-E203 PolarHBondContact O-N 2.96Å; S200-A204 PolarHBondContact O-N 2.9Å |
| 201 | T | 96.2 | Very high | 92.1 | Very high | 11 Ų | 11 | 51.8 Ų | 51.8 | 7% | 0.067 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -65.9 | -44.5 | 177.2 | -55.4 | 0 | 0 | 0 | 0 | 111.5 | L95 V100 I139 Y143 L197 K198 Q199 E203 A204 V205 | L95-T201 HydrophobicContact CD2-CG2 3.56Å; V100-T201 HydrophobicContact CG1-CG2 3.72Å; I139-T201 HydrophobicContact CG2-CG2 3.78Å; Y143-T201 HydrophobicContact CD2-CG2 4.05Å; Y143-T201 WeakPolarHBondContact CD2-OG1 3.4Å; Y143-T201 HydrophobicContact CG-CG2 4.07Å; L197-T201 WeakPolarHBondContact O-CB 3.43Å; L197-T201 PolarHBondContact O-N 3.08Å; L197-T201 PolarHBondContact O-OG1 2.93Å; K198-T201 PolarHBondContact O-N 3.21Å; Q199-T201 VanDerWaalsContact C-N 3.29Å; Q199-T201 PolarHBondContact O-N 3Å; T201-E203 VanDerWaalsContact C-N 3.34Å; T201-E203 PolarHBondContact O-N 3.47Å; T201-A204 WeakPolarHBondContact O-CB 3.26Å; T201-A204 PolarHBondContact O-N 2.99Å; T201-V205 WeakPolarHBondContact O-CG2 3.37Å; T201-V205 PolarHBondContact O-N 2.72Å |
| 202 | C | 94.4 | Very high | 91.8 | Very high | 4 Ų | 4 | 51.5 Ų | 51.5 | 3% | 0.027 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -58.1 | -45.7 | 173.9 | -76.6 | 0 | 0 | 0 | 0 | 111.9 | L91 M94 L95 K198 Q199 A204 V205 M206 | L91-C202 HydrophobicContact CD2-CB 4.05Å; M94-C202 HydrophobicContact SD-CB 3.5Å; M94-C202 VanDerWaalsContact SD-CB 3.5Å; M94-C202 PolarHBondContact SD-SG 2.88Å; L95-C202 VanDerWaalsContact CD2-SG 3.52Å; K198-C202 WeakPolarHBondContact O-CB 3.33Å; K198-C202 PolarHBondContact O-N 3.44Å; K198-C202 PolarHBondContact O-SG 3.31Å; K198-C202 VanDerWaalsContact O-SG 3.33Å; Q199-C202 WeakPolarHBondContact O-CB 3.3Å; Q199-C202 PolarHBondContact O-N 3.44Å; C202-A204 VanDerWaalsContact C-N 3.33Å; C202-A204 PolarHBondContact O-N 3.24Å; C202-V205 PolarHBondContact O-N 3.46Å; C202-M206 WeakPolarHBondContact O-CG 3.49Å; C202-M206 PolarHBondContact O-N 3.24Å |
| 203 | E | 94.8 | Very high | 91.1 | Very high | 103 Ų | 103 | 53.3 Ų | 53.3 | 48% | 0.481 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -60.8 | -41 | 176.6 | -73.3 | 170.2 | -171.1 | 0 | 0 | 112.3 | Q199 S200 T201 M206 T207 | Q199-E203 PolarHBondContact NE2-OE1 3.38Å; Q199-E203 WeakPolarHBondContact O-CG 3.33Å; Q199-E203 PolarHBondContact O-N 3.46Å; S200-E203 PolarHBondContact O-N 2.96Å; T201-E203 VanDerWaalsContact C-N 3.34Å; T201-E203 PolarHBondContact O-N 3.47Å; E203-M206 PolarHBondContact O-N 3.47Å; E203-T207 VanDerWaalsContact O-CB 3.31Å; E203-T207 WeakPolarHBondContact O-CB 3.36Å; E203-T207 PolarHBondContact O-N 3.35Å; E203-T207 PolarHBondContact O-OG1 3.42Å |
| 204 | A | 95.2 | Very high | 90.1 | Very high | 40 Ų | 40 | 54.5 Ų | 54.5 | 33% | 0.331 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.7 | -43.3 | 175 | 0 | 0 | 0 | 0 | 0 | 111.6 | I139 S200 T201 C202 T207 L208 | I139-A204 HydrophobicContact CD1-CB 4.08Å; I139-A204 HydrophobicContact CG1-CB 4.38Å; I139-A204 HydrophobicContact CG2-CB 4.43Å; S200-A204 PolarHBondContact O-N 2.9Å; T201-A204 WeakPolarHBondContact O-CB 3.26Å; T201-A204 PolarHBondContact O-N 2.99Å; C202-A204 VanDerWaalsContact C-N 3.33Å; C202-A204 PolarHBondContact O-N 3.24Å; A204-T207 PolarHBondContact O-N 2.82Å; A204-L208 WeakPolarHBondContact O-CB 3.15Å; A204-L208 PolarHBondContact O-N 2.94Å |
| 205 | V | 93.5 | Very high | 88.8 | Confident | 1 Ų | 1 | 54.4 Ų | 54.4 | 1% | 0.006 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -66.1 | -44 | 176.5 | 179.1 | 0 | 0 | 0 | 0 | 111.6 | E98 V100 L136 I139 T201 C202 T207 L208 R209 | E98-V205 HydrophobicContact CB-CG1 4.03Å; E98-V205 HydrophobicContact CG-CG1 3.6Å; V100-V205 HydrophobicContact CG2-CG2 3.97Å; L136-V205 HydrophobicContact CD1-CG1 4.31Å; L136-V205 HydrophobicContact CD1-CG2 4.15Å; I139-V205 HydrophobicContact CD1-CG2 4.39Å; I139-V205 HydrophobicContact CG2-CG2 3.95Å; T201-V205 WeakPolarHBondContact O-CG2 3.37Å; T201-V205 PolarHBondContact O-N 2.72Å; C202-V205 PolarHBondContact O-N 3.46Å; V205-T207 VanDerWaalsContact C-N 3.33Å; V205-T207 PolarHBondContact O-N 3.34Å; V205-L208 WeakPolarHBondContact O-CB 3.45Å; V205-L208 PolarHBondContact O-N 2.8Å; V205-R209 HydrophobicContact CG1-CG 4.42Å; V205-R209 WeakPolarHBondContact O-CG 3.31Å; V205-R209 PolarHBondContact O-N 3.36Å |
| 206 | M | 90.9 | Very high | 87.5 | Confident | 83 Ų | 83 | 60.5 Ų | 60.5 | 41% | 0.409 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.8 | -41.2 | 177.6 | -69 | -57.8 | 126.1 | 0 | 0 | 111.7 | M94 C202 E203 L208 R209 S210 | M94-M206 HydrophobicContact CG-CE 4.16Å; M94-M206 HydrophobicContact SD-CE 3.98Å; C202-M206 WeakPolarHBondContact O-CG 3.49Å; C202-M206 PolarHBondContact O-N 3.24Å; E203-M206 PolarHBondContact O-N 3.47Å; M206-L208 VanDerWaalsContact C-N 3.35Å; M206-R209 PolarHBondContact O-N 3.32Å; M206-S210 WeakPolarHBondContact O-CB 3.31Å; M206-S210 PolarHBondContact O-N 3.39Å |
| 207 | T | 92.2 | Very high | 85.9 | Confident | 70 Ų | 70 | 64.3 Ų | 64.3 | 43% | 0.429 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -62.2 | -43.8 | 174.5 | -60.2 | 0 | 0 | 0 | 0 | 111.2 | E203 A204 V205 S210 R211 | E203-T207 VanDerWaalsContact O-CB 3.31Å; E203-T207 WeakPolarHBondContact O-CB 3.36Å; E203-T207 PolarHBondContact O-N 3.35Å; E203-T207 PolarHBondContact O-OG1 3.42Å; A204-T207 PolarHBondContact O-N 2.82Å; V205-T207 VanDerWaalsContact C-N 3.33Å; V205-T207 PolarHBondContact O-N 3.34Å; T207-S210 PolarHBondContact O-N 3.05Å; T207-R211 WeakPolarHBondContact O-CG 3.42Å; T207-R211 PolarHBondContact O-N 3.03Å |
| 208 | L | 91.2 | Very high | 84.2 | Confident | 13 Ų | 13 | 72.1 Ų | 72.1 | 7% | 0.068 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60.5 | -50.4 | 175.8 | -175.5 | 67.3 | 0 | 0 | 0 | 110.7 | Y132 K135 L136 I139 A204 V205 M206 S210 R211 F212 | Y132-L208 HydrophobicContact CD2-CD1 4.4Å; Y132-L208 HydrophobicContact CD2-CD2 3.98Å; Y132-L208 HydrophobicContact CD2-CG 3.83Å; Y132-L208 HydrophobicContact CE2-CD2 3.83Å; Y132-L208 HydrophobicContact CE2-CG 3.76Å; K135-L208 HydrophobicContact CB-CD1 3.66Å; K135-L208 HydrophobicContact CB-CD2 3.96Å; K135-L208 HydrophobicContact CB-CG 4.5Å; K135-L208 HydrophobicContact CD-CD1 3.74Å; K135-L208 HydrophobicContact CG-CD1 4.33Å; L136-L208 HydrophobicContact CB-CD2 4Å; L136-L208 HydrophobicContact CD1-CD2 4.4Å; I139-L208 HydrophobicContact CD1-CB 4.31Å; I139-L208 HydrophobicContact CD1-CD2 3.91Å; A204-L208 WeakPolarHBondContact O-CB 3.15Å; A204-L208 PolarHBondContact O-N 2.94Å; V205-L208 WeakPolarHBondContact O-CB 3.45Å; V205-L208 PolarHBondContact O-N 2.8Å; M206-L208 VanDerWaalsContact C-N 3.35Å; L208-S210 VanDerWaalsContact C-N 3.34Å; L208-S210 PolarHBondContact O-N 2.98Å; L208-R211 PolarHBondContact O-N 2.97Å; L208-F212 HydrophobicContact CD1-CD2 3.77Å; L208-F212 HydrophobicContact CD1-CE2 3.46Å; L208-F212 VanDerWaalsContact CD1-CE2 3.46Å; L208-F212 HydrophobicContact CG-CD2 4.22Å; L208-F212 HydrophobicContact CG-CE2 4.32Å; L208-F212 VanDerWaalsContact O-CD2 3.31Å; L208-F212 WeakPolarHBondContact O-CD2 3.47Å; L208-F212 PolarHBondContact O-N 2.86Å; L208-F212 VanDerWaalsContact O-N 3.15Å |
| 209 | R | 88.3 | Confident | 82.4 | Confident | 95 Ų | 95 | 81.4 Ų | 81.4 | 36% | 0.358 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -59.1 | -44.2 | 177.8 | -71.7 | -175.2 | 78.9 | 110.5 | 1.3 | 112 | E98 Y132 V205 M206 F212 L213 | E98-R209 VanDerWaalsContact OE1-CD 3.3Å; E98-R209 WeakPolarHBondContact OE1-CD 3.44Å; E98-R209 IonicContact OE1-CZ 3.21Å; E98-R209 IonicContact OE1-NE 2.69Å; E98-R209 IonicContact OE1-NH1 2.52Å; E98-R209 PolarHBondContact OE1-NH1 2.89Å; E98-R209 IonicContact OE2-NH1 3.29Å; E98-R209 PolarHBondContact OE2-NH1 3.47Å; Y132-R209 HydrophobicContact CE2-CG 4.3Å; V205-R209 HydrophobicContact CG1-CG 4.42Å; V205-R209 WeakPolarHBondContact O-CG 3.31Å; V205-R209 PolarHBondContact O-N 3.36Å; M206-R209 PolarHBondContact O-N 3.32Å; R209-F212 PolarHBondContact O-N 3.22Å; R209-L213 VanDerWaalsContact O-CB 3.31Å; R209-L213 WeakPolarHBondContact O-CB 3.45Å; R209-L213 VanDerWaalsContact O-CG 3.28Å; R209-L213 WeakPolarHBondContact O-CG 3.35Å; R209-L213 PolarHBondContact O-N 3.39Å |
| 210 | S | 87.5 | Confident | 81.2 | Confident | 57 Ų | 57 | 89.6 Ų | 89.6 | 40% | 0.399 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -57.9 | -50.9 | 178.1 | -177.8 | 0 | 0 | 0 | 0 | 111.2 | M206 T207 L208 F212 L213 D214 | M206-S210 WeakPolarHBondContact O-CB 3.31Å; M206-S210 PolarHBondContact O-N 3.39Å; T207-S210 PolarHBondContact O-N 3.05Å; L208-S210 VanDerWaalsContact C-N 3.34Å; L208-S210 PolarHBondContact O-N 2.98Å; S210-F212 VanDerWaalsContact C-N 3.3Å; S210-F212 PolarHBondContact O-N 3.46Å; S210-L213 PolarHBondContact O-N 3.24Å; S210-D214 WeakPolarHBondContact O-CB 3.29Å; S210-D214 VanDerWaalsContact O-CG 3.26Å; S210-D214 PolarHBondContact O-N 3.4Å |
| 211 | R | 86.4 | Confident | 80.6 | Confident | 138 Ų | 138 | 94.7 Ų | 94.7 | 52% | 0.521 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -58 | -39.7 | 179.1 | -71.7 | -177.3 | 179.3 | -161.4 | 1.7 | 113 | T207 L208 A215 | T207-R211 WeakPolarHBondContact O-CG 3.42Å; T207-R211 PolarHBondContact O-N 3.03Å; L208-R211 PolarHBondContact O-N 2.97Å; R211-A215 VanDerWaalsContact O-CB 3.29Å; R211-A215 WeakPolarHBondContact O-CB 3.28Å; R211-A215 PolarHBondContact O-N 3.15Å |
| 212 | F | 82.3 | Confident | 80.2 | Confident | 38 Ų | 38 | 96.8 Ų | 96.8 | 17% | 0.167 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -81.6 | -37.3 | -178.9 | -82.7 | -90.7 | 0 | 0 | 0 | 113.7 | E128 D131 Y132 K135 L208 R209 S210 D214 A215 R216 | E128-F212 HydrophobicContact CB-CE1 4.44Å; E128-F212 WeakPolarHBondContact O-CE1 3.2Å; D131-F212 HydrophobicContact CB-CE1 4.35Å; D131-F212 HydrophobicContact CB-CZ 4.04Å; Y132-F212 HydrophobicContact CD2-CB 4.08Å; Y132-F212 HydrophobicContact CD2-CD1 4.24Å; Y132-F212 AromaticContact CD2-CD2 3.61Å; Y132-F212 HydrophobicContact CD2-CD2 3.61Å; Y132-F212 HydrophobicContact CD2-CE2 4.05Å; Y132-F212 AromaticContact CD2-CG 3.7Å; Y132-F212 HydrophobicContact CD2-CG 3.7Å; Y132-F212 HydrophobicContact CE2-CD2 4.5Å; Y132-F212 HydrophobicContact CG-CD1 4.43Å; Y132-F212 HydrophobicContact CG-CD2 4.44Å; Y132-F212 HydrophobicContact CG-CG 4.32Å; K135-F212 HydrophobicContact CD-CE2 4.18Å; K135-F212 HydrophobicContact CD-CZ 4.42Å; L208-F212 HydrophobicContact CD1-CD2 3.77Å; L208-F212 HydrophobicContact CD1-CE2 3.46Å; L208-F212 VanDerWaalsContact CD1-CE2 3.46Å; L208-F212 HydrophobicContact CG-CD2 4.22Å; L208-F212 HydrophobicContact CG-CE2 4.32Å; L208-F212 VanDerWaalsContact O-CD2 3.31Å; L208-F212 WeakPolarHBondContact O-CD2 3.47Å; L208-F212 PolarHBondContact O-N 2.86Å; L208-F212 VanDerWaalsContact O-N 3.15Å; R209-F212 PolarHBondContact O-N 3.22Å; S210-F212 VanDerWaalsContact C-N 3.3Å; S210-F212 PolarHBondContact O-N 3.46Å; F212-D214 VanDerWaalsContact C-N 3.31Å; F212-A215 PolarHBondContact O-N 2.86Å; F212-R216 WeakPolarHBondContact O-CB 3.31Å; F212-R216 PolarHBondContact O-N 2.87Å |
| 213 | L | 74.7 | Confident | 80 | Confident | 77 Ų | 77 | 99.6 Ų | 99.6 | 40% | 0.403 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -68.5 | -33.6 | 173.9 | -70.3 | 174.4 | 0 | 0 | 0 | 111.6 | R209 S210 R216 R217 | R209-L213 VanDerWaalsContact O-CB 3.31Å; R209-L213 WeakPolarHBondContact O-CB 3.45Å; R209-L213 VanDerWaalsContact O-CG 3.28Å; R209-L213 WeakPolarHBondContact O-CG 3.35Å; R209-L213 PolarHBondContact O-N 3.39Å; S210-L213 PolarHBondContact O-N 3.24Å; L213-R216 PolarHBondContact O-N 3.42Å; L213-R217 PolarHBondContact O-N 3.26Å |
| 214 | D | 71.2 | Confident | 79.8 | Confident | 69 Ų | 69 | 102.6 Ų | 102.6 | 37% | 0.369 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -75.1 | -35.7 | 174.4 | -70.7 | -9.6 | 0 | 0 | 0 | 112 | S210 F212 R216 R217 K218 | S210-D214 WeakPolarHBondContact O-CB 3.29Å; S210-D214 VanDerWaalsContact O-CG 3.26Å; S210-D214 PolarHBondContact O-N 3.4Å; F212-D214 VanDerWaalsContact C-N 3.31Å; D214-R216 VanDerWaalsContact C-N 3.34Å; D214-R217 CarbonylContact O-C 3.41Å; D214-R217 WeakPolarHBondContact O-CA 3.4Å; D214-R217 PolarHBondContact O-N 3.32Å; D214-R217 VanDerWaalsContact O-N 3.07Å; D214-R217 IonicContact OD1-CZ 3.27Å; D214-R217 IonicContact OD1-NE 3.98Å; D214-R217 PolarHBondContact OD1-NE 3Å; D214-R217 IonicContact OD1-NH2 3.78Å; D214-R217 PolarHBondContact OD1-NH2 3.38Å; D214-K218 PolarHBondContact O-N 2.86Å |
| 215 | A | 64.1 | Low | 79.7 | Confident | 39 Ų | 39 | 106.8 Ų | 106.8 | 32% | 0.322 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -59 | -45.3 | 167.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | R211 F212 R217 K218 | R211-A215 VanDerWaalsContact O-CB 3.29Å; R211-A215 WeakPolarHBondContact O-CB 3.28Å; R211-A215 PolarHBondContact O-N 3.15Å; F212-A215 PolarHBondContact O-N 2.86Å; A215-R217 PolarHBondContact O-N 2.82Å; A215-K218 WeakPolarHBondContact O-CB 3.43Å; A215-K218 PolarHBondContact O-N 2.93Å |
| 216 | R | 62.8 | Low | 79.7 | Confident | 203 Ų | 203 | 106.7 Ų | 106.7 | 77% | 0.766 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -62.2 | -30.5 | 172.8 | -173 | 177.9 | 161.5 | -160.2 | -4.7 | 112.7 | F212 L213 D214 | F212-R216 WeakPolarHBondContact O-CB 3.31Å; F212-R216 PolarHBondContact O-N 2.87Å; L213-R216 PolarHBondContact O-N 3.42Å; D214-R216 VanDerWaalsContact C-N 3.34Å |
| 217 | R | 61.4 | Low | 79.9 | Confident | 183 Ų | 183 | 104.8 Ų | 104.8 | 69% | 0.691 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -79.6 | -16.8 | 173.7 | -94.4 | -173.8 | -75.1 | -167.7 | 0.5 | 114.1 | L213 D214 A215 R219 | L213-R217 PolarHBondContact O-N 3.26Å; D214-R217 CarbonylContact O-C 3.41Å; D214-R217 WeakPolarHBondContact O-CA 3.4Å; D214-R217 PolarHBondContact O-N 3.32Å; D214-R217 VanDerWaalsContact O-N 3.07Å; D214-R217 IonicContact OD1-CZ 3.27Å; D214-R217 IonicContact OD1-NE 3.98Å; D214-R217 PolarHBondContact OD1-NE 3Å; D214-R217 IonicContact OD1-NH2 3.78Å; D214-R217 PolarHBondContact OD1-NH2 3.38Å; A215-R217 PolarHBondContact O-N 2.82Å; R217-R219 PolarHBondContact O-N 3.33Å |
| 218 | K | 57.4 | Low | 80.1 | Confident | 181 Ų | 181 | 104.1 Ų | 104.1 | 79% | 0.787 | 47% | 0.469 | S | S | * | . | S | Bend | trans | -70.7 | 65.5 | 163.5 | -78 | -176.4 | 175.9 | 179.5 | 0 | 109.2 | D214 A215 R220 | D214-K218 PolarHBondContact O-N 2.86Å; A215-K218 WeakPolarHBondContact O-CB 3.43Å; A215-K218 PolarHBondContact O-N 2.93Å; K218-R220 PolarHBondContact O-N 3.04Å |
| 219 | R | 57 | Low | 80.2 | Confident | 207 Ų | 207 | 104.7 Ų | 104.7 | 78% | 0.781 | 47% | 0.473 | S | S | * | . | P | Polyproline II helix | trans | -47.5 | 120.1 | 178 | -160 | 177.5 | -168.1 | 172.8 | 3.1 | 108.8 | R217 N221 | R217-R219 PolarHBondContact O-N 3.33Å; R219-N221 PolarHBondContact O-N 3.29Å; R219-N221 VanDerWaalsContact O-N 3.1Å |
| 220 | R | 69.7 | Low | 80.6 | Confident | 226 Ų | 226 | 100.1 Ų | 100.1 | 85% | 0.853 | 46% | 0.456 | S | S | * | . | P | Polyproline II helix | trans | -48.1 | 116.3 | 176.9 | -151.5 | 173.6 | 83.6 | -174 | 7 | 109.1 | K218 | K218-R220 PolarHBondContact O-N 3.04Š|
| 221 | N | 82.2 | Confident | 81 | Confident | 150 Ų | 150 | 98 Ų | 98 | 80% | 0.802 | 44% | 0.44 | S | S | * | . | P | Polyproline II helix | trans | -57.9 | 149.7 | 170.3 | -70.1 | -41.5 | 0 | 0 | 0 | 108.4 | R219 | R219-N221 PolarHBondContact O-N 3.29Å; R219-N221 VanDerWaalsContact O-N 3.1Å |
| 222 | F | 87.1 | Confident | 81.4 | Confident | 56 Ų | 56 | 97.5 Ų | 97.5 | 25% | 0.246 | 44% | 0.443 | C | S | . | . | P | Polyproline II helix | trans | -59.6 | 150.6 | 169 | -68.5 | -22.8 | 0 | 0 | 0 | 109.8 | A226 L230 I257 Q261 W265 | F222-A226 HydrophobicContact CB-CB 4.01Å; F222-L230 HydrophobicContact CD2-CD1 3.76Å; F222-L230 HydrophobicContact CE2-CD1 3.86Å; F222-I257 HydrophobicContact CD1-CG2 4.16Å; F222-I257 HydrophobicContact CD2-CD1 4.47Å; F222-I257 HydrophobicContact CE1-CG2 4.31Å; F222-I257 HydrophobicContact CE2-CD1 4.17Å; F222-I257 HydrophobicContact CZ-CD1 4.38Å; F222-Q261 HydrophobicContact CE1-CB 4.16Å; F222-Q261 HydrophobicContact CE1-CG 4.2Å; F222-Q261 HydrophobicContact CZ-CB 3.78Å; F222-Q261 HydrophobicContact CZ-CG 4.22Å; F222-W265 AromaticContact CD2-CD1 3.62Å; F222-W265 HydrophobicContact CD2-CG 4.43Å; F222-W265 HydrophobicContact CE2-CB 3.89Å; F222-W265 AromaticContact CE2-CD1 3.32Å; F222-W265 AromaticContact CE2-CG 3.84Å; F222-W265 HydrophobicContact CE2-CG 3.84Å |
| 223 | S | 90.1 | Very high | 82 | Confident | 62 Ų | 62 | 97.7 Ų | 97.7 | 43% | 0.434 | 44% | 0.443 | S | S | . | . | P | Polyproline II helix | trans | -56.9 | 156.9 | 172.9 | 65.8 | 0 | 0 | 0 | 0 | 109.6 | Q225 A226 T227 | S223-Q225 PolarHBondContact O-N 2.86Å; S223-A226 PolarHBondContact O-N 3.07Å; S223-A226 VanDerWaalsContact OG-CB 3.27Å; S223-A226 WeakPolarHBondContact OG-CB 3.45Å; S223-A226 PolarHBondContact OG-N 2.75Å; S223-A226 VanDerWaalsContact OG-N 3.1Å; S223-T227 WeakPolarHBondContact O-CB 3.27Å; S223-T227 PolarHBondContact O-N 2.96Å; S223-T227 PolarHBondContact O-OG1 3.49Å |
| 224 | K | 91.2 | Very high | 83 | Confident | 166 Ų | 166 | 94 Ų | 94 | 72% | 0.722 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -55.7 | -44.8 | 175.8 | -174.1 | -179.3 | 175 | -172.8 | 0 | 110.8 | A226 T227 D228 | K224-A226 PolarHBondContact O-N 3.38Å; K224-T227 WeakPolarHBondContact O-CB 3.29Å; K224-T227 PolarHBondContact O-N 3.1Å; K224-D228 WeakPolarHBondContact O-CB 3.36Å; K224-D228 PolarHBondContact O-N 3.1Å |
| 225 | Q | 92.6 | Very high | 84 | Confident | 128 Ų | 128 | 91.1 Ų | 91.1 | 60% | 0.598 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -56.3 | -50.6 | 175.1 | -179.4 | -176 | -1 | 0 | 0 | 112.7 | S223 T227 D228 V229 K254 | S223-Q225 PolarHBondContact O-N 2.86Å; Q225-T227 VanDerWaalsContact C-N 3.27Å; Q225-T227 PolarHBondContact O-N 3.23Å; Q225-D228 PolarHBondContact O-N 2.73Å; Q225-V229 VanDerWaalsContact O-CG2 3.32Å; Q225-V229 WeakPolarHBondContact O-CG2 3.38Å; Q225-V229 PolarHBondContact O-N 3.4Å; Q225-K254 PolarHBondContact NE2-O 3.17Å |
| 226 | A | 94.3 | Very high | 85.4 | Confident | 0 Ų | 0 | 93 Ų | 93 | 0% | 0 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -60.7 | -40.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | F222 S223 K224 L230 G255 I257 | F222-A226 HydrophobicContact CB-CB 4.01Å; S223-A226 PolarHBondContact O-N 3.07Å; S223-A226 VanDerWaalsContact OG-CB 3.27Å; S223-A226 WeakPolarHBondContact OG-CB 3.45Å; S223-A226 PolarHBondContact OG-N 2.75Å; S223-A226 VanDerWaalsContact OG-N 3.1Å; K224-A226 PolarHBondContact O-N 3.38Å; A226-L230 WeakPolarHBondContact O-CB 3.25Å; A226-L230 WeakPolarHBondContact O-CD1 3.23Å; A226-L230 WeakPolarHBondContact O-CG 3.36Å; A226-L230 PolarHBondContact O-N 3.37Å; A226-L230 VanDerWaalsContact O-N 3.13Å; A226-G255 WeakPolarHBondContact CB-O 3.44Å; A226-I257 HydrophobicContact CB-CG2 4.1Å |
| 227 | T | 94.5 | Very high | 86.8 | Confident | 42 Ų | 42 | 86.9 Ų | 86.9 | 26% | 0.258 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -65.2 | -43 | 177.9 | -56.2 | 0 | 0 | 0 | 0 | 111.8 | S223 K224 Q225 L230 N231 | S223-T227 WeakPolarHBondContact O-CB 3.27Å; S223-T227 PolarHBondContact O-N 2.96Å; S223-T227 PolarHBondContact O-OG1 3.49Å; K224-T227 WeakPolarHBondContact O-CB 3.29Å; K224-T227 PolarHBondContact O-N 3.1Å; Q225-T227 VanDerWaalsContact C-N 3.27Å; Q225-T227 PolarHBondContact O-N 3.23Å; T227-L230 PolarHBondContact O-N 2.92Å; T227-N231 WeakPolarHBondContact CG2-ND2 3.3Å; T227-N231 WeakPolarHBondContact O-CB 3.48Å; T227-N231 PolarHBondContact O-N 2.95Å; T227-N231 PolarHBondContact O-ND2 2.93Å; T227-N231 VanDerWaalsContact O-ND2 3.14Å |
| 228 | D | 95.1 | Very high | 88.2 | Confident | 57 Ų | 57 | 81 Ų | 81 | 31% | 0.305 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -65 | -46.3 | 179.4 | -69.6 | -15.4 | 0 | 0 | 0 | 110.9 | K224 Q225 L230 N231 E232 Y287 | K224-D228 WeakPolarHBondContact O-CB 3.36Å; K224-D228 PolarHBondContact O-N 3.1Å; Q225-D228 PolarHBondContact O-N 2.73Å; D228-L230 VanDerWaalsContact C-N 3.34Å; D228-L230 PolarHBondContact O-N 3.21Å; D228-N231 PolarHBondContact O-N 3.03Å; D228-E232 VanDerWaalsContact O-CB 3.31Å; D228-E232 WeakPolarHBondContact O-CB 3.5Å; D228-E232 PolarHBondContact O-N 2.88Å; D228-Y287 PolarHBondContact OD1-OH 3.3Å |
| 229 | V | 95 | Very high | 89.6 | Confident | 24 Ų | 24 | 78.2 Ų | 78.2 | 15% | 0.145 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -57.9 | -45 | 176.2 | 167.5 | 0 | 0 | 0 | 0 | 111.8 | Q225 Y233 L251 K254 | Q225-V229 VanDerWaalsContact O-CG2 3.32Å; Q225-V229 WeakPolarHBondContact O-CG2 3.38Å; Q225-V229 PolarHBondContact O-N 3.4Å; V229-Y233 PolarHBondContact O-N 3.34Å; V229-L251 HydrophobicContact CG1-CD2 3.66Å; V229-K254 HydrophobicContact CG1-CB 3.8Å; V229-K254 HydrophobicContact CG1-CD 4.41Å; V229-K254 HydrophobicContact CG2-CB 4.22Å |
| 230 | L | 96.2 | Very high | 91.2 | Very high | 0 Ų | 0 | 73 Ų | 73 | 0% | 0 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -69 | -42 | 180 | -69.2 | 169.7 | 0 | 0 | 0 | 112.2 | F222 A226 T227 D228 F234 L251 I257 V262 W265 F266 | F222-L230 HydrophobicContact CD2-CD1 3.76Å; F222-L230 HydrophobicContact CE2-CD1 3.86Å; A226-L230 WeakPolarHBondContact O-CB 3.25Å; A226-L230 WeakPolarHBondContact O-CD1 3.23Å; A226-L230 WeakPolarHBondContact O-CG 3.36Å; A226-L230 PolarHBondContact O-N 3.37Å; A226-L230 VanDerWaalsContact O-N 3.13Å; T227-L230 PolarHBondContact O-N 2.92Å; D228-L230 VanDerWaalsContact C-N 3.34Å; D228-L230 PolarHBondContact O-N 3.21Å; L230-F234 WeakPolarHBondContact O-CB 3.17Å; L230-F234 PolarHBondContact O-N 2.91Å; L230-L251 HydrophobicContact CD2-CB 4.4Å; L230-I257 HydrophobicContact CD1-CD1 3.75Å; L230-I257 HydrophobicContact CD2-CD1 4.34Å; L230-I257 HydrophobicContact CG-CD1 4.34Å; L230-V262 HydrophobicContact CD2-CG1 3.99Å; L230-V262 HydrophobicContact CD2-CG2 4.23Å; L230-W265 HydrophobicContact CB-CD2 4.05Å; L230-W265 HydrophobicContact CB-CE3 3.92Å; L230-W265 HydrophobicContact CB-CH2 3.71Å; L230-W265 HydrophobicContact CB-CZ2 3.81Å; L230-W265 HydrophobicContact CB-CZ3 3.77Å; L230-W265 HydrophobicContact CD1-CB 4.33Å; L230-W265 HydrophobicContact CD1-CD2 3.75Å; L230-W265 HydrophobicContact CD1-CE3 4.27Å; L230-W265 HydrophobicContact CD1-CG 3.76Å; L230-W265 HydrophobicContact CD2-CE3 4.32Å; L230-W265 HydrophobicContact CG-CD2 4.36Å; L230-W265 HydrophobicContact CG-CE3 4.42Å; L230-F266 HydrophobicContact CD2-CD2 4.31Å; L230-F266 HydrophobicContact CD2-CE2 3.6Å; L230-F266 HydrophobicContact CD2-CZ 4.41Å |
| 231 | N | 94.8 | Very high | 92.3 | Very high | 13 Ų | 13 | 63.1 Ų | 63.1 | 7% | 0.07 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -67.4 | -42.8 | 177.8 | -79.5 | -38.4 | 0 | 0 | 0 | 111.7 | T227 D228 Y233 F234 Y235 W265 K269 Y287 | T227-N231 WeakPolarHBondContact CG2-ND2 3.3Å; T227-N231 WeakPolarHBondContact O-CB 3.48Å; T227-N231 PolarHBondContact O-N 2.95Å; T227-N231 PolarHBondContact O-ND2 2.93Å; T227-N231 VanDerWaalsContact O-ND2 3.14Å; D228-N231 PolarHBondContact O-N 3.03Å; N231-Y233 VanDerWaalsContact C-N 3.34Å; N231-Y233 PolarHBondContact O-N 3.49Å; N231-F234 PolarHBondContact O-N 3.26Å; N231-Y235 HydrophobicContact CB-CD2 4.05Å; N231-Y235 HydrophobicContact CB-CE2 3.98Å; N231-Y235 WeakPolarHBondContact O-CD2 3.43Å; N231-Y235 PolarHBondContact O-N 2.89Å; N231-W265 WeakPolarHBondContact OD1-CH2 3.35Å; N231-W265 WeakPolarHBondContact OD1-CZ2 3.36Å; N231-K269 PolarHBondContact OD1-NZ 3.46Å; N231-Y287 HydrophobicContact CB-CD2 4.42Å; N231-Y287 HydrophobicContact CB-CE1 3.83Å; N231-Y287 HydrophobicContact CB-CE2 3.74Å; N231-Y287 VanDerWaalsContact CB-CZ 3.4Å; N231-Y287 WeakPolarHBondContact CB-OH 3.42Å; N231-Y287 PolarHBondContact ND2-OH 3.46Å |
| 232 | E | 95.3 | Very high | 92.9 | Very high | 127 Ų | 127 | 62.8 Ų | 62.8 | 59% | 0.593 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -54 | -51.5 | 177.8 | -176.1 | -177.7 | 169.7 | 0 | 0 | 110.7 | D228 Y235 S236 Y287 | D228-E232 VanDerWaalsContact O-CB 3.31Å; D228-E232 WeakPolarHBondContact O-CB 3.5Å; D228-E232 PolarHBondContact O-N 2.88Å; E232-Y235 PolarHBondContact O-N 3.45Å; E232-S236 WeakPolarHBondContact O-CB 3.47Å; E232-S236 PolarHBondContact O-N 3.26Å; E232-S236 PolarHBondContact O-OG 2.99Å; E232-Y287 HydrophobicContact CB-CD1 4.21Å; E232-Y287 HydrophobicContact CB-CE1 4.31Å |
| 233 | Y | 95.3 | Very high | 93.3 | Very high | 41 Ų | 41 | 60.6 Ų | 60.6 | 16% | 0.161 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.5 | -44 | 177.1 | -176 | -85 | 0 | 0 | 0 | 112.6 | V229 N231 Y235 S236 H237 P243 T247 L251 F266 | V229-Y233 PolarHBondContact O-N 3.34Å; N231-Y233 VanDerWaalsContact C-N 3.34Å; N231-Y233 PolarHBondContact O-N 3.49Å; Y233-Y235 PolarHBondContact O-N 2.97Å; Y233-S236 PolarHBondContact O-N 2.98Å; Y233-S236 PolarHBondContact O-OG 3.38Å; Y233-S236 VanDerWaalsContact O-OG 3.11Å; Y233-H237 AromaticContact CD1-ND1 3.96Å; Y233-H237 AromaticContact CD2-CE1 3.62Å; Y233-H237 AromaticContact CD2-ND1 3.59Å; Y233-H237 HydrophobicContact CE1-CB 4.32Å; Y233-H237 AromaticContact CE1-ND1 3.85Å; Y233-H237 AromaticContact CE2-CE1 3.3Å; Y233-H237 WeakPolarHBondContact CE2-CE1 3.43Å; Y233-H237 AromaticContact CE2-ND1 3.46Å; Y233-H237 WeakPolarHBondContact CE2-ND1 3.47Å; Y233-H237 AromaticContact CE2-NE2 3.97Å; Y233-H237 AromaticContact CG-ND1 3.84Å; Y233-H237 AromaticContact CZ-CE1 3.79Å; Y233-H237 AromaticContact CZ-CG 3.95Å; Y233-H237 AromaticContact CZ-ND1 3.6Å; Y233-H237 WeakPolarHBondContact O-CB 3.33Å; Y233-H237 PolarHBondContact O-N 2.94Å; Y233-H237 VanDerWaalsContact O-N 3.07Å; Y233-H237 PolarHBondContact O-ND1 3.19Å; Y233-P243 HydrophobicContact CE1-CB 3.73Å; Y233-P243 HydrophobicContact CE1-CG 4.24Å; Y233-P243 WeakPolarHBondContact OH-CA 3.41Å; Y233-T247 HydrophobicContact CD2-CG2 4.09Å; Y233-T247 HydrophobicContact CE1-CG2 4.46Å; Y233-T247 HydrophobicContact CE2-CG2 3.39Å; Y233-L251 HydrophobicContact CD1-CD1 4.1Å; Y233-L251 HydrophobicContact CD2-CD1 4.34Å; Y233-L251 HydrophobicContact CD2-CD2 4.44Å; Y233-L251 HydrophobicContact CG-CD1 3.94Å; Y233-L251 HydrophobicContact CG-CD2 4.28Å; Y233-F266 AromaticContact CD1-CE1 3.72Å; Y233-F266 HydrophobicContact CD1-CE1 3.72Å; Y233-F266 AromaticContact CD1-CZ 3.54Å; Y233-F266 HydrophobicContact CD1-CZ 3.54Å; Y233-F266 HydrophobicContact CE1-CE1 4.25Å; Y233-F266 HydrophobicContact CE1-CZ 4.29Å; Y233-F266 HydrophobicContact CG-CZ 4.32Å |
| 234 | F | 95.3 | Very high | 93.5 | Very high | 1 Ų | 1 | 60.6 Ų | 60.6 | 0% | 0.004 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -60.7 | -45.1 | -178.9 | -175.8 | -87.8 | 0 | 0 | 0 | 111.7 | L230 N231 H237 L238 P241 W265 F266 K269 R270 Y273 | L230-F234 WeakPolarHBondContact O-CB 3.17Å; L230-F234 PolarHBondContact O-N 2.91Å; N231-F234 PolarHBondContact O-N 3.26Å; F234-H237 CarbonylContact O-C 3.51Å; F234-H237 PolarHBondContact O-N 3.22Å; F234-L238 HydrophobicContact CD1-CD2 4.32Å; F234-L238 HydrophobicContact CE1-CD2 3.93Å; F234-L238 PolarHBondContact O-N 2.89Å; F234-P241 HydrophobicContact CD2-CB 3.93Å; F234-P241 HydrophobicContact CE2-CB 3.76Å; F234-P241 HydrophobicContact CE2-CG 4.32Å; F234-P241 HydrophobicContact CZ-CB 4.4Å; F234-W265 HydrophobicContact CB-CH2 4.26Å; F234-W265 HydrophobicContact CB-CZ3 4.15Å; F234-W265 HydrophobicContact CD2-CZ3 4.26Å; F234-W265 HydrophobicContact CG-CZ3 4.42Å; F234-F266 HydrophobicContact CB-CE1 3.98Å; F234-F266 AromaticContact CD2-CD1 3.86Å; F234-F266 HydrophobicContact CD2-CD1 3.86Å; F234-F266 AromaticContact CD2-CE1 3.83Å; F234-F266 HydrophobicContact CD2-CE1 3.83Å; F234-F266 HydrophobicContact CG-CE1 4.43Å; F234-K269 HydrophobicContact CD1-CG 4.07Å; F234-K269 HydrophobicContact CD2-CB 4.26Å; F234-K269 HydrophobicContact CD2-CG 3.66Å; F234-K269 HydrophobicContact CE1-CG 3.97Å; F234-K269 HydrophobicContact CE2-CB 4.02Å; F234-K269 HydrophobicContact CE2-CG 3.53Å; F234-K269 HydrophobicContact CG-CG 3.94Å; F234-K269 HydrophobicContact CZ-CG 3.7Å; F234-R270 HydrophobicContact CE2-CG 3.88Å; F234-Y273 AromaticContact CE1-CD2 3.92Å; F234-Y273 HydrophobicContact CE1-CD2 3.92Å; F234-Y273 HydrophobicContact CE1-CG 4.01Å; F234-Y273 HydrophobicContact CZ-CD2 4.4Å; F234-Y273 HydrophobicContact CZ-CG 4.03Å |
| 235 | Y | 93.7 | Very high | 93.7 | Very high | 7 Ų | 7 | 57.6 Ų | 57.6 | 3% | 0.027 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -76.6 | -31.9 | -178.4 | -69.3 | -61.1 | 0 | 0 | 0 | 112.9 | N231 E232 Y233 H237 L238 K269 Y273 E283 A284 Y287 | N231-Y235 HydrophobicContact CB-CD2 4.05Å; N231-Y235 HydrophobicContact CB-CE2 3.98Å; N231-Y235 WeakPolarHBondContact O-CD2 3.43Å; N231-Y235 PolarHBondContact O-N 2.89Å; E232-Y235 PolarHBondContact O-N 3.45Å; Y233-Y235 PolarHBondContact O-N 2.97Å; Y235-H237 PolarHBondContact O-N 3.44Å; Y235-L238 HydrophobicContact CD1-CD1 4.18Å; Y235-L238 HydrophobicContact CD1-CD2 4.08Å; Y235-L238 HydrophobicContact CD1-CG 4.28Å; Y235-L238 WeakPolarHBondContact O-CG 3.5Å; Y235-K269 WeakPolarHBondContact OH-CE 3.41Å; Y235-K269 PolarHBondContact OH-NZ 3.46Å; Y235-Y273 HydrophobicContact CE1-CE2 4.33Å; Y235-E283 HydrophobicContact CE2-CB 4.28Å; Y235-E283 WeakPolarHBondContact OH-CB 3.49Å; Y235-E283 PolarHBondContact OH-OE2 3.26Å; Y235-A284 HydrophobicContact CD1-CB 3.49Å; Y235-A284 VanDerWaalsContact CD1-CB 3.49Å; Y235-A284 HydrophobicContact CE1-CB 3.66Å; Y235-A284 HydrophobicContact CG-CB 4.36Å; Y235-Y287 AromaticContact CD2-CD2 3.4Å; Y235-Y287 HydrophobicContact CD2-CD2 3.4Å; Y235-Y287 VanDerWaalsContact CD2-CD2 3.4Å; Y235-Y287 HydrophobicContact CD2-CE2 4.04Å; Y235-Y287 AromaticContact CD2-CG 3.72Å; Y235-Y287 HydrophobicContact CD2-CG 3.72Å; Y235-Y287 AromaticContact CE2-CD2 3.75Å; Y235-Y287 HydrophobicContact CE2-CD2 3.75Å; Y235-Y287 HydrophobicContact CE2-CE2 4.05Å; Y235-Y287 HydrophobicContact CE2-CG 4.5Å; Y235-Y287 HydrophobicContact CG-CD2 4.35Å; Y235-Y287 HydrophobicContact CG-CG 4.42Å |
| 236 | S | 92.2 | Very high | 93.8 | Very high | 80 Ų | 80 | 58.8 Ų | 58.8 | 56% | 0.559 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -70.6 | -20.4 | 172.7 | 75.3 | 0 | 0 | 0 | 0 | 113 | E232 Y233 | E232-S236 WeakPolarHBondContact O-CB 3.47Å; E232-S236 PolarHBondContact O-N 3.26Å; E232-S236 PolarHBondContact O-OG 2.99Å; Y233-S236 PolarHBondContact O-N 2.98Å; Y233-S236 PolarHBondContact O-OG 3.38Å; Y233-S236 VanDerWaalsContact O-OG 3.11Å |
| 237 | H | 92.7 | Very high | 93.9 | Very high | 73 Ų | 73 | 60.5 Ų | 60.5 | 34% | 0.338 | 32% | 0.322 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -119 | 38.3 | 179.4 | -59.9 | 87.2 | 0 | 0 | 0 | 112.7 | Y233 F234 Y235 S239 N240 P241 | Y233-H237 AromaticContact CD1-ND1 3.96Å; Y233-H237 AromaticContact CD2-CE1 3.62Å; Y233-H237 AromaticContact CD2-ND1 3.59Å; Y233-H237 HydrophobicContact CE1-CB 4.32Å; Y233-H237 AromaticContact CE1-ND1 3.85Å; Y233-H237 AromaticContact CE2-CE1 3.3Å; Y233-H237 WeakPolarHBondContact CE2-CE1 3.43Å; Y233-H237 AromaticContact CE2-ND1 3.46Å; Y233-H237 WeakPolarHBondContact CE2-ND1 3.47Å; Y233-H237 AromaticContact CE2-NE2 3.97Å; Y233-H237 AromaticContact CG-ND1 3.84Å; Y233-H237 AromaticContact CZ-CE1 3.79Å; Y233-H237 AromaticContact CZ-CG 3.95Å; Y233-H237 AromaticContact CZ-ND1 3.6Å; Y233-H237 WeakPolarHBondContact O-CB 3.33Å; Y233-H237 PolarHBondContact O-N 2.94Å; Y233-H237 VanDerWaalsContact O-N 3.07Å; Y233-H237 PolarHBondContact O-ND1 3.19Å; F234-H237 CarbonylContact O-C 3.51Å; F234-H237 PolarHBondContact O-N 3.22Å; Y235-H237 PolarHBondContact O-N 3.44Å; H237-S239 PolarHBondContact O-N 3.28Å; H237-N240 CarbonylContact O-C 3.4Å; H237-N240 PolarHBondContact O-N 2.82Å; H237-P241 WeakPolarHBondContact O-CA 3.49Å; H237-P241 WeakPolarHBondContact O-CD 3.32Å |
| 238 | L | 90.4 | Very high | 94 | Very high | 59 Ų | 59 | 60.4 Ų | 60.4 | 31% | 0.309 | 32% | 0.317 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.3 | -31.3 | -179 | -84.4 | 167.5 | 0 | 0 | 0 | 114.2 | F234 Y235 N240 Y273 A284 | F234-L238 HydrophobicContact CD1-CD2 4.32Å; F234-L238 HydrophobicContact CE1-CD2 3.93Å; F234-L238 PolarHBondContact O-N 2.89Å; Y235-L238 HydrophobicContact CD1-CD1 4.18Å; Y235-L238 HydrophobicContact CD1-CD2 4.08Å; Y235-L238 HydrophobicContact CD1-CG 4.28Å; Y235-L238 WeakPolarHBondContact O-CG 3.5Å; L238-N240 VanDerWaalsContact C-N 3.34Å; L238-Y273 HydrophobicContact CD2-CE1 3.96Å; L238-Y273 HydrophobicContact CD2-CE2 3.85Å; L238-A284 HydrophobicContact CD1-CB 4.2Å |
| 239 | S | 87.5 | Confident | 94.1 | Very high | 124 Ų | 124 | 63 Ų | 63 | 87% | 0.867 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.7 | -32.9 | 177.3 | 53.8 | 0 | 0 | 0 | 0 | 112.6 | H237 | H237-S239 PolarHBondContact O-N 3.28Š|
| 240 | N | 91 | Very high | 94.1 | Very high | 97 Ų | 97 | 64.7 Ų | 64.7 | 52% | 0.519 | 33% | 0.334 | S | S | . | . | trans | -146.4 | 76.1 | 179.9 | -172.3 | 26.9 | 0 | 0 | 0 | 111.8 | H237 L238 Y242 | H237-N240 CarbonylContact O-C 3.4Å; H237-N240 PolarHBondContact O-N 2.82Å; L238-N240 VanDerWaalsContact C-N 3.34Å; N240-Y242 PolarHBondContact O-N 3.47Å; N240-Y242 VanDerWaalsContact OD1-CD2 3.31Å; N240-Y242 WeakPolarHBondContact OD1-CD2 3.44Å | ||
| 241 | P | 92 | Very high | 94.2 | Very high | 18 Ų | 18 | 65 Ų | 65 | 12% | 0.117 | 34% | 0.336 | C | S | . | . | trans | -81.6 | 52 | -174.8 | 32.6 | -35.3 | 0 | 0 | 0 | 112.2 | F234 H237 R270 | F234-P241 HydrophobicContact CD2-CB 3.93Å; F234-P241 HydrophobicContact CE2-CB 3.76Å; F234-P241 HydrophobicContact CE2-CG 4.32Å; F234-P241 HydrophobicContact CZ-CB 4.4Å; H237-P241 WeakPolarHBondContact O-CA 3.49Å; H237-P241 WeakPolarHBondContact O-CD 3.32Å; P241-R270 HydrophobicContact CB-CG 4.34Å; P241-R270 HydrophobicContact CG-CG 3.98Å; P241-R270 WeakPolarHBondContact O-CD 3.46Å; P241-R270 PolarHBondContact O-NH1 3.23Å | ||
| 242 | Y | 95.1 | Very high | 94.2 | Very high | 143 Ų | 143 | 64.8 Ų | 64.8 | 56% | 0.561 | 34% | 0.335 | S | S | * | . | trans | -125.1 | 84.4 | -179.8 | -68.1 | -92.2 | 0 | 0 | 0 | 109.3 | N240 | N240-Y242 PolarHBondContact O-N 3.47Å; N240-Y242 VanDerWaalsContact OD1-CD2 3.31Å; N240-Y242 WeakPolarHBondContact OD1-CD2 3.44Å | ||
| 243 | P | 94.1 | Very high | 94.3 | Very high | 11 Ų | 11 | 66.5 Ų | 66.5 | 7% | 0.071 | 34% | 0.336 | C | S | . | . | trans | -62.6 | 141 | 179.3 | 24.2 | -32.4 | 0 | 0 | 0 | 111.3 | Y233 T247 K248 F266 | Y233-P243 HydrophobicContact CE1-CB 3.73Å; Y233-P243 HydrophobicContact CE1-CG 4.24Å; Y233-P243 WeakPolarHBondContact OH-CA 3.41Å; P243-T247 HydrophobicContact CB-CG2 3.79Å; P243-K248 HydrophobicContact CB-CG 4.09Å; P243-K248 HydrophobicContact CG-CG 3.88Å; P243-K248 WeakPolarHBondContact O-CE 2.96Å; P243-F266 HydrophobicContact CG-CD1 4.29Å; P243-F266 HydrophobicContact CG-CD2 4.15Å; P243-F266 HydrophobicContact CG-CE1 4.39Å; P243-F266 HydrophobicContact CG-CE2 4.25Å; P243-F266 HydrophobicContact CG-CG 4.18Å; P243-F266 HydrophobicContact CG-CZ 4.38Å | ||
| 244 | S | 95.5 | Very high | 94.3 | Very high | 61 Ų | 61 | 69.6 Ų | 69.6 | 43% | 0.427 | 35% | 0.351 | S | S | . | . | trans | -62.5 | 165.7 | 169.4 | 67.1 | 0 | 0 | 0 | 0 | 111 | E246 T247 K248 | S244-E246 PolarHBondContact O-N 2.9Å; S244-T247 WeakPolarHBondContact O-CB 3.45Å; S244-T247 PolarHBondContact O-N 2.52Å; S244-T247 VanDerWaalsContact O-N 3.12Å; S244-T247 PolarHBondContact OG-N 2.69Å; S244-T247 PolarHBondContact OG-OG1 3.45Å; S244-K248 WeakPolarHBondContact O-CG 3.15Å; S244-K248 PolarHBondContact O-N 3.27Å | ||
| 245 | E | 94.7 | Very high | 94.2 | Very high | 104 Ų | 104 | 69.8 Ų | 69.8 | 49% | 0.486 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -60 | -46.8 | -179.7 | -160.6 | 58.3 | -152.7 | 0 | 0 | 112 | T247 K248 E249 V259 | E245-T247 VanDerWaalsContact C-N 3.28Å; E245-T247 PolarHBondContact O-N 2.87Å; E245-K248 WeakPolarHBondContact O-CB 3.4Å; E245-K248 PolarHBondContact O-N 3.48Å; E245-K248 IonicContact OE2-NZ 2.94Å; E245-K248 PolarHBondContact OE2-NZ 2.87Å; E245-E249 PolarHBondContact O-N 3.41Å; E245-V259 WeakPolarHBondContact OE1-CG1 3.42Å |
| 246 | E | 95.6 | Very high | 94.2 | Very high | 153 Ų | 153 | 72.9 Ų | 72.9 | 72% | 0.715 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -55.3 | -41.3 | 172.6 | -176 | -176.8 | -169.3 | 0 | 0 | 112.3 | S244 K248 E249 E250 | S244-E246 PolarHBondContact O-N 2.9Å; E246-K248 VanDerWaalsContact C-N 3.35Å; E246-K248 PolarHBondContact O-N 3.47Å; E246-E249 WeakPolarHBondContact O-CB 3.49Å; E246-E249 PolarHBondContact O-N 3.13Å; E246-E250 PolarHBondContact O-N 2.97Å |
| 247 | T | 95.5 | Very high | 94.4 | Very high | 36 Ų | 36 | 70.2 Ų | 70.2 | 22% | 0.221 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -67.8 | -35.7 | 177.6 | -55.3 | 0 | 0 | 0 | 0 | 111.9 | Y233 P243 S244 E245 E249 E250 L251 | Y233-T247 HydrophobicContact CD2-CG2 4.09Å; Y233-T247 HydrophobicContact CE1-CG2 4.46Å; Y233-T247 HydrophobicContact CE2-CG2 3.39Å; P243-T247 HydrophobicContact CB-CG2 3.79Å; S244-T247 WeakPolarHBondContact O-CB 3.45Å; S244-T247 PolarHBondContact O-N 2.52Å; S244-T247 VanDerWaalsContact O-N 3.12Å; S244-T247 PolarHBondContact OG-N 2.69Å; S244-T247 PolarHBondContact OG-OG1 3.45Å; E245-T247 VanDerWaalsContact C-N 3.28Å; E245-T247 PolarHBondContact O-N 2.87Å; T247-E249 VanDerWaalsContact C-N 3.34Å; T247-E250 WeakPolarHBondContact O-CB 3.29Å; T247-E250 PolarHBondContact O-N 3.42Å; T247-L251 HydrophobicContact CG2-CD1 4.19Å; T247-L251 HydrophobicContact CG2-CG 4.42Å; T247-L251 VanDerWaalsContact O-CG 3.28Å; T247-L251 WeakPolarHBondContact O-CG 3.39Å; T247-L251 PolarHBondContact O-N 2.76Å |
| 248 | K | 96.6 | Very high | 94.4 | Very high | 39 Ų | 39 | 70.5 Ų | 70.5 | 17% | 0.17 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -66.6 | -38.4 | 175.5 | -65 | 175.3 | -156 | 152.8 | 0 | 111.2 | P243 S244 E245 E246 E250 L251 A252 V259 V262 | P243-K248 HydrophobicContact CB-CG 4.09Å; P243-K248 HydrophobicContact CG-CG 3.88Å; P243-K248 WeakPolarHBondContact O-CE 2.96Å; S244-K248 WeakPolarHBondContact O-CG 3.15Å; S244-K248 PolarHBondContact O-N 3.27Å; E245-K248 WeakPolarHBondContact O-CB 3.4Å; E245-K248 PolarHBondContact O-N 3.48Å; E245-K248 IonicContact OE2-NZ 2.94Å; E245-K248 PolarHBondContact OE2-NZ 2.87Å; E246-K248 VanDerWaalsContact C-N 3.35Å; E246-K248 PolarHBondContact O-N 3.47Å; K248-E250 VanDerWaalsContact C-N 3.33Å; K248-L251 PolarHBondContact O-N 3.27Å; K248-A252 WeakPolarHBondContact O-CB 3.47Å; K248-A252 PolarHBondContact O-N 3Å; K248-V259 HydrophobicContact CB-CG1 3.95Å; K248-V259 HydrophobicContact CD-CG1 4.42Å; K248-V262 HydrophobicContact CB-CG1 4.19Å; K248-V262 HydrophobicContact CG-CG1 4.22Å |
| 249 | E | 96.9 | Very high | 94.7 | Very high | 111 Ų | 111 | 69.8 Ų | 69.8 | 52% | 0.519 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -60.8 | -43.1 | 173.3 | -68.8 | 176 | -179.7 | 0 | 0 | 111.1 | E245 E246 T247 A252 R253 V259 | E245-E249 PolarHBondContact O-N 3.41Å; E246-E249 WeakPolarHBondContact O-CB 3.49Å; E246-E249 PolarHBondContact O-N 3.13Å; T247-E249 VanDerWaalsContact C-N 3.34Å; E249-A252 WeakPolarHBondContact O-CB 3.44Å; E249-A252 PolarHBondContact O-N 3.34Å; E249-R253 WeakPolarHBondContact O-CB 3.44Å; E249-R253 PolarHBondContact O-N 3.46Å; E249-V259 HydrophobicContact CG-CG2 3.97Å |
| 250 | E | 96.5 | Very high | 95 | Very high | 60 Ų | 60 | 67.5 Ų | 67.5 | 28% | 0.28 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -60.3 | -49.4 | 174.8 | -174.6 | 61.2 | -149.8 | 0 | 0 | 112.5 | E246 T247 K248 A252 R253 K254 | E246-E250 PolarHBondContact O-N 2.97Å; T247-E250 WeakPolarHBondContact O-CB 3.29Å; T247-E250 PolarHBondContact O-N 3.42Å; K248-E250 VanDerWaalsContact C-N 3.33Å; E250-A252 VanDerWaalsContact C-N 3.33Å; E250-A252 PolarHBondContact O-N 3.49Å; E250-R253 PolarHBondContact O-N 3.3Å; E250-R253 IonicContact OE1-CZ 2.63Å; E250-R253 IonicContact OE1-NH1 2.71Å; E250-R253 PolarHBondContact OE1-NH1 3.03Å; E250-R253 IonicContact OE1-NH2 3.27Å; E250-R253 PolarHBondContact OE1-NH2 3.43Å; E250-R253 IonicContact OE2-CZ 2.7Å; E250-R253 VanDerWaalsContact OE2-CZ 3.29Å; E250-R253 IonicContact OE2-NE 3.3Å; E250-R253 IonicContact OE2-NH2 2.78Å; E250-R253 PolarHBondContact OE2-NH2 2.9Å; E250-K254 HydrophobicContact CG-CD 4.36Å; E250-K254 WeakPolarHBondContact O-CG 3.38Å; E250-K254 PolarHBondContact O-N 3.46Å; E250-K254 WeakPolarHBondContact OE1-CE 3.48Å; E250-K254 IonicContact OE1-NZ 2.76Å |
| 251 | L | 96.8 | Very high | 95.2 | Very high | 8 Ų | 8 | 66.6 Ų | 66.6 | 4% | 0.042 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -65.4 | -38.5 | -180 | -68 | 172 | 0 | 0 | 0 | 111.6 | V229 L230 Y233 T247 K248 R253 K254 G255 V262 F266 | V229-L251 HydrophobicContact CG1-CD2 3.66Å; L230-L251 HydrophobicContact CD2-CB 4.4Å; Y233-L251 HydrophobicContact CD1-CD1 4.1Å; Y233-L251 HydrophobicContact CD2-CD1 4.34Å; Y233-L251 HydrophobicContact CD2-CD2 4.44Å; Y233-L251 HydrophobicContact CG-CD1 3.94Å; Y233-L251 HydrophobicContact CG-CD2 4.28Å; T247-L251 HydrophobicContact CG2-CD1 4.19Å; T247-L251 HydrophobicContact CG2-CG 4.42Å; T247-L251 VanDerWaalsContact O-CG 3.28Å; T247-L251 WeakPolarHBondContact O-CG 3.39Å; T247-L251 PolarHBondContact O-N 2.76Å; K248-L251 PolarHBondContact O-N 3.27Å; L251-R253 VanDerWaalsContact C-N 3.35Å; L251-K254 PolarHBondContact O-N 3.07Å; L251-G255 PolarHBondContact O-N 2.87Å; L251-V262 HydrophobicContact CB-CG1 4.2Å; L251-V262 HydrophobicContact CB-CG2 4.41Å; L251-V262 HydrophobicContact CD1-CG1 4.34Å; L251-F266 HydrophobicContact CD1-CE2 3.66Å; L251-F266 HydrophobicContact CD1-CZ 3.83Å |
| 252 | A | 96.3 | Very high | 95.4 | Very high | 7 Ų | 7 | 65.8 Ų | 65.8 | 6% | 0.058 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -58.8 | -48.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | K248 E249 E250 G255 G256 I257 V259 V262 | K248-A252 WeakPolarHBondContact O-CB 3.47Å; K248-A252 PolarHBondContact O-N 3Å; E249-A252 WeakPolarHBondContact O-CB 3.44Å; E249-A252 PolarHBondContact O-N 3.34Å; E250-A252 VanDerWaalsContact C-N 3.33Å; E250-A252 PolarHBondContact O-N 3.49Å; A252-G255 PolarHBondContact O-N 3.01Å; A252-G256 PolarHBondContact O-N 3.36Å; A252-I257 CarbonylContact C-O 3.4Å; A252-I257 WeakPolarHBondContact CA-O 3.28Å; A252-I257 VanDerWaalsContact CB-O 3.23Å; A252-I257 WeakPolarHBondContact CB-O 3.34Å; A252-I257 PolarHBondContact O-N 2.98Å; A252-I257 VanDerWaalsContact O-O 3.08Å; A252-V259 HydrophobicContact CB-CG2 3.89Å; A252-V262 HydrophobicContact CB-CG2 3.9Å |
| 253 | R | 96.2 | Very high | 95.4 | Very high | 163 Ų | 163 | 61.6 Ų | 61.6 | 62% | 0.615 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -63.7 | -45.2 | 177.7 | -172.2 | 173.5 | 51.9 | 67.3 | -19.1 | 112.6 | E249 E250 L251 | E249-R253 WeakPolarHBondContact O-CB 3.44Å; E249-R253 PolarHBondContact O-N 3.46Å; E250-R253 PolarHBondContact O-N 3.3Å; E250-R253 IonicContact OE1-CZ 2.63Å; E250-R253 IonicContact OE1-NH1 2.71Å; E250-R253 PolarHBondContact OE1-NH1 3.03Å; E250-R253 IonicContact OE1-NH2 3.27Å; E250-R253 PolarHBondContact OE1-NH2 3.43Å; E250-R253 IonicContact OE2-CZ 2.7Å; E250-R253 VanDerWaalsContact OE2-CZ 3.29Å; E250-R253 IonicContact OE2-NE 3.3Å; E250-R253 IonicContact OE2-NH2 2.78Å; E250-R253 PolarHBondContact OE2-NH2 2.9Å; L251-R253 VanDerWaalsContact C-N 3.35Å |
| 254 | K | 95.7 | Very high | 95.5 | Very high | 107 Ų | 107 | 65 Ų | 65 | 47% | 0.465 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -66.9 | -36.5 | 178.6 | -73.4 | -174.5 | -173.9 | -177.7 | 0 | 113.2 | Q225 V229 E250 L251 | Q225-K254 PolarHBondContact NE2-O 3.17Å; V229-K254 HydrophobicContact CG1-CB 3.8Å; V229-K254 HydrophobicContact CG1-CD 4.41Å; V229-K254 HydrophobicContact CG2-CB 4.22Å; E250-K254 HydrophobicContact CG-CD 4.36Å; E250-K254 WeakPolarHBondContact O-CG 3.38Å; E250-K254 PolarHBondContact O-N 3.46Å; E250-K254 WeakPolarHBondContact OE1-CE 3.48Å; E250-K254 IonicContact OE1-NZ 2.76Å; L251-K254 PolarHBondContact O-N 3.07Å |
| 255 | G | 93.5 | Very high | 95.5 | Very high | 5 Ų | 5 | 64 Ų | 64 | 5% | 0.052 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -85.9 | -12.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | A226 L251 A252 I257 | A226-G255 WeakPolarHBondContact CB-O 3.44Å; L251-G255 PolarHBondContact O-N 2.87Å; A252-G255 PolarHBondContact O-N 3.01Å; G255-I257 VanDerWaalsContact C-N 3.31Å |
| 256 | G | 94.2 | Very high | 95.6 | Very high | 71 Ų | 71 | 59.2 Ų | 59.2 | 73% | 0.732 | 32% | 0.316 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.1 | 36.9 | -172.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | A252 | A252-G256 PolarHBondContact O-N 3.36Š|
| 257 | I | 94.6 | Very high | 95.5 | Very high | 25 Ų | 25 | 52.8 Ų | 52.8 | 13% | 0.128 | 29% | 0.291 | C | S | . | . | S | Bend | trans | -127.8 | 169.1 | -179.4 | 57.8 | 173.4 | 0 | 0 | 0 | 109.9 | F222 A226 L230 A252 G255 Q261 V262 | F222-I257 HydrophobicContact CD1-CG2 4.16Å; F222-I257 HydrophobicContact CD2-CD1 4.47Å; F222-I257 HydrophobicContact CE1-CG2 4.31Å; F222-I257 HydrophobicContact CE2-CD1 4.17Å; F222-I257 HydrophobicContact CZ-CD1 4.38Å; A226-I257 HydrophobicContact CB-CG2 4.1Å; L230-I257 HydrophobicContact CD1-CD1 3.75Å; L230-I257 HydrophobicContact CD2-CD1 4.34Å; L230-I257 HydrophobicContact CG-CD1 4.34Å; A252-I257 CarbonylContact C-O 3.4Å; A252-I257 WeakPolarHBondContact CA-O 3.28Å; A252-I257 VanDerWaalsContact CB-O 3.23Å; A252-I257 WeakPolarHBondContact CB-O 3.34Å; A252-I257 PolarHBondContact O-N 2.98Å; A252-I257 VanDerWaalsContact O-O 3.08Å; G255-I257 VanDerWaalsContact C-N 3.31Å; I257-Q261 HydrophobicContact CB-CB 4.32Å; I257-V262 HydrophobicContact CD1-CG2 3.65Å; I257-V262 HydrophobicContact CG1-CG2 3.9Å |
| 258 | T | 94.8 | Very high | 95.5 | Very high | 79 Ų | 79 | 54.7 Ų | 54.7 | 49% | 0.485 | 30% | 0.3 | S | S | . | . | trans | -84.2 | 153.6 | -179.4 | 70.5 | 0 | 0 | 0 | 0 | 112.3 | S260 Q261 V262 | T258-S260 PolarHBondContact O-N 3.27Å; T258-Q261 WeakPolarHBondContact O-CA 3.42Å; T258-Q261 VanDerWaalsContact O-CB 3.3Å; T258-Q261 WeakPolarHBondContact O-CB 3.42Å; T258-Q261 PolarHBondContact O-N 2.85Å; T258-Q261 WeakPolarHBondContact OG1-CB 3.28Å; T258-Q261 VanDerWaalsContact OG1-CG 3.29Å; T258-Q261 WeakPolarHBondContact OG1-CG 3.38Å; T258-Q261 PolarHBondContact OG1-N 3.45Å; T258-Q261 PolarHBondContact OG1-OE1 2.84Å; T258-V262 WeakPolarHBondContact O-CG2 3.5Å; T258-V262 PolarHBondContact O-N 3.31Å | ||
| 259 | V | 95.7 | Very high | 95.4 | Very high | 44 Ų | 44 | 53.7 Ų | 53.7 | 27% | 0.267 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -55.4 | -38.3 | 174.8 | -179.6 | 0 | 0 | 0 | 0 | 111.5 | E245 K248 E249 A252 Q261 V262 S263 | E245-V259 WeakPolarHBondContact OE1-CG1 3.42Å; K248-V259 HydrophobicContact CB-CG1 3.95Å; K248-V259 HydrophobicContact CD-CG1 4.42Å; E249-V259 HydrophobicContact CG-CG2 3.97Å; A252-V259 HydrophobicContact CB-CG2 3.89Å; V259-Q261 PolarHBondContact O-N 3.38Å; V259-V262 WeakPolarHBondContact O-CB 3.33Å; V259-V262 PolarHBondContact O-N 2.94Å; V259-S263 WeakPolarHBondContact O-CB 3.31Å; V259-S263 PolarHBondContact O-N 2.76Å |
| 260 | S | 94.2 | Very high | 95.3 | Very high | 76 Ų | 76 | 51.4 Ų | 51.4 | 53% | 0.531 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -62.7 | -41 | 174 | -177.1 | 0 | 0 | 0 | 0 | 112.5 | T258 S263 N264 | T258-S260 PolarHBondContact O-N 3.27Å; S260-S263 PolarHBondContact O-N 3.47Å; S260-N264 WeakPolarHBondContact O-CB 3.49Å; S260-N264 VanDerWaalsContact O-CG 3.29Å; S260-N264 PolarHBondContact O-N 3.14Å; S260-N264 PolarHBondContact O-ND2 2.92Å; S260-N264 PolarHBondContact OG-ND2 2.93Å |
| 261 | Q | 94.6 | Very high | 95.1 | Very high | 78 Ų | 78 | 52.7 Ų | 52.7 | 36% | 0.364 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -62.8 | -42 | 174.3 | -79 | 171.1 | -31.4 | 0 | 0 | 111.7 | F222 I257 T258 V259 W265 | F222-Q261 HydrophobicContact CE1-CB 4.16Å; F222-Q261 HydrophobicContact CE1-CG 4.2Å; F222-Q261 HydrophobicContact CZ-CB 3.78Å; F222-Q261 HydrophobicContact CZ-CG 4.22Å; I257-Q261 HydrophobicContact CB-CB 4.32Å; T258-Q261 WeakPolarHBondContact O-CA 3.42Å; T258-Q261 VanDerWaalsContact O-CB 3.3Å; T258-Q261 WeakPolarHBondContact O-CB 3.42Å; T258-Q261 PolarHBondContact O-N 2.85Å; T258-Q261 WeakPolarHBondContact OG1-CB 3.28Å; T258-Q261 VanDerWaalsContact OG1-CG 3.29Å; T258-Q261 WeakPolarHBondContact OG1-CG 3.38Å; T258-Q261 PolarHBondContact OG1-N 3.45Å; T258-Q261 PolarHBondContact OG1-OE1 2.84Å; V259-Q261 PolarHBondContact O-N 3.38Å; Q261-W265 VanDerWaalsContact O-CB 3.25Å; Q261-W265 WeakPolarHBondContact O-CB 3.28Å; Q261-W265 PolarHBondContact O-N 3.35Å |
| 262 | V | 96.6 | Very high | 94.9 | Very high | 0 Ų | 0 | 59.7 Ų | 59.7 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -60.4 | -52.7 | 174.3 | 178.4 | 0 | 0 | 0 | 0 | 110.6 | L230 K248 L251 A252 I257 T258 V259 N264 W265 F266 | L230-V262 HydrophobicContact CD2-CG1 3.99Å; L230-V262 HydrophobicContact CD2-CG2 4.23Å; K248-V262 HydrophobicContact CB-CG1 4.19Å; K248-V262 HydrophobicContact CG-CG1 4.22Å; L251-V262 HydrophobicContact CB-CG1 4.2Å; L251-V262 HydrophobicContact CB-CG2 4.41Å; L251-V262 HydrophobicContact CD1-CG1 4.34Å; A252-V262 HydrophobicContact CB-CG2 3.9Å; I257-V262 HydrophobicContact CD1-CG2 3.65Å; I257-V262 HydrophobicContact CG1-CG2 3.9Å; T258-V262 WeakPolarHBondContact O-CG2 3.5Å; T258-V262 PolarHBondContact O-N 3.31Å; V259-V262 WeakPolarHBondContact O-CB 3.33Å; V259-V262 PolarHBondContact O-N 2.94Å; V262-N264 VanDerWaalsContact C-N 3.34Å; V262-N264 PolarHBondContact O-N 3.4Å; V262-W265 WeakPolarHBondContact O-CB 3.36Å; V262-W265 PolarHBondContact O-N 2.83Å; V262-F266 HydrophobicContact CG1-CD2 3.67Å; V262-F266 HydrophobicContact CG1-CE2 3.75Å; V262-F266 WeakPolarHBondContact O-CD2 3.44Å; V262-F266 PolarHBondContact O-N 2.98Å |
| 263 | S | 95.5 | Very high | 94.7 | Very high | 56 Ų | 56 | 61.6 Ų | 61.6 | 39% | 0.392 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -55.8 | -48.3 | -180 | -174.8 | 0 | 0 | 0 | 0 | 112 | V259 S260 W265 F266 G267 | V259-S263 WeakPolarHBondContact O-CB 3.31Å; V259-S263 PolarHBondContact O-N 2.76Å; S260-S263 PolarHBondContact O-N 3.47Å; S263-W265 PolarHBondContact O-N 3.46Å; S263-F266 PolarHBondContact O-N 2.96Å; S263-G267 PolarHBondContact O-N 3.05Å |
| 264 | N | 94.9 | Very high | 94.4 | Very high | 83 Ų | 83 | 61.8 Ų | 61.8 | 44% | 0.444 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -62.7 | -40.4 | 175.9 | -76 | -47.4 | 0 | 0 | 0 | 112.3 | S260 V262 N268 | S260-N264 WeakPolarHBondContact O-CB 3.49Å; S260-N264 VanDerWaalsContact O-CG 3.29Å; S260-N264 PolarHBondContact O-N 3.14Å; S260-N264 PolarHBondContact O-ND2 2.92Å; S260-N264 PolarHBondContact OG-ND2 2.93Å; V262-N264 VanDerWaalsContact C-N 3.34Å; V262-N264 PolarHBondContact O-N 3.4Å; N264-N268 WeakPolarHBondContact O-CB 3.33Å; N264-N268 VanDerWaalsContact O-CG 3.29Å; N264-N268 PolarHBondContact O-N 3.46Å; N264-N268 PolarHBondContact O-ND2 2.86Å |
| 265 | W | 96 | Very high | 94.1 | Very high | 40 Ų | 40 | 64.2 Ų | 64.2 | 15% | 0.152 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -64.3 | -47.3 | 178.6 | -173.2 | 97.8 | 0 | 0 | 0 | 111.4 | F222 L230 N231 F234 Q261 V262 S263 G267 N268 K269 | F222-W265 AromaticContact CD2-CD1 3.62Å; F222-W265 HydrophobicContact CD2-CG 4.43Å; F222-W265 HydrophobicContact CE2-CB 3.89Å; F222-W265 AromaticContact CE2-CD1 3.32Å; F222-W265 AromaticContact CE2-CG 3.84Å; F222-W265 HydrophobicContact CE2-CG 3.84Å; L230-W265 HydrophobicContact CB-CD2 4.05Å; L230-W265 HydrophobicContact CB-CE3 3.92Å; L230-W265 HydrophobicContact CB-CH2 3.71Å; L230-W265 HydrophobicContact CB-CZ2 3.81Å; L230-W265 HydrophobicContact CB-CZ3 3.77Å; L230-W265 HydrophobicContact CD1-CB 4.33Å; L230-W265 HydrophobicContact CD1-CD2 3.75Å; L230-W265 HydrophobicContact CD1-CE3 4.27Å; L230-W265 HydrophobicContact CD1-CG 3.76Å; L230-W265 HydrophobicContact CD2-CE3 4.32Å; L230-W265 HydrophobicContact CG-CD2 4.36Å; L230-W265 HydrophobicContact CG-CE3 4.42Å; N231-W265 WeakPolarHBondContact OD1-CH2 3.35Å; N231-W265 WeakPolarHBondContact OD1-CZ2 3.36Å; F234-W265 HydrophobicContact CB-CH2 4.26Å; F234-W265 HydrophobicContact CB-CZ3 4.15Å; F234-W265 HydrophobicContact CD2-CZ3 4.26Å; F234-W265 HydrophobicContact CG-CZ3 4.42Å; Q261-W265 VanDerWaalsContact O-CB 3.25Å; Q261-W265 WeakPolarHBondContact O-CB 3.28Å; Q261-W265 PolarHBondContact O-N 3.35Å; V262-W265 WeakPolarHBondContact O-CB 3.36Å; V262-W265 PolarHBondContact O-N 2.83Å; S263-W265 PolarHBondContact O-N 3.46Å; W265-G267 PolarHBondContact O-N 3.32Å; W265-N268 PolarHBondContact O-N 3.38Å; W265-K269 HydrophobicContact CD2-CB 4.33Å; W265-K269 HydrophobicContact CE3-CB 3.94Å; W265-K269 HydrophobicContact CE3-CG 4.43Å; W265-K269 HydrophobicContact CH2-CB 4.05Å; W265-K269 HydrophobicContact CH2-CD 3.65Å; W265-K269 HydrophobicContact CH2-CG 3.64Å; W265-K269 HydrophobicContact CZ2-CB 4.44Å; W265-K269 HydrophobicContact CZ2-CD 3.82Å; W265-K269 HydrophobicContact CZ2-CG 4.21Å; W265-K269 HydrophobicContact CZ3-CB 3.77Å; W265-K269 HydrophobicContact CZ3-CD 4.28Å; W265-K269 HydrophobicContact CZ3-CG 3.76Å; W265-K269 VanDerWaalsContact O-CB 3.29Å; W265-K269 WeakPolarHBondContact O-CB 3.45Å; W265-K269 PolarHBondContact O-N 3.28Å |
| 266 | F | 96.7 | Very high | 93.7 | Very high | 2 Ų | 2 | 67.6 Ų | 67.6 | 1% | 0.009 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -63.8 | -41.8 | 177.9 | -87.7 | -85.5 | 0 | 0 | 0 | 112 | L230 Y233 F234 P243 L251 V262 S263 N268 K269 R270 | L230-F266 HydrophobicContact CD2-CD2 4.31Å; L230-F266 HydrophobicContact CD2-CE2 3.6Å; L230-F266 HydrophobicContact CD2-CZ 4.41Å; Y233-F266 AromaticContact CD1-CE1 3.72Å; Y233-F266 HydrophobicContact CD1-CE1 3.72Å; Y233-F266 AromaticContact CD1-CZ 3.54Å; Y233-F266 HydrophobicContact CD1-CZ 3.54Å; Y233-F266 HydrophobicContact CE1-CE1 4.25Å; Y233-F266 HydrophobicContact CE1-CZ 4.29Å; Y233-F266 HydrophobicContact CG-CZ 4.32Å; F234-F266 HydrophobicContact CB-CE1 3.98Å; F234-F266 AromaticContact CD2-CD1 3.86Å; F234-F266 HydrophobicContact CD2-CD1 3.86Å; F234-F266 AromaticContact CD2-CE1 3.83Å; F234-F266 HydrophobicContact CD2-CE1 3.83Å; F234-F266 HydrophobicContact CG-CE1 4.43Å; P243-F266 HydrophobicContact CG-CD1 4.29Å; P243-F266 HydrophobicContact CG-CD2 4.15Å; P243-F266 HydrophobicContact CG-CE1 4.39Å; P243-F266 HydrophobicContact CG-CE2 4.25Å; P243-F266 HydrophobicContact CG-CG 4.18Å; P243-F266 HydrophobicContact CG-CZ 4.38Å; L251-F266 HydrophobicContact CD1-CE2 3.66Å; L251-F266 HydrophobicContact CD1-CZ 3.83Å; V262-F266 HydrophobicContact CG1-CD2 3.67Å; V262-F266 HydrophobicContact CG1-CE2 3.75Å; V262-F266 WeakPolarHBondContact O-CD2 3.44Å; V262-F266 PolarHBondContact O-N 2.98Å; S263-F266 PolarHBondContact O-N 2.96Å; F266-N268 VanDerWaalsContact C-N 3.35Å; F266-N268 PolarHBondContact O-N 3.03Å; F266-K269 PolarHBondContact O-N 3.12Å; F266-R270 WeakPolarHBondContact O-CB 3.48Å; F266-R270 WeakPolarHBondContact O-CG 3.35Å; F266-R270 PolarHBondContact O-N 3.24Å |
| 267 | G | 94.9 | Very high | 93 | Very high | 19 Ų | 19 | 67.2 Ų | 67.2 | 20% | 0.196 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -55.9 | -49.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112 | S263 W265 I271 | S263-G267 PolarHBondContact O-N 3.05Å; W265-G267 PolarHBondContact O-N 3.32Å; G267-I271 WeakPolarHBondContact O-CG1 3.4Å; G267-I271 PolarHBondContact O-N 3.38Å |
| 268 | N | 94.8 | Very high | 92.1 | Very high | 76 Ų | 76 | 69 Ų | 69 | 41% | 0.406 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -66.9 | -43.1 | 178.2 | -72.9 | -45.8 | 0 | 0 | 0 | 112.9 | N264 W265 F266 I271 R272 | N264-N268 WeakPolarHBondContact O-CB 3.33Å; N264-N268 VanDerWaalsContact O-CG 3.29Å; N264-N268 PolarHBondContact O-N 3.46Å; N264-N268 PolarHBondContact O-ND2 2.86Å; W265-N268 PolarHBondContact O-N 3.38Å; F266-N268 VanDerWaalsContact C-N 3.35Å; F266-N268 PolarHBondContact O-N 3.03Å; N268-I271 PolarHBondContact O-N 2.8Å; N268-R272 WeakPolarHBondContact O-CG 3.08Å; N268-R272 PolarHBondContact O-N 3.28Å |
| 269 | K | 94.5 | Very high | 91.1 | Very high | 18 Ų | 18 | 72.8 Ų | 72.8 | 8% | 0.078 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -62.8 | -42.8 | 179.9 | -173.7 | 79.9 | -179.3 | -162.6 | 0 | 110.5 | N231 F234 Y235 W265 F266 I271 R272 Y273 E283 | N231-K269 PolarHBondContact OD1-NZ 3.46Å; F234-K269 HydrophobicContact CD1-CG 4.07Å; F234-K269 HydrophobicContact CD2-CB 4.26Å; F234-K269 HydrophobicContact CD2-CG 3.66Å; F234-K269 HydrophobicContact CE1-CG 3.97Å; F234-K269 HydrophobicContact CE2-CB 4.02Å; F234-K269 HydrophobicContact CE2-CG 3.53Å; F234-K269 HydrophobicContact CG-CG 3.94Å; F234-K269 HydrophobicContact CZ-CG 3.7Å; Y235-K269 WeakPolarHBondContact OH-CE 3.41Å; Y235-K269 PolarHBondContact OH-NZ 3.46Å; W265-K269 HydrophobicContact CD2-CB 4.33Å; W265-K269 HydrophobicContact CE3-CB 3.94Å; W265-K269 HydrophobicContact CE3-CG 4.43Å; W265-K269 HydrophobicContact CH2-CB 4.05Å; W265-K269 HydrophobicContact CH2-CD 3.65Å; W265-K269 HydrophobicContact CH2-CG 3.64Å; W265-K269 HydrophobicContact CZ2-CB 4.44Å; W265-K269 HydrophobicContact CZ2-CD 3.82Å; W265-K269 HydrophobicContact CZ2-CG 4.21Å; W265-K269 HydrophobicContact CZ3-CB 3.77Å; W265-K269 HydrophobicContact CZ3-CD 4.28Å; W265-K269 HydrophobicContact CZ3-CG 3.76Å; W265-K269 VanDerWaalsContact O-CB 3.29Å; W265-K269 WeakPolarHBondContact O-CB 3.45Å; W265-K269 PolarHBondContact O-N 3.28Å; F266-K269 PolarHBondContact O-N 3.12Å; K269-I271 PolarHBondContact O-N 3.3Å; K269-R272 PolarHBondContact O-N 2.86Å; K269-Y273 VanDerWaalsContact O-CB 3.28Å; K269-Y273 WeakPolarHBondContact O-CB 3.37Å; K269-Y273 PolarHBondContact O-N 3.25Å; K269-E283 IonicContact NZ-OE2 3.38Å; K269-E283 PolarHBondContact NZ-OE2 3.05Å |
| 270 | R | 95.3 | Very high | 90.3 | Very high | 63 Ų | 63 | 72.2 Ų | 72.2 | 24% | 0.238 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -59.4 | -44.7 | 174.1 | -74.6 | -167.8 | -59.3 | -96.8 | 0.4 | 112.6 | F234 P241 F266 Y273 K274 | F234-R270 HydrophobicContact CE2-CG 3.88Å; P241-R270 HydrophobicContact CB-CG 4.34Å; P241-R270 HydrophobicContact CG-CG 3.98Å; P241-R270 WeakPolarHBondContact O-CD 3.46Å; P241-R270 PolarHBondContact O-NH1 3.23Å; F266-R270 WeakPolarHBondContact O-CB 3.48Å; F266-R270 WeakPolarHBondContact O-CG 3.35Å; F266-R270 PolarHBondContact O-N 3.24Å; R270-Y273 PolarHBondContact O-N 3.4Å; R270-K274 WeakPolarHBondContact O-CB 3.3Å; R270-K274 PolarHBondContact O-N 3.31Å |
| 271 | I | 92.6 | Very high | 89.2 | Confident | 87 Ų | 87 | 74 Ų | 74 | 45% | 0.446 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -62.7 | -45.6 | 178.1 | -66 | 166.5 | 0 | 0 | 0 | 110.8 | G267 N268 K269 K275 | G267-I271 WeakPolarHBondContact O-CG1 3.4Å; G267-I271 PolarHBondContact O-N 3.38Å; N268-I271 PolarHBondContact O-N 2.8Å; K269-I271 PolarHBondContact O-N 3.3Å; I271-K275 HydrophobicContact CG2-CD 4.26Å; I271-K275 WeakPolarHBondContact O-CG 3.45Å; I271-K275 PolarHBondContact O-N 3.5Å; I271-K275 VanDerWaalsContact O-N 3.16Å |
| 272 | R | 92 | Very high | 88.1 | Confident | 154 Ų | 154 | 77.6 Ų | 77.6 | 58% | 0.581 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -65.3 | -44.9 | 178.6 | -68.7 | -179.8 | -163.5 | 176.7 | 4.4 | 111.9 | N268 K269 K274 K275 N276 F280 | N268-R272 WeakPolarHBondContact O-CG 3.08Å; N268-R272 PolarHBondContact O-N 3.28Å; K269-R272 PolarHBondContact O-N 2.86Å; R272-K274 PolarHBondContact O-N 3.48Å; R272-K275 PolarHBondContact O-N 2.87Å; R272-N276 PolarHBondContact O-N 3.41Å; R272-F280 HydrophobicContact CB-CE2 4.01Å; R272-F280 HydrophobicContact CB-CZ 4.01Å; R272-F280 WeakPolarHBondContact O-CE2 3.31Å |
| 273 | Y | 91.3 | Very high | 87.2 | Confident | 48 Ų | 48 | 81.6 Ų | 81.6 | 19% | 0.188 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -59.2 | -48.9 | 178.6 | -172.4 | -95.5 | 0 | 0 | 0 | 110.9 | F234 Y235 L238 K269 R270 K275 N276 T277 F280 | F234-Y273 AromaticContact CE1-CD2 3.92Å; F234-Y273 HydrophobicContact CE1-CD2 3.92Å; F234-Y273 HydrophobicContact CE1-CG 4.01Å; F234-Y273 HydrophobicContact CZ-CD2 4.4Å; F234-Y273 HydrophobicContact CZ-CG 4.03Å; Y235-Y273 HydrophobicContact CE1-CE2 4.33Å; L238-Y273 HydrophobicContact CD2-CE1 3.96Å; L238-Y273 HydrophobicContact CD2-CE2 3.85Å; K269-Y273 VanDerWaalsContact O-CB 3.28Å; K269-Y273 WeakPolarHBondContact O-CB 3.37Å; K269-Y273 PolarHBondContact O-N 3.25Å; R270-Y273 PolarHBondContact O-N 3.4Å; Y273-K275 VanDerWaalsContact C-N 3.31Å; Y273-K275 PolarHBondContact O-N 3.47Å; Y273-N276 CarbonylContact O-C 3.1Å; Y273-N276 PolarHBondContact O-N 2.96Å; Y273-T277 HydrophobicContact CE1-CG2 4.46Å; Y273-T277 WeakPolarHBondContact O-CA 3.35Å; Y273-T277 PolarHBondContact O-N 3.18Å; Y273-T277 PolarHBondContact O-OG1 3.13Å; Y273-F280 HydrophobicContact CD2-CB 3.44Å; Y273-F280 VanDerWaalsContact CD2-CB 3.44Å; Y273-F280 HydrophobicContact CD2-CD2 4.24Å; Y273-F280 AromaticContact CD2-CG 3.94Å; Y273-F280 HydrophobicContact CD2-CG 3.94Å; Y273-F280 HydrophobicContact CE2-CB 3.6Å |
| 274 | K | 89.8 | Confident | 86.2 | Confident | 166 Ų | 166 | 79.4 Ų | 79.4 | 72% | 0.722 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -60.7 | -36 | 178.4 | -173.6 | 173.3 | 68.2 | 172.4 | 0 | 113.4 | R270 R272 | R270-K274 WeakPolarHBondContact O-CB 3.3Å; R270-K274 PolarHBondContact O-N 3.31Å; R272-K274 PolarHBondContact O-N 3.48Å |
| 275 | K | 90.3 | Very high | 85.5 | Confident | 158 Ų | 158 | 79.9 Ų | 79.9 | 69% | 0.687 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -79.1 | -24.5 | -179.6 | -73.7 | -175.7 | 175.9 | -170.6 | 0 | 113.6 | I271 R272 Y273 | I271-K275 HydrophobicContact CG2-CD 4.26Å; I271-K275 WeakPolarHBondContact O-CG 3.45Å; I271-K275 PolarHBondContact O-N 3.5Å; I271-K275 VanDerWaalsContact O-N 3.16Å; R272-K275 PolarHBondContact O-N 2.87Å; Y273-K275 VanDerWaalsContact C-N 3.31Å; Y273-K275 PolarHBondContact O-N 3.47Å |
| 276 | N | 85.2 | Confident | 84.7 | Confident | 76 Ų | 76 | 84.2 Ų | 84.2 | 41% | 0.406 | 42% | 0.417 | S | S | . | . | trans | -138.7 | 42.1 | -169.8 | -69.9 | 92.2 | 0 | 0 | 0 | 112.5 | R272 Y273 G278 K279 F280 | R272-N276 PolarHBondContact O-N 3.41Å; Y273-N276 CarbonylContact O-C 3.1Å; Y273-N276 PolarHBondContact O-N 2.96Å; N276-G278 VanDerWaalsContact C-N 3.26Å; N276-G278 PolarHBondContact O-N 3.22Å; N276-G278 VanDerWaalsContact O-N 3.1Å; N276-K279 PolarHBondContact O-N 3.1Å; N276-F280 HydrophobicContact CB-CD2 4.15Å; N276-F280 HydrophobicContact CB-CE2 3.94Å; N276-F280 WeakPolarHBondContact O-CD2 3.5Å; N276-F280 PolarHBondContact O-N 3.11Å | ||
| 277 | T | 78.1 | Confident | 83.7 | Confident | 63 Ų | 63 | 86.4 Ų | 86.4 | 39% | 0.387 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -45.8 | -46.8 | -174.3 | -51.2 | 0 | 0 | 0 | 0 | 113.4 | Y273 K279 F280 Q281 | Y273-T277 HydrophobicContact CE1-CG2 4.46Å; Y273-T277 WeakPolarHBondContact O-CA 3.35Å; Y273-T277 PolarHBondContact O-N 3.18Å; Y273-T277 PolarHBondContact O-OG1 3.13Å; T277-K279 VanDerWaalsContact C-N 3.29Å; T277-K279 PolarHBondContact O-N 2.97Å; T277-F280 PolarHBondContact O-N 3.29Å; T277-F280 VanDerWaalsContact O-N 3.13Å; T277-Q281 PolarHBondContact O-N 3.42Å; T277-Q281 VanDerWaalsContact O-N 3.15Å |
| 278 | G | 75.7 | Confident | 82.6 | Confident | 62 Ų | 62 | 89.2 Ų | 89.2 | 64% | 0.639 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -61 | -31.6 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | N276 | N276-G278 VanDerWaalsContact C-N 3.26Å; N276-G278 PolarHBondContact O-N 3.22Å; N276-G278 VanDerWaalsContact O-N 3.1Å |
| 279 | K | 75 | Confident | 81 | Confident | 159 Ų | 159 | 87.4 Ų | 87.4 | 69% | 0.691 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -75 | -32.1 | 177.6 | -68.2 | -170.4 | 175.1 | -173.7 | 0 | 112.5 | N276 T277 | N276-K279 PolarHBondContact O-N 3.1Å; T277-K279 VanDerWaalsContact C-N 3.29Å; T277-K279 PolarHBondContact O-N 2.97Å |
| 280 | F | 78 | Confident | 79 | Confident | 33 Ų | 33 | 93 Ų | 93 | 15% | 0.145 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -88.5 | -7.9 | -177.7 | -69.2 | -70.9 | 0 | 0 | 0 | 113.2 | R272 Y273 N276 T277 E282 E283 A284 | R272-F280 HydrophobicContact CB-CE2 4.01Å; R272-F280 HydrophobicContact CB-CZ 4.01Å; R272-F280 WeakPolarHBondContact O-CE2 3.31Å; Y273-F280 HydrophobicContact CD2-CB 3.44Å; Y273-F280 VanDerWaalsContact CD2-CB 3.44Å; Y273-F280 HydrophobicContact CD2-CD2 4.24Å; Y273-F280 AromaticContact CD2-CG 3.94Å; Y273-F280 HydrophobicContact CD2-CG 3.94Å; Y273-F280 HydrophobicContact CE2-CB 3.6Å; N276-F280 HydrophobicContact CB-CD2 4.15Å; N276-F280 HydrophobicContact CB-CE2 3.94Å; N276-F280 WeakPolarHBondContact O-CD2 3.5Å; N276-F280 PolarHBondContact O-N 3.11Å; T277-F280 PolarHBondContact O-N 3.29Å; T277-F280 VanDerWaalsContact O-N 3.13Å; F280-E282 VanDerWaalsContact C-N 3.34Å; F280-E283 VanDerWaalsContact CD1-OE2 3.28Å; F280-E283 WeakPolarHBondContact CD1-OE2 3.4Å; F280-E283 PolarHBondContact O-N 3.07Å; F280-A284 WeakPolarHBondContact O-CB 3.39Å; F280-A284 PolarHBondContact O-N 3.32Å |
| 281 | Q | 71.8 | Confident | 76.9 | Confident | 114 Ų | 114 | 93.4 Ų | 93.4 | 53% | 0.533 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -65.3 | -37.6 | 177.2 | -164.1 | 116.4 | 28.6 | 0 | 0 | 111.9 | T277 A284 T285 | T277-Q281 PolarHBondContact O-N 3.42Å; T277-Q281 VanDerWaalsContact O-N 3.15Å; Q281-A284 PolarHBondContact O-N 3.27Å; Q281-T285 PolarHBondContact O-N 3.49Å; Q281-T285 PolarHBondContact O-OG1 2.85Å |
| 282 | E | 71 | Confident | 74.7 | Confident | 152 Ų | 152 | 93.1 Ų | 93.1 | 71% | 0.71 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -65.1 | -46.1 | 175 | -171.9 | 176.4 | -173.2 | 0 | 0 | 111.1 | F280 A284 T285 M286 | F280-E282 VanDerWaalsContact C-N 3.34Å; E282-A284 VanDerWaalsContact C-N 3.33Å; E282-A284 PolarHBondContact O-N 3.16Å; E282-T285 WeakPolarHBondContact O-CB 3.42Å; E282-T285 PolarHBondContact O-N 3.27Å; E282-M286 PolarHBondContact O-N 2.88Å |
| 283 | E | 76.9 | Confident | 72.7 | Confident | 85 Ų | 85 | 90.7 Ų | 90.7 | 40% | 0.397 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.6 | -43.7 | 173.4 | -67.3 | -171.5 | 170.5 | 0 | 0 | 111.4 | Y235 K269 F280 T285 M286 Y287 | Y235-E283 HydrophobicContact CE2-CB 4.28Å; Y235-E283 WeakPolarHBondContact OH-CB 3.49Å; Y235-E283 PolarHBondContact OH-OE2 3.26Å; K269-E283 IonicContact NZ-OE2 3.38Å; K269-E283 PolarHBondContact NZ-OE2 3.05Å; F280-E283 VanDerWaalsContact CD1-OE2 3.28Å; F280-E283 WeakPolarHBondContact CD1-OE2 3.4Å; F280-E283 PolarHBondContact O-N 3.07Å; E283-T285 VanDerWaalsContact C-N 3.3Å; E283-T285 PolarHBondContact O-N 3.49Å; E283-M286 WeakPolarHBondContact O-CB 3.39Å; E283-M286 PolarHBondContact O-N 2.99Å; E283-Y287 WeakPolarHBondContact O-CD2 3.46Å; E283-Y287 PolarHBondContact O-N 3.44Å |
| 284 | A | 76.4 | Confident | 70.8 | Confident | 9 Ų | 9 | 94.6 Ų | 94.6 | 7% | 0.074 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -60.5 | -40.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y235 L238 F280 Q281 E282 M286 Y287 T288 | Y235-A284 HydrophobicContact CD1-CB 3.49Å; Y235-A284 VanDerWaalsContact CD1-CB 3.49Å; Y235-A284 HydrophobicContact CE1-CB 3.66Å; Y235-A284 HydrophobicContact CG-CB 4.36Å; L238-A284 HydrophobicContact CD1-CB 4.2Å; F280-A284 WeakPolarHBondContact O-CB 3.39Å; F280-A284 PolarHBondContact O-N 3.32Å; Q281-A284 PolarHBondContact O-N 3.27Å; E282-A284 VanDerWaalsContact C-N 3.33Å; E282-A284 PolarHBondContact O-N 3.16Å; A284-M286 VanDerWaalsContact C-N 3.29Å; A284-M286 PolarHBondContact O-N 3.13Å; A284-Y287 PolarHBondContact O-N 3.41Å; A284-T288 PolarHBondContact O-N 3.37Å; A284-T288 PolarHBondContact O-OG1 3.11Å; A284-T288 VanDerWaalsContact O-OG1 3.11Å |
| 285 | T | 80.3 | Confident | 68.7 | Low | 93 Ų | 93 | 92.7 Ų | 92.7 | 57% | 0.571 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61.6 | -39.9 | 178.8 | -55.1 | 0 | 0 | 0 | 0 | 111.2 | Q281 E282 E283 Y287 T288 G289 | Q281-T285 PolarHBondContact O-N 3.49Å; Q281-T285 PolarHBondContact O-OG1 2.85Å; E282-T285 WeakPolarHBondContact O-CB 3.42Å; E282-T285 PolarHBondContact O-N 3.27Å; E283-T285 VanDerWaalsContact C-N 3.3Å; E283-T285 PolarHBondContact O-N 3.49Å; T285-Y287 PolarHBondContact O-N 3.36Å; T285-T288 PolarHBondContact O-N 3.48Å; T285-G289 PolarHBondContact O-N 3.47Å |
| 286 | M | 78 | Confident | 66.3 | Low | 132 Ų | 132 | 94.4 Ų | 94.4 | 65% | 0.65 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.1 | -37.1 | 177.5 | -71.1 | -71.7 | -87.7 | 0 | 0 | 113.1 | E282 E283 A284 | E282-M286 PolarHBondContact O-N 2.88Å; E283-M286 WeakPolarHBondContact O-CB 3.39Å; E283-M286 PolarHBondContact O-N 2.99Å; A284-M286 VanDerWaalsContact C-N 3.29Å; A284-M286 PolarHBondContact O-N 3.13Å |
| 287 | Y | 76.4 | Confident | 63.9 | Low | 47 Ų | 47 | 95.5 Ų | 95.5 | 18% | 0.184 | 55% | 0.546 | C | S | . | . | H | α-helix | trans | -79 | -36.5 | 178.1 | -79.1 | -86 | 0 | 0 | 0 | 112.6 | D228 N231 E232 Y235 E283 A284 T285 G289 K290 A291 | D228-Y287 PolarHBondContact OD1-OH 3.3Å; N231-Y287 HydrophobicContact CB-CD2 4.42Å; N231-Y287 HydrophobicContact CB-CE1 3.83Å; N231-Y287 HydrophobicContact CB-CE2 3.74Å; N231-Y287 VanDerWaalsContact CB-CZ 3.4Å; N231-Y287 WeakPolarHBondContact CB-OH 3.42Å; N231-Y287 PolarHBondContact ND2-OH 3.46Å; E232-Y287 HydrophobicContact CB-CD1 4.21Å; E232-Y287 HydrophobicContact CB-CE1 4.31Å; Y235-Y287 AromaticContact CD2-CD2 3.4Å; Y235-Y287 HydrophobicContact CD2-CD2 3.4Å; Y235-Y287 VanDerWaalsContact CD2-CD2 3.4Å; Y235-Y287 HydrophobicContact CD2-CE2 4.04Å; Y235-Y287 AromaticContact CD2-CG 3.72Å; Y235-Y287 HydrophobicContact CD2-CG 3.72Å; Y235-Y287 AromaticContact CE2-CD2 3.75Å; Y235-Y287 HydrophobicContact CE2-CD2 3.75Å; Y235-Y287 HydrophobicContact CE2-CE2 4.05Å; Y235-Y287 HydrophobicContact CE2-CG 4.5Å; Y235-Y287 HydrophobicContact CG-CD2 4.35Å; Y235-Y287 HydrophobicContact CG-CG 4.42Å; E283-Y287 WeakPolarHBondContact O-CD2 3.46Å; E283-Y287 PolarHBondContact O-N 3.44Å; A284-Y287 PolarHBondContact O-N 3.41Å; T285-Y287 PolarHBondContact O-N 3.36Å; Y287-G289 VanDerWaalsContact C-N 3.34Å; Y287-G289 PolarHBondContact O-N 2.97Å; Y287-K290 PolarHBondContact O-N 3.21Å; Y287-A291 PolarHBondContact O-N 2.78Å |
| 288 | T | 71.2 | Confident | 62.1 | Low | 78 Ų | 78 | 103.7 Ų | 103.7 | 48% | 0.479 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -66.3 | -34.8 | 174.5 | -60 | 0 | 0 | 0 | 0 | 112.4 | A284 T285 S292 | A284-T288 PolarHBondContact O-N 3.37Å; A284-T288 PolarHBondContact O-OG1 3.11Å; A284-T288 VanDerWaalsContact O-OG1 3.11Å; T285-T288 PolarHBondContact O-N 3.48Å; T288-S292 PolarHBondContact O-OG 2.99Å |
| 289 | G | 60.5 | Low | 60.5 | Low | 38 Ų | 38 | 111.7 Ų | 111.7 | 39% | 0.392 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.1 | -37.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | T285 Y287 S292 T293 | T285-G289 PolarHBondContact O-N 3.47Å; Y287-G289 VanDerWaalsContact C-N 3.34Å; Y287-G289 PolarHBondContact O-N 2.97Å; G289-S292 PolarHBondContact O-N 3.4Å; G289-T293 PolarHBondContact O-OG1 3.36Å |
| 290 | K | 54 | Low | 59 | Low | 137 Ų | 137 | 108.8 Ų | 108.8 | 60% | 0.596 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -67.9 | -38.7 | 178.5 | -77.2 | 176.5 | 177.1 | 176.2 | 0 | 112.7 | Y287 S292 T293 | Y287-K290 PolarHBondContact O-N 3.21Å; K290-S292 PolarHBondContact O-N 3.23Å; K290-T293 PolarHBondContact O-N 2.97Å; K290-T293 VanDerWaalsContact O-N 3.13Å |
| 291 | A | 50.1 | Low | 57 | Low | 71 Ų | 71 | 118.6 Ų | 118.6 | 59% | 0.587 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -60.4 | -34.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y287 T293 | Y287-A291 PolarHBondContact O-N 2.78Å; A291-T293 VanDerWaalsContact C-N 3.32Å; A291-T293 PolarHBondContact O-N 3.42Å |
| 292 | S | 46.6 | Very low | 55.4 | Low | 80 Ų | 80 | 116.3 Ų | 116.3 | 56% | 0.559 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -75.2 | -16.4 | 179 | -56.5 | 0 | 0 | 0 | 0 | 114.2 | T288 G289 K290 | T288-S292 PolarHBondContact O-OG 2.99Å; G289-S292 PolarHBondContact O-N 3.4Å; K290-S292 PolarHBondContact O-N 3.23Å |
| 293 | T | 50.6 | Low | 54.1 | Low | 104 Ų | 104 | 117.6 Ų | 117.6 | 64% | 0.638 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -87.3 | -19.9 | -173.3 | -38.8 | 0 | 0 | 0 | 0 | 112.5 | G289 K290 A291 | G289-T293 PolarHBondContact O-OG1 3.36Å; K290-T293 PolarHBondContact O-N 2.97Å; K290-T293 VanDerWaalsContact O-N 3.13Å; A291-T293 VanDerWaalsContact C-N 3.32Å; A291-T293 PolarHBondContact O-N 3.42Å |
| 294 | V | 50.8 | Low | 52.5 | Low | 129 Ų | 129 | 119 Ų | 119 | 78% | 0.782 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.9 | -20.3 | -178.1 | 177.5 | 0 | 0 | 0 | 0 | 112.9 | ||
| 295 | T | 45.6 | Very low | 50.7 | Low | 126 Ų | 126 | 123.4 Ų | 123.4 | 77% | 0.773 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.1 | 5.8 | -175.1 | 31 | 0 | 0 | 0 | 0 | 115.5 | ||
| 296 | K | 39.4 | Very low | 48.7 | Very low | 194 Ų | 194 | 124.6 Ų | 124.6 | 84% | 0.843 | 69% | 0.687 | S | S | * | * | trans | -136.5 | 48.4 | -176.5 | -146.5 | 174.7 | -175.8 | 176 | 0 | 114.4 | ||||
| 297 | A | 36 | Very low | 46.8 | Very low | 100 Ų | 100 | 126.7 Ų | 126.7 | 83% | 0.826 | 70% | 0.695 | S | S | * | * | trans | -101 | 72.4 | 170 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 298 | R | 39.6 | Very low | 45.2 | Very low | 234 Ų | 234 | 130.4 Ų | 130.4 | 88% | 0.883 | 73% | 0.728 | S | S | * | * | trans | -154.4 | 81.7 | 163.7 | -163 | 154.9 | 115.1 | -174.2 | 0.9 | 113.6 | ||||
| 299 | R | 43 | Very low | 43.8 | Very low | 231 Ų | 231 | 133.1 Ų | 133.1 | 87% | 0.872 | 75% | 0.745 | S | S | * | * | trans | 64.6 | 159 | 137.8 | -91.6 | -167.8 | 93 | -150.1 | 6.6 | 120.1 | ||||
| 300 | P | 43.7 | Very low | 43 | Very low | 98 Ų | 98 | 137.2 Ų | 137.2 | 64% | 0.636 | 77% | 0.765 | S | S | * | * | -139 | -178.6 | -89.8 | 37.5 | -15.3 | 0 | 0 | 0 | 115.8 | |||||
| 301 | R | 35.6 | Very low | 42.3 | Very low | 238 Ų | 238 | 136.1 Ų | 136.1 | 90% | 0.898 | 77% | 0.774 | S | S | * | * | trans | 93.9 | 124 | 142.4 | -145.9 | 175.8 | -163.4 | -136.4 | 3.4 | 119.5 | ||||
| 302 | G | 38.8 | Very low | 42 | Very low | 67 Ų | 67 | 138.9 Ų | 138.9 | 69% | 0.691 | 79% | 0.786 | S | S | * | * | trans | 151.6 | 82 | 165.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 303 | Q | 42.9 | Very low | 41.7 | Very low | 178 Ų | 178 | 138.4 Ų | 138.4 | 83% | 0.832 | 79% | 0.794 | S | S | * | * | 40.1 | 110.2 | 104.9 | -71.8 | -178.8 | 10.6 | 0 | 0 | 112.5 | |||||
| 304 | S | 42.8 | Very low | 41.3 | Very low | 115 Ų | 115 | 139.3 Ų | 139.3 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | -174.4 | 123.8 | 73.2 | 45.6 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 305 | S | 39.9 | Very low | 40.8 | Very low | 101 Ų | 101 | 139.8 Ų | 139.8 | 71% | 0.706 | 81% | 0.809 | S | S | * | * | 62.5 | 106.2 | 96.2 | -175.5 | 0 | 0 | 0 | 0 | 118.6 | |||||
| 306 | C | 36.4 | Very low | 40.4 | Very low | 118 Ų | 118 | 137.2 Ų | 137.2 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | 170.6 | 103.9 | 128.7 | 51 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 307 | Q | 38.4 | Very low | 40.4 | Very low | 176 Ų | 176 | 134 Ų | 134 | 82% | 0.822 | 81% | 0.807 | S | S | * | * | 63 | 109.2 | 89.2 | -69.1 | -170.5 | 52.1 | 0 | 0 | 115.8 | |||||
| 308 | S | 44.5 | Very low | 40.3 | Very low | 125 Ų | 125 | 137.4 Ų | 137.4 | 87% | 0.874 | 81% | 0.81 | S | S | * | * | 173.7 | 110.6 | 121.9 | -71.4 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 309 | T | 41.1 | Very low | 40.2 | Very low | 136 Ų | 136 | 131.3 Ų | 131.3 | 83% | 0.834 | 80% | 0.801 | S | S | * | * | trans | -72.7 | 170.8 | 157.1 | 31.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 310 | P | 42.4 | Very low | 39.5 | Very low | 124 Ų | 124 | 129 Ų | 129 | 81% | 0.805 | 81% | 0.805 | S | S | * | * | cis | -147.5 | 168.9 | 38.8 | 36.9 | -12.5 | 0 | 0 | 0 | 120.3 | ||||
| 311 | S | 40.2 | Very low | 39.1 | Very low | 113 Ų | 113 | 130.5 Ų | 130.5 | 79% | 0.79 | 81% | 0.812 | S | S | * | * | trans | -47 | -178.6 | 158.3 | -92.3 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 312 | P | 44.5 | Very low | 38.9 | Very low | 129 Ų | 129 | 126.7 Ų | 126.7 | 84% | 0.838 | 81% | 0.81 | S | S | * | * | cis | -135.8 | 170.1 | 17.2 | 29.4 | -4 | 0 | 0 | 0 | 114.2 | ||||
| 313 | G | 39.9 | Very low | 38.5 | Very low | 70 Ų | 70 | 126.5 Ų | 126.5 | 72% | 0.722 | 81% | 0.808 | S | S | * | * | 154 | 172.7 | 71.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 314 | P | 41.7 | Very low | 38.1 | Very low | 123 Ų | 123 | 123.6 Ų | 123.6 | 80% | 0.799 | 81% | 0.807 | S | S | * | * | trans | -122.4 | 155.8 | -144.4 | 37.6 | -22.8 | 0 | 0 | 0 | 114.9 | ||||
| 315 | C | 40.7 | Very low | 37.7 | Very low | 139 Ų | 139 | 124.2 Ų | 124.2 | 94% | 0.939 | 80% | 0.802 | S | S | * | * | trans | -167.8 | 125.7 | 158.9 | -99.4 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 316 | G | 36.9 | Very low | 38.1 | Very low | 73 Ų | 73 | 124 Ų | 124 | 75% | 0.753 | 80% | 0.796 | S | S | * | * | cis | 129.2 | 132.8 | 30.5 | 0 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 317 | P | 39.1 | Very low | 38.7 | Very low | 126 Ų | 126 | 124 Ų | 124 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -103.6 | 159.1 | -148.4 | 34.5 | -23.3 | 0 | 0 | 0 | 113.8 | ||||
| 318 | L | 35.3 | Very low | 38.8 | Very low | 172 Ų | 172 | 122.6 Ų | 122.6 | 90% | 0.901 | 79% | 0.789 | S | S | * | * | trans | -125.3 | 143.3 | 165.4 | -71.3 | 179.6 | 0 | 0 | 0 | 112.3 | ||||
| 319 | P | 36.2 | Very low | 38.7 | Very low | 106 Ų | 106 | 122.2 Ų | 122.2 | 69% | 0.688 | 78% | 0.782 | S | S | * | * | trans | -99 | 148.3 | -153.1 | 11.5 | 9.9 | 0 | 0 | 0 | 112.3 | T321 | P319-T321 PolarHBondContact O-N 2.89Š| ||
| 320 | L | 29.5 | Very low | 38.7 | Very low | 181 Ų | 181 | 121.6 Ų | 121.6 | 95% | 0.948 | 77% | 0.773 | S | S | * | * | trans | -62.3 | 117.1 | 160.3 | -66.8 | 161.6 | 0 | 0 | 0 | 108.6 | ||||
| 321 | T | 34.4 | Very low | 38.8 | Very low | 130 Ų | 130 | 126.6 Ų | 126.6 | 80% | 0.798 | 78% | 0.775 | S | S | * | * | trans | -112 | 101.2 | 168.1 | 150.2 | 0 | 0 | 0 | 0 | 108.8 | P319 | P319-T321 PolarHBondContact O-N 2.89Š| ||
| 322 | N | 31.9 | Very low | 38.8 | Very low | 159 Ų | 159 | 126.4 Ų | 126.4 | 85% | 0.85 | 77% | 0.77 | S | S | * | * | trans | -56.2 | 157.5 | 155 | -91.9 | -3.9 | 0 | 0 | 0 | 110.9 | ||||
| 323 | G | 30.4 | Very low | 38.4 | Very low | 63 Ų | 63 | 124.2 Ų | 124.2 | 65% | 0.649 | 75% | 0.751 | S | S | * | * | trans | 107.9 | 113.4 | 145 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 324 | S | 33.5 | Very low | 38.3 | Very low | 116 Ų | 116 | 124.3 Ų | 124.3 | 81% | 0.811 | 75% | 0.745 | S | S | * | * | trans | 48.1 | 80.8 | 136.1 | 61.8 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 325 | D | 35.8 | Very low | 38.1 | Very low | 129 Ų | 129 | 128 Ų | 128 | 69% | 0.69 | 75% | 0.748 | S | S | * | * | trans | -155.5 | 92.2 | 149.6 | -108.7 | -41.2 | 0 | 0 | 0 | 110.6 | ||||
| 326 | V | 48.2 | Very low | 38 | Very low | 96 Ų | 96 | 128.6 Ų | 128.6 | 58% | 0.582 | 74% | 0.741 | S | S | * | * | trans | -128.3 | 22.2 | 169.5 | -144.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 327 | V | 47.6 | Very low | 38.2 | Very low | 118 Ų | 118 | 131.7 Ų | 131.7 | 72% | 0.715 | 74% | 0.736 | S | S | * | * | trans | -118.7 | 48.5 | 178.3 | -164.8 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 328 | L | 41.7 | Very low | 38.4 | Very low | 147 Ų | 147 | 130.4 Ų | 130.4 | 77% | 0.77 | 73% | 0.728 | S | S | * | * | trans | -136.7 | 109.1 | 168.7 | -109.7 | 94.3 | 0 | 0 | 0 | 108.3 | ||||
| 329 | T | 41.9 | Very low | 38.9 | Very low | 117 Ų | 117 | 128.4 Ų | 128.4 | 72% | 0.718 | 73% | 0.725 | S | S | * | * | trans | 150.2 | 48.3 | 147.7 | -49.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 330 | L | 41.4 | Very low | 39.1 | Very low | 123 Ų | 123 | 129.4 Ų | 129.4 | 64% | 0.644 | 73% | 0.729 | S | S | * | * | trans | -118.7 | 30.3 | 162.3 | -85.4 | 174.5 | 0 | 0 | 0 | 111.7 | I142 | I142-L330 HydrophobicContact CG2-CD1 4.06Š| ||
| 331 | R | 44.2 | Very low | 39.6 | Very low | 228 Ų | 228 | 124 Ų | 124 | 86% | 0.86 | 72% | 0.718 | S | S | * | * | trans | -96.9 | -0.1 | 180 | -154.5 | 174.9 | 176.9 | 105.6 | 0.4 | 113.6 | ||||
| 332 | T | 39.4 | Very low | 39.5 | Very low | 109 Ų | 109 | 121.3 Ų | 121.3 | 67% | 0.669 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.8 | 4.6 | -167.5 | -43.2 | 0 | 0 | 0 | 0 | 114.9 | ||
| 333 | L | 36.8 | Very low | 39.7 | Very low | 84 Ų | 84 | 120.1 Ų | 120.1 | 44% | 0.44 | 71% | 0.714 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -118.1 | 28.1 | 177.2 | -66.8 | 179.3 | 0 | 0 | 0 | 114.2 | F335 | L333-F335 PolarHBondContact O-N 3.15Å; L333-F335 VanDerWaalsContact O-N 3.08Å |
| 334 | A | 37.2 | Very low | 39.7 | Very low | 72 Ų | 72 | 123 Ų | 123 | 60% | 0.595 | 72% | 0.723 | S | S | * | * | G | 310 helix | trans | -73.5 | 14 | 175 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 335 | F | 38.5 | Very low | 39.8 | Very low | 199 Ų | 199 | 125.1 Ų | 125.1 | 87% | 0.873 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -89.4 | 3.6 | -178.3 | -87 | -78.1 | 0 | 0 | 0 | 115 | L333 | L333-F335 PolarHBondContact O-N 3.15Å; L333-F335 VanDerWaalsContact O-N 3.08Å |
| 336 | L | 37.9 | Very low | 39.7 | Very low | 152 Ų | 152 | 127.4 Ų | 127.4 | 80% | 0.796 | 73% | 0.731 | S | S | * | * | G | 310 helix | trans | -137.4 | 50.6 | 173.4 | -68.7 | 170.1 | 0 | 0 | 0 | 110.8 | ||
| 337 | Q | 41.2 | Very low | 39 | Very low | 138 Ų | 138 | 129 Ų | 129 | 65% | 0.645 | 74% | 0.744 | S | S | * | * | trans | -105.9 | 112.5 | 168.2 | -167.9 | 171.9 | -33.5 | 0 | 0 | 108.7 | ||||
| 338 | P | 43.5 | Very low | 38.3 | Very low | 99 Ų | 99 | 131 Ų | 131 | 64% | 0.643 | 75% | 0.749 | S | S | * | * | trans | -65 | 143.8 | 166.2 | 27.6 | -29.5 | 0 | 0 | 0 | 108.4 | T340 | P338-T340 PolarHBondContact O-N 2.96Š| ||
| 339 | P | 45.6 | Very low | 38 | Very low | 130 Ų | 130 | 129.9 Ų | 129.9 | 84% | 0.844 | 75% | 0.748 | S | S | * | * | trans | -63.5 | 108.7 | -176 | 25.8 | -32.7 | 0 | 0 | 0 | 109.9 | G341 | P339-G341 PolarHBondContact O-N 3.24Š| ||
| 340 | T | 41.5 | Very low | 37.6 | Very low | 127 Ų | 127 | 133.2 Ų | 133.2 | 78% | 0.779 | 76% | 0.755 | S | S | * | * | trans | -80.6 | 89.8 | 166.3 | 39.3 | 0 | 0 | 0 | 0 | 108.5 | P338 | P338-T340 PolarHBondContact O-N 2.96Š| ||
| 341 | G | 39.1 | Very low | 37.5 | Very low | 68 Ų | 68 | 132.8 Ų | 132.8 | 70% | 0.701 | 76% | 0.763 | S | S | * | * | trans | -140.7 | 114.1 | 167.2 | 0 | 0 | 0 | 0 | 0 | 107.9 | P339 | P339-G341 PolarHBondContact O-N 3.24Š| ||
| 342 | G | 32.2 | Very low | 37 | Very low | 74 Ų | 74 | 127.6 Ų | 127.6 | 76% | 0.763 | 75% | 0.752 | S | S | * | * | trans | -69 | 160.5 | -168.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 343 | V | 36.2 | Very low | 36.7 | Very low | 134 Ų | 134 | 134.6 Ų | 134.6 | 81% | 0.812 | 77% | 0.766 | S | S | * | * | -157.4 | 132.2 | 111 | -175.5 | 0 | 0 | 0 | 0 | 106.9 | L345 | V343-L345 HydrophobicContact CG1-CG 4.38Å; V343-L345 PolarHBondContact O-N 3.47Å | |||
| 344 | C | 29.9 | Very low | 36.7 | Very low | 124 Ų | 124 | 138.2 Ų | 138.2 | 84% | 0.838 | 78% | 0.781 | S | S | * | * | trans | -68 | 110.2 | 169 | -178.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 345 | L | 35.2 | Very low | 36.8 | Very low | 160 Ų | 160 | 146 Ų | 146 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | trans | -140.9 | 134.5 | 161.6 | -75.2 | 179.2 | 0 | 0 | 0 | 110.1 | V343 | V343-L345 HydrophobicContact CG1-CG 4.38Å; V343-L345 PolarHBondContact O-N 3.47Å | ||
| 346 | Q | 35.5 | Very low | 36.7 | Very low | 176 Ų | 176 | 141.6 Ų | 141.6 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | -57.1 | 159.7 | -178.4 | -70.2 | -153.4 | 0.9 | 0 | 0 | 113.6 | L348 | Q346-L348 PolarHBondContact O-N 3.41Š| ||
| 347 | P | 33.3 | Very low | 37 | Very low | 131 Ų | 131 | 138.1 Ų | 138.1 | 85% | 0.851 | 79% | 0.788 | S | S | * | * | trans | -76.8 | 103.7 | -169.8 | 29.8 | -29.5 | 0 | 0 | 0 | 110.6 | ||||
| 348 | L | 32.7 | Very low | 37.5 | Very low | 159 Ų | 159 | 137.8 Ų | 137.8 | 83% | 0.832 | 80% | 0.798 | S | S | * | * | trans | -112.2 | 111.1 | 157.3 | -157.1 | 75.7 | 0 | 0 | 0 | 108.1 | Q346 H350 | Q346-L348 PolarHBondContact O-N 3.41Å; L348-H350 PolarHBondContact O-N 3.04Å | ||
| 349 | V | 34.6 | Very low | 37.7 | Very low | 123 Ų | 123 | 141.8 Ų | 141.8 | 75% | 0.745 | 81% | 0.808 | S | S | * | * | trans | -38.7 | 121.7 | 163.5 | -82.2 | 0 | 0 | 0 | 0 | 111 | ||||
| 350 | H | 34.8 | Very low | 38 | Very low | 188 Ų | 188 | 141.6 Ų | 141.6 | 87% | 0.87 | 81% | 0.807 | S | S | * | * | trans | -175.7 | 125 | 140.6 | -99.4 | 86.7 | 0 | 0 | 0 | 109.9 | L348 | L348-H350 PolarHBondContact O-N 3.04Š| ||
| 351 | S | 37.5 | Very low | 38.5 | Very low | 114 Ų | 114 | 140.3 Ų | 140.3 | 80% | 0.797 | 81% | 0.809 | S | S | * | * | trans | -83.4 | 127.8 | 176.9 | -50.3 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 352 | N | 35.5 | Very low | 38.8 | Very low | 119 Ų | 119 | 142.6 Ų | 142.6 | 64% | 0.636 | 81% | 0.814 | S | S | * | * | trans | -141.1 | 98.4 | 162.5 | -166.9 | 4.3 | 0 | 0 | 0 | 109.6 | Q354 | N352-Q354 PolarHBondContact ND2-OE1 3.04Å; N352-Q354 PolarHBondContact OD1-OE1 3.18Å | ||
| 353 | W | 31.5 | Very low | 39.8 | Very low | 255 Ų | 255 | 144.7 Ų | 144.7 | 97% | 0.966 | 82% | 0.817 | S | S | * | * | trans | -90.9 | 89.2 | 162.4 | -77.5 | 90.5 | 0 | 0 | 0 | 107.2 | ||||
| 354 | Q | 38.1 | Very low | 40.5 | Very low | 160 Ų | 160 | 144.3 Ų | 144.3 | 75% | 0.748 | 82% | 0.817 | S | S | * | * | trans | -93.4 | 108.2 | 172.1 | -123.1 | 160.5 | -17.5 | 0 | 0 | 109.9 | N352 | N352-Q354 PolarHBondContact ND2-OE1 3.04Å; N352-Q354 PolarHBondContact OD1-OE1 3.18Å | ||
| 355 | R | 38.3 | Very low | 41.1 | Very low | 237 Ų | 237 | 143.6 Ų | 143.6 | 89% | 0.894 | 82% | 0.821 | S | S | * | * | trans | -47.9 | 122.6 | 167.8 | -179.7 | -173.3 | -68.3 | 173.1 | -3 | 111.2 | ||||
| 356 | A | 37.6 | Very low | 41.5 | Very low | 106 Ų | 106 | 139.4 Ų | 139.4 | 88% | 0.876 | 82% | 0.816 | S | S | * | * | trans | -107.5 | 105.8 | 161.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 357 | A | 42.8 | Very low | 41.7 | Very low | 79 Ų | 79 | 139.9 Ų | 139.9 | 65% | 0.653 | 82% | 0.818 | S | S | * | * | trans | -134.6 | 135.5 | 162 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 358 | P | 51.7 | Low | 42.4 | Very low | 130 Ų | 130 | 139.3 Ų | 139.3 | 84% | 0.844 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 143.7 | -171.9 | -3.9 | 22.4 | 0 | 0 | 0 | 111.7 | ||
| 359 | Q | 48.9 | Very low | 42.8 | Very low | 184 Ų | 184 | 135.5 Ų | 135.5 | 86% | 0.86 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 148 | 177.4 | -61.7 | -160.6 | -20.1 | 0 | 0 | 112.7 | ||
| 360 | P | 51.2 | Low | 43.2 | Very low | 125 Ų | 125 | 134.6 Ų | 134.6 | 81% | 0.812 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 139.6 | 159.8 | 32.6 | -27.8 | 0 | 0 | 0 | 110.9 | ||
| 361 | A | 51.3 | Low | 43.4 | Very low | 100 Ų | 100 | 134.4 Ų | 134.4 | 83% | 0.826 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 144.2 | -179 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 362 | S | 45.3 | Very low | 43.7 | Very low | 117 Ų | 117 | 135.4 Ų | 135.4 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 136.4 | 173.8 | 42.1 | 0 | 0 | 0 | 0 | 114.7 | ||
| 363 | S | 54.8 | Low | 43.8 | Very low | 118 Ų | 118 | 141.1 Ų | 141.1 | 83% | 0.825 | 82% | 0.822 | S | S | * | * | trans | -110 | 139.9 | 155.7 | -68.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 364 | P | 49.3 | Very low | 44.5 | Very low | 125 Ų | 125 | 135.8 Ų | 135.8 | 81% | 0.812 | 81% | 0.812 | S | S | * | * | trans | -101.8 | 137.6 | 168.7 | 34.2 | -24.9 | 0 | 0 | 0 | 113 | ||||
| 365 | A | 42.3 | Very low | 44.8 | Very low | 110 Ų | 110 | 132.3 Ų | 132.3 | 91% | 0.909 | 81% | 0.811 | S | S | * | * | trans | 20.4 | 133.1 | 147.9 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 366 | G | 44.9 | Very low | 45 | Very low | 71 Ų | 71 | 125.6 Ų | 125.6 | 73% | 0.732 | 81% | 0.806 | S | S | * | * | trans | 174.7 | 93.8 | 157.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 367 | E | 40.2 | Very low | 45.4 | Very low | 186 Ų | 186 | 126.2 Ų | 126.2 | 87% | 0.869 | 80% | 0.804 | S | S | * | * | trans | 66.9 | 111.5 | 147.2 | -66.4 | -173 | 100.5 | 0 | 0 | 123.1 | ||||
| 368 | S | 46.1 | Very low | 45.6 | Very low | 120 Ų | 120 | 134.1 Ų | 134.1 | 84% | 0.839 | 84% | 0.835 | S | S | * | * | 52.8 | 110 | 118.3 | -51.6 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 369 | G | 42.9 | Very low | 45.3 | Very low | 79 Ų | 79 | 134.3 Ų | 134.3 | 81% | 0.814 | 84% | 0.835 | S | S | * | * | trans | -175.7 | 88.6 | 163.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 370 | S | 42.9 | Very low | 45.1 | Very low | 104 Ų | 104 | 131.7 Ų | 131.7 | 73% | 0.727 | 83% | 0.833 | S | S | * | * | trans | -53 | 140.3 | 167.6 | 178.3 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 371 | F | 39.3 | Very low | 44.8 | Very low | 183 Ų | 183 | 132.1 Ų | 132.1 | 80% | 0.803 | 83% | 0.834 | S | S | * | * | 170.7 | 116.9 | 116.4 | -106.5 | -97.8 | 0 | 0 | 0 | 113 | |||||
| 372 | N | 43.9 | Very low | 44.4 | Very low | 135 Ų | 135 | 133.9 Ų | 133.9 | 72% | 0.722 | 84% | 0.835 | S | S | * | * | trans | 58.8 | 129.2 | 135.2 | -125.4 | 13.7 | 0 | 0 | 0 | 123.6 | ||||
| 373 | W | 35.5 | Very low | 44.3 | Very low | 240 Ų | 240 | 135 Ų | 135 | 91% | 0.909 | 84% | 0.836 | S | S | * | * | trans | -93.8 | 131.8 | 164.8 | -71.5 | 92.3 | 0 | 0 | 0 | 109.8 | ||||
| 374 | D | 47.2 | Very low | 43.6 | Very low | 142 Ų | 142 | 136.1 Ų | 136.1 | 76% | 0.759 | 84% | 0.837 | S | S | * | * | trans | -150.6 | 109.1 | 151.9 | -94.4 | -51.4 | 0 | 0 | 0 | 104.9 | ||||
| 375 | A | 44 | Very low | 43.2 | Very low | 88 Ų | 88 | 136.9 Ų | 136.9 | 73% | 0.727 | 84% | 0.838 | S | S | * | * | 57.6 | 104.1 | 75.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 376 | A | 43.9 | Very low | 43.3 | Very low | 95 Ų | 95 | 139 Ų | 139 | 79% | 0.785 | 83% | 0.833 | S | S | * | * | 148.6 | 132.4 | 119.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 377 | S | 45.7 | Very low | 43.1 | Very low | 119 Ų | 119 | 144.7 Ų | 144.7 | 83% | 0.832 | 84% | 0.841 | S | S | * | * | trans | 79.5 | 116.6 | 144.4 | -66 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 378 | N | 46.3 | Very low | 43.4 | Very low | 245 Ų | 245 | 140.9 Ų | 140.9 | 100% | 1.31 | 84% | 0.839 | S | S | * | * | trans | 81.3 | 0 | 158.3 | -110.4 | 29.9 | 0 | 0 | 0 | 119.8 |
Retrieved 378 of 378 residues in 620.9 ms
(Link to these results)