| 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 | 50.8 | Low | 64.2 | Low | 230 Ų | 230 | 122.8 Ų | 122.8 | 100% | 1.133 | 64% | 0.64 | S | S | * | * | 0 | -9.9 | 0 | -93.5 | 169.6 | 152.2 | 0 | 0 | 113.5 | |||||
| 2 | E | 54.5 | Low | 65.1 | Low | 178 Ų | 178 | 126.7 Ų | 126.7 | 83% | 0.832 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.8 | -28.8 | -175 | -74.8 | 165.1 | 144.4 | 0 | 0 | 116 | R4 | E2-R4 VanDerWaalsContact C-N 3.3Å; E2-R4 PolarHBondContact O-N 2.88Å |
| 3 | G | 55.2 | Low | 66.1 | Low | 59 Ų | 59 | 122.4 Ų | 122.4 | 61% | 0.608 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -73.2 | -13.9 | -177.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | S6 | G3-S6 PolarHBondContact O-OG 3.31Å |
| 4 | R | 55.1 | Low | 67.3 | Low | 210 Ų | 210 | 117.9 Ų | 117.9 | 79% | 0.792 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -86.4 | -28 | 179.6 | -132 | 178 | -171.3 | -178.9 | 2.3 | 112.3 | E2 L8 | E2-R4 VanDerWaalsContact C-N 3.3Å; E2-R4 PolarHBondContact O-N 2.88Å; R4-L8 WeakPolarHBondContact O-CG 3.35Å; R4-L8 PolarHBondContact O-N 3.33Å |
| 5 | S | 58.8 | Low | 68.1 | Low | 73 Ų | 73 | 115.9 Ų | 115.9 | 51% | 0.51 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -73.5 | -38.1 | 175.9 | -77.7 | 0 | 0 | 0 | 0 | 112.5 | L8 I9 | S5-L8 PolarHBondContact O-N 2.89Å; S5-I9 WeakPolarHBondContact O-CD1 3.5Å; S5-I9 WeakPolarHBondContact O-CG1 3.46Å; S5-I9 PolarHBondContact O-N 3.37Å |
| 6 | S | 66.5 | Low | 69 | Low | 73 Ų | 73 | 112.3 Ų | 112.3 | 51% | 0.51 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -66.5 | -38.2 | 179.9 | 51.2 | 0 | 0 | 0 | 0 | 112.9 | G3 I9 W10 | G3-S6 PolarHBondContact O-OG 3.31Å; S6-I9 PolarHBondContact O-N 2.91Å; S6-W10 WeakPolarHBondContact O-CB 3.42Å; S6-W10 PolarHBondContact O-N 3.35Å |
| 7 | A | 70.9 | Confident | 69.6 | Low | 50 Ų | 50 | 113.3 Ų | 113.3 | 41% | 0.413 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -66.7 | -40.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | W10 I11 | A7-W10 PolarHBondContact O-N 3.08Å; A7-I11 WeakPolarHBondContact O-CB 3.49Å; A7-I11 VanDerWaalsContact O-CG1 3.23Å; A7-I11 WeakPolarHBondContact O-CG1 3.29Å; A7-I11 PolarHBondContact O-N 3.19Å |
| 8 | L | 70.9 | Confident | 70.1 | Confident | 117 Ų | 117 | 113.7 Ų | 113.7 | 61% | 0.613 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -66.6 | -39.7 | 176 | -75.7 | 168.3 | 0 | 0 | 0 | 112.1 | R4 S5 Y12 | R4-L8 WeakPolarHBondContact O-CG 3.35Å; R4-L8 PolarHBondContact O-N 3.33Å; S5-L8 PolarHBondContact O-N 2.89Å; L8-Y12 VanDerWaalsContact O-CB 3.27Å; L8-Y12 WeakPolarHBondContact O-CB 3.23Å; L8-Y12 PolarHBondContact O-N 3.46Å |
| 9 | I | 73.6 | Confident | 70.6 | Confident | 109 Ų | 109 | 113.6 Ų | 113.6 | 56% | 0.559 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -63.7 | -44.3 | 174.9 | -68 | 163.6 | 0 | 0 | 0 | 110.2 | S5 S6 Y12 T13 | S5-I9 WeakPolarHBondContact O-CD1 3.5Å; S5-I9 WeakPolarHBondContact O-CG1 3.46Å; S5-I9 PolarHBondContact O-N 3.37Å; S6-I9 PolarHBondContact O-N 2.91Å; I9-Y12 PolarHBondContact O-N 3.48Å; I9-T13 HydrophobicContact CG2-CG2 4.45Å; I9-T13 WeakPolarHBondContact O-CG2 3.35Å; I9-T13 PolarHBondContact O-N 3.03Å; I9-T13 PolarHBondContact O-OG1 3.48Å |
| 10 | W | 74.7 | Confident | 71 | Confident | 170 Ų | 170 | 113.1 Ų | 113.1 | 64% | 0.644 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -63.5 | -44.1 | 178.5 | -176.4 | 82.8 | 0 | 0 | 0 | 112.8 | S6 A7 Y12 T13 N14 | S6-W10 WeakPolarHBondContact O-CB 3.42Å; S6-W10 PolarHBondContact O-N 3.35Å; A7-W10 PolarHBondContact O-N 3.08Å; W10-Y12 VanDerWaalsContact C-N 3.34Å; W10-T13 WeakPolarHBondContact CA-OG1 3.42Å; W10-T13 PolarHBondContact O-N 3.38Å; W10-T13 PolarHBondContact O-OG1 3.01Å; W10-N14 WeakPolarHBondContact O-CB 3.35Å; W10-N14 PolarHBondContact O-N 3.2Å |
| 11 | I | 75.4 | Confident | 71.3 | Confident | 82 Ų | 82 | 111.1 Ų | 111.1 | 42% | 0.421 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -61.4 | -45.4 | 174.8 | -69.3 | 166.8 | 0 | 0 | 0 | 110.1 | A7 N14 I15 | A7-I11 WeakPolarHBondContact O-CB 3.49Å; A7-I11 VanDerWaalsContact O-CG1 3.23Å; A7-I11 WeakPolarHBondContact O-CG1 3.29Å; A7-I11 PolarHBondContact O-N 3.19Å; I11-N14 PolarHBondContact O-N 3.12Å; I11-I15 HydrophobicContact CG2-CD1 3.59Å; I11-I15 HydrophobicContact CG2-CG1 4.36Å; I11-I15 WeakPolarHBondContact O-CB 3.34Å; I11-I15 VanDerWaalsContact O-CG1 3.25Å; I11-I15 WeakPolarHBondContact O-CG1 3.23Å; I11-I15 PolarHBondContact O-N 3.02Å |
| 12 | Y | 75.4 | Confident | 72.5 | Confident | 169 Ų | 169 | 103.1 Ų | 103.1 | 66% | 0.663 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63 | -43.9 | 179.1 | -174.9 | -91.8 | 0 | 0 | 0 | 112.1 | L8 I9 W10 T16 | L8-Y12 VanDerWaalsContact O-CB 3.27Å; L8-Y12 WeakPolarHBondContact O-CB 3.23Å; L8-Y12 PolarHBondContact O-N 3.46Å; I9-Y12 PolarHBondContact O-N 3.48Å; W10-Y12 VanDerWaalsContact C-N 3.34Å; Y12-T16 WeakPolarHBondContact O-CB 3.26Å; Y12-T16 PolarHBondContact O-N 3.29Å; Y12-T16 PolarHBondContact O-OG1 2.87Å |
| 13 | T | 77.9 | Confident | 73.5 | Confident | 71 Ų | 71 | 101.4 Ų | 101.4 | 44% | 0.436 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.5 | -41.7 | 177.3 | 46.8 | 0 | 0 | 0 | 0 | 112.1 | I9 W10 T16 E17 | I9-T13 HydrophobicContact CG2-CG2 4.45Å; I9-T13 WeakPolarHBondContact O-CG2 3.35Å; I9-T13 PolarHBondContact O-N 3.03Å; I9-T13 PolarHBondContact O-OG1 3.48Å; W10-T13 WeakPolarHBondContact CA-OG1 3.42Å; W10-T13 PolarHBondContact O-N 3.38Å; W10-T13 PolarHBondContact O-OG1 3.01Å; T13-T16 PolarHBondContact O-N 3.45Å; T13-E17 WeakPolarHBondContact O-CB 3.47Å; T13-E17 PolarHBondContact O-N 2.93Å |
| 14 | N | 82.3 | Confident | 74.6 | Confident | 60 Ų | 60 | 107 Ų | 107 | 32% | 0.321 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67.9 | -43.4 | -179.2 | -160.1 | 27.2 | 0 | 0 | 0 | 111.4 | W10 I11 T16 E17 E18 | W10-N14 WeakPolarHBondContact O-CB 3.35Å; W10-N14 PolarHBondContact O-N 3.2Å; I11-N14 PolarHBondContact O-N 3.12Å; N14-T16 VanDerWaalsContact C-N 3.3Å; N14-T16 PolarHBondContact O-N 2.88Å; N14-E17 PolarHBondContact O-N 3.49Å; N14-E18 PolarHBondContact O-N 3.2Å |
| 15 | I | 80.3 | Confident | 75.5 | Confident | 88 Ų | 88 | 102.2 Ų | 102.2 | 45% | 0.451 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.1 | -39.5 | 174.2 | -68.1 | 170.1 | 0 | 0 | 0 | 111.1 | I11 E17 L19 | I11-I15 HydrophobicContact CG2-CD1 3.59Å; I11-I15 HydrophobicContact CG2-CG1 4.36Å; I11-I15 WeakPolarHBondContact O-CB 3.34Å; I11-I15 VanDerWaalsContact O-CG1 3.25Å; I11-I15 WeakPolarHBondContact O-CG1 3.23Å; I11-I15 PolarHBondContact O-N 3.02Å; I15-E17 VanDerWaalsContact C-N 3.35Å; I15-L19 HydrophobicContact CG2-CD1 3.96Å; I15-L19 WeakPolarHBondContact O-CB 3.39Å; I15-L19 PolarHBondContact O-N 2.71Å |
| 16 | T | 81 | Confident | 76.1 | Confident | 57 Ų | 57 | 101.8 Ų | 101.8 | 35% | 0.35 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.9 | -37.5 | 178.3 | -55.1 | 0 | 0 | 0 | 0 | 111.5 | Y12 T13 N14 N20 | Y12-T16 WeakPolarHBondContact O-CB 3.26Å; Y12-T16 PolarHBondContact O-N 3.29Å; Y12-T16 PolarHBondContact O-OG1 2.87Å; T13-T16 PolarHBondContact O-N 3.45Å; N14-T16 VanDerWaalsContact C-N 3.3Å; N14-T16 PolarHBondContact O-N 2.88Å; T16-N20 WeakPolarHBondContact O-CB 3.34Å; T16-N20 PolarHBondContact O-N 3.19Å |
| 17 | E | 80.4 | Confident | 76.5 | Confident | 130 Ų | 130 | 100.7 Ų | 100.7 | 61% | 0.607 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -71.3 | -39.8 | 177.6 | -166.2 | 167.4 | -169.5 | 0 | 0 | 112 | T13 N14 I15 N20 T21 | T13-E17 WeakPolarHBondContact O-CB 3.47Å; T13-E17 PolarHBondContact O-N 2.93Å; N14-E17 PolarHBondContact O-N 3.49Å; I15-E17 VanDerWaalsContact C-N 3.35Å; E17-N20 PolarHBondContact O-N 3.18Å; E17-T21 WeakPolarHBondContact O-CB 3.5Å; E17-T21 WeakPolarHBondContact O-CG2 3.47Å; E17-T21 PolarHBondContact O-N 3.36Å; E17-T21 PolarHBondContact O-OG1 2.89Å |
| 18 | E | 78.3 | Confident | 76.8 | Confident | 121 Ų | 121 | 102.3 Ų | 102.3 | 57% | 0.565 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.6 | -43.8 | 171.1 | -76.2 | -174.8 | 173.8 | 0 | 0 | 112 | N14 N20 T21 S22 | N14-E18 PolarHBondContact O-N 3.2Å; E18-N20 PolarHBondContact O-N 3.42Å; E18-T21 WeakPolarHBondContact CA-OG1 3.23Å; E18-T21 PolarHBondContact O-N 2.92Å; E18-T21 PolarHBondContact O-OG1 2.75Å; E18-S22 WeakPolarHBondContact O-CB 3.46Å; E18-S22 PolarHBondContact O-N 3.28Å; E18-S22 PolarHBondContact O-OG 3.28Å |
| 19 | L | 78.6 | Confident | 77 | Confident | 112 Ų | 112 | 99.8 Ų | 99.8 | 59% | 0.586 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.4 | -40.2 | 175.1 | -108.8 | 95 | 0 | 0 | 0 | 112.2 | I15 S22 F23 | I15-L19 HydrophobicContact CG2-CD1 3.96Å; I15-L19 WeakPolarHBondContact O-CB 3.39Å; I15-L19 PolarHBondContact O-N 2.71Å; L19-S22 PolarHBondContact O-OG 2.88Å; L19-F23 WeakPolarHBondContact O-CB 3.36Å; L19-F23 PolarHBondContact O-N 3.34Å |
| 20 | N | 79.9 | Confident | 77.2 | Confident | 103 Ų | 103 | 100.7 Ų | 100.7 | 55% | 0.551 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -67.9 | -38.7 | 178.7 | -99.7 | -8.2 | 0 | 0 | 0 | 112.1 | T16 E17 E18 R24 | T16-N20 WeakPolarHBondContact O-CB 3.34Å; T16-N20 PolarHBondContact O-N 3.19Å; E17-N20 PolarHBondContact O-N 3.18Å; E18-N20 PolarHBondContact O-N 3.42Å; N20-R24 WeakPolarHBondContact O-CB 3.3Å; N20-R24 PolarHBondContact O-N 3.08Å |
| 21 | T | 77.9 | Confident | 77.4 | Confident | 72 Ų | 72 | 96.5 Ų | 96.5 | 44% | 0.442 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -70.6 | -41.5 | 176.2 | 44.7 | 0 | 0 | 0 | 0 | 111.3 | E17 E18 R24 N25 | E17-T21 WeakPolarHBondContact O-CB 3.5Å; E17-T21 WeakPolarHBondContact O-CG2 3.47Å; E17-T21 PolarHBondContact O-N 3.36Å; E17-T21 PolarHBondContact O-OG1 2.89Å; E18-T21 WeakPolarHBondContact CA-OG1 3.23Å; E18-T21 PolarHBondContact O-N 2.92Å; E18-T21 PolarHBondContact O-OG1 2.75Å; T21-R24 PolarHBondContact O-N 2.98Å; T21-N25 VanDerWaalsContact O-CB 3.31Å; T21-N25 WeakPolarHBondContact O-CB 3.31Å; T21-N25 PolarHBondContact O-N 3.28Å; T21-N25 PolarHBondContact O-ND2 3.39Å |
| 22 | S | 74.7 | Confident | 77.8 | Confident | 61 Ų | 61 | 99.6 Ų | 99.6 | 43% | 0.427 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.8 | -45.8 | 173.7 | 71.9 | 0 | 0 | 0 | 0 | 111.3 | E18 L19 N25 S26 | E18-S22 WeakPolarHBondContact O-CB 3.46Å; E18-S22 PolarHBondContact O-N 3.28Å; E18-S22 PolarHBondContact O-OG 3.28Å; L19-S22 PolarHBondContact O-OG 2.88Å; S22-N25 PolarHBondContact O-N 2.74Å; S22-S26 PolarHBondContact O-N 3.26Å; S22-S26 PolarHBondContact O-OG 3.46Å; S22-S26 VanDerWaalsContact O-OG 3.11Å |
| 23 | F | 75.9 | Confident | 78.1 | Confident | 142 Ų | 142 | 96.4 Ų | 96.4 | 62% | 0.623 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62.4 | -46.4 | 178.1 | -173.6 | -100.5 | 0 | 0 | 0 | 111.8 | L19 N25 S26 T27 | L19-F23 WeakPolarHBondContact O-CB 3.36Å; L19-F23 PolarHBondContact O-N 3.34Å; F23-N25 VanDerWaalsContact C-N 3.32Å; F23-N25 PolarHBondContact O-N 2.91Å; F23-S26 WeakPolarHBondContact O-CB 3.22Å; F23-S26 PolarHBondContact O-N 3.19Å; F23-T27 PolarHBondContact O-N 3.22Å; F23-T27 PolarHBondContact O-OG1 2.92Å |
| 24 | R | 77.3 | Confident | 78.3 | Confident | 178 Ų | 178 | 100.1 Ų | 100.1 | 67% | 0.672 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -62.3 | -39.7 | 177.1 | -173.6 | 177 | -71 | -178.1 | -1.7 | 111.8 | N20 T21 T28 | N20-R24 WeakPolarHBondContact O-CB 3.3Å; N20-R24 PolarHBondContact O-N 3.08Å; T21-R24 PolarHBondContact O-N 2.98Å; R24-T28 VanDerWaalsContact O-CB 3.32Å; R24-T28 WeakPolarHBondContact O-CB 3.44Å; R24-T28 PolarHBondContact O-N 3.39Å; R24-T28 PolarHBondContact O-OG1 3.15Å |
| 25 | N | 75.8 | Confident | 78.5 | Confident | 109 Ų | 109 | 105.1 Ų | 105.1 | 58% | 0.583 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -66.1 | -42 | 176.1 | -71.7 | -14.4 | 0 | 0 | 0 | 111.3 | T21 S22 F23 T28 S29 | T21-N25 VanDerWaalsContact O-CB 3.31Å; T21-N25 WeakPolarHBondContact O-CB 3.31Å; T21-N25 PolarHBondContact O-N 3.28Å; T21-N25 PolarHBondContact O-ND2 3.39Å; S22-N25 PolarHBondContact O-N 2.74Å; F23-N25 VanDerWaalsContact C-N 3.32Å; F23-N25 PolarHBondContact O-N 2.91Å; N25-T28 PolarHBondContact O-N 3.45Å; N25-S29 WeakPolarHBondContact O-CB 3.36Å; N25-S29 PolarHBondContact O-N 2.86Å |
| 26 | S | 70.6 | Confident | 78.9 | Confident | 64 Ų | 64 | 104.7 Ų | 104.7 | 45% | 0.448 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.1 | -50.4 | 173.5 | -64.8 | 0 | 0 | 0 | 0 | 112 | S22 F23 T28 S29 E30 | S22-S26 PolarHBondContact O-N 3.26Å; S22-S26 PolarHBondContact O-OG 3.46Å; S22-S26 VanDerWaalsContact O-OG 3.11Å; F23-S26 WeakPolarHBondContact O-CB 3.22Å; F23-S26 PolarHBondContact O-N 3.19Å; S26-T28 VanDerWaalsContact C-N 3.3Å; S26-T28 PolarHBondContact O-N 3.38Å; S26-S29 PolarHBondContact O-N 2.87Å; S26-E30 WeakPolarHBondContact O-CG 3.32Å; S26-E30 PolarHBondContact O-N 3.41Å |
| 27 | T | 74.8 | Confident | 79.3 | Confident | 49 Ų | 49 | 106 Ų | 106 | 30% | 0.301 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.8 | -37.4 | 177.4 | -47.3 | 0 | 0 | 0 | 0 | 112.3 | F23 N31 | F23-T27 PolarHBondContact O-N 3.22Å; F23-T27 PolarHBondContact O-OG1 2.92Å; T27-N31 WeakPolarHBondContact O-CB 3.47Å; T27-N31 VanDerWaalsContact O-CG 3.24Å; T27-N31 PolarHBondContact O-N 2.81Å; T27-N31 PolarHBondContact O-ND2 3.19Å; T27-N31 VanDerWaalsContact O-ND2 3.13Å |
| 28 | T | 76.4 | Confident | 79.7 | Confident | 84 Ų | 84 | 103.7 Ų | 103.7 | 52% | 0.515 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -69.3 | -39.8 | 178 | -54.2 | 0 | 0 | 0 | 0 | 111.3 | R24 N25 S26 Y32 | R24-T28 VanDerWaalsContact O-CB 3.32Å; R24-T28 WeakPolarHBondContact O-CB 3.44Å; R24-T28 PolarHBondContact O-N 3.39Å; R24-T28 PolarHBondContact O-OG1 3.15Å; N25-T28 PolarHBondContact O-N 3.45Å; S26-T28 VanDerWaalsContact C-N 3.3Å; S26-T28 PolarHBondContact O-N 3.38Å; T28-Y32 WeakPolarHBondContact O-CB 3.47Å; T28-Y32 PolarHBondContact O-N 3.5Å |
| 29 | S | 76.1 | Confident | 80.3 | Confident | 64 Ų | 64 | 103.3 Ų | 103.3 | 45% | 0.448 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.7 | -48.1 | 176.1 | -166.1 | 0 | 0 | 0 | 0 | 111.8 | N25 S26 N31 Y32 E33 | N25-S29 WeakPolarHBondContact O-CB 3.36Å; N25-S29 PolarHBondContact O-N 2.86Å; S26-S29 PolarHBondContact O-N 2.87Å; S29-N31 VanDerWaalsContact C-N 3.34Å; S29-N31 PolarHBondContact O-N 3.2Å; S29-Y32 PolarHBondContact O-N 2.87Å; S29-E33 PolarHBondContact O-N 3.2Å |
| 30 | E | 76.8 | Confident | 81 | Confident | 129 Ų | 129 | 101.3 Ų | 101.3 | 60% | 0.603 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.3 | -43.4 | 177 | -74.6 | 177.1 | 177.9 | 0 | 0 | 111.8 | S26 E33 K34 | S26-E30 WeakPolarHBondContact O-CG 3.32Å; S26-E30 PolarHBondContact O-N 3.41Å; E30-E33 PolarHBondContact O-N 3.36Å; E30-K34 WeakPolarHBondContact O-CB 3.36Å; E30-K34 PolarHBondContact O-N 2.91Å |
| 31 | N | 80.8 | Confident | 81.7 | Confident | 81 Ų | 81 | 96.5 Ų | 96.5 | 43% | 0.433 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -63.2 | -44.1 | 175.7 | -77.5 | -29.7 | 0 | 0 | 0 | 111.3 | T27 S29 K34 Y35 | T27-N31 WeakPolarHBondContact O-CB 3.47Å; T27-N31 VanDerWaalsContact O-CG 3.24Å; T27-N31 PolarHBondContact O-N 2.81Å; T27-N31 PolarHBondContact O-ND2 3.19Å; T27-N31 VanDerWaalsContact O-ND2 3.13Å; S29-N31 VanDerWaalsContact C-N 3.34Å; S29-N31 PolarHBondContact O-N 3.2Å; N31-K34 PolarHBondContact O-N 3.31Å; N31-Y35 HydrophobicContact CB-CE2 4.48Å; N31-Y35 WeakPolarHBondContact O-CD2 3.29Å; N31-Y35 PolarHBondContact O-N 2.82Å |
| 32 | Y | 82.4 | Confident | 82.4 | Confident | 148 Ų | 148 | 95.6 Ų | 95.6 | 58% | 0.58 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -61.1 | -45.7 | 178.8 | -176.5 | -95.9 | 0 | 0 | 0 | 112.2 | T28 S29 K34 Y35 Q36 | T28-Y32 WeakPolarHBondContact O-CB 3.47Å; T28-Y32 PolarHBondContact O-N 3.5Å; S29-Y32 PolarHBondContact O-N 2.87Å; Y32-K34 PolarHBondContact O-N 2.89Å; Y32-Y35 PolarHBondContact O-N 2.98Å; Y32-Q36 HydrophobicContact CD1-CG 4.01Å; Y32-Q36 HydrophobicContact CE1-CG 3.65Å; Y32-Q36 VanDerWaalsContact CZ-NE2 3.29Å; Y32-Q36 WeakPolarHBondContact O-CG 3.35Å; Y32-Q36 PolarHBondContact O-N 3.11Å; Y32-Q36 PolarHBondContact OH-NE2 2.97Å |
| 33 | E | 82.9 | Confident | 83.4 | Confident | 102 Ų | 102 | 99.2 Ų | 99.2 | 48% | 0.477 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -60.8 | -44.2 | 175.7 | -73.5 | -174 | 175.4 | 0 | 0 | 111.9 | S29 E30 Y35 Q36 F37 | S29-E33 PolarHBondContact O-N 3.2Å; E30-E33 PolarHBondContact O-N 3.36Å; E33-Y35 VanDerWaalsContact C-N 3.34Å; E33-Y35 PolarHBondContact O-N 3.07Å; E33-Q36 PolarHBondContact O-N 3.34Å; E33-F37 HydrophobicContact CB-CE2 4.37Å; E33-F37 WeakPolarHBondContact O-CD2 3.44Å; E33-F37 VanDerWaalsContact O-CG 3.32Å; E33-F37 WeakPolarHBondContact O-CG 3.46Å; E33-F37 PolarHBondContact O-N 2.82Å |
| 34 | K | 82.1 | Confident | 84.3 | Confident | 149 Ų | 149 | 94.5 Ų | 94.5 | 65% | 0.648 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -60.2 | -42.7 | 175.8 | -171.9 | 173.4 | -176.3 | 170.4 | 0 | 112.2 | E30 N31 Y32 Y38 | E30-K34 WeakPolarHBondContact O-CB 3.36Å; E30-K34 PolarHBondContact O-N 2.91Å; N31-K34 PolarHBondContact O-N 3.31Å; Y32-K34 PolarHBondContact O-N 2.89Å; K34-Y38 WeakPolarHBondContact O-CB 3.08Å; K34-Y38 PolarHBondContact O-N 3.48Å |
| 35 | Y | 85.7 | Confident | 85.2 | Confident | 165 Ų | 165 | 86 Ų | 86 | 65% | 0.647 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -63.8 | -42.5 | 174.5 | -81.8 | -67.7 | 0 | 0 | 0 | 112.1 | N31 Y32 E33 Y38 M39 | N31-Y35 HydrophobicContact CB-CE2 4.48Å; N31-Y35 WeakPolarHBondContact O-CD2 3.29Å; N31-Y35 PolarHBondContact O-N 2.82Å; Y32-Y35 PolarHBondContact O-N 2.98Å; E33-Y35 VanDerWaalsContact C-N 3.34Å; E33-Y35 PolarHBondContact O-N 3.07Å; Y35-Y38 PolarHBondContact O-N 3.29Å; Y35-M39 VanDerWaalsContact O-CG 3.27Å; Y35-M39 WeakPolarHBondContact O-CG 3.13Å; Y35-M39 PolarHBondContact O-N 3.36Å |
| 36 | Q | 88.8 | Confident | 86.1 | Confident | 78 Ų | 78 | 83.2 Ų | 83.2 | 36% | 0.364 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -61 | -48.4 | 176.7 | -73.4 | -67.6 | -23.1 | 0 | 0 | 111.4 | Y32 E33 Y38 M39 I40 | Y32-Q36 HydrophobicContact CD1-CG 4.01Å; Y32-Q36 HydrophobicContact CE1-CG 3.65Å; Y32-Q36 VanDerWaalsContact CZ-NE2 3.29Å; Y32-Q36 WeakPolarHBondContact O-CG 3.35Å; Y32-Q36 PolarHBondContact O-N 3.11Å; Y32-Q36 PolarHBondContact OH-NE2 2.97Å; E33-Q36 PolarHBondContact O-N 3.34Å; Q36-Y38 VanDerWaalsContact C-N 3.33Å; Q36-Y38 PolarHBondContact O-N 3.22Å; Q36-M39 PolarHBondContact O-N 2.9Å; Q36-I40 VanDerWaalsContact O-CG1 3.28Å; Q36-I40 WeakPolarHBondContact O-CG1 3.43Å; Q36-I40 PolarHBondContact O-N 3.47Å |
| 37 | F | 89.4 | Confident | 87.3 | Confident | 85 Ų | 85 | 84 Ų | 84 | 37% | 0.373 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -61.5 | -41.4 | 177.4 | -63.1 | -24.9 | 0 | 0 | 0 | 112.3 | E33 I40 G41 L287 | E33-F37 HydrophobicContact CB-CE2 4.37Å; E33-F37 WeakPolarHBondContact O-CD2 3.44Å; E33-F37 VanDerWaalsContact O-CG 3.32Å; E33-F37 WeakPolarHBondContact O-CG 3.46Å; E33-F37 PolarHBondContact O-N 2.82Å; F37-I40 PolarHBondContact O-N 2.76Å; F37-G41 PolarHBondContact O-N 2.82Å; F37-L287 HydrophobicContact CB-CB 4.4Å; F37-L287 HydrophobicContact CD1-CB 4.28Å; F37-L287 HydrophobicContact CD1-CD2 3.88Å; F37-L287 HydrophobicContact CE1-CD2 4.32Å; F37-L287 HydrophobicContact CG-CB 4.32Å |
| 38 | Y | 89 | Confident | 88.3 | Confident | 82 Ų | 82 | 82 Ų | 82 | 32% | 0.322 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -60.7 | -45.5 | 174.8 | -179.9 | -91.3 | 0 | 0 | 0 | 112 | K34 Y35 Q36 G41 L42 L102 N103 | K34-Y38 WeakPolarHBondContact O-CB 3.08Å; K34-Y38 PolarHBondContact O-N 3.48Å; Y35-Y38 PolarHBondContact O-N 3.29Å; Q36-Y38 VanDerWaalsContact C-N 3.33Å; Q36-Y38 PolarHBondContact O-N 3.22Å; Y38-G41 PolarHBondContact O-N 3.46Å; Y38-L42 HydrophobicContact CE1-CD2 4.28Å; Y38-L42 WeakPolarHBondContact O-CB 3.49Å; Y38-L42 PolarHBondContact O-N 3.24Å; Y38-L102 HydrophobicContact CD2-CB 3.8Å; Y38-L102 HydrophobicContact CD2-CD1 4.19Å; Y38-L102 HydrophobicContact CE2-CB 3.69Å; Y38-L102 HydrophobicContact CE2-CD1 3.93Å; Y38-L102 HydrophobicContact CE2-CG 4.49Å; Y38-N103 WeakPolarHBondContact CE2-ND2 3.29Å |
| 39 | M | 91.3 | Very high | 89.2 | Confident | 112 Ų | 112 | 79.6 Ų | 79.6 | 55% | 0.552 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -66.3 | -40.7 | 179.9 | -70.9 | -60.6 | -67.7 | 0 | 0 | 112.3 | Y35 Q36 F43 | Y35-M39 VanDerWaalsContact O-CG 3.27Å; Y35-M39 WeakPolarHBondContact O-CG 3.13Å; Y35-M39 PolarHBondContact O-N 3.36Å; Q36-M39 PolarHBondContact O-N 2.9Å; M39-F43 WeakPolarHBondContact O-CB 3.15Å; M39-F43 PolarHBondContact O-N 2.92Å |
| 40 | I | 93.1 | Very high | 90.1 | Very high | 71 Ų | 71 | 82.4 Ų | 82.4 | 36% | 0.364 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -64.9 | -46.8 | 174.9 | -63.6 | 165.4 | 0 | 0 | 0 | 110 | Q36 F37 L42 F43 L44 L287 | Q36-I40 VanDerWaalsContact O-CG1 3.28Å; Q36-I40 WeakPolarHBondContact O-CG1 3.43Å; Q36-I40 PolarHBondContact O-N 3.47Å; F37-I40 PolarHBondContact O-N 2.76Å; I40-L42 PolarHBondContact O-N 3.23Å; I40-F43 WeakPolarHBondContact O-CB 3.5Å; I40-F43 PolarHBondContact O-N 3.07Å; I40-L44 HydrophobicContact CG2-CD1 4.17Å; I40-L44 HydrophobicContact CG2-CG 4.46Å; I40-L44 WeakPolarHBondContact O-CG 3.28Å; I40-L44 PolarHBondContact O-N 3.4Å; I40-L287 HydrophobicContact CB-CD1 4.11Å; I40-L287 HydrophobicContact CD1-CD2 4.41Å; I40-L287 HydrophobicContact CG2-CD1 3.75Å; I40-L287 HydrophobicContact CG2-CD2 4.35Å |
| 41 | G | 93.1 | Very high | 90.9 | Very high | 2 Ų | 2 | 80.8 Ų | 80.8 | 2% | 0.021 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -54.9 | -51.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | F37 Y38 F43 L44 S45 | F37-G41 PolarHBondContact O-N 2.82Å; Y38-G41 PolarHBondContact O-N 3.46Å; G41-F43 VanDerWaalsContact C-N 3.31Å; G41-F43 PolarHBondContact O-N 2.68Å; G41-L44 WeakPolarHBondContact O-CB 3.28Å; G41-L44 PolarHBondContact O-N 2.98Å; G41-S45 PolarHBondContact O-N 3.29Å; G41-S45 PolarHBondContact O-OG 2.98Å |
| 42 | L | 93.6 | Very high | 91.6 | Very high | 52 Ų | 52 | 78.8 Ų | 78.8 | 27% | 0.272 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -58.7 | -41 | 177.7 | -177 | 62.8 | 0 | 0 | 0 | 112.9 | Y38 I40 S45 C46 F100 L102 | Y38-L42 HydrophobicContact CE1-CD2 4.28Å; Y38-L42 WeakPolarHBondContact O-CB 3.49Å; Y38-L42 PolarHBondContact O-N 3.24Å; I40-L42 PolarHBondContact O-N 3.23Å; L42-S45 WeakPolarHBondContact O-CB 3.33Å; L42-S45 PolarHBondContact O-N 2.9Å; L42-C46 WeakPolarHBondContact O-CB 3.5Å; L42-C46 PolarHBondContact O-N 3.43Å; L42-C46 PolarHBondContact O-SG 2.99Å; L42-F100 HydrophobicContact CD1-CD1 4.19Å; L42-F100 HydrophobicContact CD1-CE1 4.13Å; L42-L102 HydrophobicContact CB-CD1 3.67Å; L42-L102 HydrophobicContact CD1-CD1 4.14Å |
| 43 | F | 94.9 | Very high | 92.2 | Very high | 138 Ų | 138 | 73.5 Ų | 73.5 | 61% | 0.605 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -61.7 | -44.9 | 175.2 | 175.5 | -99.2 | 0 | 0 | 0 | 111.7 | M39 I40 G41 C46 L47 | M39-F43 WeakPolarHBondContact O-CB 3.15Å; M39-F43 PolarHBondContact O-N 2.92Å; I40-F43 WeakPolarHBondContact O-CB 3.5Å; I40-F43 PolarHBondContact O-N 3.07Å; G41-F43 VanDerWaalsContact C-N 3.31Å; G41-F43 PolarHBondContact O-N 2.68Å; F43-C46 PolarHBondContact O-N 3.4Å; F43-L47 WeakPolarHBondContact O-CB 3.43Å; F43-L47 PolarHBondContact O-N 3.49Å |
| 44 | L | 95.3 | Very high | 92.8 | Very high | 43 Ų | 43 | 70.9 Ų | 70.9 | 23% | 0.225 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -65.4 | -41 | 176.5 | -65.8 | 174.7 | 0 | 0 | 0 | 112 | I40 G41 C46 L47 Y48 I291 L294 | I40-L44 HydrophobicContact CG2-CD1 4.17Å; I40-L44 HydrophobicContact CG2-CG 4.46Å; I40-L44 WeakPolarHBondContact O-CG 3.28Å; I40-L44 PolarHBondContact O-N 3.4Å; G41-L44 WeakPolarHBondContact O-CB 3.28Å; G41-L44 PolarHBondContact O-N 2.98Å; L44-C46 VanDerWaalsContact C-N 3.34Å; L44-C46 PolarHBondContact O-N 3.05Å; L44-L47 WeakPolarHBondContact O-CB 3.22Å; L44-L47 PolarHBondContact O-N 3.34Å; L44-Y48 WeakPolarHBondContact O-CB 3.43Å; L44-Y48 PolarHBondContact O-N 3.35Å; L44-I291 HydrophobicContact CD1-CD1 4.3Å; L44-I291 HydrophobicContact CD1-CG1 3.72Å; L44-L294 HydrophobicContact CB-CD1 3.63Å; L44-L294 HydrophobicContact CD1-CD1 4.46Å |
| 45 | S | 95.4 | Very high | 93.3 | Very high | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -57.6 | -46.1 | 173.7 | -58.3 | 0 | 0 | 0 | 0 | 112.1 | G41 L42 Y48 T49 V99 H290 | G41-S45 PolarHBondContact O-N 3.29Å; G41-S45 PolarHBondContact O-OG 2.98Å; L42-S45 WeakPolarHBondContact O-CB 3.33Å; L42-S45 PolarHBondContact O-N 2.9Å; S45-Y48 PolarHBondContact O-N 2.86Å; S45-T49 VanDerWaalsContact O-CB 3.3Å; S45-T49 WeakPolarHBondContact O-CB 3.48Å; S45-T49 PolarHBondContact O-N 2.72Å; S45-T49 PolarHBondContact O-OG1 3.26Å; S45-V99 VanDerWaalsContact CB-CG1 3.4Å; S45-V99 WeakPolarHBondContact CB-O 3.28Å; S45-V99 PolarHBondContact OG-O 2.91Å; S45-H290 PolarHBondContact OG-CE1 3.19Å; S45-H290 PolarHBondContact OG-NE2 2.91Å; S45-H290 VanDerWaalsContact OG-NE2 3.14Å |
| 46 | C | 95.4 | Very high | 93.8 | Very high | 49 Ų | 49 | 59 Ų | 59 | 33% | 0.331 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.9 | -43.5 | 175.4 | -74 | 0 | 0 | 0 | 0 | 111.4 | L42 F43 L44 T49 I50 | L42-C46 WeakPolarHBondContact O-CB 3.5Å; L42-C46 PolarHBondContact O-N 3.43Å; L42-C46 PolarHBondContact O-SG 2.99Å; F43-C46 PolarHBondContact O-N 3.4Å; L44-C46 VanDerWaalsContact C-N 3.34Å; L44-C46 PolarHBondContact O-N 3.05Å; C46-T49 PolarHBondContact O-N 3.23Å; C46-I50 WeakPolarHBondContact O-CB 3.18Å; C46-I50 VanDerWaalsContact O-CG1 3.25Å; C46-I50 WeakPolarHBondContact O-CG1 3.4Å; C46-I50 PolarHBondContact O-N 3.46Å |
| 47 | L | 95.6 | Very high | 94.1 | Very high | 82 Ų | 82 | 59.2 Ų | 59.2 | 43% | 0.429 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -61.1 | -47.3 | 177.8 | -172.7 | 70.1 | 0 | 0 | 0 | 111.7 | F43 L44 I50 L51 | F43-L47 WeakPolarHBondContact O-CB 3.43Å; F43-L47 PolarHBondContact O-N 3.49Å; L44-L47 WeakPolarHBondContact O-CB 3.22Å; L44-L47 PolarHBondContact O-N 3.34Å; L47-I50 PolarHBondContact O-N 2.78Å; L47-L51 HydrophobicContact CD1-CD1 3.39Å; L47-L51 HydrophobicContact CD1-CG 4.09Å; L47-L51 HydrophobicContact CG-CD1 3.96Å; L47-L51 VanDerWaalsContact O-CB 3.31Å; L47-L51 WeakPolarHBondContact O-CB 3.28Å; L47-L51 WeakPolarHBondContact O-CG 3.12Å; L47-L51 PolarHBondContact O-N 3.47Å |
| 48 | Y | 95.7 | Very high | 94.4 | Very high | 7 Ų | 7 | 60.5 Ų | 60.5 | 3% | 0.027 | 31% | 0.305 | C | S | . | . | I | π-helix | trans | -59.1 | -47.6 | 175.3 | 174.2 | -87.3 | 0 | 0 | 0 | 111.3 | L44 S45 I50 L52 F53 S95 V99 L294 F297 | L44-Y48 WeakPolarHBondContact O-CB 3.43Å; L44-Y48 PolarHBondContact O-N 3.35Å; S45-Y48 PolarHBondContact O-N 2.86Å; Y48-I50 PolarHBondContact O-N 2.83Å; Y48-L52 HydrophobicContact CD2-CB 3.94Å; Y48-L52 HydrophobicContact CD2-CD1 3.66Å; Y48-L52 HydrophobicContact CD2-CG 4.4Å; Y48-L52 HydrophobicContact CE2-CB 4.02Å; Y48-L52 HydrophobicContact CE2-CD1 4.07Å; Y48-L52 HydrophobicContact CG-CB 4.45Å; Y48-L52 WeakPolarHBondContact O-CA 3.28Å; Y48-L52 WeakPolarHBondContact O-CB 3.39Å; Y48-L52 PolarHBondContact O-N 3.28Å; Y48-F53 HydrophobicContact CE1-CB 4.43Å; Y48-F53 PolarHBondContact O-N 3.45Å; Y48-S95 PolarHBondContact OH-OG 3.33Å; Y48-V99 HydrophobicContact CD1-CB 4.45Å; Y48-V99 HydrophobicContact CD1-CG1 4.1Å; Y48-V99 HydrophobicContact CD1-CG2 3.87Å; Y48-V99 HydrophobicContact CE1-CG2 3.93Å; Y48-V99 HydrophobicContact CG-CG2 4.48Å; Y48-L294 HydrophobicContact CD1-CD2 4.33Å; Y48-L294 HydrophobicContact CD2-CD2 3.91Å; Y48-L294 HydrophobicContact CG-CD2 3.72Å; Y48-F297 HydrophobicContact CE2-CB 3.86Å; Y48-F297 VanDerWaalsContact OH-CB 3.32Å; Y48-F297 WeakPolarHBondContact OH-CB 3.44Å |
| 49 | T | 95.3 | Very high | 94.6 | Very high | 32 Ų | 32 | 57.2 Ų | 57.2 | 20% | 0.196 | 30% | 0.297 | C | S | . | . | I | π-helix | trans | -67.3 | -35.4 | -177.1 | -57.1 | 0 | 0 | 0 | 0 | 112.6 | S45 C46 P54 L96 F100 | S45-T49 VanDerWaalsContact O-CB 3.3Å; S45-T49 WeakPolarHBondContact O-CB 3.48Å; S45-T49 PolarHBondContact O-N 2.72Å; S45-T49 PolarHBondContact O-OG1 3.26Å; C46-T49 PolarHBondContact O-N 3.23Å; T49-P54 WeakPolarHBondContact O-CD 3.28Å; T49-L96 HydrophobicContact CG2-CD2 3.9Å; T49-F100 HydrophobicContact CG2-CE2 4.29Å; T49-F100 HydrophobicContact CG2-CZ 4.46Å; T49-F100 WeakPolarHBondContact OG1-CE2 3.35Å |
| 50 | I | 95 | Very high | 94.8 | Very high | 123 Ų | 123 | 51.9 Ų | 51.9 | 63% | 0.631 | 27% | 0.271 | S | S | * | . | I | π-helix | trans | -80.3 | -38.8 | -179.7 | -67.9 | 167.6 | 0 | 0 | 0 | 111.3 | C46 L47 Y48 P54 | C46-I50 WeakPolarHBondContact O-CB 3.18Å; C46-I50 VanDerWaalsContact O-CG1 3.25Å; C46-I50 WeakPolarHBondContact O-CG1 3.4Å; C46-I50 PolarHBondContact O-N 3.46Å; L47-I50 PolarHBondContact O-N 2.78Å; Y48-I50 PolarHBondContact O-N 2.83Å; I50-P54 WeakPolarHBondContact O-CG 3.38Å |
| 51 | L | 94.3 | Very high | 94.9 | Very high | 95 Ų | 95 | 51.6 Ų | 51.6 | 50% | 0.497 | 27% | 0.269 | S | S | . | . | I | π-helix | trans | -97.4 | -52.6 | -172.6 | -60.2 | -176.6 | 0 | 0 | 0 | 113.4 | L47 I55 | L47-L51 HydrophobicContact CD1-CD1 3.39Å; L47-L51 HydrophobicContact CD1-CG 4.09Å; L47-L51 HydrophobicContact CG-CD1 3.96Å; L47-L51 VanDerWaalsContact O-CB 3.31Å; L47-L51 WeakPolarHBondContact O-CB 3.28Å; L47-L51 WeakPolarHBondContact O-CG 3.12Å; L47-L51 PolarHBondContact O-N 3.47Å; L51-I55 WeakPolarHBondContact O-CD1 3.41Å; L51-I55 VanDerWaalsContact O-CG1 3.22Å; L51-I55 WeakPolarHBondContact O-CG1 3.35Å |
| 52 | L | 94.9 | Very high | 94.9 | Very high | 39 Ų | 39 | 54.2 Ų | 54.2 | 20% | 0.204 | 28% | 0.282 | C | S | . | . | I | π-helix | trans | -88.4 | -42.8 | -169.1 | -68.6 | 177.5 | 0 | 0 | 0 | 112.5 | Y48 I55 G56 S298 C301 L302 | Y48-L52 HydrophobicContact CD2-CB 3.94Å; Y48-L52 HydrophobicContact CD2-CD1 3.66Å; Y48-L52 HydrophobicContact CD2-CG 4.4Å; Y48-L52 HydrophobicContact CE2-CB 4.02Å; Y48-L52 HydrophobicContact CE2-CD1 4.07Å; Y48-L52 HydrophobicContact CG-CB 4.45Å; Y48-L52 WeakPolarHBondContact O-CA 3.28Å; Y48-L52 WeakPolarHBondContact O-CB 3.39Å; Y48-L52 PolarHBondContact O-N 3.28Å; L52-I55 WeakPolarHBondContact O-CB 3.48Å; L52-I55 PolarHBondContact O-N 3.45Å; L52-G56 PolarHBondContact O-N 3.16Å; L52-S298 VanDerWaalsContact CD1-OG 3.26Å; L52-S298 WeakPolarHBondContact CD1-OG 3.43Å; L52-C301 HydrophobicContact CB-CB 3.94Å; L52-C301 HydrophobicContact CD2-CB 4.38Å; L52-C301 PolarHBondContact O-SG 3.02Å; L52-C301 VanDerWaalsContact O-SG 3.33Å; L52-L302 HydrophobicContact CD2-CD2 4.45Å |
| 53 | F | 94.9 | Very high | 94.8 | Very high | 38 Ų | 38 | 51.8 Ų | 51.8 | 17% | 0.167 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -54.7 | -46.6 | -178.9 | 172.7 | -91.1 | 0 | 0 | 0 | 113.2 | Y48 I55 G56 F57 V92 L96 | Y48-F53 HydrophobicContact CE1-CB 4.43Å; Y48-F53 PolarHBondContact O-N 3.45Å; F53-I55 VanDerWaalsContact C-N 3.3Å; F53-I55 PolarHBondContact O-N 2.9Å; F53-G56 PolarHBondContact O-N 3.01Å; F53-F57 HydrophobicContact CE1-CB 4.27Å; F53-F57 HydrophobicContact CE1-CG 4.48Å; F53-F57 HydrophobicContact CE2-CB 4.47Å; F53-F57 HydrophobicContact CE2-CD2 4.44Å; F53-F57 HydrophobicContact CZ-CB 4.14Å; F53-F57 HydrophobicContact CZ-CD2 4.1Å; F53-F57 HydrophobicContact CZ-CG 4.11Å; F53-F57 VanDerWaalsContact O-CB 3.28Å; F53-F57 WeakPolarHBondContact O-CB 3.27Å; F53-F57 PolarHBondContact O-N 3.37Å; F53-V92 HydrophobicContact CD2-CG1 3.55Å; F53-V92 HydrophobicContact CE2-CG1 3.64Å; F53-V92 WeakPolarHBondContact CE2-O 3.21Å; F53-V92 HydrophobicContact CG-CG1 4.45Å; F53-L96 HydrophobicContact CD1-CD2 4.34Å; F53-L96 HydrophobicContact CD2-CD1 4.1Å; F53-L96 HydrophobicContact CD2-CD2 3.57Å; F53-L96 HydrophobicContact CD2-CG 3.64Å; F53-L96 HydrophobicContact CE1-CD1 4.19Å; F53-L96 HydrophobicContact CE2-CD1 3.42Å; F53-L96 VanDerWaalsContact CE2-CD1 3.42Å; F53-L96 HydrophobicContact CE2-CD2 3.81Å; F53-L96 HydrophobicContact CE2-CG 3.4Å; F53-L96 VanDerWaalsContact CE2-CG 3.4Å; F53-L96 HydrophobicContact CG-CD2 3.88Å; F53-L96 HydrophobicContact CG-CG 4.4Å; F53-L96 HydrophobicContact CZ-CD1 3.49Å; F53-L96 VanDerWaalsContact CZ-CD1 3.49Å; F53-L96 HydrophobicContact CZ-CD2 4.31Å; F53-L96 HydrophobicContact CZ-CG 4Å |
| 54 | P | 94.9 | Very high | 94.8 | Very high | 47 Ų | 47 | 46.7 Ų | 46.7 | 31% | 0.305 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -64.8 | -35.6 | 178 | -22.4 | 35.2 | 0 | 0 | 0 | 112.4 | T49 I50 I58 | T49-P54 WeakPolarHBondContact O-CD 3.28Å; I50-P54 WeakPolarHBondContact O-CG 3.38Å; P54-I58 HydrophobicContact CB-CD1 4.29Å; P54-I58 WeakPolarHBondContact O-CB 3.49Å; P54-I58 VanDerWaalsContact O-CG1 3.31Å; P54-I58 WeakPolarHBondContact O-CG1 3.47Å; P54-I58 PolarHBondContact O-N 3.39Å |
| 55 | I | 94.4 | Very high | 94.6 | Very high | 65 Ų | 65 | 47.3 Ų | 47.3 | 33% | 0.333 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -64.4 | -48.1 | 176.8 | -62.8 | 173.1 | 0 | 0 | 0 | 109.9 | L51 L52 F53 G59 C301 I305 | L51-I55 WeakPolarHBondContact O-CD1 3.41Å; L51-I55 VanDerWaalsContact O-CG1 3.22Å; L51-I55 WeakPolarHBondContact O-CG1 3.35Å; L52-I55 WeakPolarHBondContact O-CB 3.48Å; L52-I55 PolarHBondContact O-N 3.45Å; F53-I55 VanDerWaalsContact C-N 3.3Å; F53-I55 PolarHBondContact O-N 2.9Å; I55-G59 WeakPolarHBondContact O-CA 3.44Å; I55-G59 PolarHBondContact O-N 3.46Å; I55-C301 VanDerWaalsContact CG2-O 3.25Å; I55-C301 WeakPolarHBondContact CG2-O 3.35Å; I55-I305 HydrophobicContact CD1-CD1 4.2Å; I55-I305 HydrophobicContact CG2-CD1 3.88Å; I55-I305 HydrophobicContact CG2-CG1 3.6Å |
| 56 | G | 95.1 | Very high | 94.3 | Very high | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62.9 | -49.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | L52 F53 N60 | L52-G56 PolarHBondContact O-N 3.16Å; F53-G56 PolarHBondContact O-N 3.01Å; G56-N60 VanDerWaalsContact O-CB 3.25Å; G56-N60 WeakPolarHBondContact O-CB 3.22Å; G56-N60 PolarHBondContact O-N 3.29Å; G56-N60 PolarHBondContact O-ND2 3.26Å |
| 57 | F | 95.4 | Very high | 94 | Very high | 82 Ų | 82 | 45 Ų | 45 | 36% | 0.36 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -69.2 | -56.3 | -174.2 | -166.3 | -101.5 | 0 | 0 | 0 | 111.7 | F53 G59 I61 L89 V92 | F53-F57 HydrophobicContact CE1-CB 4.27Å; F53-F57 HydrophobicContact CE1-CG 4.48Å; F53-F57 HydrophobicContact CE2-CB 4.47Å; F53-F57 HydrophobicContact CE2-CD2 4.44Å; F53-F57 HydrophobicContact CZ-CB 4.14Å; F53-F57 HydrophobicContact CZ-CD2 4.1Å; F53-F57 HydrophobicContact CZ-CG 4.11Å; F53-F57 VanDerWaalsContact O-CB 3.28Å; F53-F57 WeakPolarHBondContact O-CB 3.27Å; F53-F57 PolarHBondContact O-N 3.37Å; F57-G59 PolarHBondContact O-N 2.93Å; F57-I61 HydrophobicContact CD1-CD1 3.77Å; F57-I61 HydrophobicContact CE1-CD1 3.49Å; F57-I61 VanDerWaalsContact CE1-CD1 3.49Å; F57-I61 HydrophobicContact CE2-CD1 4.49Å; F57-I61 HydrophobicContact CG-CD1 4.39Å; F57-I61 HydrophobicContact CZ-CD1 3.89Å; F57-I61 WeakPolarHBondContact O-CD1 3.4Å; F57-I61 VanDerWaalsContact O-CG1 3.29Å; F57-I61 WeakPolarHBondContact O-CG1 3.38Å; F57-I61 PolarHBondContact O-N 3.45Å; F57-I61 VanDerWaalsContact O-N 3.15Å; F57-L89 HydrophobicContact CD2-CD2 4.08Å; F57-L89 HydrophobicContact CE2-CD2 4.43Å; F57-L89 WeakPolarHBondContact O-CD2 3.42Å; F57-V92 HydrophobicContact CB-CG1 4.01Å; F57-V92 HydrophobicContact CD2-CG1 4.36Å |
| 58 | I | 94.8 | Very high | 93.7 | Very high | 111 Ų | 111 | 45.7 Ų | 45.7 | 57% | 0.569 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -68 | -41 | -178.6 | -58.6 | 171.1 | 0 | 0 | 0 | 110.2 | P54 I61 L62 | P54-I58 HydrophobicContact CB-CD1 4.29Å; P54-I58 WeakPolarHBondContact O-CB 3.49Å; P54-I58 VanDerWaalsContact O-CG1 3.31Å; P54-I58 WeakPolarHBondContact O-CG1 3.47Å; P54-I58 PolarHBondContact O-N 3.39Å; I58-I61 PolarHBondContact O-N 2.76Å; I58-L62 VanDerWaalsContact O-CB 3.3Å; I58-L62 WeakPolarHBondContact O-CB 3.46Å; I58-L62 PolarHBondContact O-N 3.3Å |
| 59 | G | 94 | Very high | 93.4 | Very high | 14 Ų | 14 | 49.1 Ų | 49.1 | 14% | 0.144 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.8 | -46.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | I55 F57 L62 I63 | I55-G59 WeakPolarHBondContact O-CA 3.44Å; I55-G59 PolarHBondContact O-N 3.46Å; F57-G59 PolarHBondContact O-N 2.93Å; G59-L62 WeakPolarHBondContact O-CB 3.48Å; G59-L62 PolarHBondContact O-N 3.33Å; G59-I63 WeakPolarHBondContact O-CG1 3.29Å; G59-I63 PolarHBondContact O-N 2.98Å |
| 60 | N | 95.6 | Very high | 92.8 | Very high | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -69.5 | -37.5 | 177.9 | -71.6 | -59.8 | 0 | 0 | 0 | 112.2 | G56 L62 I63 L64 A85 L89 S300 P304 | G56-N60 VanDerWaalsContact O-CB 3.25Å; G56-N60 WeakPolarHBondContact O-CB 3.22Å; G56-N60 PolarHBondContact O-N 3.29Å; G56-N60 PolarHBondContact O-ND2 3.26Å; N60-L62 VanDerWaalsContact C-N 3.3Å; N60-L62 PolarHBondContact O-N 3.01Å; N60-I63 PolarHBondContact O-N 3.49Å; N60-L64 WeakPolarHBondContact O-CG 3.34Å; N60-L64 PolarHBondContact O-N 3.45Å; N60-L64 VanDerWaalsContact O-N 3.11Å; N60-A85 HydrophobicContact CB-CB 4.1Å; N60-L89 HydrophobicContact CB-CD1 4.24Å; N60-L89 HydrophobicContact CB-CD2 3.76Å; N60-L89 HydrophobicContact CB-CG 3.6Å; N60-S300 PolarHBondContact ND2-O 3.2Å; N60-P304 HydrophobicContact CB-CG 4.5Å |
| 61 | I | 95.2 | Very high | 92.3 | Very high | 65 Ų | 65 | 51.2 Ų | 51.2 | 33% | 0.333 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -58.3 | -44.6 | 170.1 | -71.4 | 167.7 | 0 | 0 | 0 | 110.6 | F57 I58 I63 L64 V65 L89 | F57-I61 HydrophobicContact CD1-CD1 3.77Å; F57-I61 HydrophobicContact CE1-CD1 3.49Å; F57-I61 VanDerWaalsContact CE1-CD1 3.49Å; F57-I61 HydrophobicContact CE2-CD1 4.49Å; F57-I61 HydrophobicContact CG-CD1 4.39Å; F57-I61 HydrophobicContact CZ-CD1 3.89Å; F57-I61 WeakPolarHBondContact O-CD1 3.4Å; F57-I61 VanDerWaalsContact O-CG1 3.29Å; F57-I61 WeakPolarHBondContact O-CG1 3.38Å; F57-I61 PolarHBondContact O-N 3.45Å; F57-I61 VanDerWaalsContact O-N 3.15Å; I58-I61 PolarHBondContact O-N 2.76Å; I61-I63 VanDerWaalsContact C-N 3.31Å; I61-I63 PolarHBondContact O-N 2.56Å; I61-L64 WeakPolarHBondContact O-CB 3.49Å; I61-L64 PolarHBondContact O-N 2.89Å; I61-V65 HydrophobicContact CG2-CG2 4.1Å; I61-V65 WeakPolarHBondContact O-CG2 3.39Å; I61-V65 PolarHBondContact O-N 3.43Å; I61-L89 HydrophobicContact CD1-CD2 4.45Å; I61-L89 HydrophobicContact CG1-CD1 4.02Å; I61-L89 HydrophobicContact CG1-CD2 3.83Å |
| 62 | L | 92.9 | Very high | 91.8 | Very high | 56 Ų | 56 | 56.1 Ų | 56.1 | 29% | 0.293 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -62.3 | -39.7 | 180 | -175.1 | 65.2 | 0 | 0 | 0 | 111.7 | I58 G59 N60 L64 V65 V66 F314 L318 | I58-L62 VanDerWaalsContact O-CB 3.3Å; I58-L62 WeakPolarHBondContact O-CB 3.46Å; I58-L62 PolarHBondContact O-N 3.3Å; G59-L62 WeakPolarHBondContact O-CB 3.48Å; G59-L62 PolarHBondContact O-N 3.33Å; N60-L62 VanDerWaalsContact C-N 3.3Å; N60-L62 PolarHBondContact O-N 3.01Å; L62-L64 VanDerWaalsContact C-N 3.33Å; L62-L64 PolarHBondContact O-N 3.46Å; L62-V65 PolarHBondContact O-N 3.33Å; L62-V66 HydrophobicContact CD1-CG2 3.79Å; L62-V66 HydrophobicContact CG-CG2 4.1Å; L62-V66 VanDerWaalsContact O-CB 3.3Å; L62-V66 WeakPolarHBondContact O-CB 3.25Å; L62-V66 VanDerWaalsContact O-CG2 3.23Å; L62-V66 WeakPolarHBondContact O-CG2 3.07Å; L62-V66 PolarHBondContact O-N 3.13Å; L62-F314 HydrophobicContact CD2-CZ 4.4Å; L62-F314 HydrophobicContact CG-CZ 4.31Å; L62-L318 HydrophobicContact CD1-CD1 3.91Å; L62-L318 HydrophobicContact CD2-CD1 3.89Å; L62-L318 HydrophobicContact CD2-CD2 4.45Å; L62-L318 HydrophobicContact CG-CD1 4.15Å |
| 63 | I | 92.2 | Very high | 91.2 | Very high | 2 Ų | 2 | 61 Ų | 61 | 1% | 0.01 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -59.3 | -45.8 | 174.6 | -69.4 | 160.2 | 0 | 0 | 0 | 111 | G59 N60 I61 N67 F81 A85 P304 Y307 F314 | G59-I63 WeakPolarHBondContact O-CG1 3.29Å; G59-I63 PolarHBondContact O-N 2.98Å; N60-I63 PolarHBondContact O-N 3.49Å; I61-I63 VanDerWaalsContact C-N 3.31Å; I61-I63 PolarHBondContact O-N 2.56Å; I63-N67 WeakPolarHBondContact O-CB 3.21Å; I63-N67 PolarHBondContact O-N 3.27Å; I63-N67 PolarHBondContact O-ND2 3.46Å; I63-F81 HydrophobicContact CG2-CB 4.38Å; I63-A85 HydrophobicContact CB-CB 4.11Å; I63-A85 HydrophobicContact CG2-CB 3.84Å; I63-P304 HydrophobicContact CD1-CB 4.09Å; I63-P304 HydrophobicContact CD1-CG 4.08Å; I63-Y307 HydrophobicContact CD1-CD2 3.55Å; I63-Y307 HydrophobicContact CD1-CE2 4.28Å; I63-Y307 HydrophobicContact CD1-CG 4.49Å; I63-F314 HydrophobicContact CB-CE2 4.49Å; I63-F314 HydrophobicContact CG1-CE2 4.02Å; I63-F314 HydrophobicContact CG1-CZ 4.04Å |
| 64 | L | 93.6 | Very high | 90.7 | Very high | 30 Ų | 30 | 60.5 Ų | 60.5 | 16% | 0.157 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.1 | -54.4 | 176.8 | -65.2 | -179.4 | 0 | 0 | 0 | 111 | N60 I61 L62 V66 N67 L68 V82 A85 V86 L89 | N60-L64 WeakPolarHBondContact O-CG 3.34Å; N60-L64 PolarHBondContact O-N 3.45Å; N60-L64 VanDerWaalsContact O-N 3.11Å; I61-L64 WeakPolarHBondContact O-CB 3.49Å; I61-L64 PolarHBondContact O-N 2.89Å; L62-L64 VanDerWaalsContact C-N 3.33Å; L62-L64 PolarHBondContact O-N 3.46Å; L64-V66 PolarHBondContact O-N 3.39Å; L64-N67 PolarHBondContact O-N 3.04Å; L64-L68 HydrophobicContact CB-CD1 4.35Å; L64-L68 VanDerWaalsContact O-CB 3.22Å; L64-L68 WeakPolarHBondContact O-CB 3.47Å; L64-L68 WeakPolarHBondContact O-CG 3.47Å; L64-L68 PolarHBondContact O-N 3.34Å; L64-V82 HydrophobicContact CD2-CB 4.27Å; L64-V82 HydrophobicContact CD2-CG1 3.75Å; L64-V82 HydrophobicContact CD2-CG2 4.4Å; L64-V82 WeakPolarHBondContact CD2-O 3.38Å; L64-A85 HydrophobicContact CD2-CB 3.95Å; L64-A85 HydrophobicContact CG-CB 4.09Å; L64-V86 HydrophobicContact CD1-CG2 4.27Å; L64-V86 HydrophobicContact CD2-CG2 3.84Å; L64-L89 HydrophobicContact CD1-CD1 3.48Å; L64-L89 VanDerWaalsContact CD1-CD1 3.48Å; L64-L89 HydrophobicContact CG-CD1 4.47Å |
| 65 | V | 92.4 | Very high | 90.3 | Very high | 57 Ų | 57 | 61 Ų | 61 | 35% | 0.345 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -58.2 | -52.1 | -176.7 | 171.7 | 0 | 0 | 0 | 0 | 111 | I61 L62 N67 L68 T69 F321 | I61-V65 HydrophobicContact CG2-CG2 4.1Å; I61-V65 WeakPolarHBondContact O-CG2 3.39Å; I61-V65 PolarHBondContact O-N 3.43Å; L62-V65 PolarHBondContact O-N 3.33Å; V65-N67 VanDerWaalsContact C-N 3.33Å; V65-N67 PolarHBondContact O-N 3.43Å; V65-L68 PolarHBondContact O-N 3.36Å; V65-T69 WeakPolarHBondContact O-CB 3.06Å; V65-T69 PolarHBondContact O-N 2.88Å; V65-T69 PolarHBondContact O-OG1 2.9Å; V65-F321 HydrophobicContact CG1-CE1 4.48Å; V65-F321 HydrophobicContact CG1-CE2 3.85Å; V65-F321 HydrophobicContact CG1-CZ 3.67Å |
| 66 | V | 89.3 | Confident | 90.1 | Very high | 0 Ų | 0 | 58.7 Ų | 58.7 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61.3 | -41.6 | -175.9 | 170.1 | 0 | 0 | 0 | 0 | 111.9 | L62 L64 H70 F314 K317 L318 F321 | L62-V66 HydrophobicContact CD1-CG2 3.79Å; L62-V66 HydrophobicContact CG-CG2 4.1Å; L62-V66 VanDerWaalsContact O-CB 3.3Å; L62-V66 WeakPolarHBondContact O-CB 3.25Å; L62-V66 VanDerWaalsContact O-CG2 3.23Å; L62-V66 WeakPolarHBondContact O-CG2 3.07Å; L62-V66 PolarHBondContact O-N 3.13Å; L64-V66 PolarHBondContact O-N 3.39Å; V66-H70 PolarHBondContact O-N 2.97Å; V66-H70 PolarHBondContact O-ND1 3.26Å; V66-F314 HydrophobicContact CB-CE2 3.93Å; V66-F314 HydrophobicContact CG1-CD2 4.16Å; V66-F314 HydrophobicContact CG1-CE2 3.96Å; V66-F314 HydrophobicContact CG2-CE2 4.28Å; V66-K317 HydrophobicContact CG1-CB 3.48Å; V66-K317 VanDerWaalsContact CG1-CB 3.48Å; V66-L318 HydrophobicContact CG2-CD1 3.91Å; V66-F321 HydrophobicContact CG2-CB 4.46Å; V66-F321 HydrophobicContact CG2-CD1 4.34Å; V66-F321 HydrophobicContact CG2-CG 4.33Å |
| 67 | N | 89.3 | Confident | 89.7 | Confident | 1 Ų | 1 | 60.8 Ų | 60.8 | 1% | 0.005 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -77.8 | -36.6 | -178.9 | -76.9 | -67.3 | 0 | 0 | 0 | 113 | I63 L64 V65 H70 R71 D78 V82 K317 | I63-N67 WeakPolarHBondContact O-CB 3.21Å; I63-N67 PolarHBondContact O-N 3.27Å; I63-N67 PolarHBondContact O-ND2 3.46Å; L64-N67 PolarHBondContact O-N 3.04Å; V65-N67 VanDerWaalsContact C-N 3.33Å; V65-N67 PolarHBondContact O-N 3.43Å; N67-H70 CarbonylContact O-C 3.42Å; N67-H70 VanDerWaalsContact O-C 3.31Å; N67-H70 PolarHBondContact O-N 3.13Å; N67-R71 PolarHBondContact O-N 2.7Å; N67-D78 WeakPolarHBondContact OD1-CB 3.09Å; N67-V82 HydrophobicContact CB-CG2 3.56Å; N67-K317 PolarHBondContact OD1-NZ 3.24Å |
| 68 | L | 89.6 | Confident | 89.3 | Confident | 96 Ų | 96 | 57.1 Ų | 57.1 | 50% | 0.503 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -73.6 | -34.3 | 178.3 | -66.6 | 175.1 | 0 | 0 | 0 | 112.1 | L64 V65 H70 R71 | L64-L68 HydrophobicContact CB-CD1 4.35Å; L64-L68 VanDerWaalsContact O-CB 3.22Å; L64-L68 WeakPolarHBondContact O-CB 3.47Å; L64-L68 WeakPolarHBondContact O-CG 3.47Å; L64-L68 PolarHBondContact O-N 3.34Å; V65-L68 PolarHBondContact O-N 3.36Å; L68-H70 VanDerWaalsContact C-N 3.26Å; L68-H70 PolarHBondContact O-N 2.99Å; L68-R71 PolarHBondContact O-N 2.72Å |
| 69 | T | 87.4 | Confident | 89.2 | Confident | 78 Ų | 78 | 52.8 Ų | 52.8 | 48% | 0.479 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -63.6 | -33.6 | 171.7 | -59.4 | 0 | 0 | 0 | 0 | 111.8 | V65 F321 | V65-T69 WeakPolarHBondContact O-CB 3.06Å; V65-T69 PolarHBondContact O-N 2.88Å; V65-T69 PolarHBondContact O-OG1 2.9Å; T69-F321 HydrophobicContact CG2-CD2 4.38Å |
| 70 | H | 84.1 | Confident | 89.2 | Confident | 27 Ų | 27 | 52.3 Ų | 52.3 | 13% | 0.125 | 26% | 0.259 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106.8 | 41 | 179 | -61.2 | 90.4 | 0 | 0 | 0 | 112.5 | V66 N67 L68 E72 K73 M74 | V66-H70 PolarHBondContact O-N 2.97Å; V66-H70 PolarHBondContact O-ND1 3.26Å; N67-H70 CarbonylContact O-C 3.42Å; N67-H70 VanDerWaalsContact O-C 3.31Å; N67-H70 PolarHBondContact O-N 3.13Å; L68-H70 VanDerWaalsContact C-N 3.26Å; L68-H70 PolarHBondContact O-N 2.99Å; H70-E72 VanDerWaalsContact C-N 3.26Å; H70-E72 PolarHBondContact O-N 2.95Å; H70-K73 CarbonylContact O-C 3.56Å; H70-K73 PolarHBondContact O-N 2.78Å; H70-M74 PolarHBondContact O-N 3.31Å |
| 71 | R | 84.3 | Confident | 88.9 | Confident | 173 Ų | 173 | 53 Ų | 53 | 65% | 0.653 | 26% | 0.262 | S | S | * | . | G | 310 helix | trans | -57 | -34.9 | -173.1 | -167.8 | 179.2 | -173.8 | -176.7 | 3.5 | 113.9 | N67 L68 K73 M74 | N67-R71 PolarHBondContact O-N 2.7Å; L68-R71 PolarHBondContact O-N 2.72Å; R71-K73 PolarHBondContact O-N 3.37Å; R71-M74 WeakPolarHBondContact O-CB 3.5Å; R71-M74 PolarHBondContact O-N 2.79Å |
| 72 | E | 83 | Confident | 88.8 | Confident | 197 Ų | 197 | 50.6 Ų | 50.6 | 92% | 0.921 | 25% | 0.251 | S | S | * | . | G | 310 helix | trans | -65.2 | -27.3 | 178.5 | -62.7 | -177.9 | 171.9 | 0 | 0 | 113 | H70 | H70-E72 VanDerWaalsContact C-N 3.26Å; H70-E72 PolarHBondContact O-N 2.95Å |
| 73 | K | 82.4 | Confident | 88.9 | Confident | 143 Ų | 143 | 49.1 Ų | 49.1 | 62% | 0.622 | 24% | 0.243 | S | C | * | . | G | 310 helix | trans | -102.6 | 21.2 | 178.7 | -58.4 | 179.8 | -175.6 | 175.1 | 0 | 111.6 | H70 R71 T75 K317 | H70-K73 CarbonylContact O-C 3.56Å; H70-K73 PolarHBondContact O-N 2.78Å; R71-K73 PolarHBondContact O-N 3.37Å; K73-T75 PolarHBondContact O-N 2.86Å; K73-K317 WeakPolarHBondContact O-CE 3.27Å; K73-K317 PolarHBondContact O-NZ 3.33Å |
| 74 | M | 84.8 | Confident | 89 | Confident | 27 Ų | 27 | 49 Ų | 49 | 13% | 0.133 | 24% | 0.243 | C | C | . | . | trans | -74.2 | 121.9 | -179.2 | -166.7 | -176.3 | -150.5 | 0 | 0 | 110.2 | H70 R71 D78 L79 V82 M154 | H70-M74 PolarHBondContact O-N 3.31Å; R71-M74 WeakPolarHBondContact O-CB 3.5Å; R71-M74 PolarHBondContact O-N 2.79Å; M74-D78 HydrophobicContact CE-CB 4.46Å; M74-D78 HydrophobicContact CG-CB 3.83Å; M74-L79 VanDerWaalsContact CE-CA 3.44Å; M74-L79 HydrophobicContact CE-CB 4.04Å; M74-L79 HydrophobicContact CE-CD1 3.92Å; M74-L79 HydrophobicContact SD-CB 4.27Å; M74-L79 HydrophobicContact SD-CD1 4.1Å; M74-V82 HydrophobicContact CE-CB 3.89Å; M74-V82 HydrophobicContact CE-CG1 4.4Å; M74-V82 HydrophobicContact CE-CG2 3.53Å; M74-M154 HydrophobicContact CB-CE 4.25Å; M74-M154 HydrophobicContact CG-CE 4.07Å; M74-M154 HydrophobicContact SD-CE 3.83Å | ||
| 75 | T | 87.3 | Confident | 89 | Confident | 56 Ų | 56 | 47.6 Ų | 47.6 | 34% | 0.344 | 24% | 0.235 | S | C | . | . | trans | -87.3 | 165.1 | 172.9 | 70.6 | 0 | 0 | 0 | 0 | 110.6 | K73 D78 L79 T313 | K73-T75 PolarHBondContact O-N 2.86Å; T75-D78 WeakPolarHBondContact CB-OD2 3.5Å; T75-D78 PolarHBondContact N-OD2 3.43Å; T75-D78 WeakPolarHBondContact O-CB 3.22Å; T75-D78 PolarHBondContact O-N 3.14Å; T75-D78 VanDerWaalsContact O-N 3.13Å; T75-D78 PolarHBondContact OG1-N 3.38Å; T75-D78 PolarHBondContact OG1-OD2 2.65Å; T75-L79 PolarHBondContact O-N 3.38Å; T75-L79 VanDerWaalsContact O-N 3.11Å; T75-T313 HydrophobicContact CG2-CG2 4.47Å | ||
| 76 | I | 88.8 | Confident | 89.2 | Confident | 17 Ų | 17 | 47.6 Ų | 47.6 | 9% | 0.087 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -57.8 | -46.3 | 177.3 | -69.5 | 170.7 | 0 | 0 | 0 | 112.2 | D78 L79 Y80 R152 M154 A157 | I76-D78 VanDerWaalsContact C-N 3.3Å; I76-D78 PolarHBondContact O-N 3.46Å; I76-L79 WeakPolarHBondContact O-CB 3.32Å; I76-L79 PolarHBondContact O-N 3.44Å; I76-L79 VanDerWaalsContact O-N 3.11Å; I76-Y80 HydrophobicContact CG2-CD2 4.18Å; I76-Y80 HydrophobicContact CG2-CE1 4.43Å; I76-Y80 HydrophobicContact CG2-CE2 3.4Å; I76-Y80 PolarHBondContact O-N 3.35Å; I76-R152 HydrophobicContact CD1-CG 3.52Å; I76-M154 HydrophobicContact CG1-SD 4.03Å; I76-A157 HydrophobicContact CB-CB 4.35Å; I76-A157 HydrophobicContact CD1-CB 4.39Å; I76-A157 HydrophobicContact CG1-CB 3.95Å; I76-A157 HydrophobicContact CG2-CB 3.75Å |
| 77 | P | 86.4 | Confident | 89.4 | Confident | 45 Ų | 45 | 47.7 Ų | 47.7 | 29% | 0.292 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -57.7 | -39.1 | 172.6 | -26.9 | 35.4 | 0 | 0 | 0 | 113.8 | L79 Y80 F81 | P77-L79 PolarHBondContact O-N 3.48Å; P77-Y80 PolarHBondContact O-N 2.98Å; P77-F81 HydrophobicContact CB-CE2 4.44Å; P77-F81 WeakPolarHBondContact O-CD2 3.37Å; P77-F81 WeakPolarHBondContact O-CG 3.3Å; P77-F81 PolarHBondContact O-N 2.93Å |
| 78 | D | 88.8 | Confident | 89.7 | Confident | 4 Ų | 4 | 47.7 Ų | 47.7 | 2% | 0.021 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.1 | -35 | 177.1 | -58.8 | -40.5 | 0 | 0 | 0 | 111.6 | N67 M74 T75 I76 F81 V82 K317 | N67-D78 WeakPolarHBondContact OD1-CB 3.09Å; M74-D78 HydrophobicContact CE-CB 4.46Å; M74-D78 HydrophobicContact CG-CB 3.83Å; T75-D78 WeakPolarHBondContact CB-OD2 3.5Å; T75-D78 PolarHBondContact N-OD2 3.43Å; T75-D78 WeakPolarHBondContact O-CB 3.22Å; T75-D78 PolarHBondContact O-N 3.14Å; T75-D78 VanDerWaalsContact O-N 3.13Å; T75-D78 PolarHBondContact OG1-N 3.38Å; T75-D78 PolarHBondContact OG1-OD2 2.65Å; I76-D78 VanDerWaalsContact C-N 3.3Å; I76-D78 PolarHBondContact O-N 3.46Å; D78-F81 PolarHBondContact O-N 3.33Å; D78-V82 WeakPolarHBondContact O-CG2 3.32Å; D78-V82 PolarHBondContact O-N 3.19Å; D78-K317 VanDerWaalsContact CG-NZ 3.33Å; D78-K317 IonicContact OD1-NZ 3.7Å; D78-K317 IonicContact OD2-NZ 3.52Å; D78-K317 PolarHBondContact OD2-NZ 2.99Å |
| 79 | L | 92.5 | Very high | 89.9 | Confident | 20 Ų | 20 | 44.4 Ų | 44.4 | 11% | 0.105 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -64.5 | -43.9 | 175.3 | -178.5 | 64.6 | 0 | 0 | 0 | 111.7 | M74 T75 I76 P77 F81 V82 N83 M154 A157 K158 | M74-L79 VanDerWaalsContact CE-CA 3.44Å; M74-L79 HydrophobicContact CE-CB 4.04Å; M74-L79 HydrophobicContact CE-CD1 3.92Å; M74-L79 HydrophobicContact SD-CB 4.27Å; M74-L79 HydrophobicContact SD-CD1 4.1Å; T75-L79 PolarHBondContact O-N 3.38Å; T75-L79 VanDerWaalsContact O-N 3.11Å; I76-L79 WeakPolarHBondContact O-CB 3.32Å; I76-L79 PolarHBondContact O-N 3.44Å; I76-L79 VanDerWaalsContact O-N 3.11Å; P77-L79 PolarHBondContact O-N 3.48Å; L79-F81 VanDerWaalsContact C-N 3.34Å; L79-V82 PolarHBondContact O-N 3.24Å; L79-N83 PolarHBondContact O-N 3.11Å; L79-N83 VanDerWaalsContact O-N 3.15Å; L79-N83 PolarHBondContact O-ND2 2.96Å; L79-M154 HydrophobicContact CB-CE 4.2Å; L79-M154 HydrophobicContact CD2-CE 4.07Å; L79-M154 HydrophobicContact CD2-SD 4.15Å; L79-A157 HydrophobicContact CD2-CB 3.96Å; L79-K158 HydrophobicContact CD2-CB 4.46Å; L79-K158 HydrophobicContact CD2-CG 3.74Å |
| 80 | Y | 92.4 | Very high | 90.1 | Very high | 5 Ų | 5 | 44 Ų | 44 | 2% | 0.02 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -65.1 | -39.3 | 176.3 | -55.1 | -40.1 | 0 | 0 | 0 | 111.4 | I76 P77 N83 L84 F130 W133 M134 D137 A157 | I76-Y80 HydrophobicContact CG2-CD2 4.18Å; I76-Y80 HydrophobicContact CG2-CE1 4.43Å; I76-Y80 HydrophobicContact CG2-CE2 3.4Å; I76-Y80 PolarHBondContact O-N 3.35Å; P77-Y80 PolarHBondContact O-N 2.98Å; Y80-N83 PolarHBondContact O-N 3.11Å; Y80-L84 PolarHBondContact O-N 3.13Å; Y80-F130 HydrophobicContact CD1-CD1 4.46Å; Y80-W133 AromaticContact CE1-CD1 3.78Å; Y80-W133 AromaticContact CE1-NE1 3.94Å; Y80-W133 AromaticContact CZ-CD1 3.61Å; Y80-W133 AromaticContact CZ-NE1 3.6Å; Y80-W133 PolarHBondContact OH-NE1 3.2Å; Y80-M134 HydrophobicContact CD2-CG 3.75Å; Y80-M134 HydrophobicContact CG-CE 4.45Å; Y80-M134 HydrophobicContact CG-CG 4.1Å; Y80-D137 HydrophobicContact CE2-CB 4.21Å; Y80-D137 PolarHBondContact OH-OD1 2.88Å; Y80-A157 HydrophobicContact CE1-CB 4.18Å |
| 81 | F | 90.3 | Very high | 90.5 | Very high | 13 Ų | 13 | 42.7 Ų | 42.7 | 6% | 0.057 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -66.4 | -36.4 | 175.1 | -64.1 | -28 | 0 | 0 | 0 | 113.9 | I63 P77 D78 L79 N83 L84 A85 M134 M243 Y307 | I63-F81 HydrophobicContact CG2-CB 4.38Å; P77-F81 HydrophobicContact CB-CE2 4.44Å; P77-F81 WeakPolarHBondContact O-CD2 3.37Å; P77-F81 WeakPolarHBondContact O-CG 3.3Å; P77-F81 PolarHBondContact O-N 2.93Å; D78-F81 PolarHBondContact O-N 3.33Å; L79-F81 VanDerWaalsContact C-N 3.34Å; F81-N83 VanDerWaalsContact C-N 3.34Å; F81-L84 PolarHBondContact O-N 2.87Å; F81-A85 VanDerWaalsContact O-CB 3.28Å; F81-A85 WeakPolarHBondContact O-CB 3.21Å; F81-A85 PolarHBondContact O-N 2.87Å; F81-M134 HydrophobicContact CD1-CE 3.63Å; F81-M134 HydrophobicContact CD1-SD 4.3Å; F81-M134 HydrophobicContact CE1-CE 3.77Å; F81-M134 HydrophobicContact CE1-SD 3.81Å; F81-M243 HydrophobicContact CE2-CE 3.75Å; F81-M243 HydrophobicContact CE2-SD 4.01Å; F81-M243 HydrophobicContact CZ-CE 3.39Å; F81-M243 HydrophobicContact CZ-SD 3.8Å; F81-Y307 HydrophobicContact CD1-CD1 4.15Å; F81-Y307 AromaticContact CD1-CE1 3.48Å; F81-Y307 HydrophobicContact CD1-CE1 3.48Å; F81-Y307 VanDerWaalsContact CD1-CE1 3.48Å; F81-Y307 HydrophobicContact CD1-CE2 4.1Å; F81-Y307 AromaticContact CD1-CZ 3.45Å; F81-Y307 VanDerWaalsContact CD1-CZ 3.45Å; F81-Y307 HydrophobicContact CD2-CD1 4.34Å; F81-Y307 HydrophobicContact CD2-CE1 4.45Å; F81-Y307 AromaticContact CE1-CD1 3.85Å; F81-Y307 HydrophobicContact CE1-CD1 3.85Å; F81-Y307 AromaticContact CE1-CE1 3.12Å; F81-Y307 HydrophobicContact CE1-CE1 3.12Å; F81-Y307 AromaticContact CE1-CZ 3.55Å; F81-Y307 HydrophobicContact CE2-CD1 4.01Å; F81-Y307 HydrophobicContact CE2-CE1 4.14Å; F81-Y307 HydrophobicContact CG-CD1 4.4Å; F81-Y307 HydrophobicContact CG-CE1 4.16Å; F81-Y307 HydrophobicContact CG-CE2 4.46Å; F81-Y307 AromaticContact CZ-CD1 3.75Å; F81-Y307 HydrophobicContact CZ-CD1 3.75Å; F81-Y307 AromaticContact CZ-CE1 3.48Å; F81-Y307 HydrophobicContact CZ-CE1 3.48Å; F81-Y307 VanDerWaalsContact CZ-CE1 3.48Å |
| 82 | V | 93.4 | Very high | 91 | Very high | 15 Ų | 15 | 34.5 Ų | 34.5 | 9% | 0.091 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62.2 | -44.2 | 173.4 | 161.5 | 0 | 0 | 0 | 0 | 110.8 | L64 N67 M74 D78 L79 A85 V86 | L64-V82 HydrophobicContact CD2-CB 4.27Å; L64-V82 HydrophobicContact CD2-CG1 3.75Å; L64-V82 HydrophobicContact CD2-CG2 4.4Å; L64-V82 WeakPolarHBondContact CD2-O 3.38Å; N67-V82 HydrophobicContact CB-CG2 3.56Å; M74-V82 HydrophobicContact CE-CB 3.89Å; M74-V82 HydrophobicContact CE-CG1 4.4Å; M74-V82 HydrophobicContact CE-CG2 3.53Å; D78-V82 WeakPolarHBondContact O-CG2 3.32Å; D78-V82 PolarHBondContact O-N 3.19Å; L79-V82 PolarHBondContact O-N 3.24Å; V82-A85 PolarHBondContact O-N 3.34Å; V82-V86 WeakPolarHBondContact O-CG2 3.36Å; V82-V86 PolarHBondContact O-N 3.3Å |
| 83 | N | 95.3 | Very high | 91.4 | Very high | 26 Ų | 26 | 27.4 Ų | 27.4 | 14% | 0.139 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -66.4 | -39.8 | 177.7 | -75.5 | -89.5 | 0 | 0 | 0 | 112.3 | L79 Y80 F81 V86 A87 F130 C161 W165 | L79-N83 PolarHBondContact O-N 3.11Å; L79-N83 VanDerWaalsContact O-N 3.15Å; L79-N83 PolarHBondContact O-ND2 2.96Å; Y80-N83 PolarHBondContact O-N 3.11Å; F81-N83 VanDerWaalsContact C-N 3.34Å; N83-V86 WeakPolarHBondContact O-CB 3.38Å; N83-V86 PolarHBondContact O-N 3.28Å; N83-A87 PolarHBondContact O-N 3.47Å; N83-A87 VanDerWaalsContact O-N 3.09Å; N83-F130 HydrophobicContact CB-CD2 4.44Å; N83-F130 HydrophobicContact CB-CE1 3.75Å; N83-F130 HydrophobicContact CB-CE2 3.7Å; N83-F130 HydrophobicContact CB-CZ 3.31Å; N83-C161 PolarHBondContact ND2-SG 3.32Å; N83-W165 PolarHBondContact OD1-NE1 3.36Å |
| 84 | L | 93.2 | Very high | 91.8 | Very high | 0 Ų | 0 | 21.2 Ų | 21.2 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -64.4 | -42.2 | 175.7 | -162.6 | 75.3 | 0 | 0 | 0 | 111.6 | Y80 F81 V86 A87 D88 F130 Y307 | Y80-L84 PolarHBondContact O-N 3.13Å; F81-L84 PolarHBondContact O-N 2.87Å; L84-V86 VanDerWaalsContact C-N 3.27Å; L84-V86 PolarHBondContact O-N 2.86Å; L84-A87 PolarHBondContact O-N 2.66Å; L84-A87 VanDerWaalsContact O-N 3.13Å; L84-D88 WeakPolarHBondContact O-CB 3.24Å; L84-D88 VanDerWaalsContact O-CG 3.28Å; L84-D88 PolarHBondContact O-N 3.26Å; L84-F130 HydrophobicContact CD1-CB 4.16Å; L84-Y307 HydrophobicContact CD2-CE2 4.36Å; L84-Y307 WeakPolarHBondContact CD2-OH 3.37Å |
| 85 | A | 95 | Very high | 92.1 | Very high | 0 Ų | 0 | 19.9 Ų | 19.9 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -62.7 | -33.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | N60 I63 L64 F81 V82 L89 | N60-A85 HydrophobicContact CB-CB 4.1Å; I63-A85 HydrophobicContact CB-CB 4.11Å; I63-A85 HydrophobicContact CG2-CB 3.84Å; L64-A85 HydrophobicContact CD2-CB 3.95Å; L64-A85 HydrophobicContact CG-CB 4.09Å; F81-A85 VanDerWaalsContact O-CB 3.28Å; F81-A85 WeakPolarHBondContact O-CB 3.21Å; F81-A85 PolarHBondContact O-N 2.87Å; V82-A85 PolarHBondContact O-N 3.34Å; A85-L89 WeakPolarHBondContact O-CB 3.36Å; A85-L89 VanDerWaalsContact O-CG 3.28Å; A85-L89 WeakPolarHBondContact O-CG 3.44Å; A85-L89 PolarHBondContact O-N 3.42Å |
| 86 | V | 95.3 | Very high | 92.2 | Very high | 57 Ų | 57 | 20 Ų | 20 | 35% | 0.345 | 12% | 0.116 | S | C | . | . | H | α-helix | trans | -64.4 | -49.1 | 171.3 | 170.6 | 0 | 0 | 0 | 0 | 110.7 | L64 V82 N83 L84 L89 I90 W165 | L64-V86 HydrophobicContact CD1-CG2 4.27Å; L64-V86 HydrophobicContact CD2-CG2 3.84Å; V82-V86 WeakPolarHBondContact O-CG2 3.36Å; V82-V86 PolarHBondContact O-N 3.3Å; N83-V86 WeakPolarHBondContact O-CB 3.38Å; N83-V86 PolarHBondContact O-N 3.28Å; L84-V86 VanDerWaalsContact C-N 3.27Å; L84-V86 PolarHBondContact O-N 2.86Å; V86-L89 PolarHBondContact O-N 2.89Å; V86-I90 HydrophobicContact CG1-CD1 4.41Å; V86-I90 WeakPolarHBondContact O-CG1 2.87Å; V86-I90 PolarHBondContact O-N 3.47Å; V86-W165 HydrophobicContact CB-CZ2 4.44Å; V86-W165 HydrophobicContact CG1-CH2 4.36Å; V86-W165 HydrophobicContact CG1-CZ2 4.16Å |
| 87 | A | 94.4 | Very high | 92.2 | Very high | 2 Ų | 2 | 23 Ų | 23 | 2% | 0.017 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -60.4 | -47.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | N83 L84 L89 I90 L91 N123 S126 W165 | N83-A87 PolarHBondContact O-N 3.47Å; N83-A87 VanDerWaalsContact O-N 3.09Å; L84-A87 PolarHBondContact O-N 2.66Å; L84-A87 VanDerWaalsContact O-N 3.13Å; A87-L89 PolarHBondContact O-N 2.64Å; A87-I90 PolarHBondContact O-N 3.01Å; A87-L91 PolarHBondContact O-N 3.41Å; A87-N123 PolarHBondContact O-ND2 3.49Å; A87-S126 WeakPolarHBondContact CB-OG 3.38Å; A87-W165 HydrophobicContact CB-CH2 3.83Å; A87-W165 HydrophobicContact CB-CZ2 4.36Å |
| 88 | D | 95.1 | Very high | 92.2 | Very high | 0 Ų | 0 | 21.8 Ų | 21.8 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -63.2 | -38.6 | -178 | -75.2 | -25.4 | 0 | 0 | 0 | 112.4 | L84 I90 L91 V92 N123 S300 N303 | L84-D88 WeakPolarHBondContact O-CB 3.24Å; L84-D88 VanDerWaalsContact O-CG 3.28Å; L84-D88 PolarHBondContact O-N 3.26Å; D88-I90 VanDerWaalsContact C-N 3.28Å; D88-I90 PolarHBondContact O-N 3.44Å; D88-L91 PolarHBondContact O-N 2.88Å; D88-V92 WeakPolarHBondContact O-CB 3.46Å; D88-V92 WeakPolarHBondContact O-CG2 3.4Å; D88-V92 PolarHBondContact O-N 2.91Å; D88-N123 PolarHBondContact N-ND2 3.32Å; D88-S300 VanDerWaalsContact OD1-CB 3.26Å; D88-S300 WeakPolarHBondContact OD1-CB 3.38Å; D88-S300 PolarHBondContact OD1-OG 3.08Å; D88-N303 PolarHBondContact OD2-ND2 2.99Å |
| 89 | L | 94.8 | Very high | 92.2 | Very high | 28 Ų | 28 | 21.6 Ų | 21.6 | 15% | 0.147 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -62.3 | -38.2 | 177 | -82 | 169.9 | 0 | 0 | 0 | 112.8 | F57 N60 I61 L64 A85 V86 A87 A93 | F57-L89 HydrophobicContact CD2-CD2 4.08Å; F57-L89 HydrophobicContact CE2-CD2 4.43Å; F57-L89 WeakPolarHBondContact O-CD2 3.42Å; N60-L89 HydrophobicContact CB-CD1 4.24Å; N60-L89 HydrophobicContact CB-CD2 3.76Å; N60-L89 HydrophobicContact CB-CG 3.6Å; I61-L89 HydrophobicContact CD1-CD2 4.45Å; I61-L89 HydrophobicContact CG1-CD1 4.02Å; I61-L89 HydrophobicContact CG1-CD2 3.83Å; L64-L89 HydrophobicContact CD1-CD1 3.48Å; L64-L89 VanDerWaalsContact CD1-CD1 3.48Å; L64-L89 HydrophobicContact CG-CD1 4.47Å; A85-L89 WeakPolarHBondContact O-CB 3.36Å; A85-L89 VanDerWaalsContact O-CG 3.28Å; A85-L89 WeakPolarHBondContact O-CG 3.44Å; A85-L89 PolarHBondContact O-N 3.42Å; V86-L89 PolarHBondContact O-N 2.89Å; A87-L89 PolarHBondContact O-N 2.64Å; L89-A93 WeakPolarHBondContact O-CB 3.45Å; L89-A93 PolarHBondContact O-N 2.87Å |
| 90 | I | 90.9 | Very high | 92.1 | Very high | 68 Ų | 68 | 25.1 Ų | 25.1 | 35% | 0.349 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -64.6 | -47.8 | 178.7 | -62 | 165.1 | 0 | 0 | 0 | 109.2 | V86 A87 D88 A93 D94 F119 | V86-I90 HydrophobicContact CG1-CD1 4.41Å; V86-I90 WeakPolarHBondContact O-CG1 2.87Å; V86-I90 PolarHBondContact O-N 3.47Å; A87-I90 PolarHBondContact O-N 3.01Å; D88-I90 VanDerWaalsContact C-N 3.28Å; D88-I90 PolarHBondContact O-N 3.44Å; I90-A93 PolarHBondContact O-N 3.32Å; I90-D94 WeakPolarHBondContact O-CB 3.43Å; I90-D94 PolarHBondContact O-N 3.07Å; I90-F119 HydrophobicContact CG2-CB 4.27Å; I90-F119 HydrophobicContact CG2-CD1 3.18Å; I90-F119 HydrophobicContact CG2-CE1 3.71Å; I90-F119 HydrophobicContact CG2-CG 3.95Å |
| 91 | L | 93 | Very high | 91.8 | Very high | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -66.6 | -39.6 | 177.8 | -179.1 | 60.8 | 0 | 0 | 0 | 112.9 | A87 D88 A93 D94 S95 L120 N123 W255 F297 | A87-L91 PolarHBondContact O-N 3.41Å; D88-L91 PolarHBondContact O-N 2.88Å; L91-A93 VanDerWaalsContact C-N 3.31Å; L91-A93 PolarHBondContact O-N 3.26Å; L91-D94 WeakPolarHBondContact O-CB 3.33Å; L91-D94 PolarHBondContact O-N 3.49Å; L91-S95 WeakPolarHBondContact O-CB 3.34Å; L91-S95 PolarHBondContact O-N 3.41Å; L91-L120 HydrophobicContact CD1-CD1 3.57Å; L91-L120 HydrophobicContact CD2-CD1 4.42Å; L91-N123 HydrophobicContact CB-CB 3.87Å; L91-N123 WeakPolarHBondContact CB-ND2 3.07Å; L91-N123 HydrophobicContact CD2-CB 4.16Å; L91-N123 VanDerWaalsContact CD2-CG 3.47Å; L91-N123 WeakPolarHBondContact CD2-OD1 3.38Å; L91-N123 HydrophobicContact CG-CB 4.44Å; L91-W255 HydrophobicContact CD2-CZ2 4.31Å; L91-F297 HydrophobicContact CD1-CD1 3.9Å; L91-F297 HydrophobicContact CD1-CE1 4.06Å; L91-F297 HydrophobicContact CD2-CD1 4.34Å; L91-F297 HydrophobicContact CG-CD1 4.28Å |
| 92 | V | 94.4 | Very high | 91.3 | Very high | 1 Ų | 1 | 27 Ų | 27 | 1% | 0.006 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -62.5 | -41.5 | 177.9 | 169.9 | 0 | 0 | 0 | 0 | 110.5 | F53 F57 D88 S95 | F53-V92 HydrophobicContact CD2-CG1 3.55Å; F53-V92 HydrophobicContact CE2-CG1 3.64Å; F53-V92 WeakPolarHBondContact CE2-O 3.21Å; F53-V92 HydrophobicContact CG-CG1 4.45Å; F57-V92 HydrophobicContact CB-CG1 4.01Å; F57-V92 HydrophobicContact CD2-CG1 4.36Å; D88-V92 WeakPolarHBondContact O-CB 3.46Å; D88-V92 WeakPolarHBondContact O-CG2 3.4Å; D88-V92 PolarHBondContact O-N 2.91Å; V92-S95 PolarHBondContact O-OG 3.43Å |
| 93 | A | 91.8 | Very high | 90.5 | Very high | 48 Ų | 48 | 30.4 Ų | 30.4 | 40% | 0.397 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -64.2 | -43.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | L89 I90 L91 | L89-A93 WeakPolarHBondContact O-CB 3.45Å; L89-A93 PolarHBondContact O-N 2.87Å; I90-A93 PolarHBondContact O-N 3.32Å; L91-A93 VanDerWaalsContact C-N 3.31Å; L91-A93 PolarHBondContact O-N 3.26Å |
| 94 | D | 89.4 | Confident | 89.4 | Confident | 13 Ų | 13 | 32.2 Ų | 32.2 | 7% | 0.07 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.4 | -40.7 | 178 | -161 | 61.5 | 0 | 0 | 0 | 112.4 | I90 L91 L96 I97 M116 | I90-D94 WeakPolarHBondContact O-CB 3.43Å; I90-D94 PolarHBondContact O-N 3.07Å; L91-D94 WeakPolarHBondContact O-CB 3.33Å; L91-D94 PolarHBondContact O-N 3.49Å; D94-L96 PolarHBondContact O-N 2.92Å; D94-I97 PolarHBondContact O-N 2.94Å; D94-M116 VanDerWaalsContact OD1-CE 3.27Å; D94-M116 WeakPolarHBondContact OD1-CE 3.42Å; D94-M116 WeakPolarHBondContact OD1-CG 3.14Å; D94-M116 VanDerWaalsContact OD1-SD 3.37Å; D94-M116 WeakPolarHBondContact OD2-CB 3.43Å |
| 95 | S | 91.1 | Very high | 88.3 | Confident | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -59.5 | -25.1 | -176.2 | 73 | 0 | 0 | 0 | 0 | 113.8 | Y48 L91 V92 I97 E98 V99 | Y48-S95 PolarHBondContact OH-OG 3.33Å; L91-S95 WeakPolarHBondContact O-CB 3.34Å; L91-S95 PolarHBondContact O-N 3.41Å; V92-S95 PolarHBondContact O-OG 3.43Å; S95-I97 VanDerWaalsContact C-N 3.25Å; S95-I97 PolarHBondContact O-N 3.46Å; S95-E98 PolarHBondContact O-N 3.29Å; S95-V99 WeakPolarHBondContact O-CB 3.23Å; S95-V99 WeakPolarHBondContact O-CG2 3.41Å; S95-V99 PolarHBondContact O-N 3.47Å |
| 96 | L | 89.9 | Confident | 87.1 | Confident | 57 Ų | 57 | 39.4 Ų | 39.4 | 30% | 0.298 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -62.3 | -34.9 | 176.9 | -76.4 | -178.9 | 0 | 0 | 0 | 112.5 | T49 F53 D94 F100 | T49-L96 HydrophobicContact CG2-CD2 3.9Å; F53-L96 HydrophobicContact CD1-CD2 4.34Å; F53-L96 HydrophobicContact CD2-CD1 4.1Å; F53-L96 HydrophobicContact CD2-CD2 3.57Å; F53-L96 HydrophobicContact CD2-CG 3.64Å; F53-L96 HydrophobicContact CE1-CD1 4.19Å; F53-L96 HydrophobicContact CE2-CD1 3.42Å; F53-L96 VanDerWaalsContact CE2-CD1 3.42Å; F53-L96 HydrophobicContact CE2-CD2 3.81Å; F53-L96 HydrophobicContact CE2-CG 3.4Å; F53-L96 VanDerWaalsContact CE2-CG 3.4Å; F53-L96 HydrophobicContact CG-CD2 3.88Å; F53-L96 HydrophobicContact CG-CG 4.4Å; F53-L96 HydrophobicContact CZ-CD1 3.49Å; F53-L96 VanDerWaalsContact CZ-CD1 3.49Å; F53-L96 HydrophobicContact CZ-CD2 4.31Å; F53-L96 HydrophobicContact CZ-CG 4Å; D94-L96 PolarHBondContact O-N 2.92Å; L96-F100 WeakPolarHBondContact O-CD2 3.39Å |
| 97 | I | 87.9 | Confident | 86 | Confident | 80 Ų | 80 | 39.8 Ų | 39.8 | 41% | 0.41 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -76.9 | -43.9 | -178.6 | -67.3 | 167.5 | 0 | 0 | 0 | 109.2 | D94 S95 N101 M116 | D94-I97 PolarHBondContact O-N 2.94Å; S95-I97 VanDerWaalsContact C-N 3.25Å; S95-I97 PolarHBondContact O-N 3.46Å; I97-N101 PolarHBondContact O-N 3.35Å; I97-M116 HydrophobicContact CB-CE 3.94Å; I97-M116 HydrophobicContact CD1-CE 3.18Å; I97-M116 HydrophobicContact CG1-CE 4.1Å; I97-M116 HydrophobicContact CG2-CE 4.04Å |
| 98 | E | 86.9 | Confident | 84.7 | Confident | 20 Ų | 20 | 44.4 Ų | 44.4 | 9% | 0.093 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -68.8 | -38.9 | -178.3 | -168 | 58.9 | -158.2 | 0 | 0 | 112.7 | S95 F100 N101 Y106 Y107 F297 | S95-E98 PolarHBondContact O-N 3.29Å; E98-F100 PolarHBondContact O-N 3.11Å; E98-N101 VanDerWaalsContact O-CB 3.3Å; E98-N101 WeakPolarHBondContact O-CB 3.26Å; E98-N101 PolarHBondContact O-N 2.92Å; E98-Y106 WeakPolarHBondContact OE2-CD1 3.17Å; E98-Y106 VanDerWaalsContact OE2-CE1 3.3Å; E98-Y106 WeakPolarHBondContact OE2-CE1 3.27Å; E98-Y107 PolarHBondContact OE1-OH 2.9Å; E98-F297 HydrophobicContact CB-CE2 4.06Å; E98-F297 HydrophobicContact CB-CZ 4Å; E98-F297 HydrophobicContact CG-CE2 3.82Å; E98-F297 HydrophobicContact CG-CZ 3.59Å |
| 99 | V | 90.1 | Very high | 84 | Confident | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.5 | -25.2 | -177.8 | 167 | 0 | 0 | 0 | 0 | 112.8 | S45 Y48 S95 H290 L294 F297 | S45-V99 VanDerWaalsContact CB-CG1 3.4Å; S45-V99 WeakPolarHBondContact CB-O 3.28Å; S45-V99 PolarHBondContact OG-O 2.91Å; Y48-V99 HydrophobicContact CD1-CB 4.45Å; Y48-V99 HydrophobicContact CD1-CG1 4.1Å; Y48-V99 HydrophobicContact CD1-CG2 3.87Å; Y48-V99 HydrophobicContact CE1-CG2 3.93Å; Y48-V99 HydrophobicContact CG-CG2 4.48Å; S95-V99 WeakPolarHBondContact O-CB 3.23Å; S95-V99 WeakPolarHBondContact O-CG2 3.41Å; S95-V99 PolarHBondContact O-N 3.47Å; V99-H290 PolarHBondContact O-CE1 3.44Å; V99-H290 VanDerWaalsContact O-CE1 3.31Å; V99-L294 HydrophobicContact CB-CD2 4.38Å; V99-L294 HydrophobicContact CG1-CD2 3.91Å; V99-L294 HydrophobicContact CG2-CD2 3.6Å; V99-F297 HydrophobicContact CG2-CD2 3.76Å; V99-F297 HydrophobicContact CG2-CE2 4.05Å |
| 100 | F | 89.3 | Confident | 83.2 | Confident | 95 Ų | 95 | 51.5 Ų | 51.5 | 42% | 0.417 | 25% | 0.253 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.5 | 3.6 | 174.2 | -70.8 | -72.8 | 0 | 0 | 0 | 113.8 | L42 T49 L96 E98 L102 | L42-F100 HydrophobicContact CD1-CD1 4.19Å; L42-F100 HydrophobicContact CD1-CE1 4.13Å; T49-F100 HydrophobicContact CG2-CE2 4.29Å; T49-F100 HydrophobicContact CG2-CZ 4.46Å; T49-F100 WeakPolarHBondContact OG1-CE2 3.35Å; L96-F100 WeakPolarHBondContact O-CD2 3.39Å; E98-F100 PolarHBondContact O-N 3.11Å; F100-L102 PolarHBondContact O-N 2.85Å |
| 101 | N | 85.3 | Confident | 82.7 | Confident | 21 Ų | 21 | 54.3 Ų | 54.3 | 11% | 0.112 | 27% | 0.274 | C | S | . | . | trans | -80.3 | 47.8 | 177.9 | -175.1 | 36.9 | 0 | 0 | 0 | 113.4 | I97 E98 N103 E104 K105 Y106 Y107 | I97-N101 PolarHBondContact O-N 3.35Å; E98-N101 VanDerWaalsContact O-CB 3.3Å; E98-N101 WeakPolarHBondContact O-CB 3.26Å; E98-N101 PolarHBondContact O-N 2.92Å; N101-N103 PolarHBondContact O-N 2.94Å; N101-E104 PolarHBondContact O-N 3.15Å; N101-E104 WeakPolarHBondContact OD1-CA 3.17Å; N101-E104 PolarHBondContact OD1-N 3.5Å; N101-K105 PolarHBondContact OD1-N 3.17Å; N101-Y106 HydrophobicContact CB-CD1 4.42Å; N101-Y106 WeakPolarHBondContact OD1-CB 3.1Å; N101-Y106 PolarHBondContact OD1-N 3.25Å; N101-Y107 WeakPolarHBondContact ND2-CD2 3.19Å; N101-Y107 WeakPolarHBondContact ND2-CE2 3.22Å | ||
| 102 | L | 81.5 | Confident | 82.3 | Confident | 36 Ų | 36 | 57.8 Ų | 57.8 | 19% | 0.188 | 29% | 0.292 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.8 | -19 | -173.9 | -61 | 173 | 0 | 0 | 0 | 114.4 | Y38 L42 F100 | Y38-L102 HydrophobicContact CD2-CB 3.8Å; Y38-L102 HydrophobicContact CD2-CD1 4.19Å; Y38-L102 HydrophobicContact CE2-CB 3.69Å; Y38-L102 HydrophobicContact CE2-CD1 3.93Å; Y38-L102 HydrophobicContact CE2-CG 4.49Å; L42-L102 HydrophobicContact CB-CD1 3.67Å; L42-L102 HydrophobicContact CD1-CD1 4.14Å; F100-L102 PolarHBondContact O-N 2.85Å |
| 103 | N | 75.6 | Confident | 81.8 | Confident | 86 Ų | 86 | 57.7 Ų | 57.7 | 46% | 0.46 | 29% | 0.291 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.3 | 7.1 | 180 | -68.1 | -45.2 | 0 | 0 | 0 | 112.4 | Y38 N101 K105 | Y38-N103 WeakPolarHBondContact CE2-ND2 3.29Å; N101-N103 PolarHBondContact O-N 2.94Å; N103-K105 HydrophobicContact CB-CD 4.44Å; N103-K105 HydrophobicContact CB-CG 4.04Å; N103-K105 PolarHBondContact O-N 2.86Å |
| 104 | E | 71.5 | Confident | 81.4 | Confident | 65 Ų | 65 | 56.5 Ų | 56.5 | 30% | 0.304 | 28% | 0.279 | S | S | . | . | trans | 57.3 | 4.7 | -178.9 | -62.6 | -178.5 | -173.1 | 0 | 0 | 115.8 | N101 Y106 Y107 | N101-E104 PolarHBondContact O-N 3.15Å; N101-E104 WeakPolarHBondContact OD1-CA 3.17Å; N101-E104 PolarHBondContact OD1-N 3.5Å; E104-Y106 PolarHBondContact O-N 2.89Å; E104-Y107 HydrophobicContact CB-CD2 3.9Å; E104-Y107 HydrophobicContact CB-CE2 4.45Å; E104-Y107 HydrophobicContact CG-CD2 4.27Å; E104-Y107 HydrophobicContact CG-CE2 4.35Å; E104-Y107 WeakPolarHBondContact O-CB 3.4Å; E104-Y107 WeakPolarHBondContact O-CD2 3.3Å; E104-Y107 PolarHBondContact O-N 3.44Å | ||
| 105 | K | 70.1 | Confident | 81.1 | Confident | 135 Ų | 135 | 61.1 Ų | 61.1 | 59% | 0.587 | 30% | 0.299 | S | S | * | . | G | 310 helix | trans | -58 | -22 | -179.1 | -67 | -172.6 | 178.6 | -175.7 | 0 | 113.9 | N101 N103 Y107 D108 Y109 | N101-K105 PolarHBondContact OD1-N 3.17Å; N103-K105 HydrophobicContact CB-CD 4.44Å; N103-K105 HydrophobicContact CB-CG 4.04Å; N103-K105 PolarHBondContact O-N 2.86Å; K105-Y107 VanDerWaalsContact C-N 3.3Å; K105-D108 WeakPolarHBondContact O-CB 3.29Å; K105-D108 PolarHBondContact O-N 3.32Å; K105-Y109 VanDerWaalsContact O-CD2 3.31Å; K105-Y109 WeakPolarHBondContact O-CD2 3.42Å; K105-Y109 WeakPolarHBondContact O-CE2 3.42Å |
| 106 | Y | 71.4 | Confident | 80.9 | Confident | 16 Ų | 16 | 61.7 Ų | 61.7 | 6% | 0.063 | 30% | 0.301 | C | S | . | . | G | 310 helix | trans | -65.8 | -33.7 | 176 | 166.3 | -130.8 | 0 | 0 | 0 | 112.3 | E98 N101 E104 D108 Y109 L112 C113 M116 | E98-Y106 WeakPolarHBondContact OE2-CD1 3.17Å; E98-Y106 VanDerWaalsContact OE2-CE1 3.3Å; E98-Y106 WeakPolarHBondContact OE2-CE1 3.27Å; N101-Y106 HydrophobicContact CB-CD1 4.42Å; N101-Y106 WeakPolarHBondContact OD1-CB 3.1Å; N101-Y106 PolarHBondContact OD1-N 3.25Å; E104-Y106 PolarHBondContact O-N 2.89Å; Y106-D108 PolarHBondContact O-N 2.84Å; Y106-D108 VanDerWaalsContact O-N 3.15Å; Y106-Y109 PolarHBondContact O-N 2.97Å; Y106-L112 HydrophobicContact CD2-CB 4.16Å; Y106-L112 HydrophobicContact CD2-CD2 3.44Å; Y106-L112 VanDerWaalsContact CD2-CD2 3.44Å; Y106-L112 HydrophobicContact CD2-CG 3.8Å; Y106-L112 HydrophobicContact CE2-CB 3.44Å; Y106-L112 VanDerWaalsContact CE2-CB 3.44Å; Y106-L112 HydrophobicContact CE2-CD1 4.48Å; Y106-L112 HydrophobicContact CE2-CD2 3.34Å; Y106-L112 HydrophobicContact CE2-CG 3.12Å; Y106-L112 PolarHBondContact OH-O 3.48Å; Y106-C113 HydrophobicContact CE2-CB 4.45Å; Y106-C113 VanDerWaalsContact CE2-N 3.28Å; Y106-C113 VanDerWaalsContact CZ-CA 3.47Å; Y106-C113 WeakPolarHBondContact OH-CA 3.41Å; Y106-C113 PolarHBondContact OH-N 3.33Å; Y106-M116 HydrophobicContact CE1-CB 4.24Å; Y106-M116 HydrophobicContact CE1-CG 4.01Å; Y106-M116 WeakPolarHBondContact OH-CB 3.4Å; Y106-M116 WeakPolarHBondContact OH-CG 3.14Å; Y106-M116 PolarHBondContact OH-SD 3.02Å |
| 107 | Y | 70.5 | Confident | 80.7 | Confident | 64 Ų | 64 | 59.5 Ų | 59.5 | 25% | 0.251 | 29% | 0.291 | S | S | . | . | G | 310 helix | trans | -64.2 | -19.1 | 178.4 | -68.2 | -82.6 | 0 | 0 | 0 | 112.5 | E98 N101 E104 K105 Y109 C113 | E98-Y107 PolarHBondContact OE1-OH 2.9Å; N101-Y107 WeakPolarHBondContact ND2-CD2 3.19Å; N101-Y107 WeakPolarHBondContact ND2-CE2 3.22Å; E104-Y107 HydrophobicContact CB-CD2 3.9Å; E104-Y107 HydrophobicContact CB-CE2 4.45Å; E104-Y107 HydrophobicContact CG-CD2 4.27Å; E104-Y107 HydrophobicContact CG-CE2 4.35Å; E104-Y107 WeakPolarHBondContact O-CB 3.4Å; E104-Y107 WeakPolarHBondContact O-CD2 3.3Å; E104-Y107 PolarHBondContact O-N 3.44Å; K105-Y107 VanDerWaalsContact C-N 3.3Å; Y107-Y109 PolarHBondContact O-N 3.38Å; Y107-C113 WeakPolarHBondContact CD1-SG 3.45Å |
| 108 | D | 69.1 | Low | 80.7 | Confident | 99 Ų | 99 | 57 Ų | 57 | 53% | 0.529 | 28% | 0.278 | S | S | . | . | G | 310 helix | trans | -68.6 | -23.9 | 173.8 | -59.8 | -33.5 | 0 | 0 | 0 | 112.7 | K105 Y106 A110 H188 | K105-D108 WeakPolarHBondContact O-CB 3.29Å; K105-D108 PolarHBondContact O-N 3.32Å; Y106-D108 PolarHBondContact O-N 2.84Å; Y106-D108 VanDerWaalsContact O-N 3.15Å; D108-A110 PolarHBondContact O-N 3.42Å; D108-H188 PolarHBondContact O-ND1 3.4Å |
| 109 | Y | 80.1 | Confident | 80.9 | Confident | 156 Ų | 156 | 58.8 Ų | 58.8 | 61% | 0.612 | 29% | 0.286 | S | S | * | . | trans | -94.3 | 85 | 179.9 | -59.3 | -86.1 | 0 | 0 | 0 | 110.7 | K105 Y106 Y107 V111 L112 C113 | K105-Y109 VanDerWaalsContact O-CD2 3.31Å; K105-Y109 WeakPolarHBondContact O-CD2 3.42Å; K105-Y109 WeakPolarHBondContact O-CE2 3.42Å; Y106-Y109 PolarHBondContact O-N 2.97Å; Y107-Y109 PolarHBondContact O-N 3.38Å; Y109-V111 VanDerWaalsContact C-N 3.28Å; Y109-V111 PolarHBondContact O-N 2.68Å; Y109-V111 VanDerWaalsContact O-N 3.08Å; Y109-L112 PolarHBondContact O-N 3.04Å; Y109-C113 PolarHBondContact O-N 3.08Å | ||
| 110 | A | 76.9 | Confident | 80.8 | Confident | 21 Ų | 21 | 60.4 Ų | 60.4 | 17% | 0.174 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -48.6 | -42 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115 | D108 T114 V187 | D108-A110 PolarHBondContact O-N 3.42Å; A110-T114 VanDerWaalsContact O-CB 3.26Å; A110-T114 WeakPolarHBondContact O-CB 3.49Å; A110-T114 PolarHBondContact O-N 3.11Å; A110-T114 PolarHBondContact O-OG1 2.93Å; A110-V187 WeakPolarHBondContact CB-O 3.42Å |
| 111 | V | 81.7 | Confident | 80.8 | Confident | 128 Ų | 128 | 56.3 Ų | 56.3 | 78% | 0.776 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -63.9 | -50.2 | 179.5 | 175.6 | 0 | 0 | 0 | 0 | 111.1 | Y109 F115 | Y109-V111 VanDerWaalsContact C-N 3.28Å; Y109-V111 PolarHBondContact O-N 2.68Å; Y109-V111 VanDerWaalsContact O-N 3.08Å; V111-F115 WeakPolarHBondContact O-CB 3.4Å; V111-F115 PolarHBondContact O-N 3.28Å |
| 112 | L | 83 | Confident | 81.2 | Confident | 72 Ų | 72 | 56.8 Ų | 56.8 | 38% | 0.377 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -66.9 | -45.2 | -178.8 | -171.1 | 71.9 | 0 | 0 | 0 | 107.9 | Y106 Y109 T114 F115 M116 | Y106-L112 HydrophobicContact CD2-CB 4.16Å; Y106-L112 HydrophobicContact CD2-CD2 3.44Å; Y106-L112 VanDerWaalsContact CD2-CD2 3.44Å; Y106-L112 HydrophobicContact CD2-CG 3.8Å; Y106-L112 HydrophobicContact CE2-CB 3.44Å; Y106-L112 VanDerWaalsContact CE2-CB 3.44Å; Y106-L112 HydrophobicContact CE2-CD1 4.48Å; Y106-L112 HydrophobicContact CE2-CD2 3.34Å; Y106-L112 HydrophobicContact CE2-CG 3.12Å; Y106-L112 PolarHBondContact OH-O 3.48Å; Y109-L112 PolarHBondContact O-N 3.04Å; L112-T114 VanDerWaalsContact C-N 3.31Å; L112-T114 PolarHBondContact O-N 2.93Å; L112-F115 WeakPolarHBondContact O-CA 3.36Å; L112-F115 WeakPolarHBondContact O-CB 3.45Å; L112-F115 PolarHBondContact O-N 2.86Å; L112-M116 HydrophobicContact CD1-CE 3.96Å; L112-M116 HydrophobicContact CD1-SD 3.87Å; L112-M116 HydrophobicContact CG-SD 4.16Å; L112-M116 PolarHBondContact O-N 3.38Å; L112-M116 VanDerWaalsContact O-N 3.08Å |
| 113 | C | 83.8 | Confident | 81.7 | Confident | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -53.5 | -47 | 178.3 | -164.7 | 0 | 0 | 0 | 0 | 112.5 | Y106 Y107 Y109 F115 S117 C190 | Y106-C113 HydrophobicContact CE2-CB 4.45Å; Y106-C113 VanDerWaalsContact CE2-N 3.28Å; Y106-C113 VanDerWaalsContact CZ-CA 3.47Å; Y106-C113 WeakPolarHBondContact OH-CA 3.41Å; Y106-C113 PolarHBondContact OH-N 3.33Å; Y107-C113 WeakPolarHBondContact CD1-SG 3.45Å; Y109-C113 PolarHBondContact O-N 3.08Å; C113-F115 VanDerWaalsContact C-N 3.34Å; C113-F115 PolarHBondContact O-N 2.92Å; C113-S117 VanDerWaalsContact O-CB 3.23Å; C113-S117 WeakPolarHBondContact O-CB 3.48Å; C113-S117 PolarHBondContact O-N 3.25Å; C113-S117 VanDerWaalsContact O-N 3.1Å; C113-S117 PolarHBondContact O-OG 2.95Å; C113-C190 HydrophobicContact CB-CB 3.89Å; C113-C190 WeakPolarHBondContact CB-SG 3.34Å; C113-C190 WeakPolarHBondContact SG-CB 3.42Å; C113-C190 CovalentContact SG-SG 2.03Å; C113-C190 PolarHBondContact SG-SG 2.91Å |
| 114 | T | 83.4 | Confident | 82.5 | Confident | 23 Ų | 23 | 51.2 Ų | 51.2 | 14% | 0.141 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.8 | -40.5 | 176.6 | -59.7 | 0 | 0 | 0 | 0 | 111.3 | A110 L112 L118 F176 F191 | A110-T114 VanDerWaalsContact O-CB 3.26Å; A110-T114 WeakPolarHBondContact O-CB 3.49Å; A110-T114 PolarHBondContact O-N 3.11Å; A110-T114 PolarHBondContact O-OG1 2.93Å; L112-T114 VanDerWaalsContact C-N 3.31Å; L112-T114 PolarHBondContact O-N 2.93Å; T114-L118 HydrophobicContact CG2-CD1 3.96Å; T114-L118 HydrophobicContact CG2-CG 4.36Å; T114-L118 WeakPolarHBondContact O-CB 3.21Å; T114-L118 WeakPolarHBondContact O-CG 3.33Å; T114-L118 PolarHBondContact O-N 3.36Å; T114-L118 VanDerWaalsContact O-N 3.1Å; T114-F176 HydrophobicContact CG2-CD2 4.32Å; T114-F176 HydrophobicContact CG2-CE2 3.4Å; T114-F176 VanDerWaalsContact CG2-CE2 3.4Å; T114-F176 HydrophobicContact CG2-CZ 3.73Å; T114-F191 HydrophobicContact CG2-CD1 4.04Å; T114-F191 HydrophobicContact CG2-CE1 4.12Å; T114-F191 WeakPolarHBondContact O-CE1 3.44Å |
| 115 | F | 84.8 | Confident | 83.6 | Confident | 110 Ų | 110 | 48.1 Ų | 48.1 | 48% | 0.482 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.5 | -58 | 178.9 | -170.5 | -89.8 | 0 | 0 | 0 | 111.4 | V111 L112 C113 S117 L118 F119 | V111-F115 WeakPolarHBondContact O-CB 3.4Å; V111-F115 PolarHBondContact O-N 3.28Å; L112-F115 WeakPolarHBondContact O-CA 3.36Å; L112-F115 WeakPolarHBondContact O-CB 3.45Å; L112-F115 PolarHBondContact O-N 2.86Å; C113-F115 VanDerWaalsContact C-N 3.34Å; C113-F115 PolarHBondContact O-N 2.92Å; F115-S117 VanDerWaalsContact C-N 3.33Å; F115-S117 PolarHBondContact O-N 3.09Å; F115-L118 PolarHBondContact O-N 2.88Å; F115-L118 VanDerWaalsContact O-N 3.11Å; F115-F119 AromaticContact CD1-CD2 3.52Å; F115-F119 HydrophobicContact CD1-CD2 3.52Å; F115-F119 AromaticContact CD1-CE2 3.6Å; F115-F119 HydrophobicContact CD1-CE2 3.6Å; F115-F119 HydrophobicContact CD2-CD2 4.31Å; F115-F119 AromaticContact CD2-CE2 3.67Å; F115-F119 HydrophobicContact CD2-CE2 3.67Å; F115-F119 AromaticContact CE1-CD2 3.42Å; F115-F119 HydrophobicContact CE1-CD2 3.42Å; F115-F119 VanDerWaalsContact CE1-CD2 3.42Å; F115-F119 AromaticContact CE1-CE2 3.21Å; F115-F119 HydrophobicContact CE1-CE2 3.21Å; F115-F119 HydrophobicContact CE1-CZ 4.11Å; F115-F119 HydrophobicContact CE2-CD2 4.23Å; F115-F119 AromaticContact CE2-CE2 3.3Å; F115-F119 HydrophobicContact CE2-CE2 3.3Å; F115-F119 AromaticContact CE2-CZ 3.99Å; F115-F119 HydrophobicContact CE2-CZ 3.99Å; F115-F119 AromaticContact CG-CD2 4Å; F115-F119 HydrophobicContact CG-CD2 4Å; F115-F119 AromaticContact CG-CE2 3.83Å; F115-F119 HydrophobicContact CG-CE2 3.83Å; F115-F119 AromaticContact CZ-CD2 3.81Å; F115-F119 HydrophobicContact CZ-CD2 3.81Å; F115-F119 AromaticContact CZ-CE2 3.06Å; F115-F119 HydrophobicContact CZ-CE2 3.06Å; F115-F119 AromaticContact CZ-CZ 3.66Å; F115-F119 HydrophobicContact CZ-CZ 3.66Å; F115-F119 WeakPolarHBondContact O-CD2 3.46Å; F115-F119 PolarHBondContact O-N 2.94Å; F115-F119 VanDerWaalsContact O-N 3.12Å |
| 116 | M | 86.2 | Confident | 84.7 | Confident | 11 Ų | 11 | 41.7 Ų | 41.7 | 5% | 0.054 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -60.6 | -45.3 | -176.9 | -74.5 | 33.8 | -158.8 | 0 | 0 | 111.1 | D94 I97 Y106 L112 L118 F119 L120 | D94-M116 VanDerWaalsContact OD1-CE 3.27Å; D94-M116 WeakPolarHBondContact OD1-CE 3.42Å; D94-M116 WeakPolarHBondContact OD1-CG 3.14Å; D94-M116 VanDerWaalsContact OD1-SD 3.37Å; D94-M116 WeakPolarHBondContact OD2-CB 3.43Å; I97-M116 HydrophobicContact CB-CE 3.94Å; I97-M116 HydrophobicContact CD1-CE 3.18Å; I97-M116 HydrophobicContact CG1-CE 4.1Å; I97-M116 HydrophobicContact CG2-CE 4.04Å; Y106-M116 HydrophobicContact CE1-CB 4.24Å; Y106-M116 HydrophobicContact CE1-CG 4.01Å; Y106-M116 WeakPolarHBondContact OH-CB 3.4Å; Y106-M116 WeakPolarHBondContact OH-CG 3.14Å; Y106-M116 PolarHBondContact OH-SD 3.02Å; L112-M116 HydrophobicContact CD1-CE 3.96Å; L112-M116 HydrophobicContact CD1-SD 3.87Å; L112-M116 HydrophobicContact CG-SD 4.16Å; L112-M116 PolarHBondContact O-N 3.38Å; L112-M116 VanDerWaalsContact O-N 3.08Å; M116-L118 PolarHBondContact O-N 3.13Å; M116-F119 PolarHBondContact O-N 3.41Å; M116-L120 WeakPolarHBondContact O-CB 3.43Å; M116-L120 PolarHBondContact O-N 3.49Å |
| 117 | S | 85.6 | Confident | 85.8 | Confident | 12 Ų | 12 | 41 Ų | 41 | 8% | 0.084 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.9 | -35.3 | -179.2 | -63.9 | 0 | 0 | 0 | 0 | 111.6 | C113 F115 Q121 | C113-S117 VanDerWaalsContact O-CB 3.23Å; C113-S117 WeakPolarHBondContact O-CB 3.48Å; C113-S117 PolarHBondContact O-N 3.25Å; C113-S117 VanDerWaalsContact O-N 3.1Å; C113-S117 PolarHBondContact O-OG 2.95Å; F115-S117 VanDerWaalsContact C-N 3.33Å; F115-S117 PolarHBondContact O-N 3.09Å; S117-Q121 WeakPolarHBondContact O-CG 3.39Å; S117-Q121 PolarHBondContact O-N 3.42Å; S117-Q121 VanDerWaalsContact O-N 3.09Å |
| 118 | L | 88.9 | Confident | 86.9 | Confident | 27 Ų | 27 | 38 Ų | 38 | 14% | 0.141 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -69.3 | -42 | 176.3 | -74.3 | 173.5 | 0 | 0 | 0 | 111.1 | T114 F115 M116 Q121 I122 T172 L173 F176 F191 | T114-L118 HydrophobicContact CG2-CD1 3.96Å; T114-L118 HydrophobicContact CG2-CG 4.36Å; T114-L118 WeakPolarHBondContact O-CB 3.21Å; T114-L118 WeakPolarHBondContact O-CG 3.33Å; T114-L118 PolarHBondContact O-N 3.36Å; T114-L118 VanDerWaalsContact O-N 3.1Å; F115-L118 PolarHBondContact O-N 2.88Å; F115-L118 VanDerWaalsContact O-N 3.11Å; M116-L118 PolarHBondContact O-N 3.13Å; L118-Q121 PolarHBondContact O-N 3.25Å; L118-I122 WeakPolarHBondContact O-CB 3.34Å; L118-I122 VanDerWaalsContact O-CG1 3.24Å; L118-I122 WeakPolarHBondContact O-CG1 3.43Å; L118-I122 PolarHBondContact O-N 3.18Å; L118-T172 HydrophobicContact CD2-CG2 3.61Å; L118-L173 HydrophobicContact CD2-CD2 4.21Å; L118-F176 HydrophobicContact CD1-CE1 4.48Å; L118-F176 HydrophobicContact CD2-CB 4.03Å; L118-F176 HydrophobicContact CD2-CD1 4.31Å; L118-F176 HydrophobicContact CD2-CD2 4.15Å; L118-F176 HydrophobicContact CD2-CG 3.89Å; L118-F191 HydrophobicContact CB-CZ 4.3Å; L118-F191 HydrophobicContact CD2-CE1 3.99Å; L118-F191 HydrophobicContact CD2-CE2 4.24Å; L118-F191 HydrophobicContact CD2-CZ 3.61Å; L118-F191 HydrophobicContact CG-CE1 3.72Å; L118-F191 HydrophobicContact CG-CZ 3.71Å; L118-F191 VanDerWaalsContact N-CZ 3.33Å |
| 119 | F | 89.5 | Confident | 88.2 | Confident | 58 Ų | 58 | 35.1 Ų | 35.1 | 25% | 0.254 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -66.4 | -40.3 | 177.4 | -80.4 | -71.6 | 0 | 0 | 0 | 112.6 | I90 F115 M116 I122 N123 | I90-F119 HydrophobicContact CG2-CB 4.27Å; I90-F119 HydrophobicContact CG2-CD1 3.18Å; I90-F119 HydrophobicContact CG2-CE1 3.71Å; I90-F119 HydrophobicContact CG2-CG 3.95Å; F115-F119 AromaticContact CD1-CD2 3.52Å; F115-F119 HydrophobicContact CD1-CD2 3.52Å; F115-F119 AromaticContact CD1-CE2 3.6Å; F115-F119 HydrophobicContact CD1-CE2 3.6Å; F115-F119 HydrophobicContact CD2-CD2 4.31Å; F115-F119 AromaticContact CD2-CE2 3.67Å; F115-F119 HydrophobicContact CD2-CE2 3.67Å; F115-F119 AromaticContact CE1-CD2 3.42Å; F115-F119 HydrophobicContact CE1-CD2 3.42Å; F115-F119 VanDerWaalsContact CE1-CD2 3.42Å; F115-F119 AromaticContact CE1-CE2 3.21Å; F115-F119 HydrophobicContact CE1-CE2 3.21Å; F115-F119 HydrophobicContact CE1-CZ 4.11Å; F115-F119 HydrophobicContact CE2-CD2 4.23Å; F115-F119 AromaticContact CE2-CE2 3.3Å; F115-F119 HydrophobicContact CE2-CE2 3.3Å; F115-F119 AromaticContact CE2-CZ 3.99Å; F115-F119 HydrophobicContact CE2-CZ 3.99Å; F115-F119 AromaticContact CG-CD2 4Å; F115-F119 HydrophobicContact CG-CD2 4Å; F115-F119 AromaticContact CG-CE2 3.83Å; F115-F119 HydrophobicContact CG-CE2 3.83Å; F115-F119 AromaticContact CZ-CD2 3.81Å; F115-F119 HydrophobicContact CZ-CD2 3.81Å; F115-F119 AromaticContact CZ-CE2 3.06Å; F115-F119 HydrophobicContact CZ-CE2 3.06Å; F115-F119 AromaticContact CZ-CZ 3.66Å; F115-F119 HydrophobicContact CZ-CZ 3.66Å; F115-F119 WeakPolarHBondContact O-CD2 3.46Å; F115-F119 PolarHBondContact O-N 2.94Å; F115-F119 VanDerWaalsContact O-N 3.12Å; M116-F119 PolarHBondContact O-N 3.41Å; F119-I122 PolarHBondContact O-N 2.99Å; F119-N123 WeakPolarHBondContact O-CB 3.16Å; F119-N123 PolarHBondContact O-N 3.44Å |
| 120 | L | 89.1 | Confident | 89 | Confident | 33 Ų | 33 | 27.7 Ų | 27.7 | 17% | 0.173 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -57.2 | -51.7 | 173.7 | -178.6 | 60.4 | 0 | 0 | 0 | 111 | L91 M116 N123 M124 W255 F297 | L91-L120 HydrophobicContact CD1-CD1 3.57Å; L91-L120 HydrophobicContact CD2-CD1 4.42Å; M116-L120 WeakPolarHBondContact O-CB 3.43Å; M116-L120 PolarHBondContact O-N 3.49Å; L120-N123 PolarHBondContact O-N 3.46Å; L120-M124 WeakPolarHBondContact O-CB 3.14Å; L120-M124 PolarHBondContact O-N 2.93Å; L120-W255 HydrophobicContact CD1-CH2 3.95Å; L120-F297 HydrophobicContact CD1-CD1 4.44Å; L120-F297 HydrophobicContact CD1-CE1 3.81Å |
| 121 | Q | 89.5 | Confident | 89.7 | Confident | 9 Ų | 9 | 26.8 Ų | 26.8 | 4% | 0.042 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -65.6 | -42.6 | 179.8 | -74.1 | -171.3 | 26.7 | 0 | 0 | 112.9 | S117 L118 N123 M124 Y125 T172 | S117-Q121 WeakPolarHBondContact O-CG 3.39Å; S117-Q121 PolarHBondContact O-N 3.42Å; S117-Q121 VanDerWaalsContact O-N 3.09Å; L118-Q121 PolarHBondContact O-N 3.25Å; Q121-N123 VanDerWaalsContact C-N 3.31Å; Q121-N123 PolarHBondContact O-N 3.49Å; Q121-M124 PolarHBondContact O-N 2.87Å; Q121-Y125 HydrophobicContact CB-CD2 4.37Å; Q121-Y125 HydrophobicContact CB-CE2 4.22Å; Q121-Y125 WeakPolarHBondContact O-CB 3.36Å; Q121-Y125 WeakPolarHBondContact O-CD2 3.42Å; Q121-Y125 PolarHBondContact O-N 2.82Å; Q121-T172 HydrophobicContact CB-CG2 3.61Å |
| 122 | I | 92.3 | Very high | 90.4 | Very high | 31 Ų | 31 | 21.5 Ų | 21.5 | 16% | 0.159 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60.8 | -43.4 | 175.8 | -70.8 | 167 | 0 | 0 | 0 | 110.3 | L118 F119 S126 W165 T172 | L118-I122 WeakPolarHBondContact O-CB 3.34Å; L118-I122 VanDerWaalsContact O-CG1 3.24Å; L118-I122 WeakPolarHBondContact O-CG1 3.43Å; L118-I122 PolarHBondContact O-N 3.18Å; F119-I122 PolarHBondContact O-N 2.99Å; I122-S126 WeakPolarHBondContact O-CB 3.37Å; I122-S126 PolarHBondContact O-N 3.22Å; I122-S126 PolarHBondContact O-OG 3Å; I122-W165 HydrophobicContact CG2-CZ3 4.08Å; I122-T172 HydrophobicContact CG1-CG2 3.98Å; I122-T172 WeakPolarHBondContact CG1-OG1 2.97Å |
| 123 | N | 93.3 | Very high | 90.9 | Very high | 4 Ų | 4 | 22.1 Ų | 22.1 | 2% | 0.021 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -62.1 | -50 | 175.9 | 176 | -78.5 | 0 | 0 | 0 | 111.1 | A87 D88 L91 F119 L120 Q121 Y125 S126 S127 | A87-N123 PolarHBondContact O-ND2 3.49Å; D88-N123 PolarHBondContact N-ND2 3.32Å; L91-N123 HydrophobicContact CB-CB 3.87Å; L91-N123 WeakPolarHBondContact CB-ND2 3.07Å; L91-N123 HydrophobicContact CD2-CB 4.16Å; L91-N123 VanDerWaalsContact CD2-CG 3.47Å; L91-N123 WeakPolarHBondContact CD2-OD1 3.38Å; L91-N123 HydrophobicContact CG-CB 4.44Å; F119-N123 WeakPolarHBondContact O-CB 3.16Å; F119-N123 PolarHBondContact O-N 3.44Å; L120-N123 PolarHBondContact O-N 3.46Å; Q121-N123 VanDerWaalsContact C-N 3.31Å; Q121-N123 PolarHBondContact O-N 3.49Å; N123-Y125 PolarHBondContact O-N 2.88Å; N123-S126 PolarHBondContact O-N 2.93Å; N123-S126 PolarHBondContact O-OG 3.32Å; N123-S126 VanDerWaalsContact O-OG 3.06Å; N123-S127 WeakPolarHBondContact O-CB 2.96Å; N123-S127 PolarHBondContact O-N 3Å; N123-S127 PolarHBondContact O-OG 2.84Å; N123-S127 PolarHBondContact OD1-OG 3.39Å |
| 124 | M | 91.1 | Very high | 91.3 | Very high | 1 Ų | 1 | 22.6 Ų | 22.6 | 1% | 0.005 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -56.4 | -54.3 | -178.9 | -176.9 | -163.2 | 58.1 | 0 | 0 | 110.6 | L120 Q121 S127 I128 E201 W255 | L120-M124 WeakPolarHBondContact O-CB 3.14Å; L120-M124 PolarHBondContact O-N 2.93Å; Q121-M124 PolarHBondContact O-N 2.87Å; M124-S127 PolarHBondContact O-N 3.37Å; M124-I128 WeakPolarHBondContact O-CG2 3.37Å; M124-I128 PolarHBondContact O-N 2.82Å; M124-E201 HydrophobicContact CE-CB 4.36Å; M124-E201 HydrophobicContact CE-CG 3.82Å; M124-E201 HydrophobicContact SD-CG 3.93Å; M124-W255 HydrophobicContact CB-CH2 3.56Å; M124-W255 HydrophobicContact CB-CZ2 4.05Å; M124-W255 HydrophobicContact CB-CZ3 3.89Å; M124-W255 HydrophobicContact CG-CD2 4.33Å; M124-W255 HydrophobicContact CG-CE3 3.92Å; M124-W255 HydrophobicContact CG-CH2 3.74Å; M124-W255 HydrophobicContact CG-CZ2 4.16Å; M124-W255 HydrophobicContact CG-CZ3 3.61Å; M124-W255 HydrophobicContact SD-CE3 4.23Å; M124-W255 HydrophobicContact SD-CZ3 3.97Å |
| 125 | Y | 94.4 | Very high | 91.7 | Very high | 1 Ų | 1 | 21.5 Ų | 21.5 | 0% | 0.004 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -62.4 | -46.6 | -179.4 | -71.7 | -50.8 | 0 | 0 | 0 | 112.2 | Q121 N123 S127 I128 F129 A171 T172 E201 I204 | Q121-Y125 HydrophobicContact CB-CD2 4.37Å; Q121-Y125 HydrophobicContact CB-CE2 4.22Å; Q121-Y125 WeakPolarHBondContact O-CB 3.36Å; Q121-Y125 WeakPolarHBondContact O-CD2 3.42Å; Q121-Y125 PolarHBondContact O-N 2.82Å; N123-Y125 PolarHBondContact O-N 2.88Å; Y125-S127 PolarHBondContact O-N 3.44Å; Y125-I128 WeakPolarHBondContact O-CG2 3.34Å; Y125-I128 PolarHBondContact O-N 3.13Å; Y125-F129 HydrophobicContact CD1-CZ 4.08Å; Y125-F129 WeakPolarHBondContact O-CB 3.21Å; Y125-F129 WeakPolarHBondContact O-CD2 3.16Å; Y125-F129 WeakPolarHBondContact O-CG 3.13Å; Y125-F129 PolarHBondContact O-N 3.33Å; Y125-A171 HydrophobicContact CD1-CB 4.48Å; Y125-A171 HydrophobicContact CD2-CB 3.91Å; Y125-A171 HydrophobicContact CE2-CB 3.95Å; Y125-A171 HydrophobicContact CG-CB 4.19Å; Y125-T172 WeakPolarHBondContact CD2-OG1 3.44Å; Y125-E201 WeakPolarHBondContact OH-CA 3.18Å; Y125-I204 HydrophobicContact CD1-CG2 4.27Å; Y125-I204 HydrophobicContact CE1-CB 4.13Å; Y125-I204 HydrophobicContact CE1-CG2 3.96Å |
| 126 | S | 95.1 | Very high | 92 | Very high | 0 Ų | 0 | 19.8 Ų | 19.8 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -62.5 | -45 | 179 | 59.5 | 0 | 0 | 0 | 0 | 111.3 | A87 I122 N123 F129 F130 S168 | A87-S126 WeakPolarHBondContact CB-OG 3.38Å; I122-S126 WeakPolarHBondContact O-CB 3.37Å; I122-S126 PolarHBondContact O-N 3.22Å; I122-S126 PolarHBondContact O-OG 3Å; N123-S126 PolarHBondContact O-N 2.93Å; N123-S126 PolarHBondContact O-OG 3.32Å; N123-S126 VanDerWaalsContact O-OG 3.06Å; S126-F129 PolarHBondContact O-N 2.95Å; S126-F130 WeakPolarHBondContact O-CB 3.27Å; S126-F130 WeakPolarHBondContact O-CD2 3.36Å; S126-F130 PolarHBondContact O-N 3.4Å; S126-S168 WeakPolarHBondContact CA-OG 3.39Å; S126-S168 PolarHBondContact N-OG 3.46Å |
| 127 | S | 93.6 | Very high | 92.2 | Very high | 1 Ų | 1 | 20.2 Ų | 20.2 | 1% | 0.007 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -57.7 | -53.3 | 178.3 | -66 | 0 | 0 | 0 | 0 | 111.8 | N123 M124 Y125 F129 F130 L131 | N123-S127 WeakPolarHBondContact O-CB 2.96Å; N123-S127 PolarHBondContact O-N 3Å; N123-S127 PolarHBondContact O-OG 2.84Å; N123-S127 PolarHBondContact OD1-OG 3.39Å; M124-S127 PolarHBondContact O-N 3.37Å; Y125-S127 PolarHBondContact O-N 3.44Å; S127-F129 PolarHBondContact O-N 3.4Å; S127-F130 PolarHBondContact O-N 3.38Å; S127-L131 WeakPolarHBondContact O-CG 3.28Å; S127-L131 PolarHBondContact O-N 2.92Å |
| 128 | I | 94.3 | Very high | 92.3 | Very high | 0 Ų | 0 | 21.6 Ų | 21.6 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -70.1 | -35 | -177 | -166.7 | 47.3 | 0 | 0 | 0 | 112.8 | M124 Y125 L131 T132 P209 I213 F251 F252 | M124-I128 WeakPolarHBondContact O-CG2 3.37Å; M124-I128 PolarHBondContact O-N 2.82Å; Y125-I128 WeakPolarHBondContact O-CG2 3.34Å; Y125-I128 PolarHBondContact O-N 3.13Å; I128-L131 HydrophobicContact CD1-CB 4.47Å; I128-L131 PolarHBondContact O-N 3.47Å; I128-T132 WeakPolarHBondContact O-CB 3.34Å; I128-T132 PolarHBondContact O-N 3.46Å; I128-T132 PolarHBondContact O-OG1 3.33Å; I128-P209 HydrophobicContact CD1-CB 3.74Å; I128-P209 HydrophobicContact CG1-CB 3.29Å; I128-P209 HydrophobicContact CG1-CG 3.59Å; I128-P209 HydrophobicContact CG2-CG 4.19Å; I128-I213 HydrophobicContact CD1-CD1 3.91Å; I128-F251 HydrophobicContact CB-CE1 4.04Å; I128-F251 HydrophobicContact CB-CE2 3.97Å; I128-F251 HydrophobicContact CB-CZ 3.51Å; I128-F251 HydrophobicContact CD1-CD1 3.66Å; I128-F251 HydrophobicContact CD1-CE1 3.37Å; I128-F251 HydrophobicContact CD1-CE2 4.37Å; I128-F251 HydrophobicContact CD1-CG 4.33Å; I128-F251 HydrophobicContact CD1-CZ 3.78Å; I128-F251 HydrophobicContact CG1-CE1 3.8Å; I128-F251 HydrophobicContact CG1-CZ 3.82Å; I128-F252 HydrophobicContact CD1-CZ 4.21Å |
| 129 | F | 96.4 | Very high | 92.2 | Very high | 39 Ų | 39 | 23.4 Ų | 23.4 | 17% | 0.171 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -67.6 | -39.5 | 174.9 | -67.3 | -10.5 | 0 | 0 | 0 | 111.6 | Y125 S126 S127 T132 W133 I164 A167 S168 I204 | Y125-F129 HydrophobicContact CD1-CZ 4.08Å; Y125-F129 WeakPolarHBondContact O-CB 3.21Å; Y125-F129 WeakPolarHBondContact O-CD2 3.16Å; Y125-F129 WeakPolarHBondContact O-CG 3.13Å; Y125-F129 PolarHBondContact O-N 3.33Å; S126-F129 PolarHBondContact O-N 2.95Å; S127-F129 PolarHBondContact O-N 3.4Å; F129-T132 PolarHBondContact O-N 3.3Å; F129-W133 VanDerWaalsContact O-CB 3.28Å; F129-W133 WeakPolarHBondContact O-CB 3.48Å; F129-W133 PolarHBondContact O-N 3.15Å; F129-I164 HydrophobicContact CB-CG2 3.73Å; F129-A167 HydrophobicContact CD2-CB 4.22Å; F129-A167 HydrophobicContact CE2-CB 4.09Å; F129-S168 WeakPolarHBondContact CD2-OG 3.02Å; F129-I204 HydrophobicContact CE1-CG2 3.93Å; F129-I204 HydrophobicContact CZ-CG2 3.61Å |
| 130 | F | 95.2 | Very high | 92.1 | Very high | 0 Ų | 0 | 22.7 Ų | 22.7 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -61.8 | -44.2 | 171.8 | -85 | -62.3 | 0 | 0 | 0 | 111.6 | Y80 N83 L84 S126 S127 W133 M134 C161 I164 W165 | Y80-F130 HydrophobicContact CD1-CD1 4.46Å; N83-F130 HydrophobicContact CB-CD2 4.44Å; N83-F130 HydrophobicContact CB-CE1 3.75Å; N83-F130 HydrophobicContact CB-CE2 3.7Å; N83-F130 HydrophobicContact CB-CZ 3.31Å; L84-F130 HydrophobicContact CD1-CB 4.16Å; S126-F130 WeakPolarHBondContact O-CB 3.27Å; S126-F130 WeakPolarHBondContact O-CD2 3.36Å; S126-F130 PolarHBondContact O-N 3.4Å; S127-F130 PolarHBondContact O-N 3.38Å; F130-W133 PolarHBondContact O-N 2.99Å; F130-M134 HydrophobicContact CB-CE 4.5Å; F130-M134 WeakPolarHBondContact O-CB 3.27Å; F130-M134 WeakPolarHBondContact O-CG 3.35Å; F130-M134 PolarHBondContact O-N 3.45Å; F130-C161 HydrophobicContact CE1-CB 4.14Å; F130-C161 HydrophobicContact CZ-CB 4.3Å; F130-I164 HydrophobicContact CD1-CD1 3.65Å; F130-I164 HydrophobicContact CD1-CG2 4.19Å; F130-I164 HydrophobicContact CD2-CG2 3.78Å; F130-I164 HydrophobicContact CE1-CB 4.21Å; F130-I164 HydrophobicContact CE1-CD1 3.68Å; F130-I164 HydrophobicContact CE1-CG2 4.05Å; F130-I164 HydrophobicContact CE2-CB 4.43Å; F130-I164 HydrophobicContact CE2-CG2 3.6Å; F130-I164 HydrophobicContact CG-CD1 4.36Å; F130-I164 HydrophobicContact CG-CG2 4.03Å; F130-I164 HydrophobicContact CZ-CB 4.07Å; F130-I164 HydrophobicContact CZ-CD1 4.39Å; F130-I164 HydrophobicContact CZ-CG2 3.72Å; F130-W165 HydrophobicContact CE2-CZ2 4.47Å; F130-W165 AromaticContact CZ-NE1 3.85Å |
| 131 | L | 92.9 | Very high | 91.8 | Very high | 3 Ų | 3 | 21.8 Ų | 21.8 | 2% | 0.016 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -65.7 | -39.2 | 177.9 | -66.8 | 178.3 | 0 | 0 | 0 | 113.1 | S127 I128 M134 S135 V247 V248 F251 | S127-L131 WeakPolarHBondContact O-CG 3.28Å; S127-L131 PolarHBondContact O-N 2.92Å; I128-L131 HydrophobicContact CD1-CB 4.47Å; I128-L131 PolarHBondContact O-N 3.47Å; L131-M134 HydrophobicContact CD2-SD 4.44Å; L131-M134 PolarHBondContact O-N 3.27Å; L131-S135 WeakPolarHBondContact O-CB 3.31Å; L131-S135 PolarHBondContact O-N 3.19Å; L131-S135 PolarHBondContact O-OG 3.2Å; L131-V247 HydrophobicContact CD1-CG1 4.32Å; L131-V247 HydrophobicContact CD2-CB 4.18Å; L131-V247 HydrophobicContact CD2-CG1 3.35Å; L131-V247 HydrophobicContact CG-CG1 4.47Å; L131-V248 HydrophobicContact CB-CG2 4.42Å; L131-F251 HydrophobicContact CD1-CB 3.49Å; L131-F251 VanDerWaalsContact CD1-CB 3.49Å; L131-F251 HydrophobicContact CD1-CD1 4.45Å; L131-F251 HydrophobicContact CD1-CD2 3.57Å; L131-F251 HydrophobicContact CD1-CE2 4.48Å; L131-F251 HydrophobicContact CD1-CG 3.56Å |
| 132 | T | 95.3 | Very high | 91.4 | Very high | 17 Ų | 17 | 21.4 Ų | 21.4 | 10% | 0.104 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -62 | -48.7 | 174.4 | -57.3 | 0 | 0 | 0 | 0 | 110.3 | I128 F129 S135 F136 P209 I212 I213 | I128-T132 WeakPolarHBondContact O-CB 3.34Å; I128-T132 PolarHBondContact O-N 3.46Å; I128-T132 PolarHBondContact O-OG1 3.33Å; F129-T132 PolarHBondContact O-N 3.3Å; T132-S135 WeakPolarHBondContact O-CB 3.35Å; T132-S135 PolarHBondContact O-N 3.33Å; T132-F136 PolarHBondContact O-N 3.05Å; T132-P209 WeakPolarHBondContact OG1-CB 3.3Å; T132-I212 HydrophobicContact CG2-CB 3.9Å; T132-I212 HydrophobicContact CG2-CD1 4.3Å; T132-I212 HydrophobicContact CG2-CG2 3.47Å; T132-I212 VanDerWaalsContact CG2-CG2 3.47Å; T132-I213 HydrophobicContact CG2-CG1 4.31Å |
| 133 | W | 94.9 | Very high | 90.8 | Very high | 85 Ų | 85 | 21.3 Ų | 21.3 | 32% | 0.322 | 10% | 0.101 | S | C | . | . | H | α-helix | trans | -65.4 | -41.4 | 178.4 | -172 | -100.2 | 0 | 0 | 0 | 112.5 | Y80 F129 F130 S135 F136 D137 S160 I164 | Y80-W133 AromaticContact CE1-CD1 3.78Å; Y80-W133 AromaticContact CE1-NE1 3.94Å; Y80-W133 AromaticContact CZ-CD1 3.61Å; Y80-W133 AromaticContact CZ-NE1 3.6Å; Y80-W133 PolarHBondContact OH-NE1 3.2Å; F129-W133 VanDerWaalsContact O-CB 3.28Å; F129-W133 WeakPolarHBondContact O-CB 3.48Å; F129-W133 PolarHBondContact O-N 3.15Å; F130-W133 PolarHBondContact O-N 2.99Å; W133-S135 VanDerWaalsContact C-N 3.29Å; W133-S135 PolarHBondContact O-N 2.94Å; W133-F136 HydrophobicContact CE3-CD1 4.2Å; W133-F136 HydrophobicContact CH2-CD1 4.25Å; W133-F136 HydrophobicContact CH2-CE1 4.33Å; W133-F136 AromaticContact CZ3-CD1 3.96Å; W133-F136 HydrophobicContact CZ3-CD1 3.96Å; W133-F136 HydrophobicContact CZ3-CE1 4.24Å; W133-F136 CarbonylContact O-C 3.56Å; W133-F136 PolarHBondContact O-N 2.95Å; W133-D137 WeakPolarHBondContact O-CB 3.47Å; W133-D137 PolarHBondContact O-N 3.28Å; W133-S160 WeakPolarHBondContact CZ2-OG 3.47Å; W133-I164 HydrophobicContact CB-CD1 3.7Å; W133-I164 HydrophobicContact CG-CD1 3.81Å |
| 134 | M | 91.3 | Very high | 89.9 | Confident | 9 Ų | 9 | 22.2 Ų | 22.2 | 4% | 0.044 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -59.5 | -41 | 174.3 | -76.6 | -174.5 | -156.8 | 0 | 0 | 111.5 | Y80 F81 F130 L131 F136 R138 I244 | Y80-M134 HydrophobicContact CD2-CG 3.75Å; Y80-M134 HydrophobicContact CG-CE 4.45Å; Y80-M134 HydrophobicContact CG-CG 4.1Å; F81-M134 HydrophobicContact CD1-CE 3.63Å; F81-M134 HydrophobicContact CD1-SD 4.3Å; F81-M134 HydrophobicContact CE1-CE 3.77Å; F81-M134 HydrophobicContact CE1-SD 3.81Å; F130-M134 HydrophobicContact CB-CE 4.5Å; F130-M134 WeakPolarHBondContact O-CB 3.27Å; F130-M134 WeakPolarHBondContact O-CG 3.35Å; F130-M134 PolarHBondContact O-N 3.45Å; L131-M134 HydrophobicContact CD2-SD 4.44Å; L131-M134 PolarHBondContact O-N 3.27Å; M134-F136 VanDerWaalsContact C-N 3.35Å; M134-R138 VanDerWaalsContact O-CB 3.28Å; M134-R138 WeakPolarHBondContact O-CB 3.23Å; M134-R138 PolarHBondContact O-N 3.07Å; M134-I244 HydrophobicContact CB-CG2 4.37Å |
| 135 | S | 91.8 | Very high | 88.7 | Confident | 0 Ų | 0 | 25.4 Ų | 25.4 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -65 | -40.6 | 176.7 | -59.2 | 0 | 0 | 0 | 0 | 111.3 | L131 T132 W133 Y139 | L131-S135 WeakPolarHBondContact O-CB 3.31Å; L131-S135 PolarHBondContact O-N 3.19Å; L131-S135 PolarHBondContact O-OG 3.2Å; T132-S135 WeakPolarHBondContact O-CB 3.35Å; T132-S135 PolarHBondContact O-N 3.33Å; W133-S135 VanDerWaalsContact C-N 3.29Å; W133-S135 PolarHBondContact O-N 2.94Å; S135-Y139 PolarHBondContact O-N 2.87Å |
| 136 | F | 91.8 | Very high | 87.1 | Confident | 74 Ų | 74 | 30.5 Ų | 30.5 | 33% | 0.325 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -69.1 | -45.4 | 175.7 | -176.1 | -110.8 | 0 | 0 | 0 | 113.1 | T132 W133 M134 R138 Y139 I140 | T132-F136 PolarHBondContact O-N 3.05Å; W133-F136 HydrophobicContact CE3-CD1 4.2Å; W133-F136 HydrophobicContact CH2-CD1 4.25Å; W133-F136 HydrophobicContact CH2-CE1 4.33Å; W133-F136 AromaticContact CZ3-CD1 3.96Å; W133-F136 HydrophobicContact CZ3-CD1 3.96Å; W133-F136 HydrophobicContact CZ3-CE1 4.24Å; W133-F136 CarbonylContact O-C 3.56Å; W133-F136 PolarHBondContact O-N 2.95Å; M134-F136 VanDerWaalsContact C-N 3.35Å; F136-R138 VanDerWaalsContact C-N 3.26Å; F136-R138 PolarHBondContact O-N 3.37Å; F136-Y139 HydrophobicContact CD2-CD1 4.27Å; F136-Y139 HydrophobicContact CE2-CD1 4.27Å; F136-Y139 WeakPolarHBondContact O-CB 3.28Å; F136-Y139 PolarHBondContact O-N 3.16Å; F136-Y139 VanDerWaalsContact O-N 3.11Å; F136-I140 HydrophobicContact CD1-CD1 3.8Å; F136-I140 HydrophobicContact CE1-CD1 3.26Å; F136-I140 HydrophobicContact CE1-CG1 4.18Å; F136-I140 HydrophobicContact CE2-CD1 4.35Å; F136-I140 HydrophobicContact CE2-CG1 4.49Å; F136-I140 HydrophobicContact CZ-CD1 3.58Å; F136-I140 HydrophobicContact CZ-CG1 4.16Å; F136-I140 PolarHBondContact O-N 2.89Å |
| 137 | D | 89.6 | Confident | 85.4 | Confident | 20 Ų | 20 | 33.7 Ų | 33.7 | 11% | 0.107 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -57.1 | -42 | 173.8 | -179.3 | 92.4 | 0 | 0 | 0 | 110.6 | Y80 W133 Y139 I140 A141 R152 | Y80-D137 HydrophobicContact CE2-CB 4.21Å; Y80-D137 PolarHBondContact OH-OD1 2.88Å; W133-D137 WeakPolarHBondContact O-CB 3.47Å; W133-D137 PolarHBondContact O-N 3.28Å; D137-Y139 VanDerWaalsContact C-N 3.34Å; D137-Y139 PolarHBondContact O-N 2.76Å; D137-I140 PolarHBondContact O-N 3.34Å; D137-A141 WeakPolarHBondContact O-CB 3.37Å; D137-A141 PolarHBondContact O-N 3.47Å; D137-R152 IonicContact OD2-NH1 3.45Å; D137-R152 PolarHBondContact OD2-NH1 3.04Å |
| 138 | R | 87.3 | Confident | 83.4 | Confident | 42 Ų | 42 | 40.1 Ų | 40.1 | 16% | 0.158 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -63.7 | -40.5 | 177 | -173.1 | 64.7 | -105.9 | -174.5 | -8 | 112.1 | M134 F136 L142 I220 L241 I244 | M134-R138 VanDerWaalsContact O-CB 3.28Å; M134-R138 WeakPolarHBondContact O-CB 3.23Å; M134-R138 PolarHBondContact O-N 3.07Å; F136-R138 VanDerWaalsContact C-N 3.26Å; F136-R138 PolarHBondContact O-N 3.37Å; R138-L142 HydrophobicContact CG-CD1 4.47Å; R138-L142 WeakPolarHBondContact O-CG 3.29Å; R138-L142 PolarHBondContact O-N 3.26Å; R138-L142 VanDerWaalsContact O-N 3.15Å; R138-I220 HydrophobicContact CB-CD1 4.48Å; R138-I220 HydrophobicContact CG-CD1 4.28Å; R138-L241 HydrophobicContact CG-CD1 3.9Å; R138-I244 HydrophobicContact CB-CD1 3.89Å; R138-I244 HydrophobicContact CG-CD1 3.92Å |
| 139 | Y | 87.8 | Confident | 81.4 | Confident | 64 Ų | 64 | 43.6 Ų | 43.6 | 25% | 0.251 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -61 | -52.3 | 172.8 | 162 | -106 | 0 | 0 | 0 | 110.8 | S135 F136 D137 A141 L142 A143 L219 I220 I223 | S135-Y139 PolarHBondContact O-N 2.87Å; F136-Y139 HydrophobicContact CD2-CD1 4.27Å; F136-Y139 HydrophobicContact CE2-CD1 4.27Å; F136-Y139 WeakPolarHBondContact O-CB 3.28Å; F136-Y139 PolarHBondContact O-N 3.16Å; F136-Y139 VanDerWaalsContact O-N 3.11Å; D137-Y139 VanDerWaalsContact C-N 3.34Å; D137-Y139 PolarHBondContact O-N 2.76Å; Y139-A141 VanDerWaalsContact C-N 3.31Å; Y139-A141 PolarHBondContact O-N 2.85Å; Y139-L142 PolarHBondContact O-N 3.4Å; Y139-L142 VanDerWaalsContact O-N 3.08Å; Y139-A143 HydrophobicContact CE2-CB 4.35Å; Y139-A143 WeakPolarHBondContact O-CB 3.48Å; Y139-A143 PolarHBondContact O-N 3.35Å; Y139-L219 HydrophobicContact CD2-CB 3.82Å; Y139-L219 HydrophobicContact CD2-CD1 4.48Å; Y139-L219 HydrophobicContact CE2-CB 3.64Å; Y139-L219 HydrophobicContact CE2-CD1 3.99Å; Y139-L219 HydrophobicContact CE2-CG 4.42Å; Y139-I220 HydrophobicContact CD2-CG1 4.26Å; Y139-I223 HydrophobicContact CD2-CD1 3.92Å; Y139-I223 HydrophobicContact CE2-CD1 3.59Å |
| 140 | I | 87.6 | Confident | 79.6 | Confident | 44 Ų | 44 | 47 Ų | 47 | 23% | 0.226 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -57.2 | -45.3 | 177.8 | -69.2 | 176.1 | 0 | 0 | 0 | 110.6 | F136 D137 L142 A143 S144 L151 | F136-I140 HydrophobicContact CD1-CD1 3.8Å; F136-I140 HydrophobicContact CE1-CD1 3.26Å; F136-I140 HydrophobicContact CE1-CG1 4.18Å; F136-I140 HydrophobicContact CE2-CD1 4.35Å; F136-I140 HydrophobicContact CE2-CG1 4.49Å; F136-I140 HydrophobicContact CZ-CD1 3.58Å; F136-I140 HydrophobicContact CZ-CG1 4.16Å; F136-I140 PolarHBondContact O-N 2.89Å; D137-I140 PolarHBondContact O-N 3.34Å; I140-L142 PolarHBondContact O-N 3.28Å; I140-A143 PolarHBondContact O-N 3.29Å; I140-S144 VanDerWaalsContact O-CB 3.23Å; I140-S144 WeakPolarHBondContact O-CB 3.37Å; I140-S144 PolarHBondContact O-N 3.32Å; I140-S144 PolarHBondContact O-OG 3.31Å; I140-L151 HydrophobicContact CG2-CB 4.39Å |
| 141 | A | 83.3 | Confident | 78.2 | Confident | 14 Ų | 14 | 52.7 Ų | 52.7 | 12% | 0.116 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.7 | -30.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | D137 Y139 S145 | D137-A141 WeakPolarHBondContact O-CB 3.37Å; D137-A141 PolarHBondContact O-N 3.47Å; Y139-A141 VanDerWaalsContact C-N 3.31Å; Y139-A141 PolarHBondContact O-N 2.85Å; A141-S145 PolarHBondContact O-N 2.78Å |
| 142 | L | 80.3 | Confident | 77.6 | Confident | 1 Ų | 1 | 57.7 Ų | 57.7 | 1% | 0.005 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -81.5 | -39.3 | 175.8 | -72 | 171.6 | 0 | 0 | 0 | 112 | R138 Y139 I140 I220 I223 R237 | R138-L142 HydrophobicContact CG-CD1 4.47Å; R138-L142 WeakPolarHBondContact O-CG 3.29Å; R138-L142 PolarHBondContact O-N 3.26Å; R138-L142 VanDerWaalsContact O-N 3.15Å; Y139-L142 PolarHBondContact O-N 3.4Å; Y139-L142 VanDerWaalsContact O-N 3.08Å; I140-L142 PolarHBondContact O-N 3.28Å; L142-I220 HydrophobicContact CD1-CB 4.46Å; L142-I220 HydrophobicContact CD1-CG1 4.18Å; L142-I220 HydrophobicContact CD1-CG2 3.64Å; L142-I223 HydrophobicContact CB-CG2 4.39Å; L142-R237 HydrophobicContact CD2-CB 4.14Å; L142-R237 HydrophobicContact CD2-CG 4.13Å |
| 143 | A | 79.9 | Confident | 77.2 | Confident | 29 Ų | 29 | 59.4 Ų | 59.4 | 24% | 0.24 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -68.2 | -43.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y139 I140 S145 M146 S147 I223 | Y139-A143 HydrophobicContact CE2-CB 4.35Å; Y139-A143 WeakPolarHBondContact O-CB 3.48Å; Y139-A143 PolarHBondContact O-N 3.35Å; I140-A143 PolarHBondContact O-N 3.29Å; A143-S145 VanDerWaalsContact C-N 3.32Å; A143-S145 PolarHBondContact O-N 3Å; A143-M146 WeakPolarHBondContact O-CA 3.46Å; A143-M146 WeakPolarHBondContact O-CB 3.35Å; A143-M146 PolarHBondContact O-N 3.49Å; A143-S147 PolarHBondContact O-N 3.38Å; A143-I223 HydrophobicContact CB-CD1 3.97Å |
| 144 | S | 73.2 | Confident | 76.9 | Confident | 22 Ų | 22 | 58.2 Ų | 58.2 | 15% | 0.154 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -69.7 | -27.4 | 178.2 | 68.2 | 0 | 0 | 0 | 0 | 112.6 | I140 M146 S147 | I140-S144 VanDerWaalsContact O-CB 3.23Å; I140-S144 WeakPolarHBondContact O-CB 3.37Å; I140-S144 PolarHBondContact O-N 3.32Å; I140-S144 PolarHBondContact O-OG 3.31Å; S144-M146 PolarHBondContact O-N 3.14Å; S144-M146 VanDerWaalsContact O-N 3.12Å; S144-S147 WeakPolarHBondContact CA-OG 3.41Å; S144-S147 CarbonylContact O-C 3.6Å; S144-S147 PolarHBondContact O-N 3.27Å |
| 145 | S | 66.8 | Low | 76.8 | Confident | 68 Ų | 68 | 65.2 Ų | 65.2 | 48% | 0.476 | 36% | 0.362 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.2 | -10.5 | 170.5 | -173.4 | 0 | 0 | 0 | 0 | 113.2 | A141 A143 R237 | A141-S145 PolarHBondContact O-N 2.78Å; A143-S145 VanDerWaalsContact C-N 3.32Å; A143-S145 PolarHBondContact O-N 3Å; S145-R237 PolarHBondContact OG-NH2 3.49Å |
| 146 | M | 61 | Low | 76.8 | Confident | 108 Ų | 108 | 70 Ų | 70 | 53% | 0.532 | 39% | 0.385 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.9 | -4.5 | 172.4 | -57.6 | 176.3 | 62.9 | 0 | 0 | 112.5 | A143 S144 I223 | A143-M146 WeakPolarHBondContact O-CA 3.46Å; A143-M146 WeakPolarHBondContact O-CB 3.35Å; A143-M146 PolarHBondContact O-N 3.49Å; S144-M146 PolarHBondContact O-N 3.14Å; S144-M146 VanDerWaalsContact O-N 3.12Å; M146-I223 HydrophobicContact SD-CG2 3.59Å; M146-I223 VanDerWaalsContact SD-CG2 3.59Å |
| 147 | S | 58.7 | Low | 76.8 | Confident | 67 Ų | 67 | 66.6 Ų | 66.6 | 47% | 0.469 | 37% | 0.37 | S | S | . | . | S | Bend | trans | -126.3 | 157.5 | 178.3 | 66.6 | 0 | 0 | 0 | 0 | 111.2 | A143 S144 C149 | A143-S147 PolarHBondContact O-N 3.38Å; S144-S147 WeakPolarHBondContact CA-OG 3.41Å; S144-S147 CarbonylContact O-C 3.6Å; S144-S147 PolarHBondContact O-N 3.27Å; S147-C149 PolarHBondContact O-N 2.86Å |
| 148 | S | 51.3 | Low | 77 | Confident | 136 Ų | 136 | 71.1 Ų | 71.1 | 95% | 0.951 | 39% | 0.389 | S | S | * | . | S | Bend | trans | -83.1 | 13 | -173.9 | -50.3 | 0 | 0 | 0 | 0 | 114.3 | ||
| 149 | C | 52.8 | Low | 77.4 | Confident | 73 Ų | 73 | 74.1 Ų | 74.1 | 49% | 0.493 | 41% | 0.407 | S | S | . | . | trans | -114.2 | 111.6 | -172.8 | -169 | 0 | 0 | 0 | 0 | 112.1 | S147 L151 | S147-C149 PolarHBondContact O-N 2.86Å; C149-L151 PolarHBondContact O-N 3.12Å | ||
| 150 | P | 59.1 | Low | 77.7 | Confident | 112 Ų | 112 | 71.7 Ų | 71.7 | 73% | 0.727 | 40% | 0.4 | S | S | * | . | trans | -81.5 | 95.6 | 176.7 | 30.9 | -31.1 | 0 | 0 | 0 | 111.2 | R152 | P150-R152 VanDerWaalsContact C-N 3.28Å; P150-R152 PolarHBondContact O-N 3.32Å | ||
| 151 | L | 66.8 | Low | 78.2 | Confident | 118 Ų | 118 | 69.9 Ų | 69.9 | 62% | 0.618 | 39% | 0.391 | S | S | * | . | trans | -78.6 | -3.8 | 174.1 | -82.6 | 145.9 | 0 | 0 | 0 | 114.3 | I140 C149 | I140-L151 HydrophobicContact CG2-CB 4.39Å; C149-L151 PolarHBondContact O-N 3.12Å | ||
| 152 | R | 79.9 | Confident | 78.8 | Confident | 108 Ų | 108 | 70.9 Ų | 70.9 | 41% | 0.408 | 40% | 0.402 | S | S | . | . | trans | -109.4 | 103.2 | -166.4 | -162.2 | 178.1 | 77.1 | 154 | 4.2 | 112.1 | I76 D137 P150 | I76-R152 HydrophobicContact CD1-CG 3.52Å; D137-R152 IonicContact OD2-NH1 3.45Å; D137-R152 PolarHBondContact OD2-NH1 3.04Å; P150-R152 VanDerWaalsContact C-N 3.28Å; P150-R152 PolarHBondContact O-N 3.32Å | ||
| 153 | T | 86.5 | Confident | 79.6 | Confident | 53 Ų | 53 | 75.9 Ų | 75.9 | 33% | 0.325 | 43% | 0.429 | S | S | . | . | trans | -122.1 | 157 | 175.6 | 75.9 | 0 | 0 | 0 | 0 | 111.6 | Q155 H156 A157 | T153-Q155 PolarHBondContact O-N 2.99Å; T153-H156 PolarHBondContact O-N 2.8Å; T153-H156 PolarHBondContact OG1-CD2 3.25Å; T153-H156 PolarHBondContact OG1-N 2.95Å; T153-A157 PolarHBondContact O-N 2.9Å; T153-A157 VanDerWaalsContact O-N 3.13Å | ||
| 154 | M | 88.6 | Confident | 80.5 | Confident | 61 Ų | 61 | 75.2 Ų | 75.2 | 30% | 0.3 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -64 | -28.6 | 176.1 | -171.2 | 61.3 | 164.2 | 0 | 0 | 112.3 | M74 I76 L79 A157 K158 | M74-M154 HydrophobicContact CB-CE 4.25Å; M74-M154 HydrophobicContact CG-CE 4.07Å; M74-M154 HydrophobicContact SD-CE 3.83Å; I76-M154 HydrophobicContact CG1-SD 4.03Å; L79-M154 HydrophobicContact CB-CE 4.2Å; L79-M154 HydrophobicContact CD2-CE 4.07Å; L79-M154 HydrophobicContact CD2-SD 4.15Å; M154-A157 PolarHBondContact O-N 2.87Å; M154-K158 WeakPolarHBondContact O-CG 3.45Å; M154-K158 PolarHBondContact O-N 3.3Å |
| 155 | Q | 89.9 | Confident | 81.6 | Confident | 155 Ų | 155 | 76.6 Ų | 76.6 | 72% | 0.724 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -67.1 | -45.3 | 175.8 | -69.7 | 176.2 | -10.6 | 0 | 0 | 111.1 | T153 A157 K158 L159 | T153-Q155 PolarHBondContact O-N 2.99Å; Q155-A157 VanDerWaalsContact C-N 3.31Å; Q155-A157 PolarHBondContact O-N 2.95Å; Q155-K158 PolarHBondContact O-N 3.35Å; Q155-L159 PolarHBondContact O-N 3.46Å |
| 156 | H | 90.6 | Very high | 83.1 | Confident | 102 Ų | 102 | 79.5 Ų | 79.5 | 47% | 0.472 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -62 | -39.4 | 174.6 | -66 | -47.8 | 0 | 0 | 0 | 111.9 | T153 L159 S160 | T153-H156 PolarHBondContact O-N 2.8Å; T153-H156 PolarHBondContact OG1-CD2 3.25Å; T153-H156 PolarHBondContact OG1-N 2.95Å; H156-L159 PolarHBondContact O-N 3Å; H156-S160 WeakPolarHBondContact O-CB 3.29Å; H156-S160 PolarHBondContact O-N 3.4Å; H156-S160 PolarHBondContact O-OG 3.22Å |
| 157 | A | 92.1 | Very high | 84.8 | Confident | 2 Ų | 2 | 76.4 Ų | 76.4 | 2% | 0.017 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -62.1 | -43.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | I76 L79 Y80 T153 M154 Q155 S160 C161 | I76-A157 HydrophobicContact CB-CB 4.35Å; I76-A157 HydrophobicContact CD1-CB 4.39Å; I76-A157 HydrophobicContact CG1-CB 3.95Å; I76-A157 HydrophobicContact CG2-CB 3.75Å; L79-A157 HydrophobicContact CD2-CB 3.96Å; Y80-A157 HydrophobicContact CE1-CB 4.18Å; T153-A157 PolarHBondContact O-N 2.9Å; T153-A157 VanDerWaalsContact O-N 3.13Å; M154-A157 PolarHBondContact O-N 2.87Å; Q155-A157 VanDerWaalsContact C-N 3.31Å; Q155-A157 PolarHBondContact O-N 2.95Å; A157-S160 PolarHBondContact O-N 2.9Å; A157-C161 PolarHBondContact O-N 3.05Å; A157-C161 PolarHBondContact O-SG 3.46Å |
| 158 | K | 94.1 | Very high | 86.6 | Confident | 115 Ų | 115 | 73.2 Ų | 73.2 | 50% | 0.5 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -62.3 | -45.7 | 175.4 | -73.7 | 176.2 | 179.7 | -179.4 | 0 | 112.4 | L79 M154 Q155 S160 C161 G162 | L79-K158 HydrophobicContact CD2-CB 4.46Å; L79-K158 HydrophobicContact CD2-CG 3.74Å; M154-K158 WeakPolarHBondContact O-CG 3.45Å; M154-K158 PolarHBondContact O-N 3.3Å; Q155-K158 PolarHBondContact O-N 3.35Å; K158-S160 VanDerWaalsContact C-N 3.31Å; K158-S160 PolarHBondContact O-N 3.03Å; K158-C161 PolarHBondContact O-N 3.45Å; K158-G162 PolarHBondContact O-N 2.82Å; K158-G162 VanDerWaalsContact O-N 3.08Å |
| 159 | L | 95.2 | Very high | 88.7 | Confident | 105 Ų | 105 | 69.7 Ų | 69.7 | 55% | 0.55 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -59.2 | -45 | 175.8 | 178.9 | 62.7 | 0 | 0 | 0 | 110.8 | Q155 H156 C161 G162 L163 | Q155-L159 PolarHBondContact O-N 3.46Å; H156-L159 PolarHBondContact O-N 3Å; L159-C161 VanDerWaalsContact C-N 3.34Å; L159-C161 PolarHBondContact O-N 3.27Å; L159-G162 PolarHBondContact O-N 3.16Å; L159-G162 VanDerWaalsContact O-N 3.13Å; L159-L163 HydrophobicContact CD1-CG 4.44Å; L159-L163 HydrophobicContact CG-CD1 4.19Å; L159-L163 HydrophobicContact CG-CG 4.48Å; L159-L163 WeakPolarHBondContact O-CG 3.46Å; L159-L163 PolarHBondContact O-N 3.33Å |
| 160 | S | 95.1 | Very high | 90.6 | Very high | 13 Ų | 13 | 72.5 Ų | 72.5 | 9% | 0.091 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -61.2 | -42 | 178.7 | -52.7 | 0 | 0 | 0 | 0 | 111.8 | W133 H156 A157 K158 G162 L163 I164 | W133-S160 WeakPolarHBondContact CZ2-OG 3.47Å; H156-S160 WeakPolarHBondContact O-CB 3.29Å; H156-S160 PolarHBondContact O-N 3.4Å; H156-S160 PolarHBondContact O-OG 3.22Å; A157-S160 PolarHBondContact O-N 2.9Å; K158-S160 VanDerWaalsContact C-N 3.31Å; K158-S160 PolarHBondContact O-N 3.03Å; S160-G162 VanDerWaalsContact C-N 3.33Å; S160-G162 PolarHBondContact O-N 3.03Å; S160-L163 PolarHBondContact O-N 2.87Å; S160-I164 WeakPolarHBondContact O-CB 3.45Å; S160-I164 WeakPolarHBondContact O-CD1 3.49Å; S160-I164 WeakPolarHBondContact O-CG1 3.36Å; S160-I164 PolarHBondContact O-N 3.46Å |
| 161 | C | 96.7 | Very high | 92.2 | Very high | 6 Ų | 6 | 68 Ų | 68 | 4% | 0.041 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -59.8 | -44.5 | 174.2 | -62.1 | 0 | 0 | 0 | 0 | 111.5 | N83 F130 A157 K158 L159 I164 W165 | N83-C161 PolarHBondContact ND2-SG 3.32Å; F130-C161 HydrophobicContact CE1-CB 4.14Å; F130-C161 HydrophobicContact CZ-CB 4.3Å; A157-C161 PolarHBondContact O-N 3.05Å; A157-C161 PolarHBondContact O-SG 3.46Å; K158-C161 PolarHBondContact O-N 3.45Å; L159-C161 VanDerWaalsContact C-N 3.34Å; L159-C161 PolarHBondContact O-N 3.27Å; C161-I164 PolarHBondContact O-N 3.24Å; C161-W165 PolarHBondContact O-N 2.88Å |
| 162 | G | 96.9 | Very high | 93.4 | Very high | 35 Ų | 35 | 62.4 Ų | 62.4 | 36% | 0.361 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.2 | -45 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | K158 L159 S160 I164 W165 M166 | K158-G162 PolarHBondContact O-N 2.82Å; K158-G162 VanDerWaalsContact O-N 3.08Å; L159-G162 PolarHBondContact O-N 3.16Å; L159-G162 VanDerWaalsContact O-N 3.13Å; S160-G162 VanDerWaalsContact C-N 3.33Å; S160-G162 PolarHBondContact O-N 3.03Å; G162-I164 PolarHBondContact O-N 3.19Å; G162-W165 PolarHBondContact O-N 3.28Å; G162-M166 VanDerWaalsContact O-CG 3.27Å; G162-M166 WeakPolarHBondContact O-CG 3.42Å; G162-M166 PolarHBondContact O-N 3.21Å |
| 163 | L | 97.2 | Very high | 94 | Very high | 106 Ų | 106 | 60.7 Ų | 60.7 | 56% | 0.555 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -63.6 | -39.7 | 177.1 | -68.6 | 174.5 | 0 | 0 | 0 | 112.4 | L159 S160 M166 A167 | L159-L163 HydrophobicContact CD1-CG 4.44Å; L159-L163 HydrophobicContact CG-CD1 4.19Å; L159-L163 HydrophobicContact CG-CG 4.48Å; L159-L163 WeakPolarHBondContact O-CG 3.46Å; L159-L163 PolarHBondContact O-N 3.33Å; S160-L163 PolarHBondContact O-N 2.87Å; L163-M166 PolarHBondContact O-N 3.12Å; L163-A167 VanDerWaalsContact O-CB 3.29Å; L163-A167 WeakPolarHBondContact O-CB 3.18Å; L163-A167 PolarHBondContact O-N 3.01Å |
| 164 | I | 97.6 | Very high | 94.1 | Very high | 15 Ų | 15 | 61.8 Ų | 61.8 | 8% | 0.077 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.3 | -46.2 | 177 | -70.7 | 162.5 | 0 | 0 | 0 | 110.7 | F129 F130 W133 S160 C161 G162 A167 S168 | F129-I164 HydrophobicContact CB-CG2 3.73Å; F130-I164 HydrophobicContact CD1-CD1 3.65Å; F130-I164 HydrophobicContact CD1-CG2 4.19Å; F130-I164 HydrophobicContact CD2-CG2 3.78Å; F130-I164 HydrophobicContact CE1-CB 4.21Å; F130-I164 HydrophobicContact CE1-CD1 3.68Å; F130-I164 HydrophobicContact CE1-CG2 4.05Å; F130-I164 HydrophobicContact CE2-CB 4.43Å; F130-I164 HydrophobicContact CE2-CG2 3.6Å; F130-I164 HydrophobicContact CG-CD1 4.36Å; F130-I164 HydrophobicContact CG-CG2 4.03Å; F130-I164 HydrophobicContact CZ-CB 4.07Å; F130-I164 HydrophobicContact CZ-CD1 4.39Å; F130-I164 HydrophobicContact CZ-CG2 3.72Å; W133-I164 HydrophobicContact CB-CD1 3.7Å; W133-I164 HydrophobicContact CG-CD1 3.81Å; S160-I164 WeakPolarHBondContact O-CB 3.45Å; S160-I164 WeakPolarHBondContact O-CD1 3.49Å; S160-I164 WeakPolarHBondContact O-CG1 3.36Å; S160-I164 PolarHBondContact O-N 3.46Å; C161-I164 PolarHBondContact O-N 3.24Å; G162-I164 PolarHBondContact O-N 3.19Å; I164-A167 PolarHBondContact O-N 3.37Å; I164-S168 WeakPolarHBondContact O-CB 3.24Å; I164-S168 PolarHBondContact O-N 3.43Å; I164-S168 PolarHBondContact O-OG 2.94Å |
| 165 | W | 97.6 | Very high | 94.1 | Very high | 51 Ų | 51 | 59.6 Ų | 59.6 | 19% | 0.193 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -60.3 | -47.3 | 175.4 | -82 | 114.3 | 0 | 0 | 0 | 112 | N83 V86 A87 I122 F130 C161 G162 A167 S168 I169 | N83-W165 PolarHBondContact OD1-NE1 3.36Å; V86-W165 HydrophobicContact CB-CZ2 4.44Å; V86-W165 HydrophobicContact CG1-CH2 4.36Å; V86-W165 HydrophobicContact CG1-CZ2 4.16Å; A87-W165 HydrophobicContact CB-CH2 3.83Å; A87-W165 HydrophobicContact CB-CZ2 4.36Å; I122-W165 HydrophobicContact CG2-CZ3 4.08Å; F130-W165 HydrophobicContact CE2-CZ2 4.47Å; F130-W165 AromaticContact CZ-NE1 3.85Å; C161-W165 PolarHBondContact O-N 2.88Å; G162-W165 PolarHBondContact O-N 3.28Å; W165-A167 VanDerWaalsContact C-N 3.33Å; W165-A167 PolarHBondContact O-N 3.29Å; W165-S168 PolarHBondContact O-N 2.91Å; W165-I169 WeakPolarHBondContact O-CB 3.35Å; W165-I169 VanDerWaalsContact O-CG1 3.29Å; W165-I169 WeakPolarHBondContact O-CG1 3.42Å; W165-I169 PolarHBondContact O-N 2.94Å |
| 166 | M | 97.3 | Very high | 93.9 | Very high | 128 Ų | 128 | 53.9 Ų | 53.9 | 63% | 0.631 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -59 | -44.6 | 176.9 | -70.8 | -59.2 | -60.9 | 0 | 0 | 111.7 | G162 L163 F170 | G162-M166 VanDerWaalsContact O-CG 3.27Å; G162-M166 WeakPolarHBondContact O-CG 3.42Å; G162-M166 PolarHBondContact O-N 3.21Å; L163-M166 PolarHBondContact O-N 3.12Å; M166-F170 WeakPolarHBondContact O-CB 3.49Å; M166-F170 PolarHBondContact O-N 3.48Å |
| 167 | A | 96.4 | Very high | 93.6 | Very high | 43 Ų | 43 | 52.3 Ų | 52.3 | 36% | 0.355 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -63.8 | -41.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | F129 L163 I164 W165 F170 A171 | F129-A167 HydrophobicContact CD2-CB 4.22Å; F129-A167 HydrophobicContact CE2-CB 4.09Å; L163-A167 VanDerWaalsContact O-CB 3.29Å; L163-A167 WeakPolarHBondContact O-CB 3.18Å; L163-A167 PolarHBondContact O-N 3.01Å; I164-A167 PolarHBondContact O-N 3.37Å; W165-A167 VanDerWaalsContact C-N 3.33Å; W165-A167 PolarHBondContact O-N 3.29Å; A167-F170 PolarHBondContact O-N 3.3Å; A167-A171 VanDerWaalsContact O-CB 3.22Å; A167-A171 WeakPolarHBondContact O-CB 3.38Å; A167-A171 PolarHBondContact O-N 3.29Å |
| 168 | S | 96.4 | Very high | 93.3 | Very high | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -67.2 | -44.7 | -179.6 | -50.7 | 0 | 0 | 0 | 0 | 111.8 | S126 F129 I164 W165 T172 | S126-S168 WeakPolarHBondContact CA-OG 3.39Å; S126-S168 PolarHBondContact N-OG 3.46Å; F129-S168 WeakPolarHBondContact CD2-OG 3.02Å; I164-S168 WeakPolarHBondContact O-CB 3.24Å; I164-S168 PolarHBondContact O-N 3.43Å; I164-S168 PolarHBondContact O-OG 2.94Å; W165-S168 PolarHBondContact O-N 2.91Å; S168-T172 PolarHBondContact O-N 3.44Å; S168-T172 PolarHBondContact O-OG1 2.7Å |
| 169 | I | 95.2 | Very high | 92.7 | Very high | 63 Ų | 63 | 51 Ų | 51 | 32% | 0.323 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -64.3 | -44.8 | 176.1 | -68.3 | 167.5 | 0 | 0 | 0 | 109.9 | W165 T172 L173 | W165-I169 WeakPolarHBondContact O-CB 3.35Å; W165-I169 VanDerWaalsContact O-CG1 3.29Å; W165-I169 WeakPolarHBondContact O-CG1 3.42Å; W165-I169 PolarHBondContact O-N 2.94Å; I169-T172 PolarHBondContact O-N 2.8Å; I169-L173 HydrophobicContact CG2-CD1 3.48Å; I169-L173 VanDerWaalsContact CG2-CD1 3.48Å; I169-L173 HydrophobicContact CG2-CG 3.98Å; I169-L173 WeakPolarHBondContact O-CB 2.93Å; I169-L173 WeakPolarHBondContact O-CG 3.44Å; I169-L173 PolarHBondContact O-N 3.06Å |
| 170 | F | 94.6 | Very high | 92 | Very high | 132 Ų | 132 | 50.4 Ų | 50.4 | 58% | 0.579 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -63.8 | -44.7 | 179.1 | -177 | -100.4 | 0 | 0 | 0 | 112.3 | M166 A167 T172 L174 | M166-F170 WeakPolarHBondContact O-CB 3.49Å; M166-F170 PolarHBondContact O-N 3.48Å; A167-F170 PolarHBondContact O-N 3.3Å; F170-T172 PolarHBondContact O-N 2.86Å; F170-L174 HydrophobicContact CE1-CD2 3.85Å; F170-L174 HydrophobicContact CE2-CB 4.3Å; F170-L174 HydrophobicContact CE2-CD2 4.28Å; F170-L174 HydrophobicContact CZ-CB 4.36Å; F170-L174 HydrophobicContact CZ-CD2 3.61Å; F170-L174 HydrophobicContact CZ-CG 4.41Å; F170-L174 VanDerWaalsContact O-CB 3.29Å; F170-L174 WeakPolarHBondContact O-CB 3.48Å; F170-L174 PolarHBondContact O-N 3.45Å |
| 171 | A | 92.6 | Very high | 91.3 | Very high | 17 Ų | 17 | 54.5 Ų | 54.5 | 14% | 0.14 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -60.3 | -26.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y125 A167 P175 | Y125-A171 HydrophobicContact CD1-CB 4.48Å; Y125-A171 HydrophobicContact CD2-CB 3.91Å; Y125-A171 HydrophobicContact CE2-CB 3.95Å; Y125-A171 HydrophobicContact CG-CB 4.19Å; A167-A171 VanDerWaalsContact O-CB 3.22Å; A167-A171 WeakPolarHBondContact O-CB 3.38Å; A167-A171 PolarHBondContact O-N 3.29Å; A171-P175 WeakPolarHBondContact O-CD 3.22Å; A171-P175 VanDerWaalsContact O-CG 3.3Å; A171-P175 WeakPolarHBondContact O-CG 3.16Å |
| 172 | T | 91.8 | Very high | 90.5 | Very high | 0 Ų | 0 | 60.6 Ų | 60.6 | 0% | 0 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -89.4 | -50.5 | 177.2 | -48.8 | 0 | 0 | 0 | 0 | 112.4 | L118 Q121 I122 Y125 S168 I169 F170 P175 F176 | L118-T172 HydrophobicContact CD2-CG2 3.61Å; Q121-T172 HydrophobicContact CB-CG2 3.61Å; I122-T172 HydrophobicContact CG1-CG2 3.98Å; I122-T172 WeakPolarHBondContact CG1-OG1 2.97Å; Y125-T172 WeakPolarHBondContact CD2-OG1 3.44Å; S168-T172 PolarHBondContact O-N 3.44Å; S168-T172 PolarHBondContact O-OG1 2.7Å; I169-T172 PolarHBondContact O-N 2.8Å; F170-T172 PolarHBondContact O-N 2.86Å; T172-P175 WeakPolarHBondContact O-CD 3.28Å; T172-F176 WeakPolarHBondContact O-CB 3.4Å; T172-F176 PolarHBondContact O-N 3.42Å |
| 173 | L | 91.1 | Very high | 89.5 | Confident | 73 Ų | 73 | 61.6 Ų | 61.6 | 38% | 0.382 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -75.6 | -32.9 | -171.3 | -67.3 | -174.7 | 0 | 0 | 0 | 113.2 | L118 I169 F176 T177 | L118-L173 HydrophobicContact CD2-CD2 4.21Å; I169-L173 HydrophobicContact CG2-CD1 3.48Å; I169-L173 VanDerWaalsContact CG2-CD1 3.48Å; I169-L173 HydrophobicContact CG2-CG 3.98Å; I169-L173 WeakPolarHBondContact O-CB 2.93Å; I169-L173 WeakPolarHBondContact O-CG 3.44Å; I169-L173 PolarHBondContact O-N 3.06Å; L173-F176 HydrophobicContact CD2-CD1 4.44Å; L173-F176 PolarHBondContact O-N 2.86Å; L173-T177 WeakPolarHBondContact O-CB 2.99Å; L173-T177 VanDerWaalsContact O-CG2 3.28Å; L173-T177 WeakPolarHBondContact O-CG2 3.21Å; L173-T177 PolarHBondContact O-N 3.24Å; L173-T177 PolarHBondContact O-OG1 3.25Å |
| 174 | L | 89.8 | Confident | 88.1 | Confident | 75 Ų | 75 | 67.3 Ų | 67.3 | 39% | 0.393 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -63.2 | -53.7 | 179.7 | 176.4 | 73.8 | 0 | 0 | 0 | 111.2 | F170 F176 T177 I178 | F170-L174 HydrophobicContact CE1-CD2 3.85Å; F170-L174 HydrophobicContact CE2-CB 4.3Å; F170-L174 HydrophobicContact CE2-CD2 4.28Å; F170-L174 HydrophobicContact CZ-CB 4.36Å; F170-L174 HydrophobicContact CZ-CD2 3.61Å; F170-L174 HydrophobicContact CZ-CG 4.41Å; F170-L174 VanDerWaalsContact O-CB 3.29Å; F170-L174 WeakPolarHBondContact O-CB 3.48Å; F170-L174 PolarHBondContact O-N 3.45Å; L174-F176 VanDerWaalsContact C-N 3.31Å; L174-F176 PolarHBondContact O-N 3.13Å; L174-T177 PolarHBondContact O-N 3.09Å; L174-T177 PolarHBondContact O-OG1 3.27Å; L174-I178 HydrophobicContact CD1-CD1 4.1Å; L174-I178 HydrophobicContact CG-CD1 4.02Å; L174-I178 WeakPolarHBondContact O-CG1 3.25Å; L174-I178 PolarHBondContact O-N 3.05Å; L174-I178 VanDerWaalsContact O-N 3.16Å |
| 175 | P | 87.1 | Confident | 86.5 | Confident | 15 Ų | 15 | 70.1 Ų | 70.1 | 10% | 0.097 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -60.8 | -40.8 | 176.3 | -22.8 | 34.9 | 0 | 0 | 0 | 112.4 | A171 T172 T177 I178 V179 I197 L200 | A171-P175 WeakPolarHBondContact O-CD 3.22Å; A171-P175 VanDerWaalsContact O-CG 3.3Å; A171-P175 WeakPolarHBondContact O-CG 3.16Å; T172-P175 WeakPolarHBondContact O-CD 3.28Å; P175-T177 PolarHBondContact O-N 3.34Å; P175-I178 PolarHBondContact O-N 3.39Å; P175-V179 WeakPolarHBondContact O-CB 3.26Å; P175-V179 WeakPolarHBondContact O-CG2 3.34Å; P175-V179 PolarHBondContact O-N 3.38Å; P175-I197 HydrophobicContact CB-CD1 4.19Å; P175-I197 HydrophobicContact CB-CG1 3.91Å; P175-L200 HydrophobicContact CB-CD1 4.11Å; P175-L200 HydrophobicContact CG-CD1 3.68Å |
| 176 | F | 86.3 | Confident | 85.2 | Confident | 35 Ų | 35 | 73.1 Ų | 73.1 | 15% | 0.154 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -56.2 | -50.5 | 176.2 | 169.2 | -107.9 | 0 | 0 | 0 | 112.3 | T114 L118 T172 L173 L174 I178 V179 Q180 F191 | T114-F176 HydrophobicContact CG2-CD2 4.32Å; T114-F176 HydrophobicContact CG2-CE2 3.4Å; T114-F176 VanDerWaalsContact CG2-CE2 3.4Å; T114-F176 HydrophobicContact CG2-CZ 3.73Å; L118-F176 HydrophobicContact CD1-CE1 4.48Å; L118-F176 HydrophobicContact CD2-CB 4.03Å; L118-F176 HydrophobicContact CD2-CD1 4.31Å; L118-F176 HydrophobicContact CD2-CD2 4.15Å; L118-F176 HydrophobicContact CD2-CG 3.89Å; T172-F176 WeakPolarHBondContact O-CB 3.4Å; T172-F176 PolarHBondContact O-N 3.42Å; L173-F176 HydrophobicContact CD2-CD1 4.44Å; L173-F176 PolarHBondContact O-N 2.86Å; L174-F176 VanDerWaalsContact C-N 3.31Å; L174-F176 PolarHBondContact O-N 3.13Å; F176-I178 PolarHBondContact O-N 2.62Å; F176-V179 PolarHBondContact O-N 2.8Å; F176-Q180 VanDerWaalsContact O-CB 3.26Å; F176-Q180 WeakPolarHBondContact O-CB 3.44Å; F176-Q180 PolarHBondContact O-N 3.11Å; F176-F191 HydrophobicContact CD2-CB 4.3Å; F176-F191 HydrophobicContact CD2-CD1 4.09Å; F176-F191 HydrophobicContact CD2-CE1 4.49Å; F176-F191 HydrophobicContact CD2-CG 4.07Å; F176-F191 HydrophobicContact CE2-CD1 4.36Å |
| 177 | T | 85.4 | Confident | 83.4 | Confident | 69 Ų | 69 | 72.7 Ų | 72.7 | 42% | 0.423 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -64 | -39.8 | -179.2 | 53.6 | 0 | 0 | 0 | 0 | 112.5 | L173 L174 P175 Q180 T181 | L173-T177 WeakPolarHBondContact O-CB 2.99Å; L173-T177 VanDerWaalsContact O-CG2 3.28Å; L173-T177 WeakPolarHBondContact O-CG2 3.21Å; L173-T177 PolarHBondContact O-N 3.24Å; L173-T177 PolarHBondContact O-OG1 3.25Å; L174-T177 PolarHBondContact O-N 3.09Å; L174-T177 PolarHBondContact O-OG1 3.27Å; P175-T177 PolarHBondContact O-N 3.34Å; T177-Q180 PolarHBondContact O-N 3.19Å; T177-T181 WeakPolarHBondContact O-CG2 3.47Å; T177-T181 PolarHBondContact O-N 3.23Å; T177-T181 VanDerWaalsContact O-N 3.12Å |
| 178 | I | 84.7 | Confident | 81.8 | Confident | 83 Ų | 83 | 77.2 Ų | 77.2 | 43% | 0.426 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -61 | -51.1 | 176.7 | -67 | 166.4 | 0 | 0 | 0 | 110 | L174 P175 F176 Q180 T181 Q182 | L174-I178 HydrophobicContact CD1-CD1 4.1Å; L174-I178 HydrophobicContact CG-CD1 4.02Å; L174-I178 WeakPolarHBondContact O-CG1 3.25Å; L174-I178 PolarHBondContact O-N 3.05Å; L174-I178 VanDerWaalsContact O-N 3.16Å; P175-I178 PolarHBondContact O-N 3.39Å; F176-I178 PolarHBondContact O-N 2.62Å; I178-Q180 PolarHBondContact O-N 3.49Å; I178-T181 PolarHBondContact O-N 3.41Å; I178-T181 PolarHBondContact O-OG1 3.38Å; I178-Q182 PolarHBondContact O-N 2.86Å |
| 179 | V | 82 | Confident | 80.3 | Confident | 7 Ų | 7 | 78.7 Ų | 78.7 | 4% | 0.042 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -63.1 | -42.3 | -179.6 | 166.6 | 0 | 0 | 0 | 0 | 111.9 | P175 F176 T181 Q182 H183 F189 V194 I197 | P175-V179 WeakPolarHBondContact O-CB 3.26Å; P175-V179 WeakPolarHBondContact O-CG2 3.34Å; P175-V179 PolarHBondContact O-N 3.38Å; F176-V179 PolarHBondContact O-N 2.8Å; V179-T181 PolarHBondContact O-N 3.25Å; V179-Q182 WeakPolarHBondContact O-CB 3.34Å; V179-Q182 PolarHBondContact O-N 3.33Å; V179-H183 PolarHBondContact O-N 3.02Å; V179-H183 PolarHBondContact O-ND1 3.43Å; V179-H183 VanDerWaalsContact O-ND1 3.1Å; V179-F189 HydrophobicContact CG1-CE1 3.36Å; V179-F189 HydrophobicContact CG1-CZ 3.34Å; V179-V194 HydrophobicContact CG1-CG2 3.69Å; V179-V194 HydrophobicContact CG2-CB 4.45Å; V179-V194 HydrophobicContact CG2-CG1 3.86Å; V179-V194 HydrophobicContact CG2-CG2 4.31Å; V179-I197 HydrophobicContact CB-CD1 4.33Å; V179-I197 HydrophobicContact CG2-CD1 3.75Å; V179-I197 HydrophobicContact CG2-CG1 4.14Å |
| 180 | Q | 81.1 | Confident | 79.2 | Confident | 92 Ų | 92 | 76.3 Ų | 76.3 | 43% | 0.43 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -61 | -34.2 | 179 | -170.2 | 68.6 | 3.1 | 0 | 0 | 111.7 | F176 T177 I178 | F176-Q180 VanDerWaalsContact O-CB 3.26Å; F176-Q180 WeakPolarHBondContact O-CB 3.44Å; F176-Q180 PolarHBondContact O-N 3.11Å; T177-Q180 PolarHBondContact O-N 3.19Å; I178-Q180 PolarHBondContact O-N 3.49Å |
| 181 | T | 80.6 | Confident | 78.2 | Confident | 99 Ų | 99 | 70 Ų | 70 | 61% | 0.607 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -71.8 | -30.6 | 174.4 | 61.4 | 0 | 0 | 0 | 0 | 113.1 | T177 I178 V179 | T177-T181 WeakPolarHBondContact O-CG2 3.47Å; T177-T181 PolarHBondContact O-N 3.23Å; T177-T181 VanDerWaalsContact O-N 3.12Å; I178-T181 PolarHBondContact O-N 3.41Å; I178-T181 PolarHBondContact O-OG1 3.38Å; V179-T181 PolarHBondContact O-N 3.25Å |
| 182 | Q | 79.3 | Confident | 76.9 | Confident | 135 Ų | 135 | 70.5 Ų | 70.5 | 63% | 0.631 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -74.2 | -35.6 | 178.6 | -70.5 | 176.2 | -12.6 | 0 | 0 | 112.5 | I178 V179 | I178-Q182 PolarHBondContact O-N 2.86Å; V179-Q182 WeakPolarHBondContact O-CB 3.34Å; V179-Q182 PolarHBondContact O-N 3.33Å |
| 183 | H | 74.9 | Confident | 75.8 | Confident | 55 Ų | 55 | 74.3 Ų | 74.3 | 26% | 0.255 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.5 | 28.1 | -177.9 | -60.2 | 78.2 | 0 | 0 | 0 | 112.5 | V179 G185 E186 F189 | V179-H183 PolarHBondContact O-N 3.02Å; V179-H183 PolarHBondContact O-ND1 3.43Å; V179-H183 VanDerWaalsContact O-ND1 3.1Å; H183-G185 PolarHBondContact O-N 3.38Å; H183-E186 IonicContact CD2-OE1 2.56Å; H183-E186 IonicContact CD2-OE2 2.76Å; H183-E186 PolarHBondContact O-N 3.06Å; H183-F189 HydrophobicContact CB-CD1 4.24Å; H183-F189 HydrophobicContact CB-CD2 3.96Å; H183-F189 HydrophobicContact CB-CE1 4.42Å; H183-F189 HydrophobicContact CB-CE2 4.15Å; H183-F189 HydrophobicContact CB-CG 4Å; H183-F189 HydrophobicContact CB-CZ 4.36Å; H183-F189 AromaticContact CD2-CD2 3.63Å; H183-F189 AromaticContact CD2-CE2 3.34Å; H183-F189 WeakPolarHBondContact CD2-CE2 3.48Å; H183-F189 AromaticContact CE1-CE2 3.86Å; H183-F189 AromaticContact CE1-CZ 3.92Å; H183-F189 AromaticContact CG-CD2 3.76Å; H183-F189 AromaticContact CG-CE2 3.5Å; H183-F189 VanDerWaalsContact CG-CE2 3.5Å; H183-F189 AromaticContact CG-CZ 3.78Å; H183-F189 AromaticContact ND1-CE2 3.81Å; H183-F189 AromaticContact ND1-CZ 3.7Å; H183-F189 AromaticContact NE2-CE2 3.6Å |
| 184 | R | 68.2 | Low | 75.2 | Confident | 226 Ų | 226 | 71.9 Ų | 71.9 | 85% | 0.853 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.7 | 95.5 | -176.9 | -168.6 | 177.5 | -177.2 | 171.4 | 1 | 110.4 | ||
| 185 | G | 63.4 | Low | 74.7 | Confident | 74 Ų | 74 | 69.9 Ų | 69.9 | 76% | 0.763 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 140.8 | -12.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | H183 | H183-G185 PolarHBondContact O-N 3.38Š|
| 186 | E | 70.4 | Confident | 74.5 | Confident | 115 Ų | 115 | 74.8 Ų | 74.8 | 54% | 0.537 | 39% | 0.39 | S | S | . | . | trans | -88.9 | 114.6 | 178.8 | -66.5 | 178.5 | -166.1 | 0 | 0 | 111.1 | H183 H188 F189 | H183-E186 IonicContact CD2-OE1 2.56Å; H183-E186 IonicContact CD2-OE2 2.76Å; H183-E186 PolarHBondContact O-N 3.06Å; E186-H188 VanDerWaalsContact C-N 3.31Å; E186-H188 PolarHBondContact O-N 3.44Å; E186-F189 HydrophobicContact CB-CB 3.92Å; E186-F189 WeakPolarHBondContact OE2-CD2 3.28Å | ||
| 187 | V | 59.3 | Low | 74.3 | Confident | 119 Ų | 119 | 73.3 Ų | 73.3 | 72% | 0.721 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.7 | -20.7 | -173 | -171.5 | 0 | 0 | 0 | 0 | 112.7 | A110 | A110-V187 WeakPolarHBondContact CB-O 3.42Š|
| 188 | H | 63 | Low | 74.2 | Confident | 138 Ų | 138 | 70.4 Ų | 70.4 | 64% | 0.639 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.8 | 22.8 | -177.7 | -64.3 | -74.3 | 0 | 0 | 0 | 113.8 | D108 E186 C190 | D108-H188 PolarHBondContact O-ND1 3.4Å; E186-H188 VanDerWaalsContact C-N 3.31Å; E186-H188 PolarHBondContact O-N 3.44Å; H188-C190 PolarHBondContact O-N 2.91Å |
| 189 | F | 66.6 | Low | 74.3 | Confident | 30 Ų | 30 | 70.5 Ų | 70.5 | 13% | 0.132 | 36% | 0.36 | C | S | . | . | trans | -75.3 | 123.2 | -178.5 | -176.9 | -96.9 | 0 | 0 | 0 | 111.6 | V179 H183 E186 F191 V194 | V179-F189 HydrophobicContact CG1-CE1 3.36Å; V179-F189 HydrophobicContact CG1-CZ 3.34Å; H183-F189 HydrophobicContact CB-CD1 4.24Å; H183-F189 HydrophobicContact CB-CD2 3.96Å; H183-F189 HydrophobicContact CB-CE1 4.42Å; H183-F189 HydrophobicContact CB-CE2 4.15Å; H183-F189 HydrophobicContact CB-CG 4Å; H183-F189 HydrophobicContact CB-CZ 4.36Å; H183-F189 AromaticContact CD2-CD2 3.63Å; H183-F189 AromaticContact CD2-CE2 3.34Å; H183-F189 WeakPolarHBondContact CD2-CE2 3.48Å; H183-F189 AromaticContact CE1-CE2 3.86Å; H183-F189 AromaticContact CE1-CZ 3.92Å; H183-F189 AromaticContact CG-CD2 3.76Å; H183-F189 AromaticContact CG-CE2 3.5Å; H183-F189 VanDerWaalsContact CG-CE2 3.5Å; H183-F189 AromaticContact CG-CZ 3.78Å; H183-F189 AromaticContact ND1-CE2 3.81Å; H183-F189 AromaticContact ND1-CZ 3.7Å; H183-F189 AromaticContact NE2-CE2 3.6Å; E186-F189 HydrophobicContact CB-CB 3.92Å; E186-F189 WeakPolarHBondContact OE2-CD2 3.28Å; F189-F191 HydrophobicContact CE1-CB 4.05Å; F189-V194 HydrophobicContact CE1-CG2 4.41Å; F189-V194 HydrophobicContact CE2-CG2 4.32Å; F189-V194 HydrophobicContact CZ-CG2 3.54Å | ||
| 190 | C | 71.5 | Confident | 74.6 | Confident | 13 Ų | 13 | 73.4 Ų | 73.4 | 9% | 0.088 | 38% | 0.375 | C | S | . | . | trans | -112.6 | 128 | 168.4 | -168.8 | 0 | 0 | 0 | 0 | 111 | C113 H188 A192 | C113-C190 HydrophobicContact CB-CB 3.89Å; C113-C190 WeakPolarHBondContact CB-SG 3.34Å; C113-C190 WeakPolarHBondContact SG-CB 3.42Å; C113-C190 CovalentContact SG-SG 2.03Å; C113-C190 PolarHBondContact SG-SG 2.91Å; H188-C190 PolarHBondContact O-N 2.91Å; C190-A192 VanDerWaalsContact C-N 3.26Å; C190-A192 PolarHBondContact O-N 2.9Å | ||
| 191 | F | 72.6 | Confident | 74.9 | Confident | 1 Ų | 1 | 69.7 Ų | 69.7 | 0% | 0.004 | 36% | 0.357 | C | S | . | . | G | 310 helix | trans | -74.6 | -10.9 | -170.2 | 81.1 | -88.5 | 0 | 0 | 0 | 114.7 | T114 L118 F176 F189 N193 V194 I197 | T114-F191 HydrophobicContact CG2-CD1 4.04Å; T114-F191 HydrophobicContact CG2-CE1 4.12Å; T114-F191 WeakPolarHBondContact O-CE1 3.44Å; L118-F191 HydrophobicContact CB-CZ 4.3Å; L118-F191 HydrophobicContact CD2-CE1 3.99Å; L118-F191 HydrophobicContact CD2-CE2 4.24Å; L118-F191 HydrophobicContact CD2-CZ 3.61Å; L118-F191 HydrophobicContact CG-CE1 3.72Å; L118-F191 HydrophobicContact CG-CZ 3.71Å; L118-F191 VanDerWaalsContact N-CZ 3.33Å; F176-F191 HydrophobicContact CD2-CB 4.3Å; F176-F191 HydrophobicContact CD2-CD1 4.09Å; F176-F191 HydrophobicContact CD2-CE1 4.49Å; F176-F191 HydrophobicContact CD2-CG 4.07Å; F176-F191 HydrophobicContact CE2-CD1 4.36Å; F189-F191 HydrophobicContact CE1-CB 4.05Å; F191-N193 PolarHBondContact O-N 3.38Å; F191-V194 PolarHBondContact O-N 2.89Å; F191-I197 HydrophobicContact CB-CD1 4.44Å; F191-I197 HydrophobicContact CD2-CD1 3.91Å |
| 192 | A | 65.7 | Low | 75.4 | Confident | 27 Ų | 27 | 65.2 Ų | 65.2 | 22% | 0.223 | 33% | 0.33 | C | S | . | . | G | 310 helix | trans | -61.7 | -25.6 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | C190 Q198 | C190-A192 VanDerWaalsContact C-N 3.26Å; C190-A192 PolarHBondContact O-N 2.9Å; A192-Q198 PolarHBondContact O-NE2 2.94Å |
| 193 | N | 69.4 | Low | 76 | Confident | 79 Ų | 79 | 61.4 Ų | 61.4 | 42% | 0.422 | 32% | 0.316 | S | S | . | . | G | 310 helix | trans | -94.2 | 11 | -174.8 | -68 | -28.1 | 0 | 0 | 0 | 114 | F191 F195 T280 | F191-N193 PolarHBondContact O-N 3.38Å; N193-F195 PolarHBondContact O-N 3.49Å; N193-T280 HydrophobicContact CB-CG2 4.48Å; N193-T280 WeakPolarHBondContact OD1-CG2 3.41Å |
| 194 | V | 78.6 | Confident | 76.8 | Confident | 22 Ų | 22 | 61.6 Ų | 61.6 | 13% | 0.133 | 32% | 0.318 | C | S | . | . | trans | -83.8 | 121.5 | -178.1 | -177.9 | 0 | 0 | 0 | 0 | 111.3 | V179 F189 F191 E196 I197 Q198 | V179-V194 HydrophobicContact CG1-CG2 3.69Å; V179-V194 HydrophobicContact CG2-CB 4.45Å; V179-V194 HydrophobicContact CG2-CG1 3.86Å; V179-V194 HydrophobicContact CG2-CG2 4.31Å; F189-V194 HydrophobicContact CE1-CG2 4.41Å; F189-V194 HydrophobicContact CE2-CG2 4.32Å; F189-V194 HydrophobicContact CZ-CG2 3.54Å; F191-V194 PolarHBondContact O-N 2.89Å; V194-E196 VanDerWaalsContact C-N 3.35Å; V194-E196 PolarHBondContact O-N 2.97Å; V194-I197 HydrophobicContact CB-CB 4.17Å; V194-I197 HydrophobicContact CB-CD1 3.98Å; V194-I197 HydrophobicContact CB-CG1 3.93Å; V194-I197 HydrophobicContact CG1-CD1 4.4Å; V194-I197 HydrophobicContact CG1-CG1 4.05Å; V194-I197 HydrophobicContact CG2-CD1 4.38Å; V194-I197 WeakPolarHBondContact O-CB 3.15Å; V194-I197 PolarHBondContact O-N 3.4Å; V194-Q198 PolarHBondContact O-N 3.38Å | ||
| 195 | F | 79.8 | Confident | 77.7 | Confident | 33 Ų | 33 | 50.9 Ų | 50.9 | 15% | 0.145 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -50.8 | -47.2 | -178.7 | -170.1 | -99.5 | 0 | 0 | 0 | 114 | N193 I197 Q198 W199 L266 T270 R276 | N193-F195 PolarHBondContact O-N 3.49Å; F195-I197 VanDerWaalsContact C-N 3.33Å; F195-I197 PolarHBondContact O-N 2.91Å; F195-Q198 PolarHBondContact O-N 3.31Å; F195-W199 AromaticContact CD1-CD1 3.63Å; F195-W199 AromaticContact CD1-NE1 3.7Å; F195-W199 AromaticContact CE1-CD1 3.4Å; F195-W199 VanDerWaalsContact CE1-CD1 3.4Å; F195-W199 AromaticContact CE1-NE1 3Å; F195-W199 AromaticContact CE2-NE1 3.8Å; F195-W199 AromaticContact CZ-CD1 3.87Å; F195-W199 AromaticContact CZ-NE1 3.06Å; F195-W199 VanDerWaalsContact O-CD1 3.27Å; F195-W199 PolarHBondContact O-N 2.97Å; F195-W199 VanDerWaalsContact O-N 3.09Å; F195-L266 HydrophobicContact CD2-CD2 3.47Å; F195-L266 VanDerWaalsContact CD2-CD2 3.47Å; F195-L266 HydrophobicContact CE2-CB 4.32Å; F195-L266 HydrophobicContact CE2-CD2 3.57Å; F195-L266 WeakPolarHBondContact CE2-O 3.36Å; F195-L266 HydrophobicContact CG-CD2 4.02Å; F195-L266 HydrophobicContact CZ-CD2 4.19Å; F195-L266 WeakPolarHBondContact O-CD2 3.09Å; F195-T270 HydrophobicContact CE1-CG2 4.49Å; F195-T270 HydrophobicContact CZ-CG2 3.64Å; F195-R276 HydrophobicContact CD2-CG 4.45Å |
| 196 | E | 82.5 | Confident | 79 | Confident | 119 Ų | 119 | 48.2 Ų | 48.2 | 56% | 0.556 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -68 | -33.5 | -179.1 | -55.5 | -55.5 | 157.6 | 0 | 0 | 112.6 | V194 W199 L200 | V194-E196 VanDerWaalsContact C-N 3.35Å; V194-E196 PolarHBondContact O-N 2.97Å; E196-W199 PolarHBondContact O-N 3.49Å; E196-L200 WeakPolarHBondContact O-CG 3.42Å; E196-L200 PolarHBondContact O-N 3Å; E196-L200 VanDerWaalsContact O-N 3.17Å |
| 197 | I | 82.1 | Confident | 80.1 | Confident | 3 Ų | 3 | 47 Ų | 47 | 2% | 0.015 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -68.7 | -44.2 | 176.6 | -62.9 | -173.5 | 0 | 0 | 0 | 109.7 | P175 V179 F191 V194 F195 W199 L200 E201 | P175-I197 HydrophobicContact CB-CD1 4.19Å; P175-I197 HydrophobicContact CB-CG1 3.91Å; V179-I197 HydrophobicContact CB-CD1 4.33Å; V179-I197 HydrophobicContact CG2-CD1 3.75Å; V179-I197 HydrophobicContact CG2-CG1 4.14Å; F191-I197 HydrophobicContact CB-CD1 4.44Å; F191-I197 HydrophobicContact CD2-CD1 3.91Å; V194-I197 HydrophobicContact CB-CB 4.17Å; V194-I197 HydrophobicContact CB-CD1 3.98Å; V194-I197 HydrophobicContact CB-CG1 3.93Å; V194-I197 HydrophobicContact CG1-CD1 4.4Å; V194-I197 HydrophobicContact CG1-CG1 4.05Å; V194-I197 HydrophobicContact CG2-CD1 4.38Å; V194-I197 WeakPolarHBondContact O-CB 3.15Å; V194-I197 PolarHBondContact O-N 3.4Å; F195-I197 VanDerWaalsContact C-N 3.33Å; F195-I197 PolarHBondContact O-N 2.91Å; I197-W199 VanDerWaalsContact C-N 3.31Å; I197-W199 PolarHBondContact O-N 3.45Å; I197-L200 WeakPolarHBondContact O-CB 3.5Å; I197-L200 PolarHBondContact O-N 3.06Å; I197-L200 VanDerWaalsContact O-N 3.13Å; I197-E201 WeakPolarHBondContact O-CB 3.36Å; I197-E201 PolarHBondContact O-N 3.23Å |
| 198 | Q | 83.5 | Confident | 81.8 | Confident | 8 Ų | 8 | 44.8 Ų | 44.8 | 4% | 0.037 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.3 | -38.5 | 177 | -73.5 | -179.2 | -20 | 0 | 0 | 112.2 | A192 V194 F195 E201 V202 I262 L266 | A192-Q198 PolarHBondContact O-NE2 2.94Å; V194-Q198 PolarHBondContact O-N 3.38Å; F195-Q198 PolarHBondContact O-N 3.31Å; Q198-E201 PolarHBondContact O-N 3.05Å; Q198-V202 WeakPolarHBondContact O-CG2 3.3Å; Q198-V202 PolarHBondContact O-N 3.19Å; Q198-I262 HydrophobicContact CB-CG2 3.72Å; Q198-I262 HydrophobicContact CG-CG2 4Å; Q198-L266 HydrophobicContact CB-CD1 4.06Å; Q198-L266 HydrophobicContact CB-CD2 3.62Å; Q198-L266 HydrophobicContact CB-CG 4.08Å |
| 199 | W | 86.5 | Confident | 83.2 | Confident | 85 Ų | 85 | 38.4 Ų | 38.4 | 32% | 0.322 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -64.4 | -42.2 | 172.9 | -85.4 | 109.3 | 0 | 0 | 0 | 113.1 | F195 E196 I197 E201 T203 L266 T270 | F195-W199 AromaticContact CD1-CD1 3.63Å; F195-W199 AromaticContact CD1-NE1 3.7Å; F195-W199 AromaticContact CE1-CD1 3.4Å; F195-W199 VanDerWaalsContact CE1-CD1 3.4Å; F195-W199 AromaticContact CE1-NE1 3Å; F195-W199 AromaticContact CE2-NE1 3.8Å; F195-W199 AromaticContact CZ-CD1 3.87Å; F195-W199 AromaticContact CZ-NE1 3.06Å; F195-W199 VanDerWaalsContact O-CD1 3.27Å; F195-W199 PolarHBondContact O-N 2.97Å; F195-W199 VanDerWaalsContact O-N 3.09Å; E196-W199 PolarHBondContact O-N 3.49Å; I197-W199 VanDerWaalsContact C-N 3.31Å; I197-W199 PolarHBondContact O-N 3.45Å; W199-E201 VanDerWaalsContact C-N 3.32Å; W199-T203 VanDerWaalsContact O-CB 3.25Å; W199-T203 WeakPolarHBondContact O-CB 3.22Å; W199-T203 PolarHBondContact O-N 3.23Å; W199-T203 PolarHBondContact O-OG1 2.97Å; W199-L266 HydrophobicContact CD2-CD1 3.78Å; W199-L266 HydrophobicContact CD2-CD2 4.49Å; W199-L266 HydrophobicContact CE3-CD1 4.15Å; W199-L266 HydrophobicContact CG-CD1 3.96Å; W199-L266 HydrophobicContact CG-CD2 4.18Å; W199-L266 HydrophobicContact CZ2-CB 3.91Å; W199-L266 HydrophobicContact CZ2-CD1 4.47Å; W199-T270 HydrophobicContact CZ2-CG2 3.88Å |
| 200 | L | 87.8 | Confident | 84.5 | Confident | 68 Ų | 68 | 42.3 Ų | 42.3 | 36% | 0.356 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63.3 | -41.9 | 176.5 | -73.1 | 169.6 | 0 | 0 | 0 | 111 | P175 E196 I197 T203 I204 | P175-L200 HydrophobicContact CB-CD1 4.11Å; P175-L200 HydrophobicContact CG-CD1 3.68Å; E196-L200 WeakPolarHBondContact O-CG 3.42Å; E196-L200 PolarHBondContact O-N 3Å; E196-L200 VanDerWaalsContact O-N 3.17Å; I197-L200 WeakPolarHBondContact O-CB 3.5Å; I197-L200 PolarHBondContact O-N 3.06Å; I197-L200 VanDerWaalsContact O-N 3.13Å; L200-T203 PolarHBondContact O-N 3.35Å; L200-I204 HydrophobicContact CD2-CD1 3.85Å; L200-I204 VanDerWaalsContact O-CB 3.29Å; L200-I204 WeakPolarHBondContact O-CB 3.23Å; L200-I204 PolarHBondContact O-N 2.66Å |
| 201 | E | 88.3 | Confident | 85.6 | Confident | 14 Ų | 14 | 44.9 Ų | 44.9 | 7% | 0.065 | 24% | 0.235 | C | C | . | . | I | π-helix | trans | -58.5 | -53.6 | 175.4 | 165.7 | 165.5 | -175.9 | 0 | 0 | 111.7 | M124 Y125 I197 Q198 W199 T203 G205 I262 | M124-E201 HydrophobicContact CE-CB 4.36Å; M124-E201 HydrophobicContact CE-CG 3.82Å; M124-E201 HydrophobicContact SD-CG 3.93Å; Y125-E201 WeakPolarHBondContact OH-CA 3.18Å; I197-E201 WeakPolarHBondContact O-CB 3.36Å; I197-E201 PolarHBondContact O-N 3.23Å; Q198-E201 PolarHBondContact O-N 3.05Å; W199-E201 VanDerWaalsContact C-N 3.32Å; E201-T203 VanDerWaalsContact C-N 3.29Å; E201-T203 PolarHBondContact O-N 3.34Å; E201-G205 WeakPolarHBondContact O-CA 3.46Å; E201-G205 PolarHBondContact O-N 3.03Å; E201-I262 HydrophobicContact CG-CD1 4.43Å; E201-I262 WeakPolarHBondContact OE1-CD1 3.18Å |
| 202 | V | 89.7 | Confident | 86.7 | Confident | 6 Ų | 6 | 48 Ų | 48 | 4% | 0.036 | 25% | 0.251 | C | S | . | . | I | π-helix | trans | -62.3 | -38 | 178.1 | 174.6 | 0 | 0 | 0 | 0 | 111.5 | Q198 F206 L207 I262 S263 L266 | Q198-V202 WeakPolarHBondContact O-CG2 3.3Å; Q198-V202 PolarHBondContact O-N 3.19Å; V202-F206 VanDerWaalsContact O-CB 3.3Å; V202-F206 WeakPolarHBondContact O-CB 3.3Å; V202-F206 PolarHBondContact O-N 3.17Å; V202-L207 HydrophobicContact CG1-CD1 4.15Å; V202-L207 HydrophobicContact CG1-CG 4.32Å; V202-L207 WeakPolarHBondContact O-CG 3.3Å; V202-L207 PolarHBondContact O-N 3.35Å; V202-I262 HydrophobicContact CG2-CB 4.23Å; V202-I262 HydrophobicContact CG2-CG2 3.76Å; V202-S263 WeakPolarHBondContact CG1-OG 3.48Å; V202-L266 HydrophobicContact CG2-CD1 4.09Å |
| 203 | T | 91.4 | Very high | 88 | Confident | 54 Ų | 54 | 47 Ų | 47 | 33% | 0.331 | 24% | 0.242 | S | C | . | . | I | π-helix | trans | -76.9 | -54.3 | -175 | -55 | 0 | 0 | 0 | 0 | 112.1 | W199 L200 E201 L207 V208 | W199-T203 VanDerWaalsContact O-CB 3.25Å; W199-T203 WeakPolarHBondContact O-CB 3.22Å; W199-T203 PolarHBondContact O-N 3.23Å; W199-T203 PolarHBondContact O-OG1 2.97Å; L200-T203 PolarHBondContact O-N 3.35Å; E201-T203 VanDerWaalsContact C-N 3.29Å; E201-T203 PolarHBondContact O-N 3.34Å; T203-L207 PolarHBondContact O-N 2.96Å; T203-V208 HydrophobicContact CG2-CG2 4.23Å; T203-V208 WeakPolarHBondContact O-CB 3.26Å; T203-V208 WeakPolarHBondContact O-CG2 3.41Å; T203-V208 PolarHBondContact O-N 3.31Å |
| 204 | I | 92.1 | Very high | 89.1 | Confident | 60 Ų | 60 | 45.2 Ų | 45.2 | 31% | 0.308 | 24% | 0.242 | S | C | . | . | I | π-helix | trans | -86.8 | -34 | -173 | -60.5 | 177.3 | 0 | 0 | 0 | 111.1 | Y125 F129 L200 P209 | Y125-I204 HydrophobicContact CD1-CG2 4.27Å; Y125-I204 HydrophobicContact CE1-CB 4.13Å; Y125-I204 HydrophobicContact CE1-CG2 3.96Å; F129-I204 HydrophobicContact CE1-CG2 3.93Å; F129-I204 HydrophobicContact CZ-CG2 3.61Å; L200-I204 HydrophobicContact CD2-CD1 3.85Å; L200-I204 VanDerWaalsContact O-CB 3.29Å; L200-I204 WeakPolarHBondContact O-CB 3.23Å; L200-I204 PolarHBondContact O-N 2.66Å; I204-P209 WeakPolarHBondContact O-CD 3.44Å; I204-P209 WeakPolarHBondContact O-CG 3.3Å |
| 205 | G | 88.6 | Confident | 89.9 | Confident | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 26% | 0.263 | C | S | . | . | I | π-helix | trans | -80.2 | -22.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | E201 | E201-G205 WeakPolarHBondContact O-CA 3.46Å; E201-G205 PolarHBondContact O-N 3.03Å |
| 206 | F | 90.5 | Very high | 90.5 | Very high | 19 Ų | 19 | 48.2 Ų | 48.2 | 8% | 0.083 | 26% | 0.259 | C | S | . | . | I | π-helix | trans | -131.5 | -65.5 | -174 | -161.1 | -91.5 | 0 | 0 | 0 | 114.6 | V202 P209 F210 F252 L256 N259 | V202-F206 VanDerWaalsContact O-CB 3.3Å; V202-F206 WeakPolarHBondContact O-CB 3.3Å; V202-F206 PolarHBondContact O-N 3.17Å; F206-P209 WeakPolarHBondContact O-CD 3.33Å; F206-F210 WeakPolarHBondContact O-CB 3.43Å; F206-F210 PolarHBondContact O-N 3Å; F206-F252 HydrophobicContact CD2-CD1 4.2Å; F206-F252 HydrophobicContact CD2-CE1 4.22Å; F206-F252 HydrophobicContact CE1-CD1 4.46Å; F206-F252 AromaticContact CE2-CD1 3.48Å; F206-F252 HydrophobicContact CE2-CD1 3.48Å; F206-F252 VanDerWaalsContact CE2-CD1 3.48Å; F206-F252 AromaticContact CE2-CE1 3.93Å; F206-F252 HydrophobicContact CE2-CE1 3.93Å; F206-F252 AromaticContact CZ-CD1 3.6Å; F206-F252 HydrophobicContact CZ-CD1 3.6Å; F206-F252 HydrophobicContact CZ-CE1 4.09Å; F206-L256 HydrophobicContact CE1-CD1 3.77Å; F206-L256 HydrophobicContact CE2-CB 4.01Å; F206-L256 HydrophobicContact CE2-CD1 4.27Å; F206-L256 HydrophobicContact CZ-CB 3.8Å; F206-L256 HydrophobicContact CZ-CD1 3.36Å; F206-L256 HydrophobicContact CZ-CG 4.17Å; F206-N259 HydrophobicContact CB-CB 4.3Å; F206-N259 WeakPolarHBondContact CB-OD1 3.41Å; F206-N259 HydrophobicContact CD1-CB 4.45Å; F206-N259 HydrophobicContact CD2-CB 3.88Å; F206-N259 HydrophobicContact CE2-CB 4.31Å; F206-N259 HydrophobicContact CG-CB 3.96Å |
| 207 | L | 92.6 | Very high | 90.9 | Very high | 90 Ų | 90 | 44.2 Ų | 44.2 | 47% | 0.471 | 24% | 0.238 | S | C | . | . | I | π-helix | trans | -65.5 | -46.4 | -168.5 | -67 | 175.5 | 0 | 0 | 0 | 114 | V202 T203 S211 | V202-L207 HydrophobicContact CG1-CD1 4.15Å; V202-L207 HydrophobicContact CG1-CG 4.32Å; V202-L207 WeakPolarHBondContact O-CG 3.3Å; V202-L207 PolarHBondContact O-N 3.35Å; T203-L207 PolarHBondContact O-N 2.96Å; L207-S211 WeakPolarHBondContact O-CB 3.35Å; L207-S211 PolarHBondContact O-N 3.03Å; L207-S211 PolarHBondContact O-OG 3.48Å |
| 208 | V | 94.5 | Very high | 91.3 | Very high | 72 Ų | 72 | 46.2 Ų | 46.2 | 44% | 0.436 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -65.7 | -51.9 | 179.6 | 167.8 | 0 | 0 | 0 | 0 | 110.7 | T203 F210 S211 I212 | T203-V208 HydrophobicContact CG2-CG2 4.23Å; T203-V208 WeakPolarHBondContact O-CB 3.26Å; T203-V208 WeakPolarHBondContact O-CG2 3.41Å; T203-V208 PolarHBondContact O-N 3.31Å; V208-F210 PolarHBondContact O-N 3.17Å; V208-S211 WeakPolarHBondContact O-CB 3.25Å; V208-S211 PolarHBondContact O-N 2.93Å; V208-I212 HydrophobicContact CG1-CD1 3.77Å; V208-I212 HydrophobicContact CG1-CG1 4.49Å; V208-I212 WeakPolarHBondContact O-CG1 3.35Å; V208-I212 PolarHBondContact O-N 3.09Å |
| 209 | P | 94.1 | Very high | 91.6 | Very high | 4 Ų | 4 | 48.7 Ų | 48.7 | 3% | 0.026 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -57.3 | -44.1 | 174 | -28.5 | 35.9 | 0 | 0 | 0 | 114.4 | I128 T132 I204 F206 S211 I212 I213 | I128-P209 HydrophobicContact CD1-CB 3.74Å; I128-P209 HydrophobicContact CG1-CB 3.29Å; I128-P209 HydrophobicContact CG1-CG 3.59Å; I128-P209 HydrophobicContact CG2-CG 4.19Å; T132-P209 WeakPolarHBondContact OG1-CB 3.3Å; I204-P209 WeakPolarHBondContact O-CD 3.44Å; I204-P209 WeakPolarHBondContact O-CG 3.3Å; F206-P209 WeakPolarHBondContact O-CD 3.33Å; P209-S211 VanDerWaalsContact C-N 3.27Å; P209-S211 PolarHBondContact O-N 3.01Å; P209-I212 PolarHBondContact O-N 2.96Å; P209-I213 VanDerWaalsContact O-CB 3.28Å; P209-I213 WeakPolarHBondContact O-CB 3.46Å; P209-I213 VanDerWaalsContact O-CG1 3.22Å; P209-I213 WeakPolarHBondContact O-CG1 3.34Å; P209-I213 PolarHBondContact O-N 2.99Å |
| 210 | F | 93.1 | Very high | 91.7 | Very high | 111 Ų | 111 | 44.7 Ų | 44.7 | 49% | 0.487 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -56 | -45.1 | 177 | 179.7 | -94.7 | 0 | 0 | 0 | 111.4 | F206 V208 G214 F252 | F206-F210 WeakPolarHBondContact O-CB 3.43Å; F206-F210 PolarHBondContact O-N 3Å; V208-F210 PolarHBondContact O-N 3.17Å; F210-G214 PolarHBondContact O-N 2.78Å; F210-F252 HydrophobicContact CB-CE1 3.77Å; F210-F252 HydrophobicContact CB-CZ 3.72Å; F210-F252 AromaticContact CD2-CD1 3.93Å; F210-F252 HydrophobicContact CD2-CD1 3.93Å; F210-F252 HydrophobicContact CD2-CD2 4.17Å; F210-F252 AromaticContact CD2-CE1 3.62Å; F210-F252 HydrophobicContact CD2-CE1 3.62Å; F210-F252 AromaticContact CD2-CE2 3.84Å; F210-F252 HydrophobicContact CD2-CE2 3.84Å; F210-F252 HydrophobicContact CD2-CG 4.23Å; F210-F252 AromaticContact CD2-CZ 3.59Å; F210-F252 HydrophobicContact CD2-CZ 3.59Å; F210-F252 HydrophobicContact CG-CE1 4.19Å; F210-F252 HydrophobicContact CG-CZ 4.14Å |
| 211 | S | 94.6 | Very high | 91.6 | Very high | 67 Ų | 67 | 45.4 Ų | 45.4 | 47% | 0.469 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -63.5 | -47.7 | 177.5 | -57.9 | 0 | 0 | 0 | 0 | 111.8 | L207 V208 P209 I213 G214 L215 | L207-S211 WeakPolarHBondContact O-CB 3.35Å; L207-S211 PolarHBondContact O-N 3.03Å; L207-S211 PolarHBondContact O-OG 3.48Å; V208-S211 WeakPolarHBondContact O-CB 3.25Å; V208-S211 PolarHBondContact O-N 2.93Å; P209-S211 VanDerWaalsContact C-N 3.27Å; P209-S211 PolarHBondContact O-N 3.01Å; S211-I213 PolarHBondContact O-N 3.25Å; S211-G214 PolarHBondContact O-N 3.28Å; S211-L215 WeakPolarHBondContact O-CB 3.23Å; S211-L215 VanDerWaalsContact O-CG 3.26Å; S211-L215 WeakPolarHBondContact O-CG 3.42Å; S211-L215 PolarHBondContact O-N 2.87Å |
| 212 | I | 95.4 | Very high | 91.5 | Very high | 68 Ų | 68 | 52.3 Ų | 52.3 | 35% | 0.349 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -63.2 | -44.7 | 179.5 | -65 | 167.5 | 0 | 0 | 0 | 111.1 | T132 V208 P209 L215 C216 | T132-I212 HydrophobicContact CG2-CB 3.9Å; T132-I212 HydrophobicContact CG2-CD1 4.3Å; T132-I212 HydrophobicContact CG2-CG2 3.47Å; T132-I212 VanDerWaalsContact CG2-CG2 3.47Å; V208-I212 HydrophobicContact CG1-CD1 3.77Å; V208-I212 HydrophobicContact CG1-CG1 4.49Å; V208-I212 WeakPolarHBondContact O-CG1 3.35Å; V208-I212 PolarHBondContact O-N 3.09Å; P209-I212 PolarHBondContact O-N 2.96Å; I212-L215 PolarHBondContact O-N 3.43Å; I212-C216 WeakPolarHBondContact O-CB 3.14Å; I212-C216 PolarHBondContact O-N 3.24Å; I212-C216 PolarHBondContact O-SG 3.35Å |
| 213 | I | 93.8 | Very high | 91.2 | Very high | 5 Ų | 5 | 53 Ų | 53 | 3% | 0.026 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -63.2 | -46.9 | 178.4 | -71.7 | 172.2 | 0 | 0 | 0 | 110.1 | I128 T132 P209 S211 L215 C216 Y217 V248 F252 | I128-I213 HydrophobicContact CD1-CD1 3.91Å; T132-I213 HydrophobicContact CG2-CG1 4.31Å; P209-I213 VanDerWaalsContact O-CB 3.28Å; P209-I213 WeakPolarHBondContact O-CB 3.46Å; P209-I213 VanDerWaalsContact O-CG1 3.22Å; P209-I213 WeakPolarHBondContact O-CG1 3.34Å; P209-I213 PolarHBondContact O-N 2.99Å; S211-I213 PolarHBondContact O-N 3.25Å; I213-L215 VanDerWaalsContact C-N 3.33Å; I213-L215 PolarHBondContact O-N 3.28Å; I213-C216 WeakPolarHBondContact O-CB 3.26Å; I213-C216 PolarHBondContact O-N 3.3Å; I213-Y217 HydrophobicContact CG2-CD2 3.52Å; I213-Y217 HydrophobicContact CG2-CE2 3.47Å; I213-Y217 VanDerWaalsContact CG2-CE2 3.47Å; I213-Y217 WeakPolarHBondContact O-CD2 3.34Å; I213-Y217 PolarHBondContact O-N 2.88Å; I213-V248 HydrophobicContact CG2-CG1 3.69Å; I213-V248 HydrophobicContact CG2-CG2 4.35Å; I213-F252 HydrophobicContact CD1-CE2 4.13Å; I213-F252 HydrophobicContact CD1-CZ 4.15Å |
| 214 | G | 92.4 | Very high | 90.7 | Very high | 41 Ų | 41 | 51.5 Ų | 51.5 | 42% | 0.423 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -57.5 | -44.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | F210 S211 Y217 S218 | F210-G214 PolarHBondContact O-N 2.78Å; S211-G214 PolarHBondContact O-N 3.28Å; G214-Y217 PolarHBondContact O-N 2.89Å; G214-S218 WeakPolarHBondContact O-CB 3.43Å; G214-S218 PolarHBondContact O-N 3.46Å |
| 215 | L | 94.3 | Very high | 90.2 | Very high | 112 Ų | 112 | 54.5 Ų | 54.5 | 59% | 0.586 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -61.7 | -49.5 | 174.1 | -71.2 | 173.8 | 0 | 0 | 0 | 111.5 | S211 I212 I213 Y217 S218 L219 | S211-L215 WeakPolarHBondContact O-CB 3.23Å; S211-L215 VanDerWaalsContact O-CG 3.26Å; S211-L215 WeakPolarHBondContact O-CG 3.42Å; S211-L215 PolarHBondContact O-N 2.87Å; I212-L215 PolarHBondContact O-N 3.43Å; I213-L215 VanDerWaalsContact C-N 3.33Å; I213-L215 PolarHBondContact O-N 3.28Å; L215-Y217 VanDerWaalsContact C-N 3.33Å; L215-Y217 PolarHBondContact O-N 2.67Å; L215-S218 PolarHBondContact O-N 3.1Å; L215-S218 PolarHBondContact O-OG 3.36Å; L215-L219 WeakPolarHBondContact O-CG 3.18Å; L215-L219 PolarHBondContact O-N 3.01Å |
| 216 | C | 93.1 | Very high | 89.7 | Confident | 7 Ų | 7 | 63.4 Ų | 63.4 | 5% | 0.047 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -54.1 | -48.9 | 177.2 | -71.5 | 0 | 0 | 0 | 0 | 111.6 | I212 I213 L219 I220 | I212-C216 WeakPolarHBondContact O-CB 3.14Å; I212-C216 PolarHBondContact O-N 3.24Å; I212-C216 PolarHBondContact O-SG 3.35Å; I213-C216 WeakPolarHBondContact O-CB 3.26Å; I213-C216 PolarHBondContact O-N 3.3Å; C216-L219 PolarHBondContact O-N 3.44Å; C216-I220 VanDerWaalsContact O-CG1 3.23Å; C216-I220 WeakPolarHBondContact O-CG1 3.45Å; C216-I220 PolarHBondContact O-N 3.23Å |
| 217 | Y | 90.3 | Very high | 88.9 | Confident | 34 Ų | 34 | 63.6 Ų | 63.6 | 13% | 0.133 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -67.3 | -37.6 | 179.3 | -79 | -66.5 | 0 | 0 | 0 | 113 | I213 G214 L215 L219 I220 V221 L241 I244 V245 V248 | I213-Y217 HydrophobicContact CG2-CD2 3.52Å; I213-Y217 HydrophobicContact CG2-CE2 3.47Å; I213-Y217 VanDerWaalsContact CG2-CE2 3.47Å; I213-Y217 WeakPolarHBondContact O-CD2 3.34Å; I213-Y217 PolarHBondContact O-N 2.88Å; G214-Y217 PolarHBondContact O-N 2.89Å; L215-Y217 VanDerWaalsContact C-N 3.33Å; L215-Y217 PolarHBondContact O-N 2.67Å; Y217-L219 VanDerWaalsContact C-N 3.29Å; Y217-L219 PolarHBondContact O-N 3.41Å; Y217-I220 HydrophobicContact CD1-CD1 4.18Å; Y217-I220 HydrophobicContact CE1-CD1 4.43Å; Y217-I220 PolarHBondContact O-N 3.23Å; Y217-V221 VanDerWaalsContact O-CG2 3.31Å; Y217-V221 WeakPolarHBondContact O-CG2 3.4Å; Y217-V221 PolarHBondContact O-N 3.25Å; Y217-L241 HydrophobicContact CD1-CD1 4.12Å; Y217-L241 HydrophobicContact CE1-CD1 3.59Å; Y217-L241 HydrophobicContact CE1-CG 4.46Å; Y217-I244 VanDerWaalsContact OH-C 3.25Å; Y217-I244 WeakPolarHBondContact OH-CG2 3.1Å; Y217-I244 PolarHBondContact OH-O 3.12Å; Y217-V245 HydrophobicContact CD1-CG2 3.96Å; Y217-V245 HydrophobicContact CE1-CG2 3.26Å; Y217-V245 PolarHBondContact OH-N 3.45Å; Y217-V248 HydrophobicContact CE2-CG1 4.3Å; Y217-V248 HydrophobicContact CE2-CG2 4.21Å |
| 218 | S | 89.8 | Confident | 87.7 | Confident | 45 Ų | 45 | 64 Ų | 64 | 32% | 0.315 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -60.1 | -40.9 | 174.1 | 80.1 | 0 | 0 | 0 | 0 | 111.7 | G214 L215 V221 R222 | G214-S218 WeakPolarHBondContact O-CB 3.43Å; G214-S218 PolarHBondContact O-N 3.46Å; L215-S218 PolarHBondContact O-N 3.1Å; L215-S218 PolarHBondContact O-OG 3.36Å; S218-V221 PolarHBondContact O-N 2.87Å; S218-R222 VanDerWaalsContact O-CG 3.29Å; S218-R222 WeakPolarHBondContact O-CG 3.35Å; S218-R222 PolarHBondContact O-N 3.06Å |
| 219 | L | 90.8 | Very high | 86.1 | Confident | 60 Ų | 60 | 69.3 Ų | 69.3 | 31% | 0.314 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -69.7 | -40.5 | 176.9 | -65.8 | 176 | 0 | 0 | 0 | 111.7 | Y139 L215 C216 Y217 R222 I223 | Y139-L219 HydrophobicContact CD2-CB 3.82Å; Y139-L219 HydrophobicContact CD2-CD1 4.48Å; Y139-L219 HydrophobicContact CE2-CB 3.64Å; Y139-L219 HydrophobicContact CE2-CD1 3.99Å; Y139-L219 HydrophobicContact CE2-CG 4.42Å; L215-L219 WeakPolarHBondContact O-CG 3.18Å; L215-L219 PolarHBondContact O-N 3.01Å; C216-L219 PolarHBondContact O-N 3.44Å; Y217-L219 VanDerWaalsContact C-N 3.29Å; Y217-L219 PolarHBondContact O-N 3.41Å; L219-R222 PolarHBondContact O-N 3.46Å; L219-I223 WeakPolarHBondContact O-CG1 3.32Å; L219-I223 PolarHBondContact O-N 3.1Å |
| 220 | I | 87.7 | Confident | 84.3 | Confident | 1 Ų | 1 | 76.7 Ų | 76.7 | 1% | 0.005 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -60 | -47.1 | 174.4 | -71.2 | 165.8 | 0 | 0 | 0 | 110.5 | R138 Y139 L142 C216 Y217 R222 I223 L224 L241 | R138-I220 HydrophobicContact CB-CD1 4.48Å; R138-I220 HydrophobicContact CG-CD1 4.28Å; Y139-I220 HydrophobicContact CD2-CG1 4.26Å; L142-I220 HydrophobicContact CD1-CB 4.46Å; L142-I220 HydrophobicContact CD1-CG1 4.18Å; L142-I220 HydrophobicContact CD1-CG2 3.64Å; C216-I220 VanDerWaalsContact O-CG1 3.23Å; C216-I220 WeakPolarHBondContact O-CG1 3.45Å; C216-I220 PolarHBondContact O-N 3.23Å; Y217-I220 HydrophobicContact CD1-CD1 4.18Å; Y217-I220 HydrophobicContact CE1-CD1 4.43Å; Y217-I220 PolarHBondContact O-N 3.23Å; I220-R222 VanDerWaalsContact C-N 3.34Å; I220-R222 PolarHBondContact O-N 3.11Å; I220-I223 PolarHBondContact O-N 3.21Å; I220-L224 HydrophobicContact CG2-CD1 3.8Å; I220-L224 HydrophobicContact CG2-CG 4.25Å; I220-L224 WeakPolarHBondContact O-CB 3.41Å; I220-L224 VanDerWaalsContact O-CG 3.3Å; I220-L224 WeakPolarHBondContact O-CG 3.37Å; I220-L224 PolarHBondContact O-N 2.81Å; I220-L241 HydrophobicContact CD1-CD1 3.98Å; I220-L241 HydrophobicContact CG2-CD1 3.87Å; I220-L241 HydrophobicContact CG2-CD2 3.68Å; I220-L241 HydrophobicContact CG2-CG 4.46Å |
| 221 | V | 85.9 | Confident | 82.3 | Confident | 84 Ų | 84 | 83.4 Ų | 83.4 | 51% | 0.509 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -59.3 | -45.8 | 176.9 | 170.1 | 0 | 0 | 0 | 0 | 110.4 | Y217 S218 I223 L224 M225 | Y217-V221 VanDerWaalsContact O-CG2 3.31Å; Y217-V221 WeakPolarHBondContact O-CG2 3.4Å; Y217-V221 PolarHBondContact O-N 3.25Å; S218-V221 PolarHBondContact O-N 2.87Å; V221-I223 VanDerWaalsContact C-N 3.34Å; V221-I223 PolarHBondContact O-N 3.09Å; V221-L224 PolarHBondContact O-N 3.12Å; V221-M225 HydrophobicContact CG1-CG 4.21Å; V221-M225 WeakPolarHBondContact O-CB 2.92Å; V221-M225 VanDerWaalsContact O-CG 3.23Å; V221-M225 WeakPolarHBondContact O-CG 3.14Å; V221-M225 PolarHBondContact O-N 3.06Å |
| 222 | R | 86.8 | Confident | 80.4 | Confident | 158 Ų | 158 | 83.2 Ų | 83.2 | 60% | 0.596 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -57.9 | -44 | 175.6 | -72.3 | 172 | -176.2 | -172.9 | 2.4 | 112.4 | S218 L219 I220 R226 | S218-R222 VanDerWaalsContact O-CG 3.29Å; S218-R222 WeakPolarHBondContact O-CG 3.35Å; S218-R222 PolarHBondContact O-N 3.06Å; L219-R222 PolarHBondContact O-N 3.46Å; I220-R222 VanDerWaalsContact C-N 3.34Å; I220-R222 PolarHBondContact O-N 3.11Å; R222-R226 WeakPolarHBondContact O-CG 3.38Å; R222-R226 PolarHBondContact O-N 2.98Å; R222-R226 VanDerWaalsContact O-N 3.08Å |
| 223 | I | 83.6 | Confident | 78.4 | Confident | 21 Ų | 21 | 85.7 Ų | 85.7 | 11% | 0.108 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -62 | -46.2 | 176.2 | -75.2 | 169 | 0 | 0 | 0 | 110.9 | Y139 L142 A143 M146 L219 I220 V221 M225 R226 A227 | Y139-I223 HydrophobicContact CD2-CD1 3.92Å; Y139-I223 HydrophobicContact CE2-CD1 3.59Å; L142-I223 HydrophobicContact CB-CG2 4.39Å; A143-I223 HydrophobicContact CB-CD1 3.97Å; M146-I223 HydrophobicContact SD-CG2 3.59Å; M146-I223 VanDerWaalsContact SD-CG2 3.59Å; L219-I223 WeakPolarHBondContact O-CG1 3.32Å; L219-I223 PolarHBondContact O-N 3.1Å; I220-I223 PolarHBondContact O-N 3.21Å; V221-I223 VanDerWaalsContact C-N 3.34Å; V221-I223 PolarHBondContact O-N 3.09Å; I223-M225 PolarHBondContact O-N 3.44Å; I223-R226 PolarHBondContact O-N 3.39Å; I223-A227 WeakPolarHBondContact O-CB 3.5Å; I223-A227 PolarHBondContact O-N 3.39Å |
| 224 | L | 81.2 | Confident | 76.6 | Confident | 23 Ų | 23 | 90.8 Ų | 90.8 | 12% | 0.12 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -64.7 | -40.4 | -179.3 | -70.8 | 173.7 | 0 | 0 | 0 | 112.3 | I220 V221 A227 Q228 L241 | I220-L224 HydrophobicContact CG2-CD1 3.8Å; I220-L224 HydrophobicContact CG2-CG 4.25Å; I220-L224 WeakPolarHBondContact O-CB 3.41Å; I220-L224 VanDerWaalsContact O-CG 3.3Å; I220-L224 WeakPolarHBondContact O-CG 3.37Å; I220-L224 PolarHBondContact O-N 2.81Å; V221-L224 PolarHBondContact O-N 3.12Å; L224-A227 PolarHBondContact O-N 3.49Å; L224-Q228 WeakPolarHBondContact O-CB 3.21Å; L224-Q228 PolarHBondContact O-N 2.88Å; L224-L241 HydrophobicContact CD1-CD2 3.67Å |
| 225 | M | 81.1 | Confident | 74.7 | Confident | 123 Ų | 123 | 93.6 Ų | 93.6 | 61% | 0.606 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -64.1 | -41 | 175.8 | -69 | -63.8 | -72.5 | 0 | 0 | 111.7 | V221 I223 | V221-M225 HydrophobicContact CG1-CG 4.21Å; V221-M225 WeakPolarHBondContact O-CB 2.92Å; V221-M225 VanDerWaalsContact O-CG 3.23Å; V221-M225 WeakPolarHBondContact O-CG 3.14Å; V221-M225 PolarHBondContact O-N 3.06Å; I223-M225 PolarHBondContact O-N 3.44Å |
| 226 | R | 78.8 | Confident | 72.7 | Confident | 186 Ų | 186 | 99.4 Ų | 99.4 | 70% | 0.702 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -66.4 | -41.1 | 174.3 | -72.2 | 177.4 | -179.4 | -176.7 | 0.1 | 112 | R222 I223 K229 | R222-R226 WeakPolarHBondContact O-CG 3.38Å; R222-R226 PolarHBondContact O-N 2.98Å; R222-R226 VanDerWaalsContact O-N 3.08Å; I223-R226 PolarHBondContact O-N 3.39Å; R226-K229 WeakPolarHBondContact O-CB 3.39Å; R226-K229 PolarHBondContact O-N 3.45Å |
| 227 | A | 73.7 | Confident | 71.2 | Confident | 24 Ų | 24 | 101.2 Ų | 101.2 | 20% | 0.198 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -69.9 | -32.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | I223 L224 K229 H230 | I223-A227 WeakPolarHBondContact O-CB 3.5Å; I223-A227 PolarHBondContact O-N 3.39Å; L224-A227 PolarHBondContact O-N 3.49Å; A227-K229 PolarHBondContact O-N 3.04Å; A227-H230 CarbonylContact O-C 3.45Å; A227-H230 WeakPolarHBondContact O-CA 3.45Å; A227-H230 PolarHBondContact O-N 3.33Å |
| 228 | Q | 67.8 | Low | 70 | Confident | 99 Ų | 99 | 103.3 Ų | 103.3 | 46% | 0.463 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.6 | -25.9 | 175.8 | -171.7 | 178.2 | -14.9 | 0 | 0 | 112.7 | L224 H230 W234 | L224-Q228 WeakPolarHBondContact O-CB 3.21Å; L224-Q228 PolarHBondContact O-N 2.88Å; Q228-H230 PolarHBondContact O-N 2.77Å; Q228-W234 HydrophobicContact CB-CZ2 4.5Å; Q228-W234 HydrophobicContact CG-CZ2 3.82Å |
| 229 | K | 59 | Low | 68.8 | Low | 183 Ų | 183 | 105.8 Ų | 105.8 | 80% | 0.796 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.5 | -20.6 | 173 | -160.9 | 172.8 | -179.3 | 179.3 | 0 | 112.9 | R226 A227 | R226-K229 WeakPolarHBondContact O-CB 3.39Å; R226-K229 PolarHBondContact O-N 3.45Å; A227-K229 PolarHBondContact O-N 3.04Å |
| 230 | H | 56.2 | Low | 67.6 | Low | 158 Ų | 158 | 104.7 Ų | 104.7 | 73% | 0.731 | 49% | 0.49 | S | S | * | . | S | Bend | trans | -118.2 | 99.6 | 176.8 | -71.5 | -84.2 | 0 | 0 | 0 | 110.5 | A227 Q228 | A227-H230 CarbonylContact O-C 3.45Å; A227-H230 WeakPolarHBondContact O-CA 3.45Å; A227-H230 PolarHBondContact O-N 3.33Å; Q228-H230 PolarHBondContact O-N 2.77Å |
| 231 | R | 53 | Low | 67.1 | Low | 252 Ų | 252 | 105.6 Ų | 105.6 | 95% | 0.951 | 49% | 0.494 | S | S | * | . | trans | -45.2 | 139.1 | -171.1 | -67.7 | -179.3 | 174.8 | -176.2 | -1.9 | 115.3 | ||||
| 232 | G | 53.9 | Low | 66.9 | Low | 63 Ų | 63 | 109 Ų | 109 | 65% | 0.649 | 50% | 0.498 | S | S | * | . | S | Bend | trans | 136.1 | -42.2 | 144.8 | 0 | 0 | 0 | 0 | 0 | 119.2 | W234 | G232-W234 PolarHBondContact O-N 2.79Š|
| 233 | L | 54 | Low | 66.6 | Low | 120 Ų | 120 | 102.3 Ų | 102.3 | 63% | 0.628 | 47% | 0.474 | S | S | * | . | trans | -92.7 | 13.6 | -171 | -89.8 | 85.9 | 0 | 0 | 0 | 115.5 | ||||
| 234 | W | 55.4 | Low | 66.6 | Low | 112 Ų | 112 | 102.2 Ų | 102.2 | 42% | 0.424 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -59 | -44.8 | -169.4 | -131.7 | 48.9 | 0 | 0 | 0 | 115.9 | Q228 G232 | Q228-W234 HydrophobicContact CB-CZ2 4.5Å; Q228-W234 HydrophobicContact CG-CZ2 3.82Å; G232-W234 PolarHBondContact O-N 2.79Å |
| 235 | P | 51.5 | Low | 66.8 | Low | 100 Ų | 100 | 103.4 Ų | 103.4 | 65% | 0.649 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -74.5 | -37.6 | -166.3 | -19.7 | 32.5 | 0 | 0 | 0 | 116 | ||
| 236 | R | 52.5 | Low | 67.2 | Low | 234 Ų | 234 | 99.7 Ų | 99.7 | 88% | 0.883 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -75.9 | -25.6 | -177.4 | -82.5 | -178.3 | 176.2 | 158.4 | -0.9 | 113.2 | ||
| 237 | R | 61.4 | Low | 67.6 | Low | 46 Ų | 46 | 91 Ų | 91 | 17% | 0.174 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -79.3 | -31.7 | -175.5 | -68.5 | -178.6 | 179.5 | -170.8 | 3.8 | 113.5 | L142 S145 | L142-R237 HydrophobicContact CD2-CB 4.14Å; L142-R237 HydrophobicContact CD2-CG 4.13Å; S145-R237 PolarHBondContact OG-NH2 3.49Å |
| 238 | Q | 65.3 | Low | 68.3 | Low | 77 Ų | 77 | 90.3 Ų | 90.3 | 36% | 0.36 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -73.5 | -24.6 | 179.2 | -77.5 | -178.7 | -18.1 | 0 | 0 | 113.8 | L241 R242 | Q238-L241 PolarHBondContact O-N 3.23Å; Q238-R242 WeakPolarHBondContact O-CB 3.49Å; Q238-R242 PolarHBondContact O-N 3.15Å |
| 239 | K | 66.3 | Low | 69.4 | Low | 98 Ų | 98 | 90.1 Ų | 90.1 | 43% | 0.426 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -73.9 | -47.6 | -170.4 | -161.5 | 171.6 | -169.9 | 170.1 | 0 | 113.4 | L241 R242 M243 E312 | K239-L241 VanDerWaalsContact C-N 3.28Å; K239-L241 PolarHBondContact O-N 3.43Å; K239-R242 WeakPolarHBondContact O-CB 3.29Å; K239-R242 PolarHBondContact O-N 3.46Å; K239-M243 PolarHBondContact O-N 3.41Å; K239-E312 WeakPolarHBondContact CE-OE1 3.36Å; K239-E312 WeakPolarHBondContact CE-OE2 3.15Å; K239-E312 IonicContact NZ-OE1 3.89Å; K239-E312 PolarHBondContact NZ-OE1 2.92Å; K239-E312 IonicContact NZ-OE2 2.64Å; K239-E312 PolarHBondContact NZ-OE2 3.43Å |
| 240 | A | 65.1 | Low | 71 | Confident | 37 Ų | 37 | 82.7 Ų | 82.7 | 31% | 0.306 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -64.8 | -35.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | M243 I244 | A240-M243 PolarHBondContact O-N 2.88Å; A240-I244 WeakPolarHBondContact O-CG1 3.32Å; A240-I244 PolarHBondContact O-N 3.34Å |
| 241 | L | 76.6 | Confident | 72.6 | Confident | 19 Ų | 19 | 75.2 Ų | 75.2 | 10% | 0.099 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -64.1 | -44 | 174.2 | -174.7 | 68.7 | 0 | 0 | 0 | 111.7 | R138 Y217 I220 L224 Q238 K239 M243 I244 V245 | R138-L241 HydrophobicContact CG-CD1 3.9Å; Y217-L241 HydrophobicContact CD1-CD1 4.12Å; Y217-L241 HydrophobicContact CE1-CD1 3.59Å; Y217-L241 HydrophobicContact CE1-CG 4.46Å; I220-L241 HydrophobicContact CD1-CD1 3.98Å; I220-L241 HydrophobicContact CG2-CD1 3.87Å; I220-L241 HydrophobicContact CG2-CD2 3.68Å; I220-L241 HydrophobicContact CG2-CG 4.46Å; L224-L241 HydrophobicContact CD1-CD2 3.67Å; Q238-L241 PolarHBondContact O-N 3.23Å; K239-L241 VanDerWaalsContact C-N 3.28Å; K239-L241 PolarHBondContact O-N 3.43Å; L241-M243 VanDerWaalsContact C-N 3.29Å; L241-M243 PolarHBondContact O-N 2.81Å; L241-I244 PolarHBondContact O-N 3.31Å; L241-V245 HydrophobicContact CG-CG2 4.32Å; L241-V245 VanDerWaalsContact O-CG2 3.29Å; L241-V245 WeakPolarHBondContact O-CG2 3.28Å; L241-V245 PolarHBondContact O-N 3.02Å |
| 242 | R | 81.8 | Confident | 74.5 | Confident | 157 Ų | 157 | 64.2 Ų | 64.2 | 59% | 0.592 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -56.6 | -44.1 | 177.7 | -177.2 | -175.6 | -64.5 | -168 | -1.6 | 111.4 | Q238 K239 V245 V246 L310 | Q238-R242 WeakPolarHBondContact O-CB 3.49Å; Q238-R242 PolarHBondContact O-N 3.15Å; K239-R242 WeakPolarHBondContact O-CB 3.29Å; K239-R242 PolarHBondContact O-N 3.46Å; R242-V245 PolarHBondContact O-N 3.32Å; R242-V246 VanDerWaalsContact O-CG2 3.28Å; R242-V246 WeakPolarHBondContact O-CG2 3.32Å; R242-V246 PolarHBondContact O-N 2.82Å; R242-L310 HydrophobicContact CG-CD2 4.42Å |
| 243 | M | 80.9 | Confident | 76.3 | Confident | 17 Ų | 17 | 66.8 Ų | 66.8 | 8% | 0.084 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -60.4 | -51.4 | 177 | -179 | -176.1 | 59.7 | 0 | 0 | 111.3 | F81 K239 A240 L241 V245 V246 V247 I306 Y307 L310 | F81-M243 HydrophobicContact CE2-CE 3.75Å; F81-M243 HydrophobicContact CE2-SD 4.01Å; F81-M243 HydrophobicContact CZ-CE 3.39Å; F81-M243 HydrophobicContact CZ-SD 3.8Å; K239-M243 PolarHBondContact O-N 3.41Å; A240-M243 PolarHBondContact O-N 2.88Å; L241-M243 VanDerWaalsContact C-N 3.29Å; L241-M243 PolarHBondContact O-N 2.81Å; M243-V245 VanDerWaalsContact C-N 3.32Å; M243-V245 PolarHBondContact O-N 3.33Å; M243-V246 PolarHBondContact O-N 3.3Å; M243-V246 VanDerWaalsContact O-N 3.16Å; M243-V247 WeakPolarHBondContact O-CG2 3.33Å; M243-V247 PolarHBondContact O-N 3.44Å; M243-I306 HydrophobicContact CG-CG2 4.49Å; M243-Y307 HydrophobicContact SD-CD1 4.26Å; M243-L310 HydrophobicContact CB-CB 4.18Å; M243-L310 HydrophobicContact CG-CB 4.12Å |
| 244 | I | 82.3 | Confident | 78.3 | Confident | 18 Ų | 18 | 61.5 Ų | 61.5 | 9% | 0.092 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.4 | -39.2 | -178.8 | -54.4 | 168.3 | 0 | 0 | 0 | 110.7 | M134 R138 Y217 A240 L241 V246 V247 V248 | M134-I244 HydrophobicContact CB-CG2 4.37Å; R138-I244 HydrophobicContact CB-CD1 3.89Å; R138-I244 HydrophobicContact CG-CD1 3.92Å; Y217-I244 VanDerWaalsContact OH-C 3.25Å; Y217-I244 WeakPolarHBondContact OH-CG2 3.1Å; Y217-I244 PolarHBondContact OH-O 3.12Å; A240-I244 WeakPolarHBondContact O-CG1 3.32Å; A240-I244 PolarHBondContact O-N 3.34Å; L241-I244 PolarHBondContact O-N 3.31Å; I244-V246 VanDerWaalsContact C-N 3.34Å; I244-V246 PolarHBondContact O-N 2.89Å; I244-V247 PolarHBondContact O-N 3.23Å; I244-V248 HydrophobicContact CG2-CG2 4.34Å; I244-V248 WeakPolarHBondContact O-CB 3.44Å; I244-V248 VanDerWaalsContact O-CG2 3.28Å; I244-V248 WeakPolarHBondContact O-CG2 3.44Å; I244-V248 PolarHBondContact O-N 2.91Å |
| 245 | V | 86.8 | Confident | 80 | Confident | 49 Ų | 49 | 56.2 Ų | 56.2 | 30% | 0.297 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -59.2 | -45.8 | 174.7 | 170.9 | 0 | 0 | 0 | 0 | 110.9 | Y217 L241 R242 M243 V248 L249 | Y217-V245 HydrophobicContact CD1-CG2 3.96Å; Y217-V245 HydrophobicContact CE1-CG2 3.26Å; Y217-V245 PolarHBondContact OH-N 3.45Å; L241-V245 HydrophobicContact CG-CG2 4.32Å; L241-V245 VanDerWaalsContact O-CG2 3.29Å; L241-V245 WeakPolarHBondContact O-CG2 3.28Å; L241-V245 PolarHBondContact O-N 3.02Å; R242-V245 PolarHBondContact O-N 3.32Å; M243-V245 VanDerWaalsContact C-N 3.32Å; M243-V245 PolarHBondContact O-N 3.33Å; V245-V248 PolarHBondContact O-N 3Å; V245-L249 HydrophobicContact CG1-CD1 3.89Å; V245-L249 HydrophobicContact CG1-CG 4.31Å; V245-L249 WeakPolarHBondContact O-CB 3.49Å; V245-L249 VanDerWaalsContact O-CG 3.27Å; V245-L249 WeakPolarHBondContact O-CG 3.22Å; V245-L249 PolarHBondContact O-N 3.5Å |
| 246 | V | 88.9 | Confident | 82 | Confident | 45 Ų | 45 | 55.2 Ų | 55.2 | 27% | 0.273 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -63.2 | -44.8 | 178.9 | 172 | 0 | 0 | 0 | 0 | 111.2 | R242 M243 I244 V248 L249 V250 I306 L310 | R242-V246 VanDerWaalsContact O-CG2 3.28Å; R242-V246 WeakPolarHBondContact O-CG2 3.32Å; R242-V246 PolarHBondContact O-N 2.82Å; M243-V246 PolarHBondContact O-N 3.3Å; M243-V246 VanDerWaalsContact O-N 3.16Å; I244-V246 VanDerWaalsContact C-N 3.34Å; I244-V246 PolarHBondContact O-N 2.89Å; V246-V248 VanDerWaalsContact C-N 3.34Å; V246-V248 PolarHBondContact O-N 3.37Å; V246-L249 PolarHBondContact O-N 2.9Å; V246-V250 HydrophobicContact CG1-CG2 4.47Å; V246-V250 WeakPolarHBondContact O-CG2 3.49Å; V246-V250 PolarHBondContact O-N 2.88Å; V246-I306 HydrophobicContact CB-CG2 4.32Å; V246-I306 HydrophobicContact CG1-CD1 4.29Å; V246-I306 HydrophobicContact CG1-CG1 4.17Å; V246-I306 HydrophobicContact CG1-CG2 3.86Å; V246-L310 HydrophobicContact CB-CD1 4.18Å; V246-L310 HydrophobicContact CG1-CD1 3.94Å; V246-L310 HydrophobicContact CG2-CD1 4.24Å |
| 247 | V | 86.8 | Confident | 83.9 | Confident | 2 Ų | 2 | 46.4 Ų | 46.4 | 1% | 0.012 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.1 | -44.5 | 177.4 | -175.3 | 0 | 0 | 0 | 0 | 111.1 | L131 M243 I244 L249 V250 F251 I306 Y307 | L131-V247 HydrophobicContact CD1-CG1 4.32Å; L131-V247 HydrophobicContact CD2-CB 4.18Å; L131-V247 HydrophobicContact CD2-CG1 3.35Å; L131-V247 HydrophobicContact CG-CG1 4.47Å; M243-V247 WeakPolarHBondContact O-CG2 3.33Å; M243-V247 PolarHBondContact O-N 3.44Å; I244-V247 PolarHBondContact O-N 3.23Å; V247-L249 PolarHBondContact O-N 2.9Å; V247-V250 PolarHBondContact O-N 2.98Å; V247-F251 PolarHBondContact O-N 3.48Å; V247-I306 HydrophobicContact CG2-CB 4.28Å; V247-I306 HydrophobicContact CG2-CD1 4.25Å; V247-I306 HydrophobicContact CG2-CG2 3.48Å; V247-I306 VanDerWaalsContact CG2-CG2 3.48Å; V247-Y307 HydrophobicContact CG2-CE1 3.69Å |
| 248 | V | 88.6 | Confident | 85.3 | Confident | 10 Ų | 10 | 44.6 Ų | 44.6 | 6% | 0.061 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.2 | -43.3 | 177.1 | 164.9 | 0 | 0 | 0 | 0 | 111.7 | L131 I213 Y217 I244 V245 V246 F251 F252 | L131-V248 HydrophobicContact CB-CG2 4.42Å; I213-V248 HydrophobicContact CG2-CG1 3.69Å; I213-V248 HydrophobicContact CG2-CG2 4.35Å; Y217-V248 HydrophobicContact CE2-CG1 4.3Å; Y217-V248 HydrophobicContact CE2-CG2 4.21Å; I244-V248 HydrophobicContact CG2-CG2 4.34Å; I244-V248 WeakPolarHBondContact O-CB 3.44Å; I244-V248 VanDerWaalsContact O-CG2 3.28Å; I244-V248 WeakPolarHBondContact O-CG2 3.44Å; I244-V248 PolarHBondContact O-N 2.91Å; V245-V248 PolarHBondContact O-N 3Å; V246-V248 VanDerWaalsContact C-N 3.34Å; V246-V248 PolarHBondContact O-N 3.37Å; V248-F251 PolarHBondContact O-N 3.19Å; V248-F252 HydrophobicContact CG1-CD2 3.79Å; V248-F252 HydrophobicContact CG1-CE2 3.69Å; V248-F252 WeakPolarHBondContact O-CD2 3.31Å; V248-F252 PolarHBondContact O-N 3Å |
| 249 | L | 91.2 | Very high | 86.5 | Confident | 95 Ų | 95 | 41 Ų | 41 | 50% | 0.497 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -63.9 | -44.3 | 177.4 | -73.2 | 172.6 | 0 | 0 | 0 | 111.5 | V245 V246 V247 F251 F252 I253 | V245-L249 HydrophobicContact CG1-CD1 3.89Å; V245-L249 HydrophobicContact CG1-CG 4.31Å; V245-L249 WeakPolarHBondContact O-CB 3.49Å; V245-L249 VanDerWaalsContact O-CG 3.27Å; V245-L249 WeakPolarHBondContact O-CG 3.22Å; V245-L249 PolarHBondContact O-N 3.5Å; V246-L249 PolarHBondContact O-N 2.9Å; V247-L249 PolarHBondContact O-N 2.9Å; L249-F251 VanDerWaalsContact C-N 3.33Å; L249-F251 PolarHBondContact O-N 3.46Å; L249-F252 PolarHBondContact O-N 3.05Å; L249-I253 WeakPolarHBondContact O-CB 3.46Å; L249-I253 WeakPolarHBondContact O-CD1 3.44Å; L249-I253 WeakPolarHBondContact O-CG1 3.46Å; L249-I253 PolarHBondContact O-N 3.45Å |
| 250 | V | 92.3 | Very high | 87.7 | Confident | 27 Ų | 27 | 39.6 Ų | 39.6 | 16% | 0.164 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62.1 | -43.1 | 177.3 | 169.4 | 0 | 0 | 0 | 0 | 110.9 | V246 V247 F252 I253 C254 L302 I306 | V246-V250 HydrophobicContact CG1-CG2 4.47Å; V246-V250 WeakPolarHBondContact O-CG2 3.49Å; V246-V250 PolarHBondContact O-N 2.88Å; V247-V250 PolarHBondContact O-N 2.98Å; V250-F252 PolarHBondContact O-N 2.85Å; V250-I253 PolarHBondContact O-N 2.9Å; V250-C254 WeakPolarHBondContact O-CB 3.36Å; V250-C254 PolarHBondContact O-N 3.14Å; V250-C254 PolarHBondContact O-SG 2.87Å; V250-L302 HydrophobicContact CG1-CB 3.85Å; V250-L302 HydrophobicContact CG1-CD1 3.66Å; V250-L302 HydrophobicContact CG1-CG 4.43Å; V250-I306 HydrophobicContact CB-CD1 3.88Å; V250-I306 HydrophobicContact CG1-CD1 4.09Å; V250-I306 HydrophobicContact CG2-CD1 3.73Å |
| 251 | F | 90.3 | Very high | 88.9 | Confident | 1 Ų | 1 | 38.6 Ų | 38.6 | 0% | 0.004 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -54.6 | -53.7 | 174.2 | -179.3 | -83.7 | 0 | 0 | 0 | 111.3 | I128 L131 V247 V248 L249 I253 C254 W255 N299 | I128-F251 HydrophobicContact CB-CE1 4.04Å; I128-F251 HydrophobicContact CB-CE2 3.97Å; I128-F251 HydrophobicContact CB-CZ 3.51Å; I128-F251 HydrophobicContact CD1-CD1 3.66Å; I128-F251 HydrophobicContact CD1-CE1 3.37Å; I128-F251 HydrophobicContact CD1-CE2 4.37Å; I128-F251 HydrophobicContact CD1-CG 4.33Å; I128-F251 HydrophobicContact CD1-CZ 3.78Å; I128-F251 HydrophobicContact CG1-CE1 3.8Å; I128-F251 HydrophobicContact CG1-CZ 3.82Å; L131-F251 HydrophobicContact CD1-CB 3.49Å; L131-F251 VanDerWaalsContact CD1-CB 3.49Å; L131-F251 HydrophobicContact CD1-CD1 4.45Å; L131-F251 HydrophobicContact CD1-CD2 3.57Å; L131-F251 HydrophobicContact CD1-CE2 4.48Å; L131-F251 HydrophobicContact CD1-CG 3.56Å; V247-F251 PolarHBondContact O-N 3.48Å; V248-F251 PolarHBondContact O-N 3.19Å; L249-F251 VanDerWaalsContact C-N 3.33Å; L249-F251 PolarHBondContact O-N 3.46Å; F251-I253 VanDerWaalsContact C-N 3.35Å; F251-I253 PolarHBondContact O-N 3.4Å; F251-C254 PolarHBondContact O-N 2.84Å; F251-W255 AromaticContact CD2-CD1 3.41Å; F251-W255 VanDerWaalsContact CD2-CD1 3.41Å; F251-W255 HydrophobicContact CD2-CG 4.41Å; F251-W255 AromaticContact CD2-NE1 3.63Å; F251-W255 HydrophobicContact CE1-CB 4.06Å; F251-W255 AromaticContact CE1-CD1 3.9Å; F251-W255 HydrophobicContact CE1-CG 4.07Å; F251-W255 AromaticContact CE2-CD1 3.25Å; F251-W255 HydrophobicContact CE2-CD2 4.41Å; F251-W255 AromaticContact CE2-CG 3.96Å; F251-W255 HydrophobicContact CE2-CG 3.96Å; F251-W255 AromaticContact CE2-NE1 3.29Å; F251-W255 VanDerWaalsContact CE2-NE1 3.29Å; F251-W255 AromaticContact CG-CD1 3.81Å; F251-W255 HydrophobicContact CZ-CB 4.19Å; F251-W255 AromaticContact CZ-CD1 3.48Å; F251-W255 VanDerWaalsContact CZ-CD1 3.48Å; F251-W255 HydrophobicContact CZ-CD2 4.28Å; F251-W255 AromaticContact CZ-CG 3.73Å; F251-W255 HydrophobicContact CZ-CG 3.73Å; F251-W255 AromaticContact CZ-NE1 3.86Å; F251-W255 WeakPolarHBondContact O-CB 3.41Å; F251-W255 VanDerWaalsContact O-CD1 3.26Å; F251-W255 PolarHBondContact O-N 3.45Å; F251-N299 WeakPolarHBondContact CA-OD1 3.18Å |
| 252 | F | 91.8 | Very high | 89.5 | Confident | 22 Ų | 22 | 38 Ų | 38 | 10% | 0.096 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -66.3 | -35.9 | -179.1 | -74 | -60.9 | 0 | 0 | 0 | 112.6 | I128 F206 F210 I213 V248 L249 V250 C254 L256 | I128-F252 HydrophobicContact CD1-CZ 4.21Å; F206-F252 HydrophobicContact CD2-CD1 4.2Å; F206-F252 HydrophobicContact CD2-CE1 4.22Å; F206-F252 HydrophobicContact CE1-CD1 4.46Å; F206-F252 AromaticContact CE2-CD1 3.48Å; F206-F252 HydrophobicContact CE2-CD1 3.48Å; F206-F252 VanDerWaalsContact CE2-CD1 3.48Å; F206-F252 AromaticContact CE2-CE1 3.93Å; F206-F252 HydrophobicContact CE2-CE1 3.93Å; F206-F252 AromaticContact CZ-CD1 3.6Å; F206-F252 HydrophobicContact CZ-CD1 3.6Å; F206-F252 HydrophobicContact CZ-CE1 4.09Å; F210-F252 HydrophobicContact CB-CE1 3.77Å; F210-F252 HydrophobicContact CB-CZ 3.72Å; F210-F252 AromaticContact CD2-CD1 3.93Å; F210-F252 HydrophobicContact CD2-CD1 3.93Å; F210-F252 HydrophobicContact CD2-CD2 4.17Å; F210-F252 AromaticContact CD2-CE1 3.62Å; F210-F252 HydrophobicContact CD2-CE1 3.62Å; F210-F252 AromaticContact CD2-CE2 3.84Å; F210-F252 HydrophobicContact CD2-CE2 3.84Å; F210-F252 HydrophobicContact CD2-CG 4.23Å; F210-F252 AromaticContact CD2-CZ 3.59Å; F210-F252 HydrophobicContact CD2-CZ 3.59Å; F210-F252 HydrophobicContact CG-CE1 4.19Å; F210-F252 HydrophobicContact CG-CZ 4.14Å; I213-F252 HydrophobicContact CD1-CE2 4.13Å; I213-F252 HydrophobicContact CD1-CZ 4.15Å; V248-F252 HydrophobicContact CG1-CD2 3.79Å; V248-F252 HydrophobicContact CG1-CE2 3.69Å; V248-F252 WeakPolarHBondContact O-CD2 3.31Å; V248-F252 PolarHBondContact O-N 3Å; L249-F252 PolarHBondContact O-N 3.05Å; V250-F252 PolarHBondContact O-N 2.85Å; F252-C254 VanDerWaalsContact C-N 3.33Å; F252-C254 PolarHBondContact O-N 3.42Å; F252-L256 WeakPolarHBondContact O-CA 3.47Å; F252-L256 WeakPolarHBondContact O-CB 3.35Å; F252-L256 PolarHBondContact O-N 3.18Å |
| 253 | I | 93.8 | Very high | 89.8 | Confident | 117 Ų | 117 | 32.2 Ų | 32.2 | 60% | 0.6 | 18% | 0.18 | S | C | * | . | H | α-helix | trans | -63.7 | -40.3 | 175.9 | -71.3 | 164.6 | 0 | 0 | 0 | 111.3 | L249 V250 F251 P257 | L249-I253 WeakPolarHBondContact O-CB 3.46Å; L249-I253 WeakPolarHBondContact O-CD1 3.44Å; L249-I253 WeakPolarHBondContact O-CG1 3.46Å; L249-I253 PolarHBondContact O-N 3.45Å; V250-I253 PolarHBondContact O-N 2.9Å; F251-I253 VanDerWaalsContact C-N 3.35Å; F251-I253 PolarHBondContact O-N 3.4Å; I253-P257 WeakPolarHBondContact O-CD 3.28Å |
| 254 | C | 94 | Very high | 90.2 | Very high | 8 Ų | 8 | 35 Ų | 35 | 5% | 0.054 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -74.6 | -42.9 | -179.5 | -76.4 | 0 | 0 | 0 | 0 | 113 | V250 F251 F252 A295 A296 N299 | V250-C254 WeakPolarHBondContact O-CB 3.36Å; V250-C254 PolarHBondContact O-N 3.14Å; V250-C254 PolarHBondContact O-SG 2.87Å; F251-C254 PolarHBondContact O-N 2.84Å; F252-C254 VanDerWaalsContact C-N 3.33Å; F252-C254 PolarHBondContact O-N 3.42Å; C254-A295 WeakPolarHBondContact CB-O 3.25Å; C254-A295 CarbonylContact O-C 3.35Å; C254-A295 PolarHBondContact SG-O 2.89Å; C254-A296 PolarHBondContact O-N 2.86Å; C254-N299 HydrophobicContact CB-CB 3.7Å |
| 255 | W | 92.6 | Very high | 90.4 | Very high | 1 Ų | 1 | 35.5 Ų | 35.5 | 0% | 0.004 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -94.1 | -21 | -172.6 | -72.8 | 97.2 | 0 | 0 | 0 | 114.6 | L91 L120 M124 F251 E258 N259 A296 N299 | L91-W255 HydrophobicContact CD2-CZ2 4.31Å; L120-W255 HydrophobicContact CD1-CH2 3.95Å; M124-W255 HydrophobicContact CB-CH2 3.56Å; M124-W255 HydrophobicContact CB-CZ2 4.05Å; M124-W255 HydrophobicContact CB-CZ3 3.89Å; M124-W255 HydrophobicContact CG-CD2 4.33Å; M124-W255 HydrophobicContact CG-CE3 3.92Å; M124-W255 HydrophobicContact CG-CH2 3.74Å; M124-W255 HydrophobicContact CG-CZ2 4.16Å; M124-W255 HydrophobicContact CG-CZ3 3.61Å; M124-W255 HydrophobicContact SD-CE3 4.23Å; M124-W255 HydrophobicContact SD-CZ3 3.97Å; F251-W255 AromaticContact CD2-CD1 3.41Å; F251-W255 VanDerWaalsContact CD2-CD1 3.41Å; F251-W255 HydrophobicContact CD2-CG 4.41Å; F251-W255 AromaticContact CD2-NE1 3.63Å; F251-W255 HydrophobicContact CE1-CB 4.06Å; F251-W255 AromaticContact CE1-CD1 3.9Å; F251-W255 HydrophobicContact CE1-CG 4.07Å; F251-W255 AromaticContact CE2-CD1 3.25Å; F251-W255 HydrophobicContact CE2-CD2 4.41Å; F251-W255 AromaticContact CE2-CG 3.96Å; F251-W255 HydrophobicContact CE2-CG 3.96Å; F251-W255 AromaticContact CE2-NE1 3.29Å; F251-W255 VanDerWaalsContact CE2-NE1 3.29Å; F251-W255 AromaticContact CG-CD1 3.81Å; F251-W255 HydrophobicContact CZ-CB 4.19Å; F251-W255 AromaticContact CZ-CD1 3.48Å; F251-W255 VanDerWaalsContact CZ-CD1 3.48Å; F251-W255 HydrophobicContact CZ-CD2 4.28Å; F251-W255 AromaticContact CZ-CG 3.73Å; F251-W255 HydrophobicContact CZ-CG 3.73Å; F251-W255 AromaticContact CZ-NE1 3.86Å; F251-W255 WeakPolarHBondContact O-CB 3.41Å; F251-W255 VanDerWaalsContact O-CD1 3.26Å; F251-W255 PolarHBondContact O-N 3.45Å; W255-E258 VanDerWaalsContact CE3-OE2 3.23Å; W255-E258 WeakPolarHBondContact CZ3-OE2 3.36Å; W255-E258 PolarHBondContact O-N 2.68Å; W255-N259 PolarHBondContact O-N 2.99Å; W255-N259 PolarHBondContact O-ND2 2.87Å; W255-A296 HydrophobicContact CD2-CB 4.35Å; W255-A296 HydrophobicContact CE3-CB 4.09Å; W255-A296 HydrophobicContact CH2-CB 4.49Å; W255-A296 HydrophobicContact CZ3-CB 4.16Å; W255-N299 VanDerWaalsContact NE1-CG 3.34Å; W255-N299 PolarHBondContact NE1-ND2 2.97Å; W255-N299 VanDerWaalsContact NE1-ND2 3.16Å |
| 256 | L | 92.6 | Very high | 90.3 | Very high | 80 Ų | 80 | 33.2 Ų | 33.2 | 42% | 0.419 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -59.1 | -45.3 | 178.1 | 174.3 | 70.2 | 0 | 0 | 0 | 112.8 | F206 F252 E258 N259 V260 | F206-L256 HydrophobicContact CE1-CD1 3.77Å; F206-L256 HydrophobicContact CE2-CB 4.01Å; F206-L256 HydrophobicContact CE2-CD1 4.27Å; F206-L256 HydrophobicContact CZ-CB 3.8Å; F206-L256 HydrophobicContact CZ-CD1 3.36Å; F206-L256 HydrophobicContact CZ-CG 4.17Å; F252-L256 WeakPolarHBondContact O-CA 3.47Å; F252-L256 WeakPolarHBondContact O-CB 3.35Å; F252-L256 PolarHBondContact O-N 3.18Å; L256-E258 PolarHBondContact O-N 3.41Å; L256-N259 PolarHBondContact O-N 2.96Å; L256-V260 HydrophobicContact CD1-CG2 3.68Å; L256-V260 HydrophobicContact CG-CG2 4.06Å; L256-V260 WeakPolarHBondContact O-CB 3.46Å; L256-V260 VanDerWaalsContact O-CG2 3.24Å; L256-V260 WeakPolarHBondContact O-CG2 3.31Å; L256-V260 PolarHBondContact O-N 3.47Å |
| 257 | P | 93.5 | Very high | 90.2 | Very high | 48 Ų | 48 | 35.9 Ų | 35.9 | 31% | 0.312 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -56.4 | -41.3 | -179.8 | -25.3 | 35.4 | 0 | 0 | 0 | 112.3 | I253 V260 F261 V292 | I253-P257 WeakPolarHBondContact O-CD 3.28Å; P257-V260 PolarHBondContact O-N 3.21Å; P257-F261 WeakPolarHBondContact O-CB 3.38Å; P257-F261 PolarHBondContact O-N 2.03Å; P257-V292 HydrophobicContact CB-CG1 4.37Å; P257-V292 HydrophobicContact CB-CG2 3.92Å |
| 258 | E | 90.4 | Very high | 90.1 | Very high | 8 Ų | 8 | 39.3 Ų | 39.3 | 4% | 0.037 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -67.8 | -48.9 | 178.8 | -170.8 | 176.4 | -167.1 | 0 | 0 | 112 | W255 L256 V260 F261 I262 V292 A296 | W255-E258 VanDerWaalsContact CE3-OE2 3.23Å; W255-E258 WeakPolarHBondContact CZ3-OE2 3.36Å; W255-E258 PolarHBondContact O-N 2.68Å; L256-E258 PolarHBondContact O-N 3.41Å; E258-V260 PolarHBondContact O-N 3.4Å; E258-F261 WeakPolarHBondContact O-CB 3.41Å; E258-F261 PolarHBondContact O-N 2.76Å; E258-I262 HydrophobicContact CG-CD1 4.03Å; E258-I262 WeakPolarHBondContact O-CG1 3.26Å; E258-I262 PolarHBondContact O-N 2.93Å; E258-V292 HydrophobicContact CB-CG1 3.52Å; E258-V292 HydrophobicContact CG-CG1 4Å; E258-A296 WeakPolarHBondContact OE2-CB 3.5Å |
| 259 | N | 91.1 | Very high | 89.8 | Confident | 3 Ų | 3 | 39 Ų | 39 | 2% | 0.016 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -63.1 | -33.2 | 178.2 | -79.8 | -89.3 | 0 | 0 | 0 | 112.2 | F206 W255 L256 S263 | F206-N259 HydrophobicContact CB-CB 4.3Å; F206-N259 WeakPolarHBondContact CB-OD1 3.41Å; F206-N259 HydrophobicContact CD1-CB 4.45Å; F206-N259 HydrophobicContact CD2-CB 3.88Å; F206-N259 HydrophobicContact CE2-CB 4.31Å; F206-N259 HydrophobicContact CG-CB 3.96Å; W255-N259 PolarHBondContact O-N 2.99Å; W255-N259 PolarHBondContact O-ND2 2.87Å; L256-N259 PolarHBondContact O-N 2.96Å; N259-S263 VanDerWaalsContact O-CB 3.22Å; N259-S263 WeakPolarHBondContact O-CB 3.49Å; N259-S263 PolarHBondContact O-N 3.1Å; N259-S263 PolarHBondContact O-OG 2.98Å |
| 260 | V | 91.6 | Very high | 89.4 | Confident | 68 Ų | 68 | 37.6 Ų | 37.6 | 41% | 0.412 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -67.6 | -45 | 172.2 | 169.2 | 0 | 0 | 0 | 0 | 110.8 | L256 P257 E258 S263 I264 | L256-V260 HydrophobicContact CD1-CG2 3.68Å; L256-V260 HydrophobicContact CG-CG2 4.06Å; L256-V260 WeakPolarHBondContact O-CB 3.46Å; L256-V260 VanDerWaalsContact O-CG2 3.24Å; L256-V260 WeakPolarHBondContact O-CG2 3.31Å; L256-V260 PolarHBondContact O-N 3.47Å; P257-V260 PolarHBondContact O-N 3.21Å; E258-V260 PolarHBondContact O-N 3.4Å; V260-S263 WeakPolarHBondContact O-CB 3.36Å; V260-S263 PolarHBondContact O-N 3.5Å; V260-I264 HydrophobicContact CG1-CD1 4.02Å; V260-I264 WeakPolarHBondContact O-CG1 3.29Å; V260-I264 PolarHBondContact O-N 3.27Å |
| 261 | F | 90.1 | Very high | 89 | Confident | 15 Ų | 15 | 40.5 Ų | 40.5 | 7% | 0.066 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -61 | -46.8 | 179.3 | -159.5 | -101.2 | 0 | 0 | 0 | 111.5 | P257 E258 I264 Q265 L281 W282 T288 V292 | P257-F261 WeakPolarHBondContact O-CB 3.38Å; P257-F261 PolarHBondContact O-N 2.03Å; E258-F261 WeakPolarHBondContact O-CB 3.41Å; E258-F261 PolarHBondContact O-N 2.76Å; F261-I264 PolarHBondContact O-N 3.08Å; F261-Q265 PolarHBondContact O-N 2.54Å; F261-L281 HydrophobicContact CD1-CB 4.44Å; F261-L281 HydrophobicContact CD1-CD2 3.85Å; F261-L281 HydrophobicContact CD1-CG 4.47Å; F261-L281 HydrophobicContact CD2-CD2 3.74Å; F261-L281 HydrophobicContact CE1-CB 3.77Å; F261-L281 HydrophobicContact CE1-CD2 3.71Å; F261-L281 HydrophobicContact CE1-CG 3.85Å; F261-L281 HydrophobicContact CE2-CD2 3.59Å; F261-L281 HydrophobicContact CE2-CG 4Å; F261-L281 HydrophobicContact CG-CD2 3.87Å; F261-L281 HydrophobicContact CZ-CB 3.98Å; F261-L281 HydrophobicContact CZ-CD2 3.59Å; F261-L281 HydrophobicContact CZ-CG 3.59Å; F261-L281 WeakPolarHBondContact CZ-O 3.35Å; F261-L281 WeakPolarHBondContact O-CD2 3.05Å; F261-W282 HydrophobicContact CD1-CD2 4.38Å; F261-W282 AromaticContact CD1-CE2 3.65Å; F261-W282 AromaticContact CD1-CZ2 3.88Å; F261-W282 HydrophobicContact CD1-CZ2 3.88Å; F261-W282 AromaticContact CD1-NE1 3.52Å; F261-W282 AromaticContact CE1-CD1 3.67Å; F261-W282 AromaticContact CE1-CD2 3.87Å; F261-W282 HydrophobicContact CE1-CD2 3.87Å; F261-W282 AromaticContact CE1-CE2 3.62Å; F261-W282 AromaticContact CE1-CG 3.84Å; F261-W282 HydrophobicContact CE1-CG 3.84Å; F261-W282 HydrophobicContact CE1-CZ2 4.16Å; F261-W282 AromaticContact CE1-NE1 3.55Å; F261-T288 HydrophobicContact CD2-CG2 4.37Å; F261-T288 HydrophobicContact CE2-CG2 3.94Å; F261-V292 HydrophobicContact CB-CG1 4.4Å |
| 262 | I | 87.9 | Confident | 88.5 | Confident | 8 Ų | 8 | 43.7 Ų | 43.7 | 4% | 0.041 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.6 | -44.7 | 173.5 | -64.8 | 170.1 | 0 | 0 | 0 | 110.7 | Q198 E201 V202 E258 I264 Q265 L266 | Q198-I262 HydrophobicContact CB-CG2 3.72Å; Q198-I262 HydrophobicContact CG-CG2 4Å; E201-I262 HydrophobicContact CG-CD1 4.43Å; E201-I262 WeakPolarHBondContact OE1-CD1 3.18Å; V202-I262 HydrophobicContact CG2-CB 4.23Å; V202-I262 HydrophobicContact CG2-CG2 3.76Å; E258-I262 HydrophobicContact CG-CD1 4.03Å; E258-I262 WeakPolarHBondContact O-CG1 3.26Å; E258-I262 PolarHBondContact O-N 2.93Å; I262-I264 VanDerWaalsContact C-N 3.3Å; I262-I264 PolarHBondContact O-N 3.33Å; I262-Q265 WeakPolarHBondContact O-CB 3.17Å; I262-Q265 PolarHBondContact O-N 2.91Å; I262-Q265 VanDerWaalsContact O-N 3.13Å; I262-L266 HydrophobicContact CG2-CD1 3.96Å; I262-L266 HydrophobicContact CG2-CG 4.21Å; I262-L266 WeakPolarHBondContact O-CG 3.42Å; I262-L266 PolarHBondContact O-N 3.41Å |
| 263 | S | 89.4 | Confident | 88 | Confident | 35 Ų | 35 | 46.4 Ų | 46.4 | 25% | 0.245 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -59.9 | -38.9 | 178.7 | -64.6 | 0 | 0 | 0 | 0 | 112.6 | V202 N259 V260 L266 L267 | V202-S263 WeakPolarHBondContact CG1-OG 3.48Å; N259-S263 VanDerWaalsContact O-CB 3.22Å; N259-S263 WeakPolarHBondContact O-CB 3.49Å; N259-S263 PolarHBondContact O-N 3.1Å; N259-S263 PolarHBondContact O-OG 2.98Å; V260-S263 WeakPolarHBondContact O-CB 3.36Å; V260-S263 PolarHBondContact O-N 3.5Å; S263-L266 PolarHBondContact O-N 3.36Å; S263-L267 WeakPolarHBondContact O-CB 3.3Å; S263-L267 VanDerWaalsContact O-CG 3.27Å; S263-L267 WeakPolarHBondContact O-CG 3.27Å; S263-L267 PolarHBondContact O-N 3.01Å |
| 264 | I | 88.4 | Confident | 87 | Confident | 74 Ų | 74 | 44.6 Ų | 44.6 | 38% | 0.379 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.1 | -46.5 | 175.5 | -68.5 | 165.1 | 0 | 0 | 0 | 110.2 | V260 F261 I262 L266 L267 Q268 L281 | V260-I264 HydrophobicContact CG1-CD1 4.02Å; V260-I264 WeakPolarHBondContact O-CG1 3.29Å; V260-I264 PolarHBondContact O-N 3.27Å; F261-I264 PolarHBondContact O-N 3.08Å; I262-I264 VanDerWaalsContact C-N 3.3Å; I262-I264 PolarHBondContact O-N 3.33Å; I264-L266 VanDerWaalsContact C-N 3.33Å; I264-L266 PolarHBondContact O-N 3.46Å; I264-L267 PolarHBondContact O-N 3.34Å; I264-Q268 WeakPolarHBondContact O-CG 2.9Å; I264-Q268 PolarHBondContact O-N 2.74Å; I264-L281 HydrophobicContact CB-CD2 4.13Å; I264-L281 HydrophobicContact CG2-CD1 4.4Å; I264-L281 HydrophobicContact CG2-CD2 3.95Å |
| 265 | Q | 85.6 | Confident | 85.8 | Confident | 30 Ų | 30 | 49.2 Ų | 49.2 | 14% | 0.14 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -58.1 | -45.7 | 176.1 | 177.7 | 166.9 | -46.9 | 0 | 0 | 111.5 | F261 I262 L267 Q268 G269 L281 | F261-Q265 PolarHBondContact O-N 2.54Å; I262-Q265 WeakPolarHBondContact O-CB 3.17Å; I262-Q265 PolarHBondContact O-N 2.91Å; I262-Q265 VanDerWaalsContact O-N 3.13Å; Q265-L267 PolarHBondContact O-N 3.04Å; Q265-Q268 PolarHBondContact O-N 3.31Å; Q265-G269 PolarHBondContact O-N 2.95Å; Q265-L281 HydrophobicContact CB-CB 4.17Å |
| 266 | L | 85.7 | Confident | 84.7 | Confident | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -60.9 | -46.3 | 177.8 | -71.7 | 175.4 | 0 | 0 | 0 | 112 | F195 Q198 W199 V202 I262 S263 I264 Q268 G269 T270 | F195-L266 HydrophobicContact CD2-CD2 3.47Å; F195-L266 VanDerWaalsContact CD2-CD2 3.47Å; F195-L266 HydrophobicContact CE2-CB 4.32Å; F195-L266 HydrophobicContact CE2-CD2 3.57Å; F195-L266 WeakPolarHBondContact CE2-O 3.36Å; F195-L266 HydrophobicContact CG-CD2 4.02Å; F195-L266 HydrophobicContact CZ-CD2 4.19Å; F195-L266 WeakPolarHBondContact O-CD2 3.09Å; Q198-L266 HydrophobicContact CB-CD1 4.06Å; Q198-L266 HydrophobicContact CB-CD2 3.62Å; Q198-L266 HydrophobicContact CB-CG 4.08Å; W199-L266 HydrophobicContact CD2-CD1 3.78Å; W199-L266 HydrophobicContact CD2-CD2 4.49Å; W199-L266 HydrophobicContact CE3-CD1 4.15Å; W199-L266 HydrophobicContact CG-CD1 3.96Å; W199-L266 HydrophobicContact CG-CD2 4.18Å; W199-L266 HydrophobicContact CZ2-CB 3.91Å; W199-L266 HydrophobicContact CZ2-CD1 4.47Å; V202-L266 HydrophobicContact CG2-CD1 4.09Å; I262-L266 HydrophobicContact CG2-CD1 3.96Å; I262-L266 HydrophobicContact CG2-CG 4.21Å; I262-L266 WeakPolarHBondContact O-CG 3.42Å; I262-L266 PolarHBondContact O-N 3.41Å; S263-L266 PolarHBondContact O-N 3.36Å; I264-L266 VanDerWaalsContact C-N 3.33Å; I264-L266 PolarHBondContact O-N 3.46Å; L266-Q268 VanDerWaalsContact C-N 3.34Å; L266-Q268 PolarHBondContact O-N 3.43Å; L266-G269 CarbonylContact O-C 3.31Å; L266-G269 PolarHBondContact O-N 3.23Å; L266-T270 WeakPolarHBondContact O-CG2 2.99Å; L266-T270 PolarHBondContact O-N 3Å |
| 267 | L | 86.8 | Confident | 83.1 | Confident | 102 Ų | 102 | 57.6 Ų | 57.6 | 53% | 0.534 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.5 | -41 | 178.4 | -72 | 172.6 | 0 | 0 | 0 | 111.6 | S263 I264 Q265 G269 T270 A271 | S263-L267 WeakPolarHBondContact O-CB 3.3Å; S263-L267 VanDerWaalsContact O-CG 3.27Å; S263-L267 WeakPolarHBondContact O-CG 3.27Å; S263-L267 PolarHBondContact O-N 3.01Å; I264-L267 PolarHBondContact O-N 3.34Å; Q265-L267 PolarHBondContact O-N 3.04Å; L267-G269 VanDerWaalsContact C-N 3.34Å; L267-G269 PolarHBondContact O-N 3.06Å; L267-T270 WeakPolarHBondContact CA-OG1 3.11Å; L267-T270 PolarHBondContact O-N 2.63Å; L267-T270 PolarHBondContact O-OG1 3.22Å; L267-A271 WeakPolarHBondContact O-CB 3.38Å; L267-A271 PolarHBondContact O-N 2.89Å |
| 268 | Q | 84.6 | Confident | 81.2 | Confident | 73 Ų | 73 | 57.8 Ų | 57.8 | 34% | 0.341 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -62.9 | -40.2 | 174.5 | -69.1 | -175 | 20.7 | 0 | 0 | 112.3 | I264 Q265 L266 A271 N272 K275 | I264-Q268 WeakPolarHBondContact O-CG 2.9Å; I264-Q268 PolarHBondContact O-N 2.74Å; Q265-Q268 PolarHBondContact O-N 3.31Å; L266-Q268 VanDerWaalsContact C-N 3.34Å; L266-Q268 PolarHBondContact O-N 3.43Å; Q268-A271 PolarHBondContact O-N 3.03Å; Q268-N272 PolarHBondContact O-N 3.49Å; Q268-K275 HydrophobicContact CB-CD 4.44Å |
| 269 | G | 81.8 | Confident | 79.7 | Confident | 3 Ų | 3 | 61.5 Ų | 61.5 | 3% | 0.031 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -70.1 | -28.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | Q265 L266 L267 N272 R276 | Q265-G269 PolarHBondContact O-N 2.95Å; L266-G269 CarbonylContact O-C 3.31Å; L266-G269 PolarHBondContact O-N 3.23Å; L267-G269 VanDerWaalsContact C-N 3.34Å; L267-G269 PolarHBondContact O-N 3.06Å; G269-N272 CarbonylContact O-C 3.6Å; G269-R276 WeakPolarHBondContact O-CG 3.13Å; G269-R276 PolarHBondContact O-NE 2.85Å |
| 270 | T | 83 | Confident | 78.7 | Confident | 67 Ų | 67 | 62.6 Ų | 62.6 | 41% | 0.411 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -69.3 | -43.2 | 169.2 | 59.7 | 0 | 0 | 0 | 0 | 111.9 | F195 W199 L266 L267 | F195-T270 HydrophobicContact CE1-CG2 4.49Å; F195-T270 HydrophobicContact CZ-CG2 3.64Å; W199-T270 HydrophobicContact CZ2-CG2 3.88Å; L266-T270 WeakPolarHBondContact O-CG2 2.99Å; L266-T270 PolarHBondContact O-N 3Å; L267-T270 WeakPolarHBondContact CA-OG1 3.11Å; L267-T270 PolarHBondContact O-N 2.63Å; L267-T270 PolarHBondContact O-OG1 3.22Å |
| 271 | A | 83.6 | Confident | 78.1 | Confident | 87 Ų | 87 | 59.8 Ų | 59.8 | 72% | 0.719 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -71.5 | -36.2 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L267 Q268 | L267-A271 WeakPolarHBondContact O-CB 3.38Å; L267-A271 PolarHBondContact O-N 2.89Å; Q268-A271 PolarHBondContact O-N 3.03Å |
| 272 | N | 80.9 | Confident | 77.5 | Confident | 69 Ų | 69 | 60.9 Ų | 60.9 | 37% | 0.369 | 35% | 0.349 | S | S | . | . | trans | -134.3 | 103.8 | 176.6 | -170.7 | -2.9 | 0 | 0 | 0 | 111.1 | Q268 G269 S274 K275 | Q268-N272 PolarHBondContact O-N 3.49Å; G269-N272 CarbonylContact O-C 3.6Å; N272-S274 VanDerWaalsContact CG-OG 3.31Å; N272-S274 PolarHBondContact ND2-OG 2.97Å; N272-S274 PolarHBondContact O-N 2.99Å; N272-S274 VanDerWaalsContact O-N 3.11Å; N272-S274 PolarHBondContact OD1-N 3.38Å; N272-S274 PolarHBondContact OD1-OG 2.85Å; N272-K275 HydrophobicContact CB-CD 4.37Å; N272-K275 HydrophobicContact CB-CG 4.2Å; N272-K275 WeakPolarHBondContact O-CB 3.46Å; N272-K275 PolarHBondContact O-N 3.42Å | ||
| 273 | P | 79.7 | Confident | 77 | Confident | 79 Ų | 79 | 65.7 Ų | 65.7 | 51% | 0.513 | 37% | 0.371 | S | S | . | . | G | 310 helix | trans | -57.5 | -26.2 | -179.7 | -26.8 | 35 | 0 | 0 | 0 | 114.7 | K275 R276 | P273-K275 PolarHBondContact O-N 3.46Å; P273-R276 WeakPolarHBondContact O-CB 3.41Å; P273-R276 WeakPolarHBondContact O-CG 3.3Å; P273-R276 PolarHBondContact O-N 3.46Å; P273-R276 VanDerWaalsContact O-N 3.12Å |
| 274 | S | 73.8 | Confident | 76.6 | Confident | 78 Ų | 78 | 68 Ų | 68 | 55% | 0.545 | 38% | 0.38 | S | S | . | . | G | 310 helix | trans | -68.3 | -18.3 | 176.8 | 71.6 | 0 | 0 | 0 | 0 | 113.2 | N272 | N272-S274 VanDerWaalsContact CG-OG 3.31Å; N272-S274 PolarHBondContact ND2-OG 2.97Å; N272-S274 PolarHBondContact O-N 2.99Å; N272-S274 VanDerWaalsContact O-N 3.11Å; N272-S274 PolarHBondContact OD1-N 3.38Å; N272-S274 PolarHBondContact OD1-OG 2.85Å |
| 275 | K | 69 | Low | 76.5 | Confident | 106 Ų | 106 | 70.9 Ų | 70.9 | 46% | 0.461 | 39% | 0.388 | S | S | . | . | G | 310 helix | trans | -84.3 | -7.7 | 173.7 | -67.7 | -169.8 | 169.4 | -162.4 | 0 | 113.9 | Q268 N272 P273 T277 | Q268-K275 HydrophobicContact CB-CD 4.44Å; N272-K275 HydrophobicContact CB-CD 4.37Å; N272-K275 HydrophobicContact CB-CG 4.2Å; N272-K275 WeakPolarHBondContact O-CB 3.46Å; N272-K275 PolarHBondContact O-N 3.42Å; P273-K275 PolarHBondContact O-N 3.46Å; K275-T277 PolarHBondContact O-N 3.07Å |
| 276 | R | 69.9 | Low | 76.5 | Confident | 123 Ų | 123 | 72.1 Ų | 72.1 | 46% | 0.464 | 40% | 0.398 | S | S | . | . | S | Bend | trans | -67.7 | -27.3 | 176.4 | -64.2 | -177.5 | -167.1 | -172.4 | 5.4 | 112.5 | F195 G269 P273 | F195-R276 HydrophobicContact CD2-CG 4.45Å; G269-R276 WeakPolarHBondContact O-CG 3.13Å; G269-R276 PolarHBondContact O-NE 2.85Å; P273-R276 WeakPolarHBondContact O-CB 3.41Å; P273-R276 WeakPolarHBondContact O-CG 3.3Å; P273-R276 PolarHBondContact O-N 3.46Å; P273-R276 VanDerWaalsContact O-N 3.12Å |
| 277 | T | 58.5 | Low | 76.6 | Confident | 133 Ų | 133 | 73.9 Ų | 73.9 | 82% | 0.816 | 41% | 0.407 | S | S | * | . | S | Bend | trans | -112 | -4.7 | 179.9 | 40.6 | 0 | 0 | 0 | 0 | 113.2 | K275 | K275-T277 PolarHBondContact O-N 3.07Š|
| 278 | A | 54.1 | Low | 76.8 | Confident | 53 Ų | 53 | 72.2 Ų | 72.2 | 44% | 0.438 | 40% | 0.401 | S | S | . | . | S | Bend | trans | -81.6 | 172.1 | 175 | 0 | 0 | 0 | 0 | 0 | 111.3 | T280 | A278-T280 PolarHBondContact O-N 3.31Š|
| 279 | T | 58.3 | Low | 77 | Confident | 85 Ų | 85 | 68.7 Ų | 68.7 | 52% | 0.521 | 39% | 0.385 | S | S | . | . | trans | -41.8 | 132.9 | -178.9 | 42.9 | 0 | 0 | 0 | 0 | 112.4 | H283 | T279-H283 HydrophobicContact CG2-CB 4.45Š| ||
| 280 | T | 70.2 | Confident | 77.4 | Confident | 27 Ų | 27 | 69.6 Ų | 69.6 | 17% | 0.166 | 39% | 0.388 | C | S | . | . | trans | -64.9 | 154.6 | 178.4 | 53.2 | 0 | 0 | 0 | 0 | 110 | N193 A278 W282 H283 D284 | N193-T280 HydrophobicContact CB-CG2 4.48Å; N193-T280 WeakPolarHBondContact OD1-CG2 3.41Å; A278-T280 PolarHBondContact O-N 3.31Å; T280-W282 PolarHBondContact O-N 3.42Å; T280-H283 WeakPolarHBondContact O-CB 3.37Å; T280-H283 PolarHBondContact O-N 3.33Å; T280-D284 PolarHBondContact O-N 2.82Å | ||
| 281 | L | 79.3 | Confident | 77.9 | Confident | 9 Ų | 9 | 70.2 Ų | 70.2 | 5% | 0.047 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -58 | -24.9 | 176.2 | -162.6 | 75.5 | 0 | 0 | 0 | 111.6 | F261 I264 Q265 D284 Y285 | F261-L281 HydrophobicContact CD1-CB 4.44Å; F261-L281 HydrophobicContact CD1-CD2 3.85Å; F261-L281 HydrophobicContact CD1-CG 4.47Å; F261-L281 HydrophobicContact CD2-CD2 3.74Å; F261-L281 HydrophobicContact CE1-CB 3.77Å; F261-L281 HydrophobicContact CE1-CD2 3.71Å; F261-L281 HydrophobicContact CE1-CG 3.85Å; F261-L281 HydrophobicContact CE2-CD2 3.59Å; F261-L281 HydrophobicContact CE2-CG 4Å; F261-L281 HydrophobicContact CG-CD2 3.87Å; F261-L281 HydrophobicContact CZ-CB 3.98Å; F261-L281 HydrophobicContact CZ-CD2 3.59Å; F261-L281 HydrophobicContact CZ-CG 3.59Å; F261-L281 WeakPolarHBondContact CZ-O 3.35Å; F261-L281 WeakPolarHBondContact O-CD2 3.05Å; I264-L281 HydrophobicContact CB-CD2 4.13Å; I264-L281 HydrophobicContact CG2-CD1 4.4Å; I264-L281 HydrophobicContact CG2-CD2 3.95Å; Q265-L281 HydrophobicContact CB-CB 4.17Å; L281-D284 PolarHBondContact O-N 2.75Å; L281-Y285 HydrophobicContact CD1-CD2 4.15Å; L281-Y285 HydrophobicContact CD1-CE2 4.23Å; L281-Y285 HydrophobicContact CG-CD2 4.24Å; L281-Y285 PolarHBondContact O-N 2.92Å |
| 282 | W | 77.1 | Confident | 78.4 | Confident | 38 Ų | 38 | 66.7 Ų | 66.7 | 14% | 0.144 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -62.5 | -39.4 | 172.3 | -69.2 | 86.2 | 0 | 0 | 0 | 113.2 | F261 T280 Y285 P286 G289 V292 N293 | F261-W282 HydrophobicContact CD1-CD2 4.38Å; F261-W282 AromaticContact CD1-CE2 3.65Å; F261-W282 AromaticContact CD1-CZ2 3.88Å; F261-W282 HydrophobicContact CD1-CZ2 3.88Å; F261-W282 AromaticContact CD1-NE1 3.52Å; F261-W282 AromaticContact CE1-CD1 3.67Å; F261-W282 AromaticContact CE1-CD2 3.87Å; F261-W282 HydrophobicContact CE1-CD2 3.87Å; F261-W282 AromaticContact CE1-CE2 3.62Å; F261-W282 AromaticContact CE1-CG 3.84Å; F261-W282 HydrophobicContact CE1-CG 3.84Å; F261-W282 HydrophobicContact CE1-CZ2 4.16Å; F261-W282 AromaticContact CE1-NE1 3.55Å; T280-W282 PolarHBondContact O-N 3.42Å; W282-Y285 CarbonylContact O-C 3.35Å; W282-P286 WeakPolarHBondContact O-CA 3.49Å; W282-P286 VanDerWaalsContact O-N 3.12Å; W282-G289 VanDerWaalsContact CH2-CA 3.47Å; W282-G289 WeakPolarHBondContact CH2-O 3.19Å; W282-G289 WeakPolarHBondContact CZ3-O 3.42Å; W282-V292 HydrophobicContact CH2-CB 4.35Å; W282-V292 HydrophobicContact CH2-CG1 4.21Å; W282-V292 HydrophobicContact CZ2-CG1 4.35Å; W282-N293 HydrophobicContact CH2-CB 4.1Å; W282-N293 WeakPolarHBondContact CH2-ND2 3.36Å; W282-N293 WeakPolarHBondContact CH2-OD1 3.47Å; W282-N293 HydrophobicContact CZ3-CB 4.25Å; W282-N293 VanDerWaalsContact CZ3-CG 3.41Å; W282-N293 WeakPolarHBondContact CZ3-ND2 3.32Å |
| 283 | H | 78.1 | Confident | 78.8 | Confident | 109 Ų | 109 | 64.1 Ų | 64.1 | 51% | 0.505 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -71.4 | -35.3 | 175.7 | -172.7 | -77.2 | 0 | 0 | 0 | 111.9 | T279 T280 | T279-H283 HydrophobicContact CG2-CB 4.45Å; T280-H283 WeakPolarHBondContact O-CB 3.37Å; T280-H283 PolarHBondContact O-N 3.33Å |
| 284 | D | 80.4 | Confident | 79.5 | Confident | 83 Ų | 83 | 61 Ų | 61 | 44% | 0.444 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -74.6 | -32.9 | 178.3 | -67.7 | -9.5 | 0 | 0 | 0 | 112 | T280 L281 | T280-D284 PolarHBondContact O-N 2.82Å; L281-D284 PolarHBondContact O-N 2.75Å |
| 285 | Y | 86.3 | Confident | 80.5 | Confident | 135 Ų | 135 | 58.6 Ų | 58.6 | 53% | 0.529 | 31% | 0.307 | S | S | . | . | S | Bend | trans | -132.1 | 66.6 | -178.3 | -60.1 | -81 | 0 | 0 | 0 | 112.3 | L281 W282 L287 T288 G289 | L281-Y285 HydrophobicContact CD1-CD2 4.15Å; L281-Y285 HydrophobicContact CD1-CE2 4.23Å; L281-Y285 HydrophobicContact CG-CD2 4.24Å; L281-Y285 PolarHBondContact O-N 2.92Å; W282-Y285 CarbonylContact O-C 3.35Å; Y285-L287 PolarHBondContact O-N 3.21Å; Y285-T288 PolarHBondContact O-N 2.82Å; Y285-G289 PolarHBondContact O-N 2.93Å |
| 286 | P | 85.3 | Confident | 81.7 | Confident | 55 Ų | 55 | 53.5 Ų | 53.5 | 36% | 0.357 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -64.3 | -38.3 | -170.5 | 24 | -34.5 | 0 | 0 | 0 | 113.2 | W282 H290 | W282-P286 WeakPolarHBondContact O-CA 3.49Å; W282-P286 VanDerWaalsContact O-N 3.12Å; P286-H290 WeakPolarHBondContact O-CB 3.5Å; P286-H290 PolarHBondContact O-N 3.49Å |
| 287 | L | 88.5 | Confident | 82.8 | Confident | 37 Ų | 37 | 47.8 Ų | 47.8 | 19% | 0.194 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -67.3 | -44.5 | 177.3 | -178.1 | 63.9 | 0 | 0 | 0 | 111.8 | F37 I40 Y285 H290 I291 | F37-L287 HydrophobicContact CB-CB 4.4Å; F37-L287 HydrophobicContact CD1-CB 4.28Å; F37-L287 HydrophobicContact CD1-CD2 3.88Å; F37-L287 HydrophobicContact CE1-CD2 4.32Å; F37-L287 HydrophobicContact CG-CB 4.32Å; I40-L287 HydrophobicContact CB-CD1 4.11Å; I40-L287 HydrophobicContact CD1-CD2 4.41Å; I40-L287 HydrophobicContact CG2-CD1 3.75Å; I40-L287 HydrophobicContact CG2-CD2 4.35Å; Y285-L287 PolarHBondContact O-N 3.21Å; L287-H290 PolarHBondContact O-N 2.95Å; L287-I291 HydrophobicContact CD1-CD1 4.33Å; L287-I291 HydrophobicContact CG-CD1 4.04Å; L287-I291 VanDerWaalsContact O-CG1 3.3Å; L287-I291 WeakPolarHBondContact O-CG1 3.48Å; L287-I291 PolarHBondContact O-N 3.43Å |
| 288 | T | 90.4 | Very high | 84.6 | Confident | 67 Ų | 67 | 42.3 Ų | 42.3 | 41% | 0.411 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -65 | -45 | 179.2 | -56 | 0 | 0 | 0 | 0 | 110.7 | F261 Y285 H290 I291 V292 | F261-T288 HydrophobicContact CD2-CG2 4.37Å; F261-T288 HydrophobicContact CE2-CG2 3.94Å; Y285-T288 PolarHBondContact O-N 2.82Å; T288-H290 PolarHBondContact O-N 3.38Å; T288-I291 PolarHBondContact O-N 3.46Å; T288-V292 WeakPolarHBondContact O-CB 3.3Å; T288-V292 VanDerWaalsContact O-CG2 3.28Å; T288-V292 WeakPolarHBondContact O-CG2 3.34Å; T288-V292 PolarHBondContact O-N 3.11Å |
| 289 | G | 89.1 | Confident | 86.4 | Confident | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -53.5 | -54.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | W282 Y285 I291 V292 N293 | W282-G289 VanDerWaalsContact CH2-CA 3.47Å; W282-G289 WeakPolarHBondContact CH2-O 3.19Å; W282-G289 WeakPolarHBondContact CZ3-O 3.42Å; Y285-G289 PolarHBondContact O-N 2.93Å; G289-I291 VanDerWaalsContact C-N 3.3Å; G289-I291 PolarHBondContact O-N 3.31Å; G289-V292 WeakPolarHBondContact O-CA 3.28Å; G289-V292 WeakPolarHBondContact O-CB 3.5Å; G289-V292 PolarHBondContact O-N 3.19Å; G289-N293 PolarHBondContact O-N 3.39Å |
| 290 | H | 90.8 | Very high | 88.1 | Confident | 21 Ų | 21 | 35.8 Ų | 35.8 | 10% | 0.097 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -56.4 | -42.4 | -179.1 | -173.2 | 64.4 | 0 | 0 | 0 | 113.3 | S45 V99 P286 L287 T288 V292 N293 L294 | S45-H290 PolarHBondContact OG-CE1 3.19Å; S45-H290 PolarHBondContact OG-NE2 2.91Å; S45-H290 VanDerWaalsContact OG-NE2 3.14Å; V99-H290 PolarHBondContact O-CE1 3.44Å; V99-H290 VanDerWaalsContact O-CE1 3.31Å; P286-H290 WeakPolarHBondContact O-CB 3.5Å; P286-H290 PolarHBondContact O-N 3.49Å; L287-H290 PolarHBondContact O-N 2.95Å; T288-H290 PolarHBondContact O-N 3.38Å; H290-V292 VanDerWaalsContact C-N 3.32Å; H290-V292 PolarHBondContact O-N 2.91Å; H290-N293 PolarHBondContact O-N 2.93Å; H290-L294 WeakPolarHBondContact NE2-CD1 3.42Å; H290-L294 WeakPolarHBondContact O-CG 3.44Å; H290-L294 PolarHBondContact O-N 3.22Å |
| 291 | I | 92.7 | Very high | 89.3 | Confident | 80 Ų | 80 | 34.5 Ų | 34.5 | 41% | 0.41 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -61.7 | -41.3 | 175.2 | -69.6 | 164.8 | 0 | 0 | 0 | 111.5 | L44 L287 T288 G289 L294 A295 | L44-I291 HydrophobicContact CD1-CD1 4.3Å; L44-I291 HydrophobicContact CD1-CG1 3.72Å; L287-I291 HydrophobicContact CD1-CD1 4.33Å; L287-I291 HydrophobicContact CG-CD1 4.04Å; L287-I291 VanDerWaalsContact O-CG1 3.3Å; L287-I291 WeakPolarHBondContact O-CG1 3.48Å; L287-I291 PolarHBondContact O-N 3.43Å; T288-I291 PolarHBondContact O-N 3.46Å; G289-I291 VanDerWaalsContact C-N 3.3Å; G289-I291 PolarHBondContact O-N 3.31Å; I291-L294 PolarHBondContact O-N 2.94Å; I291-A295 PolarHBondContact O-N 3.27Å |
| 292 | V | 93.2 | Very high | 89.9 | Confident | 13 Ų | 13 | 36.4 Ų | 36.4 | 8% | 0.079 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -64.2 | -44.8 | 178.4 | 162.5 | 0 | 0 | 0 | 0 | 111.3 | P257 E258 F261 W282 T288 G289 H290 L294 A295 A296 | P257-V292 HydrophobicContact CB-CG1 4.37Å; P257-V292 HydrophobicContact CB-CG2 3.92Å; E258-V292 HydrophobicContact CB-CG1 3.52Å; E258-V292 HydrophobicContact CG-CG1 4Å; F261-V292 HydrophobicContact CB-CG1 4.4Å; W282-V292 HydrophobicContact CH2-CB 4.35Å; W282-V292 HydrophobicContact CH2-CG1 4.21Å; W282-V292 HydrophobicContact CZ2-CG1 4.35Å; T288-V292 WeakPolarHBondContact O-CB 3.3Å; T288-V292 VanDerWaalsContact O-CG2 3.28Å; T288-V292 WeakPolarHBondContact O-CG2 3.34Å; T288-V292 PolarHBondContact O-N 3.11Å; G289-V292 WeakPolarHBondContact O-CA 3.28Å; G289-V292 WeakPolarHBondContact O-CB 3.5Å; G289-V292 PolarHBondContact O-N 3.19Å; H290-V292 VanDerWaalsContact C-N 3.32Å; H290-V292 PolarHBondContact O-N 2.91Å; V292-L294 PolarHBondContact O-N 2.97Å; V292-A295 WeakPolarHBondContact O-CB 3.35Å; V292-A295 PolarHBondContact O-N 3.42Å; V292-A296 PolarHBondContact O-N 3.28Å |
| 293 | N | 90.9 | Very high | 90.5 | Very high | 15 Ų | 15 | 34.7 Ų | 34.7 | 8% | 0.08 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -60.2 | -45.5 | 173.9 | -86.5 | -6.6 | 0 | 0 | 0 | 111.8 | W282 G289 H290 A295 A296 F297 | W282-N293 HydrophobicContact CH2-CB 4.1Å; W282-N293 WeakPolarHBondContact CH2-ND2 3.36Å; W282-N293 WeakPolarHBondContact CH2-OD1 3.47Å; W282-N293 HydrophobicContact CZ3-CB 4.25Å; W282-N293 VanDerWaalsContact CZ3-CG 3.41Å; W282-N293 WeakPolarHBondContact CZ3-ND2 3.32Å; G289-N293 PolarHBondContact O-N 3.39Å; H290-N293 PolarHBondContact O-N 2.93Å; N293-A295 VanDerWaalsContact C-N 3.27Å; N293-A295 PolarHBondContact O-N 2.95Å; N293-A296 WeakPolarHBondContact O-CB 3.36Å; N293-A296 PolarHBondContact O-N 3.38Å; N293-A296 VanDerWaalsContact O-N 3.17Å; N293-F297 HydrophobicContact CB-CE2 3.86Å; N293-F297 HydrophobicContact CB-CZ 4.18Å; N293-F297 WeakPolarHBondContact O-CD2 3.48Å; N293-F297 VanDerWaalsContact O-CG 3.3Å; N293-F297 WeakPolarHBondContact O-CG 3.34Å; N293-F297 PolarHBondContact O-N 3.44Å |
| 294 | L | 94.2 | Very high | 91 | Very high | 15 Ų | 15 | 30 Ų | 30 | 8% | 0.079 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -59.5 | -39.2 | 176.2 | -73.6 | 174.8 | 0 | 0 | 0 | 112.2 | L44 Y48 V99 H290 I291 V292 S298 | L44-L294 HydrophobicContact CB-CD1 3.63Å; L44-L294 HydrophobicContact CD1-CD1 4.46Å; Y48-L294 HydrophobicContact CD1-CD2 4.33Å; Y48-L294 HydrophobicContact CD2-CD2 3.91Å; Y48-L294 HydrophobicContact CG-CD2 3.72Å; V99-L294 HydrophobicContact CB-CD2 4.38Å; V99-L294 HydrophobicContact CG1-CD2 3.91Å; V99-L294 HydrophobicContact CG2-CD2 3.6Å; H290-L294 WeakPolarHBondContact NE2-CD1 3.42Å; H290-L294 WeakPolarHBondContact O-CG 3.44Å; H290-L294 PolarHBondContact O-N 3.22Å; I291-L294 PolarHBondContact O-N 2.94Å; V292-L294 PolarHBondContact O-N 2.97Å; L294-S298 WeakPolarHBondContact O-CB 3.43Å; L294-S298 PolarHBondContact O-N 3.22Å; L294-S298 PolarHBondContact O-OG 2.98Å |
| 295 | A | 95.1 | Very high | 91.4 | Very high | 26 Ų | 26 | 28.6 Ų | 28.6 | 22% | 0.215 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -63.4 | -43 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | C254 I291 V292 N293 S298 | C254-A295 WeakPolarHBondContact CB-O 3.25Å; C254-A295 CarbonylContact O-C 3.35Å; C254-A295 PolarHBondContact SG-O 2.89Å; I291-A295 PolarHBondContact O-N 3.27Å; V292-A295 WeakPolarHBondContact O-CB 3.35Å; V292-A295 PolarHBondContact O-N 3.42Å; N293-A295 VanDerWaalsContact C-N 3.27Å; N293-A295 PolarHBondContact O-N 2.95Å; A295-S298 WeakPolarHBondContact O-CB 3.25Å; A295-S298 PolarHBondContact O-N 2.95Å |
| 296 | A | 93.5 | Very high | 91.3 | Very high | 0 Ų | 0 | 22.7 Ų | 22.7 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62.3 | -50.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | C254 W255 E258 V292 N293 S298 N299 | C254-A296 PolarHBondContact O-N 2.86Å; W255-A296 HydrophobicContact CD2-CB 4.35Å; W255-A296 HydrophobicContact CE3-CB 4.09Å; W255-A296 HydrophobicContact CH2-CB 4.49Å; W255-A296 HydrophobicContact CZ3-CB 4.16Å; E258-A296 WeakPolarHBondContact OE2-CB 3.5Å; V292-A296 PolarHBondContact O-N 3.28Å; N293-A296 WeakPolarHBondContact O-CB 3.36Å; N293-A296 PolarHBondContact O-N 3.38Å; N293-A296 VanDerWaalsContact O-N 3.17Å; A296-S298 PolarHBondContact O-N 2.89Å; A296-N299 WeakPolarHBondContact O-CB 3.37Å; A296-N299 PolarHBondContact O-N 3.24Å |
| 297 | F | 93.9 | Very high | 91.1 | Very high | 3 Ų | 3 | 20.2 Ų | 20.2 | 1% | 0.013 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -63 | -29.5 | 178.3 | -55 | -38.3 | 0 | 0 | 0 | 113.2 | Y48 L91 E98 V99 L120 N293 N299 S300 | Y48-F297 HydrophobicContact CE2-CB 3.86Å; Y48-F297 VanDerWaalsContact OH-CB 3.32Å; Y48-F297 WeakPolarHBondContact OH-CB 3.44Å; L91-F297 HydrophobicContact CD1-CD1 3.9Å; L91-F297 HydrophobicContact CD1-CE1 4.06Å; L91-F297 HydrophobicContact CD2-CD1 4.34Å; L91-F297 HydrophobicContact CG-CD1 4.28Å; E98-F297 HydrophobicContact CB-CE2 4.06Å; E98-F297 HydrophobicContact CB-CZ 4Å; E98-F297 HydrophobicContact CG-CE2 3.82Å; E98-F297 HydrophobicContact CG-CZ 3.59Å; V99-F297 HydrophobicContact CG2-CD2 3.76Å; V99-F297 HydrophobicContact CG2-CE2 4.05Å; L120-F297 HydrophobicContact CD1-CD1 4.44Å; L120-F297 HydrophobicContact CD1-CE1 3.81Å; N293-F297 HydrophobicContact CB-CE2 3.86Å; N293-F297 HydrophobicContact CB-CZ 4.18Å; N293-F297 WeakPolarHBondContact O-CD2 3.48Å; N293-F297 VanDerWaalsContact O-CG 3.3Å; N293-F297 WeakPolarHBondContact O-CG 3.34Å; N293-F297 PolarHBondContact O-N 3.44Å; F297-N299 PolarHBondContact O-N 3.25Å; F297-S300 PolarHBondContact O-N 3.4Å |
| 298 | S | 94.7 | Very high | 90.5 | Very high | 18 Ų | 18 | 20.4 Ų | 20.4 | 13% | 0.126 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -59.6 | -26.7 | 176.2 | -61.8 | 0 | 0 | 0 | 0 | 112.5 | L52 L294 A295 A296 S300 C301 L302 | L52-S298 VanDerWaalsContact CD1-OG 3.26Å; L52-S298 WeakPolarHBondContact CD1-OG 3.43Å; L294-S298 WeakPolarHBondContact O-CB 3.43Å; L294-S298 PolarHBondContact O-N 3.22Å; L294-S298 PolarHBondContact O-OG 2.98Å; A295-S298 WeakPolarHBondContact O-CB 3.25Å; A295-S298 PolarHBondContact O-N 2.95Å; A296-S298 PolarHBondContact O-N 2.89Å; S298-S300 VanDerWaalsContact C-N 3.35Å; S298-S300 PolarHBondContact O-N 2.87Å; S298-C301 PolarHBondContact O-N 3.11Å; S298-C301 VanDerWaalsContact O-N 3.09Å; S298-L302 VanDerWaalsContact O-CG 3.22Å; S298-L302 WeakPolarHBondContact O-CG 3.47Å; S298-L302 PolarHBondContact O-N 2.9Å |
| 299 | N | 93.5 | Very high | 89.7 | Confident | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -51.9 | -51.3 | 176.8 | 176.9 | 63.1 | 0 | 0 | 0 | 112.1 | F251 C254 W255 A296 F297 C301 L302 N303 | F251-N299 WeakPolarHBondContact CA-OD1 3.18Å; C254-N299 HydrophobicContact CB-CB 3.7Å; W255-N299 VanDerWaalsContact NE1-CG 3.34Å; W255-N299 PolarHBondContact NE1-ND2 2.97Å; W255-N299 VanDerWaalsContact NE1-ND2 3.16Å; A296-N299 WeakPolarHBondContact O-CB 3.37Å; A296-N299 PolarHBondContact O-N 3.24Å; F297-N299 PolarHBondContact O-N 3.25Å; N299-C301 VanDerWaalsContact C-N 3.26Å; N299-C301 PolarHBondContact O-N 3.05Å; N299-L302 PolarHBondContact O-N 3.43Å; N299-N303 PolarHBondContact O-N 3.4Å |
| 300 | S | 93.5 | Very high | 88.6 | Confident | 0 Ų | 0 | 27.3 Ų | 27.3 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -69.8 | -24 | -178.4 | -66.3 | 0 | 0 | 0 | 0 | 113.1 | N60 D88 F297 S298 | N60-S300 PolarHBondContact ND2-O 3.2Å; D88-S300 VanDerWaalsContact OD1-CB 3.26Å; D88-S300 WeakPolarHBondContact OD1-CB 3.38Å; D88-S300 PolarHBondContact OD1-OG 3.08Å; F297-S300 PolarHBondContact O-N 3.4Å; S298-S300 VanDerWaalsContact C-N 3.35Å; S298-S300 PolarHBondContact O-N 2.87Å |
| 301 | C | 94.3 | Very high | 87.5 | Confident | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -80.3 | -30 | 174.8 | -65.1 | 0 | 0 | 0 | 0 | 113.3 | L52 I55 S298 N299 P304 | L52-C301 HydrophobicContact CB-CB 3.94Å; L52-C301 HydrophobicContact CD2-CB 4.38Å; L52-C301 PolarHBondContact O-SG 3.02Å; L52-C301 VanDerWaalsContact O-SG 3.33Å; I55-C301 VanDerWaalsContact CG2-O 3.25Å; I55-C301 WeakPolarHBondContact CG2-O 3.35Å; S298-C301 PolarHBondContact O-N 3.11Å; S298-C301 VanDerWaalsContact O-N 3.09Å; N299-C301 VanDerWaalsContact C-N 3.26Å; N299-C301 PolarHBondContact O-N 3.05Å; C301-P304 WeakPolarHBondContact O-CD 3.2Å |
| 302 | L | 92.8 | Very high | 86.4 | Confident | 50 Ų | 50 | 27.5 Ų | 27.5 | 26% | 0.262 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -82.6 | -26.3 | -177.5 | -68 | 172.6 | 0 | 0 | 0 | 112.7 | L52 V250 S298 N299 I305 I306 | L52-L302 HydrophobicContact CD2-CD2 4.45Å; V250-L302 HydrophobicContact CG1-CB 3.85Å; V250-L302 HydrophobicContact CG1-CD1 3.66Å; V250-L302 HydrophobicContact CG1-CG 4.43Å; S298-L302 VanDerWaalsContact O-CG 3.22Å; S298-L302 WeakPolarHBondContact O-CG 3.47Å; S298-L302 PolarHBondContact O-N 2.9Å; N299-L302 PolarHBondContact O-N 3.43Å; L302-I305 HydrophobicContact CD2-CD1 4.04Å; L302-I305 WeakPolarHBondContact O-CB 3.11Å; L302-I305 PolarHBondContact O-N 3.39Å; L302-I306 WeakPolarHBondContact O-CG1 3.25Å; L302-I306 PolarHBondContact O-N 2.99Å; L302-I306 VanDerWaalsContact O-N 3.12Å |
| 303 | N | 89.9 | Confident | 85.3 | Confident | 2 Ų | 2 | 30.1 Ų | 30.1 | 1% | 0.011 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -51 | -49.2 | 179.7 | -77.4 | -19.1 | 0 | 0 | 0 | 113.6 | D88 N299 I305 I306 Y307 | D88-N303 PolarHBondContact OD2-ND2 2.99Å; N299-N303 PolarHBondContact O-N 3.4Å; N303-I305 VanDerWaalsContact C-N 3.32Å; N303-I305 PolarHBondContact O-N 3.15Å; N303-I306 PolarHBondContact O-N 2.95Å; N303-I306 VanDerWaalsContact O-N 3.14Å; N303-Y307 HydrophobicContact CB-CD2 4.42Å; N303-Y307 HydrophobicContact CB-CE2 3.77Å; N303-Y307 WeakPolarHBondContact O-CD2 3.45Å; N303-Y307 VanDerWaalsContact O-CG 3.28Å; N303-Y307 PolarHBondContact O-N 3.45Å |
| 304 | P | 89.1 | Confident | 84.4 | Confident | 9 Ų | 9 | 30 Ų | 30 | 6% | 0.058 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -60.2 | -33.6 | 175.6 | -25.5 | 34.2 | 0 | 0 | 0 | 115.6 | N60 I63 C301 S308 | N60-P304 HydrophobicContact CB-CG 4.5Å; I63-P304 HydrophobicContact CD1-CB 4.09Å; I63-P304 HydrophobicContact CD1-CG 4.08Å; C301-P304 WeakPolarHBondContact O-CD 3.2Å; P304-S308 VanDerWaalsContact O-CB 3.23Å; P304-S308 WeakPolarHBondContact O-CB 3.48Å; P304-S308 PolarHBondContact O-N 3.21Å; P304-S308 PolarHBondContact O-OG 2.94Å |
| 305 | I | 87.2 | Confident | 83.7 | Confident | 55 Ų | 55 | 34.8 Ų | 34.8 | 28% | 0.282 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -63.2 | -50.1 | 174.7 | -60.3 | -178.6 | 0 | 0 | 0 | 108.5 | I55 L302 N303 Y307 S308 F309 | I55-I305 HydrophobicContact CD1-CD1 4.2Å; I55-I305 HydrophobicContact CG2-CD1 3.88Å; I55-I305 HydrophobicContact CG2-CG1 3.6Å; L302-I305 HydrophobicContact CD2-CD1 4.04Å; L302-I305 WeakPolarHBondContact O-CB 3.11Å; L302-I305 PolarHBondContact O-N 3.39Å; N303-I305 VanDerWaalsContact C-N 3.32Å; N303-I305 PolarHBondContact O-N 3.15Å; I305-Y307 VanDerWaalsContact C-N 3.3Å; I305-Y307 PolarHBondContact O-N 2.99Å; I305-S308 WeakPolarHBondContact CA-OG 3.47Å; I305-S308 PolarHBondContact O-N 2.85Å; I305-S308 PolarHBondContact O-OG 3.49Å; I305-F309 HydrophobicContact CG2-CD2 3.55Å; I305-F309 HydrophobicContact CG2-CE2 3.79Å; I305-F309 VanDerWaalsContact O-CD2 3.27Å; I305-F309 WeakPolarHBondContact O-CD2 3.49Å; I305-F309 PolarHBondContact O-N 3.45Å |
| 306 | I | 85.4 | Confident | 82.9 | Confident | 11 Ų | 11 | 37.9 Ų | 37.9 | 6% | 0.056 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -58.8 | -45.4 | -178.7 | -57.8 | 166.6 | 0 | 0 | 0 | 110 | M243 V246 V247 V250 L302 N303 L310 | M243-I306 HydrophobicContact CG-CG2 4.49Å; V246-I306 HydrophobicContact CB-CG2 4.32Å; V246-I306 HydrophobicContact CG1-CD1 4.29Å; V246-I306 HydrophobicContact CG1-CG1 4.17Å; V246-I306 HydrophobicContact CG1-CG2 3.86Å; V247-I306 HydrophobicContact CG2-CB 4.28Å; V247-I306 HydrophobicContact CG2-CD1 4.25Å; V247-I306 HydrophobicContact CG2-CG2 3.48Å; V247-I306 VanDerWaalsContact CG2-CG2 3.48Å; V250-I306 HydrophobicContact CB-CD1 3.88Å; V250-I306 HydrophobicContact CG1-CD1 4.09Å; V250-I306 HydrophobicContact CG2-CD1 3.73Å; L302-I306 WeakPolarHBondContact O-CG1 3.25Å; L302-I306 PolarHBondContact O-N 2.99Å; L302-I306 VanDerWaalsContact O-N 3.12Å; N303-I306 PolarHBondContact O-N 2.95Å; N303-I306 VanDerWaalsContact O-N 3.14Å; I306-L310 HydrophobicContact CG2-CD1 3.72Å; I306-L310 VanDerWaalsContact O-CB 3.26Å; I306-L310 WeakPolarHBondContact O-CB 3.42Å; I306-L310 PolarHBondContact O-N 3.24Å |
| 307 | Y | 81.1 | Confident | 82.1 | Confident | 3 Ų | 3 | 38.6 Ų | 38.6 | 1% | 0.012 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -68.8 | -39 | 179.8 | -57.1 | -39 | 0 | 0 | 0 | 113.6 | I63 F81 L84 M243 V247 N303 I305 G311 | I63-Y307 HydrophobicContact CD1-CD2 3.55Å; I63-Y307 HydrophobicContact CD1-CE2 4.28Å; I63-Y307 HydrophobicContact CD1-CG 4.49Å; F81-Y307 HydrophobicContact CD1-CD1 4.15Å; F81-Y307 AromaticContact CD1-CE1 3.48Å; F81-Y307 HydrophobicContact CD1-CE1 3.48Å; F81-Y307 VanDerWaalsContact CD1-CE1 3.48Å; F81-Y307 HydrophobicContact CD1-CE2 4.1Å; F81-Y307 AromaticContact CD1-CZ 3.45Å; F81-Y307 VanDerWaalsContact CD1-CZ 3.45Å; F81-Y307 HydrophobicContact CD2-CD1 4.34Å; F81-Y307 HydrophobicContact CD2-CE1 4.45Å; F81-Y307 AromaticContact CE1-CD1 3.85Å; F81-Y307 HydrophobicContact CE1-CD1 3.85Å; F81-Y307 AromaticContact CE1-CE1 3.12Å; F81-Y307 HydrophobicContact CE1-CE1 3.12Å; F81-Y307 AromaticContact CE1-CZ 3.55Å; F81-Y307 HydrophobicContact CE2-CD1 4.01Å; F81-Y307 HydrophobicContact CE2-CE1 4.14Å; F81-Y307 HydrophobicContact CG-CD1 4.4Å; F81-Y307 HydrophobicContact CG-CE1 4.16Å; F81-Y307 HydrophobicContact CG-CE2 4.46Å; F81-Y307 AromaticContact CZ-CD1 3.75Å; F81-Y307 HydrophobicContact CZ-CD1 3.75Å; F81-Y307 AromaticContact CZ-CE1 3.48Å; F81-Y307 HydrophobicContact CZ-CE1 3.48Å; F81-Y307 VanDerWaalsContact CZ-CE1 3.48Å; L84-Y307 HydrophobicContact CD2-CE2 4.36Å; L84-Y307 WeakPolarHBondContact CD2-OH 3.37Å; M243-Y307 HydrophobicContact SD-CD1 4.26Å; V247-Y307 HydrophobicContact CG2-CE1 3.69Å; N303-Y307 HydrophobicContact CB-CD2 4.42Å; N303-Y307 HydrophobicContact CB-CE2 3.77Å; N303-Y307 WeakPolarHBondContact O-CD2 3.45Å; N303-Y307 VanDerWaalsContact O-CG 3.28Å; N303-Y307 PolarHBondContact O-N 3.45Å; I305-Y307 VanDerWaalsContact C-N 3.3Å; I305-Y307 PolarHBondContact O-N 2.99Å; Y307-G311 VanDerWaalsContact O-CA 3.23Å; Y307-G311 WeakPolarHBondContact O-CA 3.31Å; Y307-G311 PolarHBondContact O-N 3.18Å |
| 308 | S | 75.2 | Confident | 81.4 | Confident | 41 Ų | 41 | 40.5 Ų | 40.5 | 29% | 0.287 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -71.6 | -34.3 | 179.2 | 60 | 0 | 0 | 0 | 0 | 113.4 | P304 I305 R315 | P304-S308 VanDerWaalsContact O-CB 3.23Å; P304-S308 WeakPolarHBondContact O-CB 3.48Å; P304-S308 PolarHBondContact O-N 3.21Å; P304-S308 PolarHBondContact O-OG 2.94Å; I305-S308 WeakPolarHBondContact CA-OG 3.47Å; I305-S308 PolarHBondContact O-N 2.85Å; I305-S308 PolarHBondContact O-OG 3.49Å; S308-R315 WeakPolarHBondContact O-CD 3.37Å; S308-R315 WeakPolarHBondContact O-CG 3.27Å |
| 309 | F | 73.1 | Confident | 80.8 | Confident | 153 Ų | 153 | 46.8 Ų | 46.8 | 67% | 0.671 | 23% | 0.225 | S | C | * | . | H | α-helix | trans | -86.2 | -41.1 | 178.7 | -77 | -77.5 | 0 | 0 | 0 | 113 | I305 | I305-F309 HydrophobicContact CG2-CD2 3.55Å; I305-F309 HydrophobicContact CG2-CE2 3.79Å; I305-F309 VanDerWaalsContact O-CD2 3.27Å; I305-F309 WeakPolarHBondContact O-CD2 3.49Å; I305-F309 PolarHBondContact O-N 3.45Å |
| 310 | L | 66.6 | Low | 80.2 | Confident | 59 Ų | 59 | 51 Ų | 51 | 31% | 0.309 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -101.8 | -17.8 | -172 | -66.1 | 143.2 | 0 | 0 | 0 | 114.1 | R242 M243 V246 I306 E312 | R242-L310 HydrophobicContact CG-CD2 4.42Å; M243-L310 HydrophobicContact CB-CB 4.18Å; M243-L310 HydrophobicContact CG-CB 4.12Å; V246-L310 HydrophobicContact CB-CD1 4.18Å; V246-L310 HydrophobicContact CG1-CD1 3.94Å; V246-L310 HydrophobicContact CG2-CD1 4.24Å; I306-L310 HydrophobicContact CG2-CD1 3.72Å; I306-L310 VanDerWaalsContact O-CB 3.26Å; I306-L310 WeakPolarHBondContact O-CB 3.42Å; I306-L310 PolarHBondContact O-N 3.24Å; L310-E312 PolarHBondContact O-N 3.46Å |
| 311 | G | 68.3 | Low | 79.5 | Confident | 8 Ų | 8 | 52.8 Ų | 52.8 | 8% | 0.082 | 26% | 0.255 | C | S | . | . | trans | -90.1 | 95.5 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y307 T313 F314 R315 | Y307-G311 VanDerWaalsContact O-CA 3.23Å; Y307-G311 WeakPolarHBondContact O-CA 3.31Å; Y307-G311 PolarHBondContact O-N 3.18Å; G311-T313 PolarHBondContact O-N 3.5Å; G311-F314 PolarHBondContact O-N 3.33Å; G311-R315 VanDerWaalsContact O-CG 3.29Å; G311-R315 WeakPolarHBondContact O-CG 3.32Å; G311-R315 PolarHBondContact O-N 3.46Å | ||
| 312 | E | 70 | Confident | 79 | Confident | 97 Ų | 97 | 56.8 Ų | 56.8 | 45% | 0.453 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -63.4 | -41.8 | 179.3 | -67.3 | -158.2 | 141.1 | 0 | 0 | 113.7 | K239 L310 F314 R315 D316 | K239-E312 WeakPolarHBondContact CE-OE1 3.36Å; K239-E312 WeakPolarHBondContact CE-OE2 3.15Å; K239-E312 IonicContact NZ-OE1 3.89Å; K239-E312 PolarHBondContact NZ-OE1 2.92Å; K239-E312 IonicContact NZ-OE2 2.64Å; K239-E312 PolarHBondContact NZ-OE2 3.43Å; L310-E312 PolarHBondContact O-N 3.46Å; E312-F314 VanDerWaalsContact C-N 3.27Å; E312-F314 PolarHBondContact O-N 2.89Å; E312-R315 PolarHBondContact O-N 2.82Å; E312-R315 VanDerWaalsContact O-N 3.15Å; E312-D316 PolarHBondContact O-N 2.91Å |
| 313 | T | 69.8 | Low | 78.4 | Confident | 68 Ų | 68 | 61 Ų | 61 | 42% | 0.417 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -61 | -39 | 177.5 | -51.3 | 0 | 0 | 0 | 0 | 111.5 | T75 G311 K317 | T75-T313 HydrophobicContact CG2-CG2 4.47Å; G311-T313 PolarHBondContact O-N 3.5Å; T313-K317 HydrophobicContact CG2-CD 4.46Å; T313-K317 VanDerWaalsContact O-CG 3.28Å; T313-K317 WeakPolarHBondContact O-CG 3.34Å; T313-K317 PolarHBondContact O-N 2.96Å; T313-K317 VanDerWaalsContact O-N 3.11Å |
| 314 | F | 71.9 | Confident | 77.8 | Confident | 12 Ų | 12 | 65.9 Ų | 65.9 | 5% | 0.053 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -67.8 | -44.9 | 174.2 | 176.8 | -105.5 | 0 | 0 | 0 | 111.4 | L62 I63 V66 G311 E312 D316 K317 L318 | L62-F314 HydrophobicContact CD2-CZ 4.4Å; L62-F314 HydrophobicContact CG-CZ 4.31Å; I63-F314 HydrophobicContact CB-CE2 4.49Å; I63-F314 HydrophobicContact CG1-CE2 4.02Å; I63-F314 HydrophobicContact CG1-CZ 4.04Å; V66-F314 HydrophobicContact CB-CE2 3.93Å; V66-F314 HydrophobicContact CG1-CD2 4.16Å; V66-F314 HydrophobicContact CG1-CE2 3.96Å; V66-F314 HydrophobicContact CG2-CE2 4.28Å; G311-F314 PolarHBondContact O-N 3.33Å; E312-F314 VanDerWaalsContact C-N 3.27Å; E312-F314 PolarHBondContact O-N 2.89Å; F314-D316 VanDerWaalsContact C-N 3.31Å; F314-D316 PolarHBondContact O-N 2.88Å; F314-K317 PolarHBondContact O-N 2.95Å; F314-L318 HydrophobicContact CE1-CD2 4.21Å; F314-L318 VanDerWaalsContact O-CB 3.27Å; F314-L318 WeakPolarHBondContact O-CB 3.32Å; F314-L318 PolarHBondContact O-N 2.9Å |
| 315 | R | 79.2 | Confident | 77.2 | Confident | 116 Ų | 116 | 72.3 Ų | 72.3 | 44% | 0.438 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -59.6 | -39.7 | 176.6 | -71.1 | 172.8 | 71.1 | 179.7 | -0.5 | 112.7 | S308 G311 E312 L318 R319 | S308-R315 WeakPolarHBondContact O-CD 3.37Å; S308-R315 WeakPolarHBondContact O-CG 3.27Å; G311-R315 VanDerWaalsContact O-CG 3.29Å; G311-R315 WeakPolarHBondContact O-CG 3.32Å; G311-R315 PolarHBondContact O-N 3.46Å; E312-R315 PolarHBondContact O-N 2.82Å; E312-R315 VanDerWaalsContact O-N 3.15Å; R315-L318 PolarHBondContact O-N 2.88Å; R315-R319 VanDerWaalsContact O-CB 3.31Å; R315-R319 WeakPolarHBondContact O-CB 3.03Å; R315-R319 PolarHBondContact O-N 3.34Å |
| 316 | D | 78.9 | Confident | 76.6 | Confident | 91 Ų | 91 | 72 Ų | 72 | 49% | 0.487 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -67.2 | -45.9 | 177.4 | -73.1 | -22.6 | 0 | 0 | 0 | 111.1 | E312 F314 L318 R319 L320 | E312-D316 PolarHBondContact O-N 2.91Å; F314-D316 VanDerWaalsContact C-N 3.31Å; F314-D316 PolarHBondContact O-N 2.88Å; D316-L318 PolarHBondContact O-N 3.36Å; D316-R319 PolarHBondContact O-N 3.42Å; D316-L320 WeakPolarHBondContact O-CG 3.47Å; D316-L320 PolarHBondContact O-N 2.68Å |
| 317 | K | 76.2 | Confident | 75.8 | Confident | 14 Ų | 14 | 74.8 Ų | 74.8 | 6% | 0.061 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -62.3 | -41.7 | 174.6 | -71.6 | 173.4 | 175.5 | -177.6 | 0 | 112.1 | V66 N67 K73 D78 T313 F314 L320 F321 | V66-K317 HydrophobicContact CG1-CB 3.48Å; V66-K317 VanDerWaalsContact CG1-CB 3.48Å; N67-K317 PolarHBondContact OD1-NZ 3.24Å; K73-K317 WeakPolarHBondContact O-CE 3.27Å; K73-K317 PolarHBondContact O-NZ 3.33Å; D78-K317 VanDerWaalsContact CG-NZ 3.33Å; D78-K317 IonicContact OD1-NZ 3.7Å; D78-K317 IonicContact OD2-NZ 3.52Å; D78-K317 PolarHBondContact OD2-NZ 2.99Å; T313-K317 HydrophobicContact CG2-CD 4.46Å; T313-K317 VanDerWaalsContact O-CG 3.28Å; T313-K317 WeakPolarHBondContact O-CG 3.34Å; T313-K317 PolarHBondContact O-N 2.96Å; T313-K317 VanDerWaalsContact O-N 3.11Å; F314-K317 PolarHBondContact O-N 2.95Å; K317-L320 PolarHBondContact O-N 3.44Å; K317-F321 WeakPolarHBondContact O-CB 3.32Å; K317-F321 PolarHBondContact O-N 2.9Å |
| 318 | L | 78.7 | Confident | 74.9 | Confident | 43 Ų | 43 | 83.7 Ų | 83.7 | 23% | 0.225 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -62.8 | -44.1 | 176 | 178.8 | 62.5 | 0 | 0 | 0 | 111 | L62 V66 F314 R315 D316 L320 F321 V322 | L62-L318 HydrophobicContact CD1-CD1 3.91Å; L62-L318 HydrophobicContact CD2-CD1 3.89Å; L62-L318 HydrophobicContact CD2-CD2 4.45Å; L62-L318 HydrophobicContact CG-CD1 4.15Å; V66-L318 HydrophobicContact CG2-CD1 3.91Å; F314-L318 HydrophobicContact CE1-CD2 4.21Å; F314-L318 VanDerWaalsContact O-CB 3.27Å; F314-L318 WeakPolarHBondContact O-CB 3.32Å; F314-L318 PolarHBondContact O-N 2.9Å; R315-L318 PolarHBondContact O-N 2.88Å; D316-L318 PolarHBondContact O-N 3.36Å; L318-L320 VanDerWaalsContact C-N 3.34Å; L318-L320 PolarHBondContact O-N 2.93Å; L318-F321 PolarHBondContact O-N 2.91Å; L318-V322 HydrophobicContact CD1-CG2 4.24Å; L318-V322 VanDerWaalsContact O-CG2 3.3Å; L318-V322 WeakPolarHBondContact O-CG2 3.35Å; L318-V322 PolarHBondContact O-N 3.34Å |
| 319 | R | 82.5 | Confident | 74.3 | Confident | 150 Ų | 150 | 83.9 Ų | 83.9 | 57% | 0.566 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -61.5 | -42.2 | 176.1 | -175.7 | -176.7 | -69.9 | -177 | -3.6 | 111.5 | R315 D316 K323 | R315-R319 VanDerWaalsContact O-CB 3.31Å; R315-R319 WeakPolarHBondContact O-CB 3.03Å; R315-R319 PolarHBondContact O-N 3.34Å; D316-R319 PolarHBondContact O-N 3.42Å; R319-K323 WeakPolarHBondContact O-CB 3.23Å; R319-K323 WeakPolarHBondContact O-CG 3.34Å; R319-K323 PolarHBondContact O-N 3.31Å |
| 320 | L | 79.9 | Confident | 74.1 | Confident | 88 Ų | 88 | 79.8 Ų | 79.8 | 46% | 0.461 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -63.7 | -45.7 | 175.3 | -71.5 | 173.1 | 0 | 0 | 0 | 111.4 | D316 K317 L318 V322 K323 Q324 | D316-L320 WeakPolarHBondContact O-CG 3.47Å; D316-L320 PolarHBondContact O-N 2.68Å; K317-L320 PolarHBondContact O-N 3.44Å; L318-L320 VanDerWaalsContact C-N 3.34Å; L318-L320 PolarHBondContact O-N 2.93Å; L320-V322 PolarHBondContact O-N 3.05Å; L320-K323 PolarHBondContact O-N 2.88Å; L320-Q324 WeakPolarHBondContact O-CB 3.27Å; L320-Q324 PolarHBondContact O-N 3.13Å |
| 321 | F | 79.9 | Confident | 73.9 | Confident | 38 Ų | 38 | 80.7 Ų | 80.7 | 17% | 0.167 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -58.7 | -47.2 | 176.8 | -178.8 | -100.3 | 0 | 0 | 0 | 112.1 | V65 V66 T69 K317 L318 Q324 K325 | V65-F321 HydrophobicContact CG1-CE1 4.48Å; V65-F321 HydrophobicContact CG1-CE2 3.85Å; V65-F321 HydrophobicContact CG1-CZ 3.67Å; V66-F321 HydrophobicContact CG2-CB 4.46Å; V66-F321 HydrophobicContact CG2-CD1 4.34Å; V66-F321 HydrophobicContact CG2-CG 4.33Å; T69-F321 HydrophobicContact CG2-CD2 4.38Å; K317-F321 WeakPolarHBondContact O-CB 3.32Å; K317-F321 PolarHBondContact O-N 2.9Å; L318-F321 PolarHBondContact O-N 2.91Å; F321-Q324 PolarHBondContact O-N 3.21Å; F321-K325 HydrophobicContact CE1-CD 4.45Å; F321-K325 WeakPolarHBondContact O-CB 3.38Å; F321-K325 PolarHBondContact O-N 2.93Å |
| 322 | V | 83.3 | Confident | 73.6 | Confident | 84 Ų | 84 | 84.8 Ų | 84.8 | 51% | 0.509 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63.3 | -43.7 | 177.3 | 172.1 | 0 | 0 | 0 | 0 | 111.1 | L318 L320 K325 A326 | L318-V322 HydrophobicContact CD1-CG2 4.24Å; L318-V322 VanDerWaalsContact O-CG2 3.3Å; L318-V322 WeakPolarHBondContact O-CG2 3.35Å; L318-V322 PolarHBondContact O-N 3.34Å; L320-V322 PolarHBondContact O-N 3.05Å; V322-K325 PolarHBondContact O-N 2.92Å; V322-A326 VanDerWaalsContact O-CB 3.25Å; V322-A326 WeakPolarHBondContact O-CB 3.31Å; V322-A326 PolarHBondContact O-N 2.94Å |
| 323 | K | 80 | Confident | 73.5 | Confident | 139 Ų | 139 | 87.9 Ų | 87.9 | 60% | 0.604 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -61.9 | -43.2 | 176.1 | -78 | -176.9 | 176.4 | -169.2 | 0 | 112.3 | R319 L320 A326 S327 | R319-K323 WeakPolarHBondContact O-CB 3.23Å; R319-K323 WeakPolarHBondContact O-CG 3.34Å; R319-K323 PolarHBondContact O-N 3.31Å; L320-K323 PolarHBondContact O-N 2.88Å; K323-A326 PolarHBondContact O-N 3.42Å; K323-S327 WeakPolarHBondContact O-CB 3.49Å; K323-S327 PolarHBondContact O-N 2.79Å |
| 324 | Q | 77.8 | Confident | 73.2 | Confident | 104 Ų | 104 | 91.7 Ų | 91.7 | 49% | 0.486 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -64.8 | -43.2 | 178.9 | -171.2 | 175.8 | 7 | 0 | 0 | 111.4 | L320 F321 S327 W328 | L320-Q324 WeakPolarHBondContact O-CB 3.27Å; L320-Q324 PolarHBondContact O-N 3.13Å; F321-Q324 PolarHBondContact O-N 3.21Å; Q324-S327 PolarHBondContact O-N 3.45Å; Q324-W328 WeakPolarHBondContact O-CB 3.49Å; Q324-W328 PolarHBondContact O-N 3.4Å |
| 325 | K | 76 | Confident | 72.8 | Confident | 144 Ų | 144 | 94.7 Ų | 94.7 | 63% | 0.626 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -68.8 | -37.7 | 177 | -161.3 | 175.6 | -176.2 | 178.7 | 0 | 112.2 | F321 V322 W328 S329 | F321-K325 HydrophobicContact CE1-CD 4.45Å; F321-K325 WeakPolarHBondContact O-CB 3.38Å; F321-K325 PolarHBondContact O-N 2.93Å; V322-K325 PolarHBondContact O-N 2.92Å; K325-W328 PolarHBondContact O-N 2.93Å; K325-S329 WeakPolarHBondContact O-CB 3.34Å; K325-S329 PolarHBondContact O-N 2.97Å |
| 326 | A | 74.1 | Confident | 71.8 | Confident | 49 Ų | 49 | 94.4 Ų | 94.4 | 41% | 0.405 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -63.6 | -45.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | V322 K323 S329 V330 | V322-A326 VanDerWaalsContact O-CB 3.25Å; V322-A326 WeakPolarHBondContact O-CB 3.31Å; V322-A326 PolarHBondContact O-N 2.94Å; K323-A326 PolarHBondContact O-N 3.42Å; A326-S329 PolarHBondContact O-N 3.38Å; A326-S329 PolarHBondContact O-OG 3.49Å; A326-V330 WeakPolarHBondContact O-CG2 3.43Å; A326-V330 PolarHBondContact O-N 3.2Å |
| 327 | S | 70.3 | Confident | 70.9 | Confident | 70 Ų | 70 | 95.9 Ų | 95.9 | 49% | 0.49 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -60.9 | -45.8 | 174.9 | 179.9 | 0 | 0 | 0 | 0 | 111.8 | K323 Q324 S329 V330 V331 | K323-S327 WeakPolarHBondContact O-CB 3.49Å; K323-S327 PolarHBondContact O-N 2.79Å; Q324-S327 PolarHBondContact O-N 3.45Å; S327-S329 VanDerWaalsContact C-N 3.34Å; S327-S329 PolarHBondContact O-N 3.46Å; S327-V330 PolarHBondContact O-N 3Å; S327-V331 WeakPolarHBondContact O-CG2 3.36Å; S327-V331 PolarHBondContact O-N 3.47Å |
| 328 | W | 60.2 | Low | 70.1 | Confident | 189 Ų | 189 | 98.5 Ų | 98.5 | 72% | 0.716 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -60.4 | -39.3 | 173.2 | -100.8 | 66.5 | 0 | 0 | 0 | 113 | Q324 K325 V330 V331 N332 | Q324-W328 WeakPolarHBondContact O-CB 3.49Å; Q324-W328 PolarHBondContact O-N 3.4Å; K325-W328 PolarHBondContact O-N 2.93Å; W328-V330 VanDerWaalsContact C-N 3.32Å; W328-V330 PolarHBondContact O-N 3.3Å; W328-V331 PolarHBondContact O-N 2.96Å; W328-N332 VanDerWaalsContact O-CB 3.28Å; W328-N332 WeakPolarHBondContact O-CB 3.22Å; W328-N332 PolarHBondContact O-N 3.41Å |
| 329 | S | 64.6 | Low | 69.3 | Low | 46 Ų | 46 | 101.5 Ų | 101.5 | 32% | 0.322 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.4 | -31.8 | 176.7 | 75.7 | 0 | 0 | 0 | 0 | 113 | K325 A326 S327 R333 | K325-S329 WeakPolarHBondContact O-CB 3.34Å; K325-S329 PolarHBondContact O-N 2.97Å; A326-S329 PolarHBondContact O-N 3.38Å; A326-S329 PolarHBondContact O-OG 3.49Å; S327-S329 VanDerWaalsContact C-N 3.34Å; S327-S329 PolarHBondContact O-N 3.46Å; S329-R333 WeakPolarHBondContact O-CB 3.37Å; S329-R333 WeakPolarHBondContact O-CG 3.37Å; S329-R333 PolarHBondContact O-N 2.97Å; S329-R333 VanDerWaalsContact O-N 3.11Å; S329-R333 PolarHBondContact O-NE 3.37Å; S329-R333 PolarHBondContact OG-NH2 3.03Å |
| 330 | V | 67.1 | Low | 68.3 | Low | 66 Ų | 66 | 98.8 Ų | 98.8 | 40% | 0.4 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -72.2 | -46.2 | 173.6 | 171.9 | 0 | 0 | 0 | 0 | 110.1 | A326 S327 W328 N332 R333 F334 | A326-V330 WeakPolarHBondContact O-CG2 3.43Å; A326-V330 PolarHBondContact O-N 3.2Å; S327-V330 PolarHBondContact O-N 3Å; W328-V330 VanDerWaalsContact C-N 3.32Å; W328-V330 PolarHBondContact O-N 3.3Å; V330-N332 VanDerWaalsContact C-N 3.33Å; V330-N332 PolarHBondContact O-N 3.25Å; V330-R333 PolarHBondContact O-N 2.68Å; V330-F334 HydrophobicContact CG1-CD2 3.84Å; V330-F334 HydrophobicContact CG1-CE2 4.01Å; V330-F334 WeakPolarHBondContact O-CD2 3.42Å; V330-F334 PolarHBondContact O-N 3.3Å |
| 331 | V | 63.8 | Low | 67.3 | Low | 79 Ų | 79 | 99.1 Ų | 99.1 | 48% | 0.479 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60 | -43.3 | 175.8 | 172.9 | 0 | 0 | 0 | 0 | 110.9 | S327 W328 R333 F334 C335 | S327-V331 WeakPolarHBondContact O-CG2 3.36Å; S327-V331 PolarHBondContact O-N 3.47Å; W328-V331 PolarHBondContact O-N 2.96Å; V331-R333 PolarHBondContact O-N 3.41Å; V331-F334 PolarHBondContact O-N 2.93Å; V331-C335 PolarHBondContact O-N 2.86Å |
| 332 | N | 62.2 | Low | 66.2 | Low | 94 Ų | 94 | 103.6 Ų | 103.6 | 50% | 0.503 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67.1 | -36.3 | 179.3 | -155.4 | 30.3 | 0 | 0 | 0 | 112.2 | W328 V330 C335 H336 | W328-N332 VanDerWaalsContact O-CB 3.28Å; W328-N332 WeakPolarHBondContact O-CB 3.22Å; W328-N332 PolarHBondContact O-N 3.41Å; V330-N332 VanDerWaalsContact C-N 3.33Å; V330-N332 PolarHBondContact O-N 3.25Å; N332-C335 PolarHBondContact O-N 2.95Å; N332-H336 WeakPolarHBondContact O-CB 3.34Å; N332-H336 PolarHBondContact O-N 3.18Å |
| 333 | R | 66.2 | Low | 65 | Low | 161 Ų | 161 | 103.9 Ų | 103.9 | 61% | 0.608 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -65.1 | -40.2 | 170.5 | -83.2 | -173.3 | -71.4 | -113.9 | -5.3 | 112.5 | S329 V330 V331 H336 H337 | S329-R333 WeakPolarHBondContact O-CB 3.37Å; S329-R333 WeakPolarHBondContact O-CG 3.37Å; S329-R333 PolarHBondContact O-N 2.97Å; S329-R333 VanDerWaalsContact O-N 3.11Å; S329-R333 PolarHBondContact O-NE 3.37Å; S329-R333 PolarHBondContact OG-NH2 3.03Å; V330-R333 PolarHBondContact O-N 2.68Å; V331-R333 PolarHBondContact O-N 3.41Å; R333-H336 PolarHBondContact O-N 3.41Å; R333-H337 WeakPolarHBondContact O-CB 3.47Å; R333-H337 PolarHBondContact O-N 2.9Å |
| 334 | F | 65.1 | Low | 63.7 | Low | 148 Ų | 148 | 100.4 Ų | 100.4 | 65% | 0.649 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.7 | -41 | 174.6 | -96.2 | -81.5 | 0 | 0 | 0 | 112.2 | V330 V331 H337 S338 | V330-F334 HydrophobicContact CG1-CD2 3.84Å; V330-F334 HydrophobicContact CG1-CE2 4.01Å; V330-F334 WeakPolarHBondContact O-CD2 3.42Å; V330-F334 PolarHBondContact O-N 3.3Å; V331-F334 PolarHBondContact O-N 2.93Å; F334-H337 PolarHBondContact O-N 3.48Å; F334-S338 WeakPolarHBondContact O-CB 3.49Å; F334-S338 PolarHBondContact O-N 2.96Å |
| 335 | C | 62.3 | Low | 62.7 | Low | 76 Ų | 76 | 99.4 Ų | 99.4 | 51% | 0.514 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.1 | -43.9 | 174.7 | -77.5 | 0 | 0 | 0 | 0 | 111.9 | V331 N332 S338 L339 | V331-C335 PolarHBondContact O-N 2.86Å; N332-C335 PolarHBondContact O-N 2.95Å; C335-S338 PolarHBondContact O-N 3.47Å; C335-L339 WeakPolarHBondContact O-CB 3.22Å; C335-L339 PolarHBondContact O-N 2.97Å |
| 336 | H | 59.1 | Low | 61.6 | Low | 109 Ų | 109 | 101.2 Ų | 101.2 | 51% | 0.505 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62 | -44.7 | 174.2 | -96.3 | -80.6 | 0 | 0 | 0 | 112.2 | N332 R333 S338 L339 D340 | N332-H336 WeakPolarHBondContact O-CB 3.34Å; N332-H336 PolarHBondContact O-N 3.18Å; R333-H336 PolarHBondContact O-N 3.41Å; H336-S338 PolarHBondContact O-N 2.96Å; H336-L339 PolarHBondContact O-N 2.92Å; H336-D340 PolarHBondContact O-N 3Å |
| 337 | H | 60.5 | Low | 60.5 | Low | 122 Ų | 122 | 103.8 Ų | 103.8 | 57% | 0.565 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -66.1 | -38.5 | 178.9 | -162.5 | 57.7 | 0 | 0 | 0 | 112.7 | R333 F334 L339 D340 L341 | R333-H337 WeakPolarHBondContact O-CB 3.47Å; R333-H337 PolarHBondContact O-N 2.9Å; F334-H337 PolarHBondContact O-N 3.48Å; H337-L339 VanDerWaalsContact C-N 3.32Å; H337-L339 PolarHBondContact O-N 3.03Å; H337-D340 PolarHBondContact O-N 2.99Å; H337-L341 WeakPolarHBondContact O-CD1 3.42Å; H337-L341 PolarHBondContact O-N 3.35Å |
| 338 | S | 59.3 | Low | 59.7 | Low | 70 Ų | 70 | 107.5 Ų | 107.5 | 49% | 0.49 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.9 | -32 | 174.1 | -174.9 | 0 | 0 | 0 | 0 | 112.7 | F334 C335 H336 H342 | F334-S338 WeakPolarHBondContact O-CB 3.49Å; F334-S338 PolarHBondContact O-N 2.96Å; C335-S338 PolarHBondContact O-N 3.47Å; H336-S338 PolarHBondContact O-N 2.96Å; S338-H342 WeakPolarHBondContact O-CB 3.28Å; S338-H342 PolarHBondContact O-N 2.87Å |
| 339 | L | 60.8 | Low | 59.4 | Low | 106 Ų | 106 | 103.5 Ų | 103.5 | 56% | 0.555 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -73.2 | -40.9 | 177 | -160 | 75.3 | 0 | 0 | 0 | 111.2 | C335 H336 H337 H342 L343 | C335-L339 WeakPolarHBondContact O-CB 3.22Å; C335-L339 PolarHBondContact O-N 2.97Å; H336-L339 PolarHBondContact O-N 2.92Å; H337-L339 VanDerWaalsContact C-N 3.32Å; H337-L339 PolarHBondContact O-N 3.03Å; L339-H342 PolarHBondContact O-N 3.27Å; L339-L343 PolarHBondContact O-N 3.31Å |
| 340 | D | 61.6 | Low | 58.8 | Low | 93 Ų | 93 | 105.4 Ų | 105.4 | 50% | 0.497 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -65.8 | -39.6 | 175.7 | -72.5 | -22.9 | 0 | 0 | 0 | 112.3 | H336 H337 H342 L343 S344 | H336-D340 PolarHBondContact O-N 3Å; H337-D340 PolarHBondContact O-N 2.99Å; D340-H342 VanDerWaalsContact C-N 3.34Å; D340-L343 PolarHBondContact O-N 3.4Å; D340-S344 WeakPolarHBondContact O-CB 3.43Å; D340-S344 PolarHBondContact O-N 3.05Å |
| 341 | L | 59.7 | Low | 58 | Low | 95 Ų | 95 | 110.6 Ų | 110.6 | 50% | 0.497 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.1 | -38.8 | 172.7 | -100.5 | 115.8 | 0 | 0 | 0 | 112.1 | H337 S344 V345 | H337-L341 WeakPolarHBondContact O-CD1 3.42Å; H337-L341 PolarHBondContact O-N 3.35Å; L341-S344 PolarHBondContact O-N 3.2Å; L341-V345 VanDerWaalsContact O-CG2 3.28Å; L341-V345 WeakPolarHBondContact O-CG2 3.48Å; L341-V345 PolarHBondContact O-N 2.97Å |
| 342 | H | 56.1 | Low | 57.1 | Low | 132 Ų | 132 | 115.8 Ų | 115.8 | 61% | 0.611 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -69.1 | -32.4 | 177.9 | -110.8 | -67.2 | 0 | 0 | 0 | 113.2 | S338 L339 D340 R346 | S338-H342 WeakPolarHBondContact O-CB 3.28Å; S338-H342 PolarHBondContact O-N 2.87Å; L339-H342 PolarHBondContact O-N 3.27Å; D340-H342 VanDerWaalsContact C-N 3.34Å; H342-R346 WeakPolarHBondContact O-CB 3.47Å; H342-R346 PolarHBondContact O-N 3.5Å |
| 343 | L | 58 | Low | 56.8 | Low | 89 Ų | 89 | 116.9 Ų | 116.9 | 47% | 0.466 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -71.3 | -45.8 | 173.3 | -76.5 | 161.6 | 0 | 0 | 0 | 111.4 | L339 D340 V345 R346 D347 | L339-L343 PolarHBondContact O-N 3.31Å; D340-L343 PolarHBondContact O-N 3.4Å; L343-V345 VanDerWaalsContact C-N 3.33Å; L343-V345 PolarHBondContact O-N 3.03Å; L343-R346 PolarHBondContact O-N 3.24Å; L343-R346 VanDerWaalsContact O-N 3.1Å; L343-D347 PolarHBondContact O-N 3.19Å |
| 344 | S | 53.8 | Low | 56.3 | Low | 66 Ų | 66 | 114.5 Ų | 114.5 | 46% | 0.462 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -64 | -33.9 | 178.3 | -176 | 0 | 0 | 0 | 0 | 113.7 | D340 L341 K348 | D340-S344 WeakPolarHBondContact O-CB 3.43Å; D340-S344 PolarHBondContact O-N 3.05Å; L341-S344 PolarHBondContact O-N 3.2Å; S344-K348 PolarHBondContact O-N 3.48Å |
| 345 | V | 56.1 | Low | 55.8 | Low | 84 Ų | 84 | 112.7 Ų | 112.7 | 51% | 0.509 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -71.7 | -35.6 | 173.6 | 171.7 | 0 | 0 | 0 | 0 | 111.4 | L341 L343 K348 V349 | L341-V345 VanDerWaalsContact O-CG2 3.28Å; L341-V345 WeakPolarHBondContact O-CG2 3.48Å; L341-V345 PolarHBondContact O-N 2.97Å; L343-V345 VanDerWaalsContact C-N 3.33Å; L343-V345 PolarHBondContact O-N 3.03Å; V345-K348 PolarHBondContact O-N 3.47Å; V345-V349 HydrophobicContact CG1-CG2 4.49Å; V345-V349 VanDerWaalsContact O-CG2 3.27Å; V345-V349 WeakPolarHBondContact O-CG2 3.27Å; V345-V349 PolarHBondContact O-N 3.28Å |
| 346 | R | 52.2 | Low | 55.5 | Low | 182 Ų | 182 | 114.8 Ų | 114.8 | 69% | 0.687 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -66.7 | -40.8 | 177.1 | -174.3 | 175.6 | -74 | -176.2 | -3 | 111.7 | H342 L343 K348 V349 S350 | H342-R346 WeakPolarHBondContact O-CB 3.47Å; H342-R346 PolarHBondContact O-N 3.5Å; L343-R346 PolarHBondContact O-N 3.24Å; L343-R346 VanDerWaalsContact O-N 3.1Å; R346-K348 VanDerWaalsContact C-N 3.34Å; R346-K348 PolarHBondContact O-N 3.32Å; R346-V349 PolarHBondContact O-N 3.31Å; R346-S350 PolarHBondContact O-N 3.1Å; R346-S350 PolarHBondContact O-OG 3.27Å |
| 347 | D | 52 | Low | 55.2 | Low | 102 Ų | 102 | 115.2 Ų | 115.2 | 55% | 0.545 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -67.3 | -33.8 | 178.3 | -67.3 | -24.5 | 0 | 0 | 0 | 112.4 | L343 S350 | L343-D347 PolarHBondContact O-N 3.19Å; D347-S350 WeakPolarHBondContact CA-OG 3.49Å; D347-S350 PolarHBondContact O-OG 2.85Å |
| 348 | K | 52.6 | Low | 54.9 | Low | 149 Ų | 149 | 114.7 Ų | 114.7 | 65% | 0.648 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -73.8 | -24 | 174.7 | -77.7 | -174.5 | 177.3 | -177.5 | 0 | 114.4 | S344 V345 R346 | S344-K348 PolarHBondContact O-N 3.48Å; V345-K348 PolarHBondContact O-N 3.47Å; R346-K348 VanDerWaalsContact C-N 3.34Å; R346-K348 PolarHBondContact O-N 3.32Å |
| 349 | V | 54.5 | Low | 54.6 | Low | 104 Ų | 104 | 117.9 Ų | 117.9 | 63% | 0.63 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -83.4 | -18.6 | 177.6 | 172.5 | 0 | 0 | 0 | 0 | 111.6 | V345 R346 | V345-V349 HydrophobicContact CG1-CG2 4.49Å; V345-V349 VanDerWaalsContact O-CG2 3.27Å; V345-V349 WeakPolarHBondContact O-CG2 3.27Å; V345-V349 PolarHBondContact O-N 3.28Å; R346-V349 PolarHBondContact O-N 3.31Å |
| 350 | S | 51.8 | Low | 54.1 | Low | 86 Ų | 86 | 118.8 Ų | 118.8 | 60% | 0.601 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.2 | -6.1 | 173.3 | 42.6 | 0 | 0 | 0 | 0 | 115.3 | R346 D347 | R346-S350 PolarHBondContact O-N 3.1Å; R346-S350 PolarHBondContact O-OG 3.27Å; D347-S350 WeakPolarHBondContact CA-OG 3.49Å; D347-S350 PolarHBondContact O-OG 2.85Å |
| 351 | E | 49.8 | Very low | 53.5 | Low | 176 Ų | 176 | 121 Ų | 121 | 82% | 0.822 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.7 | 7.8 | 178.9 | -78.5 | -171.9 | 155.4 | 0 | 0 | 114.2 | ||
| 352 | V | 45 | Very low | 52.9 | Low | 187 Ų | 187 | 123.4 Ų | 123.4 | 100% | 1.133 | 65% | 0.647 | S | S | * | * | trans | -118 | 0 | 171.9 | -175.4 | 0 | 0 | 0 | 0 | 108.8 |
Retrieved 352 of 352 residues in 350.4 ms
(Link to these results)