| 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 | 29.2 | Very low | 28.8 | Very low | 238 Ų | 238 | 160 Ų | 160 | 100% | 1.172 | 85% | 0.848 | S | S | * | * | 0 | 103.7 | 0 | -81.7 | 172 | 160.2 | 0 | 0 | 107.9 | |||||
| 2 | N | 31.4 | Very low | 29.1 | Very low | 163 Ų | 163 | 159.6 Ų | 159.6 | 87% | 0.872 | 85% | 0.846 | S | S | * | * | trans | -153 | 109.1 | 157.9 | -101.9 | -9.4 | 0 | 0 | 0 | 107.1 | ||||
| 3 | N | 29.1 | Very low | 29.1 | Very low | 158 Ų | 158 | 159.4 Ų | 159.4 | 85% | 0.845 | 85% | 0.846 | S | S | * | * | trans | -72.2 | 120.2 | -178.3 | -68.7 | -32.4 | 0 | 0 | 0 | 109.1 | ||||
| 4 | I | 29.5 | Very low | 29.1 | Very low | 153 Ų | 153 | 157.8 Ų | 157.8 | 79% | 0.785 | 84% | 0.837 | S | S | * | * | trans | -108 | 96.7 | 165.3 | -61.8 | 177.4 | 0 | 0 | 0 | 107.3 | L6 | I4-L6 HydrophobicContact CG2-CD1 4.49Å; I4-L6 PolarHBondContact O-N 3.25Å | ||
| 5 | T | 27.8 | Very low | 29.1 | Very low | 129 Ų | 129 | 156.1 Ų | 156.1 | 79% | 0.791 | 84% | 0.838 | S | S | * | * | trans | -68.3 | 109.8 | 164.2 | 38.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 6 | L | 27.1 | Very low | 29 | Very low | 153 Ų | 153 | 152.1 Ų | 152.1 | 80% | 0.801 | 82% | 0.821 | S | S | * | * | trans | -96.3 | 109.5 | 167.4 | -139.5 | 86.2 | 0 | 0 | 0 | 109 | I4 L8 | I4-L6 HydrophobicContact CG2-CD1 4.49Å; I4-L6 PolarHBondContact O-N 3.25Å; L6-L8 PolarHBondContact O-N 3.1Å | ||
| 7 | S | 27.4 | Very low | 28.8 | Very low | 113 Ų | 113 | 154.7 Ų | 154.7 | 79% | 0.79 | 82% | 0.823 | S | S | * | * | trans | -64.8 | 112.7 | 171.7 | 36.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 8 | L | 30.2 | Very low | 28.7 | Very low | 171 Ų | 171 | 150.9 Ų | 150.9 | 90% | 0.895 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 137.3 | 174.1 | -80.5 | 166.3 | 0 | 0 | 0 | 111.2 | L6 | L6-L8 PolarHBondContact O-N 3.1Š|
| 9 | L | 30.5 | Very low | 28.5 | Very low | 173 Ų | 173 | 148.7 Ų | 148.7 | 91% | 0.906 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 148.5 | -177.1 | -91.3 | 121.1 | 0 | 0 | 0 | 113.7 | ||
| 10 | K | 27.3 | Very low | 28.4 | Very low | 181 Ų | 181 | 151 Ų | 151 | 79% | 0.787 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 137.7 | 177.9 | -174.7 | 169.9 | -178.6 | 176.4 | 0 | 111.8 | ||
| 11 | N | 26.8 | Very low | 28.5 | Very low | 128 Ų | 128 | 150.3 Ų | 150.3 | 68% | 0.684 | 79% | 0.793 | S | S | * | * | trans | 24.8 | 121.1 | 148.6 | -58.2 | -8.4 | 0 | 0 | 0 | 118.2 | ||||
| 12 | N | 33.2 | Very low | 28.6 | Very low | 155 Ų | 155 | 144.2 Ų | 144.2 | 83% | 0.829 | 77% | 0.765 | S | S | * | * | -172.5 | 145.9 | 110.6 | -84.6 | -19.8 | 0 | 0 | 0 | 110.5 | L14 | N12-L14 PolarHBondContact O-N 3.43Š| |||
| 13 | D | 29.2 | Very low | 28.7 | Very low | 157 Ų | 157 | 142.5 Ų | 142.5 | 84% | 0.84 | 76% | 0.755 | S | S | * | * | trans | -62.1 | 117.5 | -168.9 | -55.6 | -75.1 | 0 | 0 | 0 | 114.3 | ||||
| 14 | L | 29.4 | Very low | 28.9 | Very low | 137 Ų | 137 | 138.4 Ų | 138.4 | 72% | 0.717 | 74% | 0.739 | S | S | * | * | trans | -158.8 | 125.1 | 143.7 | -150.4 | 71.4 | 0 | 0 | 0 | 109.9 | N12 T16 | N12-L14 PolarHBondContact O-N 3.43Å; L14-T16 HydrophobicContact CD2-CG2 4.14Å; L14-T16 PolarHBondContact O-N 3.37Å | ||
| 15 | P | 28.1 | Very low | 29.2 | Very low | 132 Ų | 132 | 135.8 Ų | 135.8 | 86% | 0.857 | 73% | 0.726 | S | S | * | * | trans | -80.4 | 63.7 | 177.3 | 34 | -33.6 | 0 | 0 | 0 | 109.8 | K17 | P15-K17 PolarHBondContact O-N 3.23Š| ||
| 16 | T | 27.8 | Very low | 29.7 | Very low | 93 Ų | 93 | 133 Ų | 133 | 57% | 0.571 | 71% | 0.709 | S | S | * | * | trans | -79.8 | 111.6 | 159.9 | 42.2 | 0 | 0 | 0 | 0 | 106.8 | L14 T18 | L14-T16 HydrophobicContact CD2-CG2 4.14Å; L14-T16 PolarHBondContact O-N 3.37Å; T16-T18 PolarHBondContact O-N 3.37Å; T16-T18 PolarHBondContact O-OG1 3.36Å | ||
| 17 | K | 25.7 | Very low | 30.2 | Very low | 196 Ų | 196 | 131.8 Ų | 131.8 | 85% | 0.852 | 70% | 0.699 | S | S | * | * | trans | -66.4 | 68.2 | 170 | -161.7 | 176.8 | -173 | 178 | 0 | 108.3 | P15 T19 | P15-K17 PolarHBondContact O-N 3.23Å; K17-T19 PolarHBondContact O-N 3.49Å | ||
| 18 | T | 26.8 | Very low | 31 | Very low | 87 Ų | 87 | 131.3 Ų | 131.3 | 53% | 0.534 | 69% | 0.688 | S | S | . | * | trans | -71.6 | 87 | 165.8 | 30.2 | 0 | 0 | 0 | 0 | 106.2 | T16 Y20 | T16-T18 PolarHBondContact O-N 3.37Å; T16-T18 PolarHBondContact O-OG1 3.36Å; T18-Y20 VanDerWaalsContact C-N 3.26Å; T18-Y20 VanDerWaalsContact O-CD2 3.27Å; T18-Y20 WeakPolarHBondContact O-CD2 3.41Å; T18-Y20 PolarHBondContact O-N 3.05Å | ||
| 19 | T | 25.1 | Very low | 31.7 | Very low | 108 Ų | 108 | 129 Ų | 129 | 66% | 0.663 | 67% | 0.673 | S | S | * | * | trans | -60.1 | 98.4 | 162 | -50.1 | 0 | 0 | 0 | 0 | 106.2 | K17 I21 | K17-T19 PolarHBondContact O-N 3.49Å; T19-I21 VanDerWaalsContact C-N 3.26Å; T19-I21 PolarHBondContact O-N 2.86Å | ||
| 20 | Y | 26.5 | Very low | 32.6 | Very low | 194 Ų | 194 | 125.7 Ų | 125.7 | 76% | 0.761 | 66% | 0.656 | S | S | * | * | trans | -60.5 | 96.2 | 164.7 | -67.3 | -88.8 | 0 | 0 | 0 | 106.6 | T18 N22 | T18-Y20 VanDerWaalsContact C-N 3.26Å; T18-Y20 VanDerWaalsContact O-CD2 3.27Å; T18-Y20 WeakPolarHBondContact O-CD2 3.41Å; T18-Y20 PolarHBondContact O-N 3.05Å; Y20-N22 VanDerWaalsContact C-N 3.33Å; Y20-N22 PolarHBondContact O-N 2.86Å | ||
| 21 | I | 30.7 | Very low | 33.7 | Very low | 137 Ų | 137 | 122.8 Ų | 122.8 | 70% | 0.703 | 65% | 0.645 | S | S | * | * | trans | -67.6 | 103.1 | 164.7 | -62.5 | 173.9 | 0 | 0 | 0 | 104.2 | T19 I23 | T19-I21 VanDerWaalsContact C-N 3.26Å; T19-I21 PolarHBondContact O-N 2.86Å; I21-I23 PolarHBondContact O-N 3.09Å | ||
| 22 | N | 31.5 | Very low | 35.1 | Very low | 110 Ų | 110 | 121.4 Ų | 121.4 | 59% | 0.588 | 64% | 0.641 | S | S | * | * | trans | -57 | 99.5 | 172.7 | -90.9 | -19.4 | 0 | 0 | 0 | 109 | Y20 S24 N25 | Y20-N22 VanDerWaalsContact C-N 3.33Å; Y20-N22 PolarHBondContact O-N 2.86Å; N22-S24 PolarHBondContact O-N 3.13Å; N22-S24 VanDerWaalsContact O-N 3.16Å; N22-N25 PolarHBondContact O-N 3.4Å | ||
| 23 | I | 32.8 | Very low | 36.5 | Very low | 128 Ų | 128 | 114.8 Ų | 114.8 | 66% | 0.656 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.6 | -19.2 | 176.1 | -59.2 | 171.6 | 0 | 0 | 0 | 110.8 | I21 N25 T26 | I21-I23 PolarHBondContact O-N 3.09Å; I23-N25 PolarHBondContact O-N 3.15Å; I23-T26 PolarHBondContact O-N 2.99Å; I23-T26 PolarHBondContact O-OG1 2.95Å |
| 24 | S | 33.2 | Very low | 38 | Very low | 72 Ų | 72 | 111 Ų | 111 | 50% | 0.503 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -61.3 | -29.2 | 172.6 | 50.5 | 0 | 0 | 0 | 0 | 113.3 | N22 N28 | N22-S24 PolarHBondContact O-N 3.13Å; N22-S24 VanDerWaalsContact O-N 3.16Å; S24-N28 WeakPolarHBondContact O-CB 3.49Å; S24-N28 PolarHBondContact O-N 3.18Å; S24-N28 VanDerWaalsContact O-N 3.1Å |
| 25 | N | 35.9 | Very low | 39.5 | Very low | 97 Ų | 97 | 109.1 Ų | 109.1 | 52% | 0.519 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -76.5 | -28.9 | 179.2 | -98.3 | 2.2 | 0 | 0 | 0 | 113.2 | N22 I23 Q29 | N22-N25 PolarHBondContact O-N 3.4Å; I23-N25 PolarHBondContact O-N 3.15Å; N25-Q29 WeakPolarHBondContact O-CB 3.43Å; N25-Q29 WeakPolarHBondContact O-CG 3.41Å; N25-Q29 PolarHBondContact O-N 2.84Å |
| 26 | T | 38.2 | Very low | 41.3 | Very low | 71 Ų | 71 | 109.7 Ų | 109.7 | 44% | 0.436 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -73.9 | -37.8 | 177.5 | 45.1 | 0 | 0 | 0 | 0 | 111.6 | I23 Q29 N30 | I23-T26 PolarHBondContact O-N 2.99Å; I23-T26 PolarHBondContact O-OG1 2.95Å; T26-Q29 PolarHBondContact O-N 3.3Å; T26-N30 WeakPolarHBondContact O-CB 3.32Å; T26-N30 VanDerWaalsContact O-CG 3.3Å; T26-N30 PolarHBondContact O-N 3.11Å |
| 27 | Q | 38.4 | Very low | 43.7 | Very low | 128 Ų | 128 | 108.3 Ų | 108.3 | 60% | 0.598 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -69 | -42.3 | 173.2 | -68.1 | -143.7 | -13.3 | 0 | 0 | 112.3 | Q29 N30 H31 | Q27-Q29 VanDerWaalsContact C-N 3.34Å; Q27-Q29 PolarHBondContact O-N 2.92Å; Q27-N30 PolarHBondContact O-N 3.21Å; Q27-H31 PolarHBondContact O-CD2 2.89Å; Q27-H31 VanDerWaalsContact O-CD2 3.29Å; Q27-H31 PolarHBondContact O-N 3.01Å |
| 28 | N | 43.6 | Very low | 46.4 | Very low | 103 Ų | 103 | 104.5 Ų | 104.5 | 55% | 0.551 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.8 | -36.1 | 174.4 | -94.2 | -8.3 | 0 | 0 | 0 | 112.7 | S24 T32 | S24-N28 WeakPolarHBondContact O-CB 3.49Å; S24-N28 PolarHBondContact O-N 3.18Å; S24-N28 VanDerWaalsContact O-N 3.1Å; N28-T32 WeakPolarHBondContact O-CB 3.26Å; N28-T32 VanDerWaalsContact O-CG2 3.3Å; N28-T32 WeakPolarHBondContact O-CG2 3.46Å; N28-T32 PolarHBondContact O-N 3.38Å; N28-T32 PolarHBondContact O-OG1 3.13Å |
| 29 | Q | 46.2 | Very low | 49.2 | Very low | 123 Ų | 123 | 108.5 Ų | 108.5 | 58% | 0.575 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -66.8 | -40.3 | 174.3 | -78.9 | -179.5 | -5.3 | 0 | 0 | 111.8 | N25 T26 Q27 T32 C33 | N25-Q29 WeakPolarHBondContact O-CB 3.43Å; N25-Q29 WeakPolarHBondContact O-CG 3.41Å; N25-Q29 PolarHBondContact O-N 2.84Å; T26-Q29 PolarHBondContact O-N 3.3Å; Q27-Q29 VanDerWaalsContact C-N 3.34Å; Q27-Q29 PolarHBondContact O-N 2.92Å; Q29-T32 WeakPolarHBondContact CA-OG1 3.5Å; Q29-T32 PolarHBondContact O-OG1 3.3Å; Q29-C33 WeakPolarHBondContact O-CB 3.27Å; Q29-C33 PolarHBondContact O-N 3.17Å |
| 30 | N | 48.3 | Very low | 52.1 | Low | 103 Ų | 103 | 103.5 Ų | 103.5 | 55% | 0.551 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.6 | -45.5 | 176 | -74.4 | -2.5 | 0 | 0 | 0 | 111.4 | T26 Q27 C33 I34 | T26-N30 WeakPolarHBondContact O-CB 3.32Å; T26-N30 VanDerWaalsContact O-CG 3.3Å; T26-N30 PolarHBondContact O-N 3.11Å; Q27-N30 PolarHBondContact O-N 3.21Å; N30-C33 PolarHBondContact O-N 2.95Å; N30-I34 WeakPolarHBondContact O-CD1 3.45Å; N30-I34 VanDerWaalsContact O-CG1 3.24Å; N30-I34 WeakPolarHBondContact O-CG1 3.44Å; N30-I34 PolarHBondContact O-N 2.97Å; N30-I34 VanDerWaalsContact O-N 3.16Å |
| 31 | H | 51.4 | Low | 54.9 | Low | 120 Ų | 120 | 96 Ų | 96 | 56% | 0.556 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -62.6 | -47.3 | 178.1 | -86.3 | -103.9 | 0 | 0 | 0 | 112.1 | Q27 C33 I34 D35 | Q27-H31 PolarHBondContact O-CD2 2.89Å; Q27-H31 VanDerWaalsContact O-CD2 3.29Å; Q27-H31 PolarHBondContact O-N 3.01Å; H31-C33 VanDerWaalsContact C-N 3.27Å; H31-C33 PolarHBondContact O-N 3.47Å; H31-I34 PolarHBondContact O-N 2.69Å; H31-D35 PolarHBondContact O-N 3.47Å |
| 32 | T | 56.4 | Low | 57.7 | Low | 99 Ų | 99 | 94.2 Ų | 94.2 | 61% | 0.607 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -65.7 | -29.6 | 178.9 | 51.5 | 0 | 0 | 0 | 0 | 113.3 | N28 Q29 | N28-T32 WeakPolarHBondContact O-CB 3.26Å; N28-T32 VanDerWaalsContact O-CG2 3.3Å; N28-T32 WeakPolarHBondContact O-CG2 3.46Å; N28-T32 PolarHBondContact O-N 3.38Å; N28-T32 PolarHBondContact O-OG1 3.13Å; Q29-T32 WeakPolarHBondContact CA-OG1 3.5Å; Q29-T32 PolarHBondContact O-OG1 3.3Å |
| 33 | C | 62.6 | Low | 60.6 | Low | 15 Ų | 15 | 92.2 Ų | 92.2 | 10% | 0.101 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -71.8 | -41.5 | 178.1 | -179.7 | 0 | 0 | 0 | 0 | 112.5 | Q29 N30 H31 C383 T387 | Q29-C33 WeakPolarHBondContact O-CB 3.27Å; Q29-C33 PolarHBondContact O-N 3.17Å; N30-C33 PolarHBondContact O-N 2.95Å; H31-C33 VanDerWaalsContact C-N 3.27Å; H31-C33 PolarHBondContact O-N 3.47Å; C33-C383 HydrophobicContact CB-CB 4.03Å; C33-C383 WeakPolarHBondContact CB-SG 3.25Å; C33-C383 VanDerWaalsContact SG-C 3.55Å; C33-C383 WeakPolarHBondContact SG-CA 3.2Å; C33-C383 WeakPolarHBondContact SG-CB 3.41Å; C33-C383 PolarHBondContact SG-O 3.33Å; C33-C383 CovalentContact SG-SG 2.02Å; C33-C383 PolarHBondContact SG-SG 2.81Å; C33-T387 HydrophobicContact CB-CG2 4.49Å; C33-T387 WeakPolarHBondContact SG-CG2 3.48Å |
| 34 | I | 59.2 | Low | 63.3 | Low | 77 Ų | 77 | 87.3 Ų | 87.3 | 40% | 0.395 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -69.5 | -35.3 | -175.6 | -66.2 | 161.7 | 0 | 0 | 0 | 111.6 | N30 H31 H36 F37 Q38 T387 | N30-I34 WeakPolarHBondContact O-CD1 3.45Å; N30-I34 VanDerWaalsContact O-CG1 3.24Å; N30-I34 WeakPolarHBondContact O-CG1 3.44Å; N30-I34 PolarHBondContact O-N 2.97Å; N30-I34 VanDerWaalsContact O-N 3.16Å; H31-I34 PolarHBondContact O-N 2.69Å; I34-H36 PolarHBondContact O-N 2.97Å; I34-H36 VanDerWaalsContact O-N 3.09Å; I34-F37 PolarHBondContact O-N 3.17Å; I34-F37 VanDerWaalsContact O-N 3.12Å; I34-Q38 PolarHBondContact O-N 3.22Å; I34-T387 HydrophobicContact CG1-CG2 4.4Å |
| 35 | D | 61 | Low | 65.9 | Low | 98 Ų | 98 | 89 Ų | 89 | 52% | 0.524 | 44% | 0.437 | S | S | . | . | G | 310 helix | trans | -60.2 | -26.4 | -173.9 | -75.6 | -21.6 | 0 | 0 | 0 | 113.7 | H31 Q38 | H31-D35 PolarHBondContact O-N 3.47Å; D35-Q38 PolarHBondContact OD1-NE2 2.96Å |
| 36 | H | 67.3 | Low | 68.5 | Low | 144 Ų | 144 | 89.1 Ų | 89.1 | 67% | 0.667 | 44% | 0.438 | S | S | * | . | G | 310 helix | trans | -77.7 | -22.9 | -179.6 | -160.4 | 69.2 | 0 | 0 | 0 | 114.1 | I34 | I34-H36 PolarHBondContact O-N 2.97Å; I34-H36 VanDerWaalsContact O-N 3.09Å |
| 37 | F | 77.9 | Confident | 71.1 | Confident | 64 Ų | 64 | 86.8 Ų | 86.8 | 28% | 0.281 | 42% | 0.421 | S | S | . | . | G | 310 helix | trans | -126.8 | 30.6 | -171.9 | -60.8 | -74.5 | 0 | 0 | 0 | 113.5 | I34 W39 L40 E41 V388 | I34-F37 PolarHBondContact O-N 3.17Å; I34-F37 VanDerWaalsContact O-N 3.12Å; F37-W39 PolarHBondContact O-N 2.95Å; F37-W39 VanDerWaalsContact O-N 3.15Å; F37-L40 HydrophobicContact CB-CB 4.32Å; F37-L40 WeakPolarHBondContact O-CB 3.2Å; F37-L40 PolarHBondContact O-N 3.04Å; F37-E41 PolarHBondContact O-N 2.82Å; F37-V388 HydrophobicContact CD1-CG2 4.33Å; F37-V388 HydrophobicContact CD2-CG2 4.15Å; F37-V388 HydrophobicContact CE1-CG2 4.27Å; F37-V388 HydrophobicContact CE2-CG2 4.07Å; F37-V388 HydrophobicContact CG-CG2 4.27Å; F37-V388 HydrophobicContact CZ-CG2 4.12Å |
| 38 | Q | 80.7 | Confident | 73.4 | Confident | 117 Ų | 117 | 83.7 Ų | 83.7 | 55% | 0.547 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -53.9 | -36.2 | -179.1 | -67.4 | -178.4 | -12.1 | 0 | 0 | 113.8 | I34 D35 L40 E41 L42 | I34-Q38 PolarHBondContact O-N 3.22Å; D35-Q38 PolarHBondContact OD1-NE2 2.96Å; Q38-L40 VanDerWaalsContact C-N 3.26Å; Q38-L40 PolarHBondContact O-N 2.88Å; Q38-E41 WeakPolarHBondContact O-CB 3.39Å; Q38-E41 PolarHBondContact O-N 2.82Å; Q38-L42 PolarHBondContact O-N 3.08Å |
| 39 | W | 86 | Confident | 75.5 | Confident | 171 Ų | 171 | 81.9 Ų | 81.9 | 65% | 0.648 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -64 | -33 | 177.1 | 70.3 | -93.5 | 0 | 0 | 0 | 112.4 | F37 L42 F43 | F37-W39 PolarHBondContact O-N 2.95Å; F37-W39 VanDerWaalsContact O-N 3.15Å; W39-L42 PolarHBondContact O-N 3.47Å; W39-F43 PolarHBondContact O-N 3.44Å |
| 40 | L | 87.2 | Confident | 77.7 | Confident | 2 Ų | 2 | 80.3 Ų | 80.3 | 1% | 0.01 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -77.2 | -36.3 | -179 | -176.2 | 58.1 | 0 | 0 | 0 | 110.9 | F37 Q38 L42 F43 H44 T387 V388 R391 L392 | F37-L40 HydrophobicContact CB-CB 4.32Å; F37-L40 WeakPolarHBondContact O-CB 3.2Å; F37-L40 PolarHBondContact O-N 3.04Å; Q38-L40 VanDerWaalsContact C-N 3.26Å; Q38-L40 PolarHBondContact O-N 2.88Å; L40-L42 VanDerWaalsContact C-N 3.35Å; L40-F43 HydrophobicContact CD1-CD1 4.13Å; L40-F43 PolarHBondContact O-N 2.82Å; L40-H44 WeakPolarHBondContact O-CB 3.28Å; L40-H44 PolarHBondContact O-N 2.97Å; L40-T387 WeakPolarHBondContact CD2-O 3.31Å; L40-V388 HydrophobicContact CD2-CB 4.26Å; L40-V388 HydrophobicContact CD2-CG1 4.17Å; L40-V388 HydrophobicContact CD2-CG2 4.15Å; L40-R391 HydrophobicContact CD2-CB 4.37Å; L40-R391 HydrophobicContact CG-CB 4.03Å; L40-L392 HydrophobicContact CD1-CD1 4.48Å; L40-L392 HydrophobicContact CD1-CD2 3.52Å; L40-L392 HydrophobicContact CD1-CG 3.8Å; L40-L392 HydrophobicContact CD2-CD1 4.24Å; L40-L392 HydrophobicContact CD2-CG 4.1Å |
| 41 | E | 85 | Confident | 79.9 | Confident | 38 Ų | 38 | 75.5 Ų | 75.5 | 18% | 0.178 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -58.9 | -47.2 | 168.9 | -176.4 | 62.2 | -150.2 | 0 | 0 | 110.8 | F37 Q38 F43 H44 Q45 R391 | F37-E41 PolarHBondContact O-N 2.82Å; Q38-E41 WeakPolarHBondContact O-CB 3.39Å; Q38-E41 PolarHBondContact O-N 2.82Å; E41-F43 VanDerWaalsContact C-N 3.35Å; E41-F43 PolarHBondContact O-N 3.5Å; E41-H44 PolarHBondContact O-N 2.86Å; E41-Q45 VanDerWaalsContact O-CG 3.31Å; E41-Q45 WeakPolarHBondContact O-CG 3.42Å; E41-Q45 PolarHBondContact O-N 2.97Å; E41-Q45 PolarHBondContact OE1-NE2 3.19Å; E41-R391 IonicContact OE1-CZ 3.66Å; E41-R391 IonicContact OE1-NH1 2.97Å; E41-R391 IonicContact OE1-NH2 3.57Å; E41-R391 PolarHBondContact OE1-NH2 2.99Å; E41-R391 IonicContact OE2-CZ 2.73Å; E41-R391 IonicContact OE2-NE 2.98Å; E41-R391 PolarHBondContact OE2-NE 2.86Å; E41-R391 IonicContact OE2-NH1 3.36Å; E41-R391 IonicContact OE2-NH2 2.81Å; E41-R391 PolarHBondContact OE2-NH2 3.39Å |
| 42 | L | 88.4 | Confident | 81.9 | Confident | 98 Ų | 98 | 70.1 Ų | 70.1 | 51% | 0.513 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -62 | -41.7 | 176.7 | -177.2 | 65.7 | 0 | 0 | 0 | 112.1 | Q38 W39 L40 Q45 N46 | Q38-L42 PolarHBondContact O-N 3.08Å; W39-L42 PolarHBondContact O-N 3.47Å; L40-L42 VanDerWaalsContact C-N 3.35Å; L42-Q45 PolarHBondContact O-N 2.88Å; L42-N46 WeakPolarHBondContact O-CB 3.23Å; L42-N46 PolarHBondContact O-N 3.29Å; L42-N46 VanDerWaalsContact O-N 3.11Å; L42-N46 PolarHBondContact O-ND2 2.95Å |
| 43 | F | 92.4 | Very high | 83.7 | Confident | 69 Ų | 69 | 72.1 Ų | 72.1 | 30% | 0.303 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -59.2 | -49.4 | 174.1 | 170.1 | -97.3 | 0 | 0 | 0 | 111.2 | W39 L40 E41 Q45 N46 Y47 F395 | W39-F43 PolarHBondContact O-N 3.44Å; L40-F43 HydrophobicContact CD1-CD1 4.13Å; L40-F43 PolarHBondContact O-N 2.82Å; E41-F43 VanDerWaalsContact C-N 3.35Å; E41-F43 PolarHBondContact O-N 3.5Å; F43-Q45 PolarHBondContact O-N 2.94Å; F43-N46 PolarHBondContact O-N 3.25Å; F43-Y47 HydrophobicContact CE1-CG 4.33Å; F43-Y47 HydrophobicContact CZ-CD2 4.28Å; F43-Y47 HydrophobicContact CZ-CG 4.06Å; F43-Y47 WeakPolarHBondContact O-CB 3.44Å; F43-Y47 PolarHBondContact O-N 3.2Å; F43-F395 HydrophobicContact CE1-CB 4.07Å; F43-F395 HydrophobicContact CE1-CG 4.21Å; F43-F395 HydrophobicContact CZ-CB 4.21Å; F43-F395 AromaticContact CZ-CD2 3.86Å; F43-F395 HydrophobicContact CZ-CD2 3.86Å; F43-F395 HydrophobicContact CZ-CE2 4.39Å; F43-F395 AromaticContact CZ-CG 3.93Å; F43-F395 HydrophobicContact CZ-CG 3.93Å |
| 44 | H | 89.5 | Confident | 85.3 | Confident | 24 Ų | 24 | 74.5 Ų | 74.5 | 11% | 0.111 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -60.5 | -45.9 | 179.7 | 172.9 | 80.1 | 0 | 0 | 0 | 111.9 | L40 E41 N46 Y47 Q48 R391 | L40-H44 WeakPolarHBondContact O-CB 3.28Å; L40-H44 PolarHBondContact O-N 2.97Å; E41-H44 PolarHBondContact O-N 2.86Å; H44-N46 VanDerWaalsContact C-N 3.28Å; H44-N46 PolarHBondContact O-N 3.32Å; H44-Y47 PolarHBondContact O-N 2.92Å; H44-Q48 VanDerWaalsContact O-CB 3.25Å; H44-Q48 WeakPolarHBondContact O-CB 3.48Å; H44-Q48 PolarHBondContact O-N 3.17Å; H44-R391 HydrophobicContact CB-CB 3.96Å; H44-R391 HydrophobicContact CB-CG 4.41Å; H44-R391 PolarHBondContact CD2-NH1 2.9Å; H44-R391 PolarHBondContact ND1-O 3.29Å; H44-R391 PolarHBondContact NE2-NH1 2.79Å |
| 45 | Q | 88 | Confident | 87.1 | Confident | 108 Ų | 108 | 70.9 Ų | 70.9 | 51% | 0.505 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -60.2 | -37.7 | 178.4 | -72.1 | 176.3 | 10.7 | 0 | 0 | 112.6 | E41 L42 F43 P49 | E41-Q45 VanDerWaalsContact O-CG 3.31Å; E41-Q45 WeakPolarHBondContact O-CG 3.42Å; E41-Q45 PolarHBondContact O-N 2.97Å; E41-Q45 PolarHBondContact OE1-NE2 3.19Å; L42-Q45 PolarHBondContact O-N 2.88Å; F43-Q45 PolarHBondContact O-N 2.94Å; Q45-P49 WeakPolarHBondContact O-CD 3.47Å |
| 46 | N | 90.9 | Very high | 88.8 | Confident | 100 Ų | 100 | 68 Ų | 68 | 54% | 0.535 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -77.1 | -34.5 | 176.9 | -70.6 | -21.6 | 0 | 0 | 0 | 112.7 | L42 F43 H44 I50 | L42-N46 WeakPolarHBondContact O-CB 3.23Å; L42-N46 PolarHBondContact O-N 3.29Å; L42-N46 VanDerWaalsContact O-N 3.11Å; L42-N46 PolarHBondContact O-ND2 2.95Å; F43-N46 PolarHBondContact O-N 3.25Å; H44-N46 VanDerWaalsContact C-N 3.28Å; H44-N46 PolarHBondContact O-N 3.32Å; N46-I50 VanDerWaalsContact O-CD1 3.29Å; N46-I50 WeakPolarHBondContact O-CD1 3.29Å; N46-I50 WeakPolarHBondContact O-CG1 3.41Å |
| 47 | Y | 92.3 | Very high | 90.1 | Very high | 21 Ų | 21 | 66.5 Ų | 66.5 | 8% | 0.082 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -81.5 | -41.1 | -174.6 | 179.6 | -103.5 | 0 | 0 | 0 | 112.9 | F43 H44 I50 H51 L54 D394 F395 F398 | F43-Y47 HydrophobicContact CE1-CG 4.33Å; F43-Y47 HydrophobicContact CZ-CD2 4.28Å; F43-Y47 HydrophobicContact CZ-CG 4.06Å; F43-Y47 WeakPolarHBondContact O-CB 3.44Å; F43-Y47 PolarHBondContact O-N 3.2Å; H44-Y47 PolarHBondContact O-N 2.92Å; Y47-I50 CarbonylContact O-C 2.84Å; Y47-I50 WeakPolarHBondContact O-CA 3.44Å; Y47-I50 PolarHBondContact O-N 2.85Å; Y47-H51 HydrophobicContact CD1-CB 4.09Å; Y47-H51 HydrophobicContact CE1-CB 3.6Å; Y47-H51 AromaticContact CE1-CG 3.8Å; Y47-H51 AromaticContact CE1-ND1 3.46Å; Y47-H51 WeakPolarHBondContact CE1-ND1 3.4Å; Y47-H51 AromaticContact CZ-ND1 3.55Å; Y47-H51 PolarHBondContact O-N 3.24Å; Y47-H51 PolarHBondContact OH-ND1 3.37Å; Y47-L54 HydrophobicContact CE2-CD1 4.48Å; Y47-D394 HydrophobicContact CD1-CB 4.45Å; Y47-D394 HydrophobicContact CE1-CB 4.02Å; Y47-F395 HydrophobicContact CD1-CB 4.21Å; Y47-F395 HydrophobicContact CE1-CB 3.81Å; Y47-F395 HydrophobicContact CE1-CD2 4.35Å; Y47-F395 AromaticContact CE2-CD2 4Å; Y47-F395 HydrophobicContact CE2-CD2 4Å; Y47-F395 AromaticContact CZ-CD2 3.92Å; Y47-F398 WeakPolarHBondContact OH-CB 3.49Å; Y47-F398 WeakPolarHBondContact OH-CD1 3.4Å; Y47-F398 WeakPolarHBondContact OH-CG 3.49Å |
| 48 | Q | 87.5 | Confident | 91 | Very high | 63 Ų | 63 | 65.3 Ų | 65.3 | 29% | 0.294 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -54.4 | -44.3 | -173 | -169.3 | -73.6 | -38.3 | 0 | 0 | 113.2 | H44 I50 H51 | H44-Q48 VanDerWaalsContact O-CB 3.25Å; H44-Q48 WeakPolarHBondContact O-CB 3.48Å; H44-Q48 PolarHBondContact O-N 3.17Å; Q48-I50 VanDerWaalsContact C-N 3.3Å; Q48-I50 PolarHBondContact O-N 3.4Å; Q48-H51 PolarHBondContact O-N 3.04Å |
| 49 | P | 87.9 | Confident | 91.9 | Very high | 65 Ų | 65 | 59.8 Ų | 59.8 | 42% | 0.422 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -65.4 | -34.1 | 176.4 | -21.7 | 34.1 | 0 | 0 | 0 | 113 | Q45 Y53 | Q45-P49 WeakPolarHBondContact O-CD 3.47Å; P49-Y53 WeakPolarHBondContact O-CD2 3.44Å; P49-Y53 WeakPolarHBondContact O-CE2 3.48Å |
| 50 | I | 92.5 | Very high | 92.4 | Very high | 90 Ų | 90 | 54 Ų | 54 | 46% | 0.462 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -79 | -36.1 | -176.8 | -57.1 | 173.7 | 0 | 0 | 0 | 110.7 | N46 Y47 Q48 V52 Y53 L54 | N46-I50 VanDerWaalsContact O-CD1 3.29Å; N46-I50 WeakPolarHBondContact O-CD1 3.29Å; N46-I50 WeakPolarHBondContact O-CG1 3.41Å; Y47-I50 CarbonylContact O-C 2.84Å; Y47-I50 WeakPolarHBondContact O-CA 3.44Å; Y47-I50 PolarHBondContact O-N 2.85Å; Q48-I50 VanDerWaalsContact C-N 3.3Å; Q48-I50 PolarHBondContact O-N 3.4Å; I50-V52 VanDerWaalsContact C-N 3.29Å; I50-V52 PolarHBondContact O-N 2.86Å; I50-Y53 PolarHBondContact O-N 3.4Å; I50-Y53 VanDerWaalsContact O-N 3.14Å; I50-L54 HydrophobicContact CG2-CD1 3.74Å; I50-L54 HydrophobicContact CG2-CG 3.88Å; I50-L54 WeakPolarHBondContact O-CG 3.4Å; I50-L54 PolarHBondContact O-N 3.07Å |
| 51 | H | 94.1 | Very high | 92.9 | Very high | 3 Ų | 3 | 58.9 Ų | 58.9 | 1% | 0.014 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -48.3 | -50.6 | -179.3 | 174.7 | 78.7 | 0 | 0 | 0 | 111.8 | Y47 Q48 Y53 L54 C55 D394 | Y47-H51 HydrophobicContact CD1-CB 4.09Å; Y47-H51 HydrophobicContact CE1-CB 3.6Å; Y47-H51 AromaticContact CE1-CG 3.8Å; Y47-H51 AromaticContact CE1-ND1 3.46Å; Y47-H51 WeakPolarHBondContact CE1-ND1 3.4Å; Y47-H51 AromaticContact CZ-ND1 3.55Å; Y47-H51 PolarHBondContact O-N 3.24Å; Y47-H51 PolarHBondContact OH-ND1 3.37Å; Q48-H51 PolarHBondContact O-N 3.04Å; H51-Y53 VanDerWaalsContact C-N 3.34Å; H51-Y53 PolarHBondContact O-N 2.89Å; H51-L54 PolarHBondContact O-N 3.28Å; H51-C55 PolarHBondContact CE1-SG 3.45Å; H51-C55 PolarHBondContact O-N 3.39Å; H51-C55 PolarHBondContact O-SG 2.67Å; H51-C55 VanDerWaalsContact O-SG 3.35Å; H51-D394 PolarHBondContact CE1-O 3.4Å; H51-D394 PolarHBondContact ND1-O 3.12Å |
| 52 | V | 93.2 | Very high | 93.6 | Very high | 7 Ų | 7 | 57.2 Ų | 57.2 | 4% | 0.042 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -57.4 | -45.7 | -177.5 | -173.7 | 0 | 0 | 0 | 0 | 111.6 | I50 L56 D104 L108 M109 | I50-V52 VanDerWaalsContact C-N 3.29Å; I50-V52 PolarHBondContact O-N 2.86Å; V52-L56 HydrophobicContact CG1-CD1 4Å; V52-L56 WeakPolarHBondContact O-CB 3.48Å; V52-L56 VanDerWaalsContact O-CG 3.25Å; V52-L56 WeakPolarHBondContact O-CG 3.43Å; V52-L56 PolarHBondContact O-N 2.98Å; V52-D104 HydrophobicContact CG1-CB 4.48Å; V52-L108 HydrophobicContact CG1-CB 4.17Å; V52-L108 HydrophobicContact CG2-CB 3.58Å; V52-L108 HydrophobicContact CG2-CD1 4.08Å; V52-L108 HydrophobicContact CG2-CG 4.45Å; V52-M109 HydrophobicContact CG1-CB 4.01Å |
| 53 | Y | 95.2 | Very high | 94 | Very high | 140 Ų | 140 | 54 Ų | 54 | 55% | 0.549 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -69.9 | -39.1 | 179.6 | -62.4 | -75.4 | 0 | 0 | 0 | 112.3 | P49 I50 H51 L56 I57 M109 | P49-Y53 WeakPolarHBondContact O-CD2 3.44Å; P49-Y53 WeakPolarHBondContact O-CE2 3.48Å; I50-Y53 PolarHBondContact O-N 3.4Å; I50-Y53 VanDerWaalsContact O-N 3.14Å; H51-Y53 VanDerWaalsContact C-N 3.34Å; H51-Y53 PolarHBondContact O-N 2.89Å; Y53-L56 PolarHBondContact O-N 3.13Å; Y53-I57 WeakPolarHBondContact O-CG1 3.31Å; Y53-I57 PolarHBondContact O-N 3.47Å; Y53-I57 VanDerWaalsContact O-N 3.17Å; Y53-M109 HydrophobicContact CD1-CE 4.25Å; Y53-M109 HydrophobicContact CE1-CE 3.68Å; Y53-M109 HydrophobicContact CE1-SD 4.2Å |
| 54 | L | 95.9 | Very high | 94.3 | Very high | 66 Ų | 66 | 55.9 Ų | 55.9 | 35% | 0.346 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -62.4 | -46.2 | 176.8 | -69.2 | 176.9 | 0 | 0 | 0 | 111.2 | Y47 I50 H51 I57 L58 F398 | Y47-L54 HydrophobicContact CE2-CD1 4.48Å; I50-L54 HydrophobicContact CG2-CD1 3.74Å; I50-L54 HydrophobicContact CG2-CG 3.88Å; I50-L54 WeakPolarHBondContact O-CG 3.4Å; I50-L54 PolarHBondContact O-N 3.07Å; H51-L54 PolarHBondContact O-N 3.28Å; L54-I57 PolarHBondContact O-N 3.12Å; L54-L58 WeakPolarHBondContact O-CB 3.32Å; L54-L58 PolarHBondContact O-N 3.08Å; L54-F398 HydrophobicContact CB-CD2 4.36Å; L54-F398 HydrophobicContact CB-CE2 3.7Å; L54-F398 HydrophobicContact CB-CZ 4.15Å; L54-F398 HydrophobicContact CD1-CE1 4.42Å; L54-F398 HydrophobicContact CD1-CE2 4.3Å; L54-F398 HydrophobicContact CD1-CZ 4Å |
| 55 | C | 96.5 | Very high | 94.7 | Very high | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -66.7 | -41.8 | 178.7 | -65.8 | 0 | 0 | 0 | 0 | 111.9 | H51 I57 L58 C59 D104 L401 | H51-C55 PolarHBondContact CE1-SG 3.45Å; H51-C55 PolarHBondContact O-N 3.39Å; H51-C55 PolarHBondContact O-SG 2.67Å; H51-C55 VanDerWaalsContact O-SG 3.35Å; C55-I57 PolarHBondContact O-N 3.07Å; C55-L58 PolarHBondContact O-N 3.29Å; C55-C59 VanDerWaalsContact O-CB 3.23Å; C55-C59 WeakPolarHBondContact O-CB 3.37Å; C55-C59 PolarHBondContact O-N 2.93Å; C55-C59 PolarHBondContact O-SG 3.41Å; C55-C59 VanDerWaalsContact O-SG 3.32Å; C55-D104 WeakPolarHBondContact CB-OD2 3.17Å; C55-L401 HydrophobicContact CB-CD1 4.4Å |
| 56 | L | 95.7 | Very high | 95.1 | Very high | 38 Ų | 38 | 50.3 Ų | 50.3 | 20% | 0.199 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.8 | -19.3 | 176.9 | -73.5 | 177.4 | 0 | 0 | 0 | 114.1 | V52 Y53 P60 I101 D104 M109 | V52-L56 HydrophobicContact CG1-CD1 4Å; V52-L56 WeakPolarHBondContact O-CB 3.48Å; V52-L56 VanDerWaalsContact O-CG 3.25Å; V52-L56 WeakPolarHBondContact O-CG 3.43Å; V52-L56 PolarHBondContact O-N 2.98Å; Y53-L56 PolarHBondContact O-N 3.13Å; L56-P60 WeakPolarHBondContact O-CD 3.47Å; L56-P60 WeakPolarHBondContact O-CG 3.41Å; L56-I101 HydrophobicContact CD2-CG2 4.25Å; L56-D104 HydrophobicContact CD2-CB 3.96Å; L56-D104 HydrophobicContact CG-CB 4.18Å; L56-M109 HydrophobicContact CD1-CE 4Å |
| 57 | I | 96 | Very high | 95.4 | Very high | 112 Ų | 112 | 49 Ų | 49 | 57% | 0.574 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -89.2 | -46.2 | 170.6 | -66.5 | 169.1 | 0 | 0 | 0 | 110.7 | Y53 L54 C55 P60 I61 | Y53-I57 WeakPolarHBondContact O-CG1 3.31Å; Y53-I57 PolarHBondContact O-N 3.47Å; Y53-I57 VanDerWaalsContact O-N 3.17Å; L54-I57 PolarHBondContact O-N 3.12Å; C55-I57 PolarHBondContact O-N 3.07Å; I57-P60 WeakPolarHBondContact O-CD 3.47Å; I57-I61 HydrophobicContact CG2-CD1 4.08Å; I57-I61 WeakPolarHBondContact O-CD1 3.44Å; I57-I61 WeakPolarHBondContact O-CG1 3.43Å |
| 58 | L | 97.1 | Very high | 95.6 | Very high | 40 Ų | 40 | 50 Ų | 50 | 21% | 0.209 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -66.2 | -45.3 | -175.5 | 179.3 | 67.9 | 0 | 0 | 0 | 112.3 | L54 C55 I61 G62 M97 F398 L401 I402 | L54-L58 WeakPolarHBondContact O-CB 3.32Å; L54-L58 PolarHBondContact O-N 3.08Å; C55-L58 PolarHBondContact O-N 3.29Å; L58-I61 PolarHBondContact O-N 2.93Å; L58-G62 PolarHBondContact O-N 3.02Å; L58-M97 HydrophobicContact CG-CE 4.08Å; L58-F398 HydrophobicContact CD2-CD2 4.14Å; L58-F398 HydrophobicContact CD2-CE2 3.77Å; L58-L401 HydrophobicContact CD2-CB 3.97Å; L58-I402 HydrophobicContact CD2-CB 4.48Å; L58-I402 HydrophobicContact CD2-CG1 3.64Å |
| 59 | C | 98.1 | Very high | 95.9 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.4 | -46.6 | -173.9 | -69.8 | 0 | 0 | 0 | 0 | 113 | C55 I61 G62 V63 M97 I101 | C55-C59 VanDerWaalsContact O-CB 3.23Å; C55-C59 WeakPolarHBondContact O-CB 3.37Å; C55-C59 PolarHBondContact O-N 2.93Å; C55-C59 PolarHBondContact O-SG 3.41Å; C55-C59 VanDerWaalsContact O-SG 3.32Å; C59-I61 VanDerWaalsContact C-N 3.34Å; C59-I61 PolarHBondContact O-N 3.29Å; C59-G62 PolarHBondContact O-N 3.02Å; C59-V63 VanDerWaalsContact O-CG2 3.31Å; C59-V63 WeakPolarHBondContact O-CG2 3.39Å; C59-V63 PolarHBondContact O-N 3.44Å; C59-M97 HydrophobicContact CB-CB 4.26Å; C59-I101 HydrophobicContact CB-CD1 3.98Å; C59-I101 HydrophobicContact CB-CG1 3.44Å; C59-I101 VanDerWaalsContact CB-CG1 3.44Å |
| 60 | P | 97.8 | Very high | 96.4 | Very high | 50 Ų | 50 | 45.7 Ų | 45.7 | 33% | 0.325 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -58.4 | -42.6 | 173.6 | -26.6 | 35 | 0 | 0 | 0 | 113.4 | L56 I57 G62 V63 I64 I101 | L56-P60 WeakPolarHBondContact O-CD 3.47Å; L56-P60 WeakPolarHBondContact O-CG 3.41Å; I57-P60 WeakPolarHBondContact O-CD 3.47Å; P60-G62 VanDerWaalsContact C-N 3.33Å; P60-G62 PolarHBondContact O-N 2.69Å; P60-V63 PolarHBondContact O-N 3.23Å; P60-I64 WeakPolarHBondContact O-CG1 3.5Å; P60-I64 PolarHBondContact O-N 2.93Å; P60-I64 VanDerWaalsContact O-N 3.08Å; P60-I101 HydrophobicContact CB-CD1 4.46Å; P60-I101 HydrophobicContact CG-CD1 3.85Å; P60-I101 HydrophobicContact CG-CG1 4.33Å |
| 61 | I | 97.9 | Very high | 96.5 | Very high | 105 Ų | 105 | 45.1 Ų | 45.1 | 54% | 0.538 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -62.3 | -43.7 | 176.1 | -64.3 | 170.8 | 0 | 0 | 0 | 110.1 | I57 L58 C59 I64 A65 | I57-I61 HydrophobicContact CG2-CD1 4.08Å; I57-I61 WeakPolarHBondContact O-CD1 3.44Å; I57-I61 WeakPolarHBondContact O-CG1 3.43Å; L58-I61 PolarHBondContact O-N 2.93Å; C59-I61 VanDerWaalsContact C-N 3.34Å; C59-I61 PolarHBondContact O-N 3.29Å; I61-I64 PolarHBondContact O-N 3.34Å; I61-A65 WeakPolarHBondContact O-CB 3.42Å; I61-A65 PolarHBondContact O-N 3.42Å |
| 62 | G | 97.9 | Very high | 96.6 | Very high | 2 Ų | 2 | 45 Ų | 45 | 2% | 0.021 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -65.4 | -37.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | L58 C59 P60 A65 N66 | L58-G62 PolarHBondContact O-N 3.02Å; C59-G62 PolarHBondContact O-N 3.02Å; P60-G62 VanDerWaalsContact C-N 3.33Å; P60-G62 PolarHBondContact O-N 2.69Å; G62-A65 PolarHBondContact O-N 3.16Å; G62-N66 WeakPolarHBondContact O-CB 3.26Å; G62-N66 PolarHBondContact O-N 2.66Å; G62-N66 PolarHBondContact O-ND2 3.22Å; G62-N66 VanDerWaalsContact O-ND2 3.09Å |
| 63 | V | 98.5 | Very high | 96.6 | Very high | 32 Ų | 32 | 45 Ų | 45 | 19% | 0.194 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.6 | -45.9 | 172.8 | 171.8 | 0 | 0 | 0 | 0 | 110.5 | C59 P60 N66 T67 M97 F98 I101 | C59-V63 VanDerWaalsContact O-CG2 3.31Å; C59-V63 WeakPolarHBondContact O-CG2 3.39Å; C59-V63 PolarHBondContact O-N 3.44Å; P60-V63 PolarHBondContact O-N 3.23Å; V63-N66 PolarHBondContact O-N 3.2Å; V63-T67 WeakPolarHBondContact O-CB 3.39Å; V63-T67 PolarHBondContact O-N 3.3Å; V63-T67 PolarHBondContact O-OG1 2.88Å; V63-M97 HydrophobicContact CG2-CB 3.89Å; V63-F98 HydrophobicContact CG2-CB 4.03Å; V63-I101 HydrophobicContact CG2-CD1 4.32Å |
| 64 | I | 97.7 | Very high | 96.6 | Very high | 107 Ų | 107 | 42.2 Ų | 42.2 | 55% | 0.549 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61.8 | -47.9 | 176.5 | -66 | 165.8 | 0 | 0 | 0 | 110.2 | P60 I61 N66 T67 L68 | P60-I64 WeakPolarHBondContact O-CG1 3.5Å; P60-I64 PolarHBondContact O-N 2.93Å; P60-I64 VanDerWaalsContact O-N 3.08Å; I61-I64 PolarHBondContact O-N 3.34Å; I64-N66 PolarHBondContact O-N 2.97Å; I64-T67 WeakPolarHBondContact O-CB 3.36Å; I64-T67 PolarHBondContact O-N 2.97Å; I64-T67 VanDerWaalsContact O-N 3.17Å; I64-L68 HydrophobicContact CG2-CD1 4.33Å; I64-L68 WeakPolarHBondContact O-CG 3.4Å; I64-L68 PolarHBondContact O-N 3.39Å |
| 65 | A | 97.2 | Very high | 96.5 | Very high | 13 Ų | 13 | 41.5 Ų | 41.5 | 11% | 0.107 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -59.9 | -43.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | I61 G62 L68 N69 F408 | I61-A65 WeakPolarHBondContact O-CB 3.42Å; I61-A65 PolarHBondContact O-N 3.42Å; G62-A65 PolarHBondContact O-N 3.16Å; A65-L68 PolarHBondContact O-N 3.3Å; A65-N69 PolarHBondContact O-N 3.17Å; A65-F408 HydrophobicContact CB-CB 3.86Å; A65-F408 HydrophobicContact CB-CG 4.34Å |
| 66 | N | 97.6 | Very high | 96.3 | Very high | 2 Ų | 2 | 46.2 Ų | 46.2 | 1% | 0.011 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -70.3 | -32.1 | 176.4 | -81.2 | -53.3 | 0 | 0 | 0 | 112.7 | G62 V63 I64 N69 V70 A90 N404 | G62-N66 WeakPolarHBondContact O-CB 3.26Å; G62-N66 PolarHBondContact O-N 2.66Å; G62-N66 PolarHBondContact O-ND2 3.22Å; G62-N66 VanDerWaalsContact O-ND2 3.09Å; V63-N66 PolarHBondContact O-N 3.2Å; I64-N66 PolarHBondContact O-N 2.97Å; N66-N69 WeakPolarHBondContact O-CB 3.46Å; N66-N69 PolarHBondContact O-N 3.09Å; N66-N69 PolarHBondContact OD1-ND2 3.42Å; N66-V70 WeakPolarHBondContact O-CG2 3.41Å; N66-V70 PolarHBondContact O-N 3.17Å; N66-A90 WeakPolarHBondContact CB-O 3.39Å; N66-N404 PolarHBondContact ND2-O 2.9Å |
| 67 | T | 96.8 | Very high | 95.9 | Very high | 74 Ų | 74 | 49.6 Ų | 49.6 | 45% | 0.454 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -63 | -44.8 | 171.1 | -56.9 | 0 | 0 | 0 | 0 | 111.1 | V63 I64 N69 V70 I71 | V63-T67 WeakPolarHBondContact O-CB 3.39Å; V63-T67 PolarHBondContact O-N 3.3Å; V63-T67 PolarHBondContact O-OG1 2.88Å; I64-T67 WeakPolarHBondContact O-CB 3.36Å; I64-T67 PolarHBondContact O-N 2.97Å; I64-T67 VanDerWaalsContact O-N 3.17Å; T67-N69 VanDerWaalsContact C-N 3.33Å; T67-N69 PolarHBondContact O-N 2.81Å; T67-V70 PolarHBondContact O-N 3.24Å; T67-I71 HydrophobicContact CG2-CD1 4.18Å; T67-I71 WeakPolarHBondContact O-CG1 3.03Å; T67-I71 PolarHBondContact O-N 3.24Å |
| 68 | L | 95.9 | Very high | 95.6 | Very high | 41 Ų | 41 | 44.6 Ų | 44.6 | 22% | 0.215 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.5 | -39.5 | 174.3 | -67.6 | 174.4 | 0 | 0 | 0 | 111.9 | I64 A65 V70 I71 V72 F408 F426 | I64-L68 HydrophobicContact CG2-CD1 4.33Å; I64-L68 WeakPolarHBondContact O-CG 3.4Å; I64-L68 PolarHBondContact O-N 3.39Å; A65-L68 PolarHBondContact O-N 3.3Å; L68-V70 VanDerWaalsContact C-N 3.34Å; L68-V70 PolarHBondContact O-N 3.1Å; L68-I71 PolarHBondContact O-N 2.66Å; L68-V72 VanDerWaalsContact O-CG2 3.3Å; L68-V72 WeakPolarHBondContact O-CG2 3.49Å; L68-V72 PolarHBondContact O-N 3.28Å; L68-F408 HydrophobicContact CB-CD2 3.94Å; L68-F408 HydrophobicContact CB-CE2 3.72Å; L68-F408 HydrophobicContact CD1-CE2 4.18Å; L68-F408 HydrophobicContact CD1-CZ 4.25Å; L68-F426 HydrophobicContact CD2-CE1 4.17Å; L68-F426 HydrophobicContact CD2-CE2 4.13Å; L68-F426 HydrophobicContact CD2-CZ 3.63Å |
| 69 | N | 95.2 | Very high | 95.2 | Very high | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -55.9 | -49 | 173.2 | -78 | -22.5 | 0 | 0 | 0 | 111.7 | A65 N66 T67 I71 V72 L73 A90 F408 Y411 | A65-N69 PolarHBondContact O-N 3.17Å; N66-N69 WeakPolarHBondContact O-CB 3.46Å; N66-N69 PolarHBondContact O-N 3.09Å; N66-N69 PolarHBondContact OD1-ND2 3.42Å; T67-N69 VanDerWaalsContact C-N 3.33Å; T67-N69 PolarHBondContact O-N 2.81Å; N69-I71 PolarHBondContact O-N 3.06Å; N69-V72 PolarHBondContact O-N 3.02Å; N69-L73 HydrophobicContact CB-CD1 4.43Å; N69-L73 VanDerWaalsContact O-CB 3.23Å; N69-L73 WeakPolarHBondContact O-CB 3.49Å; N69-L73 WeakPolarHBondContact O-CG 3.16Å; N69-L73 PolarHBondContact O-N 3.21Å; N69-A90 HydrophobicContact CB-CB 3.78Å; N69-F408 WeakPolarHBondContact ND2-CA 3.43Å; N69-F408 PolarHBondContact ND2-N 3.29Å; N69-F408 WeakPolarHBondContact OD1-CA 3.45Å; N69-F408 WeakPolarHBondContact OD1-CB 3.48Å; N69-F408 WeakPolarHBondContact OD1-CD2 3.5Å; N69-Y411 HydrophobicContact CB-CE2 4.45Å; N69-Y411 VanDerWaalsContact OD1-CD2 3.28Å; N69-Y411 WeakPolarHBondContact OD1-CD2 3.48Å |
| 70 | V | 97 | Very high | 94.8 | Very high | 37 Ų | 37 | 53.4 Ų | 53.4 | 22% | 0.224 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60 | -48.1 | 179.5 | 171.3 | 0 | 0 | 0 | 0 | 110.7 | N66 T67 L68 V72 C74 T87 A90 V91 | N66-V70 WeakPolarHBondContact O-CG2 3.41Å; N66-V70 PolarHBondContact O-N 3.17Å; T67-V70 PolarHBondContact O-N 3.24Å; L68-V70 VanDerWaalsContact C-N 3.34Å; L68-V70 PolarHBondContact O-N 3.1Å; V70-V72 PolarHBondContact O-N 3.2Å; V70-C74 VanDerWaalsContact O-CB 3.22Å; V70-C74 WeakPolarHBondContact O-CB 3.43Å; V70-C74 PolarHBondContact O-N 2.96Å; V70-C74 PolarHBondContact O-SG 2.87Å; V70-T87 HydrophobicContact CB-CG2 4.43Å; V70-T87 HydrophobicContact CG1-CG2 4.01Å; V70-T87 HydrophobicContact CG2-CG2 4.24Å; V70-A90 HydrophobicContact CG2-CB 3.89Å; V70-V91 HydrophobicContact CG1-CG2 4.47Å; V70-V91 HydrophobicContact CG2-CG2 3.62Å |
| 71 | I | 95.8 | Very high | 94.5 | Very high | 79 Ų | 79 | 52 Ų | 52 | 41% | 0.405 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -58.7 | -48.9 | 179.8 | -66.9 | 166.3 | 0 | 0 | 0 | 111 | T67 L68 N69 F426 | T67-I71 HydrophobicContact CG2-CD1 4.18Å; T67-I71 WeakPolarHBondContact O-CG1 3.03Å; T67-I71 PolarHBondContact O-N 3.24Å; L68-I71 PolarHBondContact O-N 2.66Å; N69-I71 PolarHBondContact O-N 3.06Å; I71-F426 HydrophobicContact CG2-CZ 4.15Å |
| 72 | V | 94.8 | Very high | 94.2 | Very high | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -69.6 | -47 | -176.7 | 176.7 | 0 | 0 | 0 | 0 | 111.4 | L68 N69 V70 C74 Q75 L78 F418 T421 F422 L425 F426 | L68-V72 VanDerWaalsContact O-CG2 3.3Å; L68-V72 WeakPolarHBondContact O-CG2 3.49Å; L68-V72 PolarHBondContact O-N 3.28Å; N69-V72 PolarHBondContact O-N 3.02Å; V70-V72 PolarHBondContact O-N 3.2Å; V72-C74 VanDerWaalsContact C-N 3.27Å; V72-C74 PolarHBondContact O-N 2.98Å; V72-Q75 VanDerWaalsContact O-CB 3.27Å; V72-Q75 WeakPolarHBondContact O-CB 3.43Å; V72-Q75 PolarHBondContact O-N 3.45Å; V72-Q75 VanDerWaalsContact O-N 3.15Å; V72-L78 HydrophobicContact CG1-CD1 3.93Å; V72-L78 WeakPolarHBondContact O-CD1 3.41Å; V72-F418 HydrophobicContact CB-CD2 4.19Å; V72-F418 HydrophobicContact CB-CE2 3.58Å; V72-F418 HydrophobicContact CB-CZ 3.78Å; V72-F418 HydrophobicContact CG1-CD1 4.24Å; V72-F418 HydrophobicContact CG1-CD2 3.42Å; V72-F418 VanDerWaalsContact CG1-CD2 3.42Å; V72-F418 HydrophobicContact CG1-CE1 4.15Å; V72-F418 HydrophobicContact CG1-CE2 3.34Å; V72-F418 HydrophobicContact CG1-CG 3.9Å; V72-F418 HydrophobicContact CG1-CZ 3.72Å; V72-F418 HydrophobicContact CG2-CE2 4.38Å; V72-F418 HydrophobicContact CG2-CZ 4.08Å; V72-T421 HydrophobicContact CG1-CG2 3.95Å; V72-F422 HydrophobicContact CG2-CB 4.18Å; V72-F422 HydrophobicContact CG2-CD2 3.87Å; V72-L425 HydrophobicContact CG2-CD1 4.48Å; V72-F426 HydrophobicContact CG2-CE2 4.21Å |
| 73 | L | 93.6 | Very high | 94 | Very high | 8 Ų | 8 | 47.9 Ų | 47.9 | 4% | 0.042 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.8 | -29.4 | -177.3 | -70.3 | 171.3 | 0 | 0 | 0 | 112.8 | N69 Q75 N83 L86 T87 Y411 F418 | N69-L73 HydrophobicContact CB-CD1 4.43Å; N69-L73 VanDerWaalsContact O-CB 3.23Å; N69-L73 WeakPolarHBondContact O-CB 3.49Å; N69-L73 WeakPolarHBondContact O-CG 3.16Å; N69-L73 PolarHBondContact O-N 3.21Å; L73-Q75 PolarHBondContact O-N 2.94Å; L73-N83 HydrophobicContact CD2-CB 4.37Å; L73-L86 HydrophobicContact CD1-CB 4.01Å; L73-T87 WeakPolarHBondContact CB-OG1 3.29Å; L73-Y411 HydrophobicContact CD1-CE2 4.15Å; L73-F418 HydrophobicContact CD2-CD2 4.1Å; L73-F418 HydrophobicContact CD2-CE2 4.25Å; L73-F418 HydrophobicContact CG-CD2 4.49Å; L73-F418 HydrophobicContact CG-CE2 4.16Å |
| 74 | C | 94.8 | Very high | 93.9 | Very high | 80 Ų | 80 | 47.8 Ų | 47.8 | 54% | 0.541 | 25% | 0.25 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -74.4 | -8.6 | 176.4 | -75.1 | 0 | 0 | 0 | 0 | 114.2 | V70 V72 T87 | V70-C74 VanDerWaalsContact O-CB 3.22Å; V70-C74 WeakPolarHBondContact O-CB 3.43Å; V70-C74 PolarHBondContact O-N 2.96Å; V70-C74 PolarHBondContact O-SG 2.87Å; V72-C74 VanDerWaalsContact C-N 3.27Å; V72-C74 PolarHBondContact O-N 2.98Å; C74-T87 VanDerWaalsContact SG-CG2 3.52Å |
| 75 | Q | 94.7 | Very high | 93.8 | Very high | 51 Ų | 51 | 42.7 Ų | 42.7 | 24% | 0.238 | 22% | 0.223 | C | C | . | . | S | Bend | trans | -64.5 | 141.1 | -179.2 | -172.7 | 67.1 | 7.5 | 0 | 0 | 111.6 | V72 L73 R77 L78 R79 T421 | V72-Q75 VanDerWaalsContact O-CB 3.27Å; V72-Q75 WeakPolarHBondContact O-CB 3.43Å; V72-Q75 PolarHBondContact O-N 3.45Å; V72-Q75 VanDerWaalsContact O-N 3.15Å; L73-Q75 PolarHBondContact O-N 2.94Å; Q75-R77 HydrophobicContact CB-CG 4.35Å; Q75-R77 HydrophobicContact CG-CG 3.71Å; Q75-R77 VanDerWaalsContact NE2-NH1 3.18Å; Q75-R77 PolarHBondContact O-N 3.04Å; Q75-L78 PolarHBondContact O-N 3.31Å; Q75-R79 PolarHBondContact O-N 3.4Å; Q75-T421 HydrophobicContact CB-CG2 3.66Å; Q75-T421 HydrophobicContact CG-CG2 3.7Å |
| 76 | P | 91.4 | Very high | 93.7 | Very high | 99 Ų | 99 | 42.1 Ų | 42.1 | 64% | 0.643 | 22% | 0.219 | S | C | * | . | G | 310 helix | trans | -50.6 | -36.9 | -177.9 | -32.7 | 37.5 | 0 | 0 | 0 | 115.6 | L78 R79 | P76-L78 PolarHBondContact O-N 2.94Å; P76-R79 WeakPolarHBondContact O-CB 3.39Å; P76-R79 PolarHBondContact O-N 2.9Å |
| 77 | R | 88.8 | Confident | 93.7 | Very high | 110 Ų | 110 | 42.4 Ų | 42.4 | 42% | 0.415 | 22% | 0.221 | S | C | . | . | G | 310 helix | trans | -66.6 | -19.6 | 178.4 | 59.1 | -177.3 | 62.2 | 98 | -2 | 114.3 | Q75 T421 | Q75-R77 HydrophobicContact CB-CG 4.35Å; Q75-R77 HydrophobicContact CG-CG 3.71Å; Q75-R77 VanDerWaalsContact NE2-NH1 3.18Å; Q75-R77 PolarHBondContact O-N 3.04Å; R77-T421 WeakPolarHBondContact CD-OG1 2.85Å; R77-T421 HydrophobicContact CG-CG2 4.07Å |
| 78 | L | 89 | Confident | 93.8 | Very high | 7 Ų | 7 | 41.1 Ų | 41.1 | 4% | 0.037 | 21% | 0.209 | C | C | . | . | G | 310 helix | trans | -107.5 | 7.6 | 177.7 | -71.9 | 175.3 | 0 | 0 | 0 | 112.5 | V72 Q75 P76 S80 N83 Q417 F418 T421 | V72-L78 HydrophobicContact CG1-CD1 3.93Å; V72-L78 WeakPolarHBondContact O-CD1 3.41Å; Q75-L78 PolarHBondContact O-N 3.31Å; P76-L78 PolarHBondContact O-N 2.94Å; L78-S80 PolarHBondContact O-N 3.32Å; L78-N83 WeakPolarHBondContact O-CB 3.44Å; L78-N83 PolarHBondContact O-ND2 3.11Å; L78-Q417 HydrophobicContact CD2-CB 3.63Å; L78-F418 HydrophobicContact CD1-CD2 4.49Å; L78-T421 HydrophobicContact CD1-CG2 4.08Å |
| 79 | R | 89.1 | Confident | 93.8 | Very high | 190 Ų | 190 | 39.2 Ų | 39.2 | 72% | 0.717 | 20% | 0.199 | S | C | * | . | trans | -67.1 | 99.9 | -177.1 | -169.3 | 173.1 | 179.4 | 143.6 | -1.5 | 110.9 | Q75 P76 M166 | Q75-R79 PolarHBondContact O-N 3.4Å; P76-R79 WeakPolarHBondContact O-CB 3.39Å; P76-R79 PolarHBondContact O-N 2.9Å; R79-M166 HydrophobicContact CG-CE 3.71Å; R79-M166 HydrophobicContact CG-SD 4.48Å | ||
| 80 | S | 89.6 | Confident | 93.9 | Very high | 35 Ų | 35 | 39.2 Ų | 39.2 | 25% | 0.245 | 20% | 0.199 | C | C | . | . | trans | -137.7 | 154.3 | 173.6 | 74.8 | 0 | 0 | 0 | 0 | 109.9 | L78 T82 N83 L84 | L78-S80 PolarHBondContact O-N 3.32Å; S80-T82 PolarHBondContact O-N 3.25Å; S80-N83 PolarHBondContact O-N 2.69Å; S80-N83 VanDerWaalsContact O-N 3.13Å; S80-N83 VanDerWaalsContact OG-CB 3.27Å; S80-N83 WeakPolarHBondContact OG-CB 3.41Å; S80-N83 PolarHBondContact OG-N 3.07Å; S80-N83 VanDerWaalsContact OG-N 3.08Å; S80-N83 PolarHBondContact OG-ND2 2.91Å; S80-L84 PolarHBondContact O-N 3.46Å | ||
| 81 | P | 92.3 | Very high | 94 | Very high | 19 Ų | 19 | 40.4 Ų | 40.4 | 12% | 0.123 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -60.9 | -35.2 | -178.6 | 27.1 | -37.6 | 0 | 0 | 0 | 111.4 | L84 L85 F149 C164 M166 A169 | P81-L84 WeakPolarHBondContact O-CB 3.44Å; P81-L84 PolarHBondContact O-N 3.24Å; P81-L85 WeakPolarHBondContact O-CG 3.45Å; P81-L85 PolarHBondContact O-N 2.97Å; P81-L85 VanDerWaalsContact O-N 3.17Å; P81-F149 HydrophobicContact CB-CD1 4.41Å; P81-F149 HydrophobicContact CB-CE1 4.42Å; P81-C164 HydrophobicContact CG-CB 4.26Å; P81-C164 WeakPolarHBondContact CG-O 3.47Å; P81-M166 VanDerWaalsContact N-CE 3.26Å; P81-A169 HydrophobicContact CB-CB 3.91Å |
| 82 | T | 91.2 | Very high | 94.1 | Very high | 8 Ų | 8 | 36.7 Ų | 36.7 | 5% | 0.049 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -66.9 | -44.5 | 174.9 | -53.7 | 0 | 0 | 0 | 0 | 111.4 | S80 L84 L85 L86 V146 L356 | S80-T82 PolarHBondContact O-N 3.25Å; T82-L84 VanDerWaalsContact C-N 3.28Å; T82-L84 PolarHBondContact O-N 3.01Å; T82-L85 WeakPolarHBondContact O-CB 3.48Å; T82-L85 PolarHBondContact O-N 3.13Å; T82-L85 VanDerWaalsContact O-N 3.14Å; T82-L86 WeakPolarHBondContact O-CG 3.48Å; T82-L86 PolarHBondContact O-N 2.97Å; T82-V146 HydrophobicContact CG2-CG1 4.33Å; T82-L356 HydrophobicContact CG2-CD1 3.68Å; T82-L356 HydrophobicContact CG2-CD2 4.22Å |
| 83 | N | 92.4 | Very high | 94.2 | Very high | 14 Ų | 14 | 36.7 Ų | 36.7 | 8% | 0.075 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -67 | -31.8 | 178 | -68.1 | -10.1 | 0 | 0 | 0 | 111.9 | L73 L78 S80 L86 T87 | L73-N83 HydrophobicContact CD2-CB 4.37Å; L78-N83 WeakPolarHBondContact O-CB 3.44Å; L78-N83 PolarHBondContact O-ND2 3.11Å; S80-N83 PolarHBondContact O-N 2.69Å; S80-N83 VanDerWaalsContact O-N 3.13Å; S80-N83 VanDerWaalsContact OG-CB 3.27Å; S80-N83 WeakPolarHBondContact OG-CB 3.41Å; S80-N83 PolarHBondContact OG-N 3.07Å; S80-N83 VanDerWaalsContact OG-N 3.08Å; S80-N83 PolarHBondContact OG-ND2 2.91Å; N83-L86 CarbonylContact O-C 3.1Å; N83-L86 PolarHBondContact O-N 3.16Å; N83-T87 PolarHBondContact O-N 3.43Å; N83-T87 PolarHBondContact O-OG1 3.43Å |
| 84 | L | 96.3 | Very high | 94.4 | Very high | 29 Ų | 29 | 36.8 Ų | 36.8 | 15% | 0.152 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.4 | -46.6 | 170.1 | 177.9 | 65.2 | 0 | 0 | 0 | 111.1 | S80 P81 T82 L86 T87 F88 M166 A169 W170 I173 | S80-L84 PolarHBondContact O-N 3.46Å; P81-L84 WeakPolarHBondContact O-CB 3.44Å; P81-L84 PolarHBondContact O-N 3.24Å; T82-L84 VanDerWaalsContact C-N 3.28Å; T82-L84 PolarHBondContact O-N 3.01Å; L84-L86 VanDerWaalsContact C-N 3.35Å; L84-L86 PolarHBondContact O-N 3.05Å; L84-T87 WeakPolarHBondContact O-CB 3.35Å; L84-T87 PolarHBondContact O-N 2.92Å; L84-F88 HydrophobicContact CD1-CD2 4.18Å; L84-F88 HydrophobicContact CD1-CE2 3.95Å; L84-F88 WeakPolarHBondContact O-CD2 3.42Å; L84-F88 PolarHBondContact O-N 3.35Å; L84-F88 VanDerWaalsContact O-N 3.15Å; L84-M166 HydrophobicContact CD2-SD 4.37Å; L84-A169 HydrophobicContact CD2-CB 3.99Å; L84-W170 HydrophobicContact CD1-CH2 4.49Å; L84-W170 HydrophobicContact CD1-CZ2 3.94Å; L84-W170 HydrophobicContact CD2-CD2 4.15Å; L84-W170 HydrophobicContact CD2-CG 4.14Å; L84-W170 HydrophobicContact CD2-CZ2 4.42Å; L84-I173 HydrophobicContact CD2-CD1 4.08Å; L84-I173 HydrophobicContact CG-CD1 3.91Å |
| 85 | L | 96.7 | Very high | 94.6 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -63.3 | -40.5 | 175.5 | -64.7 | 171.7 | 0 | 0 | 0 | 111.9 | P81 T82 T87 F88 L89 I142 V146 F149 V172 I173 | P81-L85 WeakPolarHBondContact O-CG 3.45Å; P81-L85 PolarHBondContact O-N 2.97Å; P81-L85 VanDerWaalsContact O-N 3.17Å; T82-L85 WeakPolarHBondContact O-CB 3.48Å; T82-L85 PolarHBondContact O-N 3.13Å; T82-L85 VanDerWaalsContact O-N 3.14Å; L85-T87 VanDerWaalsContact C-N 3.31Å; L85-T87 PolarHBondContact O-N 2.79Å; L85-F88 PolarHBondContact O-N 3.25Å; L85-L89 PolarHBondContact O-N 3.38Å; L85-I142 HydrophobicContact CD2-CD1 4.49Å; L85-I142 WeakPolarHBondContact O-CG2 2.95Å; L85-V146 HydrophobicContact CB-CG2 3.47Å; L85-V146 VanDerWaalsContact CB-CG2 3.47Å; L85-V146 HydrophobicContact CD1-CG2 4.19Å; L85-V146 HydrophobicContact CG-CG2 4.45Å; L85-F149 HydrophobicContact CD1-CB 4.06Å; L85-F149 HydrophobicContact CD1-CD1 4.17Å; L85-F149 HydrophobicContact CD1-CD2 3.99Å; L85-F149 HydrophobicContact CD1-CG 3.79Å; L85-V172 HydrophobicContact CD2-CG1 4.47Å; L85-I173 HydrophobicContact CD2-CD1 4.04Å; L85-I173 HydrophobicContact CD2-CG1 3.64Å |
| 86 | L | 95.3 | Very high | 94.8 | Very high | 1 Ų | 1 | 33.5 Ų | 33.5 | 1% | 0.005 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -65.2 | -32.5 | 174.9 | -66.4 | 178.8 | 0 | 0 | 0 | 113 | L73 T82 N83 L84 L89 A90 V146 M355 L356 Y411 | L73-L86 HydrophobicContact CD1-CB 4.01Å; T82-L86 WeakPolarHBondContact O-CG 3.48Å; T82-L86 PolarHBondContact O-N 2.97Å; N83-L86 CarbonylContact O-C 3.1Å; N83-L86 PolarHBondContact O-N 3.16Å; L84-L86 VanDerWaalsContact C-N 3.35Å; L84-L86 PolarHBondContact O-N 3.05Å; L86-L89 HydrophobicContact CD2-CD2 4.26Å; L86-L89 WeakPolarHBondContact O-CB 3.31Å; L86-L89 PolarHBondContact O-N 3.38Å; L86-A90 PolarHBondContact O-N 2.94Å; L86-V146 HydrophobicContact CD2-CG1 4.03Å; L86-V146 HydrophobicContact CD2-CG2 4.13Å; L86-M355 HydrophobicContact CD1-CE 4.06Å; L86-L356 HydrophobicContact CD1-CD2 3.78Å; L86-L356 HydrophobicContact CD2-CD2 3.63Å; L86-L356 HydrophobicContact CG-CD2 4.11Å; L86-Y411 HydrophobicContact CD1-CE1 4.07Å; L86-Y411 WeakPolarHBondContact CD2-OH 3.41Å |
| 87 | T | 96.9 | Very high | 95.1 | Very high | 9 Ų | 9 | 28.8 Ų | 28.8 | 6% | 0.055 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -62.4 | -47.7 | 172.3 | -63.9 | 0 | 0 | 0 | 0 | 109.9 | V70 L73 C74 N83 L84 L85 L89 A90 V91 | V70-T87 HydrophobicContact CB-CG2 4.43Å; V70-T87 HydrophobicContact CG1-CG2 4.01Å; V70-T87 HydrophobicContact CG2-CG2 4.24Å; L73-T87 WeakPolarHBondContact CB-OG1 3.29Å; C74-T87 VanDerWaalsContact SG-CG2 3.52Å; N83-T87 PolarHBondContact O-N 3.43Å; N83-T87 PolarHBondContact O-OG1 3.43Å; L84-T87 WeakPolarHBondContact O-CB 3.35Å; L84-T87 PolarHBondContact O-N 2.92Å; L85-T87 VanDerWaalsContact C-N 3.31Å; L85-T87 PolarHBondContact O-N 2.79Å; T87-L89 VanDerWaalsContact C-N 3.31Å; T87-L89 PolarHBondContact O-N 3Å; T87-A90 PolarHBondContact O-N 2.98Å; T87-A90 VanDerWaalsContact O-N 3.15Å; T87-V91 WeakPolarHBondContact O-CG2 3.3Å; T87-V91 PolarHBondContact O-N 3.42Å |
| 88 | F | 98.2 | Very high | 95.5 | Very high | 46 Ų | 46 | 28.7 Ų | 28.7 | 20% | 0.202 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -65.8 | -34.2 | 178.2 | -87.5 | -92.8 | 0 | 0 | 0 | 112.5 | L84 L85 V91 S92 F138 W170 I173 | L84-F88 HydrophobicContact CD1-CD2 4.18Å; L84-F88 HydrophobicContact CD1-CE2 3.95Å; L84-F88 WeakPolarHBondContact O-CD2 3.42Å; L84-F88 PolarHBondContact O-N 3.35Å; L84-F88 VanDerWaalsContact O-N 3.15Å; L85-F88 PolarHBondContact O-N 3.25Å; F88-V91 PolarHBondContact O-N 3.34Å; F88-S92 PolarHBondContact O-N 3.25Å; F88-S92 PolarHBondContact O-OG 2.98Å; F88-F138 HydrophobicContact CB-CE1 4.31Å; F88-F138 HydrophobicContact CB-CZ 4.15Å; F88-F138 HydrophobicContact CD1-CZ 4.03Å; F88-W170 AromaticContact CE2-CH2 3.69Å; F88-W170 HydrophobicContact CE2-CH2 3.69Å; F88-W170 HydrophobicContact CE2-CZ2 4.48Å; F88-W170 AromaticContact CE2-CZ3 3.77Å; F88-W170 HydrophobicContact CE2-CZ3 3.77Å; F88-W170 AromaticContact CZ-CH2 3.67Å; F88-W170 HydrophobicContact CZ-CH2 3.67Å; F88-W170 AromaticContact CZ-CZ3 3.51Å; F88-W170 HydrophobicContact CZ-CZ3 3.51Å; F88-I173 HydrophobicContact CD1-CG2 3.79Å; F88-I173 HydrophobicContact CD2-CD1 3.54Å; F88-I173 HydrophobicContact CD2-CG1 4.34Å; F88-I173 HydrophobicContact CD2-CG2 4.48Å; F88-I173 HydrophobicContact CE1-CG2 3.81Å; F88-I173 HydrophobicContact CE2-CD1 3.79Å; F88-I173 HydrophobicContact CE2-CG2 4.5Å; F88-I173 HydrophobicContact CG-CD1 4.04Å; F88-I173 HydrophobicContact CG-CG1 4.37Å; F88-I173 HydrophobicContact CG-CG2 4.13Å; F88-I173 HydrophobicContact CZ-CD1 4.48Å; F88-I173 HydrophobicContact CZ-CG2 4.18Å |
| 89 | L | 97.1 | Very high | 95.9 | Very high | 1 Ų | 1 | 28.9 Ų | 28.9 | 1% | 0.005 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -59.7 | -46.3 | 169.4 | -179.3 | 59.1 | 0 | 0 | 0 | 111.7 | L85 L86 T87 V91 S92 D93 I142 I143 I359 | L85-L89 PolarHBondContact O-N 3.38Å; L86-L89 HydrophobicContact CD2-CD2 4.26Å; L86-L89 WeakPolarHBondContact O-CB 3.31Å; L86-L89 PolarHBondContact O-N 3.38Å; T87-L89 VanDerWaalsContact C-N 3.31Å; T87-L89 PolarHBondContact O-N 3Å; L89-V91 VanDerWaalsContact C-N 3.33Å; L89-V91 PolarHBondContact O-N 2.92Å; L89-S92 PolarHBondContact O-N 2.77Å; L89-S92 PolarHBondContact O-OG 2.92Å; L89-D93 WeakPolarHBondContact O-CB 3.46Å; L89-D93 VanDerWaalsContact O-CG 3.28Å; L89-D93 PolarHBondContact O-N 3Å; L89-I142 HydrophobicContact CB-CG2 3.81Å; L89-I142 HydrophobicContact CD1-CG2 4.45Å; L89-I143 HydrophobicContact CD1-CD1 3.96Å; L89-I143 HydrophobicContact CD1-CG1 3.68Å; L89-I143 HydrophobicContact CD2-CG1 3.82Å; L89-I143 HydrophobicContact CG-CG1 4.41Å; L89-I359 HydrophobicContact CD2-CG2 4.47Å |
| 90 | A | 97.9 | Very high | 96.3 | Very high | 1 Ų | 1 | 20.3 Ų | 20.3 | 1% | 0.008 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -64.8 | -37.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | N66 N69 V70 L86 T87 G94 | N66-A90 WeakPolarHBondContact CB-O 3.39Å; N69-A90 HydrophobicContact CB-CB 3.78Å; V70-A90 HydrophobicContact CG2-CB 3.89Å; L86-A90 PolarHBondContact O-N 2.94Å; T87-A90 PolarHBondContact O-N 2.98Å; T87-A90 VanDerWaalsContact O-N 3.15Å; A90-G94 PolarHBondContact O-N 3.4Å |
| 91 | V | 98.2 | Very high | 96.7 | Very high | 61 Ų | 61 | 20.7 Ų | 20.7 | 37% | 0.37 | 11% | 0.108 | S | C | . | . | H | α-helix | trans | -60.5 | -50.1 | 173.9 | 171.5 | 0 | 0 | 0 | 0 | 110.4 | V70 T87 F88 L89 G94 L95 | V70-V91 HydrophobicContact CG1-CG2 4.47Å; V70-V91 HydrophobicContact CG2-CG2 3.62Å; T87-V91 WeakPolarHBondContact O-CG2 3.3Å; T87-V91 PolarHBondContact O-N 3.42Å; F88-V91 PolarHBondContact O-N 3.34Å; L89-V91 VanDerWaalsContact C-N 3.33Å; L89-V91 PolarHBondContact O-N 2.92Å; V91-G94 PolarHBondContact O-N 3.07Å; V91-L95 HydrophobicContact CG1-CD1 3.98Å; V91-L95 VanDerWaalsContact O-CG 3.31Å; V91-L95 WeakPolarHBondContact O-CG 3.32Å; V91-L95 PolarHBondContact O-N 3.5Å |
| 92 | S | 98 | Very high | 96.9 | Very high | 1 Ų | 1 | 22 Ų | 22 | 1% | 0.007 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -68.8 | -40.1 | -178 | 54.8 | 0 | 0 | 0 | 0 | 113 | F88 L89 G94 L95 V96 F138 S139 | F88-S92 PolarHBondContact O-N 3.25Å; F88-S92 PolarHBondContact O-OG 2.98Å; L89-S92 PolarHBondContact O-N 2.77Å; L89-S92 PolarHBondContact O-OG 2.92Å; S92-G94 VanDerWaalsContact C-N 3.31Å; S92-G94 PolarHBondContact O-N 3.5Å; S92-L95 PolarHBondContact O-N 3.27Å; S92-L95 VanDerWaalsContact O-N 3.15Å; S92-V96 WeakPolarHBondContact O-CG2 3.29Å; S92-V96 PolarHBondContact O-N 3.45Å; S92-F138 WeakPolarHBondContact OG-CD1 3.44Å; S92-S139 VanDerWaalsContact CB-OG 3.31Å; S92-S139 WeakPolarHBondContact CB-OG 3.3Å; S92-S139 PolarHBondContact OG-OG 3.3Å |
| 93 | D | 97.4 | Very high | 97.1 | Very high | 0 Ų | 0 | 23.2 Ų | 23.2 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -62.6 | -39.8 | 175 | -72.3 | -1 | 0 | 0 | 0 | 111.3 | L89 V96 M97 S139 Y363 N404 N407 | L89-D93 WeakPolarHBondContact O-CB 3.46Å; L89-D93 VanDerWaalsContact O-CG 3.28Å; L89-D93 PolarHBondContact O-N 3Å; D93-V96 PolarHBondContact O-N 2.68Å; D93-M97 WeakPolarHBondContact O-CG 3.03Å; D93-M97 PolarHBondContact O-N 3.17Å; D93-M97 VanDerWaalsContact O-N 3.07Å; D93-S139 WeakPolarHBondContact OD1-CB 3.37Å; D93-S139 PolarHBondContact OD1-OG 2.8Å; D93-Y363 PolarHBondContact OD1-OH 3.4Å; D93-Y363 PolarHBondContact OD2-OH 3.13Å; D93-N404 HydrophobicContact CB-CB 4.07Å; D93-N407 PolarHBondContact OD2-ND2 2.89Å |
| 94 | G | 98.1 | Very high | 97.2 | Very high | 10 Ų | 10 | 22.5 Ų | 22.5 | 10% | 0.103 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -62.5 | -41.5 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A90 V91 S92 M97 F98 | A90-G94 PolarHBondContact O-N 3.4Å; V91-G94 PolarHBondContact O-N 3.07Å; S92-G94 VanDerWaalsContact C-N 3.31Å; S92-G94 PolarHBondContact O-N 3.5Å; G94-M97 PolarHBondContact O-N 3.3Å; G94-F98 WeakPolarHBondContact O-CB 3.32Å; G94-F98 PolarHBondContact O-N 2.83Å |
| 95 | L | 98.5 | Very high | 97.2 | Very high | 63 Ų | 63 | 27.4 Ų | 27.4 | 33% | 0.33 | 13% | 0.132 | S | C | . | . | H | α-helix | trans | -67.9 | -41.4 | 177.3 | -71.2 | 172.2 | 0 | 0 | 0 | 112.3 | V91 S92 M97 F98 I99 F135 | V91-L95 HydrophobicContact CG1-CD1 3.98Å; V91-L95 VanDerWaalsContact O-CG 3.31Å; V91-L95 WeakPolarHBondContact O-CG 3.32Å; V91-L95 PolarHBondContact O-N 3.5Å; S92-L95 PolarHBondContact O-N 3.27Å; S92-L95 VanDerWaalsContact O-N 3.15Å; L95-M97 VanDerWaalsContact C-N 3.34Å; L95-M97 PolarHBondContact O-N 3.02Å; L95-F98 PolarHBondContact O-N 3.36Å; L95-I99 WeakPolarHBondContact O-CD1 3.35Å; L95-I99 VanDerWaalsContact O-CG1 3.23Å; L95-I99 WeakPolarHBondContact O-CG1 3.43Å; L95-I99 PolarHBondContact O-N 3.23Å; L95-F135 HydrophobicContact CB-CD1 4.29Å; L95-F135 HydrophobicContact CB-CD2 4.01Å; L95-F135 HydrophobicContact CB-CE1 4.45Å; L95-F135 HydrophobicContact CB-CE2 4.18Å; L95-F135 HydrophobicContact CB-CG 4.08Å; L95-F135 HydrophobicContact CB-CZ 4.4Å; L95-F135 HydrophobicContact CD1-CD1 3.95Å; L95-F135 HydrophobicContact CD1-CE1 3.45Å; L95-F135 VanDerWaalsContact CD1-CE1 3.45Å; L95-F135 HydrophobicContact CD1-CE2 4.21Å; L95-F135 HydrophobicContact CD1-CZ 3.61Å |
| 96 | V | 97.8 | Very high | 97.1 | Very high | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -54.4 | -53.2 | 172 | 168.1 | 0 | 0 | 0 | 0 | 109.7 | S92 D93 F98 I99 Y100 F135 H136 L401 | S92-V96 WeakPolarHBondContact O-CG2 3.29Å; S92-V96 PolarHBondContact O-N 3.45Å; D93-V96 PolarHBondContact O-N 2.68Å; V96-F98 VanDerWaalsContact C-N 3.33Å; V96-F98 PolarHBondContact O-N 2.66Å; V96-I99 PolarHBondContact O-N 3.11Å; V96-Y100 HydrophobicContact CG1-CD2 3.84Å; V96-Y100 HydrophobicContact CG1-CE2 4.03Å; V96-Y100 WeakPolarHBondContact O-CD2 3.23Å; V96-Y100 PolarHBondContact O-N 2.99Å; V96-F135 HydrophobicContact CG2-CB 3.54Å; V96-H136 VanDerWaalsContact CG1-NE2 3.34Å; V96-H136 WeakPolarHBondContact CG1-NE2 3.5Å; V96-L401 HydrophobicContact CG1-CD2 4.4Å |
| 97 | M | 97.7 | Very high | 97 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -64.2 | -37.4 | -178.2 | -66.2 | -176.4 | 99.1 | 0 | 0 | 112.3 | L58 C59 V63 D93 G94 L95 Y100 I101 L401 N404 | L58-M97 HydrophobicContact CG-CE 4.08Å; C59-M97 HydrophobicContact CB-CB 4.26Å; V63-M97 HydrophobicContact CG2-CB 3.89Å; D93-M97 WeakPolarHBondContact O-CG 3.03Å; D93-M97 PolarHBondContact O-N 3.17Å; D93-M97 VanDerWaalsContact O-N 3.07Å; G94-M97 PolarHBondContact O-N 3.3Å; L95-M97 VanDerWaalsContact C-N 3.34Å; L95-M97 PolarHBondContact O-N 3.02Å; M97-Y100 PolarHBondContact O-N 3.44Å; M97-I101 WeakPolarHBondContact O-CG1 3.39Å; M97-I101 PolarHBondContact O-N 3.42Å; M97-I101 VanDerWaalsContact O-N 3.15Å; M97-L401 HydrophobicContact CE-CB 4.4Å; M97-L401 WeakPolarHBondContact CE-O 3.33Å; M97-L401 HydrophobicContact CG-CD2 4.03Å; M97-N404 HydrophobicContact CG-CB 4.35Å; M97-N404 HydrophobicContact SD-CB 4.06Å |
| 98 | F | 98.1 | Very high | 96.7 | Very high | 108 Ų | 108 | 30.9 Ų | 30.9 | 47% | 0.474 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -63 | -44.7 | 175.4 | 177.9 | -102.2 | 0 | 0 | 0 | 112.4 | V63 G94 L95 V96 Y100 I101 I102 | V63-F98 HydrophobicContact CG2-CB 4.03Å; G94-F98 WeakPolarHBondContact O-CB 3.32Å; G94-F98 PolarHBondContact O-N 2.83Å; L95-F98 PolarHBondContact O-N 3.36Å; V96-F98 VanDerWaalsContact C-N 3.33Å; V96-F98 PolarHBondContact O-N 2.66Å; F98-Y100 VanDerWaalsContact C-N 3.32Å; F98-Y100 PolarHBondContact O-N 2.96Å; F98-I101 WeakPolarHBondContact O-CB 3.38Å; F98-I101 PolarHBondContact O-N 3.47Å; F98-I102 HydrophobicContact CD1-CD1 4.33Å; F98-I102 HydrophobicContact CE1-CD1 3.78Å; F98-I102 HydrophobicContact CZ-CD1 4.16Å; F98-I102 PolarHBondContact O-N 3.11Å |
| 99 | I | 98 | Very high | 96.3 | Very high | 10 Ų | 10 | 32.5 Ų | 32.5 | 5% | 0.051 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -68.1 | -34.8 | 178.2 | -62.5 | 158.9 | 0 | 0 | 0 | 110.7 | L95 V96 I101 I102 F103 N128 L131 Q132 F135 | L95-I99 WeakPolarHBondContact O-CD1 3.35Å; L95-I99 VanDerWaalsContact O-CG1 3.23Å; L95-I99 WeakPolarHBondContact O-CG1 3.43Å; L95-I99 PolarHBondContact O-N 3.23Å; V96-I99 PolarHBondContact O-N 3.11Å; I99-I101 VanDerWaalsContact C-N 3.32Å; I99-I101 PolarHBondContact O-N 3.29Å; I99-I102 WeakPolarHBondContact O-CB 3.4Å; I99-I102 PolarHBondContact O-N 3.2Å; I99-F103 PolarHBondContact O-N 2.86Å; I99-N128 HydrophobicContact CG2-CB 4.28Å; I99-N128 WeakPolarHBondContact CG2-OD1 3.37Å; I99-L131 HydrophobicContact CD1-CB 3.7Å; I99-Q132 HydrophobicContact CB-CG 4.1Å; I99-Q132 HydrophobicContact CG2-CG 3.46Å; I99-Q132 VanDerWaalsContact CG2-CG 3.46Å; I99-F135 HydrophobicContact CD1-CD2 3.49Å; I99-F135 VanDerWaalsContact CD1-CD2 3.49Å; I99-F135 HydrophobicContact CD1-CE2 3.68Å |
| 100 | Y | 96.8 | Very high | 95.9 | Very high | 11 Ų | 11 | 35.2 Ų | 35.2 | 4% | 0.043 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -60.8 | -37.2 | 173 | -101.1 | -88.7 | 0 | 0 | 0 | 112.7 | V96 M97 F98 I102 F103 D104 Q132 H136 D397 L401 | V96-Y100 HydrophobicContact CG1-CD2 3.84Å; V96-Y100 HydrophobicContact CG1-CE2 4.03Å; V96-Y100 WeakPolarHBondContact O-CD2 3.23Å; V96-Y100 PolarHBondContact O-N 2.99Å; M97-Y100 PolarHBondContact O-N 3.44Å; F98-Y100 VanDerWaalsContact C-N 3.32Å; F98-Y100 PolarHBondContact O-N 2.96Å; Y100-I102 VanDerWaalsContact C-N 3.31Å; Y100-I102 PolarHBondContact O-N 3.14Å; Y100-F103 PolarHBondContact O-N 3.46Å; Y100-D104 WeakPolarHBondContact O-CB 3.41Å; Y100-D104 VanDerWaalsContact O-CG 3.3Å; Y100-D104 PolarHBondContact O-N 3.11Å; Y100-Q132 HydrophobicContact CD2-CG 4.36Å; Y100-Q132 HydrophobicContact CE2-CG 4.39Å; Y100-H136 AromaticContact CE2-NE2 3.65Å; Y100-D397 VanDerWaalsContact OH-CG 3.31Å; Y100-D397 PolarHBondContact OH-OD2 3.1Å; Y100-L401 HydrophobicContact CD1-CD1 3.81Å; Y100-L401 HydrophobicContact CD1-CD2 4.34Å; Y100-L401 HydrophobicContact CD2-CD2 3.8Å; Y100-L401 HydrophobicContact CE1-CD1 4.06Å; Y100-L401 HydrophobicContact CE2-CD2 4.16Å; Y100-L401 HydrophobicContact CG-CD1 4.15Å; Y100-L401 HydrophobicContact CG-CD2 3.87Å |
| 101 | I | 97.2 | Very high | 95.4 | Very high | 42 Ų | 42 | 38 Ų | 38 | 22% | 0.215 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -58.5 | -45.6 | 174.3 | -63.6 | 163.6 | 0 | 0 | 0 | 110.7 | L56 C59 P60 V63 M97 F98 I99 F103 Y105 | L56-I101 HydrophobicContact CD2-CG2 4.25Å; C59-I101 HydrophobicContact CB-CD1 3.98Å; C59-I101 HydrophobicContact CB-CG1 3.44Å; C59-I101 VanDerWaalsContact CB-CG1 3.44Å; P60-I101 HydrophobicContact CB-CD1 4.46Å; P60-I101 HydrophobicContact CG-CD1 3.85Å; P60-I101 HydrophobicContact CG-CG1 4.33Å; V63-I101 HydrophobicContact CG2-CD1 4.32Å; M97-I101 WeakPolarHBondContact O-CG1 3.39Å; M97-I101 PolarHBondContact O-N 3.42Å; M97-I101 VanDerWaalsContact O-N 3.15Å; F98-I101 WeakPolarHBondContact O-CB 3.38Å; F98-I101 PolarHBondContact O-N 3.47Å; I99-I101 VanDerWaalsContact C-N 3.32Å; I99-I101 PolarHBondContact O-N 3.29Å; I101-F103 VanDerWaalsContact C-N 3.33Å; I101-Y105 WeakPolarHBondContact O-CB 3.46Å; I101-Y105 PolarHBondContact O-N 3.48Å |
| 102 | I | 96.8 | Very high | 95.1 | Very high | 48 Ų | 48 | 37.5 Ų | 37.5 | 25% | 0.246 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -63 | -45.6 | 178.1 | -60.4 | 174.5 | 0 | 0 | 0 | 109.3 | F98 I99 Y100 F106 N128 | F98-I102 HydrophobicContact CD1-CD1 4.33Å; F98-I102 HydrophobicContact CE1-CD1 3.78Å; F98-I102 HydrophobicContact CZ-CD1 4.16Å; F98-I102 PolarHBondContact O-N 3.11Å; I99-I102 WeakPolarHBondContact O-CB 3.4Å; I99-I102 PolarHBondContact O-N 3.2Å; Y100-I102 VanDerWaalsContact C-N 3.31Å; Y100-I102 PolarHBondContact O-N 3.14Å; I102-F106 HydrophobicContact CG2-CD2 3.73Å; I102-F106 HydrophobicContact CG2-CE2 4.13Å; I102-F106 WeakPolarHBondContact O-CB 3.16Å; I102-F106 WeakPolarHBondContact O-CD2 3.34Å; I102-F106 PolarHBondContact O-N 3.29Å; I102-N128 WeakPolarHBondContact CG2-OD1 3.33Å |
| 103 | F | 96.1 | Very high | 94.6 | Very high | 32 Ų | 32 | 40.6 Ų | 40.6 | 14% | 0.14 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -60.6 | -53.8 | -179.6 | 176.5 | -94.1 | 0 | 0 | 0 | 112 | I99 Y100 I101 Y105 F106 Y107 L108 L113 L125 | I99-F103 PolarHBondContact O-N 2.86Å; Y100-F103 PolarHBondContact O-N 3.46Å; I101-F103 VanDerWaalsContact C-N 3.33Å; F103-Y105 PolarHBondContact O-N 3.15Å; F103-F106 PolarHBondContact O-N 2.9Å; F103-Y107 AromaticContact CD2-CD2 3.9Å; F103-Y107 HydrophobicContact CD2-CD2 3.9Å; F103-Y107 HydrophobicContact CE2-CD2 4.48Å; F103-Y107 HydrophobicContact CG-CD2 4.41Å; F103-Y107 WeakPolarHBondContact O-CB 3.29Å; F103-Y107 WeakPolarHBondContact O-CD2 3.4Å; F103-Y107 PolarHBondContact O-N 2.9Å; F103-L108 HydrophobicContact CD1-CD1 4.48Å; F103-L108 HydrophobicContact CE1-CD1 4.01Å; F103-L108 HydrophobicContact CE1-CD2 4.49Å; F103-L108 HydrophobicContact CE1-CG 4.06Å; F103-L113 HydrophobicContact CE2-CD1 4.42Å; F103-L113 HydrophobicContact CZ-CD1 3.84Å; F103-L125 HydrophobicContact CD2-CD1 3.9Å; F103-L125 HydrophobicContact CE2-CD1 3.67Å |
| 104 | D | 94.7 | Very high | 94 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 23% | 0.232 | C | C | . | . | I | π-helix | trans | -62.9 | -43.4 | -177.1 | -67.6 | -14.5 | 0 | 0 | 0 | 111.4 | V52 C55 L56 Y100 L108 M109 | V52-D104 HydrophobicContact CG1-CB 4.48Å; C55-D104 WeakPolarHBondContact CB-OD2 3.17Å; L56-D104 HydrophobicContact CD2-CB 3.96Å; L56-D104 HydrophobicContact CG-CB 4.18Å; Y100-D104 WeakPolarHBondContact O-CB 3.41Å; Y100-D104 VanDerWaalsContact O-CG 3.3Å; Y100-D104 PolarHBondContact O-N 3.11Å; D104-L108 WeakPolarHBondContact O-CB 3.29Å; D104-L108 PolarHBondContact O-N 2.97Å; D104-L108 VanDerWaalsContact O-N 3.12Å; D104-L108 WeakPolarHBondContact OD1-CD1 3.27Å; D104-M109 PolarHBondContact O-N 3.28Å |
| 105 | Y | 94.8 | Very high | 93.6 | Very high | 131 Ų | 131 | 51.1 Ų | 51.1 | 51% | 0.514 | 25% | 0.252 | S | S | . | . | I | π-helix | trans | -65.1 | -47.5 | -179.9 | -179 | -101.4 | 0 | 0 | 0 | 112.4 | I101 F103 | I101-Y105 WeakPolarHBondContact O-CB 3.46Å; I101-Y105 PolarHBondContact O-N 3.48Å; F103-Y105 PolarHBondContact O-N 3.15Å |
| 106 | F | 95 | Very high | 93.1 | Very high | 59 Ų | 59 | 48.5 Ų | 48.5 | 26% | 0.259 | 24% | 0.24 | S | C | . | . | I | π-helix | trans | -82.5 | -27.3 | -175.7 | -77 | -73 | 0 | 0 | 0 | 113.8 | I102 F103 R112 Y121 | I102-F106 HydrophobicContact CG2-CD2 3.73Å; I102-F106 HydrophobicContact CG2-CE2 4.13Å; I102-F106 WeakPolarHBondContact O-CB 3.16Å; I102-F106 WeakPolarHBondContact O-CD2 3.34Å; I102-F106 PolarHBondContact O-N 3.29Å; F103-F106 PolarHBondContact O-N 2.9Å; F106-R112 VanDerWaalsContact O-CD 3.26Å; F106-R112 WeakPolarHBondContact O-CD 3.4Å; F106-R112 WeakPolarHBondContact O-CG 3.36Å; F106-R112 PolarHBondContact O-NH1 3.34Å; F106-Y121 HydrophobicContact CD1-CD1 4.4Å; F106-Y121 AromaticContact CD1-CE1 3.69Å; F106-Y121 HydrophobicContact CD1-CE1 3.69Å; F106-Y121 AromaticContact CE1-CE1 4Å; F106-Y121 HydrophobicContact CE1-CE1 4Å |
| 107 | Y | 93.2 | Very high | 92.8 | Very high | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 24% | 0.242 | C | C | . | . | I | π-helix | trans | -118.7 | -24.7 | -168 | -58.4 | -72.6 | 0 | 0 | 0 | 115.2 | F103 T110 R112 L113 M117 Y121 L124 L125 | F103-Y107 AromaticContact CD2-CD2 3.9Å; F103-Y107 HydrophobicContact CD2-CD2 3.9Å; F103-Y107 HydrophobicContact CE2-CD2 4.48Å; F103-Y107 HydrophobicContact CG-CD2 4.41Å; F103-Y107 WeakPolarHBondContact O-CB 3.29Å; F103-Y107 WeakPolarHBondContact O-CD2 3.4Å; F103-Y107 PolarHBondContact O-N 2.9Å; Y107-T110 CarbonylContact C-O 3.54Å; Y107-R112 HydrophobicContact CD1-CB 4.17Å; Y107-R112 PolarHBondContact O-N 3.35Å; Y107-L113 HydrophobicContact CD1-CD2 4.41Å; Y107-L113 HydrophobicContact CG-CD2 4.44Å; Y107-L113 PolarHBondContact O-N 3.36Å; Y107-M117 HydrophobicContact CD1-CE 3.66Å; Y107-M117 HydrophobicContact CD1-SD 3.99Å; Y107-M117 HydrophobicContact CE1-CE 3.9Å; Y107-M117 HydrophobicContact CE1-SD 3.56Å; Y107-M117 VanDerWaalsContact CE1-SD 3.56Å; Y107-Y121 WeakPolarHBondContact CE1-O 3.28Å; Y107-Y121 PolarHBondContact OH-O 2.86Å; Y107-L124 VanDerWaalsContact OH-C 3.31Å; Y107-L124 WeakPolarHBondContact OH-CB 3.35Å; Y107-L124 WeakPolarHBondContact OH-CG 3.47Å; Y107-L125 HydrophobicContact CD1-CB 4.36Å; Y107-L125 HydrophobicContact CD1-CD1 4.16Å; Y107-L125 HydrophobicContact CD1-CD2 4.36Å; Y107-L125 HydrophobicContact CD2-CD1 3.93Å; Y107-L125 HydrophobicContact CE1-CB 3.65Å; Y107-L125 HydrophobicContact CE1-CD1 4.2Å; Y107-L125 HydrophobicContact CE1-CD2 4.38Å; Y107-L125 HydrophobicContact CE1-CG 4.29Å; Y107-L125 HydrophobicContact CE2-CB 4.23Å; Y107-L125 HydrophobicContact CE2-CD1 3.99Å; Y107-L125 HydrophobicContact CG-CD1 4.03Å; Y107-L125 WeakPolarHBondContact OH-CA 3.41Å; Y107-L125 PolarHBondContact OH-N 3.09Å |
| 108 | L | 91 | Very high | 92.5 | Very high | 25 Ų | 25 | 52.1 Ų | 52.1 | 13% | 0.131 | 26% | 0.262 | C | S | . | . | I | π-helix | trans | -103.9 | -50.7 | 177.1 | -60.4 | -177.1 | 0 | 0 | 0 | 112.7 | V52 F103 D104 L113 | V52-L108 HydrophobicContact CG1-CB 4.17Å; V52-L108 HydrophobicContact CG2-CB 3.58Å; V52-L108 HydrophobicContact CG2-CD1 4.08Å; V52-L108 HydrophobicContact CG2-CG 4.45Å; F103-L108 HydrophobicContact CD1-CD1 4.48Å; F103-L108 HydrophobicContact CE1-CD1 4.01Å; F103-L108 HydrophobicContact CE1-CD2 4.49Å; F103-L108 HydrophobicContact CE1-CG 4.06Å; D104-L108 WeakPolarHBondContact O-CB 3.29Å; D104-L108 PolarHBondContact O-N 2.97Å; D104-L108 VanDerWaalsContact O-N 3.12Å; D104-L108 WeakPolarHBondContact OD1-CD1 3.27Å; L108-L113 HydrophobicContact CD2-CD1 3.64Å |
| 109 | M | 90.9 | Very high | 92.2 | Very high | 79 Ų | 79 | 52.6 Ų | 52.6 | 39% | 0.389 | 26% | 0.264 | S | S | . | . | I | π-helix | trans | -62.3 | -46.6 | 178.6 | -178.8 | 69 | 110.8 | 0 | 0 | 111.1 | V52 Y53 L56 D104 | V52-M109 HydrophobicContact CG1-CB 4.01Å; Y53-M109 HydrophobicContact CD1-CE 4.25Å; Y53-M109 HydrophobicContact CE1-CE 3.68Å; Y53-M109 HydrophobicContact CE1-SD 4.2Å; L56-M109 HydrophobicContact CD1-CE 4Å; D104-M109 PolarHBondContact O-N 3.28Å |
| 110 | T | 88.5 | Confident | 92 | Very high | 59 Ų | 59 | 56.4 Ų | 56.4 | 36% | 0.362 | 29% | 0.292 | S | S | . | . | S | Bend | trans | -92.4 | 114.2 | 158.5 | -50.4 | 0 | 0 | 0 | 0 | 106.4 | Y107 R112 | Y107-T110 CarbonylContact C-O 3.54Å; T110-R112 HydrophobicContact CG2-CG 3.8Å; T110-R112 PolarHBondContact O-N 3.5Å |
| 111 | P | 86.9 | Confident | 91.9 | Very high | 58 Ų | 58 | 59.4 Ų | 59.4 | 38% | 0.377 | 30% | 0.303 | S | S | . | . | trans | -74 | 59.7 | -168.7 | 30 | -36.9 | 0 | 0 | 0 | 112.6 | L113 L114 N115 | P111-L113 VanDerWaalsContact C-N 3.35Å; P111-L114 PolarHBondContact O-N 2.9Å; P111-N115 WeakPolarHBondContact O-CB 3.17Å; P111-N115 PolarHBondContact O-N 3.18Å | ||
| 112 | R | 91 | Very high | 91.7 | Very high | 51 Ų | 51 | 57.4 Ų | 57.4 | 19% | 0.192 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -75.2 | -24.6 | -177.3 | -65.9 | -167.6 | 176.7 | 94.2 | -0.4 | 111.6 | F106 Y107 T110 G116 M117 | F106-R112 VanDerWaalsContact O-CD 3.26Å; F106-R112 WeakPolarHBondContact O-CD 3.4Å; F106-R112 WeakPolarHBondContact O-CG 3.36Å; F106-R112 PolarHBondContact O-NH1 3.34Å; Y107-R112 HydrophobicContact CD1-CB 4.17Å; Y107-R112 PolarHBondContact O-N 3.35Å; T110-R112 HydrophobicContact CG2-CG 3.8Å; T110-R112 PolarHBondContact O-N 3.5Å; R112-G116 CarbonylContact O-C 3.16Å; R112-G116 WeakPolarHBondContact O-CA 3.48Å; R112-G116 PolarHBondContact O-N 3.08Å; R112-M117 HydrophobicContact CB-CB 4.17Å; R112-M117 HydrophobicContact CB-CE 3.93Å; R112-M117 VanDerWaalsContact O-CE 3.24Å; R112-M117 WeakPolarHBondContact O-CE 3.5Å |
| 113 | L | 87.6 | Confident | 91.6 | Very high | 67 Ų | 67 | 58.7 Ų | 58.7 | 35% | 0.351 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -65.2 | -48.9 | 170.6 | -61.1 | -179.3 | 0 | 0 | 0 | 110.9 | F103 Y107 L108 P111 M117 L125 K196 | F103-L113 HydrophobicContact CE2-CD1 4.42Å; F103-L113 HydrophobicContact CZ-CD1 3.84Å; Y107-L113 HydrophobicContact CD1-CD2 4.41Å; Y107-L113 HydrophobicContact CG-CD2 4.44Å; Y107-L113 PolarHBondContact O-N 3.36Å; L108-L113 HydrophobicContact CD2-CD1 3.64Å; P111-L113 VanDerWaalsContact C-N 3.35Å; L113-M117 HydrophobicContact CD2-CE 4.16Å; L113-L125 HydrophobicContact CD2-CD1 4.26Å; L113-L125 HydrophobicContact CD2-CD2 3.63Å; L113-K196 PolarHBondContact O-NZ 3.43Å |
| 114 | L | 86.1 | Confident | 91.5 | Very high | 133 Ų | 133 | 60.1 Ų | 60.1 | 70% | 0.696 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -70.4 | -49 | -178.7 | -179.9 | 63.8 | 0 | 0 | 0 | 111.9 | P111 K196 | P111-L114 PolarHBondContact O-N 2.9Å; L114-K196 PolarHBondContact O-NZ 2.76Å |
| 115 | N | 87.9 | Confident | 91.5 | Very high | 98 Ų | 98 | 60.3 Ų | 60.3 | 52% | 0.524 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -79.9 | -29.2 | -174.7 | -66.4 | -19.3 | 0 | 0 | 0 | 111.6 | P111 L236 | P111-N115 WeakPolarHBondContact O-CB 3.17Å; P111-N115 PolarHBondContact O-N 3.18Å; N115-L236 WeakPolarHBondContact O-CD2 3.18Å |
| 116 | G | 88.3 | Confident | 91.4 | Very high | 8 Ų | 8 | 55.6 Ų | 55.6 | 8% | 0.082 | 29% | 0.293 | C | S | . | . | trans | 99 | 171.7 | -167.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | R112 L236 | R112-G116 CarbonylContact O-C 3.16Å; R112-G116 WeakPolarHBondContact O-CA 3.48Å; R112-G116 PolarHBondContact O-N 3.08Å; G116-L236 VanDerWaalsContact C-CD1 3.49Å; G116-L236 VanDerWaalsContact CA-CD2 3.47Å | ||
| 117 | M | 92.1 | Very high | 91.4 | Very high | 6 Ų | 6 | 57.3 Ų | 57.3 | 3% | 0.03 | 30% | 0.304 | C | S | . | . | B | Isolated β-bridge | trans | -145.3 | 166.1 | -172.9 | 65.2 | -164.3 | 68.6 | 0 | 0 | 114.9 | Y107 R112 L113 Y121 A122 L125 L236 Y237 | Y107-M117 HydrophobicContact CD1-CE 3.66Å; Y107-M117 HydrophobicContact CD1-SD 3.99Å; Y107-M117 HydrophobicContact CE1-CE 3.9Å; Y107-M117 HydrophobicContact CE1-SD 3.56Å; Y107-M117 VanDerWaalsContact CE1-SD 3.56Å; R112-M117 HydrophobicContact CB-CB 4.17Å; R112-M117 HydrophobicContact CB-CE 3.93Å; R112-M117 VanDerWaalsContact O-CE 3.24Å; R112-M117 WeakPolarHBondContact O-CE 3.5Å; L113-M117 HydrophobicContact CD2-CE 4.16Å; M117-Y121 VanDerWaalsContact SD-C 3.5Å; M117-A122 HydrophobicContact CG-CB 3.92Å; M117-A122 VanDerWaalsContact SD-CA 3.52Å; M117-A122 HydrophobicContact SD-CB 4.08Å; M117-A122 PolarHBondContact SD-N 2.83Å; M117-A122 VanDerWaalsContact SD-N 3.45Å; M117-L125 HydrophobicContact CE-CD2 3.74Å; M117-L125 HydrophobicContact SD-CB 4.18Å; M117-L125 HydrophobicContact SD-CD2 3.97Å; M117-L236 VanDerWaalsContact CA-CD1 3.46Å; M117-L236 VanDerWaalsContact N-CD1 3.25Å; M117-L236 VanDerWaalsContact N-CG 3.31Å; M117-L236 WeakPolarHBondContact O-CD1 3.48Å; M117-Y237 WeakPolarHBondContact CG-O 3.46Å; M117-Y237 PolarHBondContact N-O 3.15Å; M117-Y237 WeakPolarHBondContact O-CA 3.48Å; M117-Y237 WeakPolarHBondContact O-CB 3.47Å; M117-Y237 PolarHBondContact O-N 3.4Å |
| 118 | T | 92.4 | Very high | 91.5 | Very high | 69 Ų | 69 | 57.6 Ų | 57.6 | 42% | 0.423 | 31% | 0.306 | S | S | . | . | trans | -68.1 | 159.7 | 172.6 | 73.9 | 0 | 0 | 0 | 0 | 110.7 | S120 Y121 A122 | T118-S120 PolarHBondContact O-N 3.35Å; T118-S120 VanDerWaalsContact O-N 3.14Å; T118-Y121 PolarHBondContact O-N 2.7Å; T118-Y121 VanDerWaalsContact O-N 3.07Å; T118-Y121 VanDerWaalsContact OG1-CD2 3.31Å; T118-Y121 WeakPolarHBondContact OG1-CD2 3.32Å; T118-A122 PolarHBondContact O-N 3.22Å | ||
| 119 | K | 91.2 | Very high | 91.6 | Very high | 119 Ų | 119 | 58 Ų | 58 | 52% | 0.517 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -54.8 | -35.6 | -179.3 | -170 | 173.2 | -178.4 | 178.7 | 0 | 113.6 | A122 N123 Y237 | K119-A122 PolarHBondContact O-N 3.44Å; K119-N123 PolarHBondContact O-N 3.28Å; K119-Y237 HydrophobicContact CB-CD2 3.96Å; K119-Y237 HydrophobicContact CB-CE2 3.83Å; K119-Y237 HydrophobicContact CB-CG 4.44Å |
| 120 | S | 93.3 | Very high | 91.8 | Very high | 90 Ų | 90 | 55 Ų | 55 | 63% | 0.629 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -64.8 | -46.7 | 177.6 | -172.7 | 0 | 0 | 0 | 0 | 111.8 | T118 A122 N123 L124 | T118-S120 PolarHBondContact O-N 3.35Å; T118-S120 VanDerWaalsContact O-N 3.14Å; S120-A122 VanDerWaalsContact C-N 3.3Å; S120-A122 PolarHBondContact O-N 3.12Å; S120-N123 PolarHBondContact O-N 2.92Å; S120-L124 PolarHBondContact O-N 3.49Å |
| 121 | Y | 94.4 | Very high | 92.1 | Very high | 74 Ų | 74 | 55.3 Ų | 55.3 | 29% | 0.29 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -66 | -32.9 | 175.8 | -76.6 | -67.6 | 0 | 0 | 0 | 112.3 | F106 Y107 M117 T118 L124 L125 | F106-Y121 HydrophobicContact CD1-CD1 4.4Å; F106-Y121 AromaticContact CD1-CE1 3.69Å; F106-Y121 HydrophobicContact CD1-CE1 3.69Å; F106-Y121 AromaticContact CE1-CE1 4Å; F106-Y121 HydrophobicContact CE1-CE1 4Å; Y107-Y121 WeakPolarHBondContact CE1-O 3.28Å; Y107-Y121 PolarHBondContact OH-O 2.86Å; M117-Y121 VanDerWaalsContact SD-C 3.5Å; T118-Y121 PolarHBondContact O-N 2.7Å; T118-Y121 VanDerWaalsContact O-N 3.07Å; T118-Y121 VanDerWaalsContact OG1-CD2 3.31Å; T118-Y121 WeakPolarHBondContact OG1-CD2 3.32Å; Y121-L124 PolarHBondContact O-N 3.5Å; Y121-L125 WeakPolarHBondContact O-CB 3.41Å; Y121-L125 PolarHBondContact O-N 2.97Å |
| 122 | A | 93.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 53.3 Ų | 53.3 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -66.9 | -41 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | M117 T118 K119 S120 L125 L126 I193 V239 | M117-A122 HydrophobicContact CG-CB 3.92Å; M117-A122 VanDerWaalsContact SD-CA 3.52Å; M117-A122 HydrophobicContact SD-CB 4.08Å; M117-A122 PolarHBondContact SD-N 2.83Å; M117-A122 VanDerWaalsContact SD-N 3.45Å; T118-A122 PolarHBondContact O-N 3.22Å; K119-A122 PolarHBondContact O-N 3.44Å; S120-A122 VanDerWaalsContact C-N 3.3Å; S120-A122 PolarHBondContact O-N 3.12Å; A122-L125 WeakPolarHBondContact O-CB 3.43Å; A122-L125 PolarHBondContact O-N 2.73Å; A122-L126 PolarHBondContact O-N 3.47Å; A122-I193 HydrophobicContact CB-CD1 4.09Å; A122-I193 HydrophobicContact CB-CG1 4.1Å; A122-I193 HydrophobicContact CB-CG2 3.75Å; A122-V239 HydrophobicContact CB-CG2 4.38Å |
| 123 | N | 93.9 | Very high | 92.7 | Very high | 75 Ų | 75 | 52.7 Ų | 52.7 | 40% | 0.401 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61.4 | -45.3 | 172.2 | -73.3 | -20.5 | 0 | 0 | 0 | 111.4 | K119 S120 L125 L126 I127 I193 | K119-N123 PolarHBondContact O-N 3.28Å; S120-N123 PolarHBondContact O-N 2.92Å; N123-L125 VanDerWaalsContact C-N 3.28Å; N123-L125 PolarHBondContact O-N 2.85Å; N123-L126 PolarHBondContact O-N 3.35Å; N123-I127 WeakPolarHBondContact O-CG1 3.2Å; N123-I127 PolarHBondContact O-N 3.32Å; N123-I127 VanDerWaalsContact O-N 3.09Å; N123-I193 HydrophobicContact CB-CD1 4.42Å; N123-I193 WeakPolarHBondContact OD1-CD1 3.35Å |
| 124 | L | 94.5 | Very high | 93.1 | Very high | 61 Ų | 61 | 51.1 Ų | 51.1 | 32% | 0.319 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -63.4 | -36.4 | 177.5 | -178.6 | 64.3 | 0 | 0 | 0 | 111.4 | Y107 S120 Y121 I127 N128 | Y107-L124 VanDerWaalsContact OH-C 3.31Å; Y107-L124 WeakPolarHBondContact OH-CB 3.35Å; Y107-L124 WeakPolarHBondContact OH-CG 3.47Å; S120-L124 PolarHBondContact O-N 3.49Å; Y121-L124 PolarHBondContact O-N 3.5Å; L124-I127 PolarHBondContact O-N 3.48Å; L124-N128 PolarHBondContact O-N 3.37Å; L124-N128 PolarHBondContact O-ND2 3.36Å |
| 125 | L | 94.7 | Very high | 93.6 | Very high | 4 Ų | 4 | 47 Ų | 47 | 2% | 0.021 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.8 | -46.3 | 177.9 | 175.6 | 57.5 | 0 | 0 | 0 | 110.2 | F103 Y107 L113 M117 Y121 A122 N123 I127 N128 I129 V239 | F103-L125 HydrophobicContact CD2-CD1 3.9Å; F103-L125 HydrophobicContact CE2-CD1 3.67Å; Y107-L125 HydrophobicContact CD1-CB 4.36Å; Y107-L125 HydrophobicContact CD1-CD1 4.16Å; Y107-L125 HydrophobicContact CD1-CD2 4.36Å; Y107-L125 HydrophobicContact CD2-CD1 3.93Å; Y107-L125 HydrophobicContact CE1-CB 3.65Å; Y107-L125 HydrophobicContact CE1-CD1 4.2Å; Y107-L125 HydrophobicContact CE1-CD2 4.38Å; Y107-L125 HydrophobicContact CE1-CG 4.29Å; Y107-L125 HydrophobicContact CE2-CB 4.23Å; Y107-L125 HydrophobicContact CE2-CD1 3.99Å; Y107-L125 HydrophobicContact CG-CD1 4.03Å; Y107-L125 WeakPolarHBondContact OH-CA 3.41Å; Y107-L125 PolarHBondContact OH-N 3.09Å; L113-L125 HydrophobicContact CD2-CD1 4.26Å; L113-L125 HydrophobicContact CD2-CD2 3.63Å; M117-L125 HydrophobicContact CE-CD2 3.74Å; M117-L125 HydrophobicContact SD-CB 4.18Å; M117-L125 HydrophobicContact SD-CD2 3.97Å; Y121-L125 WeakPolarHBondContact O-CB 3.41Å; Y121-L125 PolarHBondContact O-N 2.97Å; A122-L125 WeakPolarHBondContact O-CB 3.43Å; A122-L125 PolarHBondContact O-N 2.73Å; N123-L125 VanDerWaalsContact C-N 3.28Å; N123-L125 PolarHBondContact O-N 2.85Å; L125-I127 VanDerWaalsContact C-N 3.31Å; L125-I127 PolarHBondContact O-N 3.14Å; L125-N128 WeakPolarHBondContact O-CB 3.47Å; L125-N128 PolarHBondContact O-N 2.93Å; L125-N128 VanDerWaalsContact O-N 3.13Å; L125-I129 HydrophobicContact CD1-CD1 3.85Å; L125-I129 HydrophobicContact CD1-CG1 4.02Å; L125-I129 HydrophobicContact CD2-CD1 4.47Å; L125-I129 HydrophobicContact CG-CD1 3.78Å; L125-I129 HydrophobicContact CG-CG1 4.39Å; L125-I129 WeakPolarHBondContact O-CG1 3.2Å; L125-I129 PolarHBondContact O-N 3.12Å; L125-V239 HydrophobicContact CB-CG2 4.16Å; L125-V239 HydrophobicContact CD2-CB 3.94Å; L125-V239 HydrophobicContact CD2-CG2 3.71Å; L125-V239 HydrophobicContact CG-CB 4.43Å; L125-V239 HydrophobicContact CG-CG2 4Å |
| 126 | L | 93.5 | Very high | 94 | Very high | 32 Ų | 32 | 43.4 Ų | 43.4 | 17% | 0.168 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -57.6 | -45.6 | 176.4 | -179.4 | 61.6 | 0 | 0 | 0 | 111.2 | A122 N123 N128 I129 V130 H191 V239 | A122-L126 PolarHBondContact O-N 3.47Å; N123-L126 PolarHBondContact O-N 3.35Å; L126-N128 VanDerWaalsContact C-N 3.35Å; L126-N128 PolarHBondContact O-N 3.03Å; L126-I129 PolarHBondContact O-N 2.98Å; L126-V130 HydrophobicContact CD1-CG2 4.21Å; L126-V130 WeakPolarHBondContact O-CB 3.33Å; L126-V130 WeakPolarHBondContact O-CG2 3.49Å; L126-V130 PolarHBondContact O-N 3.27Å; L126-H191 HydrophobicContact CD1-CB 3.47Å; L126-H191 VanDerWaalsContact CD1-CB 3.47Å; L126-V239 HydrophobicContact CD1-CG1 4.46Å |
| 127 | I | 94.6 | Very high | 94.3 | Very high | 95 Ų | 95 | 43 Ų | 43 | 49% | 0.487 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -60.1 | -44.8 | 175.8 | -66.6 | 166.7 | 0 | 0 | 0 | 110.9 | N123 L124 L125 V130 L131 | N123-I127 WeakPolarHBondContact O-CG1 3.2Å; N123-I127 PolarHBondContact O-N 3.32Å; N123-I127 VanDerWaalsContact O-N 3.09Å; L124-I127 PolarHBondContact O-N 3.48Å; L125-I127 VanDerWaalsContact C-N 3.31Å; L125-I127 PolarHBondContact O-N 3.14Å; I127-V130 PolarHBondContact O-N 3Å; I127-L131 HydrophobicContact CG2-CD1 3.75Å; I127-L131 HydrophobicContact CG2-CG 4.23Å; I127-L131 WeakPolarHBondContact O-CB 3.28Å; I127-L131 VanDerWaalsContact O-CG 3.3Å; I127-L131 WeakPolarHBondContact O-CG 3.37Å; I127-L131 PolarHBondContact O-N 3.18Å |
| 128 | N | 94.9 | Very high | 94.6 | Very high | 6 Ų | 6 | 43.5 Ų | 43.5 | 3% | 0.032 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.6 | -50.9 | 178.3 | -84.2 | -87.8 | 0 | 0 | 0 | 111.7 | I99 I102 L124 L125 L126 V130 L131 Q132 | I99-N128 HydrophobicContact CG2-CB 4.28Å; I99-N128 WeakPolarHBondContact CG2-OD1 3.37Å; I102-N128 WeakPolarHBondContact CG2-OD1 3.33Å; L124-N128 PolarHBondContact O-N 3.37Å; L124-N128 PolarHBondContact O-ND2 3.36Å; L125-N128 WeakPolarHBondContact O-CB 3.47Å; L125-N128 PolarHBondContact O-N 2.93Å; L125-N128 VanDerWaalsContact O-N 3.13Å; L126-N128 VanDerWaalsContact C-N 3.35Å; L126-N128 PolarHBondContact O-N 3.03Å; N128-V130 PolarHBondContact O-N 3.34Å; N128-L131 PolarHBondContact O-N 3.4Å; N128-Q132 WeakPolarHBondContact O-CB 3.3Å; N128-Q132 VanDerWaalsContact O-CG 3.32Å; N128-Q132 WeakPolarHBondContact O-CG 3.49Å; N128-Q132 PolarHBondContact O-N 3.47Å |
| 129 | I | 93.6 | Very high | 94.8 | Very high | 34 Ų | 34 | 40.2 Ų | 40.2 | 17% | 0.174 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -55.6 | -44 | 179 | -69.8 | 167.5 | 0 | 0 | 0 | 110.6 | L125 L126 N133 V239 | L125-I129 HydrophobicContact CD1-CD1 3.85Å; L125-I129 HydrophobicContact CD1-CG1 4.02Å; L125-I129 HydrophobicContact CD2-CD1 4.47Å; L125-I129 HydrophobicContact CG-CD1 3.78Å; L125-I129 HydrophobicContact CG-CG1 4.39Å; L125-I129 WeakPolarHBondContact O-CG1 3.2Å; L125-I129 PolarHBondContact O-N 3.12Å; L126-I129 PolarHBondContact O-N 2.98Å; I129-N133 WeakPolarHBondContact O-CB 3.28Å; I129-N133 VanDerWaalsContact O-CG 3.26Å; I129-N133 PolarHBondContact O-N 2.97Å; I129-N133 PolarHBondContact O-ND2 3.16Å; I129-V239 HydrophobicContact CD1-CG1 4.2Å |
| 130 | V | 94.4 | Very high | 95 | Very high | 17 Ų | 17 | 34.9 Ų | 34.9 | 10% | 0.103 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -68.7 | -46.1 | -177.3 | 168.3 | 0 | 0 | 0 | 0 | 111.3 | L126 I127 N128 N133 L134 M188 | L126-V130 HydrophobicContact CD1-CG2 4.21Å; L126-V130 WeakPolarHBondContact O-CB 3.33Å; L126-V130 WeakPolarHBondContact O-CG2 3.49Å; L126-V130 PolarHBondContact O-N 3.27Å; I127-V130 PolarHBondContact O-N 3Å; N128-V130 PolarHBondContact O-N 3.34Å; V130-N133 PolarHBondContact O-N 3.49Å; V130-L134 WeakPolarHBondContact O-CB 3.34Å; V130-L134 PolarHBondContact O-N 2.99Å; V130-M188 HydrophobicContact CB-SD 3.64Å; V130-M188 HydrophobicContact CG1-CG 3.97Å; V130-M188 HydrophobicContact CG1-SD 3.2Å; V130-M188 WeakPolarHBondContact CG1-SD 3.49Å; V130-M188 HydrophobicContact CG2-CG 4.19Å; V130-M188 HydrophobicContact CG2-SD 3.06Å; V130-M188 WeakPolarHBondContact CG2-SD 3.22Å |
| 131 | L | 95.9 | Very high | 95.3 | Very high | 65 Ų | 65 | 33 Ų | 33 | 34% | 0.34 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -65.1 | -40.1 | 178.6 | -70.2 | 176.4 | 0 | 0 | 0 | 111.4 | I99 I127 N128 L134 F135 | I99-L131 HydrophobicContact CD1-CB 3.7Å; I127-L131 HydrophobicContact CG2-CD1 3.75Å; I127-L131 HydrophobicContact CG2-CG 4.23Å; I127-L131 WeakPolarHBondContact O-CB 3.28Å; I127-L131 VanDerWaalsContact O-CG 3.3Å; I127-L131 WeakPolarHBondContact O-CG 3.37Å; I127-L131 PolarHBondContact O-N 3.18Å; N128-L131 PolarHBondContact O-N 3.4Å; L131-L134 WeakPolarHBondContact O-CB 3.39Å; L131-L134 PolarHBondContact O-N 3.43Å; L131-F135 HydrophobicContact CB-CE2 4.34Å; L131-F135 HydrophobicContact CD2-CE2 4.31Å; L131-F135 WeakPolarHBondContact O-CD2 3.37Å; L131-F135 PolarHBondContact O-N 3.46Å |
| 132 | Q | 95.3 | Very high | 95.4 | Very high | 15 Ų | 15 | 29.4 Ų | 29.4 | 7% | 0.07 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -58.6 | -50.2 | 173.4 | -72.7 | -178.6 | 37.1 | 0 | 0 | 110.9 | I99 Y100 N128 L134 F135 H136 | I99-Q132 HydrophobicContact CB-CG 4.1Å; I99-Q132 HydrophobicContact CG2-CG 3.46Å; I99-Q132 VanDerWaalsContact CG2-CG 3.46Å; Y100-Q132 HydrophobicContact CD2-CG 4.36Å; Y100-Q132 HydrophobicContact CE2-CG 4.39Å; N128-Q132 WeakPolarHBondContact O-CB 3.3Å; N128-Q132 VanDerWaalsContact O-CG 3.32Å; N128-Q132 WeakPolarHBondContact O-CG 3.49Å; N128-Q132 PolarHBondContact O-N 3.47Å; Q132-L134 VanDerWaalsContact C-N 3.27Å; Q132-L134 PolarHBondContact O-N 3.17Å; Q132-F135 PolarHBondContact O-N 2.9Å; Q132-H136 WeakPolarHBondContact O-CB 3.21Å; Q132-H136 PolarHBondContact O-CD2 3.34Å; Q132-H136 VanDerWaalsContact O-CD2 3.25Å; Q132-H136 PolarHBondContact O-N 3.13Å |
| 133 | N | 93.6 | Very high | 95.5 | Very high | 39 Ų | 39 | 29.5 Ų | 29.5 | 21% | 0.209 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -62.2 | -36.3 | 179.3 | -72.8 | -12.6 | 0 | 0 | 0 | 112.4 | I129 V130 A137 T184 F187 | I129-N133 WeakPolarHBondContact O-CB 3.28Å; I129-N133 VanDerWaalsContact O-CG 3.26Å; I129-N133 PolarHBondContact O-N 2.97Å; I129-N133 PolarHBondContact O-ND2 3.16Å; V130-N133 PolarHBondContact O-N 3.49Å; N133-A137 VanDerWaalsContact O-CB 3.24Å; N133-A137 WeakPolarHBondContact O-CB 3.12Å; N133-A137 PolarHBondContact O-N 2.99Å; N133-T184 HydrophobicContact CB-CG2 4.39Å; N133-F187 WeakPolarHBondContact ND2-CD1 3.34Å; N133-F187 WeakPolarHBondContact ND2-CE1 3.43Å; N133-F187 WeakPolarHBondContact ND2-CZ 3.43Å |
| 134 | L | 96.7 | Very high | 95.7 | Very high | 33 Ų | 33 | 26.2 Ų | 26.2 | 17% | 0.173 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -61.9 | -51.6 | 175.3 | 177.1 | 60.9 | 0 | 0 | 0 | 111.6 | V130 L131 Q132 A137 F138 I181 T184 | V130-L134 WeakPolarHBondContact O-CB 3.34Å; V130-L134 PolarHBondContact O-N 2.99Å; L131-L134 WeakPolarHBondContact O-CB 3.39Å; L131-L134 PolarHBondContact O-N 3.43Å; Q132-L134 VanDerWaalsContact C-N 3.27Å; Q132-L134 PolarHBondContact O-N 3.17Å; L134-A137 PolarHBondContact O-N 3.14Å; L134-F138 WeakPolarHBondContact O-CB 3.36Å; L134-F138 PolarHBondContact O-N 3.29Å; L134-I181 HydrophobicContact CD1-CB 4.47Å; L134-I181 HydrophobicContact CD1-CG1 3.83Å; L134-T184 VanDerWaalsContact CA-CG2 3.46Å; L134-T184 HydrophobicContact CB-CG2 3.87Å; L134-T184 HydrophobicContact CD1-CG2 4.11Å |
| 135 | F | 97.8 | Very high | 95.8 | Very high | 46 Ų | 46 | 23.8 Ų | 23.8 | 20% | 0.202 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -74 | -31.9 | -177.2 | -66.2 | -60.6 | 0 | 0 | 0 | 112.7 | L95 V96 I99 L131 Q132 F138 S139 | L95-F135 HydrophobicContact CB-CD1 4.29Å; L95-F135 HydrophobicContact CB-CD2 4.01Å; L95-F135 HydrophobicContact CB-CE1 4.45Å; L95-F135 HydrophobicContact CB-CE2 4.18Å; L95-F135 HydrophobicContact CB-CG 4.08Å; L95-F135 HydrophobicContact CB-CZ 4.4Å; L95-F135 HydrophobicContact CD1-CD1 3.95Å; L95-F135 HydrophobicContact CD1-CE1 3.45Å; L95-F135 VanDerWaalsContact CD1-CE1 3.45Å; L95-F135 HydrophobicContact CD1-CE2 4.21Å; L95-F135 HydrophobicContact CD1-CZ 3.61Å; V96-F135 HydrophobicContact CG2-CB 3.54Å; I99-F135 HydrophobicContact CD1-CD2 3.49Å; I99-F135 VanDerWaalsContact CD1-CD2 3.49Å; I99-F135 HydrophobicContact CD1-CE2 3.68Å; L131-F135 HydrophobicContact CB-CE2 4.34Å; L131-F135 HydrophobicContact CD2-CE2 4.31Å; L131-F135 WeakPolarHBondContact O-CD2 3.37Å; L131-F135 PolarHBondContact O-N 3.46Å; Q132-F135 PolarHBondContact O-N 2.9Å; F135-F138 PolarHBondContact O-N 3.01Å; F135-S139 WeakPolarHBondContact O-CB 3.38Å; F135-S139 PolarHBondContact O-N 3.25Å; F135-S139 PolarHBondContact O-OG 3.38Å |
| 136 | H | 94.9 | Very high | 95.8 | Very high | 23 Ų | 23 | 23.7 Ų | 23.7 | 11% | 0.106 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -63.1 | -46.6 | 169.9 | -86.5 | -65.8 | 0 | 0 | 0 | 112.2 | V96 Y100 Q132 F138 S139 A140 Y367 | V96-H136 VanDerWaalsContact CG1-NE2 3.34Å; V96-H136 WeakPolarHBondContact CG1-NE2 3.5Å; Y100-H136 AromaticContact CE2-NE2 3.65Å; Q132-H136 WeakPolarHBondContact O-CB 3.21Å; Q132-H136 PolarHBondContact O-CD2 3.34Å; Q132-H136 VanDerWaalsContact O-CD2 3.25Å; Q132-H136 PolarHBondContact O-N 3.13Å; H136-F138 VanDerWaalsContact C-N 3.3Å; H136-F138 PolarHBondContact O-N 3.36Å; H136-S139 PolarHBondContact O-N 2.95Å; H136-A140 WeakPolarHBondContact O-CB 3.36Å; H136-A140 PolarHBondContact O-N 3.27Å; H136-Y367 PolarHBondContact ND1-OH 3.39Å |
| 137 | A | 96 | Very high | 95.9 | Very high | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -59.9 | -45 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | N133 L134 A140 W141 V259 | N133-A137 VanDerWaalsContact O-CB 3.24Å; N133-A137 WeakPolarHBondContact O-CB 3.12Å; N133-A137 PolarHBondContact O-N 2.99Å; L134-A137 PolarHBondContact O-N 3.14Å; A137-A140 PolarHBondContact O-N 3.36Å; A137-W141 VanDerWaalsContact O-CD1 3.22Å; A137-W141 PolarHBondContact O-N 3.48Å; A137-W141 VanDerWaalsContact O-N 3.07Å; A137-V259 HydrophobicContact CB-CG1 3.96Å |
| 138 | F | 98 | Very high | 95.8 | Very high | 16 Ų | 16 | 20.9 Ų | 20.9 | 7% | 0.07 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -60.9 | -49.4 | 177.3 | 178.9 | -91.3 | 0 | 0 | 0 | 112.3 | F88 S92 L134 F135 H136 A140 W141 I142 V176 I177 S180 | F88-F138 HydrophobicContact CB-CE1 4.31Å; F88-F138 HydrophobicContact CB-CZ 4.15Å; F88-F138 HydrophobicContact CD1-CZ 4.03Å; S92-F138 WeakPolarHBondContact OG-CD1 3.44Å; L134-F138 WeakPolarHBondContact O-CB 3.36Å; L134-F138 PolarHBondContact O-N 3.29Å; F135-F138 PolarHBondContact O-N 3.01Å; H136-F138 VanDerWaalsContact C-N 3.3Å; H136-F138 PolarHBondContact O-N 3.36Å; F138-A140 PolarHBondContact O-N 2.88Å; F138-W141 PolarHBondContact O-N 3.26Å; F138-I142 HydrophobicContact CD1-CG1 3.9Å; F138-I142 HydrophobicContact CD2-CG1 4.23Å; F138-I142 HydrophobicContact CE1-CD1 4.23Å; F138-I142 HydrophobicContact CE1-CG1 3.47Å; F138-I142 VanDerWaalsContact CE1-CG1 3.47Å; F138-I142 HydrophobicContact CE2-CD1 3.86Å; F138-I142 HydrophobicContact CE2-CG1 3.74Å; F138-I142 HydrophobicContact CG-CG1 4.3Å; F138-I142 HydrophobicContact CZ-CD1 3.63Å; F138-I142 HydrophobicContact CZ-CG1 3.38Å; F138-I142 WeakPolarHBondContact O-CB 3.33Å; F138-I142 WeakPolarHBondContact O-CG1 3.38Å; F138-I142 PolarHBondContact O-N 3.23Å; F138-V176 HydrophobicContact CD2-CG1 3.7Å; F138-V176 HydrophobicContact CE2-CB 4.36Å; F138-V176 HydrophobicContact CE2-CG1 3.89Å; F138-V176 HydrophobicContact CG-CG1 4.48Å; F138-I177 HydrophobicContact CD2-CG1 3.92Å; F138-I177 HydrophobicContact CE2-CB 4.47Å; F138-I177 HydrophobicContact CE2-CD1 4.39Å; F138-I177 HydrophobicContact CE2-CG1 3.42Å; F138-I177 VanDerWaalsContact CE2-CG1 3.42Å; F138-I177 HydrophobicContact CZ-CG1 4.31Å; F138-S180 VanDerWaalsContact CA-OG 3.25Å; F138-S180 WeakPolarHBondContact CA-OG 3.49Å; F138-S180 PolarHBondContact N-OG 2.87Å |
| 139 | S | 96.7 | Very high | 95.8 | Very high | 0 Ų | 0 | 21.4 Ų | 21.4 | 0% | 0 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -55.9 | -48.8 | 176.4 | -75.4 | 0 | 0 | 0 | 0 | 111.3 | S92 D93 F135 H136 W141 I142 I143 | S92-S139 VanDerWaalsContact CB-OG 3.31Å; S92-S139 WeakPolarHBondContact CB-OG 3.3Å; S92-S139 PolarHBondContact OG-OG 3.3Å; D93-S139 WeakPolarHBondContact OD1-CB 3.37Å; D93-S139 PolarHBondContact OD1-OG 2.8Å; F135-S139 WeakPolarHBondContact O-CB 3.38Å; F135-S139 PolarHBondContact O-N 3.25Å; F135-S139 PolarHBondContact O-OG 3.38Å; H136-S139 PolarHBondContact O-N 2.95Å; S139-W141 VanDerWaalsContact C-N 3.35Å; S139-W141 PolarHBondContact O-N 2.8Å; S139-I142 PolarHBondContact O-N 3.41Å; S139-I143 VanDerWaalsContact O-CD1 3.25Å; S139-I143 WeakPolarHBondContact O-CD1 3.49Å; S139-I143 VanDerWaalsContact O-CG1 3.24Å; S139-I143 WeakPolarHBondContact O-CG1 3.42Å; S139-I143 PolarHBondContact O-N 2.89Å |
| 140 | A | 95.9 | Very high | 95.7 | Very high | 8 Ų | 8 | 20.3 Ų | 20.3 | 7% | 0.066 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -57 | -46.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | H136 A137 F138 I143 V144 P263 | H136-A140 WeakPolarHBondContact O-CB 3.36Å; H136-A140 PolarHBondContact O-N 3.27Å; A137-A140 PolarHBondContact O-N 3.36Å; F138-A140 PolarHBondContact O-N 2.88Å; A140-I143 PolarHBondContact O-N 2.73Å; A140-V144 WeakPolarHBondContact O-CG2 3.34Å; A140-V144 PolarHBondContact O-N 2.88Å; A140-P263 HydrophobicContact CB-CB 4.23Å; A140-P263 HydrophobicContact CB-CG 4.44Å |
| 141 | W | 97.8 | Very high | 95.5 | Very high | 49 Ų | 49 | 20.6 Ų | 20.6 | 19% | 0.186 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -76.5 | -29.2 | -179.3 | -78 | 107.5 | 0 | 0 | 0 | 113.7 | A137 F138 S139 I143 V144 A145 V176 L258 L262 P263 I266 | A137-W141 VanDerWaalsContact O-CD1 3.22Å; A137-W141 PolarHBondContact O-N 3.48Å; A137-W141 VanDerWaalsContact O-N 3.07Å; F138-W141 PolarHBondContact O-N 3.26Å; S139-W141 VanDerWaalsContact C-N 3.35Å; S139-W141 PolarHBondContact O-N 2.8Å; W141-I143 VanDerWaalsContact C-N 3.33Å; W141-V144 HydrophobicContact CE3-CB 4.23Å; W141-V144 HydrophobicContact CE3-CG1 4.22Å; W141-V144 HydrophobicContact CE3-CG2 4.3Å; W141-V144 HydrophobicContact CZ3-CG1 4.34Å; W141-V144 WeakPolarHBondContact O-CB 3.47Å; W141-V144 PolarHBondContact O-N 3.5Å; W141-A145 PolarHBondContact O-N 3.39Å; W141-V176 HydrophobicContact CB-CG1 3.63Å; W141-V176 HydrophobicContact CB-CG2 4.47Å; W141-L258 WeakPolarHBondContact CZ2-O 3.43Å; W141-L258 PolarHBondContact NE1-O 3.46Å; W141-L262 HydrophobicContact CH2-CD2 3.18Å; W141-L262 HydrophobicContact CZ2-CD2 3.63Å; W141-L262 HydrophobicContact CZ3-CD2 4.14Å; W141-P263 HydrophobicContact CD2-CG 4.21Å; W141-P263 HydrophobicContact CZ2-CG 4Å; W141-I266 HydrophobicContact CH2-CD1 4.45Å; W141-I266 HydrophobicContact CZ3-CD1 4.32Å |
| 142 | I | 97.8 | Very high | 95.2 | Very high | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -63.9 | -39.4 | 169.6 | -74.7 | -61.6 | 0 | 0 | 0 | 110.8 | L85 L89 F138 S139 V144 A145 V146 I173 V176 | L85-I142 HydrophobicContact CD2-CD1 4.49Å; L85-I142 WeakPolarHBondContact O-CG2 2.95Å; L89-I142 HydrophobicContact CB-CG2 3.81Å; L89-I142 HydrophobicContact CD1-CG2 4.45Å; F138-I142 HydrophobicContact CD1-CG1 3.9Å; F138-I142 HydrophobicContact CD2-CG1 4.23Å; F138-I142 HydrophobicContact CE1-CD1 4.23Å; F138-I142 HydrophobicContact CE1-CG1 3.47Å; F138-I142 VanDerWaalsContact CE1-CG1 3.47Å; F138-I142 HydrophobicContact CE2-CD1 3.86Å; F138-I142 HydrophobicContact CE2-CG1 3.74Å; F138-I142 HydrophobicContact CG-CG1 4.3Å; F138-I142 HydrophobicContact CZ-CD1 3.63Å; F138-I142 HydrophobicContact CZ-CG1 3.38Å; F138-I142 WeakPolarHBondContact O-CB 3.33Å; F138-I142 WeakPolarHBondContact O-CG1 3.38Å; F138-I142 PolarHBondContact O-N 3.23Å; S139-I142 PolarHBondContact O-N 3.41Å; I142-V144 PolarHBondContact O-N 3.22Å; I142-A145 CarbonylContact O-C 3.58Å; I142-A145 WeakPolarHBondContact O-CB 3.27Å; I142-A145 PolarHBondContact O-N 3.28Å; I142-A145 VanDerWaalsContact O-N 3.16Å; I142-V146 HydrophobicContact CG2-CG2 4.23Å; I142-V146 VanDerWaalsContact O-CG2 3.28Å; I142-V146 WeakPolarHBondContact O-CG2 3.14Å; I142-V146 PolarHBondContact O-N 2.85Å; I142-I173 HydrophobicContact CD1-CG1 4.3Å; I142-V176 HydrophobicContact CD1-CB 4.07Å; I142-V176 HydrophobicContact CD1-CG1 3.88Å; I142-V176 HydrophobicContact CD1-CG2 4.33Å; I142-V176 HydrophobicContact CG1-CG1 3.92Å |
| 143 | I | 95.7 | Very high | 94.9 | Very high | 2 Ų | 2 | 24.4 Ų | 24.4 | 1% | 0.01 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -65.9 | -41.1 | 177.8 | -61.3 | 152 | 0 | 0 | 0 | 110.9 | L89 S139 A140 W141 A145 V146 A147 M267 I360 Y363 | L89-I143 HydrophobicContact CD1-CD1 3.96Å; L89-I143 HydrophobicContact CD1-CG1 3.68Å; L89-I143 HydrophobicContact CD2-CG1 3.82Å; L89-I143 HydrophobicContact CG-CG1 4.41Å; S139-I143 VanDerWaalsContact O-CD1 3.25Å; S139-I143 WeakPolarHBondContact O-CD1 3.49Å; S139-I143 VanDerWaalsContact O-CG1 3.24Å; S139-I143 WeakPolarHBondContact O-CG1 3.42Å; S139-I143 PolarHBondContact O-N 2.89Å; A140-I143 PolarHBondContact O-N 2.73Å; W141-I143 VanDerWaalsContact C-N 3.33Å; I143-A145 VanDerWaalsContact C-N 3.3Å; I143-A145 PolarHBondContact O-N 2.88Å; I143-V146 WeakPolarHBondContact O-CB 3.09Å; I143-V146 PolarHBondContact O-N 3.28Å; I143-A147 WeakPolarHBondContact O-CB 3.47Å; I143-A147 PolarHBondContact O-N 3.46Å; I143-M267 HydrophobicContact CB-SD 3.81Å; I143-M267 HydrophobicContact CG2-CG 4.33Å; I143-M267 HydrophobicContact CG2-SD 3.34Å; I143-M267 WeakPolarHBondContact CG2-SD 3.15Å; I143-I360 HydrophobicContact CG2-CG1 3.78Å; I143-Y363 HydrophobicContact CD1-CD1 3.33Å; I143-Y363 HydrophobicContact CD1-CD2 3.58Å; I143-Y363 HydrophobicContact CD1-CE1 3.21Å; I143-Y363 HydrophobicContact CD1-CE2 3.48Å; I143-Y363 VanDerWaalsContact CD1-CE2 3.48Å; I143-Y363 HydrophobicContact CD1-CG 3.5Å; I143-Y363 HydrophobicContact CG1-CD2 4.38Å; I143-Y363 HydrophobicContact CG1-CE2 4.26Å |
| 144 | V | 97.1 | Very high | 94.4 | Very high | 6 Ų | 6 | 24.2 Ų | 24.2 | 4% | 0.036 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -55 | -48.7 | 170.8 | 171.4 | 0 | 0 | 0 | 0 | 110.2 | A140 W141 I142 V146 A147 I148 P263 I266 M267 | A140-V144 WeakPolarHBondContact O-CG2 3.34Å; A140-V144 PolarHBondContact O-N 2.88Å; W141-V144 HydrophobicContact CE3-CB 4.23Å; W141-V144 HydrophobicContact CE3-CG1 4.22Å; W141-V144 HydrophobicContact CE3-CG2 4.3Å; W141-V144 HydrophobicContact CZ3-CG1 4.34Å; W141-V144 WeakPolarHBondContact O-CB 3.47Å; W141-V144 PolarHBondContact O-N 3.5Å; I142-V144 PolarHBondContact O-N 3.22Å; V144-V146 PolarHBondContact O-N 2.93Å; V144-A147 PolarHBondContact O-N 2.72Å; V144-I148 HydrophobicContact CG1-CD1 3.73Å; V144-I148 HydrophobicContact CG1-CG1 4.5Å; V144-I148 WeakPolarHBondContact O-CG1 3.48Å; V144-I148 PolarHBondContact O-N 3.35Å; V144-P263 HydrophobicContact CG2-CB 3.95Å; V144-I266 HydrophobicContact CG1-CB 4.35Å; V144-I266 HydrophobicContact CG1-CG2 3.63Å; V144-M267 HydrophobicContact CB-CG 4.5Å; V144-M267 HydrophobicContact CG2-CG 3.61Å; V144-M267 HydrophobicContact CG2-SD 4.31Å |
| 145 | A | 96.9 | Very high | 93.9 | Very high | 9 Ų | 9 | 29.2 Ų | 29.2 | 7% | 0.074 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -61.4 | -43.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | W141 I142 I143 A147 I148 F149 V172 | W141-A145 PolarHBondContact O-N 3.39Å; I142-A145 CarbonylContact O-C 3.58Å; I142-A145 WeakPolarHBondContact O-CB 3.27Å; I142-A145 PolarHBondContact O-N 3.28Å; I142-A145 VanDerWaalsContact O-N 3.16Å; I143-A145 VanDerWaalsContact C-N 3.3Å; I143-A145 PolarHBondContact O-N 2.88Å; A145-A147 VanDerWaalsContact C-N 3.34Å; A145-A147 PolarHBondContact O-N 3.05Å; A145-I148 PolarHBondContact O-N 2.72Å; A145-F149 WeakPolarHBondContact O-CB 3.33Å; A145-F149 WeakPolarHBondContact O-CD2 3.39Å; A145-F149 PolarHBondContact O-N 2.92Å; A145-V172 HydrophobicContact CB-CG1 3.67Å |
| 146 | V | 94.9 | Very high | 93.3 | Very high | 3 Ų | 3 | 29.1 Ų | 29.1 | 2% | 0.018 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -57.3 | -47.7 | 174.7 | 167.7 | 0 | 0 | 0 | 0 | 110.7 | T82 L85 L86 I142 I143 V144 I148 F149 R150 L356 | T82-V146 HydrophobicContact CG2-CG1 4.33Å; L85-V146 HydrophobicContact CB-CG2 3.47Å; L85-V146 VanDerWaalsContact CB-CG2 3.47Å; L85-V146 HydrophobicContact CD1-CG2 4.19Å; L85-V146 HydrophobicContact CG-CG2 4.45Å; L86-V146 HydrophobicContact CD2-CG1 4.03Å; L86-V146 HydrophobicContact CD2-CG2 4.13Å; I142-V146 HydrophobicContact CG2-CG2 4.23Å; I142-V146 VanDerWaalsContact O-CG2 3.28Å; I142-V146 WeakPolarHBondContact O-CG2 3.14Å; I142-V146 PolarHBondContact O-N 2.85Å; I143-V146 WeakPolarHBondContact O-CB 3.09Å; I143-V146 PolarHBondContact O-N 3.28Å; V144-V146 PolarHBondContact O-N 2.93Å; V146-I148 PolarHBondContact O-N 2.89Å; V146-F149 PolarHBondContact O-N 3.4Å; V146-R150 VanDerWaalsContact O-CB 3.29Å; V146-R150 WeakPolarHBondContact O-CB 3.2Å; V146-R150 PolarHBondContact O-N 3.3Å; V146-L356 HydrophobicContact CG1-CD1 4.5Å; V146-L356 HydrophobicContact CG1-CD2 3.57Å |
| 147 | A | 94.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -62.1 | -44.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | I143 V144 A145 R150 L151 V270 I360 | I143-A147 WeakPolarHBondContact O-CB 3.47Å; I143-A147 PolarHBondContact O-N 3.46Å; V144-A147 PolarHBondContact O-N 2.72Å; A145-A147 VanDerWaalsContact C-N 3.34Å; A145-A147 PolarHBondContact O-N 3.05Å; A147-R150 PolarHBondContact O-N 2.9Å; A147-L151 WeakPolarHBondContact O-CB 3.43Å; A147-L151 PolarHBondContact O-N 3.49Å; A147-V270 HydrophobicContact CB-CB 4.31Å; A147-V270 HydrophobicContact CB-CG1 3.59Å; A147-V270 WeakPolarHBondContact O-CG1 3.48Å; A147-I360 HydrophobicContact CB-CD1 3.63Å; A147-I360 HydrophobicContact CB-CG1 4.49Å |
| 148 | I | 94.3 | Very high | 91.9 | Very high | 67 Ų | 67 | 36.9 Ų | 36.9 | 34% | 0.344 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -65.4 | -48.8 | 178.1 | -67.9 | 168.7 | 0 | 0 | 0 | 110.9 | V144 A145 V146 R150 L151 I152 I266 V270 | V144-I148 HydrophobicContact CG1-CD1 3.73Å; V144-I148 HydrophobicContact CG1-CG1 4.5Å; V144-I148 WeakPolarHBondContact O-CG1 3.48Å; V144-I148 PolarHBondContact O-N 3.35Å; A145-I148 PolarHBondContact O-N 2.72Å; V146-I148 PolarHBondContact O-N 2.89Å; I148-R150 PolarHBondContact O-N 3.41Å; I148-L151 PolarHBondContact O-N 3.36Å; I148-L151 VanDerWaalsContact O-N 3.11Å; I148-I152 HydrophobicContact CG2-CD1 3.82Å; I148-I152 HydrophobicContact CG2-CG1 4.44Å; I148-I152 WeakPolarHBondContact O-CG1 3.38Å; I148-I152 PolarHBondContact O-N 3.09Å; I148-I266 HydrophobicContact CD1-CG2 4.5Å; I148-V270 HydrophobicContact CG1-CG2 4.11Å |
| 149 | F | 93.1 | Very high | 91.1 | Very high | 17 Ų | 17 | 44.7 Ų | 44.7 | 8% | 0.075 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -56.4 | -40.6 | 176 | -97.8 | -110.4 | 0 | 0 | 0 | 111.3 | P81 L85 A145 V146 Y153 C164 K168 A169 V172 | P81-F149 HydrophobicContact CB-CD1 4.41Å; P81-F149 HydrophobicContact CB-CE1 4.42Å; L85-F149 HydrophobicContact CD1-CB 4.06Å; L85-F149 HydrophobicContact CD1-CD1 4.17Å; L85-F149 HydrophobicContact CD1-CD2 3.99Å; L85-F149 HydrophobicContact CD1-CG 3.79Å; A145-F149 WeakPolarHBondContact O-CB 3.33Å; A145-F149 WeakPolarHBondContact O-CD2 3.39Å; A145-F149 PolarHBondContact O-N 2.92Å; V146-F149 PolarHBondContact O-N 3.4Å; F149-Y153 WeakPolarHBondContact O-CB 3.43Å; F149-Y153 PolarHBondContact O-N 3.45Å; F149-C164 HydrophobicContact CD1-CB 4.38Å; F149-C164 PolarHBondContact O-SG 3.46Å; F149-K168 HydrophobicContact CZ-CB 4.36Å; F149-A169 HydrophobicContact CE1-CB 4.06Å; F149-A169 HydrophobicContact CZ-CB 4.39Å; F149-V172 HydrophobicContact CE2-CB 4.18Å; F149-V172 HydrophobicContact CE2-CG1 4.16Å; F149-V172 HydrophobicContact CE2-CG2 3.63Å; F149-V172 HydrophobicContact CZ-CB 4.45Å; F149-V172 HydrophobicContact CZ-CG2 3.88Å |
| 150 | R | 91.6 | Very high | 90.3 | Very high | 11 Ų | 11 | 44.8 Ų | 44.8 | 4% | 0.042 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -67.4 | -40.9 | 178.4 | -173.1 | 61.9 | -169.7 | -178.4 | 24.9 | 112.1 | V146 A147 I148 Y153 I154 L274 A349 T353 L356 | V146-R150 VanDerWaalsContact O-CB 3.29Å; V146-R150 WeakPolarHBondContact O-CB 3.2Å; V146-R150 PolarHBondContact O-N 3.3Å; A147-R150 PolarHBondContact O-N 2.9Å; I148-R150 PolarHBondContact O-N 3.41Å; R150-Y153 PolarHBondContact O-N 3.15Å; R150-I154 HydrophobicContact CG-CD1 4.14Å; R150-I154 WeakPolarHBondContact O-CG1 3.25Å; R150-I154 PolarHBondContact O-N 3.4Å; R150-I154 VanDerWaalsContact O-N 3.07Å; R150-L274 HydrophobicContact CB-CD2 4.28Å; R150-L274 HydrophobicContact CG-CD2 3.94Å; R150-A349 PolarHBondContact NH2-O 2.91Å; R150-T353 HydrophobicContact CG-CG2 4.1Å; R150-T353 PolarHBondContact NE-OG1 3.46Å; R150-T353 PolarHBondContact NH2-OG1 3.2Å; R150-L356 HydrophobicContact CB-CD1 4.1Å; R150-L356 HydrophobicContact CG-CD1 3.72Å |
| 151 | L | 90.9 | Very high | 89.4 | Confident | 24 Ų | 24 | 48.2 Ų | 48.2 | 13% | 0.126 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -64.3 | -43.6 | 178.4 | -177.8 | 62.3 | 0 | 0 | 0 | 111.2 | A147 I148 I154 K155 V270 A273 L274 | A147-L151 WeakPolarHBondContact O-CB 3.43Å; A147-L151 PolarHBondContact O-N 3.49Å; I148-L151 PolarHBondContact O-N 3.36Å; I148-L151 VanDerWaalsContact O-N 3.11Å; L151-I154 PolarHBondContact O-N 2.99Å; L151-K155 HydrophobicContact CD1-CD 3.98Å; L151-K155 HydrophobicContact CD1-CG 4.17Å; L151-K155 HydrophobicContact CG-CD 4.12Å; L151-K155 WeakPolarHBondContact O-CB 3.43Å; L151-K155 WeakPolarHBondContact O-CG 3.42Å; L151-K155 PolarHBondContact O-N 3.43Å; L151-V270 HydrophobicContact CB-CG1 4.2Å; L151-V270 HydrophobicContact CD2-CG1 4.1Å; L151-A273 HydrophobicContact CD1-CB 4.11Å; L151-A273 HydrophobicContact CD2-CB 3.98Å; L151-L274 VanDerWaalsContact CA-CD2 3.48Å; L151-L274 HydrophobicContact CB-CD2 3.83Å; L151-L274 HydrophobicContact CB-CG 4.14Å; L151-L274 HydrophobicContact CD1-CD2 3.9Å; L151-L274 HydrophobicContact CD1-CG 4.05Å; L151-L274 HydrophobicContact CG-CD2 4.5Å |
| 152 | I | 90.7 | Very high | 88.7 | Confident | 61 Ų | 61 | 51.7 Ų | 51.7 | 31% | 0.313 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -61.5 | -46.5 | 175.8 | -65.8 | 168.1 | 0 | 0 | 0 | 110.2 | I148 I154 K155 T156 Y163 | I148-I152 HydrophobicContact CG2-CD1 3.82Å; I148-I152 HydrophobicContact CG2-CG1 4.44Å; I148-I152 WeakPolarHBondContact O-CG1 3.38Å; I148-I152 PolarHBondContact O-N 3.09Å; I152-I154 VanDerWaalsContact C-N 3.35Å; I152-I154 PolarHBondContact O-N 3.31Å; I152-K155 PolarHBondContact O-N 2.95Å; I152-T156 HydrophobicContact CG2-CG2 4.08Å; I152-T156 WeakPolarHBondContact O-CB 3.46Å; I152-T156 WeakPolarHBondContact O-CG2 3.33Å; I152-T156 PolarHBondContact O-N 3.14Å; I152-T156 PolarHBondContact O-OG1 3.38Å; I152-Y163 HydrophobicContact CG2-CG 4.29Å |
| 153 | Y | 87.4 | Confident | 87.9 | Confident | 99 Ų | 99 | 58 Ų | 58 | 39% | 0.388 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -56.3 | -46.7 | 178.9 | -179.1 | -89.4 | 0 | 0 | 0 | 112.1 | F149 R150 G157 A160 C164 A349 | F149-Y153 WeakPolarHBondContact O-CB 3.43Å; F149-Y153 PolarHBondContact O-N 3.45Å; R150-Y153 PolarHBondContact O-N 3.15Å; Y153-G157 PolarHBondContact O-N 2.91Å; Y153-A160 HydrophobicContact CD2-CB 3.64Å; Y153-A160 HydrophobicContact CE2-CB 4.13Å; Y153-A160 HydrophobicContact CG-CB 4.22Å; Y153-C164 HydrophobicContact CD2-CB 4.49Å; Y153-A349 HydrophobicContact CE1-CB 4.45Å |
| 154 | I | 84.6 | Confident | 87.5 | Confident | 34 Ų | 34 | 58.5 Ų | 58.5 | 17% | 0.174 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -70.7 | -43.7 | -178.9 | -64.5 | 170.7 | 0 | 0 | 0 | 111.8 | R150 L151 I152 L274 S277 I278 T353 | R150-I154 HydrophobicContact CG-CD1 4.14Å; R150-I154 WeakPolarHBondContact O-CG1 3.25Å; R150-I154 PolarHBondContact O-N 3.4Å; R150-I154 VanDerWaalsContact O-N 3.07Å; L151-I154 PolarHBondContact O-N 2.99Å; I152-I154 VanDerWaalsContact C-N 3.35Å; I152-I154 PolarHBondContact O-N 3.31Å; I154-L274 HydrophobicContact CD1-CD2 3.8Å; I154-S277 WeakPolarHBondContact CG2-OG 3.24Å; I154-I278 HydrophobicContact CD1-CG1 4.34Å; I154-T353 HydrophobicContact CD1-CG2 3.41Å; I154-T353 VanDerWaalsContact CD1-CG2 3.41Å |
| 155 | K | 86.2 | Confident | 87.2 | Confident | 139 Ų | 139 | 62.3 Ų | 62.3 | 60% | 0.604 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -70.2 | -36.9 | -177 | -77.3 | -174.5 | 168.2 | 178.2 | 0 | 113.2 | L151 I152 | L151-K155 HydrophobicContact CD1-CD 3.98Å; L151-K155 HydrophobicContact CD1-CG 4.17Å; L151-K155 HydrophobicContact CG-CD 4.12Å; L151-K155 WeakPolarHBondContact O-CB 3.43Å; L151-K155 WeakPolarHBondContact O-CG 3.42Å; L151-K155 PolarHBondContact O-N 3.43Å; I152-K155 PolarHBondContact O-N 2.95Å |
| 156 | T | 85 | Confident | 87 | Confident | 43 Ų | 43 | 63.7 Ų | 63.7 | 26% | 0.264 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -87.8 | -17.8 | -175.3 | 60.9 | 0 | 0 | 0 | 0 | 113.4 | I152 V158 R159 A160 Y163 | I152-T156 HydrophobicContact CG2-CG2 4.08Å; I152-T156 WeakPolarHBondContact O-CB 3.46Å; I152-T156 WeakPolarHBondContact O-CG2 3.33Å; I152-T156 PolarHBondContact O-N 3.14Å; I152-T156 PolarHBondContact O-OG1 3.38Å; T156-V158 PolarHBondContact O-N 3.01Å; T156-R159 PolarHBondContact O-N 2.97Å; T156-R159 VanDerWaalsContact O-N 3.1Å; T156-A160 VanDerWaalsContact OG1-CA 3.26Å; T156-A160 WeakPolarHBondContact OG1-CA 3.27Å; T156-A160 WeakPolarHBondContact OG1-CB 3.22Å; T156-A160 PolarHBondContact OG1-N 3.34Å; T156-Y163 HydrophobicContact CG2-CD2 4.01Å; T156-Y163 HydrophobicContact CG2-CE2 4.28Å |
| 157 | G | 81 | Confident | 87 | Confident | 43 Ų | 43 | 70.3 Ų | 70.3 | 44% | 0.443 | 36% | 0.357 | S | S | . | . | G | 310 helix | trans | 58 | -119 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y153 R159 A160 | Y153-G157 PolarHBondContact O-N 2.91Å; G157-R159 PolarHBondContact O-N 2.79Å; G157-A160 WeakPolarHBondContact O-CB 3.08Å; G157-A160 PolarHBondContact O-N 3.08Å |
| 158 | V | 78.7 | Confident | 87 | Confident | 144 Ų | 144 | 75.5 Ų | 75.5 | 87% | 0.873 | 38% | 0.38 | S | S | * | . | G | 310 helix | trans | -60.1 | -32.8 | 180 | -176.5 | 0 | 0 | 0 | 0 | 112.1 | T156 A160 | T156-V158 PolarHBondContact O-N 3.01Å; V158-A160 PolarHBondContact O-N 2.83Å |
| 159 | R | 82 | Confident | 87 | Confident | 179 Ų | 179 | 72.3 Ų | 72.3 | 68% | 0.675 | 36% | 0.363 | S | S | * | . | G | 310 helix | trans | -71.4 | -7.9 | 177.3 | -64.6 | -179 | 178 | -178.6 | -1.5 | 113 | T156 G157 A161 I162 Y163 | T156-R159 PolarHBondContact O-N 2.97Å; T156-R159 VanDerWaalsContact O-N 3.1Å; G157-R159 PolarHBondContact O-N 2.79Å; R159-A161 PolarHBondContact O-N 2.85Å; R159-I162 WeakPolarHBondContact O-CB 3.42Å; R159-I162 PolarHBondContact O-N 3.41Å; R159-Y163 HydrophobicContact CB-CE2 4.45Å; R159-Y163 WeakPolarHBondContact O-CD2 3.25Å |
| 160 | A | 80.8 | Confident | 87.3 | Confident | 3 Ų | 3 | 77 Ų | 77 | 3% | 0.025 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -59.1 | -26.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y153 T156 G157 V158 I162 Y163 C164 | Y153-A160 HydrophobicContact CD2-CB 3.64Å; Y153-A160 HydrophobicContact CE2-CB 4.13Å; Y153-A160 HydrophobicContact CG-CB 4.22Å; T156-A160 VanDerWaalsContact OG1-CA 3.26Å; T156-A160 WeakPolarHBondContact OG1-CA 3.27Å; T156-A160 WeakPolarHBondContact OG1-CB 3.22Å; T156-A160 PolarHBondContact OG1-N 3.34Å; G157-A160 WeakPolarHBondContact O-CB 3.08Å; G157-A160 PolarHBondContact O-N 3.08Å; V158-A160 PolarHBondContact O-N 2.83Å; A160-I162 PolarHBondContact O-N 2.89Å; A160-I162 VanDerWaalsContact O-N 3.16Å; A160-Y163 PolarHBondContact O-N 3.27Å; A160-C164 WeakPolarHBondContact O-CA 3.26Å; A160-C164 WeakPolarHBondContact O-CB 3.4Å; A160-C164 PolarHBondContact O-N 3.29Å |
| 161 | A | 76.8 | Confident | 87.6 | Confident | 79 Ų | 79 | 79.5 Ų | 79.5 | 65% | 0.653 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -58.1 | -26.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | R159 | R159-A161 PolarHBondContact O-N 2.85Å |
| 162 | I | 81.9 | Confident | 87.9 | Confident | 122 Ų | 122 | 80 Ų | 80 | 63% | 0.626 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -83 | -45.7 | 177.8 | -62.6 | 160.2 | 0 | 0 | 0 | 110.9 | R159 A160 | R159-I162 WeakPolarHBondContact O-CB 3.42Å; R159-I162 PolarHBondContact O-N 3.41Å; A160-I162 PolarHBondContact O-N 2.89Å; A160-I162 VanDerWaalsContact O-N 3.16Å |
| 163 | Y | 82.6 | Confident | 88.3 | Confident | 134 Ų | 134 | 77.2 Ų | 77.2 | 53% | 0.525 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -85.9 | -39.9 | -172.1 | -63.9 | -75.1 | 0 | 0 | 0 | 113.4 | I152 T156 R159 A160 N165 | I152-Y163 HydrophobicContact CG2-CG 4.29Å; T156-Y163 HydrophobicContact CG2-CD2 4.01Å; T156-Y163 HydrophobicContact CG2-CE2 4.28Å; R159-Y163 HydrophobicContact CB-CE2 4.45Å; R159-Y163 WeakPolarHBondContact O-CD2 3.25Å; A160-Y163 PolarHBondContact O-N 3.27Å; Y163-N165 PolarHBondContact O-N 3.19Å |
| 164 | C | 86.5 | Confident | 88.8 | Confident | 12 Ų | 12 | 76.9 Ų | 76.9 | 8% | 0.081 | 39% | 0.388 | C | S | . | . | S | Bend | trans | -103.6 | 70.1 | -177.1 | -61.9 | 0 | 0 | 0 | 0 | 109.6 | P81 F149 Y153 A160 | P81-C164 HydrophobicContact CG-CB 4.26Å; P81-C164 WeakPolarHBondContact CG-O 3.47Å; F149-C164 HydrophobicContact CD1-CB 4.38Å; F149-C164 PolarHBondContact O-SG 3.46Å; Y153-C164 HydrophobicContact CD2-CB 4.49Å; A160-C164 WeakPolarHBondContact O-CA 3.26Å; A160-C164 WeakPolarHBondContact O-CB 3.4Å; A160-C164 PolarHBondContact O-N 3.29Å |
| 165 | N | 90.6 | Very high | 89.5 | Confident | 86 Ų | 86 | 80.2 Ų | 80.2 | 46% | 0.46 | 41% | 0.405 | S | S | . | . | trans | -110.5 | 158.3 | 172.7 | -166.2 | 1.9 | 0 | 0 | 0 | 111.1 | Y163 F167 K168 A169 | Y163-N165 PolarHBondContact O-N 3.19Å; N165-F167 VanDerWaalsContact C-N 3.3Å; N165-F167 PolarHBondContact O-N 3.16Å; N165-K168 PolarHBondContact O-N 2.91Å; N165-K168 VanDerWaalsContact O-N 3.14Å; N165-A169 PolarHBondContact O-N 3.39Å; N165-A169 VanDerWaalsContact O-N 3.11Å | ||
| 166 | M | 92.5 | Very high | 90 | Very high | 37 Ų | 37 | 74.3 Ų | 74.3 | 18% | 0.182 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -51.6 | -44.6 | -179.6 | -68.6 | -65.3 | 166.1 | 0 | 0 | 113.4 | R79 P81 L84 K168 A169 W170 | R79-M166 HydrophobicContact CG-CE 3.71Å; R79-M166 HydrophobicContact CG-SD 4.48Å; P81-M166 VanDerWaalsContact N-CE 3.26Å; L84-M166 HydrophobicContact CD2-SD 4.37Å; M166-K168 VanDerWaalsContact C-N 3.31Å; M166-K168 PolarHBondContact O-N 3.49Å; M166-A169 WeakPolarHBondContact O-CB 3.48Å; M166-A169 PolarHBondContact O-N 3.23Å; M166-W170 VanDerWaalsContact O-CD1 3.31Å; M166-W170 PolarHBondContact O-N 3.15Å |
| 167 | F | 94.6 | Very high | 90.7 | Very high | 143 Ų | 143 | 75.4 Ų | 75.4 | 63% | 0.627 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -60.4 | -42.4 | -179.2 | 179.6 | -105.9 | 0 | 0 | 0 | 112 | N165 W170 I171 | N165-F167 VanDerWaalsContact C-N 3.3Å; N165-F167 PolarHBondContact O-N 3.16Å; F167-W170 PolarHBondContact O-N 3.32Å; F167-I171 HydrophobicContact CD1-CD1 3.86Å; F167-I171 HydrophobicContact CE1-CD1 3.36Å; F167-I171 HydrophobicContact CE1-CG1 4.39Å; F167-I171 HydrophobicContact CZ-CD1 3.74Å; F167-I171 HydrophobicContact CZ-CG1 4.43Å; F167-I171 PolarHBondContact O-N 2.93Å; F167-I171 VanDerWaalsContact O-N 3.12Å |
| 168 | K | 94.5 | Very high | 91.5 | Very high | 109 Ų | 109 | 77.5 Ų | 77.5 | 47% | 0.474 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -68 | -37.7 | 176.8 | -64.6 | -66.9 | -172.4 | 176.5 | 0 | 111.6 | F149 N165 M166 W170 I171 V172 | F149-K168 HydrophobicContact CZ-CB 4.36Å; N165-K168 PolarHBondContact O-N 2.91Å; N165-K168 VanDerWaalsContact O-N 3.14Å; M166-K168 VanDerWaalsContact C-N 3.31Å; M166-K168 PolarHBondContact O-N 3.49Å; K168-W170 VanDerWaalsContact C-N 3.34Å; K168-W170 PolarHBondContact O-N 3.24Å; K168-I171 PolarHBondContact O-N 3.02Å; K168-V172 WeakPolarHBondContact O-CG2 3.3Å; K168-V172 PolarHBondContact O-N 3.47Å |
| 169 | A | 96.2 | Very high | 92.3 | Very high | 0 Ų | 0 | 72.9 Ų | 72.9 | 0% | 0 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -61.3 | -41.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | P81 L84 F149 N165 M166 V172 I173 | P81-A169 HydrophobicContact CB-CB 3.91Å; L84-A169 HydrophobicContact CD2-CB 3.99Å; F149-A169 HydrophobicContact CE1-CB 4.06Å; F149-A169 HydrophobicContact CZ-CB 4.39Å; N165-A169 PolarHBondContact O-N 3.39Å; N165-A169 VanDerWaalsContact O-N 3.11Å; M166-A169 WeakPolarHBondContact O-CB 3.48Å; M166-A169 PolarHBondContact O-N 3.23Å; A169-V172 PolarHBondContact O-N 3.36Å; A169-I173 WeakPolarHBondContact O-CG1 3.19Å; A169-I173 PolarHBondContact O-N 3.42Å |
| 170 | W | 97.4 | Very high | 93.1 | Very high | 116 Ų | 116 | 64.3 Ų | 64.3 | 44% | 0.439 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62 | -45.2 | 173.7 | -83.9 | 111.4 | 0 | 0 | 0 | 113.5 | L84 F88 M166 F167 K168 V172 I173 I174 | L84-W170 HydrophobicContact CD1-CH2 4.49Å; L84-W170 HydrophobicContact CD1-CZ2 3.94Å; L84-W170 HydrophobicContact CD2-CD2 4.15Å; L84-W170 HydrophobicContact CD2-CG 4.14Å; L84-W170 HydrophobicContact CD2-CZ2 4.42Å; F88-W170 AromaticContact CE2-CH2 3.69Å; F88-W170 HydrophobicContact CE2-CH2 3.69Å; F88-W170 HydrophobicContact CE2-CZ2 4.48Å; F88-W170 AromaticContact CE2-CZ3 3.77Å; F88-W170 HydrophobicContact CE2-CZ3 3.77Å; F88-W170 AromaticContact CZ-CH2 3.67Å; F88-W170 HydrophobicContact CZ-CH2 3.67Å; F88-W170 AromaticContact CZ-CZ3 3.51Å; F88-W170 HydrophobicContact CZ-CZ3 3.51Å; M166-W170 VanDerWaalsContact O-CD1 3.31Å; M166-W170 PolarHBondContact O-N 3.15Å; F167-W170 PolarHBondContact O-N 3.32Å; K168-W170 VanDerWaalsContact C-N 3.34Å; K168-W170 PolarHBondContact O-N 3.24Å; W170-V172 VanDerWaalsContact C-N 3.25Å; W170-V172 PolarHBondContact O-N 3.25Å; W170-I173 HydrophobicContact CE3-CD1 4.32Å; W170-I173 PolarHBondContact O-N 3.5Å; W170-I174 WeakPolarHBondContact O-CG1 3.31Å; W170-I174 PolarHBondContact O-N 3.48Å |
| 171 | I | 97.9 | Very high | 93.8 | Very high | 63 Ų | 63 | 68 Ų | 68 | 32% | 0.323 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -56.7 | -44.7 | 174.7 | -70.5 | 170.4 | 0 | 0 | 0 | 110.3 | F167 K168 I173 I174 L175 | F167-I171 HydrophobicContact CD1-CD1 3.86Å; F167-I171 HydrophobicContact CE1-CD1 3.36Å; F167-I171 HydrophobicContact CE1-CG1 4.39Å; F167-I171 HydrophobicContact CZ-CD1 3.74Å; F167-I171 HydrophobicContact CZ-CG1 4.43Å; F167-I171 PolarHBondContact O-N 2.93Å; F167-I171 VanDerWaalsContact O-N 3.12Å; K168-I171 PolarHBondContact O-N 3.02Å; I171-I173 PolarHBondContact O-N 3.2Å; I171-I174 PolarHBondContact O-N 2.79Å; I171-L175 HydrophobicContact CG2-CD1 3.95Å; I171-L175 HydrophobicContact CG2-CG 4.32Å; I171-L175 WeakPolarHBondContact O-CG 3.5Å; I171-L175 PolarHBondContact O-N 2.9Å |
| 172 | V | 97.9 | Very high | 94.7 | Very high | 34 Ų | 34 | 69.2 Ų | 69.2 | 21% | 0.206 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -63.7 | -41.3 | -179.5 | 169.1 | 0 | 0 | 0 | 0 | 111.3 | L85 A145 F149 K168 A169 W170 I174 L175 V176 | L85-V172 HydrophobicContact CD2-CG1 4.47Å; A145-V172 HydrophobicContact CB-CG1 3.67Å; F149-V172 HydrophobicContact CE2-CB 4.18Å; F149-V172 HydrophobicContact CE2-CG1 4.16Å; F149-V172 HydrophobicContact CE2-CG2 3.63Å; F149-V172 HydrophobicContact CZ-CB 4.45Å; F149-V172 HydrophobicContact CZ-CG2 3.88Å; K168-V172 WeakPolarHBondContact O-CG2 3.3Å; K168-V172 PolarHBondContact O-N 3.47Å; A169-V172 PolarHBondContact O-N 3.36Å; W170-V172 VanDerWaalsContact C-N 3.25Å; W170-V172 PolarHBondContact O-N 3.25Å; V172-I174 PolarHBondContact O-N 3.27Å; V172-L175 PolarHBondContact O-N 3.39Å; V172-V176 HydrophobicContact CG1-CG2 4.43Å; V172-V176 VanDerWaalsContact O-CG2 3.27Å; V172-V176 WeakPolarHBondContact O-CG2 3.23Å; V172-V176 PolarHBondContact O-N 3.26Å |
| 173 | I | 98.6 | Very high | 95.2 | Very high | 2 Ų | 2 | 64.2 Ų | 64.2 | 1% | 0.01 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -58.8 | -48.8 | 174 | -68.8 | 159.1 | 0 | 0 | 0 | 110.5 | L84 L85 F88 I142 A169 W170 I171 L175 V176 I177 | L84-I173 HydrophobicContact CD2-CD1 4.08Å; L84-I173 HydrophobicContact CG-CD1 3.91Å; L85-I173 HydrophobicContact CD2-CD1 4.04Å; L85-I173 HydrophobicContact CD2-CG1 3.64Å; F88-I173 HydrophobicContact CD1-CG2 3.79Å; F88-I173 HydrophobicContact CD2-CD1 3.54Å; F88-I173 HydrophobicContact CD2-CG1 4.34Å; F88-I173 HydrophobicContact CD2-CG2 4.48Å; F88-I173 HydrophobicContact CE1-CG2 3.81Å; F88-I173 HydrophobicContact CE2-CD1 3.79Å; F88-I173 HydrophobicContact CE2-CG2 4.5Å; F88-I173 HydrophobicContact CG-CD1 4.04Å; F88-I173 HydrophobicContact CG-CG1 4.37Å; F88-I173 HydrophobicContact CG-CG2 4.13Å; F88-I173 HydrophobicContact CZ-CD1 4.48Å; F88-I173 HydrophobicContact CZ-CG2 4.18Å; I142-I173 HydrophobicContact CD1-CG1 4.3Å; A169-I173 WeakPolarHBondContact O-CG1 3.19Å; A169-I173 PolarHBondContact O-N 3.42Å; W170-I173 HydrophobicContact CE3-CD1 4.32Å; W170-I173 PolarHBondContact O-N 3.5Å; I171-I173 PolarHBondContact O-N 3.2Å; I173-L175 VanDerWaalsContact C-N 3.33Å; I173-L175 PolarHBondContact O-N 3.02Å; I173-V176 PolarHBondContact O-N 2.85Å; I173-V176 VanDerWaalsContact O-N 3.16Å; I173-I177 HydrophobicContact CG2-CD1 3.99Å; I173-I177 HydrophobicContact CG2-CG1 4.4Å; I173-I177 WeakPolarHBondContact O-CG1 2.97Å; I173-I177 PolarHBondContact O-N 3.07Å |
| 174 | I | 98.5 | Very high | 95.7 | Very high | 92 Ų | 92 | 58.4 Ų | 58.4 | 47% | 0.472 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -59.4 | -44.5 | 179.3 | -67.3 | 167.3 | 0 | 0 | 0 | 110.9 | W170 I171 V172 V176 I177 I178 | W170-I174 WeakPolarHBondContact O-CG1 3.31Å; W170-I174 PolarHBondContact O-N 3.48Å; I171-I174 PolarHBondContact O-N 2.79Å; V172-I174 PolarHBondContact O-N 3.27Å; I174-V176 VanDerWaalsContact C-N 3.34Å; I174-V176 PolarHBondContact O-N 3.36Å; I174-I177 PolarHBondContact O-N 2.94Å; I174-I178 HydrophobicContact CG2-CD1 3.86Å; I174-I178 WeakPolarHBondContact O-CG1 3.38Å; I174-I178 PolarHBondContact O-N 3.42Å |
| 175 | L | 98.5 | Very high | 95.9 | Very high | 105 Ų | 105 | 61.5 Ų | 61.5 | 55% | 0.55 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -62.2 | -40.6 | 176.9 | -70 | 174.7 | 0 | 0 | 0 | 112.1 | I171 V172 I173 I178 S179 | I171-L175 HydrophobicContact CG2-CD1 3.95Å; I171-L175 HydrophobicContact CG2-CG 4.32Å; I171-L175 WeakPolarHBondContact O-CG 3.5Å; I171-L175 PolarHBondContact O-N 2.9Å; V172-L175 PolarHBondContact O-N 3.39Å; I173-L175 VanDerWaalsContact C-N 3.33Å; I173-L175 PolarHBondContact O-N 3.02Å; L175-I178 PolarHBondContact O-N 3.24Å; L175-S179 VanDerWaalsContact O-CB 3.28Å; L175-S179 WeakPolarHBondContact O-CB 3.25Å; L175-S179 PolarHBondContact O-N 2.94Å |
| 176 | V | 98.5 | Very high | 95.9 | Very high | 14 Ų | 14 | 58.8 Ų | 58.8 | 9% | 0.085 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -68.4 | -38.8 | 177.6 | 174.4 | 0 | 0 | 0 | 0 | 111.3 | F138 W141 I142 V172 I173 I174 S179 S180 | F138-V176 HydrophobicContact CD2-CG1 3.7Å; F138-V176 HydrophobicContact CE2-CB 4.36Å; F138-V176 HydrophobicContact CE2-CG1 3.89Å; F138-V176 HydrophobicContact CG-CG1 4.48Å; W141-V176 HydrophobicContact CB-CG1 3.63Å; W141-V176 HydrophobicContact CB-CG2 4.47Å; I142-V176 HydrophobicContact CD1-CB 4.07Å; I142-V176 HydrophobicContact CD1-CG1 3.88Å; I142-V176 HydrophobicContact CD1-CG2 4.33Å; I142-V176 HydrophobicContact CG1-CG1 3.92Å; V172-V176 HydrophobicContact CG1-CG2 4.43Å; V172-V176 VanDerWaalsContact O-CG2 3.27Å; V172-V176 WeakPolarHBondContact O-CG2 3.23Å; V172-V176 PolarHBondContact O-N 3.26Å; I173-V176 PolarHBondContact O-N 2.85Å; I173-V176 VanDerWaalsContact O-N 3.16Å; I174-V176 VanDerWaalsContact C-N 3.34Å; I174-V176 PolarHBondContact O-N 3.36Å; V176-S179 PolarHBondContact O-N 3.27Å; V176-S180 VanDerWaalsContact O-CB 3.31Å; V176-S180 WeakPolarHBondContact O-CB 3.14Å; V176-S180 PolarHBondContact O-N 3.34Å; V176-S180 PolarHBondContact O-OG 3.31Å |
| 177 | I | 98.4 | Very high | 95.5 | Very high | 67 Ų | 67 | 57.9 Ų | 57.9 | 34% | 0.344 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -58.5 | -53.2 | 173.1 | -67.4 | 173.6 | 0 | 0 | 0 | 109.9 | F138 I173 I174 S179 S180 I181 | F138-I177 HydrophobicContact CD2-CG1 3.92Å; F138-I177 HydrophobicContact CE2-CB 4.47Å; F138-I177 HydrophobicContact CE2-CD1 4.39Å; F138-I177 HydrophobicContact CE2-CG1 3.42Å; F138-I177 VanDerWaalsContact CE2-CG1 3.42Å; F138-I177 HydrophobicContact CZ-CG1 4.31Å; I173-I177 HydrophobicContact CG2-CD1 3.99Å; I173-I177 HydrophobicContact CG2-CG1 4.4Å; I173-I177 WeakPolarHBondContact O-CG1 2.97Å; I173-I177 PolarHBondContact O-N 3.07Å; I174-I177 PolarHBondContact O-N 2.94Å; I177-S179 VanDerWaalsContact C-N 3.34Å; I177-S179 PolarHBondContact O-N 3Å; I177-S180 PolarHBondContact O-N 3.38Å; I177-I181 HydrophobicContact CG2-CD1 3.88Å; I177-I181 WeakPolarHBondContact O-CG1 3.4Å; I177-I181 PolarHBondContact O-N 3.45Å |
| 178 | I | 98.4 | Very high | 95.2 | Very high | 87 Ų | 87 | 55.4 Ų | 55.4 | 45% | 0.446 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -59.3 | -47.2 | -179.4 | -67 | 167.5 | 0 | 0 | 0 | 110.3 | I174 L175 S180 I181 L182 | I174-I178 HydrophobicContact CG2-CD1 3.86Å; I174-I178 WeakPolarHBondContact O-CG1 3.38Å; I174-I178 PolarHBondContact O-N 3.42Å; L175-I178 PolarHBondContact O-N 3.24Å; I178-S180 VanDerWaalsContact C-N 3.31Å; I178-S180 PolarHBondContact O-N 3.15Å; I178-I181 PolarHBondContact O-N 3.46Å; I178-L182 HydrophobicContact CG2-CD1 3.99Å; I178-L182 HydrophobicContact CG2-CG 4.43Å; I178-L182 VanDerWaalsContact O-CG 3.31Å; I178-L182 WeakPolarHBondContact O-CG 3.5Å; I178-L182 PolarHBondContact O-N 2.79Å |
| 179 | S | 96.1 | Very high | 94.9 | Very high | 46 Ų | 46 | 55.1 Ų | 55.1 | 32% | 0.322 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -59.9 | -41.6 | 177.8 | -172.6 | 0 | 0 | 0 | 0 | 111.9 | L175 V176 I177 L182 L183 | L175-S179 VanDerWaalsContact O-CB 3.28Å; L175-S179 WeakPolarHBondContact O-CB 3.25Å; L175-S179 PolarHBondContact O-N 2.94Å; V176-S179 PolarHBondContact O-N 3.27Å; I177-S179 VanDerWaalsContact C-N 3.34Å; I177-S179 PolarHBondContact O-N 3Å; S179-L182 PolarHBondContact O-N 3.19Å; S179-L183 WeakPolarHBondContact O-CB 3.09Å; S179-L183 VanDerWaalsContact O-CG 3.22Å; S179-L183 WeakPolarHBondContact O-CG 3.28Å; S179-L183 PolarHBondContact O-N 3.07Å |
| 180 | S | 97.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -67.4 | -42.4 | -179.3 | -55.5 | 0 | 0 | 0 | 0 | 111.2 | F138 V176 I177 I178 L182 L183 T184 | F138-S180 VanDerWaalsContact CA-OG 3.25Å; F138-S180 WeakPolarHBondContact CA-OG 3.49Å; F138-S180 PolarHBondContact N-OG 2.87Å; V176-S180 VanDerWaalsContact O-CB 3.31Å; V176-S180 WeakPolarHBondContact O-CB 3.14Å; V176-S180 PolarHBondContact O-N 3.34Å; V176-S180 PolarHBondContact O-OG 3.31Å; I177-S180 PolarHBondContact O-N 3.38Å; I178-S180 VanDerWaalsContact C-N 3.31Å; I178-S180 PolarHBondContact O-N 3.15Å; S180-L182 PolarHBondContact O-N 3.42Å; S180-L183 PolarHBondContact O-N 3.45Å; S180-T184 WeakPolarHBondContact O-CG2 3.16Å; S180-T184 PolarHBondContact O-N 2.94Å; S180-T184 PolarHBondContact O-OG1 2.83Å |
| 181 | I | 96.7 | Very high | 94.1 | Very high | 80 Ų | 80 | 50.5 Ų | 50.5 | 41% | 0.41 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -58.8 | -49.7 | 173.5 | -66.4 | 169.2 | 0 | 0 | 0 | 110.2 | L134 I177 I178 L183 T184 I185 | L134-I181 HydrophobicContact CD1-CB 4.47Å; L134-I181 HydrophobicContact CD1-CG1 3.83Å; I177-I181 HydrophobicContact CG2-CD1 3.88Å; I177-I181 WeakPolarHBondContact O-CG1 3.4Å; I177-I181 PolarHBondContact O-N 3.45Å; I178-I181 PolarHBondContact O-N 3.46Å; I181-L183 VanDerWaalsContact C-N 3.31Å; I181-L183 PolarHBondContact O-N 3.47Å; I181-T184 PolarHBondContact O-N 3.49Å; I181-T184 PolarHBondContact O-OG1 3.4Å; I181-I185 PolarHBondContact O-N 2.97Å |
| 182 | L | 94.8 | Very high | 93.7 | Very high | 104 Ų | 104 | 50.5 Ų | 50.5 | 55% | 0.545 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -59.2 | -41.3 | 178.9 | -70.7 | 174.2 | 0 | 0 | 0 | 112.3 | I178 S179 S180 T184 I185 | I178-L182 HydrophobicContact CG2-CD1 3.99Å; I178-L182 HydrophobicContact CG2-CG 4.43Å; I178-L182 VanDerWaalsContact O-CG 3.31Å; I178-L182 WeakPolarHBondContact O-CG 3.5Å; I178-L182 PolarHBondContact O-N 2.79Å; S179-L182 PolarHBondContact O-N 3.19Å; S180-L182 PolarHBondContact O-N 3.42Å; L182-T184 VanDerWaalsContact C-N 3.26Å; L182-T184 PolarHBondContact O-N 2.88Å; L182-I185 HydrophobicContact CD2-CD1 3.92Å; L182-I185 PolarHBondContact O-N 2.97Å |
| 183 | L | 93.1 | Very high | 93.4 | Very high | 18 Ų | 18 | 51.2 Ų | 51.2 | 9% | 0.094 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -67.2 | -24.7 | 177 | -70.7 | 174.2 | 0 | 0 | 0 | 112.9 | S179 S180 I181 P186 N254 L258 V259 | S179-L183 WeakPolarHBondContact O-CB 3.09Å; S179-L183 VanDerWaalsContact O-CG 3.22Å; S179-L183 WeakPolarHBondContact O-CG 3.28Å; S179-L183 PolarHBondContact O-N 3.07Å; S180-L183 PolarHBondContact O-N 3.45Å; I181-L183 VanDerWaalsContact C-N 3.31Å; I181-L183 PolarHBondContact O-N 3.47Å; L183-P186 WeakPolarHBondContact O-CD 3.43Å; L183-N254 WeakPolarHBondContact CD2-ND2 3.18Å; L183-N254 PolarHBondContact O-OD1 3.34Å; L183-L258 HydrophobicContact CD2-CB 3.63Å; L183-L258 HydrophobicContact CD2-CD1 3.73Å; L183-L258 HydrophobicContact CD2-CG 4.32Å; L183-V259 HydrophobicContact CB-CG2 4.01Å; L183-V259 HydrophobicContact CD1-CG2 4.35Å |
| 184 | T | 92.6 | Very high | 92.9 | Very high | 11 Ų | 11 | 54.4 Ų | 54.4 | 7% | 0.067 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -83.3 | -13.8 | 175 | 56.5 | 0 | 0 | 0 | 0 | 115.3 | N133 L134 S180 I181 L182 F187 M188 | N133-T184 HydrophobicContact CB-CG2 4.39Å; L134-T184 VanDerWaalsContact CA-CG2 3.46Å; L134-T184 HydrophobicContact CB-CG2 3.87Å; L134-T184 HydrophobicContact CD1-CG2 4.11Å; S180-T184 WeakPolarHBondContact O-CG2 3.16Å; S180-T184 PolarHBondContact O-N 2.94Å; S180-T184 PolarHBondContact O-OG1 2.83Å; I181-T184 PolarHBondContact O-N 3.49Å; I181-T184 PolarHBondContact O-OG1 3.4Å; L182-T184 VanDerWaalsContact C-N 3.26Å; L182-T184 PolarHBondContact O-N 2.88Å; T184-F187 WeakPolarHBondContact O-CA 3.48Å; T184-F187 VanDerWaalsContact O-CB 3.23Å; T184-F187 WeakPolarHBondContact O-CB 3.43Å; T184-F187 PolarHBondContact O-N 3.44Å; T184-F187 VanDerWaalsContact O-N 3.1Å; T184-M188 PolarHBondContact O-N 3.32Å; T184-M188 VanDerWaalsContact O-N 3.09Å |
| 185 | I | 90.9 | Very high | 92.5 | Very high | 77 Ų | 77 | 55.3 Ų | 55.3 | 40% | 0.395 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -59.5 | -45.8 | -179.2 | -67.4 | 172.1 | 0 | 0 | 0 | 112.4 | I181 L182 F187 M188 I189 | I181-I185 PolarHBondContact O-N 2.97Å; L182-I185 HydrophobicContact CD2-CD1 3.92Å; L182-I185 PolarHBondContact O-N 2.97Å; I185-F187 PolarHBondContact O-N 3.44Å; I185-M188 WeakPolarHBondContact O-CB 3.32Å; I185-M188 PolarHBondContact O-N 3.2Å; I185-M188 VanDerWaalsContact O-N 3.16Å; I185-I189 HydrophobicContact CG2-CD1 3.84Å; I185-I189 PolarHBondContact O-N 2.95Å |
| 186 | P | 89.6 | Confident | 91.8 | Very high | 29 Ų | 29 | 52.5 Ų | 52.5 | 19% | 0.188 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -59.1 | -35.4 | 175.1 | -26.1 | 36.6 | 0 | 0 | 0 | 113.1 | L183 I189 A190 I250 N254 | L183-P186 WeakPolarHBondContact O-CD 3.43Å; P186-I189 PolarHBondContact O-N 2.93Å; P186-A190 WeakPolarHBondContact O-CB 3.14Å; P186-A190 PolarHBondContact O-N 3.08Å; P186-I250 HydrophobicContact CB-CG2 4.5Å; P186-N254 HydrophobicContact CB-CB 4.42Å; P186-N254 HydrophobicContact CG-CB 4.4Å |
| 187 | F | 85.1 | Confident | 90.7 | Very high | 18 Ų | 18 | 56 Ų | 56 | 8% | 0.079 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -60.5 | -46.2 | 174.4 | -102.4 | -80.4 | 0 | 0 | 0 | 112.3 | N133 T184 I185 I189 A190 H191 L251 S255 | N133-F187 WeakPolarHBondContact ND2-CD1 3.34Å; N133-F187 WeakPolarHBondContact ND2-CE1 3.43Å; N133-F187 WeakPolarHBondContact ND2-CZ 3.43Å; T184-F187 WeakPolarHBondContact O-CA 3.48Å; T184-F187 VanDerWaalsContact O-CB 3.23Å; T184-F187 WeakPolarHBondContact O-CB 3.43Å; T184-F187 PolarHBondContact O-N 3.44Å; T184-F187 VanDerWaalsContact O-N 3.1Å; I185-F187 PolarHBondContact O-N 3.44Å; F187-I189 PolarHBondContact O-N 3.23Å; F187-A190 PolarHBondContact O-N 3.18Å; F187-H191 AromaticContact CD1-CE1 3.3Å; F187-H191 WeakPolarHBondContact CD1-CE1 3.33Å; F187-H191 AromaticContact CD1-ND1 3.73Å; F187-H191 AromaticContact CE1-CE1 3.58Å; F187-H191 PolarHBondContact O-N 3.31Å; F187-H191 PolarHBondContact O-ND1 3.5Å; F187-L251 HydrophobicContact CB-CD1 4.14Å; F187-L251 HydrophobicContact CD1-CD1 3.75Å; F187-L251 HydrophobicContact CD2-CD1 3.67Å; F187-L251 HydrophobicContact CE1-CD1 4Å; F187-L251 HydrophobicContact CE2-CD1 3.96Å; F187-L251 HydrophobicContact CG-CD1 3.57Å; F187-L251 HydrophobicContact CZ-CD1 4.11Å; F187-S255 VanDerWaalsContact CE2-CB 3.43Å; F187-S255 WeakPolarHBondContact CE2-OG 3.37Å; F187-S255 WeakPolarHBondContact CZ-OG 3.33Å |
| 188 | M | 87.5 | Confident | 88.8 | Confident | 91 Ų | 91 | 57.6 Ų | 57.6 | 45% | 0.448 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -59.1 | -44.8 | 177.9 | -74.2 | -67.4 | -72.1 | 0 | 0 | 112.8 | V130 T184 I185 | V130-M188 HydrophobicContact CB-SD 3.64Å; V130-M188 HydrophobicContact CG1-CG 3.97Å; V130-M188 HydrophobicContact CG1-SD 3.2Å; V130-M188 WeakPolarHBondContact CG1-SD 3.49Å; V130-M188 HydrophobicContact CG2-CG 4.19Å; V130-M188 HydrophobicContact CG2-SD 3.06Å; V130-M188 WeakPolarHBondContact CG2-SD 3.22Å; T184-M188 PolarHBondContact O-N 3.32Å; T184-M188 VanDerWaalsContact O-N 3.09Å; I185-M188 WeakPolarHBondContact O-CB 3.32Å; I185-M188 PolarHBondContact O-N 3.2Å; I185-M188 VanDerWaalsContact O-N 3.16Å |
| 189 | I | 88.7 | Confident | 86.5 | Confident | 103 Ų | 103 | 62.7 Ų | 62.7 | 53% | 0.528 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -74.8 | -32.6 | -176.1 | -61.8 | 167.6 | 0 | 0 | 0 | 110.8 | I185 P186 F187 L247 | I185-I189 HydrophobicContact CG2-CD1 3.84Å; I185-I189 PolarHBondContact O-N 2.95Å; P186-I189 PolarHBondContact O-N 2.93Å; F187-I189 PolarHBondContact O-N 3.23Å; I189-L247 HydrophobicContact CG2-CD1 4.29Å; I189-L247 HydrophobicContact CG2-CD2 4.19Å |
| 190 | A | 87.1 | Confident | 84 | Confident | 1 Ų | 1 | 68.7 Ų | 68.7 | 1% | 0.008 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -80.3 | -26.9 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | P186 F187 Y241 T242 L251 | P186-A190 WeakPolarHBondContact O-CB 3.14Å; P186-A190 PolarHBondContact O-N 3.08Å; F187-A190 PolarHBondContact O-N 3.18Å; A190-Y241 CarbonylContact O-C 3.59Å; A190-Y241 WeakPolarHBondContact O-CA 3.28Å; A190-T242 PolarHBondContact O-N 3.33Å; A190-L251 HydrophobicContact CB-CB 3.81Å; A190-L251 HydrophobicContact CB-CD1 4.02Å; A190-L251 HydrophobicContact CB-CD2 3.38Å; A190-L251 HydrophobicContact CB-CG 3.91Å |
| 191 | H | 89.7 | Confident | 81.4 | Confident | 18 Ų | 18 | 74.6 Ų | 74.6 | 8% | 0.083 | 37% | 0.368 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.6 | 129.6 | 176.7 | -71.2 | 75.7 | 0 | 0 | 0 | 111.1 | L126 F187 V239 Y241 | L126-H191 HydrophobicContact CD1-CB 3.47Å; L126-H191 VanDerWaalsContact CD1-CB 3.47Å; F187-H191 AromaticContact CD1-CE1 3.3Å; F187-H191 WeakPolarHBondContact CD1-CE1 3.33Å; F187-H191 AromaticContact CD1-ND1 3.73Å; F187-H191 AromaticContact CE1-CE1 3.58Å; F187-H191 PolarHBondContact O-N 3.31Å; F187-H191 PolarHBondContact O-ND1 3.5Å; H191-V239 HydrophobicContact CB-CG1 4.25Å; H191-Y241 AromaticContact CE1-CD1 3.83Å; H191-Y241 AromaticContact CE1-CE1 3.33Å; H191-Y241 WeakPolarHBondContact CE1-CE1 3.48Å; H191-Y241 AromaticContact NE2-CD1 3.81Å; H191-Y241 AromaticContact NE2-CE1 3.24Å; H191-Y241 WeakPolarHBondContact NE2-CE1 3.38Å; H191-Y241 AromaticContact NE2-CZ 3.8Å |
| 192 | Q | 90.2 | Very high | 78.8 | Confident | 64 Ų | 64 | 77.7 Ų | 77.7 | 30% | 0.299 | 39% | 0.385 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136 | 148.7 | -179.8 | 58.3 | 178.9 | 22.6 | 0 | 0 | 111.9 | R194 D240 | Q192-R194 HydrophobicContact CG-CG 4.3Å; Q192-R194 VanDerWaalsContact NE2-NE 3.1Å; Q192-D240 WeakPolarHBondContact CG-O 3.38Å; Q192-D240 PolarHBondContact N-O 3.49Å; Q192-D240 PolarHBondContact O-N 3Å |
| 193 | I | 90.8 | Very high | 76.4 | Confident | 49 Ų | 49 | 76.9 Ų | 76.9 | 25% | 0.251 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85 | 124 | 177.2 | -62.5 | 166.1 | 0 | 0 | 0 | 108.4 | A122 N123 Y237 E238 V239 | A122-I193 HydrophobicContact CB-CD1 4.09Å; A122-I193 HydrophobicContact CB-CG1 4.1Å; A122-I193 HydrophobicContact CB-CG2 3.75Å; N123-I193 HydrophobicContact CB-CD1 4.42Å; N123-I193 WeakPolarHBondContact OD1-CD1 3.35Å; I193-Y237 HydrophobicContact CG2-CD1 3.7Å; I193-Y237 HydrophobicContact CG2-CG 4.17Å; I193-E238 WeakPolarHBondContact CA-O 3.31Å; I193-V239 HydrophobicContact CG1-CG2 4.11Å |
| 194 | R | 88.7 | Confident | 73.8 | Confident | 69 Ų | 69 | 83.7 Ų | 83.7 | 26% | 0.26 | 41% | 0.412 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.8 | 159.2 | 179 | -60.5 | -175.5 | -174.4 | -132.8 | 11.3 | 110.5 | Q192 Y237 E238 Y241 T243 | Q192-R194 HydrophobicContact CG-CG 4.3Å; Q192-R194 VanDerWaalsContact NE2-NE 3.1Å; R194-Y237 CarbonylContact O-C 3.6Å; R194-Y237 WeakPolarHBondContact O-CA 3.31Å; R194-Y237 WeakPolarHBondContact O-CB 3.37Å; R194-E238 PolarHBondContact N-O 2.94Å; R194-E238 PolarHBondContact O-N 3.38Å; R194-Y241 PolarHBondContact NE-O 3.01Å; R194-Y241 PolarHBondContact NH2-O 3.16Å; R194-T243 VanDerWaalsContact NH1-CG2 3.25Å |
| 195 | I | 88.8 | Confident | 71.3 | Confident | 110 Ų | 110 | 92 Ų | 92 | 56% | 0.564 | 44% | 0.444 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -77.4 | 124.8 | 169 | -60.9 | 168.3 | 0 | 0 | 0 | 107 | S197 I235 L236 Y237 | I195-S197 PolarHBondContact O-N 3.06Å; I195-I235 HydrophobicContact CB-CG2 4.45Å; I195-I235 HydrophobicContact CD1-CG2 4.17Å; I195-I235 HydrophobicContact CG1-CG2 3.97Å; I195-I235 HydrophobicContact CG2-CG2 3.73Å; I195-L236 CarbonylContact C-O 3.59Å; I195-L236 WeakPolarHBondContact CA-O 3.36Å; I195-Y237 HydrophobicContact CG1-CD1 4.18Å; I195-Y237 HydrophobicContact CG1-CE1 3.81Å |
| 196 | K | 84.2 | Confident | 68.8 | Low | 47 Ų | 47 | 92.4 Ų | 92.4 | 20% | 0.204 | 45% | 0.45 | C | S | . | . | trans | -72.6 | 112.8 | 173.9 | -174 | 167.4 | -169.7 | 140.5 | 0 | 108.5 | L113 L114 N198 L236 E238 | L113-K196 PolarHBondContact O-NZ 3.43Å; L114-K196 PolarHBondContact O-NZ 2.76Å; K196-N198 PolarHBondContact O-N 3.04Å; K196-L236 PolarHBondContact N-O 3.38Å; K196-E238 HydrophobicContact CB-CB 4.46Å; K196-E238 HydrophobicContact CB-CG 4.25Å; K196-E238 IonicContact NZ-OE2 3.58Å | ||
| 197 | S | 75.9 | Confident | 66.5 | Low | 88 Ų | 88 | 96.3 Ų | 96.3 | 62% | 0.615 | 47% | 0.473 | S | S | * | . | trans | -72.8 | 113.4 | 172.2 | 56.5 | 0 | 0 | 0 | 0 | 108.2 | I195 H199 | I195-S197 PolarHBondContact O-N 3.06Å; S197-H199 PolarHBondContact O-N 2.97Å | ||
| 198 | N | 58.8 | Low | 64.5 | Low | 100 Ų | 100 | 104.4 Ų | 104.4 | 54% | 0.535 | 51% | 0.505 | S | S | . | . | trans | -53.7 | 114.5 | 167.1 | -73.3 | -18.9 | 0 | 0 | 0 | 107.3 | K196 Y200 | K196-N198 PolarHBondContact O-N 3.04Å; N198-Y200 PolarHBondContact O-N 2.88Å | ||
| 199 | H | 49.5 | Very low | 62.8 | Low | 194 Ų | 194 | 106.6 Ų | 106.6 | 90% | 0.898 | 52% | 0.518 | S | S | * | . | trans | -69.4 | 45.3 | 161.9 | -102.2 | 50.6 | 0 | 0 | 0 | 109.5 | S197 H201 | S197-H199 PolarHBondContact O-N 2.97Å; H199-H201 PolarHBondContact O-N 3.06Å | ||
| 200 | Y | 43.6 | Very low | 60.5 | Low | 171 Ų | 171 | 106.9 Ų | 106.9 | 67% | 0.671 | 53% | 0.525 | S | S | * | . | trans | -92.9 | 98.4 | 178.4 | -155.4 | -100.1 | 0 | 0 | 0 | 106.9 | N198 | N198-Y200 PolarHBondContact O-N 2.88Š| ||
| 201 | H | 44.3 | Very low | 58.4 | Low | 124 Ų | 124 | 112.6 Ų | 112.6 | 57% | 0.574 | 56% | 0.56 | S | S | * | * | trans | 53.3 | 89.1 | 167.9 | -68.7 | -74.2 | 0 | 0 | 0 | 114.6 | H199 N203 | H199-H201 PolarHBondContact O-N 3.06Å; H201-N203 PolarHBondContact O-N 3.4Å | ||
| 202 | D | 41 | Very low | 56.4 | Low | 145 Ų | 145 | 118.4 Ų | 118.4 | 78% | 0.775 | 59% | 0.592 | S | S | * | * | trans | -54.9 | 104.7 | 134.2 | -162.7 | 13.8 | 0 | 0 | 0 | 104.7 | H204 | D202-H204 PolarHBondContact O-N 2.91Š| ||
| 203 | N | 43.7 | Very low | 54.6 | Low | 88 Ų | 88 | 121.6 Ų | 121.6 | 47% | 0.471 | 61% | 0.611 | S | S | . | * | trans | -59.2 | 94.5 | 178.8 | -72.5 | -35.7 | 0 | 0 | 0 | 105.8 | H201 Y205 | H201-N203 PolarHBondContact O-N 3.4Å; N203-Y205 HydrophobicContact CB-CD2 3.64Å; N203-Y205 HydrophobicContact CB-CE1 4.39Å; N203-Y205 HydrophobicContact CB-CE2 3.3Å; N203-Y205 HydrophobicContact CB-CG 4.32Å; N203-Y205 PolarHBondContact ND2-OH 2.85Å; N203-Y205 WeakPolarHBondContact O-CD2 3.5Å; N203-Y205 PolarHBondContact O-N 3.18Å | ||
| 204 | H | 40.1 | Very low | 52.9 | Low | 160 Ų | 160 | 126.2 Ų | 126.2 | 74% | 0.741 | 64% | 0.636 | S | S | * | * | trans | -61.2 | 83 | 153.2 | -77.4 | 5.1 | 0 | 0 | 0 | 105.5 | D202 T206 | D202-H204 PolarHBondContact O-N 2.91Å; H204-T206 PolarHBondContact O-N 3.37Å | ||
| 205 | Y | 40.3 | Very low | 51 | Low | 185 Ų | 185 | 128.6 Ų | 128.6 | 73% | 0.725 | 66% | 0.658 | S | S | * | * | trans | -63.4 | 83.1 | 153.8 | -62.9 | -78.1 | 0 | 0 | 0 | 105.1 | N203 T207 | N203-Y205 HydrophobicContact CB-CD2 3.64Å; N203-Y205 HydrophobicContact CB-CE1 4.39Å; N203-Y205 HydrophobicContact CB-CE2 3.3Å; N203-Y205 HydrophobicContact CB-CG 4.32Å; N203-Y205 PolarHBondContact ND2-OH 2.85Å; N203-Y205 WeakPolarHBondContact O-CD2 3.5Å; N203-Y205 PolarHBondContact O-N 3.18Å; Y205-T207 PolarHBondContact O-N 3.35Å | ||
| 206 | T | 38.1 | Very low | 48.9 | Very low | 87 Ų | 87 | 130.6 Ų | 130.6 | 53% | 0.534 | 68% | 0.676 | S | S | . | * | trans | -66 | 92.6 | 158.8 | 42.2 | 0 | 0 | 0 | 0 | 105.5 | H204 Y208 | H204-T206 PolarHBondContact O-N 3.37Å; T206-Y208 VanDerWaalsContact C-N 3.34Å; T206-Y208 WeakPolarHBondContact O-CD2 3.49Å; T206-Y208 PolarHBondContact O-N 2.96Å | ||
| 207 | T | 41.4 | Very low | 46.9 | Very low | 110 Ų | 110 | 132.9 Ų | 132.9 | 68% | 0.675 | 69% | 0.694 | S | S | * | * | trans | -64 | 100.4 | 166.7 | -48 | 0 | 0 | 0 | 0 | 106.7 | Y205 N209 | Y205-T207 PolarHBondContact O-N 3.35Å; T207-N209 PolarHBondContact O-N 3.42Å; T207-N209 VanDerWaalsContact O-N 3.1Å | ||
| 208 | Y | 42.8 | Very low | 45.2 | Very low | 188 Ų | 188 | 135.6 Ų | 135.6 | 74% | 0.737 | 71% | 0.707 | S | S | * | * | trans | -69.4 | 103.6 | 162.8 | -57.6 | -81.8 | 0 | 0 | 0 | 106.2 | T206 T210 | T206-Y208 VanDerWaalsContact C-N 3.34Å; T206-Y208 WeakPolarHBondContact O-CD2 3.49Å; T206-Y208 PolarHBondContact O-N 2.96Å; Y208-T210 VanDerWaalsContact C-N 3.33Å; Y208-T210 PolarHBondContact O-N 2.87Å | ||
| 209 | N | 50.4 | Low | 44.2 | Very low | 138 Ų | 138 | 135.9 Ų | 135.9 | 74% | 0.738 | 71% | 0.712 | S | S | * | * | trans | -70.4 | 97.9 | 163.8 | -73.5 | -16.7 | 0 | 0 | 0 | 106.5 | T207 T211 | T207-N209 PolarHBondContact O-N 3.42Å; T207-N209 VanDerWaalsContact O-N 3.1Å; N209-T211 PolarHBondContact O-N 3.44Å | ||
| 210 | T | 41.6 | Very low | 43.6 | Very low | 109 Ų | 109 | 131.9 Ų | 131.9 | 67% | 0.669 | 70% | 0.702 | S | S | * | * | trans | -74.9 | 101.8 | 165.6 | 61.6 | 0 | 0 | 0 | 0 | 106.8 | Y208 D212 | Y208-T210 VanDerWaalsContact C-N 3.33Å; Y208-T210 PolarHBondContact O-N 2.87Å; T210-D212 PolarHBondContact O-N 3.46Å | ||
| 211 | T | 43.4 | Very low | 43.4 | Very low | 120 Ų | 120 | 130.5 Ų | 130.5 | 74% | 0.736 | 71% | 0.706 | S | S | * | * | trans | -71.3 | 78.6 | 166.1 | 31 | 0 | 0 | 0 | 0 | 108.5 | N209 N213 | N209-T211 PolarHBondContact O-N 3.44Å; T211-N213 VanDerWaalsContact C-N 3.35Å; T211-N213 PolarHBondContact O-N 3Å | ||
| 212 | D | 46.3 | Very low | 42.8 | Very low | 141 Ų | 141 | 132.3 Ų | 132.3 | 75% | 0.754 | 71% | 0.714 | S | S | * | * | trans | -81.6 | 93.9 | 162 | -74.7 | -33.5 | 0 | 0 | 0 | 107.4 | T210 N214 | T210-D212 PolarHBondContact O-N 3.46Å; D212-N214 PolarHBondContact O-N 2.97Å | ||
| 213 | N | 52.6 | Low | 42.5 | Very low | 131 Ų | 131 | 131.6 Ų | 131.6 | 70% | 0.701 | 71% | 0.71 | S | S | * | * | trans | -56 | 127.1 | 165.7 | -71.3 | -22.9 | 0 | 0 | 0 | 108 | T211 | T211-N213 VanDerWaalsContact C-N 3.35Å; T211-N213 PolarHBondContact O-N 3Å | ||
| 214 | N | 55.9 | Low | 41.9 | Very low | 145 Ų | 145 | 134.2 Ų | 134.2 | 78% | 0.775 | 72% | 0.722 | S | S | * | * | S | Bend | trans | 80.6 | 85.4 | 164.8 | -38.5 | -28.1 | 0 | 0 | 0 | 113.5 | D212 | D212-N214 PolarHBondContact O-N 2.97Š|
| 215 | T | 49.1 | Very low | 41.5 | Very low | 119 Ų | 119 | 135.5 Ų | 135.5 | 73% | 0.73 | 72% | 0.722 | S | S | * | * | 168.6 | 131.6 | 113.3 | 36.2 | 0 | 0 | 0 | 0 | 108.8 | T217 | T215-T217 VanDerWaalsContact C-N 3.28Å; T215-T217 PolarHBondContact O-N 3.32Å | |||
| 216 | T | 43.2 | Very low | 41.1 | Very low | 152 Ų | 152 | 132.5 Ų | 132.5 | 93% | 0.933 | 72% | 0.723 | S | S | * | * | trans | -60.8 | 86.5 | 171.8 | 44.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 217 | T | 42.7 | Very low | 41 | Very low | 96 Ų | 96 | 133.7 Ų | 133.7 | 59% | 0.589 | 73% | 0.731 | S | S | * | * | trans | -119.5 | 123 | 162.7 | 52.7 | 0 | 0 | 0 | 0 | 107.3 | T215 T219 | T215-T217 VanDerWaalsContact C-N 3.28Å; T215-T217 PolarHBondContact O-N 3.32Å; T217-T219 PolarHBondContact O-N 2.68Å | ||
| 218 | T | 39.7 | Very low | 40.8 | Very low | 144 Ų | 144 | 137 Ų | 137 | 88% | 0.883 | 73% | 0.732 | S | S | * | * | trans | -60.6 | 80.1 | 174.6 | 41.1 | 0 | 0 | 0 | 0 | 109.2 | T220 | T218-T220 PolarHBondContact O-N 2.88Š| ||
| 219 | T | 39.1 | Very low | 40.8 | Very low | 106 Ų | 106 | 134.4 Ų | 134.4 | 65% | 0.65 | 73% | 0.731 | S | S | * | * | trans | -79.2 | 99.4 | 170.2 | 41.5 | 0 | 0 | 0 | 0 | 107.4 | T217 N221 | T217-T219 PolarHBondContact O-N 2.68Å; T219-N221 PolarHBondContact O-N 3Å | ||
| 220 | T | 36.1 | Very low | 40.3 | Very low | 110 Ų | 110 | 136.5 Ų | 136.5 | 68% | 0.675 | 74% | 0.736 | S | S | * | * | trans | -57.2 | 105.3 | 165.2 | 45.1 | 0 | 0 | 0 | 0 | 107.7 | T218 H222 | T218-T220 PolarHBondContact O-N 2.88Å; T220-H222 PolarHBondContact O-N 3.35Å | ||
| 221 | N | 40.4 | Very low | 40.6 | Very low | 142 Ų | 142 | 134.2 Ų | 134.2 | 76% | 0.759 | 72% | 0.724 | S | S | * | * | trans | -61.8 | 87.5 | 171.3 | -72.8 | -24.2 | 0 | 0 | 0 | 108.6 | T219 L223 | T219-N221 PolarHBondContact O-N 3Å; N221-L223 PolarHBondContact O-N 2.98Å | ||
| 222 | H | 31.6 | Very low | 40.6 | Very low | 162 Ų | 162 | 134.4 Ų | 134.4 | 75% | 0.75 | 73% | 0.726 | S | S | * | * | trans | -67 | 89.2 | 163.3 | -90 | -75.6 | 0 | 0 | 0 | 106.9 | T220 I224 | T220-H222 PolarHBondContact O-N 3.35Å; H222-I224 VanDerWaalsContact C-N 3.3Å; H222-I224 PolarHBondContact O-N 3.13Å | ||
| 223 | L | 33.7 | Very low | 41.1 | Very low | 130 Ų | 130 | 132.3 Ų | 132.3 | 68% | 0.681 | 72% | 0.718 | S | S | * | * | trans | -60.3 | 97 | 163.9 | -78.6 | 142.3 | 0 | 0 | 0 | 107 | N221 Y225 | N221-L223 PolarHBondContact O-N 2.98Å; L223-Y225 VanDerWaalsContact C-N 3.28Å; L223-Y225 HydrophobicContact CB-CE2 4.15Å; L223-Y225 WeakPolarHBondContact O-CD2 3.25Å; L223-Y225 PolarHBondContact O-N 3.4Å | ||
| 224 | I | 32.1 | Very low | 41.9 | Very low | 143 Ų | 143 | 130.2 Ų | 130.2 | 73% | 0.733 | 71% | 0.714 | S | S | * | * | trans | -69.9 | 94.8 | 169.5 | -58.3 | 174.5 | 0 | 0 | 0 | 105.5 | H222 T226 | H222-I224 VanDerWaalsContact C-N 3.3Å; H222-I224 PolarHBondContact O-N 3.13Å; I224-T226 HydrophobicContact CG2-CG2 4.04Å; I224-T226 PolarHBondContact O-N 2.79Å | ||
| 225 | Y | 30.4 | Very low | 43.2 | Very low | 188 Ų | 188 | 128.3 Ų | 128.3 | 74% | 0.737 | 70% | 0.703 | S | S | * | * | trans | -63.7 | 97.4 | 156.8 | -63.3 | -86.6 | 0 | 0 | 0 | 105.6 | L223 T227 | L223-Y225 VanDerWaalsContact C-N 3.28Å; L223-Y225 HydrophobicContact CB-CE2 4.15Å; L223-Y225 WeakPolarHBondContact O-CD2 3.25Å; L223-Y225 PolarHBondContact O-N 3.4Å; Y225-T227 PolarHBondContact O-N 3.17Å | ||
| 226 | T | 32.5 | Very low | 45.1 | Very low | 121 Ų | 121 | 124.4 Ų | 124.4 | 74% | 0.742 | 68% | 0.677 | S | S | * | * | trans | -66.3 | 87.8 | 154.4 | 45.8 | 0 | 0 | 0 | 0 | 105 | I224 Y228 | I224-T226 HydrophobicContact CG2-CG2 4.04Å; I224-T226 PolarHBondContact O-N 2.79Å; T226-Y228 PolarHBondContact O-N 3.39Å | ||
| 227 | T | 35.9 | Very low | 47.4 | Very low | 113 Ų | 113 | 119.4 Ų | 119.4 | 69% | 0.693 | 64% | 0.641 | S | S | * | * | trans | -57.7 | 89.1 | 155.4 | -57.8 | 0 | 0 | 0 | 0 | 103.8 | Y225 N229 | Y225-T227 PolarHBondContact O-N 3.17Å; T227-N229 VanDerWaalsContact C-N 3.26Å; T227-N229 PolarHBondContact O-N 3.42Å | ||
| 228 | Y | 36.8 | Very low | 49.6 | Very low | 180 Ų | 180 | 117.6 Ų | 117.6 | 71% | 0.706 | 63% | 0.626 | S | S | * | * | trans | -55 | 109 | 165.5 | -166.7 | -99.4 | 0 | 0 | 0 | 102.9 | T226 Q230 S231 | T226-Y228 PolarHBondContact O-N 3.39Å; Y228-Q230 PolarHBondContact O-N 3.33Å; Y228-Q230 VanDerWaalsContact O-N 3.1Å; Y228-S231 WeakPolarHBondContact CE1-OG 3.37Å | ||
| 229 | N | 43.8 | Very low | 52 | Low | 132 Ų | 132 | 112.2 Ų | 112.2 | 71% | 0.706 | 59% | 0.593 | S | S | * | * | trans | -42.4 | 129.5 | 175.7 | -69.5 | -30.2 | 0 | 0 | 0 | 105.2 | T227 S231 | T227-N229 VanDerWaalsContact C-N 3.26Å; T227-N229 PolarHBondContact O-N 3.42Å; N229-S231 PolarHBondContact O-N 2.99Å | ||
| 230 | Q | 40.5 | Very low | 54.2 | Low | 182 Ų | 182 | 110.3 Ų | 110.3 | 85% | 0.85 | 58% | 0.579 | S | S | * | * | trans | -54 | 78.6 | 163.1 | -72.9 | 169.4 | -15.3 | 0 | 0 | 106.6 | Y228 T232 | Y228-Q230 PolarHBondContact O-N 3.33Å; Y228-Q230 VanDerWaalsContact O-N 3.1Å; Q230-T232 PolarHBondContact O-N 2.63Å | ||
| 231 | S | 46.1 | Very low | 56.6 | Low | 61 Ų | 61 | 109.9 Ų | 109.9 | 43% | 0.427 | 57% | 0.566 | S | S | . | * | -46.9 | 106.7 | 128.7 | 48.4 | 0 | 0 | 0 | 0 | 100.8 | Y228 N229 T233 | Y228-S231 WeakPolarHBondContact CE1-OG 3.37Å; N229-S231 PolarHBondContact O-N 2.99Å; S231-T233 PolarHBondContact O-N 2.68Å | |||
| 232 | T | 44 | Very low | 58.8 | Low | 124 Ų | 124 | 103.3 Ų | 103.3 | 76% | 0.761 | 53% | 0.531 | S | S | * | . | trans | -48.8 | 90.5 | 174.3 | 32.3 | 0 | 0 | 0 | 0 | 104.4 | Q230 S234 | Q230-T232 PolarHBondContact O-N 2.63Å; T232-S234 PolarHBondContact O-N 3.39Å | ||
| 233 | T | 57.4 | Low | 61.2 | Low | 98 Ų | 98 | 99.9 Ų | 99.9 | 60% | 0.601 | 52% | 0.521 | S | S | * | . | trans | -69.6 | 88.8 | 178.1 | 46.8 | 0 | 0 | 0 | 0 | 101.4 | S231 I235 | S231-T233 PolarHBondContact O-N 2.68Å; T233-I235 PolarHBondContact O-N 2.85Å | ||
| 234 | S | 68.1 | Low | 63.8 | Low | 87 Ų | 87 | 98 Ų | 98 | 61% | 0.608 | 51% | 0.512 | S | S | * | . | P | Polyproline II helix | trans | -53.3 | 118.8 | -173.9 | 52.6 | 0 | 0 | 0 | 0 | 105.2 | T232 L236 | T232-S234 PolarHBondContact O-N 3.39Å; S234-L236 PolarHBondContact O-N 3.46Å |
| 235 | I | 84.6 | Confident | 66.4 | Low | 105 Ų | 105 | 95.9 Ų | 95.9 | 54% | 0.538 | 50% | 0.501 | S | S | . | . | P | Polyproline II helix | trans | -52.2 | 116.1 | -177.4 | -60.8 | 172.9 | 0 | 0 | 0 | 106.5 | I195 T233 Y237 | I195-I235 HydrophobicContact CB-CG2 4.45Å; I195-I235 HydrophobicContact CD1-CG2 4.17Å; I195-I235 HydrophobicContact CG1-CG2 3.97Å; I195-I235 HydrophobicContact CG2-CG2 3.73Å; T233-I235 PolarHBondContact O-N 2.85Å; I235-Y237 HydrophobicContact CB-CE2 4.3Å; I235-Y237 HydrophobicContact CG2-CE1 4.5Å; I235-Y237 HydrophobicContact CG2-CE2 3.85Å; I235-Y237 WeakPolarHBondContact O-CD2 3.43Å; I235-Y237 VanDerWaalsContact O-CE2 3.28Å; I235-Y237 WeakPolarHBondContact O-CE2 3.31Å |
| 236 | L | 89.1 | Confident | 69.2 | Low | 36 Ų | 36 | 93.7 Ų | 93.7 | 19% | 0.188 | 50% | 0.497 | C | S | . | . | P | Polyproline II helix | trans | -103.7 | 142.9 | -172.4 | -155.9 | 65.2 | 0 | 0 | 0 | 108.7 | N115 G116 M117 I195 K196 S234 | N115-L236 WeakPolarHBondContact O-CD2 3.18Å; G116-L236 VanDerWaalsContact C-CD1 3.49Å; G116-L236 VanDerWaalsContact CA-CD2 3.47Å; M117-L236 VanDerWaalsContact CA-CD1 3.46Å; M117-L236 VanDerWaalsContact N-CD1 3.25Å; M117-L236 VanDerWaalsContact N-CG 3.31Å; M117-L236 WeakPolarHBondContact O-CD1 3.48Å; I195-L236 CarbonylContact C-O 3.59Å; I195-L236 WeakPolarHBondContact CA-O 3.36Å; K196-L236 PolarHBondContact N-O 3.38Å; S234-L236 PolarHBondContact O-N 3.46Å |
| 237 | Y | 91.1 | Very high | 71.8 | Confident | 48 Ų | 48 | 90.6 Ų | 90.6 | 19% | 0.188 | 48% | 0.476 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.5 | 154.8 | -173 | -63.2 | -95.3 | 0 | 0 | 0 | 110.4 | M117 K119 I193 R194 I195 I235 | M117-Y237 WeakPolarHBondContact CG-O 3.46Å; M117-Y237 PolarHBondContact N-O 3.15Å; M117-Y237 WeakPolarHBondContact O-CA 3.48Å; M117-Y237 WeakPolarHBondContact O-CB 3.47Å; M117-Y237 PolarHBondContact O-N 3.4Å; K119-Y237 HydrophobicContact CB-CD2 3.96Å; K119-Y237 HydrophobicContact CB-CE2 3.83Å; K119-Y237 HydrophobicContact CB-CG 4.44Å; I193-Y237 HydrophobicContact CG2-CD1 3.7Å; I193-Y237 HydrophobicContact CG2-CG 4.17Å; R194-Y237 CarbonylContact O-C 3.6Å; R194-Y237 WeakPolarHBondContact O-CA 3.31Å; R194-Y237 WeakPolarHBondContact O-CB 3.37Å; I195-Y237 HydrophobicContact CG1-CD1 4.18Å; I195-Y237 HydrophobicContact CG1-CE1 3.81Å; I235-Y237 HydrophobicContact CB-CE2 4.3Å; I235-Y237 HydrophobicContact CG2-CE1 4.5Å; I235-Y237 HydrophobicContact CG2-CE2 3.85Å; I235-Y237 WeakPolarHBondContact O-CD2 3.43Å; I235-Y237 VanDerWaalsContact O-CE2 3.28Å; I235-Y237 WeakPolarHBondContact O-CE2 3.31Å |
| 238 | E | 88.8 | Confident | 74.2 | Confident | 58 Ų | 58 | 89.2 Ų | 89.2 | 27% | 0.271 | 46% | 0.46 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.7 | 162.5 | 170.9 | 66.2 | -170.6 | 178.2 | 0 | 0 | 109.9 | I193 R194 K196 | I193-E238 WeakPolarHBondContact CA-O 3.31Å; R194-E238 PolarHBondContact N-O 2.94Å; R194-E238 PolarHBondContact O-N 3.38Å; K196-E238 HydrophobicContact CB-CB 4.46Å; K196-E238 HydrophobicContact CB-CG 4.25Å; K196-E238 IonicContact NZ-OE2 3.58Å |
| 239 | V | 89.8 | Confident | 76.6 | Confident | 31 Ų | 31 | 84 Ų | 84 | 19% | 0.188 | 44% | 0.444 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.6 | 120.1 | 175.2 | 177.7 | 0 | 0 | 0 | 0 | 107.4 | A122 L125 L126 I129 H191 I193 | A122-V239 HydrophobicContact CB-CG2 4.38Å; L125-V239 HydrophobicContact CB-CG2 4.16Å; L125-V239 HydrophobicContact CD2-CB 3.94Å; L125-V239 HydrophobicContact CD2-CG2 3.71Å; L125-V239 HydrophobicContact CG-CB 4.43Å; L125-V239 HydrophobicContact CG-CG2 4Å; L126-V239 HydrophobicContact CD1-CG1 4.46Å; I129-V239 HydrophobicContact CD1-CG1 4.2Å; H191-V239 HydrophobicContact CB-CG1 4.25Å; I193-V239 HydrophobicContact CG1-CG2 4.11Å |
| 240 | D | 86.2 | Confident | 78.7 | Confident | 66 Ų | 66 | 82.4 Ų | 82.4 | 35% | 0.353 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.7 | 163.9 | -179.7 | -173.3 | 22.6 | 0 | 0 | 0 | 110.1 | Q192 | Q192-D240 WeakPolarHBondContact CG-O 3.38Å; Q192-D240 PolarHBondContact N-O 3.49Å; Q192-D240 PolarHBondContact O-N 3Å |
| 241 | Y | 85.3 | Confident | 80.9 | Confident | 101 Ų | 101 | 74.2 Ų | 74.2 | 40% | 0.396 | 40% | 0.396 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.5 | 156.5 | 176.4 | -58 | -75.8 | 0 | 0 | 0 | 111.6 | A190 H191 R194 L251 | A190-Y241 CarbonylContact O-C 3.59Å; A190-Y241 WeakPolarHBondContact O-CA 3.28Å; H191-Y241 AromaticContact CE1-CD1 3.83Å; H191-Y241 AromaticContact CE1-CE1 3.33Å; H191-Y241 WeakPolarHBondContact CE1-CE1 3.48Å; H191-Y241 AromaticContact NE2-CD1 3.81Å; H191-Y241 AromaticContact NE2-CE1 3.24Å; H191-Y241 WeakPolarHBondContact NE2-CE1 3.38Å; H191-Y241 AromaticContact NE2-CZ 3.8Å; R194-Y241 PolarHBondContact NE-O 3.01Å; R194-Y241 PolarHBondContact NH2-O 3.16Å; Y241-L251 HydrophobicContact CD1-CD2 3.34Å; Y241-L251 HydrophobicContact CE1-CD2 3.41Å; Y241-L251 VanDerWaalsContact CE1-CD2 3.41Å |
| 242 | T | 87.3 | Confident | 82.8 | Confident | 4 Ų | 4 | 72.6 Ų | 72.6 | 3% | 0.025 | 38% | 0.381 | C | S | . | . | trans | -62.2 | 150 | 175.6 | -174.7 | 0 | 0 | 0 | 0 | 112.6 | A190 N244 L247 K248 | A190-T242 PolarHBondContact O-N 3.33Å; T242-N244 HydrophobicContact CG2-CB 4.27Å; T242-N244 PolarHBondContact O-N 3.36Å; T242-N244 PolarHBondContact OG1-ND2 2.91Å; T242-L247 HydrophobicContact CG2-CB 3.45Å; T242-L247 VanDerWaalsContact CG2-CB 3.45Å; T242-L247 HydrophobicContact CG2-CD1 3.89Å; T242-L247 HydrophobicContact CG2-CG 4.32Å; T242-K248 HydrophobicContact CG2-CG 4.33Å; T242-K248 WeakPolarHBondContact O-CD 3.4Å; T242-K248 VanDerWaalsContact O-CE 3.25Å; T242-K248 WeakPolarHBondContact O-CE 3.36Å; T242-K248 WeakPolarHBondContact O-CG 3.3Å | ||
| 243 | T | 82.5 | Confident | 84.9 | Confident | 90 Ų | 90 | 71.9 Ų | 71.9 | 55% | 0.552 | 37% | 0.365 | S | S | * | . | S | Bend | trans | -67.6 | -27.5 | 175.5 | 46.5 | 0 | 0 | 0 | 0 | 111.8 | R194 I245 | R194-T243 VanDerWaalsContact NH1-CG2 3.25Å; T243-I245 PolarHBondContact O-N 3.46Å; T243-I245 VanDerWaalsContact O-N 3.14Å |
| 244 | N | 88.4 | Confident | 86.5 | Confident | 90 Ų | 90 | 68.1 Ų | 68.1 | 48% | 0.481 | 34% | 0.341 | S | S | . | . | trans | -63.5 | 113.3 | -176.7 | -70.1 | -53.8 | 0 | 0 | 0 | 111.2 | T242 H246 L247 K248 | T242-N244 HydrophobicContact CG2-CB 4.27Å; T242-N244 PolarHBondContact O-N 3.36Å; T242-N244 PolarHBondContact OG1-ND2 2.91Å; N244-H246 VanDerWaalsContact C-N 3.28Å; N244-H246 PolarHBondContact O-N 3.36Å; N244-L247 HydrophobicContact CB-CB 4.18Å; N244-L247 HydrophobicContact CB-CD1 3.97Å; N244-L247 HydrophobicContact CB-CG 4.18Å; N244-L247 PolarHBondContact O-N 3.43Å; N244-K248 PolarHBondContact O-N 3.49Å; N244-K248 VanDerWaalsContact O-N 3.15Å | ||
| 245 | I | 86.5 | Confident | 87.5 | Confident | 99 Ų | 99 | 64.5 Ų | 64.5 | 51% | 0.508 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -59.1 | -38.9 | -177.8 | -171.6 | 59.3 | 0 | 0 | 0 | 112.5 | T243 L247 K248 I249 | T243-I245 PolarHBondContact O-N 3.46Å; T243-I245 VanDerWaalsContact O-N 3.14Å; I245-L247 PolarHBondContact O-N 3.23Å; I245-K248 PolarHBondContact O-N 3.15Å; I245-I249 HydrophobicContact CD1-CD1 4.41Å; I245-I249 HydrophobicContact CG1-CD1 4Å; I245-I249 WeakPolarHBondContact O-CG1 3.26Å; I245-I249 PolarHBondContact O-N 3.44Å |
| 246 | H | 89 | Confident | 87.7 | Confident | 142 Ų | 142 | 59.5 Ų | 59.5 | 66% | 0.657 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -63.2 | -43.1 | 179.4 | -64.5 | -67 | 0 | 0 | 0 | 112.5 | N244 I249 I250 | N244-H246 VanDerWaalsContact C-N 3.28Å; N244-H246 PolarHBondContact O-N 3.36Å; H246-I249 PolarHBondContact O-N 2.89Å; H246-I250 VanDerWaalsContact O-CG1 3.29Å; H246-I250 WeakPolarHBondContact O-CG1 3.4Å; H246-I250 PolarHBondContact O-N 3.42Å |
| 247 | L | 87.2 | Confident | 87.8 | Confident | 56 Ų | 56 | 60.7 Ų | 60.7 | 29% | 0.293 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -67.1 | -38.5 | 177.7 | -73.1 | 175.3 | 0 | 0 | 0 | 111.4 | I189 T242 N244 I245 I250 L251 | I189-L247 HydrophobicContact CG2-CD1 4.29Å; I189-L247 HydrophobicContact CG2-CD2 4.19Å; T242-L247 HydrophobicContact CG2-CB 3.45Å; T242-L247 VanDerWaalsContact CG2-CB 3.45Å; T242-L247 HydrophobicContact CG2-CD1 3.89Å; T242-L247 HydrophobicContact CG2-CG 4.32Å; N244-L247 HydrophobicContact CB-CB 4.18Å; N244-L247 HydrophobicContact CB-CD1 3.97Å; N244-L247 HydrophobicContact CB-CG 4.18Å; N244-L247 PolarHBondContact O-N 3.43Å; I245-L247 PolarHBondContact O-N 3.23Å; L247-I250 PolarHBondContact O-N 2.97Å; L247-L251 VanDerWaalsContact O-CB 3.23Å; L247-L251 WeakPolarHBondContact O-CB 3.13Å; L247-L251 PolarHBondContact O-N 3.1Å |
| 248 | K | 85.7 | Confident | 87.8 | Confident | 83 Ų | 83 | 61.7 Ų | 61.7 | 36% | 0.361 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61.1 | -43.2 | 173.6 | -74.4 | -171.7 | -77.2 | -175.7 | 0 | 112.2 | T242 N244 I245 F252 | T242-K248 HydrophobicContact CG2-CG 4.33Å; T242-K248 WeakPolarHBondContact O-CD 3.4Å; T242-K248 VanDerWaalsContact O-CE 3.25Å; T242-K248 WeakPolarHBondContact O-CE 3.36Å; T242-K248 WeakPolarHBondContact O-CG 3.3Å; N244-K248 PolarHBondContact O-N 3.49Å; N244-K248 VanDerWaalsContact O-N 3.15Å; I245-K248 PolarHBondContact O-N 3.15Å; K248-F252 VanDerWaalsContact O-CB 3.27Å; K248-F252 WeakPolarHBondContact O-CB 3.42Å; K248-F252 PolarHBondContact O-N 3.25Å |
| 249 | I | 86.7 | Confident | 87.9 | Confident | 72 Ų | 72 | 59.7 Ų | 59.7 | 37% | 0.369 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -64.4 | -46 | 176.8 | -69 | 168.2 | 0 | 0 | 0 | 110.9 | I245 H246 F252 W253 | I245-I249 HydrophobicContact CD1-CD1 4.41Å; I245-I249 HydrophobicContact CG1-CD1 4Å; I245-I249 WeakPolarHBondContact O-CG1 3.26Å; I245-I249 PolarHBondContact O-N 3.44Å; H246-I249 PolarHBondContact O-N 2.89Å; I249-F252 PolarHBondContact O-N 2.74Å; I249-W253 PolarHBondContact O-N 3.21Å |
| 250 | I | 87.7 | Confident | 88 | Confident | 98 Ų | 98 | 59.9 Ų | 59.9 | 50% | 0.503 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -62 | -47.6 | 178.7 | -69.9 | 165.8 | 0 | 0 | 0 | 110.9 | P186 H246 L247 F252 W253 N254 | P186-I250 HydrophobicContact CB-CG2 4.5Å; H246-I250 VanDerWaalsContact O-CG1 3.29Å; H246-I250 WeakPolarHBondContact O-CG1 3.4Å; H246-I250 PolarHBondContact O-N 3.42Å; L247-I250 PolarHBondContact O-N 2.97Å; I250-F252 VanDerWaalsContact C-N 3.3Å; I250-F252 PolarHBondContact O-N 3.41Å; I250-W253 PolarHBondContact O-N 3.24Å; I250-N254 VanDerWaalsContact O-CB 3.23Å; I250-N254 WeakPolarHBondContact O-CB 3.36Å; I250-N254 PolarHBondContact O-N 2.88Å |
| 251 | L | 86.7 | Confident | 88.3 | Confident | 10 Ų | 10 | 57.5 Ų | 57.5 | 5% | 0.052 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -55.1 | -48.5 | 175 | 171.5 | 66 | 0 | 0 | 0 | 110.9 | F187 A190 Y241 L247 N254 S255 | F187-L251 HydrophobicContact CB-CD1 4.14Å; F187-L251 HydrophobicContact CD1-CD1 3.75Å; F187-L251 HydrophobicContact CD2-CD1 3.67Å; F187-L251 HydrophobicContact CE1-CD1 4Å; F187-L251 HydrophobicContact CE2-CD1 3.96Å; F187-L251 HydrophobicContact CG-CD1 3.57Å; F187-L251 HydrophobicContact CZ-CD1 4.11Å; A190-L251 HydrophobicContact CB-CB 3.81Å; A190-L251 HydrophobicContact CB-CD1 4.02Å; A190-L251 HydrophobicContact CB-CD2 3.38Å; A190-L251 HydrophobicContact CB-CG 3.91Å; Y241-L251 HydrophobicContact CD1-CD2 3.34Å; Y241-L251 HydrophobicContact CE1-CD2 3.41Å; Y241-L251 VanDerWaalsContact CE1-CD2 3.41Å; L247-L251 VanDerWaalsContact O-CB 3.23Å; L247-L251 WeakPolarHBondContact O-CB 3.13Å; L247-L251 PolarHBondContact O-N 3.1Å; L251-N254 PolarHBondContact O-N 2.91Å; L251-S255 WeakPolarHBondContact O-CB 3.37Å; L251-S255 PolarHBondContact O-N 3.05Å |
| 252 | F | 86.8 | Confident | 88.7 | Confident | 26 Ų | 26 | 55.1 Ų | 55.1 | 11% | 0.114 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -58.4 | -56 | -178.5 | 173.7 | -97.4 | 0 | 0 | 0 | 111.6 | K248 I249 I250 N254 S255 A256 L374 N378 | K248-F252 VanDerWaalsContact O-CB 3.27Å; K248-F252 WeakPolarHBondContact O-CB 3.42Å; K248-F252 PolarHBondContact O-N 3.25Å; I249-F252 PolarHBondContact O-N 2.74Å; I250-F252 VanDerWaalsContact C-N 3.3Å; I250-F252 PolarHBondContact O-N 3.41Å; F252-N254 VanDerWaalsContact C-N 3.3Å; F252-N254 PolarHBondContact O-N 2.95Å; F252-S255 PolarHBondContact O-N 3.45Å; F252-A256 HydrophobicContact CD2-CB 4.47Å; F252-A256 HydrophobicContact CE1-CB 4.11Å; F252-A256 HydrophobicContact CE2-CB 3.94Å; F252-A256 HydrophobicContact CZ-CB 3.72Å; F252-A256 WeakPolarHBondContact O-CB 3.47Å; F252-A256 PolarHBondContact O-N 3.25Å; F252-L374 HydrophobicContact CD2-CD1 4.3Å; F252-L374 HydrophobicContact CE2-CD1 3.98Å; F252-L374 HydrophobicContact CE2-CG 4.04Å; F252-L374 WeakPolarHBondContact CE2-O 3.41Å; F252-L374 WeakPolarHBondContact CZ-O 3.35Å; F252-N378 HydrophobicContact CD1-CB 3.97Å; F252-N378 HydrophobicContact CD2-CB 4.06Å; F252-N378 HydrophobicContact CE1-CB 3.35Å; F252-N378 VanDerWaalsContact CE1-CG 3.43Å; F252-N378 HydrophobicContact CE2-CB 3.47Å; F252-N378 VanDerWaalsContact CE2-CB 3.47Å; F252-N378 HydrophobicContact CG-CB 4.3Å; F252-N378 HydrophobicContact CZ-CB 3.08Å |
| 253 | W | 88.3 | Confident | 89.1 | Confident | 109 Ų | 109 | 55 Ų | 55 | 41% | 0.413 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -64 | -36.4 | -178 | -74.7 | 109.5 | 0 | 0 | 0 | 112.2 | I249 I250 I257 | I249-W253 PolarHBondContact O-N 3.21Å; I250-W253 PolarHBondContact O-N 3.24Å; W253-I257 HydrophobicContact CD2-CD1 4.42Å; W253-I257 HydrophobicContact CE3-CD1 3.24Å; W253-I257 HydrophobicContact CE3-CG1 3.77Å; W253-I257 HydrophobicContact CZ3-CD1 3.51Å; W253-I257 HydrophobicContact CZ3-CG1 4.18Å; W253-I257 VanDerWaalsContact O-CB 3.31Å; W253-I257 WeakPolarHBondContact O-CB 3.41Å; W253-I257 PolarHBondContact O-N 2.68Å |
| 254 | N | 90 | Very high | 89.7 | Confident | 19 Ų | 19 | 51.1 Ų | 51.1 | 10% | 0.102 | 25% | 0.253 | C | S | . | . | I | π-helix | trans | -61.6 | -51.1 | 174.3 | 174 | -88.8 | 0 | 0 | 0 | 111.6 | L183 P186 I250 L251 F252 L258 V259 | L183-N254 WeakPolarHBondContact CD2-ND2 3.18Å; L183-N254 PolarHBondContact O-OD1 3.34Å; P186-N254 HydrophobicContact CB-CB 4.42Å; P186-N254 HydrophobicContact CG-CB 4.4Å; I250-N254 VanDerWaalsContact O-CB 3.23Å; I250-N254 WeakPolarHBondContact O-CB 3.36Å; I250-N254 PolarHBondContact O-N 2.88Å; L251-N254 PolarHBondContact O-N 2.91Å; F252-N254 VanDerWaalsContact C-N 3.3Å; F252-N254 PolarHBondContact O-N 2.95Å; N254-L258 WeakPolarHBondContact O-CA 3.45Å; N254-L258 WeakPolarHBondContact O-CB 3.48Å; N254-L258 PolarHBondContact O-N 3.02Å; N254-V259 PolarHBondContact O-N 3.38Å; N254-V259 VanDerWaalsContact O-N 3.13Å |
| 255 | S | 88.8 | Confident | 90 | Very high | 11 Ų | 11 | 52 Ų | 52 | 8% | 0.077 | 26% | 0.256 | C | S | . | . | I | π-helix | trans | -66 | -49.8 | 180 | -174.6 | 0 | 0 | 0 | 0 | 112.3 | F187 L251 F252 V259 K260 | F187-S255 VanDerWaalsContact CE2-CB 3.43Å; F187-S255 WeakPolarHBondContact CE2-OG 3.37Å; F187-S255 WeakPolarHBondContact CZ-OG 3.33Å; L251-S255 WeakPolarHBondContact O-CB 3.37Å; L251-S255 PolarHBondContact O-N 3.05Å; F252-S255 PolarHBondContact O-N 3.45Å; S255-V259 WeakPolarHBondContact O-CB 3.44Å; S255-K260 WeakPolarHBondContact O-CB 3.3Å; S255-K260 PolarHBondContact O-N 3.28Å |
| 256 | A | 89.4 | Confident | 90.5 | Very high | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 25% | 0.245 | C | C | . | . | I | π-helix | trans | -69.4 | -46.1 | -173.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | F252 A261 L374 L375 | F252-A256 HydrophobicContact CD2-CB 4.47Å; F252-A256 HydrophobicContact CE1-CB 4.11Å; F252-A256 HydrophobicContact CE2-CB 3.94Å; F252-A256 HydrophobicContact CZ-CB 3.72Å; F252-A256 WeakPolarHBondContact O-CB 3.47Å; F252-A256 PolarHBondContact O-N 3.25Å; A256-A261 WeakPolarHBondContact O-CB 3.48Å; A256-A261 PolarHBondContact O-N 2.93Å; A256-L374 HydrophobicContact CB-CD2 3.84Å; A256-L374 HydrophobicContact CB-CG 3.92Å; A256-L375 HydrophobicContact CB-CD2 3.84Å; A256-L375 HydrophobicContact CB-CG 4.37Å |
| 257 | I | 91.1 | Very high | 90.7 | Very high | 62 Ų | 62 | 43.1 Ų | 43.1 | 32% | 0.318 | 21% | 0.214 | S | C | . | . | I | π-helix | trans | -85.9 | -64.5 | -179.8 | -61.8 | -175.6 | 0 | 0 | 0 | 111.1 | W253 A261 L262 | W253-I257 HydrophobicContact CD2-CD1 4.42Å; W253-I257 HydrophobicContact CE3-CD1 3.24Å; W253-I257 HydrophobicContact CE3-CG1 3.77Å; W253-I257 HydrophobicContact CZ3-CD1 3.51Å; W253-I257 HydrophobicContact CZ3-CG1 4.18Å; W253-I257 VanDerWaalsContact O-CB 3.31Å; W253-I257 WeakPolarHBondContact O-CB 3.41Å; W253-I257 PolarHBondContact O-N 2.68Å; I257-A261 PolarHBondContact O-N 2.93Å; I257-L262 HydrophobicContact CG2-CB 4.25Å; I257-L262 HydrophobicContact CG2-CD1 4.46Å; I257-L262 WeakPolarHBondContact O-CB 3.23Å; I257-L262 PolarHBondContact O-N 3.34Å |
| 258 | L | 92.3 | Very high | 91.1 | Very high | 68 Ų | 68 | 43.6 Ų | 43.6 | 36% | 0.356 | 22% | 0.219 | S | C | . | . | I | π-helix | trans | -75.6 | -36.3 | -163.3 | -60.6 | 176.6 | 0 | 0 | 0 | 112.9 | W141 L183 N254 L262 P263 | W141-L258 WeakPolarHBondContact CZ2-O 3.43Å; W141-L258 PolarHBondContact NE1-O 3.46Å; L183-L258 HydrophobicContact CD2-CB 3.63Å; L183-L258 HydrophobicContact CD2-CD1 3.73Å; L183-L258 HydrophobicContact CD2-CG 4.32Å; N254-L258 WeakPolarHBondContact O-CA 3.45Å; N254-L258 WeakPolarHBondContact O-CB 3.48Å; N254-L258 PolarHBondContact O-N 3.02Å; L258-L262 HydrophobicContact CD2-CD1 4.11Å; L258-P263 WeakPolarHBondContact O-CD 3.34Å |
| 259 | V | 90.5 | Very high | 91.5 | Very high | 16 Ų | 16 | 43.6 Ų | 43.6 | 10% | 0.097 | 23% | 0.227 | C | C | . | . | I | π-helix | trans | -84.7 | -33.8 | -179.2 | 178.5 | 0 | 0 | 0 | 0 | 111.8 | A137 L183 N254 S255 | A137-V259 HydrophobicContact CB-CG1 3.96Å; L183-V259 HydrophobicContact CB-CG2 4.01Å; L183-V259 HydrophobicContact CD1-CG2 4.35Å; N254-V259 PolarHBondContact O-N 3.38Å; N254-V259 VanDerWaalsContact O-N 3.13Å; S255-V259 WeakPolarHBondContact O-CB 3.44Å |
| 260 | K | 91 | Very high | 92 | Very high | 36 Ų | 36 | 40.9 Ų | 40.9 | 16% | 0.157 | 21% | 0.213 | C | C | . | . | I | π-helix | trans | -113.6 | -69 | -172.1 | -71.6 | -169.5 | -174.6 | -81.2 | 0 | 114.3 | S255 L262 P263 I264 S371 L374 | S255-K260 WeakPolarHBondContact O-CB 3.3Å; S255-K260 PolarHBondContact O-N 3.28Å; K260-L262 PolarHBondContact O-N 2.9Å; K260-P263 WeakPolarHBondContact O-CD 3.45Å; K260-I264 WeakPolarHBondContact O-CG1 3.29Å; K260-S371 WeakPolarHBondContact CB-OG 3.31Å; K260-L374 HydrophobicContact CD-CD2 3.85Å |
| 261 | A | 92.4 | Very high | 92.2 | Very high | 16 Ų | 16 | 36.2 Ų | 36.2 | 13% | 0.132 | 19% | 0.189 | C | C | . | . | I | π-helix | trans | -67 | -42.3 | -169.6 | 0 | 0 | 0 | 0 | 0 | 114 | A256 I257 I264 I265 L375 | A256-A261 WeakPolarHBondContact O-CB 3.48Å; A256-A261 PolarHBondContact O-N 2.93Å; I257-A261 PolarHBondContact O-N 2.93Å; A261-I264 PolarHBondContact O-N 3.36Å; A261-I265 WeakPolarHBondContact O-CG1 3.48Å; A261-I265 PolarHBondContact O-N 3.13Å; A261-L375 HydrophobicContact CB-CD1 4.15Å |
| 262 | L | 94.3 | Very high | 92.6 | Very high | 51 Ų | 51 | 38.2 Ų | 38.2 | 27% | 0.267 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -66.3 | -46.4 | -175 | -175.5 | 155.1 | 0 | 0 | 0 | 112.3 | W141 I257 L258 K260 I264 I265 I266 | W141-L262 HydrophobicContact CH2-CD2 3.18Å; W141-L262 HydrophobicContact CZ2-CD2 3.63Å; W141-L262 HydrophobicContact CZ3-CD2 4.14Å; I257-L262 HydrophobicContact CG2-CB 4.25Å; I257-L262 HydrophobicContact CG2-CD1 4.46Å; I257-L262 WeakPolarHBondContact O-CB 3.23Å; I257-L262 PolarHBondContact O-N 3.34Å; L258-L262 HydrophobicContact CD2-CD1 4.11Å; K260-L262 PolarHBondContact O-N 2.9Å; L262-I264 VanDerWaalsContact C-N 3.25Å; L262-I264 PolarHBondContact O-N 3.28Å; L262-I265 PolarHBondContact O-N 2.96Å; L262-I266 HydrophobicContact CD2-CD1 3.45Å; L262-I266 VanDerWaalsContact CD2-CD1 3.45Å; L262-I266 HydrophobicContact CD2-CG1 4.24Å; L262-I266 HydrophobicContact CG-CD1 4.3Å; L262-I266 WeakPolarHBondContact O-CG1 3.38Å; L262-I266 PolarHBondContact O-N 2.99Å |
| 263 | P | 95.7 | Very high | 92.9 | Very high | 1 Ų | 1 | 38.4 Ų | 38.4 | 1% | 0.006 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -51.9 | -44 | 169.6 | -30.4 | 36.4 | 0 | 0 | 0 | 112.7 | A140 W141 V144 L258 K260 I266 M267 | A140-P263 HydrophobicContact CB-CB 4.23Å; A140-P263 HydrophobicContact CB-CG 4.44Å; W141-P263 HydrophobicContact CD2-CG 4.21Å; W141-P263 HydrophobicContact CZ2-CG 4Å; V144-P263 HydrophobicContact CG2-CB 3.95Å; L258-P263 WeakPolarHBondContact O-CD 3.34Å; K260-P263 WeakPolarHBondContact O-CD 3.45Å; P263-I266 PolarHBondContact O-N 3.34Å; P263-M267 HydrophobicContact CB-CE 4.28Å; P263-M267 WeakPolarHBondContact O-CB 3.35Å; P263-M267 WeakPolarHBondContact O-CG 3.46Å; P263-M267 PolarHBondContact O-N 3.21Å |
| 264 | I | 94.6 | Very high | 93.1 | Very high | 8 Ų | 8 | 33.3 Ų | 33.3 | 4% | 0.041 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -66.3 | -42.3 | -179 | -63.2 | 172.4 | 0 | 0 | 0 | 112 | K260 A261 L262 M267 T268 I364 L368 S371 | K260-I264 WeakPolarHBondContact O-CG1 3.29Å; A261-I264 PolarHBondContact O-N 3.36Å; L262-I264 VanDerWaalsContact C-N 3.25Å; L262-I264 PolarHBondContact O-N 3.28Å; I264-M267 HydrophobicContact CB-CE 4.41Å; I264-M267 HydrophobicContact CG1-CE 3.9Å; I264-M267 PolarHBondContact O-N 3.32Å; I264-T268 VanDerWaalsContact O-CB 3.3Å; I264-T268 WeakPolarHBondContact O-CB 3.37Å; I264-T268 PolarHBondContact O-N 2.96Å; I264-T268 PolarHBondContact O-OG1 3.06Å; I264-I364 HydrophobicContact CG2-CG2 4.42Å; I264-L368 HydrophobicContact CD1-CB 4.48Å; I264-L368 HydrophobicContact CG2-CD1 4.01Å; I264-S371 WeakPolarHBondContact CD1-OG 3.24Å |
| 265 | I | 95.2 | Very high | 93.1 | Very high | 109 Ų | 109 | 34.7 Ų | 34.7 | 56% | 0.559 | 20% | 0.201 | S | C | * | . | H | α-helix | trans | -61.2 | -47 | 176.2 | -67.4 | 164.6 | 0 | 0 | 0 | 110.1 | A261 L262 T268 T269 | A261-I265 WeakPolarHBondContact O-CG1 3.48Å; A261-I265 PolarHBondContact O-N 3.13Å; L262-I265 PolarHBondContact O-N 2.96Å; I265-T268 PolarHBondContact O-N 3.36Å; I265-T269 WeakPolarHBondContact O-CG2 3.33Å; I265-T269 PolarHBondContact O-N 3.26Å; I265-T269 PolarHBondContact O-OG1 3.09Å |
| 266 | I | 96.8 | Very high | 93.2 | Very high | 51 Ų | 51 | 38.4 Ų | 38.4 | 26% | 0.262 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -63.9 | -46.1 | 177.8 | -62.8 | 177.6 | 0 | 0 | 0 | 110.6 | W141 V144 I148 L262 P263 T268 T269 V270 | W141-I266 HydrophobicContact CH2-CD1 4.45Å; W141-I266 HydrophobicContact CZ3-CD1 4.32Å; V144-I266 HydrophobicContact CG1-CB 4.35Å; V144-I266 HydrophobicContact CG1-CG2 3.63Å; I148-I266 HydrophobicContact CD1-CG2 4.5Å; L262-I266 HydrophobicContact CD2-CD1 3.45Å; L262-I266 VanDerWaalsContact CD2-CD1 3.45Å; L262-I266 HydrophobicContact CD2-CG1 4.24Å; L262-I266 HydrophobicContact CG-CD1 4.3Å; L262-I266 WeakPolarHBondContact O-CG1 3.38Å; L262-I266 PolarHBondContact O-N 2.99Å; P263-I266 PolarHBondContact O-N 3.34Å; I266-T268 VanDerWaalsContact C-N 3.3Å; I266-T268 PolarHBondContact O-N 3.36Å; I266-T269 PolarHBondContact O-N 3.49Å; I266-T269 PolarHBondContact O-OG1 3.46Å; I266-V270 HydrophobicContact CG2-CG2 4.05Å; I266-V270 WeakPolarHBondContact O-CB 3.38Å; I266-V270 VanDerWaalsContact O-CG2 3.23Å; I266-V270 WeakPolarHBondContact O-CG2 3.41Å; I266-V270 PolarHBondContact O-N 2.88Å |
| 267 | M | 94 | Very high | 93.1 | Very high | 4 Ų | 4 | 38.9 Ų | 38.9 | 2% | 0.02 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.2 | -41.3 | 177.5 | -75 | -173.7 | -65.6 | 0 | 0 | 112.1 | I143 V144 P263 I264 S271 I360 I364 | I143-M267 HydrophobicContact CB-SD 3.81Å; I143-M267 HydrophobicContact CG2-CG 4.33Å; I143-M267 HydrophobicContact CG2-SD 3.34Å; I143-M267 WeakPolarHBondContact CG2-SD 3.15Å; V144-M267 HydrophobicContact CB-CG 4.5Å; V144-M267 HydrophobicContact CG2-CG 3.61Å; V144-M267 HydrophobicContact CG2-SD 4.31Å; P263-M267 HydrophobicContact CB-CE 4.28Å; P263-M267 WeakPolarHBondContact O-CB 3.35Å; P263-M267 WeakPolarHBondContact O-CG 3.46Å; P263-M267 PolarHBondContact O-N 3.21Å; I264-M267 HydrophobicContact CB-CE 4.41Å; I264-M267 HydrophobicContact CG1-CE 3.9Å; I264-M267 PolarHBondContact O-N 3.32Å; M267-S271 WeakPolarHBondContact O-CB 3.34Å; M267-S271 PolarHBondContact O-N 3.43Å; M267-S271 PolarHBondContact O-OG 3.43Å; M267-I360 HydrophobicContact CB-CG2 4.02Å; M267-I360 HydrophobicContact CG-CG2 4.41Å; M267-I360 HydrophobicContact SD-CG2 4.46Å; M267-I364 HydrophobicContact CB-CD1 4.29Å; M267-I364 HydrophobicContact CB-CG1 4.36Å |
| 268 | T | 94.6 | Very high | 92.8 | Very high | 65 Ų | 65 | 36.1 Ų | 36.1 | 40% | 0.399 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -66.1 | -47.8 | 180 | -57.4 | 0 | 0 | 0 | 0 | 111 | I264 I265 I266 S271 A272 | I264-T268 VanDerWaalsContact O-CB 3.3Å; I264-T268 WeakPolarHBondContact O-CB 3.37Å; I264-T268 PolarHBondContact O-N 2.96Å; I264-T268 PolarHBondContact O-OG1 3.06Å; I265-T268 PolarHBondContact O-N 3.36Å; I266-T268 VanDerWaalsContact C-N 3.3Å; I266-T268 PolarHBondContact O-N 3.36Å; T268-S271 PolarHBondContact O-N 3.01Å; T268-A272 PolarHBondContact O-N 2.96Å |
| 269 | T | 95.5 | Very high | 92.6 | Very high | 84 Ų | 84 | 40.8 Ų | 40.8 | 52% | 0.515 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -64.3 | -43.6 | 178.3 | 57.1 | 0 | 0 | 0 | 0 | 112.2 | I265 I266 A272 A273 | I265-T269 WeakPolarHBondContact O-CG2 3.33Å; I265-T269 PolarHBondContact O-N 3.26Å; I265-T269 PolarHBondContact O-OG1 3.09Å; I266-T269 PolarHBondContact O-N 3.49Å; I266-T269 PolarHBondContact O-OG1 3.46Å; T269-A272 PolarHBondContact O-N 2.97Å; T269-A273 WeakPolarHBondContact O-CB 3.4Å; T269-A273 PolarHBondContact O-N 3.22Å |
| 270 | V | 95.3 | Very high | 92.4 | Very high | 15 Ų | 15 | 44.4 Ų | 44.4 | 9% | 0.091 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -66.3 | -38.9 | 177.4 | 174.1 | 0 | 0 | 0 | 0 | 110.9 | A147 I148 L151 I266 A273 L274 | A147-V270 HydrophobicContact CB-CB 4.31Å; A147-V270 HydrophobicContact CB-CG1 3.59Å; A147-V270 WeakPolarHBondContact O-CG1 3.48Å; I148-V270 HydrophobicContact CG1-CG2 4.11Å; L151-V270 HydrophobicContact CB-CG1 4.2Å; L151-V270 HydrophobicContact CD2-CG1 4.1Å; I266-V270 HydrophobicContact CG2-CG2 4.05Å; I266-V270 WeakPolarHBondContact O-CB 3.38Å; I266-V270 VanDerWaalsContact O-CG2 3.23Å; I266-V270 WeakPolarHBondContact O-CG2 3.41Å; I266-V270 PolarHBondContact O-N 2.88Å; V270-A273 CarbonylContact O-C 3.4Å; V270-A273 PolarHBondContact O-N 3.38Å; V270-L274 HydrophobicContact CG1-CD1 4.13Å; V270-L274 HydrophobicContact CG1-CG 4.36Å; V270-L274 WeakPolarHBondContact O-CB 3.4Å; V270-L274 VanDerWaalsContact O-CG 3.31Å; V270-L274 WeakPolarHBondContact O-CG 3.31Å; V270-L274 PolarHBondContact O-N 3.29Å |
| 271 | S | 93.3 | Very high | 91.9 | Very high | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -64.8 | -41.5 | 176.3 | -64.5 | 0 | 0 | 0 | 0 | 112.4 | M267 T268 A273 L274 I275 I360 | M267-S271 WeakPolarHBondContact O-CB 3.34Å; M267-S271 PolarHBondContact O-N 3.43Å; M267-S271 PolarHBondContact O-OG 3.43Å; T268-S271 PolarHBondContact O-N 3.01Å; S271-A273 VanDerWaalsContact C-N 3.34Å; S271-A273 PolarHBondContact O-N 3.35Å; S271-L274 WeakPolarHBondContact O-CB 3.41Å; S271-L274 PolarHBondContact O-N 3.49Å; S271-I275 VanDerWaalsContact O-CG1 3.29Å; S271-I275 WeakPolarHBondContact O-CG1 3.34Å; S271-I275 PolarHBondContact O-N 3.06Å; S271-I360 WeakPolarHBondContact OG-CG2 3.41Å |
| 272 | A | 94.4 | Very high | 91.5 | Very high | 52 Ų | 52 | 46.5 Ų | 46.5 | 43% | 0.43 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62.2 | -42.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | T268 T269 L274 I275 T276 | T268-A272 PolarHBondContact O-N 2.96Å; T269-A272 PolarHBondContact O-N 2.97Å; A272-L274 VanDerWaalsContact C-N 3.34Å; A272-L274 PolarHBondContact O-N 2.71Å; A272-I275 PolarHBondContact O-N 3.29Å; A272-T276 WeakPolarHBondContact O-CB 3.45Å; A272-T276 PolarHBondContact O-N 3.04Å; A272-T276 PolarHBondContact O-OG1 3.39Å |
| 273 | A | 94.2 | Very high | 91.1 | Very high | 30 Ų | 30 | 50.9 Ų | 50.9 | 25% | 0.248 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64.5 | -37.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L151 T269 V270 S271 T276 S277 | L151-A273 HydrophobicContact CD1-CB 4.11Å; L151-A273 HydrophobicContact CD2-CB 3.98Å; T269-A273 WeakPolarHBondContact O-CB 3.4Å; T269-A273 PolarHBondContact O-N 3.22Å; V270-A273 CarbonylContact O-C 3.4Å; V270-A273 PolarHBondContact O-N 3.38Å; S271-A273 VanDerWaalsContact C-N 3.34Å; S271-A273 PolarHBondContact O-N 3.35Å; A273-T276 PolarHBondContact O-N 3.32Å; A273-S277 WeakPolarHBondContact O-CB 3.31Å; A273-S277 PolarHBondContact O-N 3.28Å; A273-S277 PolarHBondContact O-OG 3.26Å |
| 274 | L | 91.2 | Very high | 90.4 | Very high | 1 Ų | 1 | 58.1 Ų | 58.1 | 1% | 0.005 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62 | -52 | 174.8 | -81.9 | 170 | 0 | 0 | 0 | 110.8 | R150 L151 I154 V270 S271 A272 T276 S277 I278 T353 I360 | R150-L274 HydrophobicContact CB-CD2 4.28Å; R150-L274 HydrophobicContact CG-CD2 3.94Å; L151-L274 VanDerWaalsContact CA-CD2 3.48Å; L151-L274 HydrophobicContact CB-CD2 3.83Å; L151-L274 HydrophobicContact CB-CG 4.14Å; L151-L274 HydrophobicContact CD1-CD2 3.9Å; L151-L274 HydrophobicContact CD1-CG 4.05Å; L151-L274 HydrophobicContact CG-CD2 4.5Å; I154-L274 HydrophobicContact CD1-CD2 3.8Å; V270-L274 HydrophobicContact CG1-CD1 4.13Å; V270-L274 HydrophobicContact CG1-CG 4.36Å; V270-L274 WeakPolarHBondContact O-CB 3.4Å; V270-L274 VanDerWaalsContact O-CG 3.31Å; V270-L274 WeakPolarHBondContact O-CG 3.31Å; V270-L274 PolarHBondContact O-N 3.29Å; S271-L274 WeakPolarHBondContact O-CB 3.41Å; S271-L274 PolarHBondContact O-N 3.49Å; A272-L274 VanDerWaalsContact C-N 3.34Å; A272-L274 PolarHBondContact O-N 2.71Å; L274-T276 VanDerWaalsContact C-N 3.26Å; L274-T276 PolarHBondContact O-N 3.02Å; L274-S277 WeakPolarHBondContact CA-OG 3.49Å; L274-S277 PolarHBondContact O-N 2.91Å; L274-S277 VanDerWaalsContact O-N 3.07Å; L274-S277 PolarHBondContact O-OG 3.42Å; L274-I278 VanDerWaalsContact O-CG1 3.3Å; L274-I278 WeakPolarHBondContact O-CG1 3.41Å; L274-I278 PolarHBondContact O-N 3Å; L274-T353 HydrophobicContact CD2-CG2 4.48Å; L274-I360 HydrophobicContact CD1-CD1 4.48Å |
| 275 | I | 90.5 | Very high | 89.5 | Confident | 49 Ų | 49 | 62.3 Ų | 62.3 | 25% | 0.251 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -56.6 | -44.1 | 178.3 | -67.3 | 162.5 | 0 | 0 | 0 | 110.6 | S271 A272 I278 R279 L357 M361 | S271-I275 VanDerWaalsContact O-CG1 3.29Å; S271-I275 WeakPolarHBondContact O-CG1 3.34Å; S271-I275 PolarHBondContact O-N 3.06Å; A272-I275 PolarHBondContact O-N 3.29Å; I275-I278 PolarHBondContact O-N 3.36Å; I275-R279 WeakPolarHBondContact O-CG 3.46Å; I275-R279 PolarHBondContact O-N 2.93Å; I275-L357 HydrophobicContact CD1-CD1 4.07Å; I275-L357 HydrophobicContact CD1-CD2 4.06Å; I275-L357 HydrophobicContact CG1-CD1 3.84Å; I275-L357 HydrophobicContact CG1-CD2 3.67Å; I275-L357 HydrophobicContact CG1-CG 4.42Å; I275-M361 HydrophobicContact CD1-CE 3.87Å |
| 276 | T | 91.3 | Very high | 88.9 | Confident | 88 Ų | 88 | 64.6 Ų | 64.6 | 54% | 0.54 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62.4 | -44.4 | 177.4 | -55.9 | 0 | 0 | 0 | 0 | 111.2 | A272 A273 L274 I278 R279 E280 | A272-T276 WeakPolarHBondContact O-CB 3.45Å; A272-T276 PolarHBondContact O-N 3.04Å; A272-T276 PolarHBondContact O-OG1 3.39Å; A273-T276 PolarHBondContact O-N 3.32Å; L274-T276 VanDerWaalsContact C-N 3.26Å; L274-T276 PolarHBondContact O-N 3.02Å; T276-I278 VanDerWaalsContact C-N 3.32Å; T276-I278 PolarHBondContact O-N 3.43Å; T276-R279 PolarHBondContact O-N 3.5Å; T276-E280 PolarHBondContact O-N 3.41Å |
| 277 | S | 86.8 | Confident | 88.3 | Confident | 10 Ų | 10 | 66.5 Ų | 66.5 | 7% | 0.07 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -64.9 | -33.5 | 178.3 | 74.6 | 0 | 0 | 0 | 0 | 113.2 | I154 A273 L274 S281 | I154-S277 WeakPolarHBondContact CG2-OG 3.24Å; A273-S277 WeakPolarHBondContact O-CB 3.31Å; A273-S277 PolarHBondContact O-N 3.28Å; A273-S277 PolarHBondContact O-OG 3.26Å; L274-S277 WeakPolarHBondContact CA-OG 3.49Å; L274-S277 PolarHBondContact O-N 2.91Å; L274-S277 VanDerWaalsContact O-N 3.07Å; L274-S277 PolarHBondContact O-OG 3.42Å; S277-S281 WeakPolarHBondContact O-CB 3.47Å; S277-S281 PolarHBondContact O-N 3.3Å |
| 278 | I | 85.6 | Confident | 87.7 | Confident | 4 Ų | 4 | 71.1 Ų | 71.1 | 2% | 0.021 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -69.1 | -45.7 | 173.8 | -63.2 | 163.1 | 0 | 0 | 0 | 110.1 | I154 L274 I275 T276 E280 S281 E282 T353 Y354 | I154-I278 HydrophobicContact CD1-CG1 4.34Å; L274-I278 VanDerWaalsContact O-CG1 3.3Å; L274-I278 WeakPolarHBondContact O-CG1 3.41Å; L274-I278 PolarHBondContact O-N 3Å; I275-I278 PolarHBondContact O-N 3.36Å; T276-I278 VanDerWaalsContact C-N 3.32Å; T276-I278 PolarHBondContact O-N 3.43Å; I278-E280 PolarHBondContact O-N 2.94Å; I278-S281 PolarHBondContact O-N 3.33Å; I278-S281 PolarHBondContact O-OG 2.91Å; I278-E282 HydrophobicContact CG2-CG 4.4Å; I278-E282 WeakPolarHBondContact O-CB 3.34Å; I278-E282 WeakPolarHBondContact O-CG 3.2Å; I278-E282 PolarHBondContact O-N 2.85Å; I278-T353 HydrophobicContact CD1-CG2 3.44Å; I278-T353 VanDerWaalsContact CD1-CG2 3.44Å; I278-T353 HydrophobicContact CG1-CG2 4.02Å; I278-Y354 HydrophobicContact CD1-CE1 4.47Å; I278-Y354 HydrophobicContact CG2-CE1 4.36Å; I278-Y354 WeakPolarHBondContact CG2-OH 3.46Å |
| 279 | R | 87 | Confident | 87 | Confident | 166 Ų | 166 | 75.2 Ų | 75.2 | 63% | 0.626 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -59.6 | -38.2 | 177.5 | -72.1 | 176.9 | 179.2 | -170.5 | 0.5 | 111.4 | I275 T276 K283 | I275-R279 WeakPolarHBondContact O-CG 3.46Å; I275-R279 PolarHBondContact O-N 2.93Å; T276-R279 PolarHBondContact O-N 3.5Å; R279-K283 VanDerWaalsContact O-CG 3.31Å; R279-K283 WeakPolarHBondContact O-CG 3.18Å; R279-K283 PolarHBondContact O-N 3.06Å |
| 280 | E | 85.9 | Confident | 86.4 | Confident | 93 Ų | 93 | 79.7 Ų | 79.7 | 44% | 0.435 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -68.5 | -44.5 | 175.7 | -166.2 | -178.3 | 172.2 | 0 | 0 | 112.4 | T276 I278 E282 K283 R284 | T276-E280 PolarHBondContact O-N 3.41Å; I278-E280 PolarHBondContact O-N 2.94Å; E280-E282 VanDerWaalsContact C-N 3.31Å; E280-E282 PolarHBondContact O-N 3.44Å; E280-K283 WeakPolarHBondContact O-CB 3.45Å; E280-K283 PolarHBondContact O-N 2.96Å; E280-R284 WeakPolarHBondContact O-CG 3.4Å; E280-R284 PolarHBondContact O-N 3.27Å; E280-R284 IonicContact OE1-CZ 3.44Å; E280-R284 IonicContact OE1-NE 3.53Å; E280-R284 IonicContact OE1-NH2 2.66Å; E280-R284 PolarHBondContact OE1-NH2 2.86Å |
| 281 | S | 81.4 | Confident | 85.9 | Confident | 37 Ų | 37 | 86.3 Ų | 86.3 | 26% | 0.259 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -63.9 | -37 | 177.5 | 74.7 | 0 | 0 | 0 | 0 | 112 | S277 I278 R284 Y285 | S277-S281 WeakPolarHBondContact O-CB 3.47Å; S277-S281 PolarHBondContact O-N 3.3Å; I278-S281 PolarHBondContact O-N 3.33Å; I278-S281 PolarHBondContact O-OG 2.91Å; S281-R284 PolarHBondContact O-N 2.98Å; S281-Y285 WeakPolarHBondContact O-CB 2.99Å; S281-Y285 PolarHBondContact O-N 3.15Å |
| 282 | E | 83.1 | Confident | 85.4 | Confident | 58 Ų | 58 | 90.1 Ų | 90.1 | 27% | 0.271 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -66 | -40.3 | 173.1 | -74.7 | -165.9 | 158.2 | 0 | 0 | 112.8 | I278 E280 Y285 R286 Y354 | I278-E282 HydrophobicContact CG2-CG 4.4Å; I278-E282 WeakPolarHBondContact O-CB 3.34Å; I278-E282 WeakPolarHBondContact O-CG 3.2Å; I278-E282 PolarHBondContact O-N 2.85Å; E280-E282 VanDerWaalsContact C-N 3.31Å; E280-E282 PolarHBondContact O-N 3.44Å; E282-Y285 WeakPolarHBondContact O-CB 3.47Å; E282-Y285 PolarHBondContact O-N 3.44Å; E282-R286 WeakPolarHBondContact O-CG 3.4Å; E282-R286 PolarHBondContact O-N 3.38Å; E282-R286 IonicContact OE2-NH2 2.99Å; E282-Y354 PolarHBondContact OE1-OH 3.24Å; E282-Y354 VanDerWaalsContact OE1-OH 3.13Å |
| 283 | K | 85.6 | Confident | 84.8 | Confident | 143 Ų | 143 | 91.3 Ų | 91.3 | 62% | 0.622 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -59.7 | -47.8 | 174 | -77.3 | 175.1 | -178.1 | -175.6 | 0 | 110.8 | R279 E280 Y285 R286 I287 | R279-K283 VanDerWaalsContact O-CG 3.31Å; R279-K283 WeakPolarHBondContact O-CG 3.18Å; R279-K283 PolarHBondContact O-N 3.06Å; E280-K283 WeakPolarHBondContact O-CB 3.45Å; E280-K283 PolarHBondContact O-N 2.96Å; K283-Y285 VanDerWaalsContact C-N 3.3Å; K283-Y285 PolarHBondContact O-N 2.95Å; K283-R286 PolarHBondContact O-N 3.03Å; K283-I287 WeakPolarHBondContact O-CG1 3.39Å; K283-I287 PolarHBondContact O-N 3.24Å; K283-I287 VanDerWaalsContact O-N 3.16Å |
| 284 | R | 81.6 | Confident | 84.5 | Confident | 153 Ų | 153 | 94.3 Ų | 94.3 | 58% | 0.577 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -58.9 | -42.4 | 176 | -66.8 | 174.5 | -173.5 | -168.1 | 1.5 | 111.4 | E280 S281 I287 L288 | E280-R284 WeakPolarHBondContact O-CG 3.4Å; E280-R284 PolarHBondContact O-N 3.27Å; E280-R284 IonicContact OE1-CZ 3.44Å; E280-R284 IonicContact OE1-NE 3.53Å; E280-R284 IonicContact OE1-NH2 2.66Å; E280-R284 PolarHBondContact OE1-NH2 2.86Å; S281-R284 PolarHBondContact O-N 2.98Å; R284-I287 PolarHBondContact O-N 3.25Å; R284-L288 WeakPolarHBondContact O-CG 3.19Å; R284-L288 PolarHBondContact O-N 2.9Å; R284-L288 VanDerWaalsContact O-N 3.07Å |
| 285 | Y | 76.5 | Confident | 84.3 | Confident | 97 Ų | 97 | 98.2 Ų | 98.2 | 38% | 0.38 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -62.1 | -42.9 | 176.5 | -178 | -95.4 | 0 | 0 | 0 | 113.1 | S281 E282 K283 I287 L288 R289 Y343 | S281-Y285 WeakPolarHBondContact O-CB 2.99Å; S281-Y285 PolarHBondContact O-N 3.15Å; E282-Y285 WeakPolarHBondContact O-CB 3.47Å; E282-Y285 PolarHBondContact O-N 3.44Å; K283-Y285 VanDerWaalsContact C-N 3.3Å; K283-Y285 PolarHBondContact O-N 2.95Å; Y285-I287 VanDerWaalsContact C-N 3.31Å; Y285-I287 PolarHBondContact O-N 3.36Å; Y285-L288 PolarHBondContact O-N 3.07Å; Y285-R289 WeakPolarHBondContact O-CB 3.34Å; Y285-R289 PolarHBondContact O-N 3.42Å; Y285-Y343 HydrophobicContact CD2-CE1 4.4Å; Y285-Y343 AromaticContact CE2-CD1 3.47Å; Y285-Y343 HydrophobicContact CE2-CD1 3.47Å; Y285-Y343 VanDerWaalsContact CE2-CD1 3.47Å; Y285-Y343 AromaticContact CE2-CE1 3.59Å; Y285-Y343 HydrophobicContact CE2-CE1 3.59Å; Y285-Y343 AromaticContact CZ-CD1 3.89Å |
| 286 | R | 81.7 | Confident | 83.9 | Confident | 156 Ų | 156 | 101.5 Ų | 101.5 | 59% | 0.589 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -62.6 | -38.8 | 177.8 | -70.5 | 175.2 | -162.4 | -170.2 | 6.3 | 111.8 | E282 K283 R289 R290 | E282-R286 WeakPolarHBondContact O-CG 3.4Å; E282-R286 PolarHBondContact O-N 3.38Å; E282-R286 IonicContact OE2-NH2 2.99Å; K283-R286 PolarHBondContact O-N 3.03Å; R286-R289 PolarHBondContact O-N 2.85Å; R286-R290 WeakPolarHBondContact O-CG 3.49Å; R286-R290 PolarHBondContact O-N 3.02Å; R286-R290 VanDerWaalsContact O-N 3.13Å |
| 287 | I | 85 | Confident | 83.5 | Confident | 92 Ų | 92 | 101.7 Ų | 101.7 | 47% | 0.472 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -64.9 | -50.8 | 176.7 | -65.6 | 165.6 | 0 | 0 | 0 | 110.4 | K283 R284 Y285 R289 R290 Y291 | K283-I287 WeakPolarHBondContact O-CG1 3.39Å; K283-I287 PolarHBondContact O-N 3.24Å; K283-I287 VanDerWaalsContact O-N 3.16Å; R284-I287 PolarHBondContact O-N 3.25Å; Y285-I287 VanDerWaalsContact C-N 3.31Å; Y285-I287 PolarHBondContact O-N 3.36Å; I287-R289 PolarHBondContact O-N 3.07Å; I287-R290 WeakPolarHBondContact O-CB 3.27Å; I287-R290 PolarHBondContact O-N 3.48Å; I287-R290 VanDerWaalsContact O-N 3.07Å; I287-Y291 HydrophobicContact CG2-CD2 3.87Å; I287-Y291 HydrophobicContact CG2-CE2 3.7Å; I287-Y291 WeakPolarHBondContact O-CD2 3.18Å; I287-Y291 PolarHBondContact O-N 2.91Å; I287-Y291 VanDerWaalsContact O-N 3.12Å |
| 288 | L | 81.1 | Confident | 83.5 | Confident | 101 Ų | 101 | 107.9 Ų | 107.9 | 53% | 0.529 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61 | -34.9 | 178.3 | -68.6 | 172.3 | 0 | 0 | 0 | 112.5 | R284 Y285 R292 | R284-L288 WeakPolarHBondContact O-CG 3.19Å; R284-L288 PolarHBondContact O-N 2.9Å; R284-L288 VanDerWaalsContact O-N 3.07Å; Y285-L288 PolarHBondContact O-N 3.07Å; L288-R292 PolarHBondContact O-N 3.44Å |
| 289 | R | 79.7 | Confident | 83.4 | Confident | 150 Ų | 150 | 112.4 Ų | 112.4 | 57% | 0.566 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -66.6 | -35.9 | 175.3 | -170.4 | 174.3 | -179.3 | -162 | -1 | 112.5 | Y285 R286 I287 N293 | Y285-R289 WeakPolarHBondContact O-CB 3.34Å; Y285-R289 PolarHBondContact O-N 3.42Å; R286-R289 PolarHBondContact O-N 2.85Å; I287-R289 PolarHBondContact O-N 3.07Å; R289-N293 VanDerWaalsContact O-CG 3.31Å; R289-N293 PolarHBondContact O-N 3.48Å; R289-N293 VanDerWaalsContact O-N 3.08Å |
| 290 | R | 83.7 | Confident | 83.1 | Confident | 179 Ų | 179 | 109.1 Ų | 109.1 | 68% | 0.675 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63.8 | -54 | 173.1 | -72.5 | 178 | -179.3 | -178.6 | -1.7 | 110.6 | R286 I287 R292 N293 D294 | R286-R290 WeakPolarHBondContact O-CG 3.49Å; R286-R290 PolarHBondContact O-N 3.02Å; R286-R290 VanDerWaalsContact O-N 3.13Å; I287-R290 WeakPolarHBondContact O-CB 3.27Å; I287-R290 PolarHBondContact O-N 3.48Å; I287-R290 VanDerWaalsContact O-N 3.07Å; R290-R292 VanDerWaalsContact C-N 3.25Å; R290-R292 PolarHBondContact O-N 2.92Å; R290-R292 VanDerWaalsContact O-N 3.17Å; R290-N293 WeakPolarHBondContact O-CA 3.23Å; R290-N293 WeakPolarHBondContact O-CB 3.23Å; R290-N293 PolarHBondContact O-N 2.75Å; R290-D294 PolarHBondContact O-N 3.17Å |
| 291 | Y | 83.9 | Confident | 82.8 | Confident | 154 Ų | 154 | 108.3 Ų | 108.3 | 60% | 0.604 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -52.9 | -42 | 175.7 | -82.4 | -72.6 | 0 | 0 | 0 | 112.9 | I287 D294 C295 | I287-Y291 HydrophobicContact CG2-CD2 3.87Å; I287-Y291 HydrophobicContact CG2-CE2 3.7Å; I287-Y291 WeakPolarHBondContact O-CD2 3.18Å; I287-Y291 PolarHBondContact O-N 2.91Å; I287-Y291 VanDerWaalsContact O-N 3.12Å; Y291-D294 PolarHBondContact O-N 2.85Å; Y291-C295 WeakPolarHBondContact O-CB 3.01Å; Y291-C295 PolarHBondContact O-N 3.32Å; Y291-C295 PolarHBondContact O-SG 3.21Å |
| 292 | R | 82.7 | Confident | 82.8 | Confident | 80 Ų | 80 | 109.7 Ų | 109.7 | 30% | 0.302 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66 | -39.1 | 177.2 | -174 | 166.3 | -170.2 | 173 | 5 | 112.8 | L288 R290 K296 | L288-R292 PolarHBondContact O-N 3.44Å; R290-R292 VanDerWaalsContact C-N 3.25Å; R290-R292 PolarHBondContact O-N 2.92Å; R290-R292 VanDerWaalsContact O-N 3.17Å; R292-K296 WeakPolarHBondContact O-CG 3.2Å; R292-K296 PolarHBondContact O-N 3.49Å |
| 293 | N | 82.2 | Confident | 82.6 | Confident | 76 Ų | 76 | 110.9 Ų | 110.9 | 41% | 0.406 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.6 | -40 | 175.9 | -73.3 | -8.5 | 0 | 0 | 0 | 110.9 | R289 R290 K296 N297 | R289-N293 VanDerWaalsContact O-CG 3.31Å; R289-N293 PolarHBondContact O-N 3.48Å; R289-N293 VanDerWaalsContact O-N 3.08Å; R290-N293 WeakPolarHBondContact O-CA 3.23Å; R290-N293 WeakPolarHBondContact O-CB 3.23Å; R290-N293 PolarHBondContact O-N 2.75Å; N293-K296 PolarHBondContact O-N 3.38Å; N293-N297 WeakPolarHBondContact O-CB 3.48Å; N293-N297 PolarHBondContact O-N 2.79Å; N293-N297 PolarHBondContact O-ND2 3.46Å |
| 294 | D | 87.6 | Confident | 82.3 | Confident | 93 Ų | 93 | 107.2 Ų | 107.2 | 50% | 0.497 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.3 | -45.3 | 177.2 | -59.6 | -26.6 | 0 | 0 | 0 | 110.8 | R290 Y291 K296 N297 F298 | R290-D294 PolarHBondContact O-N 3.17Å; Y291-D294 PolarHBondContact O-N 2.85Å; D294-K296 VanDerWaalsContact C-N 3.33Å; D294-K296 PolarHBondContact O-N 2.85Å; D294-N297 PolarHBondContact O-N 2.94Å; D294-F298 VanDerWaalsContact O-CB 3.28Å; D294-F298 WeakPolarHBondContact O-CB 3.04Å; D294-F298 PolarHBondContact O-N 3.41Å |
| 295 | C | 86.7 | Confident | 81.9 | Confident | 84 Ų | 84 | 103.3 Ų | 103.3 | 57% | 0.568 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.2 | -37.1 | 173.9 | -70.1 | 0 | 0 | 0 | 0 | 112.8 | Y291 Q299 | Y291-C295 WeakPolarHBondContact O-CB 3.01Å; Y291-C295 PolarHBondContact O-N 3.32Å; Y291-C295 PolarHBondContact O-SG 3.21Å; C295-Q299 WeakPolarHBondContact O-CB 3.43Å; C295-Q299 PolarHBondContact O-N 3.17Å |
| 296 | K | 82.5 | Confident | 81.8 | Confident | 117 Ų | 117 | 105 Ų | 105 | 51% | 0.509 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.3 | -45.4 | 174.8 | -82.1 | -176.6 | 176.3 | -171.5 | 0 | 111.7 | R292 N293 D294 F298 Q299 I300 | R292-K296 WeakPolarHBondContact O-CG 3.2Å; R292-K296 PolarHBondContact O-N 3.49Å; N293-K296 PolarHBondContact O-N 3.38Å; D294-K296 VanDerWaalsContact C-N 3.33Å; D294-K296 PolarHBondContact O-N 2.85Å; K296-F298 VanDerWaalsContact C-N 3.32Å; K296-Q299 PolarHBondContact O-N 2.84Å; K296-I300 VanDerWaalsContact O-CG1 3.29Å; K296-I300 WeakPolarHBondContact O-CG1 3.3Å; K296-I300 PolarHBondContact O-N 3.08Å |
| 297 | N | 82.7 | Confident | 81.3 | Confident | 92 Ų | 92 | 101.3 Ų | 101.3 | 49% | 0.492 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.7 | -43.9 | 177.7 | -69.9 | -14.4 | 0 | 0 | 0 | 110.3 | N293 D294 Q299 I300 T301 | N293-N297 WeakPolarHBondContact O-CB 3.48Å; N293-N297 PolarHBondContact O-N 2.79Å; N293-N297 PolarHBondContact O-ND2 3.46Å; D294-N297 PolarHBondContact O-N 2.94Å; N297-Q299 VanDerWaalsContact C-N 3.34Å; N297-Q299 PolarHBondContact O-N 2.87Å; N297-I300 PolarHBondContact O-N 3.01Å; N297-T301 PolarHBondContact O-N 3.04Å; N297-T301 PolarHBondContact O-OG1 3.47Å |
| 298 | F | 86.9 | Confident | 80.4 | Confident | 140 Ų | 140 | 101.5 Ų | 101.5 | 61% | 0.614 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -59.8 | -43 | 175.3 | -173.9 | -107.6 | 0 | 0 | 0 | 112.2 | D294 K296 I300 T301 I302 | D294-F298 VanDerWaalsContact O-CB 3.28Å; D294-F298 WeakPolarHBondContact O-CB 3.04Å; D294-F298 PolarHBondContact O-N 3.41Å; K296-F298 VanDerWaalsContact C-N 3.32Å; F298-I300 PolarHBondContact O-N 3.39Å; F298-T301 PolarHBondContact O-N 3.48Å; F298-I302 HydrophobicContact CD1-CD1 3.74Å; F298-I302 HydrophobicContact CE1-CD1 3.31Å; F298-I302 HydrophobicContact CE1-CG1 4.27Å; F298-I302 HydrophobicContact CZ-CD1 3.76Å; F298-I302 HydrophobicContact CZ-CG1 4.36Å; F298-I302 WeakPolarHBondContact O-CG1 3.49Å; F298-I302 PolarHBondContact O-N 3.03Å |
| 299 | Q | 83.2 | Confident | 79.7 | Confident | 99 Ų | 99 | 100.5 Ų | 100.5 | 46% | 0.463 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.7 | -43 | 175.2 | -171.7 | 61.6 | 54.9 | 0 | 0 | 111.9 | C295 K296 N297 T301 I302 D303 | C295-Q299 WeakPolarHBondContact O-CB 3.43Å; C295-Q299 PolarHBondContact O-N 3.17Å; K296-Q299 PolarHBondContact O-N 2.84Å; N297-Q299 VanDerWaalsContact C-N 3.34Å; N297-Q299 PolarHBondContact O-N 2.87Å; Q299-T301 VanDerWaalsContact C-N 3.32Å; Q299-T301 PolarHBondContact O-N 3.32Å; Q299-I302 PolarHBondContact O-N 3.34Å; Q299-D303 PolarHBondContact NE2-OD1 3.34Å; Q299-D303 VanDerWaalsContact O-CG 3.27Å; Q299-D303 PolarHBondContact O-N 3.24Å |
| 300 | I | 80.9 | Confident | 78.9 | Confident | 98 Ų | 98 | 99.2 Ų | 99.2 | 50% | 0.503 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61 | -43.4 | 175.5 | -67.5 | 163.5 | 0 | 0 | 0 | 110.2 | K296 N297 F298 I302 D303 T304 | K296-I300 VanDerWaalsContact O-CG1 3.29Å; K296-I300 WeakPolarHBondContact O-CG1 3.3Å; K296-I300 PolarHBondContact O-N 3.08Å; N297-I300 PolarHBondContact O-N 3.01Å; F298-I300 PolarHBondContact O-N 3.39Å; I300-I302 PolarHBondContact O-N 2.98Å; I300-D303 PolarHBondContact O-N 3.48Å; I300-T304 HydrophobicContact CG2-CG2 4.37Å; I300-T304 WeakPolarHBondContact O-CG2 3.44Å; I300-T304 PolarHBondContact O-N 2.96Å; I300-T304 PolarHBondContact O-OG1 3.19Å |
| 301 | T | 80.6 | Confident | 77.8 | Confident | 76 Ų | 76 | 97 Ų | 97 | 47% | 0.466 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.4 | -39.8 | 177.7 | -55.2 | 0 | 0 | 0 | 0 | 112.5 | N297 F298 Q299 T304 T305 | N297-T301 PolarHBondContact O-N 3.04Å; N297-T301 PolarHBondContact O-OG1 3.47Å; F298-T301 PolarHBondContact O-N 3.48Å; Q299-T301 VanDerWaalsContact C-N 3.32Å; Q299-T301 PolarHBondContact O-N 3.32Å; T301-T304 WeakPolarHBondContact CA-OG1 3.36Å; T301-T304 PolarHBondContact O-OG1 3.16Å; T301-T305 WeakPolarHBondContact O-CB 3.23Å; T301-T305 WeakPolarHBondContact O-CG2 3.44Å; T301-T305 PolarHBondContact O-N 3.21Å; T301-T305 PolarHBondContact O-OG1 3.29Å |
| 302 | I | 81.2 | Confident | 76.6 | Confident | 66 Ų | 66 | 96 Ų | 96 | 34% | 0.338 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.1 | -44.9 | 174.1 | -70.8 | 171.4 | 0 | 0 | 0 | 110.4 | F298 Q299 I300 T304 T305 R306 | F298-I302 HydrophobicContact CD1-CD1 3.74Å; F298-I302 HydrophobicContact CE1-CD1 3.31Å; F298-I302 HydrophobicContact CE1-CG1 4.27Å; F298-I302 HydrophobicContact CZ-CD1 3.76Å; F298-I302 HydrophobicContact CZ-CG1 4.36Å; F298-I302 WeakPolarHBondContact O-CG1 3.49Å; F298-I302 PolarHBondContact O-N 3.03Å; Q299-I302 PolarHBondContact O-N 3.34Å; I300-I302 PolarHBondContact O-N 2.98Å; I302-T304 VanDerWaalsContact C-N 3.35Å; I302-T304 PolarHBondContact O-N 2.91Å; I302-T305 WeakPolarHBondContact CA-OG1 3.29Å; I302-T305 PolarHBondContact O-OG1 3.3Å; I302-T305 VanDerWaalsContact O-OG1 3.13Å; I302-R306 WeakPolarHBondContact O-CB 3.47Å; I302-R306 PolarHBondContact O-N 3.29Å |
| 303 | D | 79.8 | Confident | 75.4 | Confident | 83 Ų | 83 | 97 Ų | 97 | 44% | 0.444 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.8 | -40.3 | -179.1 | -67.9 | -19.2 | 0 | 0 | 0 | 111 | Q299 I300 V307 | Q299-D303 PolarHBondContact NE2-OD1 3.34Å; Q299-D303 VanDerWaalsContact O-CG 3.27Å; Q299-D303 PolarHBondContact O-N 3.24Å; I300-D303 PolarHBondContact O-N 3.48Å; D303-V307 VanDerWaalsContact O-CG2 3.23Å; D303-V307 WeakPolarHBondContact O-CG2 3.07Å; D303-V307 PolarHBondContact O-N 3.3Å; D303-V307 VanDerWaalsContact O-N 3.08Å |
| 304 | T | 77.4 | Confident | 74.1 | Confident | 65 Ų | 65 | 98.5 Ų | 98.5 | 40% | 0.399 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -68.1 | -49.1 | 176.2 | 54 | 0 | 0 | 0 | 0 | 112.3 | I300 T301 I302 R306 V307 D308 | I300-T304 HydrophobicContact CG2-CG2 4.37Å; I300-T304 WeakPolarHBondContact O-CG2 3.44Å; I300-T304 PolarHBondContact O-N 2.96Å; I300-T304 PolarHBondContact O-OG1 3.19Å; T301-T304 WeakPolarHBondContact CA-OG1 3.36Å; T301-T304 PolarHBondContact O-OG1 3.16Å; I302-T304 VanDerWaalsContact C-N 3.35Å; I302-T304 PolarHBondContact O-N 2.91Å; T304-R306 VanDerWaalsContact C-N 3.26Å; T304-R306 PolarHBondContact O-N 2.98Å; T304-V307 WeakPolarHBondContact O-CA 3.35Å; T304-V307 PolarHBondContact O-N 3.15Å; T304-D308 VanDerWaalsContact O-CG 3.32Å; T304-D308 PolarHBondContact O-N 2.87Å |
| 305 | T | 74.6 | Confident | 72.4 | Confident | 72 Ų | 72 | 99.9 Ų | 99.9 | 44% | 0.442 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.4 | -34.7 | 179.4 | 44.3 | 0 | 0 | 0 | 0 | 112.5 | T301 I302 S309 | T301-T305 WeakPolarHBondContact O-CB 3.23Å; T301-T305 WeakPolarHBondContact O-CG2 3.44Å; T301-T305 PolarHBondContact O-N 3.21Å; T301-T305 PolarHBondContact O-OG1 3.29Å; I302-T305 WeakPolarHBondContact CA-OG1 3.29Å; I302-T305 PolarHBondContact O-OG1 3.3Å; I302-T305 VanDerWaalsContact O-OG1 3.13Å; T305-S309 WeakPolarHBondContact O-CB 3.44Å; T305-S309 PolarHBondContact O-N 3.33Å; T305-S309 PolarHBondContact O-OG 2.88Å |
| 306 | R | 73.3 | Confident | 70.7 | Confident | 132 Ų | 132 | 101.5 Ų | 101.5 | 50% | 0.498 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.6 | -43.8 | 172.8 | -172.8 | 177.6 | 158.2 | 91.5 | 3.3 | 111 | I302 T304 F310 | I302-R306 WeakPolarHBondContact O-CB 3.47Å; I302-R306 PolarHBondContact O-N 3.29Å; T304-R306 VanDerWaalsContact C-N 3.26Å; T304-R306 PolarHBondContact O-N 2.98Å; R306-F310 HydrophobicContact CG-CD2 4.18Å; R306-F310 HydrophobicContact CG-CE2 4.2Å; R306-F310 VanDerWaalsContact O-CD2 3.26Å; R306-F310 WeakPolarHBondContact O-CD2 3.42Å; R306-F310 PolarHBondContact O-N 3.49Å; R306-F310 VanDerWaalsContact O-N 3.11Å |
| 307 | V | 72.6 | Confident | 69.2 | Low | 79 Ų | 79 | 100.8 Ų | 100.8 | 48% | 0.479 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.6 | -43.4 | 175.7 | 170.8 | 0 | 0 | 0 | 0 | 111.8 | D303 T304 F310 M311 | D303-V307 VanDerWaalsContact O-CG2 3.23Å; D303-V307 WeakPolarHBondContact O-CG2 3.07Å; D303-V307 PolarHBondContact O-N 3.3Å; D303-V307 VanDerWaalsContact O-N 3.08Å; T304-V307 WeakPolarHBondContact O-CA 3.35Å; T304-V307 PolarHBondContact O-N 3.15Å; V307-F310 WeakPolarHBondContact O-CB 3.19Å; V307-F310 PolarHBondContact O-N 3Å; V307-F310 VanDerWaalsContact O-N 3.17Å; V307-M311 HydrophobicContact CG1-CE 4.39Å; V307-M311 PolarHBondContact O-N 3.29Å |
| 308 | D | 66.3 | Low | 67.7 | Low | 95 Ų | 95 | 101.9 Ų | 101.9 | 51% | 0.508 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.6 | -42.9 | 179.1 | -66.4 | -27.1 | 0 | 0 | 0 | 111.7 | T304 F310 M311 H312 | T304-D308 VanDerWaalsContact O-CG 3.32Å; T304-D308 PolarHBondContact O-N 2.87Å; D308-F310 VanDerWaalsContact C-N 3.28Å; D308-F310 PolarHBondContact O-N 3.09Å; D308-M311 PolarHBondContact O-N 3.1Å; D308-H312 PolarHBondContact O-N 3.02Å |
| 309 | S | 64.9 | Low | 66 | Low | 80 Ų | 80 | 102.2 Ų | 102.2 | 56% | 0.559 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63 | -35.1 | 175.1 | -58.6 | 0 | 0 | 0 | 0 | 112 | T305 N313 | T305-S309 WeakPolarHBondContact O-CB 3.44Å; T305-S309 PolarHBondContact O-N 3.33Å; T305-S309 PolarHBondContact O-OG 2.88Å; S309-N313 VanDerWaalsContact O-CB 3.32Å; S309-N313 WeakPolarHBondContact O-CB 3.23Å; S309-N313 PolarHBondContact O-N 3.36Å; S309-N313 VanDerWaalsContact O-N 3.09Å |
| 310 | F | 64.2 | Low | 64.4 | Low | 123 Ų | 123 | 104 Ų | 104 | 54% | 0.539 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -67.6 | -42.3 | 172.9 | -95.7 | -75.9 | 0 | 0 | 0 | 112.1 | R306 V307 D308 N314 | R306-F310 HydrophobicContact CG-CD2 4.18Å; R306-F310 HydrophobicContact CG-CE2 4.2Å; R306-F310 VanDerWaalsContact O-CD2 3.26Å; R306-F310 WeakPolarHBondContact O-CD2 3.42Å; R306-F310 PolarHBondContact O-N 3.49Å; R306-F310 VanDerWaalsContact O-N 3.11Å; V307-F310 WeakPolarHBondContact O-CB 3.19Å; V307-F310 PolarHBondContact O-N 3Å; V307-F310 VanDerWaalsContact O-N 3.17Å; D308-F310 VanDerWaalsContact C-N 3.28Å; D308-F310 PolarHBondContact O-N 3.09Å; F310-N314 WeakPolarHBondContact O-CB 3.31Å; F310-N314 PolarHBondContact O-N 2.89Å; F310-N314 VanDerWaalsContact O-N 3.13Å |
| 311 | M | 59.4 | Low | 62.7 | Low | 134 Ų | 134 | 107.7 Ų | 107.7 | 66% | 0.66 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -64.9 | -42.1 | 176.4 | -72.8 | -155.4 | -179.5 | 0 | 0 | 112 | V307 D308 N314 N315 | V307-M311 HydrophobicContact CG1-CE 4.39Å; V307-M311 PolarHBondContact O-N 3.29Å; D308-M311 PolarHBondContact O-N 3.1Å; M311-N314 PolarHBondContact O-N 2.92Å; M311-N315 PolarHBondContact O-N 2.94Å; M311-N315 VanDerWaalsContact O-N 3.15Å |
| 312 | H | 59.6 | Low | 61.2 | Low | 133 Ų | 133 | 107.3 Ų | 107.3 | 62% | 0.616 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -70.1 | -35.1 | -178.7 | -147.4 | -39 | 0 | 0 | 0 | 112.6 | D308 N316 | D308-H312 PolarHBondContact O-N 3.02Å; H312-N316 PolarHBondContact O-N 3.5Å |
| 313 | N | 57.4 | Low | 59.7 | Low | 101 Ų | 101 | 113.3 Ų | 113.3 | 54% | 0.54 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -70.1 | -36.8 | 175.7 | -165.2 | 32.6 | 0 | 0 | 0 | 112 | S309 N317 | S309-N313 VanDerWaalsContact O-CB 3.32Å; S309-N313 WeakPolarHBondContact O-CB 3.23Å; S309-N313 PolarHBondContact O-N 3.36Å; S309-N313 VanDerWaalsContact O-N 3.09Å; N313-N317 PolarHBondContact O-N 2.95Å |
| 314 | N | 53.6 | Low | 58.1 | Low | 107 Ų | 107 | 117.7 Ų | 117.7 | 57% | 0.572 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -70.5 | -35.1 | 179.3 | -146.8 | 36.3 | 0 | 0 | 0 | 112.1 | F310 M311 N316 N317 N318 | F310-N314 WeakPolarHBondContact O-CB 3.31Å; F310-N314 PolarHBondContact O-N 2.89Å; F310-N314 VanDerWaalsContact O-N 3.13Å; M311-N314 PolarHBondContact O-N 2.92Å; N314-N316 PolarHBondContact O-N 3.26Å; N314-N317 PolarHBondContact O-N 3.39Å; N314-N318 PolarHBondContact O-N 3.13Å |
| 315 | N | 52.1 | Low | 56.6 | Low | 122 Ų | 122 | 123.7 Ų | 123.7 | 65% | 0.652 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -69.7 | -31.6 | 179 | -129.9 | 17 | 0 | 0 | 0 | 112.9 | M311 | M311-N315 PolarHBondContact O-N 2.94Å; M311-N315 VanDerWaalsContact O-N 3.15Å |
| 316 | N | 52.3 | Low | 55.1 | Low | 118 Ų | 118 | 125.5 Ų | 125.5 | 63% | 0.631 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -73.9 | -29.3 | 175.1 | -85 | -1.6 | 0 | 0 | 0 | 113.1 | H312 N314 | H312-N316 PolarHBondContact O-N 3.5Å; N314-N316 PolarHBondContact O-N 3.26Å |
| 317 | N | 51.2 | Low | 53.9 | Low | 101 Ų | 101 | 125.8 Ų | 125.8 | 54% | 0.54 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -82.8 | -16.4 | -179 | -89.5 | -5.2 | 0 | 0 | 0 | 114.3 | N313 N314 N319 N320 | N313-N317 PolarHBondContact O-N 2.95Å; N314-N317 PolarHBondContact O-N 3.39Å; N317-N319 PolarHBondContact O-N 3.31Å; N317-N320 PolarHBondContact O-N 3.47Å |
| 318 | N | 50 | Low | 52.3 | Low | 116 Ų | 116 | 128.4 Ų | 128.4 | 62% | 0.62 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | -0.9 | -180 | -86.6 | -4 | 0 | 0 | 0 | 115 | N314 | N314-N318 PolarHBondContact O-N 3.13Š|
| 319 | N | 50.9 | Low | 51.3 | Low | 146 Ų | 146 | 128.3 Ų | 128.3 | 78% | 0.781 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.7 | -0.8 | 171.9 | -83.8 | -6 | 0 | 0 | 0 | 114.7 | N317 | N317-N319 PolarHBondContact O-N 3.31Š|
| 320 | N | 51.3 | Low | 50.2 | Low | 137 Ų | 137 | 129.8 Ų | 129.8 | 73% | 0.733 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -116.8 | 105.3 | 176.2 | -71.4 | -23.8 | 0 | 0 | 0 | 111 | N317 G322 | N317-N320 PolarHBondContact O-N 3.47Å; N320-G322 PolarHBondContact O-N 3.21Å |
| 321 | N | 45 | Very low | 49.1 | Very low | 175 Ų | 175 | 134.7 Ų | 134.7 | 94% | 0.936 | 72% | 0.719 | S | S | * | * | trans | -44.4 | 118.4 | 166.4 | -66.4 | -31.3 | 0 | 0 | 0 | 110.9 | ||||
| 322 | G | 48.3 | Very low | 48.4 | Very low | 69 Ų | 69 | 133.1 Ų | 133.1 | 71% | 0.711 | 72% | 0.719 | S | S | * | * | trans | 163.9 | 96.6 | 170.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | N320 | N320-G322 PolarHBondContact O-N 3.21Š| ||
| 323 | E | 50 | Low | 47.7 | Very low | 192 Ų | 192 | 135.9 Ų | 135.9 | 90% | 0.897 | 73% | 0.729 | S | S | * | * | trans | 46 | 109.1 | 147.2 | -64.2 | -176 | 163.2 | 0 | 0 | 120.1 | K325 | E323-K325 PolarHBondContact O-N 3.15Å; E323-K325 VanDerWaalsContact O-N 3.1Å | ||
| 324 | D | 45.6 | Very low | 47 | Very low | 175 Ų | 175 | 139.8 Ų | 139.8 | 94% | 0.936 | 74% | 0.744 | S | S | * | * | trans | -47.5 | 102.9 | 170.5 | -74.9 | -46.7 | 0 | 0 | 0 | 114.1 | ||||
| 325 | K | 47 | Very low | 46.4 | Very low | 190 Ų | 190 | 142.4 Ų | 142.4 | 83% | 0.826 | 75% | 0.75 | S | S | * | * | trans | -109.1 | 104.4 | 154.1 | -81.3 | -177.8 | -179.8 | 170.9 | 0 | 109.3 | E323 I327 | E323-K325 PolarHBondContact O-N 3.15Å; E323-K325 VanDerWaalsContact O-N 3.1Å; K325-I327 VanDerWaalsContact C-N 3.29Å; K325-I327 PolarHBondContact O-N 3.28Å | ||
| 326 | S | 43.2 | Very low | 46 | Very low | 110 Ų | 110 | 141.8 Ų | 141.8 | 77% | 0.769 | 75% | 0.754 | S | S | * | * | trans | -66.5 | 81.6 | 174.4 | 57.3 | 0 | 0 | 0 | 0 | 111 | T328 | S326-T328 PolarHBondContact O-N 3.17Š| ||
| 327 | I | 47.4 | Very low | 45.4 | Very low | 139 Ų | 139 | 141.5 Ų | 141.5 | 71% | 0.713 | 75% | 0.753 | S | S | * | * | trans | -73.1 | 95.7 | 171.5 | -56.4 | 179.6 | 0 | 0 | 0 | 107.9 | K325 V329 | K325-I327 VanDerWaalsContact C-N 3.29Å; K325-I327 PolarHBondContact O-N 3.28Å; I327-V329 VanDerWaalsContact C-N 3.28Å; I327-V329 HydrophobicContact CG2-CG2 3.58Å; I327-V329 PolarHBondContact O-N 3.44Å | ||
| 328 | T | 38.9 | Very low | 45.2 | Very low | 133 Ų | 133 | 140.3 Ų | 140.3 | 82% | 0.816 | 75% | 0.752 | S | S | * | * | trans | -73.7 | 80.4 | 168.3 | 34.6 | 0 | 0 | 0 | 0 | 109.4 | S326 | S326-T328 PolarHBondContact O-N 3.17Š| ||
| 329 | V | 45.8 | Very low | 44.8 | Very low | 94 Ų | 94 | 140.6 Ų | 140.6 | 57% | 0.57 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 126.9 | 171 | -175.9 | 0 | 0 | 0 | 0 | 108.9 | I327 R331 | I327-V329 VanDerWaalsContact C-N 3.28Å; I327-V329 HydrophobicContact CG2-CG2 3.58Å; I327-V329 PolarHBondContact O-N 3.44Å; V329-R331 PolarHBondContact O-N 3.32Å |
| 330 | P | 40.7 | Very low | 44.7 | Very low | 111 Ų | 111 | 141 Ų | 141 | 72% | 0.721 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 122.8 | -179.2 | -16.7 | 28.5 | 0 | 0 | 0 | 110.3 | P332 | P330-P332 VanDerWaalsContact O-CD 3.27Å; P330-P332 WeakPolarHBondContact O-CD 3.31Å |
| 331 | R | 41.3 | Very low | 44.3 | Very low | 225 Ų | 225 | 140.8 Ų | 140.8 | 85% | 0.849 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 120.1 | 166.7 | -75.5 | 179.4 | 177.1 | -179.9 | -1.2 | 107.9 | V329 K333 | V329-R331 PolarHBondContact O-N 3.32Å; R331-K333 VanDerWaalsContact C-N 3.28Å; R331-K333 PolarHBondContact O-N 2.95Å |
| 332 | P | 44.1 | Very low | 44.1 | Very low | 102 Ų | 102 | 138.3 Ų | 138.3 | 66% | 0.662 | 74% | 0.736 | S | S | * | * | trans | -64.7 | 98.9 | 164 | 26.2 | -29.3 | 0 | 0 | 0 | 106.6 | P330 Q334 | P330-P332 VanDerWaalsContact O-CD 3.27Å; P330-P332 WeakPolarHBondContact O-CD 3.31Å; P332-Q334 PolarHBondContact O-N 3.48Å | ||
| 333 | K | 44.9 | Very low | 44.1 | Very low | 191 Ų | 191 | 138.7 Ų | 138.7 | 83% | 0.83 | 72% | 0.716 | S | S | * | * | trans | -71.4 | 57.9 | 165.6 | -69.6 | 178.6 | -179.8 | 170.7 | 0 | 108 | R331 K335 | R331-K333 VanDerWaalsContact C-N 3.28Å; R331-K333 PolarHBondContact O-N 2.95Å; K333-K335 PolarHBondContact O-N 3.01Å | ||
| 334 | Q | 44.5 | Very low | 43.7 | Very low | 182 Ų | 182 | 133.3 Ų | 133.3 | 85% | 0.85 | 70% | 0.7 | S | S | * | * | trans | -79.5 | 59.4 | 164.4 | -151.6 | 173 | 21.6 | 0 | 0 | 107.3 | P332 C336 | P332-Q334 PolarHBondContact O-N 3.48Å; Q334-C336 VanDerWaalsContact C-N 3.32Å; Q334-C336 PolarHBondContact O-N 2.95Å | ||
| 335 | K | 40.2 | Very low | 43.6 | Very low | 162 Ų | 162 | 126.9 Ų | 126.9 | 70% | 0.704 | 68% | 0.675 | S | S | * | * | trans | -64.2 | 105 | 167.4 | -136.3 | 173.7 | -177.2 | 178.7 | 0 | 103.1 | K333 N337 | K333-K335 PolarHBondContact O-N 3.01Å; K335-N337 HydrophobicContact CB-CB 4.31Å; K335-N337 PolarHBondContact O-N 3.06Å | ||
| 336 | C | 42.8 | Very low | 43.6 | Very low | 109 Ų | 109 | 119.4 Ų | 119.4 | 74% | 0.736 | 65% | 0.652 | S | S | * | * | trans | -67.8 | 62.9 | 167.7 | -156.4 | 0 | 0 | 0 | 0 | 107.6 | Q334 S338 | Q334-C336 VanDerWaalsContact C-N 3.32Å; Q334-C336 PolarHBondContact O-N 2.95Å; C336-S338 PolarHBondContact O-N 3.22Å | ||
| 337 | N | 40.2 | Very low | 44 | Very low | 113 Ų | 113 | 124.1 Ų | 124.1 | 60% | 0.604 | 65% | 0.653 | S | S | * | * | trans | -88.1 | 23.6 | 176.1 | -101.6 | 19.9 | 0 | 0 | 0 | 109.1 | K335 H339 | K335-N337 HydrophobicContact CB-CB 4.31Å; K335-N337 PolarHBondContact O-N 3.06Å; N337-H339 PolarHBondContact O-N 3.11Å | ||
| 338 | S | 47.2 | Very low | 44.3 | Very low | 76 Ų | 76 | 119.7 Ų | 119.7 | 53% | 0.531 | 63% | 0.634 | S | S | . | * | trans | -63.3 | 89.1 | 169 | 63 | 0 | 0 | 0 | 0 | 108 | C336 | C336-S338 PolarHBondContact O-N 3.22Š| ||
| 339 | H | 42.5 | Very low | 45.3 | Very low | 121 Ų | 121 | 114.3 Ų | 114.3 | 56% | 0.56 | 60% | 0.603 | S | S | * | * | trans | 32.9 | 111.3 | 151.8 | -80.6 | -107.8 | 0 | 0 | 0 | 115.4 | N337 E341 | N337-H339 PolarHBondContact O-N 3.11Å; H339-E341 HydrophobicContact CB-CB 4.38Å; H339-E341 IonicContact CE1-OE2 3.86Å; H339-E341 IonicContact CG-OE2 3.93Å; H339-E341 IonicContact ND1-OE2 3.58Å; H339-E341 PolarHBondContact ND1-OE2 3.32Å; H339-E341 PolarHBondContact O-N 2.93Å | ||
| 340 | I | 48.5 | Very low | 46.3 | Very low | 155 Ų | 155 | 111.6 Ų | 111.6 | 80% | 0.795 | 59% | 0.586 | S | S | * | * | G | 310 helix | trans | -57.6 | -7.9 | 163.6 | -73.9 | 165.9 | 0 | 0 | 0 | 112 | ||
| 341 | E | 43.1 | Very low | 47.6 | Very low | 133 Ų | 133 | 109.8 Ų | 109.8 | 62% | 0.621 | 57% | 0.567 | S | S | * | * | G | 310 helix | trans | -76.4 | -25.8 | -168.2 | -67.7 | -177.9 | 145 | 0 | 0 | 115.7 | H339 Y343 S344 | H339-E341 HydrophobicContact CB-CB 4.38Å; H339-E341 IonicContact CE1-OE2 3.86Å; H339-E341 IonicContact CG-OE2 3.93Å; H339-E341 IonicContact ND1-OE2 3.58Å; H339-E341 PolarHBondContact ND1-OE2 3.32Å; H339-E341 PolarHBondContact O-N 2.93Å; E341-Y343 PolarHBondContact O-N 3.4Å; E341-S344 PolarHBondContact O-OG 3.15Å; E341-S344 VanDerWaalsContact O-OG 3.09Å |
| 342 | T | 40.7 | Very low | 49.2 | Very low | 122 Ų | 122 | 100.4 Ų | 100.4 | 75% | 0.748 | 54% | 0.535 | S | S | * | . | G | 310 helix | trans | -71.3 | -12.7 | -179 | 8.2 | 0 | 0 | 0 | 0 | 114.8 | ||
| 343 | Y | 47.9 | Very low | 51 | Low | 77 Ų | 77 | 95.6 Ų | 95.6 | 30% | 0.302 | 50% | 0.504 | S | S | . | . | G | 310 helix | trans | -91.1 | -22.8 | -176.2 | -86.3 | -99.4 | 0 | 0 | 0 | 114.2 | Y285 E341 G345 G346 | Y285-Y343 HydrophobicContact CD2-CE1 4.4Å; Y285-Y343 AromaticContact CE2-CD1 3.47Å; Y285-Y343 HydrophobicContact CE2-CD1 3.47Å; Y285-Y343 VanDerWaalsContact CE2-CD1 3.47Å; Y285-Y343 AromaticContact CE2-CE1 3.59Å; Y285-Y343 HydrophobicContact CE2-CE1 3.59Å; Y285-Y343 AromaticContact CZ-CD1 3.89Å; E341-Y343 PolarHBondContact O-N 3.4Å; Y343-G345 PolarHBondContact O-N 2.64Å; Y343-G346 PolarHBondContact O-N 2.02Å |
| 344 | S | 40.5 | Very low | 52.9 | Low | 80 Ų | 80 | 90.7 Ų | 90.7 | 56% | 0.559 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -64.4 | -28.7 | 178 | 60.8 | 0 | 0 | 0 | 0 | 111.9 | E341 G346 R347 S348 | E341-S344 PolarHBondContact O-OG 3.15Å; E341-S344 VanDerWaalsContact O-OG 3.09Å; S344-G346 PolarHBondContact O-N 2.99Å; S344-R347 PolarHBondContact O-N 3.28Å; S344-S348 WeakPolarHBondContact O-CB 3.34Å; S344-S348 PolarHBondContact O-N 3.09Å; S344-S348 PolarHBondContact O-OG 3.49Å; S344-S348 VanDerWaalsContact O-OG 3.05Å |
| 345 | G | 43 | Very low | 55 | Low | 39 Ų | 39 | 82.3 Ų | 82.3 | 40% | 0.402 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -61.7 | -36.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | Y343 S348 A349 | Y343-G345 PolarHBondContact O-N 2.64Å; G345-S348 WeakPolarHBondContact CA-OG 3.33Å; G345-S348 PolarHBondContact O-OG 3.38Å; G345-S348 VanDerWaalsContact O-OG 3.11Å; G345-A349 WeakPolarHBondContact O-CB 3.45Å; G345-A349 PolarHBondContact O-N 3.43Å |
| 346 | G | 48 | Very low | 57.3 | Low | 34 Ų | 34 | 74.7 Ų | 74.7 | 35% | 0.351 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -71 | -42.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y343 S344 N350 | Y343-G346 PolarHBondContact O-N 2.02Å; S344-G346 PolarHBondContact O-N 2.99Å; G346-N350 WeakPolarHBondContact O-CB 3.06Å; G346-N350 PolarHBondContact O-N 3.21Å; G346-N350 PolarHBondContact O-OD1 3.26Å |
| 347 | R | 51 | Low | 59.7 | Low | 209 Ų | 209 | 70.7 Ų | 70.7 | 79% | 0.789 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -69.4 | -41.1 | 178.9 | -167.6 | 175.9 | -174.8 | 177 | 1.4 | 111.8 | S344 N350 Q351 | S344-R347 PolarHBondContact O-N 3.28Å; R347-N350 PolarHBondContact O-N 3.17Å; R347-Q351 PolarHBondContact O-N 2.88Å |
| 348 | S | 54.1 | Low | 62.2 | Low | 45 Ų | 45 | 67.4 Ų | 67.4 | 32% | 0.315 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -67 | -42.9 | 176.7 | 62.6 | 0 | 0 | 0 | 0 | 111.4 | S344 G345 N350 Q351 T352 | S344-S348 WeakPolarHBondContact O-CB 3.34Å; S344-S348 PolarHBondContact O-N 3.09Å; S344-S348 PolarHBondContact O-OG 3.49Å; S344-S348 VanDerWaalsContact O-OG 3.05Å; G345-S348 WeakPolarHBondContact CA-OG 3.33Å; G345-S348 PolarHBondContact O-OG 3.38Å; G345-S348 VanDerWaalsContact O-OG 3.11Å; S348-N350 VanDerWaalsContact C-N 3.32Å; S348-N350 PolarHBondContact O-N 2.82Å; S348-Q351 PolarHBondContact O-N 3.31Å; S348-T352 PolarHBondContact O-N 2.99Å; S348-T352 VanDerWaalsContact O-N 3.11Å; S348-T352 PolarHBondContact O-OG1 3.35Å |
| 349 | A | 59.3 | Low | 64.4 | Low | 20 Ų | 20 | 64 Ų | 64 | 17% | 0.165 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -58.3 | -45.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | R150 Y153 G345 Q351 T353 | R150-A349 PolarHBondContact NH2-O 2.91Å; Y153-A349 HydrophobicContact CE1-CB 4.45Å; G345-A349 WeakPolarHBondContact O-CB 3.45Å; G345-A349 PolarHBondContact O-N 3.43Å; A349-Q351 PolarHBondContact O-N 3.33Å; A349-T353 PolarHBondContact O-N 3.17Å; A349-T353 VanDerWaalsContact O-N 3.17Å; A349-T353 PolarHBondContact O-OG1 3.38Å |
| 350 | N | 66.6 | Low | 66.8 | Low | 38 Ų | 38 | 58.2 Ų | 58.2 | 20% | 0.203 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -62.2 | -45.1 | 178.6 | -69.4 | -2.1 | 0 | 0 | 0 | 111.6 | G346 R347 S348 T352 T353 Y354 | G346-N350 WeakPolarHBondContact O-CB 3.06Å; G346-N350 PolarHBondContact O-N 3.21Å; G346-N350 PolarHBondContact O-OD1 3.26Å; R347-N350 PolarHBondContact O-N 3.17Å; S348-N350 VanDerWaalsContact C-N 3.32Å; S348-N350 PolarHBondContact O-N 2.82Å; N350-T352 PolarHBondContact O-N 3.21Å; N350-T353 WeakPolarHBondContact O-CA 3.14Å; N350-T353 VanDerWaalsContact O-CB 3.29Å; N350-T353 WeakPolarHBondContact O-CB 3.37Å; N350-T353 PolarHBondContact O-N 3.32Å; N350-Y354 HydrophobicContact CB-CD2 4.5Å; N350-Y354 HydrophobicContact CB-CE2 4.01Å; N350-Y354 WeakPolarHBondContact O-CD2 3.45Å; N350-Y354 PolarHBondContact O-N 2.91Å |
| 351 | Q | 69.4 | Low | 68.9 | Low | 72 Ų | 72 | 54.6 Ų | 54.6 | 34% | 0.336 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -57.6 | -48.6 | 179.1 | -177 | 174 | -1.2 | 0 | 0 | 113 | R347 S348 A349 T353 Y354 M355 M414 | R347-Q351 PolarHBondContact O-N 2.88Å; S348-Q351 PolarHBondContact O-N 3.31Å; A349-Q351 PolarHBondContact O-N 3.33Å; Q351-T353 PolarHBondContact O-N 3.35Å; Q351-Y354 PolarHBondContact O-N 3.15Å; Q351-M355 PolarHBondContact O-N 3.34Å; Q351-M355 VanDerWaalsContact O-N 3.09Å; Q351-M414 VanDerWaalsContact CG-O 3.32Å; Q351-M414 WeakPolarHBondContact CG-O 3.02Å; Q351-M414 PolarHBondContact NE2-O 3.33Å |
| 352 | T | 75.3 | Confident | 71.4 | Confident | 28 Ų | 28 | 50.8 Ų | 50.8 | 17% | 0.172 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.5 | -33.1 | 176.2 | -51.4 | 0 | 0 | 0 | 0 | 111.5 | S348 N350 M355 L356 | S348-T352 PolarHBondContact O-N 2.99Å; S348-T352 VanDerWaalsContact O-N 3.11Å; S348-T352 PolarHBondContact O-OG1 3.35Å; N350-T352 PolarHBondContact O-N 3.21Å; T352-M355 HydrophobicContact CG2-CE 4.07Å; T352-L356 HydrophobicContact CG2-CD1 4.37Å; T352-L356 VanDerWaalsContact O-CG 3.29Å; T352-L356 WeakPolarHBondContact O-CG 3.48Å; T352-L356 PolarHBondContact O-N 3.33Å; T352-L356 VanDerWaalsContact O-N 3.12Å |
| 353 | T | 81.5 | Confident | 73.9 | Confident | 1 Ų | 1 | 45 Ų | 45 | 1% | 0.006 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -66.9 | -44.6 | 175.7 | -41.5 | 0 | 0 | 0 | 0 | 112 | R150 I154 L274 I278 A349 N350 Q351 M355 L356 L357 | R150-T353 HydrophobicContact CG-CG2 4.1Å; R150-T353 PolarHBondContact NE-OG1 3.46Å; R150-T353 PolarHBondContact NH2-OG1 3.2Å; I154-T353 HydrophobicContact CD1-CG2 3.41Å; I154-T353 VanDerWaalsContact CD1-CG2 3.41Å; L274-T353 HydrophobicContact CD2-CG2 4.48Å; I278-T353 HydrophobicContact CD1-CG2 3.44Å; I278-T353 VanDerWaalsContact CD1-CG2 3.44Å; I278-T353 HydrophobicContact CG1-CG2 4.02Å; A349-T353 PolarHBondContact O-N 3.17Å; A349-T353 VanDerWaalsContact O-N 3.17Å; A349-T353 PolarHBondContact O-OG1 3.38Å; N350-T353 WeakPolarHBondContact O-CA 3.14Å; N350-T353 VanDerWaalsContact O-CB 3.29Å; N350-T353 WeakPolarHBondContact O-CB 3.37Å; N350-T353 PolarHBondContact O-N 3.32Å; Q351-T353 PolarHBondContact O-N 3.35Å; T353-M355 VanDerWaalsContact C-N 3.28Å; T353-M355 PolarHBondContact O-N 3.12Å; T353-L356 PolarHBondContact O-N 3.09Å; T353-L357 WeakPolarHBondContact O-CB 3.29Å; T353-L357 PolarHBondContact O-N 3.41Å |
| 354 | Y | 85.2 | Confident | 76.1 | Confident | 89 Ų | 89 | 42.3 Ų | 42.3 | 35% | 0.349 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -62.4 | -40 | 178.9 | -69.3 | -64.4 | 0 | 0 | 0 | 111.4 | I278 E282 N350 Q351 L356 L357 T358 | I278-Y354 HydrophobicContact CD1-CE1 4.47Å; I278-Y354 HydrophobicContact CG2-CE1 4.36Å; I278-Y354 WeakPolarHBondContact CG2-OH 3.46Å; E282-Y354 PolarHBondContact OE1-OH 3.24Å; E282-Y354 VanDerWaalsContact OE1-OH 3.13Å; N350-Y354 HydrophobicContact CB-CD2 4.5Å; N350-Y354 HydrophobicContact CB-CE2 4.01Å; N350-Y354 WeakPolarHBondContact O-CD2 3.45Å; N350-Y354 PolarHBondContact O-N 2.91Å; Q351-Y354 PolarHBondContact O-N 3.15Å; Y354-L356 PolarHBondContact O-N 3.03Å; Y354-L357 PolarHBondContact O-N 3.11Å; Y354-T358 PolarHBondContact O-N 3.27Å; Y354-T358 PolarHBondContact O-OG1 2.89Å |
| 355 | M | 87.9 | Confident | 78.6 | Confident | 6 Ų | 6 | 45.7 Ų | 45.7 | 3% | 0.03 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -57 | -49.5 | 172.8 | 179.4 | -171.8 | 84.3 | 0 | 0 | 112 | L86 Q351 T352 T353 L357 T358 I359 Y411 M414 | L86-M355 HydrophobicContact CD1-CE 4.06Å; Q351-M355 PolarHBondContact O-N 3.34Å; Q351-M355 VanDerWaalsContact O-N 3.09Å; T352-M355 HydrophobicContact CG2-CE 4.07Å; T353-M355 VanDerWaalsContact C-N 3.28Å; T353-M355 PolarHBondContact O-N 3.12Å; M355-L357 PolarHBondContact O-N 3.34Å; M355-T358 WeakPolarHBondContact O-CB 3.18Å; M355-T358 PolarHBondContact O-N 3.48Å; M355-I359 HydrophobicContact CG-CD1 4.31Å; M355-I359 WeakPolarHBondContact O-CG1 3.4Å; M355-I359 PolarHBondContact O-N 3.46Å; M355-I359 VanDerWaalsContact O-N 3.09Å; M355-Y411 HydrophobicContact CE-CD1 3.94Å; M355-Y411 HydrophobicContact CE-CE1 3.92Å; M355-Y411 HydrophobicContact CG-CD1 4.07Å; M355-Y411 HydrophobicContact CG-CE1 4.42Å; M355-Y411 HydrophobicContact SD-CD1 3.54Å; M355-Y411 VanDerWaalsContact SD-CD1 3.54Å; M355-Y411 HydrophobicContact SD-CE1 4.11Å; M355-M414 HydrophobicContact CB-CB 3.86Å; M355-M414 HydrophobicContact CB-SD 4.37Å; M355-M414 HydrophobicContact CG-CB 3.93Å |
| 356 | L | 89.3 | Confident | 81 | Confident | 2 Ų | 2 | 44.3 Ų | 44.3 | 1% | 0.01 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -63.6 | -41 | 177.9 | -70.2 | 170.3 | 0 | 0 | 0 | 112.4 | T82 L86 V146 R150 T352 T353 Y354 T358 I359 I360 | T82-L356 HydrophobicContact CG2-CD1 3.68Å; T82-L356 HydrophobicContact CG2-CD2 4.22Å; L86-L356 HydrophobicContact CD1-CD2 3.78Å; L86-L356 HydrophobicContact CD2-CD2 3.63Å; L86-L356 HydrophobicContact CG-CD2 4.11Å; V146-L356 HydrophobicContact CG1-CD1 4.5Å; V146-L356 HydrophobicContact CG1-CD2 3.57Å; R150-L356 HydrophobicContact CB-CD1 4.1Å; R150-L356 HydrophobicContact CG-CD1 3.72Å; T352-L356 HydrophobicContact CG2-CD1 4.37Å; T352-L356 VanDerWaalsContact O-CG 3.29Å; T352-L356 WeakPolarHBondContact O-CG 3.48Å; T352-L356 PolarHBondContact O-N 3.33Å; T352-L356 VanDerWaalsContact O-N 3.12Å; T353-L356 PolarHBondContact O-N 3.09Å; Y354-L356 PolarHBondContact O-N 3.03Å; L356-T358 VanDerWaalsContact C-N 3.31Å; L356-T358 PolarHBondContact O-N 3.37Å; L356-I359 PolarHBondContact O-N 3.02Å; L356-I360 WeakPolarHBondContact O-CD1 3.19Å; L356-I360 WeakPolarHBondContact O-CG1 3.43Å; L356-I360 PolarHBondContact O-N 2.95Å |
| 357 | L | 92.2 | Very high | 83.1 | Confident | 25 Ų | 25 | 43.4 Ų | 43.4 | 13% | 0.131 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -61.2 | -42.3 | 176.5 | -170.7 | 75.8 | 0 | 0 | 0 | 110.6 | I275 T353 Y354 M355 I360 M361 | I275-L357 HydrophobicContact CD1-CD1 4.07Å; I275-L357 HydrophobicContact CD1-CD2 4.06Å; I275-L357 HydrophobicContact CG1-CD1 3.84Å; I275-L357 HydrophobicContact CG1-CD2 3.67Å; I275-L357 HydrophobicContact CG1-CG 4.42Å; T353-L357 WeakPolarHBondContact O-CB 3.29Å; T353-L357 PolarHBondContact O-N 3.41Å; Y354-L357 PolarHBondContact O-N 3.11Å; M355-L357 PolarHBondContact O-N 3.34Å; L357-I360 PolarHBondContact O-N 3.48Å; L357-M361 HydrophobicContact CD1-CE 4.03Å; L357-M361 HydrophobicContact CG-CE 4.39Å; L357-M361 HydrophobicContact CG-CG 4.35Å; L357-M361 WeakPolarHBondContact O-CB 3.11Å; L357-M361 WeakPolarHBondContact O-CG 3.36Å; L357-M361 PolarHBondContact O-N 2.84Å |
| 358 | T | 93.1 | Very high | 85.1 | Confident | 44 Ų | 44 | 37.6 Ų | 37.6 | 27% | 0.27 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -60.9 | -45.8 | 175.8 | -57.1 | 0 | 0 | 0 | 0 | 111.6 | Y354 M355 L356 I360 M361 L362 L410 M414 | Y354-T358 PolarHBondContact O-N 3.27Å; Y354-T358 PolarHBondContact O-OG1 2.89Å; M355-T358 WeakPolarHBondContact O-CB 3.18Å; M355-T358 PolarHBondContact O-N 3.48Å; L356-T358 VanDerWaalsContact C-N 3.31Å; L356-T358 PolarHBondContact O-N 3.37Å; T358-I360 PolarHBondContact O-N 3.42Å; T358-M361 PolarHBondContact O-N 3.17Å; T358-L362 HydrophobicContact CG2-CD1 4.01Å; T358-L362 HydrophobicContact CG2-CG 4.46Å; T358-L362 WeakPolarHBondContact O-CG 3.48Å; T358-L362 PolarHBondContact O-N 3.38Å; T358-L410 HydrophobicContact CG2-CD2 3.88Å; T358-M414 HydrophobicContact CG2-SD 4Å; T358-M414 WeakPolarHBondContact OG1-CE 3.48Å; T358-M414 PolarHBondContact OG1-SD 2.91Å; T358-M414 VanDerWaalsContact OG1-SD 3.37Å |
| 359 | I | 92.6 | Very high | 87 | Confident | 3 Ų | 3 | 37.9 Ų | 37.9 | 2% | 0.015 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -59.6 | -48.9 | 177.3 | -66.6 | 163.1 | 0 | 0 | 0 | 110 | L89 M355 L356 M361 L362 Y363 L410 Y411 | L89-I359 HydrophobicContact CD2-CG2 4.47Å; M355-I359 HydrophobicContact CG-CD1 4.31Å; M355-I359 WeakPolarHBondContact O-CG1 3.4Å; M355-I359 PolarHBondContact O-N 3.46Å; M355-I359 VanDerWaalsContact O-N 3.09Å; L356-I359 PolarHBondContact O-N 3.02Å; I359-M361 VanDerWaalsContact C-N 3.33Å; I359-M361 PolarHBondContact O-N 2.91Å; I359-L362 PolarHBondContact O-N 3.43Å; I359-Y363 HydrophobicContact CG2-CD2 3.94Å; I359-Y363 HydrophobicContact CG2-CE2 4.18Å; I359-Y363 WeakPolarHBondContact O-CB 3.5Å; I359-Y363 WeakPolarHBondContact O-CD2 3.33Å; I359-Y363 PolarHBondContact O-N 3.14Å; I359-L410 HydrophobicContact CG1-CD1 3.9Å; I359-Y411 HydrophobicContact CD1-CD1 4.14Å; I359-Y411 HydrophobicContact CD1-CE1 3.3Å |
| 360 | I | 93.7 | Very high | 88.5 | Confident | 1 Ų | 1 | 38.2 Ų | 38.2 | 1% | 0.005 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.7 | -40.3 | 179.6 | -62.3 | 158.9 | 0 | 0 | 0 | 111.2 | I143 A147 M267 S271 L274 L356 L357 T358 Y363 I364 | I143-I360 HydrophobicContact CG2-CG1 3.78Å; A147-I360 HydrophobicContact CB-CD1 3.63Å; A147-I360 HydrophobicContact CB-CG1 4.49Å; M267-I360 HydrophobicContact CB-CG2 4.02Å; M267-I360 HydrophobicContact CG-CG2 4.41Å; M267-I360 HydrophobicContact SD-CG2 4.46Å; S271-I360 WeakPolarHBondContact OG-CG2 3.41Å; L274-I360 HydrophobicContact CD1-CD1 4.48Å; L356-I360 WeakPolarHBondContact O-CD1 3.19Å; L356-I360 WeakPolarHBondContact O-CG1 3.43Å; L356-I360 PolarHBondContact O-N 2.95Å; L357-I360 PolarHBondContact O-N 3.48Å; T358-I360 PolarHBondContact O-N 3.42Å; I360-Y363 WeakPolarHBondContact O-CB 3.41Å; I360-Y363 PolarHBondContact O-N 2.74Å; I360-I364 HydrophobicContact CG2-CD1 3.92Å; I360-I364 HydrophobicContact CG2-CG1 4.44Å; I360-I364 VanDerWaalsContact O-CG1 3.28Å; I360-I364 WeakPolarHBondContact O-CG1 3.3Å; I360-I364 PolarHBondContact O-N 3.39Å |
| 361 | M | 93 | Very high | 89.7 | Confident | 79 Ų | 79 | 36.5 Ų | 36.5 | 39% | 0.389 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -68.6 | -39.6 | 179.3 | -71.5 | -62.9 | -179.8 | 0 | 0 | 112.8 | I275 L357 T358 I359 Y363 I364 F365 | I275-M361 HydrophobicContact CD1-CE 3.87Å; L357-M361 HydrophobicContact CD1-CE 4.03Å; L357-M361 HydrophobicContact CG-CE 4.39Å; L357-M361 HydrophobicContact CG-CG 4.35Å; L357-M361 WeakPolarHBondContact O-CB 3.11Å; L357-M361 WeakPolarHBondContact O-CG 3.36Å; L357-M361 PolarHBondContact O-N 2.84Å; T358-M361 PolarHBondContact O-N 3.17Å; I359-M361 VanDerWaalsContact C-N 3.33Å; I359-M361 PolarHBondContact O-N 2.91Å; M361-Y363 VanDerWaalsContact C-N 3.34Å; M361-I364 PolarHBondContact O-N 3.06Å; M361-I364 HydrophobicContact SD-CD1 4.24Å; M361-F365 WeakPolarHBondContact O-CB 3.48Å; M361-F365 PolarHBondContact O-N 3.29Å |
| 362 | L | 94.2 | Very high | 90.7 | Very high | 53 Ų | 53 | 35 Ų | 35 | 28% | 0.277 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -64.3 | -41.6 | 174.1 | -72.6 | 169.3 | 0 | 0 | 0 | 111.1 | T358 I359 F365 T366 N403 L410 | T358-L362 HydrophobicContact CG2-CD1 4.01Å; T358-L362 HydrophobicContact CG2-CG 4.46Å; T358-L362 WeakPolarHBondContact O-CG 3.48Å; T358-L362 PolarHBondContact O-N 3.38Å; I359-L362 PolarHBondContact O-N 3.43Å; L362-F365 PolarHBondContact O-N 3.17Å; L362-T366 PolarHBondContact O-N 3.2Å; L362-T366 PolarHBondContact O-OG1 2.89Å; L362-T366 VanDerWaalsContact O-OG1 3.08Å; L362-N403 VanDerWaalsContact CB-OD1 3.25Å; L362-N403 WeakPolarHBondContact CB-OD1 3.32Å; L362-L410 HydrophobicContact CD1-CD1 3.46Å; L362-L410 VanDerWaalsContact CD1-CD1 3.46Å; L362-L410 HydrophobicContact CD1-CD2 4.01Å; L362-L410 HydrophobicContact CD1-CG 4.3Å |
| 363 | Y | 93.3 | Very high | 91.4 | Very high | 1 Ų | 1 | 34.8 Ų | 34.8 | 0% | 0.004 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -59.4 | -46.2 | 172.4 | -99.5 | -80.9 | 0 | 0 | 0 | 112.8 | D93 I143 I359 I360 M361 F365 T366 Y367 N403 N404 | D93-Y363 PolarHBondContact OD1-OH 3.4Å; D93-Y363 PolarHBondContact OD2-OH 3.13Å; I143-Y363 HydrophobicContact CD1-CD1 3.33Å; I143-Y363 HydrophobicContact CD1-CD2 3.58Å; I143-Y363 HydrophobicContact CD1-CE1 3.21Å; I143-Y363 HydrophobicContact CD1-CE2 3.48Å; I143-Y363 VanDerWaalsContact CD1-CE2 3.48Å; I143-Y363 HydrophobicContact CD1-CG 3.5Å; I143-Y363 HydrophobicContact CG1-CD2 4.38Å; I143-Y363 HydrophobicContact CG1-CE2 4.26Å; I359-Y363 HydrophobicContact CG2-CD2 3.94Å; I359-Y363 HydrophobicContact CG2-CE2 4.18Å; I359-Y363 WeakPolarHBondContact O-CB 3.5Å; I359-Y363 WeakPolarHBondContact O-CD2 3.33Å; I359-Y363 PolarHBondContact O-N 3.14Å; I360-Y363 WeakPolarHBondContact O-CB 3.41Å; I360-Y363 PolarHBondContact O-N 2.74Å; M361-Y363 VanDerWaalsContact C-N 3.34Å; Y363-F365 VanDerWaalsContact C-N 3.3Å; Y363-F365 PolarHBondContact O-N 3.43Å; Y363-T366 PolarHBondContact O-N 3.46Å; Y363-Y367 AromaticContact CD1-CD2 3.55Å; Y363-Y367 HydrophobicContact CD1-CD2 3.55Å; Y363-Y367 AromaticContact CD1-CE2 3.27Å; Y363-Y367 HydrophobicContact CD1-CE2 3.27Å; Y363-Y367 HydrophobicContact CD1-CG 4.45Å; Y363-Y367 AromaticContact CD1-CZ 4Å; Y363-Y367 HydrophobicContact CE1-CD2 4.08Å; Y363-Y367 AromaticContact CE1-CE2 3.3Å; Y363-Y367 HydrophobicContact CE1-CE2 3.3Å; Y363-Y367 AromaticContact CE1-CZ 3.68Å; Y363-Y367 HydrophobicContact CG-CE2 4.44Å; Y363-Y367 VanDerWaalsContact O-CB 3.3Å; Y363-Y367 WeakPolarHBondContact O-CB 3.33Å; Y363-Y367 WeakPolarHBondContact O-CD2 3.25Å; Y363-Y367 PolarHBondContact O-N 3.46Å; Y363-N403 WeakPolarHBondContact CD1-ND2 3.22Å; Y363-N403 VanDerWaalsContact CD2-ND2 3.26Å; Y363-N403 WeakPolarHBondContact CD2-ND2 3.06Å; Y363-N403 WeakPolarHBondContact CE1-ND2 3.05Å; Y363-N403 WeakPolarHBondContact CE2-ND2 3.4Å; Y363-N403 VanDerWaalsContact CZ-ND2 3.32Å; Y363-N404 PolarHBondContact OH-OD1 2.92Å |
| 364 | I | 94.1 | Very high | 91.6 | Very high | 20 Ų | 20 | 35.5 Ų | 35.5 | 10% | 0.103 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -59.4 | -45.7 | 174.8 | -69.4 | 164.4 | 0 | 0 | 0 | 109.8 | I264 M267 I360 M361 T366 L368 | I264-I364 HydrophobicContact CG2-CG2 4.42Å; M267-I364 HydrophobicContact CB-CD1 4.29Å; M267-I364 HydrophobicContact CB-CG1 4.36Å; I360-I364 HydrophobicContact CG2-CD1 3.92Å; I360-I364 HydrophobicContact CG2-CG1 4.44Å; I360-I364 VanDerWaalsContact O-CG1 3.28Å; I360-I364 WeakPolarHBondContact O-CG1 3.3Å; I360-I364 PolarHBondContact O-N 3.39Å; M361-I364 PolarHBondContact O-N 3.06Å; M361-I364 HydrophobicContact SD-CD1 4.24Å; I364-T366 PolarHBondContact O-N 2.92Å; I364-L368 WeakPolarHBondContact O-CB 3.49Å; I364-L368 PolarHBondContact O-N 3.26Å |
| 365 | F | 93.6 | Very high | 91.7 | Very high | 150 Ų | 150 | 33.5 Ų | 33.5 | 66% | 0.658 | 18% | 0.178 | S | C | * | . | H | α-helix | trans | -63.1 | -40.5 | -177.3 | -176.9 | -99.3 | 0 | 0 | 0 | 113.2 | M361 L362 Y363 P369 | M361-F365 WeakPolarHBondContact O-CB 3.48Å; M361-F365 PolarHBondContact O-N 3.29Å; L362-F365 PolarHBondContact O-N 3.17Å; Y363-F365 VanDerWaalsContact C-N 3.3Å; Y363-F365 PolarHBondContact O-N 3.43Å; F365-P369 WeakPolarHBondContact O-CD 3.49Å; F365-P369 WeakPolarHBondContact O-CG 3.24Å |
| 366 | T | 93.9 | Very high | 91.7 | Very high | 11 Ų | 11 | 36.5 Ų | 36.5 | 7% | 0.067 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -84.6 | -34.4 | -178.3 | 56.1 | 0 | 0 | 0 | 0 | 113.6 | L362 Y363 I364 L399 N403 | L362-T366 PolarHBondContact O-N 3.2Å; L362-T366 PolarHBondContact O-OG1 2.89Å; L362-T366 VanDerWaalsContact O-OG1 3.08Å; Y363-T366 PolarHBondContact O-N 3.46Å; I364-T366 PolarHBondContact O-N 2.92Å; T366-L399 HydrophobicContact CG2-CB 4.31Å; T366-N403 HydrophobicContact CG2-CB 3.92Å |
| 367 | Y | 92 | Very high | 91.5 | Very high | 14 Ų | 14 | 37.9 Ų | 37.9 | 6% | 0.055 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -88.6 | -26.1 | -177.7 | -77.5 | -110.5 | 0 | 0 | 0 | 114.1 | H136 Y363 Q370 S371 T400 | H136-Y367 PolarHBondContact ND1-OH 3.39Å; Y363-Y367 AromaticContact CD1-CD2 3.55Å; Y363-Y367 HydrophobicContact CD1-CD2 3.55Å; Y363-Y367 AromaticContact CD1-CE2 3.27Å; Y363-Y367 HydrophobicContact CD1-CE2 3.27Å; Y363-Y367 HydrophobicContact CD1-CG 4.45Å; Y363-Y367 AromaticContact CD1-CZ 4Å; Y363-Y367 HydrophobicContact CE1-CD2 4.08Å; Y363-Y367 AromaticContact CE1-CE2 3.3Å; Y363-Y367 HydrophobicContact CE1-CE2 3.3Å; Y363-Y367 AromaticContact CE1-CZ 3.68Å; Y363-Y367 HydrophobicContact CG-CE2 4.44Å; Y363-Y367 VanDerWaalsContact O-CB 3.3Å; Y363-Y367 WeakPolarHBondContact O-CB 3.33Å; Y363-Y367 WeakPolarHBondContact O-CD2 3.25Å; Y363-Y367 PolarHBondContact O-N 3.46Å; Y367-Q370 PolarHBondContact O-N 3.18Å; Y367-S371 WeakPolarHBondContact O-CB 3.48Å; Y367-S371 PolarHBondContact O-N 3.27Å; Y367-S371 PolarHBondContact O-OG 3.48Å; Y367-T400 HydrophobicContact CD2-CG2 4.37Å; Y367-T400 HydrophobicContact CE1-CG2 4.09Å; Y367-T400 HydrophobicContact CE2-CG2 3.52Å; Y367-T400 VanDerWaalsContact OH-CG2 3.26Å; Y367-T400 WeakPolarHBondContact OH-CG2 3.36Å |
| 368 | L | 93.4 | Very high | 90.9 | Very high | 88 Ų | 88 | 40.1 Ų | 40.1 | 46% | 0.461 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -60.5 | -45.9 | -179.3 | 178.3 | 68.7 | 0 | 0 | 0 | 112.6 | I264 I364 Q370 S371 A372 | I264-L368 HydrophobicContact CD1-CB 4.48Å; I264-L368 HydrophobicContact CG2-CD1 4.01Å; I364-L368 WeakPolarHBondContact O-CB 3.49Å; I364-L368 PolarHBondContact O-N 3.26Å; L368-Q370 VanDerWaalsContact C-N 3.35Å; L368-Q370 PolarHBondContact O-N 2.83Å; L368-S371 PolarHBondContact O-N 2.95Å; L368-A372 WeakPolarHBondContact O-CB 3.32Å; L368-A372 PolarHBondContact O-N 3.05Å |
| 369 | P | 93.7 | Very high | 90.4 | Very high | 51 Ų | 51 | 45.2 Ų | 45.2 | 33% | 0.331 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -58.2 | -45.3 | 176.7 | -24.5 | 34.7 | 0 | 0 | 0 | 112.3 | F365 S371 A372 L373 L396 | F365-P369 WeakPolarHBondContact O-CD 3.49Å; F365-P369 WeakPolarHBondContact O-CG 3.24Å; P369-S371 VanDerWaalsContact C-N 3.32Å; P369-S371 PolarHBondContact O-N 3.03Å; P369-A372 PolarHBondContact O-N 2.87Å; P369-L373 WeakPolarHBondContact O-CG 3.34Å; P369-L373 PolarHBondContact O-N 2.94Å; P369-L396 HydrophobicContact CB-CD1 4.26Å; P369-L396 HydrophobicContact CB-CD2 3.85Å |
| 370 | Q | 90.9 | Very high | 89.8 | Confident | 26 Ų | 26 | 50 Ų | 50 | 12% | 0.121 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.1 | -39.1 | 179.7 | -161.4 | -171.2 | 21.3 | 0 | 0 | 111.7 | Y367 L368 L374 L396 D397 | Y367-Q370 PolarHBondContact O-N 3.18Å; L368-Q370 VanDerWaalsContact C-N 3.35Å; L368-Q370 PolarHBondContact O-N 2.83Å; Q370-L374 PolarHBondContact O-N 2.73Å; Q370-L374 VanDerWaalsContact O-N 3.07Å; Q370-L396 HydrophobicContact CB-CB 4.43Å; Q370-L396 HydrophobicContact CB-CD1 4.15Å; Q370-L396 HydrophobicContact CG-CB 4.48Å; Q370-L396 HydrophobicContact CG-CD1 4.47Å; Q370-D397 PolarHBondContact NE2-OD1 2.77Å |
| 371 | S | 90.7 | Very high | 89.1 | Confident | 3 Ų | 3 | 51.4 Ų | 51.4 | 2% | 0.021 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -67.4 | -41 | 177.1 | -53.9 | 0 | 0 | 0 | 0 | 112 | K260 I264 Y367 L368 P369 L374 L375 | K260-S371 WeakPolarHBondContact CB-OG 3.31Å; I264-S371 WeakPolarHBondContact CD1-OG 3.24Å; Y367-S371 WeakPolarHBondContact O-CB 3.48Å; Y367-S371 PolarHBondContact O-N 3.27Å; Y367-S371 PolarHBondContact O-OG 3.48Å; L368-S371 PolarHBondContact O-N 2.95Å; P369-S371 VanDerWaalsContact C-N 3.32Å; P369-S371 PolarHBondContact O-N 3.03Å; S371-L374 PolarHBondContact O-N 3.44Å; S371-L375 PolarHBondContact O-N 3.28Å; S371-L375 VanDerWaalsContact O-N 3.1Å |
| 372 | A | 90.9 | Very high | 88.2 | Confident | 40 Ų | 40 | 50.5 Ų | 50.5 | 33% | 0.331 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -66.2 | -44.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | L368 P369 L374 L375 L376 | L368-A372 WeakPolarHBondContact O-CB 3.32Å; L368-A372 PolarHBondContact O-N 3.05Å; P369-A372 PolarHBondContact O-N 2.87Å; A372-L374 VanDerWaalsContact C-N 3.33Å; A372-L374 PolarHBondContact O-N 2.97Å; A372-L375 PolarHBondContact O-N 3.01Å; A372-L376 WeakPolarHBondContact O-CB 3.45Å; A372-L376 WeakPolarHBondContact O-CG 2.99Å; A372-L376 PolarHBondContact O-N 2.98Å |
| 373 | L | 89.5 | Confident | 87.5 | Confident | 24 Ų | 24 | 51.1 Ų | 51.1 | 13% | 0.126 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -60.7 | -41.7 | 176.1 | -73 | -170.5 | 0 | 0 | 0 | 111.9 | P369 L376 N377 F384 V388 Y389 L392 L396 | P369-L373 WeakPolarHBondContact O-CG 3.34Å; P369-L373 PolarHBondContact O-N 2.94Å; L373-L376 PolarHBondContact O-N 3.27Å; L373-N377 WeakPolarHBondContact O-CB 3.41Å; L373-N377 PolarHBondContact O-N 3.49Å; L373-F384 HydrophobicContact CD2-CE1 4.37Å; L373-F384 HydrophobicContact CD2-CZ 3.7Å; L373-V388 HydrophobicContact CD2-CG1 4.12Å; L373-Y389 HydrophobicContact CB-CD2 3.99Å; L373-Y389 HydrophobicContact CB-CE2 4.45Å; L373-L392 HydrophobicContact CD1-CB 3.91Å; L373-L392 HydrophobicContact CD1-CD1 4.04Å; L373-L396 HydrophobicContact CD1-CD1 3.37Å; L373-L396 HydrophobicContact CG-CD1 4.24Å |
| 374 | L | 87.1 | Confident | 87.1 | Confident | 15 Ų | 15 | 52.2 Ų | 52.2 | 8% | 0.079 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61.6 | -45.3 | 176 | -176.7 | 61.1 | 0 | 0 | 0 | 111.1 | F252 A256 K260 Q370 S371 A372 N377 Y389 | F252-L374 HydrophobicContact CD2-CD1 4.3Å; F252-L374 HydrophobicContact CE2-CD1 3.98Å; F252-L374 HydrophobicContact CE2-CG 4.04Å; F252-L374 WeakPolarHBondContact CE2-O 3.41Å; F252-L374 WeakPolarHBondContact CZ-O 3.35Å; A256-L374 HydrophobicContact CB-CD2 3.84Å; A256-L374 HydrophobicContact CB-CG 3.92Å; K260-L374 HydrophobicContact CD-CD2 3.85Å; Q370-L374 PolarHBondContact O-N 2.73Å; Q370-L374 VanDerWaalsContact O-N 3.07Å; S371-L374 PolarHBondContact O-N 3.44Å; A372-L374 VanDerWaalsContact C-N 3.33Å; A372-L374 PolarHBondContact O-N 2.97Å; L374-N377 WeakPolarHBondContact O-CB 3.46Å; L374-N377 PolarHBondContact O-N 3.36Å; L374-Y389 HydrophobicContact CB-CE2 4.17Å; L374-Y389 HydrophobicContact CD1-CE2 4.08Å |
| 375 | L | 87.7 | Confident | 86.5 | Confident | 48 Ų | 48 | 52.4 Ų | 52.4 | 25% | 0.251 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.8 | -46.2 | 176.1 | -75.1 | 169.8 | 0 | 0 | 0 | 112.3 | A256 A261 S371 A372 N377 N378 F379 | A256-L375 HydrophobicContact CB-CD2 3.84Å; A256-L375 HydrophobicContact CB-CG 4.37Å; A261-L375 HydrophobicContact CB-CD1 4.15Å; S371-L375 PolarHBondContact O-N 3.28Å; S371-L375 VanDerWaalsContact O-N 3.1Å; A372-L375 PolarHBondContact O-N 3.01Å; L375-N377 VanDerWaalsContact C-N 3.31Å; L375-N377 PolarHBondContact O-N 3.02Å; L375-N378 PolarHBondContact O-N 2.99Å; L375-F379 WeakPolarHBondContact O-CD2 3.2Å |
| 376 | L | 87.4 | Confident | 85.7 | Confident | 69 Ų | 69 | 47.5 Ų | 47.5 | 36% | 0.361 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -64 | -35.1 | 179.4 | -72 | 173 | 0 | 0 | 0 | 112.5 | A372 L373 N378 F379 Q380 F384 | A372-L376 WeakPolarHBondContact O-CB 3.45Å; A372-L376 WeakPolarHBondContact O-CG 2.99Å; A372-L376 PolarHBondContact O-N 2.98Å; L373-L376 PolarHBondContact O-N 3.27Å; L376-N378 VanDerWaalsContact C-N 3.25Å; L376-N378 PolarHBondContact O-N 3.16Å; L376-F379 PolarHBondContact O-N 2.92Å; L376-Q380 WeakPolarHBondContact O-CB 3.16Å; L376-Q380 PolarHBondContact O-N 3.45Å; L376-F384 HydrophobicContact CB-CE1 3.82Å; L376-F384 HydrophobicContact CB-CZ 3.77Å; L376-F384 HydrophobicContact CD1-CZ 4.24Å |
| 377 | N | 84.8 | Confident | 85 | Confident | 31 Ų | 31 | 47.5 Ų | 47.5 | 17% | 0.166 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -54.7 | -41.6 | 179 | -170.4 | 27.5 | 0 | 0 | 0 | 112.6 | L373 L374 L375 G381 F384 S385 Y389 | L373-N377 WeakPolarHBondContact O-CB 3.41Å; L373-N377 PolarHBondContact O-N 3.49Å; L374-N377 WeakPolarHBondContact O-CB 3.46Å; L374-N377 PolarHBondContact O-N 3.36Å; L375-N377 VanDerWaalsContact C-N 3.31Å; L375-N377 PolarHBondContact O-N 3.02Å; N377-G381 PolarHBondContact O-N 2.92Å; N377-F384 HydrophobicContact CB-CD1 4.17Å; N377-F384 HydrophobicContact CB-CE1 4.28Å; N377-S385 VanDerWaalsContact OD1-CA 3.31Å; N377-S385 WeakPolarHBondContact OD1-CA 3.35Å; N377-S385 WeakPolarHBondContact OD1-CB 3.34Å; N377-Y389 HydrophobicContact CB-CD2 4.06Å; N377-Y389 HydrophobicContact CB-CG 4.31Å |
| 378 | N | 79.6 | Confident | 84.8 | Confident | 72 Ų | 72 | 47.4 Ų | 47.4 | 39% | 0.385 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -72.7 | -31.1 | 177.9 | -178.8 | 71.3 | 0 | 0 | 0 | 113.7 | F252 L375 L376 | F252-N378 HydrophobicContact CD1-CB 3.97Å; F252-N378 HydrophobicContact CD2-CB 4.06Å; F252-N378 HydrophobicContact CE1-CB 3.35Å; F252-N378 VanDerWaalsContact CE1-CG 3.43Å; F252-N378 HydrophobicContact CE2-CB 3.47Å; F252-N378 VanDerWaalsContact CE2-CB 3.47Å; F252-N378 HydrophobicContact CG-CB 4.3Å; F252-N378 HydrophobicContact CZ-CB 3.08Å; L375-N378 PolarHBondContact O-N 2.99Å; L376-N378 VanDerWaalsContact C-N 3.25Å; L376-N378 PolarHBondContact O-N 3.16Å |
| 379 | F | 81.9 | Confident | 84.4 | Confident | 150 Ų | 150 | 46.1 Ų | 46.1 | 66% | 0.658 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -80.4 | -33.4 | 178.8 | -69.8 | -65.5 | 0 | 0 | 0 | 113 | L375 L376 | L375-F379 WeakPolarHBondContact O-CD2 3.2Å; L376-F379 PolarHBondContact O-N 2.92Å |
| 380 | Q | 81.5 | Confident | 83.9 | Confident | 103 Ų | 103 | 48.7 Ų | 48.7 | 48% | 0.481 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -97.9 | -16.6 | -173.5 | -68.6 | 174.4 | -27.8 | 0 | 0 | 113.5 | L376 F384 | L376-Q380 WeakPolarHBondContact O-CB 3.16Å; L376-Q380 PolarHBondContact O-N 3.45Å; Q380-F384 HydrophobicContact CB-CB 3.55Å; Q380-F384 HydrophobicContact CB-CD1 4.49Å; Q380-F384 HydrophobicContact CB-CD2 4.43Å; Q380-F384 HydrophobicContact CB-CG 3.94Å |
| 381 | G | 77.8 | Confident | 83.7 | Confident | 32 Ų | 32 | 50.5 Ų | 50.5 | 33% | 0.33 | 29% | 0.287 | S | S | . | . | trans | 78.4 | -164.3 | 171.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | N377 C383 F384 S385 | N377-G381 PolarHBondContact O-N 2.92Å; G381-C383 VanDerWaalsContact C-N 3.31Å; G381-C383 PolarHBondContact O-N 3.2Å; G381-F384 PolarHBondContact O-N 3.39Å; G381-F384 VanDerWaalsContact O-N 3.13Å; G381-S385 PolarHBondContact O-N 2.84Å | ||
| 382 | G | 74.6 | Confident | 83.7 | Confident | 60 Ų | 60 | 52.2 Ų | 52.2 | 62% | 0.619 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -60.3 | -33.3 | -167.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | F384 S385 A386 | G382-F384 PolarHBondContact O-N 2.95Å; G382-S385 WeakPolarHBondContact O-CB 3.49Å; G382-S385 PolarHBondContact O-N 3.48Å; G382-A386 PolarHBondContact O-N 3.5Å; G382-A386 VanDerWaalsContact O-N 3.15Å |
| 383 | C | 79.7 | Confident | 83.6 | Confident | 66 Ų | 66 | 51.3 Ų | 51.3 | 45% | 0.446 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -60.6 | -45.3 | 176.9 | 171.6 | 0 | 0 | 0 | 0 | 111.4 | C33 G381 T387 | C33-C383 HydrophobicContact CB-CB 4.03Å; C33-C383 WeakPolarHBondContact CB-SG 3.25Å; C33-C383 VanDerWaalsContact SG-C 3.55Å; C33-C383 WeakPolarHBondContact SG-CA 3.2Å; C33-C383 WeakPolarHBondContact SG-CB 3.41Å; C33-C383 PolarHBondContact SG-O 3.33Å; C33-C383 CovalentContact SG-SG 2.02Å; C33-C383 PolarHBondContact SG-SG 2.81Å; G381-C383 VanDerWaalsContact C-N 3.31Å; G381-C383 PolarHBondContact O-N 3.2Å; C383-T387 WeakPolarHBondContact O-CB 3.3Å; C383-T387 PolarHBondContact O-N 3.49Å; C383-T387 VanDerWaalsContact O-N 3.09Å; C383-T387 PolarHBondContact O-OG1 2.71Å |
| 384 | F | 84.1 | Confident | 83.7 | Confident | 23 Ų | 23 | 52 Ų | 52 | 10% | 0.101 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -70.6 | -35.3 | 177.2 | -179.4 | -94.3 | 0 | 0 | 0 | 112.7 | L373 L376 N377 Q380 G381 G382 A386 V388 Y389 | L373-F384 HydrophobicContact CD2-CE1 4.37Å; L373-F384 HydrophobicContact CD2-CZ 3.7Å; L376-F384 HydrophobicContact CB-CE1 3.82Å; L376-F384 HydrophobicContact CB-CZ 3.77Å; L376-F384 HydrophobicContact CD1-CZ 4.24Å; N377-F384 HydrophobicContact CB-CD1 4.17Å; N377-F384 HydrophobicContact CB-CE1 4.28Å; Q380-F384 HydrophobicContact CB-CB 3.55Å; Q380-F384 HydrophobicContact CB-CD1 4.49Å; Q380-F384 HydrophobicContact CB-CD2 4.43Å; Q380-F384 HydrophobicContact CB-CG 3.94Å; G381-F384 PolarHBondContact O-N 3.39Å; G381-F384 VanDerWaalsContact O-N 3.13Å; G382-F384 PolarHBondContact O-N 2.95Å; F384-A386 VanDerWaalsContact C-N 3.34Å; F384-A386 PolarHBondContact O-N 3.34Å; F384-V388 HydrophobicContact CD2-CB 3.68Å; F384-V388 HydrophobicContact CD2-CG1 4.2Å; F384-V388 HydrophobicContact CD2-CG2 3.77Å; F384-V388 HydrophobicContact CE2-CB 3.55Å; F384-V388 HydrophobicContact CE2-CG1 3.53Å; F384-V388 HydrophobicContact CE2-CG2 3.88Å; F384-V388 HydrophobicContact CG-CB 4.27Å; F384-V388 HydrophobicContact CZ-CB 4.03Å; F384-V388 HydrophobicContact CZ-CG1 3.79Å; F384-V388 PolarHBondContact O-N 3.14Å; F384-Y389 PolarHBondContact O-N 3.26Å |
| 385 | S | 81.5 | Confident | 84 | Confident | 25 Ų | 25 | 54.3 Ų | 54.3 | 18% | 0.175 | 30% | 0.304 | C | S | . | . | I | π-helix | trans | -54.3 | -52.4 | 176 | -165.6 | 0 | 0 | 0 | 0 | 110.9 | N377 G381 G382 Y389 E390 | N377-S385 VanDerWaalsContact OD1-CA 3.31Å; N377-S385 WeakPolarHBondContact OD1-CA 3.35Å; N377-S385 WeakPolarHBondContact OD1-CB 3.34Å; G381-S385 PolarHBondContact O-N 2.84Å; G382-S385 WeakPolarHBondContact O-CB 3.49Å; G382-S385 PolarHBondContact O-N 3.48Å; S385-Y389 PolarHBondContact O-N 3.43Å; S385-E390 WeakPolarHBondContact O-CB 3.24Å; S385-E390 WeakPolarHBondContact O-CG 3.5Å; S385-E390 PolarHBondContact O-N 2.87Å; S385-E390 PolarHBondContact OG-OE1 3.09Å |
| 386 | A | 77.6 | Confident | 84.3 | Confident | 46 Ų | 46 | 52.7 Ų | 52.7 | 38% | 0.38 | 30% | 0.295 | S | S | . | . | I | π-helix | trans | -76.8 | -34.9 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | G382 F384 R391 | G382-A386 PolarHBondContact O-N 3.5Å; G382-A386 VanDerWaalsContact O-N 3.15Å; F384-A386 VanDerWaalsContact C-N 3.34Å; F384-A386 PolarHBondContact O-N 3.34Å; A386-R391 WeakPolarHBondContact O-CG 3.16Å; A386-R391 PolarHBondContact O-NE 3.43Å |
| 387 | T | 79.7 | Confident | 84.6 | Confident | 12 Ų | 12 | 51 Ų | 51 | 7% | 0.074 | 29% | 0.286 | C | S | . | . | I | π-helix | trans | -90.7 | -30.6 | -174.3 | 54.5 | 0 | 0 | 0 | 0 | 114 | C33 I34 L40 C383 R391 | C33-T387 HydrophobicContact CB-CG2 4.49Å; C33-T387 WeakPolarHBondContact SG-CG2 3.48Å; I34-T387 HydrophobicContact CG1-CG2 4.4Å; L40-T387 WeakPolarHBondContact CD2-O 3.31Å; C383-T387 WeakPolarHBondContact O-CB 3.3Å; C383-T387 PolarHBondContact O-N 3.49Å; C383-T387 VanDerWaalsContact O-N 3.09Å; C383-T387 PolarHBondContact O-OG1 2.71Å; T387-R391 VanDerWaalsContact O-CG 3.29Å; T387-R391 WeakPolarHBondContact O-CG 3.25Å |
| 388 | V | 86.5 | Confident | 85.1 | Confident | 12 Ų | 12 | 51 Ų | 51 | 7% | 0.073 | 29% | 0.285 | C | S | . | . | I | π-helix | trans | -121.6 | -54.7 | -173 | -176.8 | 0 | 0 | 0 | 0 | 112.2 | F37 L40 L373 F384 R391 L392 | F37-V388 HydrophobicContact CD1-CG2 4.33Å; F37-V388 HydrophobicContact CD2-CG2 4.15Å; F37-V388 HydrophobicContact CE1-CG2 4.27Å; F37-V388 HydrophobicContact CE2-CG2 4.07Å; F37-V388 HydrophobicContact CG-CG2 4.27Å; F37-V388 HydrophobicContact CZ-CG2 4.12Å; L40-V388 HydrophobicContact CD2-CB 4.26Å; L40-V388 HydrophobicContact CD2-CG1 4.17Å; L40-V388 HydrophobicContact CD2-CG2 4.15Å; L373-V388 HydrophobicContact CD2-CG1 4.12Å; F384-V388 HydrophobicContact CD2-CB 3.68Å; F384-V388 HydrophobicContact CD2-CG1 4.2Å; F384-V388 HydrophobicContact CD2-CG2 3.77Å; F384-V388 HydrophobicContact CE2-CB 3.55Å; F384-V388 HydrophobicContact CE2-CG1 3.53Å; F384-V388 HydrophobicContact CE2-CG2 3.88Å; F384-V388 HydrophobicContact CG-CB 4.27Å; F384-V388 HydrophobicContact CZ-CB 4.03Å; F384-V388 HydrophobicContact CZ-CG1 3.79Å; F384-V388 PolarHBondContact O-N 3.14Å; V388-R391 PolarHBondContact O-N 3.5Å; V388-L392 HydrophobicContact CG1-CD1 3.79Å; V388-L392 WeakPolarHBondContact O-CB 3.15Å; V388-L392 PolarHBondContact O-N 3.04Å |
| 389 | Y | 85.9 | Confident | 85.9 | Confident | 61 Ų | 61 | 49.7 Ų | 49.7 | 24% | 0.239 | 28% | 0.278 | C | S | . | . | I | π-helix | trans | -62.3 | -52.3 | -172.2 | 178.9 | -94.7 | 0 | 0 | 0 | 112 | L373 L374 N377 F384 S385 G393 | L373-Y389 HydrophobicContact CB-CD2 3.99Å; L373-Y389 HydrophobicContact CB-CE2 4.45Å; L374-Y389 HydrophobicContact CB-CE2 4.17Å; L374-Y389 HydrophobicContact CD1-CE2 4.08Å; N377-Y389 HydrophobicContact CB-CD2 4.06Å; N377-Y389 HydrophobicContact CB-CG 4.31Å; F384-Y389 PolarHBondContact O-N 3.26Å; S385-Y389 PolarHBondContact O-N 3.43Å; Y389-G393 PolarHBondContact O-N 3.31Å |
| 390 | E | 83.3 | Confident | 86.5 | Confident | 105 Ų | 105 | 42.7 Ų | 42.7 | 49% | 0.491 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -67.6 | -36.8 | 179.1 | -72.8 | 169.2 | -151.1 | 0 | 0 | 111.9 | S385 L392 G393 | S385-E390 WeakPolarHBondContact O-CB 3.24Å; S385-E390 WeakPolarHBondContact O-CG 3.5Å; S385-E390 PolarHBondContact O-N 2.87Å; S385-E390 PolarHBondContact OG-OE1 3.09Å; E390-L392 PolarHBondContact O-N 3.03Å; E390-G393 PolarHBondContact O-N 3.06Å |
| 391 | R | 85.9 | Confident | 87.2 | Confident | 64 Ų | 64 | 37.8 Ų | 37.8 | 24% | 0.242 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -72.4 | -30.2 | -176 | -56.3 | -50 | -177.1 | 161.2 | 21.2 | 113.5 | L40 E41 H44 A386 T387 V388 | L40-R391 HydrophobicContact CD2-CB 4.37Å; L40-R391 HydrophobicContact CG-CB 4.03Å; E41-R391 IonicContact OE1-CZ 3.66Å; E41-R391 IonicContact OE1-NH1 2.97Å; E41-R391 IonicContact OE1-NH2 3.57Å; E41-R391 PolarHBondContact OE1-NH2 2.99Å; E41-R391 IonicContact OE2-CZ 2.73Å; E41-R391 IonicContact OE2-NE 2.98Å; E41-R391 PolarHBondContact OE2-NE 2.86Å; E41-R391 IonicContact OE2-NH1 3.36Å; E41-R391 IonicContact OE2-NH2 2.81Å; E41-R391 PolarHBondContact OE2-NH2 3.39Å; H44-R391 HydrophobicContact CB-CB 3.96Å; H44-R391 HydrophobicContact CB-CG 4.41Å; H44-R391 PolarHBondContact CD2-NH1 2.9Å; H44-R391 PolarHBondContact ND1-O 3.29Å; H44-R391 PolarHBondContact NE2-NH1 2.79Å; A386-R391 WeakPolarHBondContact O-CG 3.16Å; A386-R391 PolarHBondContact O-NE 3.43Å; T387-R391 VanDerWaalsContact O-CG 3.29Å; T387-R391 WeakPolarHBondContact O-CG 3.25Å; V388-R391 PolarHBondContact O-N 3.5Å |
| 392 | L | 90.3 | Very high | 88 | Confident | 38 Ų | 38 | 38.7 Ų | 38.7 | 20% | 0.199 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -93.8 | -14.6 | 175.3 | -72.2 | 172.7 | 0 | 0 | 0 | 114 | L40 L373 V388 E390 D394 F395 L396 | L40-L392 HydrophobicContact CD1-CD1 4.48Å; L40-L392 HydrophobicContact CD1-CD2 3.52Å; L40-L392 HydrophobicContact CD1-CG 3.8Å; L40-L392 HydrophobicContact CD2-CD1 4.24Å; L40-L392 HydrophobicContact CD2-CG 4.1Å; L373-L392 HydrophobicContact CD1-CB 3.91Å; L373-L392 HydrophobicContact CD1-CD1 4.04Å; V388-L392 HydrophobicContact CG1-CD1 3.79Å; V388-L392 WeakPolarHBondContact O-CB 3.15Å; V388-L392 PolarHBondContact O-N 3.04Å; E390-L392 PolarHBondContact O-N 3.03Å; L392-D394 PolarHBondContact O-N 3.31Å; L392-F395 PolarHBondContact O-N 3.16Å; L392-L396 WeakPolarHBondContact O-CG 3.39Å; L392-L396 PolarHBondContact O-N 3.26Å |
| 393 | G | 90.1 | Very high | 89 | Confident | 21 Ų | 21 | 36 Ų | 36 | 22% | 0.216 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -52.3 | -58.3 | -173.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y389 E390 F395 L396 D397 | Y389-G393 PolarHBondContact O-N 3.31Å; E390-G393 PolarHBondContact O-N 3.06Å; G393-F395 PolarHBondContact O-N 3.07Å; G393-L396 PolarHBondContact O-N 2.96Å; G393-L396 VanDerWaalsContact O-N 3.11Å; G393-D397 PolarHBondContact O-N 3.43Å |
| 394 | D | 90.3 | Very high | 89.7 | Confident | 40 Ų | 40 | 32.9 Ų | 32.9 | 21% | 0.214 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -57.3 | -38 | -178.8 | -61.7 | -18 | 0 | 0 | 0 | 112.3 | Y47 H51 L392 F398 | Y47-D394 HydrophobicContact CD1-CB 4.45Å; Y47-D394 HydrophobicContact CE1-CB 4.02Å; H51-D394 PolarHBondContact CE1-O 3.4Å; H51-D394 PolarHBondContact ND1-O 3.12Å; L392-D394 PolarHBondContact O-N 3.31Å; D394-F398 WeakPolarHBondContact O-CB 3.47Å; D394-F398 PolarHBondContact O-N 3.29Å |
| 395 | F | 94.2 | Very high | 90.1 | Very high | 63 Ų | 63 | 32.3 Ų | 32.3 | 28% | 0.276 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -69.1 | -41 | 179.3 | 176.3 | -107.4 | 0 | 0 | 0 | 112.2 | F43 Y47 L392 G393 F398 L399 | F43-F395 HydrophobicContact CE1-CB 4.07Å; F43-F395 HydrophobicContact CE1-CG 4.21Å; F43-F395 HydrophobicContact CZ-CB 4.21Å; F43-F395 AromaticContact CZ-CD2 3.86Å; F43-F395 HydrophobicContact CZ-CD2 3.86Å; F43-F395 HydrophobicContact CZ-CE2 4.39Å; F43-F395 AromaticContact CZ-CG 3.93Å; F43-F395 HydrophobicContact CZ-CG 3.93Å; Y47-F395 HydrophobicContact CD1-CB 4.21Å; Y47-F395 HydrophobicContact CE1-CB 3.81Å; Y47-F395 HydrophobicContact CE1-CD2 4.35Å; Y47-F395 AromaticContact CE2-CD2 4Å; Y47-F395 HydrophobicContact CE2-CD2 4Å; Y47-F395 AromaticContact CZ-CD2 3.92Å; L392-F395 PolarHBondContact O-N 3.16Å; G393-F395 PolarHBondContact O-N 3.07Å; F395-F398 WeakPolarHBondContact O-CB 3.41Å; F395-F398 PolarHBondContact O-N 3.29Å; F395-L399 HydrophobicContact CD1-CD1 4.37Å; F395-L399 HydrophobicContact CE1-CD1 3.75Å; F395-L399 HydrophobicContact CE1-CG 4.22Å; F395-L399 HydrophobicContact CZ-CD1 4.05Å; F395-L399 HydrophobicContact CZ-CD2 4.21Å; F395-L399 HydrophobicContact CZ-CG 4.16Å; F395-L399 PolarHBondContact O-N 2.89Å |
| 396 | L | 94.5 | Very high | 90.6 | Very high | 13 Ų | 13 | 34 Ų | 34 | 7% | 0.068 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -70.3 | -35.1 | 176.9 | -67 | -178.4 | 0 | 0 | 0 | 112.5 | P369 Q370 L373 L392 G393 F398 L399 T400 | P369-L396 HydrophobicContact CB-CD1 4.26Å; P369-L396 HydrophobicContact CB-CD2 3.85Å; Q370-L396 HydrophobicContact CB-CB 4.43Å; Q370-L396 HydrophobicContact CB-CD1 4.15Å; Q370-L396 HydrophobicContact CG-CB 4.48Å; Q370-L396 HydrophobicContact CG-CD1 4.47Å; L373-L396 HydrophobicContact CD1-CD1 3.37Å; L373-L396 HydrophobicContact CG-CD1 4.24Å; L392-L396 WeakPolarHBondContact O-CG 3.39Å; L392-L396 PolarHBondContact O-N 3.26Å; G393-L396 PolarHBondContact O-N 2.96Å; G393-L396 VanDerWaalsContact O-N 3.11Å; L396-F398 VanDerWaalsContact C-N 3.31Å; L396-L399 HydrophobicContact CD2-CD1 4.15Å; L396-L399 PolarHBondContact O-N 2.86Å; L396-T400 WeakPolarHBondContact O-CB 3.43Å; L396-T400 PolarHBondContact O-N 2.96Å; L396-T400 PolarHBondContact O-OG1 3.3Å |
| 397 | D | 93.9 | Very high | 91.2 | Very high | 34 Ų | 34 | 31.8 Ų | 31.8 | 18% | 0.182 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -62.8 | -42.1 | 172 | -79.8 | 4.3 | 0 | 0 | 0 | 110.4 | Y100 Q370 G393 L399 T400 L401 | Y100-D397 VanDerWaalsContact OH-CG 3.31Å; Y100-D397 PolarHBondContact OH-OD2 3.1Å; Q370-D397 PolarHBondContact NE2-OD1 2.77Å; G393-D397 PolarHBondContact O-N 3.43Å; D397-L399 PolarHBondContact O-N 3.41Å; D397-T400 CarbonylContact O-C 3.58Å; D397-T400 WeakPolarHBondContact O-CA 3.34Å; D397-T400 VanDerWaalsContact O-CB 3.31Å; D397-T400 WeakPolarHBondContact O-CB 3.34Å; D397-T400 PolarHBondContact O-N 2.88Å; D397-T400 VanDerWaalsContact O-N 3.13Å; D397-L401 WeakPolarHBondContact O-CG 3.29Å; D397-L401 PolarHBondContact O-N 2.82Å |
| 398 | F | 95.3 | Very high | 91.7 | Very high | 31 Ų | 31 | 32.8 Ų | 32.8 | 14% | 0.136 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -60.7 | -43.6 | 173.1 | 176.7 | -110.8 | 0 | 0 | 0 | 113.4 | Y47 L54 L58 D394 F395 L396 T400 L401 I402 | Y47-F398 WeakPolarHBondContact OH-CB 3.49Å; Y47-F398 WeakPolarHBondContact OH-CD1 3.4Å; Y47-F398 WeakPolarHBondContact OH-CG 3.49Å; L54-F398 HydrophobicContact CB-CD2 4.36Å; L54-F398 HydrophobicContact CB-CE2 3.7Å; L54-F398 HydrophobicContact CB-CZ 4.15Å; L54-F398 HydrophobicContact CD1-CE1 4.42Å; L54-F398 HydrophobicContact CD1-CE2 4.3Å; L54-F398 HydrophobicContact CD1-CZ 4Å; L58-F398 HydrophobicContact CD2-CD2 4.14Å; L58-F398 HydrophobicContact CD2-CE2 3.77Å; D394-F398 WeakPolarHBondContact O-CB 3.47Å; D394-F398 PolarHBondContact O-N 3.29Å; F395-F398 WeakPolarHBondContact O-CB 3.41Å; F395-F398 PolarHBondContact O-N 3.29Å; L396-F398 VanDerWaalsContact C-N 3.31Å; F398-T400 PolarHBondContact O-N 2.92Å; F398-L401 PolarHBondContact O-N 3.36Å; F398-I402 HydrophobicContact CD1-CD1 3.9Å; F398-I402 HydrophobicContact CE1-CD1 3.36Å; F398-I402 HydrophobicContact CE1-CG1 4.25Å; F398-I402 HydrophobicContact CE2-CD1 4.21Å; F398-I402 HydrophobicContact CE2-CG1 4.28Å; F398-I402 HydrophobicContact CZ-CD1 3.54Å; F398-I402 HydrophobicContact CZ-CG1 4.08Å; F398-I402 WeakPolarHBondContact O-CG1 3.44Å; F398-I402 PolarHBondContact O-N 3.45Å |
| 399 | L | 95.8 | Very high | 92 | Very high | 45 Ų | 45 | 36.7 Ų | 36.7 | 24% | 0.236 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -60.1 | -38.1 | 173.8 | -69.6 | -177.8 | 0 | 0 | 0 | 111.9 | T366 F395 L396 D397 I402 N403 | T366-L399 HydrophobicContact CG2-CB 4.31Å; F395-L399 HydrophobicContact CD1-CD1 4.37Å; F395-L399 HydrophobicContact CE1-CD1 3.75Å; F395-L399 HydrophobicContact CE1-CG 4.22Å; F395-L399 HydrophobicContact CZ-CD1 4.05Å; F395-L399 HydrophobicContact CZ-CD2 4.21Å; F395-L399 HydrophobicContact CZ-CG 4.16Å; F395-L399 PolarHBondContact O-N 2.89Å; L396-L399 HydrophobicContact CD2-CD1 4.15Å; L396-L399 PolarHBondContact O-N 2.86Å; D397-L399 PolarHBondContact O-N 3.41Å; L399-I402 PolarHBondContact O-N 2.86Å; L399-N403 PolarHBondContact O-N 3.43Å |
| 400 | T | 94.5 | Very high | 92.2 | Very high | 2 Ų | 2 | 35 Ų | 35 | 1% | 0.012 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -64.7 | -44 | 175.8 | -63.2 | 0 | 0 | 0 | 0 | 111.4 | Y367 L396 D397 F398 I402 N403 N404 | Y367-T400 HydrophobicContact CD2-CG2 4.37Å; Y367-T400 HydrophobicContact CE1-CG2 4.09Å; Y367-T400 HydrophobicContact CE2-CG2 3.52Å; Y367-T400 VanDerWaalsContact OH-CG2 3.26Å; Y367-T400 WeakPolarHBondContact OH-CG2 3.36Å; L396-T400 WeakPolarHBondContact O-CB 3.43Å; L396-T400 PolarHBondContact O-N 2.96Å; L396-T400 PolarHBondContact O-OG1 3.3Å; D397-T400 CarbonylContact O-C 3.58Å; D397-T400 WeakPolarHBondContact O-CA 3.34Å; D397-T400 VanDerWaalsContact O-CB 3.31Å; D397-T400 WeakPolarHBondContact O-CB 3.34Å; D397-T400 PolarHBondContact O-N 2.88Å; D397-T400 VanDerWaalsContact O-N 3.13Å; F398-T400 PolarHBondContact O-N 2.92Å; T400-I402 PolarHBondContact O-N 2.88Å; T400-N403 WeakPolarHBondContact O-CB 3.33Å; T400-N403 PolarHBondContact O-N 2.98Å; T400-N404 VanDerWaalsContact O-CG 3.31Å; T400-N404 PolarHBondContact O-N 3.07Å; T400-N404 PolarHBondContact O-OD1 2.65Å |
| 401 | L | 95.8 | Very high | 92.5 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -64.1 | -39.1 | 176 | -68.9 | 170.8 | 0 | 0 | 0 | 112.1 | C55 L58 V96 M97 Y100 D397 F398 N403 N404 G405 | C55-L401 HydrophobicContact CB-CD1 4.4Å; L58-L401 HydrophobicContact CD2-CB 3.97Å; V96-L401 HydrophobicContact CG1-CD2 4.4Å; M97-L401 HydrophobicContact CE-CB 4.4Å; M97-L401 WeakPolarHBondContact CE-O 3.33Å; M97-L401 HydrophobicContact CG-CD2 4.03Å; Y100-L401 HydrophobicContact CD1-CD1 3.81Å; Y100-L401 HydrophobicContact CD1-CD2 4.34Å; Y100-L401 HydrophobicContact CD2-CD2 3.8Å; Y100-L401 HydrophobicContact CE1-CD1 4.06Å; Y100-L401 HydrophobicContact CE2-CD2 4.16Å; Y100-L401 HydrophobicContact CG-CD1 4.15Å; Y100-L401 HydrophobicContact CG-CD2 3.87Å; D397-L401 WeakPolarHBondContact O-CG 3.29Å; D397-L401 PolarHBondContact O-N 2.82Å; F398-L401 PolarHBondContact O-N 3.36Å; L401-N403 VanDerWaalsContact C-N 3.34Å; L401-N403 PolarHBondContact O-N 2.97Å; L401-N404 PolarHBondContact O-N 3.02Å; L401-G405 PolarHBondContact O-N 3.45Å |
| 402 | I | 95.4 | Very high | 92.6 | Very high | 52 Ų | 52 | 28.4 Ų | 28.4 | 27% | 0.267 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -57.5 | -50.7 | 172.1 | -73.7 | 173.4 | 0 | 0 | 0 | 109.7 | L58 F398 L399 T400 N404 G405 L406 | L58-I402 HydrophobicContact CD2-CB 4.48Å; L58-I402 HydrophobicContact CD2-CG1 3.64Å; F398-I402 HydrophobicContact CD1-CD1 3.9Å; F398-I402 HydrophobicContact CE1-CD1 3.36Å; F398-I402 HydrophobicContact CE1-CG1 4.25Å; F398-I402 HydrophobicContact CE2-CD1 4.21Å; F398-I402 HydrophobicContact CE2-CG1 4.28Å; F398-I402 HydrophobicContact CZ-CD1 3.54Å; F398-I402 HydrophobicContact CZ-CG1 4.08Å; F398-I402 WeakPolarHBondContact O-CG1 3.44Å; F398-I402 PolarHBondContact O-N 3.45Å; L399-I402 PolarHBondContact O-N 2.86Å; T400-I402 PolarHBondContact O-N 2.88Å; I402-N404 VanDerWaalsContact C-N 3.32Å; I402-N404 PolarHBondContact O-N 2.88Å; I402-G405 PolarHBondContact O-N 2.9Å; I402-L406 HydrophobicContact CG2-CD1 3.66Å; I402-L406 HydrophobicContact CG2-CG 3.99Å; I402-L406 VanDerWaalsContact O-CG 3.3Å; I402-L406 WeakPolarHBondContact O-CG 3.5Å; I402-L406 PolarHBondContact O-N 3.46Å |
| 403 | N | 94.2 | Very high | 92.5 | Very high | 3 Ų | 3 | 31.6 Ų | 31.6 | 2% | 0.016 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -57.2 | -45.1 | 179.7 | 175.3 | 69.8 | 0 | 0 | 0 | 112.1 | L362 Y363 T366 L399 T400 L401 G405 L406 | L362-N403 VanDerWaalsContact CB-OD1 3.25Å; L362-N403 WeakPolarHBondContact CB-OD1 3.32Å; Y363-N403 WeakPolarHBondContact CD1-ND2 3.22Å; Y363-N403 VanDerWaalsContact CD2-ND2 3.26Å; Y363-N403 WeakPolarHBondContact CD2-ND2 3.06Å; Y363-N403 WeakPolarHBondContact CE1-ND2 3.05Å; Y363-N403 WeakPolarHBondContact CE2-ND2 3.4Å; Y363-N403 VanDerWaalsContact CZ-ND2 3.32Å; T366-N403 HydrophobicContact CG2-CB 3.92Å; L399-N403 PolarHBondContact O-N 3.43Å; T400-N403 WeakPolarHBondContact O-CB 3.33Å; T400-N403 PolarHBondContact O-N 2.98Å; L401-N403 VanDerWaalsContact C-N 3.34Å; L401-N403 PolarHBondContact O-N 2.97Å; N403-G405 VanDerWaalsContact C-N 3.26Å; N403-G405 PolarHBondContact O-N 2.94Å; N403-L406 PolarHBondContact O-N 2.72Å |
| 404 | N | 94.4 | Very high | 92.3 | Very high | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -62.6 | -32 | 177.6 | -67.3 | 3.5 | 0 | 0 | 0 | 112.4 | N66 D93 M97 Y363 T400 L401 I402 | N66-N404 PolarHBondContact ND2-O 2.9Å; D93-N404 HydrophobicContact CB-CB 4.07Å; M97-N404 HydrophobicContact CG-CB 4.35Å; M97-N404 HydrophobicContact SD-CB 4.06Å; Y363-N404 PolarHBondContact OH-OD1 2.92Å; T400-N404 VanDerWaalsContact O-CG 3.31Å; T400-N404 PolarHBondContact O-N 3.07Å; T400-N404 PolarHBondContact O-OD1 2.65Å; L401-N404 PolarHBondContact O-N 3.02Å; I402-N404 VanDerWaalsContact C-N 3.32Å; I402-N404 PolarHBondContact O-N 2.88Å |
| 405 | G | 93.6 | Very high | 92.1 | Very high | 12 Ų | 12 | 32 Ų | 32 | 12% | 0.124 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -79.9 | -25.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 115 | L401 I402 N403 N407 | L401-G405 PolarHBondContact O-N 3.45Å; I402-G405 PolarHBondContact O-N 2.9Å; N403-G405 VanDerWaalsContact C-N 3.26Å; N403-G405 PolarHBondContact O-N 2.94Å; G405-N407 VanDerWaalsContact C-N 3.35Å; G405-N407 PolarHBondContact O-N 2.67Å |
| 406 | L | 92.5 | Very high | 91.7 | Very high | 60 Ų | 60 | 37.8 Ų | 37.8 | 31% | 0.314 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -77.2 | -15.1 | -174.7 | -75.9 | 178.5 | 0 | 0 | 0 | 114.4 | I402 N403 F408 I409 L410 | I402-L406 HydrophobicContact CG2-CD1 3.66Å; I402-L406 HydrophobicContact CG2-CG 3.99Å; I402-L406 VanDerWaalsContact O-CG 3.3Å; I402-L406 WeakPolarHBondContact O-CG 3.5Å; I402-L406 PolarHBondContact O-N 3.46Å; N403-L406 PolarHBondContact O-N 2.72Å; L406-F408 VanDerWaalsContact C-N 3.29Å; L406-F408 PolarHBondContact O-N 2.73Å; L406-I409 HydrophobicContact CD2-CD1 3.92Å; L406-I409 PolarHBondContact O-N 3.25Å; L406-L410 WeakPolarHBondContact O-CG 3.27Å; L406-L410 PolarHBondContact O-N 2.8Å |
| 407 | N | 89.6 | Confident | 91.3 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -51.4 | -43.8 | -176.7 | -75.6 | -32.2 | 0 | 0 | 0 | 113.3 | D93 G405 I409 L410 Y411 | D93-N407 PolarHBondContact OD2-ND2 2.89Å; G405-N407 VanDerWaalsContact C-N 3.35Å; G405-N407 PolarHBondContact O-N 2.67Å; N407-I409 PolarHBondContact O-N 2.71Å; N407-L410 PolarHBondContact O-N 3.38Å; N407-Y411 HydrophobicContact CB-CE2 4.08Å; N407-Y411 WeakPolarHBondContact O-CD2 3.17Å; N407-Y411 VanDerWaalsContact O-CG 3.24Å; N407-Y411 PolarHBondContact O-N 2.93Å |
| 408 | F | 90.8 | Very high | 91 | Very high | 33 Ų | 33 | 40.5 Ų | 40.5 | 15% | 0.145 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -63.1 | -42.9 | 178.7 | 177.4 | -93.9 | 0 | 0 | 0 | 112.7 | A65 L68 N69 L406 L410 Y411 C412 F418 F422 | A65-F408 HydrophobicContact CB-CB 3.86Å; A65-F408 HydrophobicContact CB-CG 4.34Å; L68-F408 HydrophobicContact CB-CD2 3.94Å; L68-F408 HydrophobicContact CB-CE2 3.72Å; L68-F408 HydrophobicContact CD1-CE2 4.18Å; L68-F408 HydrophobicContact CD1-CZ 4.25Å; N69-F408 WeakPolarHBondContact ND2-CA 3.43Å; N69-F408 PolarHBondContact ND2-N 3.29Å; N69-F408 WeakPolarHBondContact OD1-CA 3.45Å; N69-F408 WeakPolarHBondContact OD1-CB 3.48Å; N69-F408 WeakPolarHBondContact OD1-CD2 3.5Å; L406-F408 VanDerWaalsContact C-N 3.29Å; L406-F408 PolarHBondContact O-N 2.73Å; F408-L410 VanDerWaalsContact C-N 3.33Å; F408-L410 PolarHBondContact O-N 3.29Å; F408-Y411 PolarHBondContact O-N 3.38Å; F408-C412 VanDerWaalsContact CE1-SG 3.54Å; F408-C412 VanDerWaalsContact CZ-SG 3.58Å; F408-C412 WeakPolarHBondContact O-CB 3.43Å; F408-C412 PolarHBondContact O-N 3.14Å; F408-C412 PolarHBondContact O-SG 2.99Å; F408-C412 VanDerWaalsContact O-SG 3.32Å; F408-F418 HydrophobicContact CD2-CE1 4.17Å; F408-F418 AromaticContact CD2-CZ 3.93Å; F408-F418 HydrophobicContact CD2-CZ 3.93Å; F408-F418 AromaticContact CE2-CE1 3.87Å; F408-F418 HydrophobicContact CE2-CE1 3.87Å; F408-F418 AromaticContact CE2-CZ 3.92Å; F408-F418 HydrophobicContact CE2-CZ 3.92Å; F408-F422 HydrophobicContact CE2-CD2 4.2Å; F408-F422 HydrophobicContact CE2-CE2 4.12Å; F408-F422 HydrophobicContact CZ-CD2 4.17Å; F408-F422 AromaticContact CZ-CE2 3.83Å; F408-F422 HydrophobicContact CZ-CE2 3.83Å; F408-F422 HydrophobicContact CZ-CZ 4.25Å |
| 409 | I | 90.9 | Very high | 90.7 | Very high | 94 Ų | 94 | 44.5 Ų | 44.5 | 48% | 0.482 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63.9 | -43.3 | 177.9 | -66 | 169.3 | 0 | 0 | 0 | 109.5 | L406 N407 Y411 C412 V413 | L406-I409 HydrophobicContact CD2-CD1 3.92Å; L406-I409 PolarHBondContact O-N 3.25Å; N407-I409 PolarHBondContact O-N 2.71Å; I409-Y411 PolarHBondContact O-N 2.79Å; I409-C412 PolarHBondContact O-N 3.45Å; I409-V413 HydrophobicContact CG2-CG2 4.35Å; I409-V413 WeakPolarHBondContact O-CG2 2.85Å; I409-V413 PolarHBondContact O-N 3Å |
| 410 | L | 91.1 | Very high | 90.4 | Very high | 25 Ų | 25 | 48.1 Ų | 48.1 | 13% | 0.131 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.7 | -43.4 | 176.3 | -66.7 | 171.4 | 0 | 0 | 0 | 112 | T358 I359 L362 L406 N407 F408 V413 M414 | T358-L410 HydrophobicContact CG2-CD2 3.88Å; I359-L410 HydrophobicContact CG1-CD1 3.9Å; L362-L410 HydrophobicContact CD1-CD1 3.46Å; L362-L410 VanDerWaalsContact CD1-CD1 3.46Å; L362-L410 HydrophobicContact CD1-CD2 4.01Å; L362-L410 HydrophobicContact CD1-CG 4.3Å; L406-L410 WeakPolarHBondContact O-CG 3.27Å; L406-L410 PolarHBondContact O-N 2.8Å; N407-L410 PolarHBondContact O-N 3.38Å; F408-L410 VanDerWaalsContact C-N 3.33Å; F408-L410 PolarHBondContact O-N 3.29Å; L410-V413 PolarHBondContact O-N 2.76Å; L410-M414 VanDerWaalsContact O-CB 3.28Å; L410-M414 WeakPolarHBondContact O-CB 3.09Å; L410-M414 WeakPolarHBondContact O-CG 3.24Å; L410-M414 PolarHBondContact O-N 2.66Å |
| 411 | Y | 90.1 | Very high | 90.2 | Very high | 1 Ų | 1 | 48.1 Ų | 48.1 | 0% | 0.004 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -65.1 | -41.8 | 176.4 | -61.8 | -39.6 | 0 | 0 | 0 | 112.2 | N69 L73 L86 M355 I359 N407 F408 I409 S415 F418 | N69-Y411 HydrophobicContact CB-CE2 4.45Å; N69-Y411 VanDerWaalsContact OD1-CD2 3.28Å; N69-Y411 WeakPolarHBondContact OD1-CD2 3.48Å; L73-Y411 HydrophobicContact CD1-CE2 4.15Å; L86-Y411 HydrophobicContact CD1-CE1 4.07Å; L86-Y411 WeakPolarHBondContact CD2-OH 3.41Å; M355-Y411 HydrophobicContact CE-CD1 3.94Å; M355-Y411 HydrophobicContact CE-CE1 3.92Å; M355-Y411 HydrophobicContact CG-CD1 4.07Å; M355-Y411 HydrophobicContact CG-CE1 4.42Å; M355-Y411 HydrophobicContact SD-CD1 3.54Å; M355-Y411 VanDerWaalsContact SD-CD1 3.54Å; M355-Y411 HydrophobicContact SD-CE1 4.11Å; I359-Y411 HydrophobicContact CD1-CD1 4.14Å; I359-Y411 HydrophobicContact CD1-CE1 3.3Å; N407-Y411 HydrophobicContact CB-CE2 4.08Å; N407-Y411 WeakPolarHBondContact O-CD2 3.17Å; N407-Y411 VanDerWaalsContact O-CG 3.24Å; N407-Y411 PolarHBondContact O-N 2.93Å; F408-Y411 PolarHBondContact O-N 3.38Å; I409-Y411 PolarHBondContact O-N 2.79Å; Y411-S415 WeakPolarHBondContact O-CA 3.37Å; Y411-S415 VanDerWaalsContact O-CB 3.3Å; Y411-S415 WeakPolarHBondContact O-CB 3.26Å; Y411-S415 PolarHBondContact O-N 3.46Å; Y411-F418 HydrophobicContact CD2-CE2 4.15Å; Y411-F418 HydrophobicContact CD2-CZ 4.47Å; Y411-F418 HydrophobicContact CG-CD2 4.4Å; Y411-F418 HydrophobicContact CG-CE2 4.33Å |
| 412 | C | 88.4 | Confident | 89.9 | Confident | 29 Ų | 29 | 50.4 Ų | 50.4 | 20% | 0.196 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -59.3 | -48.6 | 174.1 | -73.6 | 0 | 0 | 0 | 0 | 111.8 | F408 I409 R419 | F408-C412 VanDerWaalsContact CE1-SG 3.54Å; F408-C412 VanDerWaalsContact CZ-SG 3.58Å; F408-C412 WeakPolarHBondContact O-CB 3.43Å; F408-C412 PolarHBondContact O-N 3.14Å; F408-C412 PolarHBondContact O-SG 2.99Å; F408-C412 VanDerWaalsContact O-SG 3.32Å; I409-C412 PolarHBondContact O-N 3.45Å; C412-R419 WeakPolarHBondContact O-CD 3.47Å; C412-R419 WeakPolarHBondContact O-CG 3.5Å; C412-R419 PolarHBondContact O-NE 2.73Å; C412-R419 VanDerWaalsContact O-NE 3.08Å |
| 413 | V | 88.1 | Confident | 89.6 | Confident | 106 Ų | 106 | 50.4 Ų | 50.4 | 64% | 0.642 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -69 | -46.6 | -177.6 | 172.1 | 0 | 0 | 0 | 0 | 111.3 | I409 L410 | I409-V413 HydrophobicContact CG2-CG2 4.35Å; I409-V413 WeakPolarHBondContact O-CG2 2.85Å; I409-V413 PolarHBondContact O-N 3Å; L410-V413 PolarHBondContact O-N 2.76Å |
| 414 | M | 84.4 | Confident | 89.4 | Confident | 55 Ų | 55 | 53.3 Ų | 53.3 | 27% | 0.271 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -96.3 | -17.6 | -166.1 | -55.5 | -166.6 | 96.7 | 0 | 0 | 114.3 | Q351 M355 T358 L410 | Q351-M414 VanDerWaalsContact CG-O 3.32Å; Q351-M414 WeakPolarHBondContact CG-O 3.02Å; Q351-M414 PolarHBondContact NE2-O 3.33Å; M355-M414 HydrophobicContact CB-CB 3.86Å; M355-M414 HydrophobicContact CB-SD 4.37Å; M355-M414 HydrophobicContact CG-CB 3.93Å; T358-M414 HydrophobicContact CG2-SD 4Å; T358-M414 WeakPolarHBondContact OG1-CE 3.48Å; T358-M414 PolarHBondContact OG1-SD 2.91Å; T358-M414 VanDerWaalsContact OG1-SD 3.37Å; L410-M414 VanDerWaalsContact O-CB 3.28Å; L410-M414 WeakPolarHBondContact O-CB 3.09Å; L410-M414 WeakPolarHBondContact O-CG 3.24Å; L410-M414 PolarHBondContact O-N 2.66Å |
| 415 | S | 87.5 | Confident | 89.1 | Confident | 14 Ų | 14 | 56.5 Ų | 56.5 | 10% | 0.098 | 27% | 0.269 | C | S | . | . | trans | -115 | 111.1 | -178.2 | -179.6 | 0 | 0 | 0 | 0 | 113.1 | Y411 Q417 F418 R419 | Y411-S415 WeakPolarHBondContact O-CA 3.37Å; Y411-S415 VanDerWaalsContact O-CB 3.3Å; Y411-S415 WeakPolarHBondContact O-CB 3.26Å; Y411-S415 PolarHBondContact O-N 3.46Å; S415-Q417 VanDerWaalsContact C-N 3.32Å; S415-Q417 PolarHBondContact O-N 2.91Å; S415-F418 PolarHBondContact O-N 2.72Å; S415-F418 WeakPolarHBondContact OG-CB 3.47Å; S415-F418 PolarHBondContact OG-N 2.91Å; S415-F418 VanDerWaalsContact OG-N 3.14Å; S415-R419 PolarHBondContact O-N 2.59Å; S415-R419 VanDerWaalsContact O-N 3.15Å | ||
| 416 | R | 85.4 | Confident | 88.9 | Confident | 184 Ų | 184 | 60.4 Ų | 60.4 | 69% | 0.694 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -64 | -38 | 174.1 | -175.2 | 178.4 | 175.4 | 177.9 | -0.6 | 112 | F418 R419 Y420 | R416-F418 VanDerWaalsContact C-N 3.35Å; R416-R419 PolarHBondContact O-N 2.73Å; R416-Y420 WeakPolarHBondContact O-CB 3.28Å; R416-Y420 PolarHBondContact O-N 3.25Å |
| 417 | Q | 86 | Confident | 88.7 | Confident | 102 Ų | 102 | 60 Ų | 60 | 48% | 0.477 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -68.1 | -37.6 | 179.6 | -65.2 | 179.3 | -17.1 | 0 | 0 | 111.4 | L78 S415 T421 | L78-Q417 HydrophobicContact CD2-CB 3.63Å; S415-Q417 VanDerWaalsContact C-N 3.32Å; S415-Q417 PolarHBondContact O-N 2.91Å; Q417-T421 WeakPolarHBondContact O-CB 3.31Å; Q417-T421 PolarHBondContact O-N 3.05Å; Q417-T421 PolarHBondContact O-OG1 2.94Å |
| 418 | F | 87.9 | Confident | 88.1 | Confident | 3 Ų | 3 | 63 Ų | 63 | 1% | 0.013 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.9 | -51.6 | 174.5 | -172.6 | -85.8 | 0 | 0 | 0 | 110.7 | V72 L73 L78 F408 Y411 S415 R416 Y420 T421 F422 | V72-F418 HydrophobicContact CB-CD2 4.19Å; V72-F418 HydrophobicContact CB-CE2 3.58Å; V72-F418 HydrophobicContact CB-CZ 3.78Å; V72-F418 HydrophobicContact CG1-CD1 4.24Å; V72-F418 HydrophobicContact CG1-CD2 3.42Å; V72-F418 VanDerWaalsContact CG1-CD2 3.42Å; V72-F418 HydrophobicContact CG1-CE1 4.15Å; V72-F418 HydrophobicContact CG1-CE2 3.34Å; V72-F418 HydrophobicContact CG1-CG 3.9Å; V72-F418 HydrophobicContact CG1-CZ 3.72Å; V72-F418 HydrophobicContact CG2-CE2 4.38Å; V72-F418 HydrophobicContact CG2-CZ 4.08Å; L73-F418 HydrophobicContact CD2-CD2 4.1Å; L73-F418 HydrophobicContact CD2-CE2 4.25Å; L73-F418 HydrophobicContact CG-CD2 4.49Å; L73-F418 HydrophobicContact CG-CE2 4.16Å; L78-F418 HydrophobicContact CD1-CD2 4.49Å; F408-F418 HydrophobicContact CD2-CE1 4.17Å; F408-F418 AromaticContact CD2-CZ 3.93Å; F408-F418 HydrophobicContact CD2-CZ 3.93Å; F408-F418 AromaticContact CE2-CE1 3.87Å; F408-F418 HydrophobicContact CE2-CE1 3.87Å; F408-F418 AromaticContact CE2-CZ 3.92Å; F408-F418 HydrophobicContact CE2-CZ 3.92Å; Y411-F418 HydrophobicContact CD2-CE2 4.15Å; Y411-F418 HydrophobicContact CD2-CZ 4.47Å; Y411-F418 HydrophobicContact CG-CD2 4.4Å; Y411-F418 HydrophobicContact CG-CE2 4.33Å; S415-F418 PolarHBondContact O-N 2.72Å; S415-F418 WeakPolarHBondContact OG-CB 3.47Å; S415-F418 PolarHBondContact OG-N 2.91Å; S415-F418 VanDerWaalsContact OG-N 3.14Å; R416-F418 VanDerWaalsContact C-N 3.35Å; F418-Y420 PolarHBondContact O-N 2.57Å; F418-T421 PolarHBondContact O-N 3.1Å; F418-T421 VanDerWaalsContact O-N 3.14Å; F418-F422 WeakPolarHBondContact O-CB 3.4Å; F418-F422 PolarHBondContact O-N 2.82Å |
| 419 | R | 89.3 | Confident | 87.5 | Confident | 114 Ų | 114 | 70.4 Ų | 70.4 | 43% | 0.43 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -56.1 | -47.5 | 177.2 | -75.7 | -172.1 | -78.5 | 134.9 | -7 | 113.2 | C412 S415 R416 T421 F422 L423 | C412-R419 WeakPolarHBondContact O-CD 3.47Å; C412-R419 WeakPolarHBondContact O-CG 3.5Å; C412-R419 PolarHBondContact O-NE 2.73Å; C412-R419 VanDerWaalsContact O-NE 3.08Å; S415-R419 PolarHBondContact O-N 2.59Å; S415-R419 VanDerWaalsContact O-N 3.15Å; R416-R419 PolarHBondContact O-N 2.73Å; R419-T421 VanDerWaalsContact C-N 3.3Å; R419-T421 PolarHBondContact O-N 3.18Å; R419-F422 PolarHBondContact O-N 2.98Å; R419-L423 WeakPolarHBondContact O-CB 3.45Å; R419-L423 WeakPolarHBondContact O-CG 3.49Å; R419-L423 PolarHBondContact O-N 3.1Å |
| 420 | Y | 89.2 | Confident | 86.5 | Confident | 122 Ų | 122 | 71.8 Ų | 71.8 | 48% | 0.478 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -61 | -42.6 | 178.6 | -177.2 | -100.1 | 0 | 0 | 0 | 111.4 | R416 F418 Q424 | R416-Y420 WeakPolarHBondContact O-CB 3.28Å; R416-Y420 PolarHBondContact O-N 3.25Å; F418-Y420 PolarHBondContact O-N 2.57Å; Y420-Q424 WeakPolarHBondContact O-CB 3.35Å; Y420-Q424 PolarHBondContact O-N 2.83Å |
| 421 | T | 88.7 | Confident | 84.9 | Confident | 2 Ų | 2 | 72.1 Ų | 72.1 | 1% | 0.012 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -65.4 | -43.7 | 177.9 | -55.5 | 0 | 0 | 0 | 0 | 112 | V72 Q75 R77 L78 Q417 F418 R419 Q424 L425 | V72-T421 HydrophobicContact CG1-CG2 3.95Å; Q75-T421 HydrophobicContact CB-CG2 3.66Å; Q75-T421 HydrophobicContact CG-CG2 3.7Å; R77-T421 WeakPolarHBondContact CD-OG1 2.85Å; R77-T421 HydrophobicContact CG-CG2 4.07Å; L78-T421 HydrophobicContact CD1-CG2 4.08Å; Q417-T421 WeakPolarHBondContact O-CB 3.31Å; Q417-T421 PolarHBondContact O-N 3.05Å; Q417-T421 PolarHBondContact O-OG1 2.94Å; F418-T421 PolarHBondContact O-N 3.1Å; F418-T421 VanDerWaalsContact O-N 3.14Å; R419-T421 VanDerWaalsContact C-N 3.3Å; R419-T421 PolarHBondContact O-N 3.18Å; T421-Q424 PolarHBondContact O-N 2.83Å; T421-L425 HydrophobicContact CG2-CD1 3.96Å; T421-L425 WeakPolarHBondContact O-CB 3.39Å; T421-L425 VanDerWaalsContact O-CG 3.31Å; T421-L425 WeakPolarHBondContact O-CG 3.41Å; T421-L425 PolarHBondContact O-N 2.91Å |
| 422 | F | 90.3 | Very high | 82.9 | Confident | 48 Ų | 48 | 82 Ų | 82 | 21% | 0.211 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -61.4 | -51 | 177.1 | 176.6 | -93.5 | 0 | 0 | 0 | 111.4 | V72 F408 F418 R419 Q424 L425 F426 | V72-F422 HydrophobicContact CG2-CB 4.18Å; V72-F422 HydrophobicContact CG2-CD2 3.87Å; F408-F422 HydrophobicContact CE2-CD2 4.2Å; F408-F422 HydrophobicContact CE2-CE2 4.12Å; F408-F422 HydrophobicContact CZ-CD2 4.17Å; F408-F422 AromaticContact CZ-CE2 3.83Å; F408-F422 HydrophobicContact CZ-CE2 3.83Å; F408-F422 HydrophobicContact CZ-CZ 4.25Å; F418-F422 WeakPolarHBondContact O-CB 3.4Å; F418-F422 PolarHBondContact O-N 2.82Å; R419-F422 PolarHBondContact O-N 2.98Å; F422-Q424 VanDerWaalsContact C-N 3.31Å; F422-Q424 PolarHBondContact O-N 2.92Å; F422-L425 PolarHBondContact O-N 3.21Å; F422-L425 VanDerWaalsContact O-N 3.16Å; F422-F426 AromaticContact CD2-CD2 3.48Å; F422-F426 HydrophobicContact CD2-CD2 3.48Å; F422-F426 VanDerWaalsContact CD2-CD2 3.48Å; F422-F426 AromaticContact CD2-CE2 3.77Å; F422-F426 HydrophobicContact CD2-CE2 3.77Å; F422-F426 AromaticContact CE2-CD2 3.45Å; F422-F426 HydrophobicContact CE2-CD2 3.45Å; F422-F426 VanDerWaalsContact CE2-CD2 3.45Å; F422-F426 AromaticContact CE2-CE2 3.8Å; F422-F426 HydrophobicContact CE2-CE2 3.8Å; F422-F426 HydrophobicContact CE2-CG 4.19Å; F422-F426 HydrophobicContact CG-CD2 4.14Å; F422-F426 HydrophobicContact CZ-CB 4.47Å; F422-F426 HydrophobicContact CZ-CD2 4.09Å; F422-F426 HydrophobicContact CZ-CG 4.46Å; F422-F426 WeakPolarHBondContact O-CD2 3.39Å; F422-F426 PolarHBondContact O-N 2.99Å |
| 423 | L | 89.7 | Confident | 82.6 | Confident | 52 Ų | 52 | 84.7 Ų | 84.7 | 27% | 0.272 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -60.7 | -41.3 | 178.2 | -70.8 | 175.6 | 0 | 0 | 0 | 111.4 | R419 L425 C427 L430 | R419-L423 WeakPolarHBondContact O-CB 3.45Å; R419-L423 WeakPolarHBondContact O-CG 3.49Å; R419-L423 PolarHBondContact O-N 3.1Å; L423-L425 VanDerWaalsContact C-N 3.31Å; L423-L425 PolarHBondContact O-N 2.88Å; L423-C427 HydrophobicContact CD2-CB 4.21Å; L423-C427 CarbonylContact O-C 3.58Å; L423-C427 WeakPolarHBondContact O-CA 3.33Å; L423-C427 PolarHBondContact O-N 2.95Å; L423-L430 HydrophobicContact CD2-CD2 3.87Å |
| 424 | Q | 89 | Confident | 82.4 | Confident | 63 Ų | 63 | 83.5 Ų | 83.5 | 29% | 0.294 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -65.8 | -32.9 | 178 | -171.1 | 172.9 | 19.3 | 0 | 0 | 113.4 | Y420 T421 F422 | Y420-Q424 WeakPolarHBondContact O-CB 3.35Å; Y420-Q424 PolarHBondContact O-N 2.83Å; T421-Q424 PolarHBondContact O-N 2.83Å; F422-Q424 VanDerWaalsContact C-N 3.31Å; F422-Q424 PolarHBondContact O-N 2.92Å |
| 425 | L | 88.8 | Confident | 82.2 | Confident | 67 Ų | 67 | 85.1 Ų | 85.1 | 35% | 0.351 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -77.5 | -45.2 | 179.6 | -74.9 | 169.2 | 0 | 0 | 0 | 112.4 | V72 T421 F422 L423 | V72-L425 HydrophobicContact CG2-CD1 4.48Å; T421-L425 HydrophobicContact CG2-CD1 3.96Å; T421-L425 WeakPolarHBondContact O-CB 3.39Å; T421-L425 VanDerWaalsContact O-CG 3.31Å; T421-L425 WeakPolarHBondContact O-CG 3.41Å; T421-L425 PolarHBondContact O-N 2.91Å; F422-L425 PolarHBondContact O-N 3.21Å; F422-L425 VanDerWaalsContact O-N 3.16Å; L423-L425 VanDerWaalsContact C-N 3.31Å; L423-L425 PolarHBondContact O-N 2.88Å |
| 426 | F | 89.7 | Confident | 81.9 | Confident | 94 Ų | 94 | 89.3 Ų | 89.3 | 41% | 0.412 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -105.3 | -19.8 | -170.3 | -64.5 | -76.6 | 0 | 0 | 0 | 113.8 | L68 I71 V72 F422 | L68-F426 HydrophobicContact CD2-CE1 4.17Å; L68-F426 HydrophobicContact CD2-CE2 4.13Å; L68-F426 HydrophobicContact CD2-CZ 3.63Å; I71-F426 HydrophobicContact CG2-CZ 4.15Å; V72-F426 HydrophobicContact CG2-CE2 4.21Å; F422-F426 AromaticContact CD2-CD2 3.48Å; F422-F426 HydrophobicContact CD2-CD2 3.48Å; F422-F426 VanDerWaalsContact CD2-CD2 3.48Å; F422-F426 AromaticContact CD2-CE2 3.77Å; F422-F426 HydrophobicContact CD2-CE2 3.77Å; F422-F426 AromaticContact CE2-CD2 3.45Å; F422-F426 HydrophobicContact CE2-CD2 3.45Å; F422-F426 VanDerWaalsContact CE2-CD2 3.45Å; F422-F426 AromaticContact CE2-CE2 3.8Å; F422-F426 HydrophobicContact CE2-CE2 3.8Å; F422-F426 HydrophobicContact CE2-CG 4.19Å; F422-F426 HydrophobicContact CG-CD2 4.14Å; F422-F426 HydrophobicContact CZ-CB 4.47Å; F422-F426 HydrophobicContact CZ-CD2 4.09Å; F422-F426 HydrophobicContact CZ-CG 4.46Å; F422-F426 WeakPolarHBondContact O-CD2 3.39Å; F422-F426 PolarHBondContact O-N 2.99Å |
| 427 | C | 87.2 | Confident | 81.7 | Confident | 52 Ų | 52 | 83.4 Ų | 83.4 | 35% | 0.351 | 41% | 0.406 | S | S | . | . | trans | -139.8 | 60.3 | -176.9 | -57.9 | 0 | 0 | 0 | 0 | 111 | L423 F429 L430 | L423-C427 HydrophobicContact CD2-CB 4.21Å; L423-C427 CarbonylContact O-C 3.58Å; L423-C427 WeakPolarHBondContact O-CA 3.33Å; L423-C427 PolarHBondContact O-N 2.95Å; C427-F429 PolarHBondContact O-N 3.32Å; C427-L430 HydrophobicContact CB-CB 4.12Å; C427-L430 PolarHBondContact O-N 2.78Å | ||
| 428 | P | 78.4 | Confident | 81.4 | Confident | 63 Ų | 63 | 82.1 Ų | 82.1 | 41% | 0.409 | 40% | 0.401 | S | S | . | . | G | 310 helix | trans | -55.4 | -33.3 | -172.3 | 21.3 | -33.1 | 0 | 0 | 0 | 112.9 | L430 S431 | P428-L430 VanDerWaalsContact C-N 3.26Å; P428-L430 PolarHBondContact O-N 2.76Å; P428-S431 PolarHBondContact O-N 3.2Å; P428-S431 PolarHBondContact O-OG 2.82Å |
| 429 | F | 77.8 | Confident | 81 | Confident | 189 Ų | 189 | 87.8 Ų | 87.8 | 83% | 0.829 | 43% | 0.429 | S | S | * | . | G | 310 helix | trans | -62.1 | -26.5 | 176.1 | -57.4 | -72.5 | 0 | 0 | 0 | 114.5 | C427 | C427-F429 PolarHBondContact O-N 3.32Š|
| 430 | L | 68.6 | Low | 80.3 | Confident | 123 Ų | 123 | 85.8 Ų | 85.8 | 64% | 0.644 | 43% | 0.429 | S | S | * | . | G | 310 helix | trans | -91.2 | -8.4 | -179.7 | -146.2 | 78.6 | 0 | 0 | 0 | 112.8 | L423 C427 P428 | L423-L430 HydrophobicContact CD2-CD2 3.87Å; C427-L430 HydrophobicContact CB-CB 4.12Å; C427-L430 PolarHBondContact O-N 2.78Å; P428-L430 VanDerWaalsContact C-N 3.26Å; P428-L430 PolarHBondContact O-N 2.76Å |
| 431 | S | 58.9 | Low | 79.6 | Confident | 32 Ų | 32 | 82.8 Ų | 82.8 | 22% | 0.224 | 43% | 0.425 | C | S | . | . | trans | -90.8 | -13.8 | -177.6 | 73.2 | 0 | 0 | 0 | 0 | 114.1 | P428 | P428-S431 PolarHBondContact O-N 3.2Å; P428-S431 PolarHBondContact O-OG 2.82Å | ||
| 432 | L | 48 | Very low | 78.8 | Confident | 208 Ų | 208 | 90.1 Ų | 90.1 | 100% | 1.089 | 46% | 0.462 | S | S | * | . | trans | -79.3 | 0 | 166.8 | -77 | 153.8 | 0 | 0 | 0 | 109.2 |
Retrieved 432 of 432 residues in 200 ms
(Link to these results)