| 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 | 37.9 | Very low | 39.9 | Very low | 242 Ų | 242 | 155.3 Ų | 155.3 | 100% | 1.192 | 84% | 0.837 | S | S | * | * | 0 | 86.1 | 0 | -75 | 177.2 | 171.8 | 0 | 0 | 108.4 | |||||
| 2 | Q | 32.9 | Very low | 41.5 | Very low | 193 Ų | 193 | 146.6 Ų | 146.6 | 90% | 0.902 | 80% | 0.797 | S | S | * | * | trans | -91.9 | 115.6 | 172 | -80.4 | 172.9 | -27.8 | 0 | 0 | 107.3 | S4 | Q2-S4 PolarHBondContact O-N 3.37Š| ||
| 3 | L | 37.1 | Very low | 43.1 | Very low | 165 Ų | 165 | 147.8 Ų | 147.8 | 86% | 0.864 | 79% | 0.794 | S | S | * | * | trans | -80.9 | 103.6 | 165.9 | -88.8 | 103.2 | 0 | 0 | 0 | 108.1 | I5 | L3-I5 PolarHBondContact O-N 3.19Š| ||
| 4 | S | 32.9 | Very low | 44.9 | Very low | 108 Ų | 108 | 145.1 Ų | 145.1 | 76% | 0.755 | 78% | 0.78 | S | S | * | * | trans | -65.5 | 112.9 | 169 | -66.5 | 0 | 0 | 0 | 0 | 110.2 | Q2 K6 | Q2-S4 PolarHBondContact O-N 3.37Å; S4-K6 PolarHBondContact O-N 3.26Å | ||
| 5 | I | 40 | Very low | 46.7 | Very low | 163 Ų | 163 | 141.9 Ų | 141.9 | 84% | 0.836 | 76% | 0.762 | S | S | * | * | trans | -66.3 | 108.3 | 162.5 | -65.9 | 165 | 0 | 0 | 0 | 106.3 | L3 M7 | L3-I5 PolarHBondContact O-N 3.19Å; I5-M7 PolarHBondContact O-N 3.18Å | ||
| 6 | K | 37.7 | Very low | 48.4 | Very low | 198 Ų | 198 | 138.1 Ų | 138.1 | 86% | 0.861 | 74% | 0.741 | S | S | * | * | trans | -62.6 | 116.3 | 173.8 | -82.3 | 178.7 | 173.5 | 177.9 | 0 | 108.7 | S4 A8 | S4-K6 PolarHBondContact O-N 3.26Å; K6-A8 PolarHBondContact O-N 3.38Å | ||
| 7 | M | 38.8 | Very low | 50.2 | Low | 180 Ų | 180 | 136.2 Ų | 136.2 | 89% | 0.887 | 73% | 0.729 | S | S | * | * | trans | -41.9 | 130.1 | 168.6 | -74.2 | -88 | -157.1 | 0 | 0 | 111.4 | I5 | I5-M7 PolarHBondContact O-N 3.18Š| ||
| 8 | A | 43.8 | Very low | 51.7 | Low | 92 Ų | 92 | 135.6 Ų | 135.6 | 76% | 0.76 | 73% | 0.726 | S | S | * | * | trans | -58.2 | 136.8 | 161.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | K6 S10 | K6-A8 PolarHBondContact O-N 3.38Å; A8-S10 PolarHBondContact O-N 3.38Å; A8-S10 VanDerWaalsContact O-N 3.1Å | ||
| 9 | A | 43.5 | Very low | 53.3 | Low | 80 Ų | 80 | 131.6 Ų | 131.6 | 66% | 0.661 | 71% | 0.71 | S | S | * | * | trans | -53.2 | 114.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111 | Y11 | A9-Y11 VanDerWaalsContact C-N 3.31Å; A9-Y11 HydrophobicContact CB-CD2 4.41Å; A9-Y11 HydrophobicContact CB-CE2 4.26Å; A9-Y11 PolarHBondContact O-N 3.37Å | ||
| 10 | S | 45.2 | Very low | 54.9 | Low | 118 Ų | 118 | 129.8 Ų | 129.8 | 83% | 0.825 | 70% | 0.7 | S | S | * | * | trans | -75.2 | 85.5 | 167.4 | 56.2 | 0 | 0 | 0 | 0 | 108.4 | A8 S12 | A8-S10 PolarHBondContact O-N 3.38Å; A8-S10 VanDerWaalsContact O-N 3.1Å; S10-S12 PolarHBondContact O-N 3.1Å | ||
| 11 | Y | 49.8 | Very low | 56.2 | Low | 169 Ų | 169 | 125 Ų | 125 | 66% | 0.663 | 68% | 0.681 | S | S | * | * | trans | -60.7 | 127 | 153.3 | -73.5 | -85.3 | 0 | 0 | 0 | 106.3 | A9 E13 | A9-Y11 VanDerWaalsContact C-N 3.31Å; A9-Y11 HydrophobicContact CB-CD2 4.41Å; A9-Y11 HydrophobicContact CB-CE2 4.26Å; A9-Y11 PolarHBondContact O-N 3.37Å; Y11-E13 PolarHBondContact O-N 3.5Å | ||
| 12 | S | 58.7 | Low | 58.6 | Low | 51 Ų | 51 | 116.6 Ų | 116.6 | 36% | 0.357 | 64% | 0.644 | S | S | . | * | trans | -61.9 | 135.8 | 172.7 | 77.7 | 0 | 0 | 0 | 0 | 107.3 | S10 N14 D15 | S10-S12 PolarHBondContact O-N 3.1Å; S12-N14 PolarHBondContact O-N 3.05Å; S12-D15 PolarHBondContact O-N 3.45Å; S12-D15 PolarHBondContact OG-N 3.32Å; S12-D15 PolarHBondContact OG-OD2 3.35Å | ||
| 13 | E | 62.4 | Low | 61.3 | Low | 162 Ų | 162 | 111.1 Ų | 111.1 | 76% | 0.757 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -52.4 | -29.3 | 179.8 | -71.7 | -179 | 153.5 | 0 | 0 | 111.6 | Y11 I17 | Y11-E13 PolarHBondContact O-N 3.5Å; E13-I17 WeakPolarHBondContact O-CD1 3.35Å; E13-I17 WeakPolarHBondContact O-CG1 3.12Å; E13-I17 PolarHBondContact O-N 2.95Å; E13-I17 VanDerWaalsContact O-N 3.16Å |
| 14 | N | 68.2 | Low | 63.6 | Low | 111 Ų | 111 | 105.4 Ų | 105.4 | 59% | 0.594 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -67.4 | -40.1 | 176.7 | -65.9 | -22.7 | 0 | 0 | 0 | 113.5 | S12 L16 I17 D18 | S12-N14 PolarHBondContact O-N 3.05Å; N14-L16 VanDerWaalsContact C-N 3.29Å; N14-L16 PolarHBondContact O-N 3.49Å; N14-I17 PolarHBondContact O-N 3.48Å; N14-D18 WeakPolarHBondContact O-CB 3.43Å; N14-D18 PolarHBondContact O-N 3.41Å |
| 15 | D | 71.8 | Confident | 66.2 | Low | 96 Ų | 96 | 104.1 Ų | 104.1 | 51% | 0.513 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66 | -34.3 | 178.9 | -65.6 | -41.6 | 0 | 0 | 0 | 111.9 | S12 S19 | S12-D15 PolarHBondContact O-N 3.45Å; S12-D15 PolarHBondContact OG-N 3.32Å; S12-D15 PolarHBondContact OG-OD2 3.35Å; D15-S19 PolarHBondContact O-N 3.16Å; D15-S19 PolarHBondContact O-OG 3.4Å |
| 16 | L | 73.4 | Confident | 68.8 | Low | 82 Ų | 82 | 104.8 Ų | 104.8 | 43% | 0.429 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -69 | -45.9 | 175.2 | -76.8 | 159.7 | 0 | 0 | 0 | 110.9 | N14 D18 S19 D20 | N14-L16 VanDerWaalsContact C-N 3.29Å; N14-L16 PolarHBondContact O-N 3.49Å; L16-D18 VanDerWaalsContact C-N 3.35Å; L16-D18 PolarHBondContact O-N 2.94Å; L16-S19 PolarHBondContact O-N 3.02Å; L16-S19 PolarHBondContact O-OG 3.29Å; L16-D20 WeakPolarHBondContact O-CB 3.4Å; L16-D20 PolarHBondContact O-N 3.49Å |
| 17 | I | 78.9 | Confident | 71.3 | Confident | 106 Ų | 106 | 101.3 Ų | 101.3 | 54% | 0.544 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -61.9 | -42.1 | 178.3 | -67.5 | 163.3 | 0 | 0 | 0 | 111.3 | E13 N14 S19 G21 | E13-I17 WeakPolarHBondContact O-CD1 3.35Å; E13-I17 WeakPolarHBondContact O-CG1 3.12Å; E13-I17 PolarHBondContact O-N 2.95Å; E13-I17 VanDerWaalsContact O-N 3.16Å; N14-I17 PolarHBondContact O-N 3.48Å; I17-S19 VanDerWaalsContact C-N 3.29Å; I17-S19 PolarHBondContact O-N 3.41Å; I17-G21 WeakPolarHBondContact O-CA 3.43Å; I17-G21 PolarHBondContact O-N 3.06Å |
| 18 | D | 77.9 | Confident | 73.6 | Confident | 124 Ų | 124 | 97.7 Ų | 97.7 | 66% | 0.663 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -67.9 | -29.7 | -179.9 | -75.9 | -18.1 | 0 | 0 | 0 | 112.5 | N14 L16 P22 | N14-D18 WeakPolarHBondContact O-CB 3.43Å; N14-D18 PolarHBondContact O-N 3.41Å; L16-D18 VanDerWaalsContact C-N 3.35Å; L16-D18 PolarHBondContact O-N 2.94Å; D18-P22 VanDerWaalsContact O-CD 3.27Å; D18-P22 WeakPolarHBondContact O-CD 3.4Å |
| 19 | S | 82.3 | Confident | 76 | Confident | 61 Ų | 61 | 97.3 Ų | 97.3 | 43% | 0.427 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -82.4 | -41.3 | 176.4 | 71.1 | 0 | 0 | 0 | 0 | 113.7 | D15 L16 I17 N23 | D15-S19 PolarHBondContact O-N 3.16Å; D15-S19 PolarHBondContact O-OG 3.4Å; L16-S19 PolarHBondContact O-N 3.02Å; L16-S19 PolarHBondContact O-OG 3.29Å; I17-S19 VanDerWaalsContact C-N 3.29Å; I17-S19 PolarHBondContact O-N 3.41Å; S19-N23 PolarHBondContact O-ND2 3Å; S19-N23 VanDerWaalsContact O-ND2 3.16Å |
| 20 | D | 84.1 | Confident | 78.4 | Confident | 95 Ų | 95 | 95.8 Ų | 95.8 | 51% | 0.508 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -90.4 | -27.6 | -174.2 | -76.3 | -23.1 | 0 | 0 | 0 | 113.2 | L16 N23 A24 | L16-D20 WeakPolarHBondContact O-CB 3.4Å; L16-D20 PolarHBondContact O-N 3.49Å; D20-N23 PolarHBondContact O-N 2.97Å; D20-A24 WeakPolarHBondContact O-CB 3.49Å; D20-A24 PolarHBondContact O-N 3.16Å |
| 21 | G | 83.5 | Confident | 80.5 | Confident | 29 Ų | 29 | 94.7 Ų | 94.7 | 30% | 0.299 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -51.1 | -56.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | I17 N23 A24 V25 | I17-G21 WeakPolarHBondContact O-CA 3.43Å; I17-G21 PolarHBondContact O-N 3.06Å; G21-N23 VanDerWaalsContact C-N 3.27Å; G21-N23 PolarHBondContact O-N 2.71Å; G21-A24 PolarHBondContact O-N 3.16Å; G21-V25 WeakPolarHBondContact O-CG2 3.44Å; G21-V25 PolarHBondContact O-N 2.93Å |
| 22 | P | 88.9 | Confident | 82.6 | Confident | 66 Ų | 66 | 90.8 Ų | 90.8 | 43% | 0.429 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.6 | -32.7 | -180 | 24.9 | -33.8 | 0 | 0 | 0 | 112.5 | D18 R26 | D18-P22 VanDerWaalsContact O-CD 3.27Å; D18-P22 WeakPolarHBondContact O-CD 3.4Å; P22-R26 VanDerWaalsContact O-CG 3.29Å; P22-R26 WeakPolarHBondContact O-CG 3.21Å; P22-R26 PolarHBondContact O-N 3.44Å; P22-R26 VanDerWaalsContact O-N 3.09Å |
| 23 | N | 87.9 | Confident | 84.3 | Confident | 77 Ų | 77 | 94.9 Ų | 94.9 | 41% | 0.412 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -70.2 | -42.6 | 176.7 | -70.6 | -35.9 | 0 | 0 | 0 | 111.6 | S19 D20 G21 R26 L27 | S19-N23 PolarHBondContact O-ND2 3Å; S19-N23 VanDerWaalsContact O-ND2 3.16Å; D20-N23 PolarHBondContact O-N 2.97Å; G21-N23 VanDerWaalsContact C-N 3.27Å; G21-N23 PolarHBondContact O-N 2.71Å; N23-R26 PolarHBondContact O-N 2.95Å; N23-L27 WeakPolarHBondContact O-CG 3.33Å; N23-L27 PolarHBondContact O-N 3.49Å |
| 24 | A | 85.6 | Confident | 85.8 | Confident | 46 Ų | 46 | 92.5 Ų | 92.5 | 38% | 0.38 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.5 | -44.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | D20 G21 R26 L27 L28 | D20-A24 WeakPolarHBondContact O-CB 3.49Å; D20-A24 PolarHBondContact O-N 3.16Å; G21-A24 PolarHBondContact O-N 3.16Å; A24-R26 PolarHBondContact O-N 3.24Å; A24-L27 PolarHBondContact O-N 3.41Å; A24-L28 WeakPolarHBondContact O-CB 3.38Å; A24-L28 WeakPolarHBondContact O-CG 3.37Å; A24-L28 PolarHBondContact O-N 3.5Å |
| 25 | V | 88.1 | Confident | 86.9 | Confident | 81 Ų | 81 | 91.1 Ų | 91.1 | 49% | 0.491 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.9 | -43.5 | 176.8 | 173.8 | 0 | 0 | 0 | 0 | 111.3 | G21 L27 L28 N29 | G21-V25 WeakPolarHBondContact O-CG2 3.44Å; G21-V25 PolarHBondContact O-N 2.93Å; V25-L27 PolarHBondContact O-N 3.09Å; V25-L28 PolarHBondContact O-N 2.81Å; V25-N29 WeakPolarHBondContact O-CB 3.3Å; V25-N29 VanDerWaalsContact O-CG 3.28Å; V25-N29 PolarHBondContact O-N 2.88Å; V25-N29 PolarHBondContact O-ND2 3.02Å |
| 26 | R | 93.6 | Very high | 88 | Confident | 177 Ų | 177 | 89.4 Ų | 89.4 | 67% | 0.668 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60.1 | -45.2 | 175 | -76.6 | 174.4 | 178.2 | 174.3 | -0.1 | 112.2 | P22 N23 A24 N29 S30 | P22-R26 VanDerWaalsContact O-CG 3.29Å; P22-R26 WeakPolarHBondContact O-CG 3.21Å; P22-R26 PolarHBondContact O-N 3.44Å; P22-R26 VanDerWaalsContact O-N 3.09Å; N23-R26 PolarHBondContact O-N 2.95Å; A24-R26 PolarHBondContact O-N 3.24Å; R26-N29 PolarHBondContact O-N 3.42Å; R26-S30 PolarHBondContact O-N 2.96Å |
| 27 | L | 90.5 | Very high | 89.1 | Confident | 124 Ų | 124 | 88.6 Ų | 88.6 | 65% | 0.649 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -67.2 | -39.5 | 179.6 | -71.3 | 172.8 | 0 | 0 | 0 | 112.2 | N23 A24 V25 S30 L31 | N23-L27 WeakPolarHBondContact O-CG 3.33Å; N23-L27 PolarHBondContact O-N 3.49Å; A24-L27 PolarHBondContact O-N 3.41Å; V25-L27 PolarHBondContact O-N 3.09Å; L27-S30 PolarHBondContact O-N 3.44Å; L27-L31 WeakPolarHBondContact O-CB 3.36Å; L27-L31 PolarHBondContact O-N 3.02Å |
| 28 | L | 87.8 | Confident | 89.8 | Confident | 104 Ų | 104 | 87.5 Ų | 87.5 | 55% | 0.545 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.3 | -43.1 | 175.2 | -74.8 | 171.7 | 0 | 0 | 0 | 111.6 | A24 V25 L31 T32 | A24-L28 WeakPolarHBondContact O-CB 3.38Å; A24-L28 WeakPolarHBondContact O-CG 3.37Å; A24-L28 PolarHBondContact O-N 3.5Å; V25-L28 PolarHBondContact O-N 2.81Å; L28-L31 WeakPolarHBondContact O-CB 3.3Å; L28-L31 PolarHBondContact O-N 3.19Å; L28-T32 WeakPolarHBondContact O-CG2 3.49Å; L28-T32 PolarHBondContact O-N 2.72Å; L28-T32 PolarHBondContact O-OG1 2.9Å |
| 29 | N | 93.3 | Very high | 90.6 | Very high | 84 Ų | 84 | 84 Ų | 84 | 45% | 0.449 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.8 | -41.2 | 175 | -70.6 | -22.2 | 0 | 0 | 0 | 111.8 | V25 R26 L31 T32 E33 | V25-N29 WeakPolarHBondContact O-CB 3.3Å; V25-N29 VanDerWaalsContact O-CG 3.28Å; V25-N29 PolarHBondContact O-N 2.88Å; V25-N29 PolarHBondContact O-ND2 3.02Å; R26-N29 PolarHBondContact O-N 3.42Å; N29-L31 VanDerWaalsContact C-N 3.31Å; N29-L31 PolarHBondContact O-N 3.46Å; N29-T32 WeakPolarHBondContact CA-OG1 3.48Å; N29-T32 PolarHBondContact O-N 3.22Å; N29-T32 PolarHBondContact O-OG1 3.36Å; N29-E33 WeakPolarHBondContact O-CG 3.41Å; N29-E33 PolarHBondContact O-N 3.25Å |
| 30 | S | 94.6 | Very high | 91.2 | Very high | 49 Ų | 49 | 82.3 Ų | 82.3 | 34% | 0.343 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -62.9 | -39.8 | 174.2 | -172.3 | 0 | 0 | 0 | 0 | 111.9 | R26 L27 E33 Q34 | R26-S30 PolarHBondContact O-N 2.96Å; L27-S30 PolarHBondContact O-N 3.44Å; S30-E33 PolarHBondContact O-N 3.31Å; S30-Q34 WeakPolarHBondContact O-CB 3.41Å; S30-Q34 VanDerWaalsContact O-CG 3.25Å; S30-Q34 WeakPolarHBondContact O-CG 3.38Å; S30-Q34 PolarHBondContact O-N 2.93Å |
| 31 | L | 89.7 | Confident | 91.7 | Very high | 94 Ų | 94 | 83.4 Ų | 83.4 | 49% | 0.492 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.5 | -43.2 | 176.8 | -175.7 | 68.8 | 0 | 0 | 0 | 111.5 | L27 L28 N29 Q34 V35 | L27-L31 WeakPolarHBondContact O-CB 3.36Å; L27-L31 PolarHBondContact O-N 3.02Å; L28-L31 WeakPolarHBondContact O-CB 3.3Å; L28-L31 PolarHBondContact O-N 3.19Å; N29-L31 VanDerWaalsContact C-N 3.31Å; N29-L31 PolarHBondContact O-N 3.46Å; L31-Q34 PolarHBondContact O-N 2.96Å; L31-V35 HydrophobicContact CD1-CG2 4.48Å; L31-V35 HydrophobicContact CG-CG2 4.46Å; L31-V35 WeakPolarHBondContact O-CB 3.35Å; L31-V35 VanDerWaalsContact O-CG2 3.25Å; L31-V35 WeakPolarHBondContact O-CG2 3.46Å; L31-V35 PolarHBondContact O-N 3.26Å |
| 32 | T | 93.1 | Very high | 92.1 | Very high | 88 Ų | 88 | 85.9 Ų | 85.9 | 54% | 0.54 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65 | -40.3 | 178.6 | 56 | 0 | 0 | 0 | 0 | 111.7 | L28 N29 V35 A36 | L28-T32 WeakPolarHBondContact O-CG2 3.49Å; L28-T32 PolarHBondContact O-N 2.72Å; L28-T32 PolarHBondContact O-OG1 2.9Å; N29-T32 WeakPolarHBondContact CA-OG1 3.48Å; N29-T32 PolarHBondContact O-N 3.22Å; N29-T32 PolarHBondContact O-OG1 3.36Å; T32-V35 PolarHBondContact O-N 3.28Å; T32-A36 WeakPolarHBondContact O-CB 3.3Å; T32-A36 PolarHBondContact O-N 3.09Å |
| 33 | E | 95.2 | Very high | 92.3 | Very high | 136 Ų | 136 | 90.2 Ų | 90.2 | 64% | 0.636 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -61.3 | -45.6 | 172.8 | -73.1 | 174.2 | -172.5 | 0 | 0 | 112.1 | N29 S30 A36 S37 | N29-E33 WeakPolarHBondContact O-CG 3.41Å; N29-E33 PolarHBondContact O-N 3.25Å; S30-E33 PolarHBondContact O-N 3.31Å; E33-A36 PolarHBondContact O-N 2.76Å; E33-S37 WeakPolarHBondContact O-CB 3.3Å; E33-S37 PolarHBondContact O-N 2.96Å |
| 34 | Q | 93.8 | Very high | 92.6 | Very high | 113 Ų | 113 | 90.3 Ų | 90.3 | 53% | 0.528 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.4 | -43.9 | 177.7 | -74.1 | 175.9 | 11.1 | 0 | 0 | 111.9 | S30 L31 A36 S37 V38 | S30-Q34 WeakPolarHBondContact O-CB 3.41Å; S30-Q34 VanDerWaalsContact O-CG 3.25Å; S30-Q34 WeakPolarHBondContact O-CG 3.38Å; S30-Q34 PolarHBondContact O-N 2.93Å; L31-Q34 PolarHBondContact O-N 2.96Å; Q34-A36 VanDerWaalsContact C-N 3.35Å; Q34-A36 PolarHBondContact O-N 2.97Å; Q34-S37 PolarHBondContact O-N 2.63Å; Q34-V38 VanDerWaalsContact O-CG2 3.32Å; Q34-V38 WeakPolarHBondContact O-CG2 3.31Å; Q34-V38 PolarHBondContact O-N 3.4Å |
| 35 | V | 91.6 | Very high | 92.8 | Very high | 81 Ų | 81 | 92.3 Ų | 92.3 | 49% | 0.491 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63 | -42.1 | 176.3 | 170.9 | 0 | 0 | 0 | 0 | 110.6 | L31 T32 S37 V38 T39 | L31-V35 HydrophobicContact CD1-CG2 4.48Å; L31-V35 HydrophobicContact CG-CG2 4.46Å; L31-V35 WeakPolarHBondContact O-CB 3.35Å; L31-V35 VanDerWaalsContact O-CG2 3.25Å; L31-V35 WeakPolarHBondContact O-CG2 3.46Å; L31-V35 PolarHBondContact O-N 3.26Å; T32-V35 PolarHBondContact O-N 3.28Å; V35-S37 PolarHBondContact O-N 3.3Å; V35-V38 PolarHBondContact O-N 2.9Å; V35-T39 HydrophobicContact CG1-CG2 4.2Å; V35-T39 WeakPolarHBondContact O-CB 3.42Å; V35-T39 WeakPolarHBondContact O-CG2 3.37Å; V35-T39 PolarHBondContact O-N 3.26Å; V35-T39 PolarHBondContact O-OG1 2.68Å |
| 36 | A | 94.6 | Very high | 92.9 | Very high | 60 Ų | 60 | 92.7 Ų | 92.7 | 50% | 0.496 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.8 | -43.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | T32 E33 Q34 T39 G40 | T32-A36 WeakPolarHBondContact O-CB 3.3Å; T32-A36 PolarHBondContact O-N 3.09Å; E33-A36 PolarHBondContact O-N 2.76Å; Q34-A36 VanDerWaalsContact C-N 3.35Å; Q34-A36 PolarHBondContact O-N 2.97Å; A36-T39 WeakPolarHBondContact CA-OG1 3.41Å; A36-T39 PolarHBondContact O-OG1 3.48Å; A36-G40 PolarHBondContact O-N 3.46Å |
| 37 | S | 95.5 | Very high | 92.8 | Very high | 66 Ų | 66 | 90.9 Ų | 90.9 | 46% | 0.462 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.9 | -49.2 | 177.3 | -174.9 | 0 | 0 | 0 | 0 | 112.2 | E33 Q34 V35 T39 G40 Q41 | E33-S37 WeakPolarHBondContact O-CB 3.3Å; E33-S37 PolarHBondContact O-N 2.96Å; Q34-S37 PolarHBondContact O-N 2.63Å; V35-S37 PolarHBondContact O-N 3.3Å; S37-T39 PolarHBondContact O-N 2.95Å; S37-G40 PolarHBondContact O-N 2.94Å; S37-Q41 WeakPolarHBondContact O-CG 3.34Å; S37-Q41 PolarHBondContact O-N 3.4Å |
| 38 | V | 93.8 | Very high | 92.7 | Very high | 82 Ų | 82 | 91 Ų | 91 | 50% | 0.497 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64 | -43.3 | 179.2 | 173.3 | 0 | 0 | 0 | 0 | 111.1 | Q34 V35 G40 Q41 V42 | Q34-V38 VanDerWaalsContact O-CG2 3.32Å; Q34-V38 WeakPolarHBondContact O-CG2 3.31Å; Q34-V38 PolarHBondContact O-N 3.4Å; V35-V38 PolarHBondContact O-N 2.9Å; V38-G40 VanDerWaalsContact C-N 3.3Å; V38-G40 PolarHBondContact O-N 2.82Å; V38-Q41 PolarHBondContact O-N 3.49Å; V38-V42 HydrophobicContact CG1-CG2 4.35Å; V38-V42 WeakPolarHBondContact O-CG2 3.27Å; V38-V42 PolarHBondContact O-N 3.27Å |
| 39 | T | 94.4 | Very high | 92.7 | Very high | 50 Ų | 50 | 88.7 Ų | 88.7 | 31% | 0.307 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.4 | -34.7 | 176.7 | 54.3 | 0 | 0 | 0 | 0 | 112.2 | V35 A36 S37 R43 | V35-T39 HydrophobicContact CG1-CG2 4.2Å; V35-T39 WeakPolarHBondContact O-CB 3.42Å; V35-T39 WeakPolarHBondContact O-CG2 3.37Å; V35-T39 PolarHBondContact O-N 3.26Å; V35-T39 PolarHBondContact O-OG1 2.68Å; A36-T39 WeakPolarHBondContact CA-OG1 3.41Å; A36-T39 PolarHBondContact O-OG1 3.48Å; S37-T39 PolarHBondContact O-N 2.95Å; T39-R43 WeakPolarHBondContact O-CB 3.33Å; T39-R43 VanDerWaalsContact O-CG 3.24Å; T39-R43 WeakPolarHBondContact O-CG 3.45Å; T39-R43 PolarHBondContact O-N 3.49Å |
| 40 | G | 95.7 | Very high | 92.4 | Very high | 26 Ų | 26 | 91.9 Ų | 91.9 | 27% | 0.268 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.5 | -52.5 | 170.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A36 S37 V38 V42 R43 D44 | A36-G40 PolarHBondContact O-N 3.46Å; S37-G40 PolarHBondContact O-N 2.94Å; V38-G40 VanDerWaalsContact C-N 3.3Å; V38-G40 PolarHBondContact O-N 2.82Å; G40-V42 VanDerWaalsContact C-N 3.34Å; G40-V42 PolarHBondContact O-N 3.34Å; G40-R43 PolarHBondContact O-N 3.29Å; G40-D44 PolarHBondContact O-N 3.23Å |
| 41 | Q | 93.9 | Very high | 91.9 | Very high | 119 Ų | 119 | 92.2 Ų | 92.2 | 56% | 0.556 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -59 | -43.4 | 178.4 | -68.2 | 177.5 | 2.3 | 0 | 0 | 112.4 | S37 V38 D44 L45 | S37-Q41 WeakPolarHBondContact O-CG 3.34Å; S37-Q41 PolarHBondContact O-N 3.4Å; V38-Q41 PolarHBondContact O-N 3.49Å; Q41-D44 PolarHBondContact O-N 2.95Å; Q41-L45 WeakPolarHBondContact O-CG 3.42Å; Q41-L45 PolarHBondContact O-N 3Å |
| 42 | V | 91.9 | Very high | 91.6 | Very high | 80 Ų | 80 | 90.3 Ų | 90.3 | 49% | 0.485 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.6 | -44 | 177.9 | 172.1 | 0 | 0 | 0 | 0 | 110.8 | V38 G40 D44 L45 L46 | V38-V42 HydrophobicContact CG1-CG2 4.35Å; V38-V42 WeakPolarHBondContact O-CG2 3.27Å; V38-V42 PolarHBondContact O-N 3.27Å; G40-V42 VanDerWaalsContact C-N 3.34Å; G40-V42 PolarHBondContact O-N 3.34Å; V42-D44 VanDerWaalsContact C-N 3.31Å; V42-D44 PolarHBondContact O-N 3.49Å; V42-L45 PolarHBondContact O-N 3.1Å; V42-L46 WeakPolarHBondContact O-CB 3.39Å; V42-L46 PolarHBondContact O-N 2.88Å |
| 43 | R | 94.3 | Very high | 91 | Very high | 158 Ų | 158 | 93.9 Ų | 93.9 | 60% | 0.596 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.6 | -40.8 | 176.3 | -75.4 | 172.6 | -176 | 137.1 | -0.6 | 111.9 | T39 G40 L46 K47 | T39-R43 WeakPolarHBondContact O-CB 3.33Å; T39-R43 VanDerWaalsContact O-CG 3.24Å; T39-R43 WeakPolarHBondContact O-CG 3.45Å; T39-R43 PolarHBondContact O-N 3.49Å; G40-R43 PolarHBondContact O-N 3.29Å; R43-L46 PolarHBondContact O-N 2.93Å; R43-K47 WeakPolarHBondContact O-CG 3.4Å; R43-K47 PolarHBondContact O-N 2.91Å |
| 44 | D | 93.3 | Very high | 90.1 | Very high | 78 Ų | 78 | 92.3 Ų | 92.3 | 42% | 0.417 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67.6 | -39.2 | 177.8 | -73.7 | -15.6 | 0 | 0 | 0 | 112.4 | G40 Q41 V42 L46 K47 R48 | G40-D44 PolarHBondContact O-N 3.23Å; Q41-D44 PolarHBondContact O-N 2.95Å; V42-D44 VanDerWaalsContact C-N 3.31Å; V42-D44 PolarHBondContact O-N 3.49Å; D44-L46 VanDerWaalsContact C-N 3.35Å; D44-K47 PolarHBondContact O-N 3.34Å; D44-K47 IonicContact OD1-NZ 3.03Å; D44-R48 VanDerWaalsContact O-CG 3.29Å; D44-R48 WeakPolarHBondContact O-CG 3.36Å; D44-R48 PolarHBondContact O-N 2.95Å; D44-R48 VanDerWaalsContact O-N 3.13Å |
| 45 | L | 89.6 | Confident | 89.2 | Confident | 88 Ų | 88 | 95.1 Ų | 95.1 | 46% | 0.461 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.4 | -43.2 | 171.7 | -71.8 | 170.8 | 0 | 0 | 0 | 111.3 | Q41 V42 K47 R48 V49 | Q41-L45 WeakPolarHBondContact O-CG 3.42Å; Q41-L45 PolarHBondContact O-N 3Å; V42-L45 PolarHBondContact O-N 3.1Å; L45-K47 PolarHBondContact O-N 3.26Å; L45-R48 WeakPolarHBondContact O-CB 3.48Å; L45-R48 PolarHBondContact O-N 3.42Å; L45-R48 VanDerWaalsContact O-N 3.08Å; L45-V49 WeakPolarHBondContact O-CG2 3.27Å; L45-V49 PolarHBondContact O-N 2.91Å |
| 46 | L | 90.1 | Very high | 88.4 | Confident | 90 Ų | 90 | 96.7 Ų | 96.7 | 47% | 0.471 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.2 | -43.9 | 179.2 | -142.9 | 168.2 | 0 | 0 | 0 | 111.2 | V42 R43 D44 R48 V49 Q50 | V42-L46 WeakPolarHBondContact O-CB 3.39Å; V42-L46 PolarHBondContact O-N 2.88Å; R43-L46 PolarHBondContact O-N 2.93Å; D44-L46 VanDerWaalsContact C-N 3.35Å; L46-R48 VanDerWaalsContact C-N 3.31Å; L46-R48 PolarHBondContact O-N 3.42Å; L46-V49 PolarHBondContact O-N 3.47Å; L46-Q50 HydrophobicContact CD2-CG 3.85Å; L46-Q50 VanDerWaalsContact CD2-NE2 3.27Å; L46-Q50 WeakPolarHBondContact O-CB 3.34Å; L46-Q50 WeakPolarHBondContact O-CG 3.26Å; L46-Q50 PolarHBondContact O-N 3Å |
| 47 | K | 92.3 | Very high | 87.4 | Confident | 138 Ų | 138 | 98.7 Ų | 98.7 | 60% | 0.6 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -58.9 | -40.3 | 172.7 | -71.7 | 172.8 | -175.4 | 170.1 | 0 | 112.3 | R43 D44 L45 G51 | R43-K47 WeakPolarHBondContact O-CG 3.4Å; R43-K47 PolarHBondContact O-N 2.91Å; D44-K47 PolarHBondContact O-N 3.34Å; D44-K47 IonicContact OD1-NZ 3.03Å; L45-K47 PolarHBondContact O-N 3.26Å; K47-G51 PolarHBondContact O-N 3.38Å |
| 48 | R | 87.8 | Confident | 86.2 | Confident | 127 Ų | 127 | 105 Ų | 105 | 48% | 0.479 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -68.2 | -37.3 | 177.9 | -68 | 170 | -170.1 | -161.5 | 4 | 112.2 | D44 L45 L46 G52 K53 F54 | D44-R48 VanDerWaalsContact O-CG 3.29Å; D44-R48 WeakPolarHBondContact O-CG 3.36Å; D44-R48 PolarHBondContact O-N 2.95Å; D44-R48 VanDerWaalsContact O-N 3.13Å; L45-R48 WeakPolarHBondContact O-CB 3.48Å; L45-R48 PolarHBondContact O-N 3.42Å; L45-R48 VanDerWaalsContact O-N 3.08Å; L46-R48 VanDerWaalsContact C-N 3.31Å; L46-R48 PolarHBondContact O-N 3.42Å; R48-G52 PolarHBondContact O-N 3.43Å; R48-K53 HydrophobicContact CB-CD 4.47Å; R48-K53 HydrophobicContact CG-CD 4.47Å; R48-K53 WeakPolarHBondContact O-CB 3.38Å; R48-K53 PolarHBondContact O-N 3.4Å; R48-K53 VanDerWaalsContact O-N 3.09Å; R48-F54 HydrophobicContact CB-CD2 4Å; R48-F54 HydrophobicContact CB-CE2 3.72Å |
| 49 | V | 87.8 | Confident | 85.2 | Confident | 56 Ų | 56 | 103.9 Ų | 103.9 | 34% | 0.339 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -67.9 | -47.3 | 175.2 | 174.8 | 0 | 0 | 0 | 0 | 110.7 | L45 L46 G51 G52 F54 T56 | L45-V49 WeakPolarHBondContact O-CG2 3.27Å; L45-V49 PolarHBondContact O-N 2.91Å; L46-V49 PolarHBondContact O-N 3.47Å; V49-G51 VanDerWaalsContact C-N 3.26Å; V49-G51 PolarHBondContact O-N 3.48Å; V49-G52 PolarHBondContact O-N 2.92Å; V49-F54 HydrophobicContact CG2-CB 4.24Å; V49-F54 HydrophobicContact CG2-CD2 4.03Å; V49-T56 HydrophobicContact CG1-CG2 3.95Å |
| 50 | Q | 86.9 | Confident | 84.5 | Confident | 150 Ų | 150 | 104 Ų | 104 | 70% | 0.701 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -61.1 | -35.6 | 175.4 | -74.2 | 175.6 | -15.5 | 0 | 0 | 112.3 | L46 G52 | L46-Q50 HydrophobicContact CD2-CG 3.85Å; L46-Q50 VanDerWaalsContact CD2-NE2 3.27Å; L46-Q50 WeakPolarHBondContact O-CB 3.34Å; L46-Q50 WeakPolarHBondContact O-CG 3.26Å; L46-Q50 PolarHBondContact O-N 3Å; Q50-G52 PolarHBondContact O-N 3.27Å; Q50-G52 VanDerWaalsContact O-N 3.16Å |
| 51 | G | 85.8 | Confident | 84 | Confident | 56 Ų | 56 | 107.2 Ų | 107.2 | 58% | 0.577 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.1 | 8.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | K47 V49 K53 | K47-G51 PolarHBondContact O-N 3.38Å; V49-G51 VanDerWaalsContact C-N 3.26Å; V49-G51 PolarHBondContact O-N 3.48Å; G51-K53 PolarHBondContact O-N 2.93Å; G51-K53 VanDerWaalsContact O-N 3.15Å |
| 52 | G | 83.1 | Confident | 83.8 | Confident | 54 Ų | 54 | 103.6 Ų | 103.6 | 56% | 0.557 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 70 | 7.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | R48 V49 Q50 F54 | R48-G52 PolarHBondContact O-N 3.43Å; V49-G52 PolarHBondContact O-N 2.92Å; Q50-G52 PolarHBondContact O-N 3.27Å; Q50-G52 VanDerWaalsContact O-N 3.16Å; G52-F54 VanDerWaalsContact C-N 3.27Å; G52-F54 PolarHBondContact O-N 3.03Å |
| 53 | K | 79.4 | Confident | 83.6 | Confident | 163 Ų | 163 | 101.5 Ų | 101.5 | 71% | 0.709 | 54% | 0.541 | S | S | * | . | S | Bend | trans | -68.9 | -27.2 | -178.5 | -64.6 | -176.1 | 176.6 | -179.2 | 0 | 112.6 | R48 G51 | R48-K53 HydrophobicContact CB-CD 4.47Å; R48-K53 HydrophobicContact CG-CD 4.47Å; R48-K53 WeakPolarHBondContact O-CB 3.38Å; R48-K53 PolarHBondContact O-N 3.4Å; R48-K53 VanDerWaalsContact O-N 3.09Å; G51-K53 PolarHBondContact O-N 2.93Å; G51-K53 VanDerWaalsContact O-N 3.15Å |
| 54 | F | 76.8 | Confident | 83.4 | Confident | 103 Ų | 103 | 98.1 Ų | 98.1 | 45% | 0.452 | 53% | 0.534 | S | S | . | . | S | Bend | trans | -119.4 | 118.8 | 176 | -59 | -60.7 | 0 | 0 | 0 | 109.5 | R48 V49 G52 T56 | R48-F54 HydrophobicContact CB-CD2 4Å; R48-F54 HydrophobicContact CB-CE2 3.72Å; V49-F54 HydrophobicContact CG2-CB 4.24Å; V49-F54 HydrophobicContact CG2-CD2 4.03Å; G52-F54 VanDerWaalsContact C-N 3.27Å; G52-F54 PolarHBondContact O-N 3.03Å; F54-T56 PolarHBondContact O-N 2.99Å |
| 55 | Q | 74.6 | Confident | 83.3 | Confident | 173 Ų | 173 | 98.1 Ų | 98.1 | 81% | 0.808 | 53% | 0.534 | S | S | * | . | trans | -81.7 | 108.6 | 173.8 | -68.7 | 172.3 | 4.4 | 0 | 0 | 108.8 | ||||
| 56 | T | 75 | Confident | 83.5 | Confident | 113 Ų | 113 | 98 Ų | 98 | 69% | 0.693 | 53% | 0.528 | S | S | * | . | trans | -89.7 | 0.9 | -179 | 53.1 | 0 | 0 | 0 | 0 | 113.6 | V49 F54 K58 | V49-T56 HydrophobicContact CG1-CG2 3.95Å; F54-T56 PolarHBondContact O-N 2.99Å; T56-K58 VanDerWaalsContact C-N 3.32Å; T56-K58 PolarHBondContact O-N 2.92Å | ||
| 57 | S | 74.2 | Confident | 83.6 | Confident | 102 Ų | 102 | 100.4 Ų | 100.4 | 71% | 0.713 | 53% | 0.531 | S | S | * | . | S | Bend | trans | -71.1 | -22 | -173.9 | 55.1 | 0 | 0 | 0 | 0 | 114.5 | ||
| 58 | K | 69.6 | Low | 83.6 | Confident | 198 Ų | 198 | 99.4 Ų | 99.4 | 86% | 0.861 | 53% | 0.529 | S | S | * | . | S | Bend | trans | -126.7 | 103.7 | 178.9 | -65.4 | -177.1 | -177.6 | 178.2 | 0 | 109.5 | T56 | T56-K58 VanDerWaalsContact C-N 3.32Å; T56-K58 PolarHBondContact O-N 2.92Å |
| 59 | G | 72.8 | Confident | 83.9 | Confident | 60 Ų | 60 | 94.7 Ų | 94.7 | 62% | 0.619 | 51% | 0.513 | S | S | * | . | trans | -128.9 | 166.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | S61 | G59-S61 PolarHBondContact O-N 3.17Š| ||
| 60 | L | 79.9 | Confident | 84.2 | Confident | 52 Ų | 52 | 95.1 Ų | 95.1 | 27% | 0.272 | 51% | 0.513 | S | S | . | . | trans | -81.3 | 103.4 | 169.8 | -70 | 171.1 | 0 | 0 | 0 | 108.6 | F62 L63 D64 I120 L123 | L60-F62 PolarHBondContact O-N 3.02Å; L60-L63 HydrophobicContact CB-CB 4.33Å; L60-L63 HydrophobicContact CB-CD1 4.04Å; L60-L63 HydrophobicContact CB-CG 4.2Å; L60-L63 HydrophobicContact CD1-CD1 3.75Å; L60-L63 HydrophobicContact CD1-CG 4.43Å; L60-L63 HydrophobicContact CG-CD1 4.5Å; L60-L63 WeakPolarHBondContact O-CB 3.31Å; L60-L63 PolarHBondContact O-N 3.19Å; L60-D64 PolarHBondContact O-N 2.81Å; L60-I120 HydrophobicContact CD1-CG1 3.71Å; L60-L123 HydrophobicContact CD1-CD1 3.98Å; L60-L123 HydrophobicContact CD2-CD1 4.37Å; L60-L123 HydrophobicContact CG-CD1 4.25Å | ||
| 61 | S | 85.8 | Confident | 84.6 | Confident | 93 Ų | 93 | 93.1 Ų | 93.1 | 65% | 0.65 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -51.5 | -31.9 | -179.7 | 169.8 | 0 | 0 | 0 | 0 | 113.8 | G59 D64 L65 | G59-S61 PolarHBondContact O-N 3.17Å; S61-D64 PolarHBondContact O-N 2.91Å; S61-L65 PolarHBondContact O-N 2.94Å; S61-L65 VanDerWaalsContact O-N 3.08Å |
| 62 | F | 88.9 | Confident | 85 | Confident | 44 Ų | 44 | 95.3 Ų | 95.3 | 19% | 0.193 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -64 | -38.8 | 175.6 | 173.7 | -95.6 | 0 | 0 | 0 | 113.3 | L60 R66 M109 L112 D113 L116 | L60-F62 PolarHBondContact O-N 3.02Å; F62-R66 PolarHBondContact O-N 3.29Å; F62-R66 VanDerWaalsContact O-N 3.08Å; F62-M109 HydrophobicContact CD2-CE 3.93Å; F62-M109 HydrophobicContact CE2-CB 4.49Å; F62-M109 HydrophobicContact CE2-CE 3.28Å; F62-M109 HydrophobicContact CE2-CG 4.49Å; F62-M109 HydrophobicContact CZ-CB 4.38Å; F62-M109 HydrophobicContact CZ-CE 3.63Å; F62-L112 HydrophobicContact CE2-CB 3.79Å; F62-L112 HydrophobicContact CE2-CD1 3.97Å; F62-L112 HydrophobicContact CZ-CB 3.81Å; F62-D113 WeakPolarHBondContact CE1-OD1 3.33Å; F62-D113 WeakPolarHBondContact CZ-OD1 3.38Å; F62-L116 HydrophobicContact CB-CD1 4.04Å; F62-L116 HydrophobicContact CD1-CD1 3.37Å; F62-L116 HydrophobicContact CD2-CD1 4.33Å; F62-L116 HydrophobicContact CE1-CD1 3.82Å; F62-L116 HydrophobicContact CG-CD1 3.65Å; F62-L116 HydrophobicContact CZ-CD1 4.47Å |
| 63 | L | 88.8 | Confident | 85.5 | Confident | 35 Ų | 35 | 95.6 Ų | 95.6 | 18% | 0.183 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -67.7 | -39.1 | 175.6 | -75.4 | 174.5 | 0 | 0 | 0 | 110.9 | L60 L65 R66 Y67 I120 | L60-L63 HydrophobicContact CB-CB 4.33Å; L60-L63 HydrophobicContact CB-CD1 4.04Å; L60-L63 HydrophobicContact CB-CG 4.2Å; L60-L63 HydrophobicContact CD1-CD1 3.75Å; L60-L63 HydrophobicContact CD1-CG 4.43Å; L60-L63 HydrophobicContact CG-CD1 4.5Å; L60-L63 WeakPolarHBondContact O-CB 3.31Å; L60-L63 PolarHBondContact O-N 3.19Å; L63-L65 PolarHBondContact O-N 2.64Å; L63-R66 WeakPolarHBondContact O-CB 3.31Å; L63-R66 PolarHBondContact O-N 3.37Å; L63-Y67 HydrophobicContact CB-CD2 4.43Å; L63-Y67 HydrophobicContact CB-CE2 4.01Å; L63-Y67 WeakPolarHBondContact O-CD2 3.41Å; L63-Y67 PolarHBondContact O-N 3.2Å; L63-I120 HydrophobicContact CD1-CD1 4.3Å; L63-I120 HydrophobicContact CD1-CG1 4.34Å; L63-I120 HydrophobicContact CD2-CD1 4.13Å; L63-I120 HydrophobicContact CG-CD1 4.42Å |
| 64 | D | 88.9 | Confident | 86.2 | Confident | 87 Ų | 87 | 93.1 Ų | 93.1 | 47% | 0.465 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -59.8 | -46.9 | 177.1 | -62 | -26.3 | 0 | 0 | 0 | 111.2 | L60 S61 R66 Y67 Q68 | L60-D64 PolarHBondContact O-N 2.81Å; S61-D64 PolarHBondContact O-N 2.91Å; D64-R66 VanDerWaalsContact C-N 3.33Å; D64-R66 PolarHBondContact O-N 2.98Å; D64-Y67 PolarHBondContact O-N 3.34Å; D64-Q68 WeakPolarHBondContact O-CG 3.48Å; D64-Q68 PolarHBondContact O-N 3.16Å |
| 65 | L | 91.9 | Very high | 86.9 | Confident | 79 Ų | 79 | 93.7 Ų | 93.7 | 41% | 0.414 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.5 | -44.8 | 175.5 | -176.4 | 151.6 | 0 | 0 | 0 | 111.3 | S61 L63 Y67 Q68 L69 M109 | S61-L65 PolarHBondContact O-N 2.94Å; S61-L65 VanDerWaalsContact O-N 3.08Å; L63-L65 PolarHBondContact O-N 2.64Å; L65-Y67 VanDerWaalsContact C-N 3.33Å; L65-Y67 PolarHBondContact O-N 3.38Å; L65-Q68 PolarHBondContact O-N 3.41Å; L65-L69 HydrophobicContact CD2-CD1 3.54Å; L65-L69 HydrophobicContact CD2-CG 4.06Å; L65-L69 WeakPolarHBondContact O-CG 3.37Å; L65-L69 PolarHBondContact O-N 3.1Å; L65-M109 HydrophobicContact CD2-CE 3.43Å; L65-M109 VanDerWaalsContact CD2-CE 3.43Å; L65-M109 HydrophobicContact CD2-SD 3.75Å |
| 66 | R | 92.6 | Very high | 87.8 | Confident | 85 Ų | 85 | 86 Ų | 86 | 32% | 0.321 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.2 | -43.4 | 178 | 179.4 | 179.8 | 170.8 | 153.3 | 5.6 | 111.7 | F62 L63 D64 L69 L70 L106 M109 D113 | F62-R66 PolarHBondContact O-N 3.29Å; F62-R66 VanDerWaalsContact O-N 3.08Å; L63-R66 WeakPolarHBondContact O-CB 3.31Å; L63-R66 PolarHBondContact O-N 3.37Å; D64-R66 VanDerWaalsContact C-N 3.33Å; D64-R66 PolarHBondContact O-N 2.98Å; R66-L69 PolarHBondContact O-N 3.33Å; R66-L70 HydrophobicContact CG-CD1 4.17Å; R66-L70 WeakPolarHBondContact O-CG 3.43Å; R66-L70 PolarHBondContact O-N 3.2Å; R66-L106 HydrophobicContact CG-CD2 4.43Å; R66-M109 HydrophobicContact CB-CE 4.1Å; R66-D113 IonicContact CZ-OD1 3.69Å; R66-D113 IonicContact CZ-OD2 2.96Å; R66-D113 IonicContact NH1-OD1 2.76Å; R66-D113 PolarHBondContact NH1-OD1 3.16Å; R66-D113 IonicContact NH1-OD2 3.3Å; R66-D113 PolarHBondContact NH1-OD2 3.19Å |
| 67 | Y | 91.8 | Very high | 88.6 | Confident | 140 Ų | 140 | 82.6 Ų | 82.6 | 55% | 0.549 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -68.1 | -38.1 | 178.3 | -65.6 | -45.7 | 0 | 0 | 0 | 112.3 | L63 D64 L65 L70 L71 | L63-Y67 HydrophobicContact CB-CD2 4.43Å; L63-Y67 HydrophobicContact CB-CE2 4.01Å; L63-Y67 WeakPolarHBondContact O-CD2 3.41Å; L63-Y67 PolarHBondContact O-N 3.2Å; D64-Y67 PolarHBondContact O-N 3.34Å; L65-Y67 VanDerWaalsContact C-N 3.33Å; L65-Y67 PolarHBondContact O-N 3.38Å; Y67-L70 HydrophobicContact CD1-CD1 4.25Å; Y67-L70 PolarHBondContact O-N 3.08Å; Y67-L71 WeakPolarHBondContact O-CB 3.43Å; Y67-L71 PolarHBondContact O-N 3.28Å |
| 68 | Q | 93 | Very high | 89.3 | Confident | 117 Ų | 117 | 81.8 Ų | 81.8 | 55% | 0.547 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -61.8 | -43.5 | 172.6 | -72.4 | 173.6 | -14.5 | 0 | 0 | 111.8 | D64 L65 L70 L71 F72 | D64-Q68 WeakPolarHBondContact O-CG 3.48Å; D64-Q68 PolarHBondContact O-N 3.16Å; L65-Q68 PolarHBondContact O-N 3.41Å; Q68-L70 PolarHBondContact O-N 3.43Å; Q68-L71 WeakPolarHBondContact O-CB 3.46Å; Q68-L71 PolarHBondContact O-N 3.01Å; Q68-F72 HydrophobicContact CB-CE2 4.42Å; Q68-F72 VanDerWaalsContact O-CD2 3.26Å; Q68-F72 WeakPolarHBondContact O-CD2 3.47Å; Q68-F72 WeakPolarHBondContact O-CG 3.39Å; Q68-F72 PolarHBondContact O-N 3.43Å |
| 69 | L | 94.6 | Very high | 90.3 | Very high | 28 Ų | 28 | 76.7 Ų | 76.7 | 15% | 0.147 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -62.8 | -41.4 | 175.3 | -71.7 | 179.6 | 0 | 0 | 0 | 112.7 | L65 R66 L71 F72 Y73 V102 V105 L106 M109 | L65-L69 HydrophobicContact CD2-CD1 3.54Å; L65-L69 HydrophobicContact CD2-CG 4.06Å; L65-L69 WeakPolarHBondContact O-CG 3.37Å; L65-L69 PolarHBondContact O-N 3.1Å; R66-L69 PolarHBondContact O-N 3.33Å; L69-L71 VanDerWaalsContact C-N 3.27Å; L69-L71 PolarHBondContact O-N 2.87Å; L69-F72 HydrophobicContact CD2-CD2 4.47Å; L69-F72 PolarHBondContact O-N 3.3Å; L69-Y73 WeakPolarHBondContact O-CB 3.45Å; L69-Y73 PolarHBondContact O-N 2.99Å; L69-V102 HydrophobicContact CB-CG1 4.3Å; L69-V102 WeakPolarHBondContact O-CG1 3.47Å; L69-V105 HydrophobicContact CD1-CG1 3.63Å; L69-L106 HydrophobicContact CB-CD2 4.08Å; L69-L106 HydrophobicContact CD1-CD2 4.2Å; L69-M109 HydrophobicContact CD1-SD 3.56Å; L69-M109 VanDerWaalsContact CD1-SD 3.56Å |
| 70 | L | 94.7 | Very high | 91.1 | Very high | 66 Ų | 66 | 74.6 Ų | 74.6 | 35% | 0.346 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.7 | -36.7 | 174.4 | -79.2 | 162 | 0 | 0 | 0 | 111.7 | R66 Y67 Q68 Y73 L74 L106 | R66-L70 HydrophobicContact CG-CD1 4.17Å; R66-L70 WeakPolarHBondContact O-CG 3.43Å; R66-L70 PolarHBondContact O-N 3.2Å; Y67-L70 HydrophobicContact CD1-CD1 4.25Å; Y67-L70 PolarHBondContact O-N 3.08Å; Q68-L70 PolarHBondContact O-N 3.43Å; L70-Y73 WeakPolarHBondContact O-CB 3.41Å; L70-Y73 PolarHBondContact O-N 3.45Å; L70-L74 WeakPolarHBondContact O-CG 3.33Å; L70-L74 PolarHBondContact O-N 3Å; L70-L106 HydrophobicContact CD2-CD1 4.26Å |
| 71 | L | 93.8 | Very high | 91.5 | Very high | 107 Ų | 107 | 77.1 Ų | 77.1 | 56% | 0.56 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -68 | -44 | 176.6 | -167.3 | 145.2 | 0 | 0 | 0 | 111.5 | Y67 Q68 L69 Y73 L74 Q75 | Y67-L71 WeakPolarHBondContact O-CB 3.43Å; Y67-L71 PolarHBondContact O-N 3.28Å; Q68-L71 WeakPolarHBondContact O-CB 3.46Å; Q68-L71 PolarHBondContact O-N 3.01Å; L69-L71 VanDerWaalsContact C-N 3.27Å; L69-L71 PolarHBondContact O-N 2.87Å; L71-Y73 VanDerWaalsContact C-N 3.3Å; L71-Y73 PolarHBondContact O-N 3.4Å; L71-L74 PolarHBondContact O-N 3.08Å; L71-Q75 WeakPolarHBondContact O-CB 3.44Å; L71-Q75 PolarHBondContact O-N 3.34Å |
| 72 | F | 94.6 | Very high | 91.6 | Very high | 103 Ų | 103 | 75 Ų | 75 | 45% | 0.452 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -60.9 | -40 | 172.8 | -64.4 | -40.5 | 0 | 0 | 0 | 112.1 | Q68 L69 L74 Q75 D76 | Q68-F72 HydrophobicContact CB-CE2 4.42Å; Q68-F72 VanDerWaalsContact O-CD2 3.26Å; Q68-F72 WeakPolarHBondContact O-CD2 3.47Å; Q68-F72 WeakPolarHBondContact O-CG 3.39Å; Q68-F72 PolarHBondContact O-N 3.43Å; L69-F72 HydrophobicContact CD2-CD2 4.47Å; L69-F72 PolarHBondContact O-N 3.3Å; F72-L74 PolarHBondContact O-N 2.93Å; F72-Q75 PolarHBondContact O-N 3.49Å; F72-D76 PolarHBondContact O-N 3.34Å |
| 73 | Y | 94.9 | Very high | 91.6 | Very high | 60 Ų | 60 | 74.7 Ų | 74.7 | 24% | 0.235 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -58.4 | -48.2 | 174.1 | -178.2 | -89.6 | 0 | 0 | 0 | 111.4 | L69 L70 L71 Q75 D76 V77 L99 V102 | L69-Y73 WeakPolarHBondContact O-CB 3.45Å; L69-Y73 PolarHBondContact O-N 2.99Å; L70-Y73 WeakPolarHBondContact O-CB 3.41Å; L70-Y73 PolarHBondContact O-N 3.45Å; L71-Y73 VanDerWaalsContact C-N 3.3Å; L71-Y73 PolarHBondContact O-N 3.4Å; Y73-Q75 VanDerWaalsContact C-N 3.34Å; Y73-Q75 PolarHBondContact O-N 3.18Å; Y73-D76 PolarHBondContact O-N 2.94Å; Y73-V77 HydrophobicContact CD1-CG2 4.16Å; Y73-V77 HydrophobicContact CE1-CG2 3.8Å; Y73-V77 VanDerWaalsContact O-CG2 3.27Å; Y73-V77 WeakPolarHBondContact O-CG2 3.35Å; Y73-V77 PolarHBondContact O-N 3.22Å; Y73-L99 HydrophobicContact CD1-CD1 4.46Å; Y73-L99 HydrophobicContact CD2-CD1 3.27Å; Y73-L99 HydrophobicContact CD2-CG 4.13Å; Y73-L99 HydrophobicContact CE1-CD1 4.48Å; Y73-L99 HydrophobicContact CE2-CD1 3.31Å; Y73-L99 HydrophobicContact CE2-CG 3.82Å; Y73-L99 HydrophobicContact CG-CD1 3.89Å; Y73-V102 HydrophobicContact CD2-CG1 4.4Å |
| 74 | L | 92.3 | Very high | 91.4 | Very high | 111 Ų | 111 | 79.8 Ų | 79.8 | 58% | 0.581 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -63 | -40 | 177.4 | -70.8 | 174.1 | 0 | 0 | 0 | 112.1 | L70 L71 F72 V77 T78 | L70-L74 WeakPolarHBondContact O-CG 3.33Å; L70-L74 PolarHBondContact O-N 3Å; L71-L74 PolarHBondContact O-N 3.08Å; F72-L74 PolarHBondContact O-N 2.93Å; L74-V77 PolarHBondContact O-N 3.06Å; L74-T78 WeakPolarHBondContact O-CG2 3.41Å; L74-T78 PolarHBondContact O-N 2.96Å; L74-T78 PolarHBondContact O-OG1 2.92Å |
| 75 | Q | 92.7 | Very high | 91.3 | Very high | 114 Ų | 114 | 80.2 Ų | 80.2 | 53% | 0.533 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -64.2 | -42.9 | 177.8 | -175.3 | 177.5 | -3 | 0 | 0 | 112.6 | L71 F72 Y73 V77 T78 H79 | L71-Q75 WeakPolarHBondContact O-CB 3.44Å; L71-Q75 PolarHBondContact O-N 3.34Å; F72-Q75 PolarHBondContact O-N 3.49Å; Y73-Q75 VanDerWaalsContact C-N 3.34Å; Y73-Q75 PolarHBondContact O-N 3.18Å; Q75-V77 VanDerWaalsContact C-N 3.35Å; Q75-T78 PolarHBondContact O-OG1 2.96Å; Q75-H79 WeakPolarHBondContact O-CB 3.38Å; Q75-H79 PolarHBondContact O-N 3.5Å |
| 76 | D | 92.3 | Very high | 91 | Very high | 13 Ų | 13 | 83.5 Ų | 83.5 | 7% | 0.07 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -68.2 | -35.9 | 176.3 | -77.9 | -37.3 | 0 | 0 | 0 | 111.2 | F72 Y73 L80 R98 L99 | F72-D76 PolarHBondContact O-N 3.34Å; Y73-D76 PolarHBondContact O-N 2.94Å; D76-L80 VanDerWaalsContact O-CG 3.3Å; D76-L80 WeakPolarHBondContact O-CG 3.29Å; D76-L80 PolarHBondContact O-N 3.19Å; D76-R98 IonicContact OD1-CZ 3.54Å; D76-R98 VanDerWaalsContact OD1-CZ 3.3Å; D76-R98 IonicContact OD1-NE 2.76Å; D76-R98 PolarHBondContact OD1-NE 3.45Å; D76-R98 IonicContact OD1-NH2 3.3Å; D76-R98 PolarHBondContact OD1-NH2 3.35Å; D76-R98 VanDerWaalsContact OD2-CB 3.3Å; D76-R98 WeakPolarHBondContact OD2-CB 3.36Å; D76-R98 IonicContact OD2-NE 3.66Å; D76-L99 HydrophobicContact CB-CB 4.5Å; D76-L99 HydrophobicContact CB-CD1 4.07Å |
| 77 | V | 91.8 | Very high | 90.5 | Very high | 41 Ų | 41 | 82.7 Ų | 82.7 | 25% | 0.248 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -64.9 | -48.1 | 174.4 | 170.7 | 0 | 0 | 0 | 0 | 111.6 | Y73 L74 Q75 H79 L80 I81 L99 | Y73-V77 HydrophobicContact CD1-CG2 4.16Å; Y73-V77 HydrophobicContact CE1-CG2 3.8Å; Y73-V77 VanDerWaalsContact O-CG2 3.27Å; Y73-V77 WeakPolarHBondContact O-CG2 3.35Å; Y73-V77 PolarHBondContact O-N 3.22Å; L74-V77 PolarHBondContact O-N 3.06Å; Q75-V77 VanDerWaalsContact C-N 3.35Å; V77-H79 VanDerWaalsContact C-N 3.29Å; V77-H79 PolarHBondContact O-N 3.23Å; V77-L80 PolarHBondContact O-N 3.49Å; V77-I81 HydrophobicContact CG1-CD1 3.84Å; V77-I81 HydrophobicContact CG1-CG1 4.45Å; V77-I81 WeakPolarHBondContact O-CG1 3.34Å; V77-I81 PolarHBondContact O-N 3.09Å; V77-L99 HydrophobicContact CG2-CD1 3.63Å; V77-L99 HydrophobicContact CG2-CD2 4.22Å |
| 78 | T | 89.9 | Confident | 90 | Very high | 85 Ų | 85 | 77.6 Ų | 77.6 | 52% | 0.521 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -64.3 | -37.1 | 179.5 | 53.4 | 0 | 0 | 0 | 0 | 111.5 | L74 Q75 I81 S82 | L74-T78 WeakPolarHBondContact O-CG2 3.41Å; L74-T78 PolarHBondContact O-N 2.96Å; L74-T78 PolarHBondContact O-OG1 2.92Å; Q75-T78 PolarHBondContact O-OG1 2.96Å; T78-I81 PolarHBondContact O-N 3.47Å; T78-S82 PolarHBondContact O-N 3.09Å |
| 79 | H | 90.2 | Very high | 89.4 | Confident | 91 Ų | 91 | 76.3 Ų | 76.3 | 42% | 0.421 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -62.1 | -43 | 173.3 | -178.2 | 57.1 | 0 | 0 | 0 | 112.2 | Q75 V77 I81 S82 L83 | Q75-H79 WeakPolarHBondContact O-CB 3.38Å; Q75-H79 PolarHBondContact O-N 3.5Å; V77-H79 VanDerWaalsContact C-N 3.29Å; V77-H79 PolarHBondContact O-N 3.23Å; H79-I81 VanDerWaalsContact C-N 3.33Å; H79-I81 PolarHBondContact O-N 3.27Å; H79-S82 WeakPolarHBondContact O-CB 3.32Å; H79-S82 PolarHBondContact O-N 2.7Å; H79-L83 WeakPolarHBondContact O-CB 3.4Å; H79-L83 PolarHBondContact O-N 2.77Å |
| 80 | L | 89.6 | Confident | 88.7 | Confident | 16 Ų | 16 | 76.5 Ų | 76.5 | 8% | 0.084 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -64.9 | -35.3 | 174.9 | -72.4 | 172.5 | 0 | 0 | 0 | 112.9 | D76 V77 K84 V90 S93 A95 L96 L99 | D76-L80 VanDerWaalsContact O-CG 3.3Å; D76-L80 WeakPolarHBondContact O-CG 3.29Å; D76-L80 PolarHBondContact O-N 3.19Å; V77-L80 PolarHBondContact O-N 3.49Å; L80-K84 WeakPolarHBondContact O-CG 3.1Å; L80-K84 PolarHBondContact O-N 3.33Å; L80-V90 HydrophobicContact CD2-CG1 4.23Å; L80-S93 WeakPolarHBondContact CD2-OG 3.46Å; L80-A95 HydrophobicContact CD2-CB 3.97Å; L80-A95 HydrophobicContact CG-CB 4.15Å; L80-L96 HydrophobicContact CD1-CD2 3.72Å; L80-L96 HydrophobicContact CD1-CG 4.23Å; L80-L96 HydrophobicContact CD2-CD2 4.37Å; L80-L96 HydrophobicContact CD2-CG 4.12Å; L80-L99 HydrophobicContact CD1-CD2 4.01Å |
| 81 | I | 87.9 | Confident | 87.7 | Confident | 104 Ų | 104 | 81.6 Ų | 81.6 | 53% | 0.533 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -65.3 | -46.2 | 174.5 | -67.6 | 166.6 | 0 | 0 | 0 | 110.1 | V77 T78 H79 L83 K84 S85 | V77-I81 HydrophobicContact CG1-CD1 3.84Å; V77-I81 HydrophobicContact CG1-CG1 4.45Å; V77-I81 WeakPolarHBondContact O-CG1 3.34Å; V77-I81 PolarHBondContact O-N 3.09Å; T78-I81 PolarHBondContact O-N 3.47Å; H79-I81 VanDerWaalsContact C-N 3.33Å; H79-I81 PolarHBondContact O-N 3.27Å; I81-L83 VanDerWaalsContact C-N 3.33Å; I81-L83 PolarHBondContact O-N 3.43Å; I81-K84 PolarHBondContact O-N 3.23Å; I81-S85 PolarHBondContact O-N 3.44Å; I81-S85 PolarHBondContact O-OG 3.42Å |
| 82 | S | 88 | Confident | 86.6 | Confident | 49 Ų | 49 | 84.2 Ų | 84.2 | 34% | 0.343 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -57 | -47.6 | 175.7 | -162.3 | 0 | 0 | 0 | 0 | 111.4 | T78 H79 K84 S85 E86 | T78-S82 PolarHBondContact O-N 3.09Å; H79-S82 WeakPolarHBondContact O-CB 3.32Å; H79-S82 PolarHBondContact O-N 2.7Å; S82-K84 VanDerWaalsContact C-N 3.31Å; S82-K84 PolarHBondContact O-N 2.87Å; S82-S85 VanDerWaalsContact CA-OG 3.3Å; S82-S85 WeakPolarHBondContact CA-OG 3.46Å; S82-S85 PolarHBondContact O-N 2.97Å; S82-S85 VanDerWaalsContact O-N 3.09Å; S82-S85 PolarHBondContact O-OG 3.33Å; S82-E86 WeakPolarHBondContact O-CG 3.47Å; S82-E86 PolarHBondContact O-N 3.47Å; S82-E86 PolarHBondContact OG-OE1 2.91Å |
| 83 | L | 88.6 | Confident | 85.9 | Confident | 38 Ų | 38 | 80.3 Ų | 80.3 | 20% | 0.199 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -63.2 | -38.1 | -178.9 | -158.4 | 151.7 | 0 | 0 | 0 | 111.6 | H79 I81 G87 G88 S89 V90 | H79-L83 WeakPolarHBondContact O-CB 3.4Å; H79-L83 PolarHBondContact O-N 2.77Å; I81-L83 VanDerWaalsContact C-N 3.33Å; I81-L83 PolarHBondContact O-N 3.43Å; L83-G87 PolarHBondContact O-N 2.87Å; L83-G88 WeakPolarHBondContact O-CA 3.48Å; L83-G88 PolarHBondContact O-N 3.44Å; L83-S89 WeakPolarHBondContact CD2-O 3.38Å; L83-V90 HydrophobicContact CD2-CG2 4.33Å |
| 84 | K | 86.5 | Confident | 85.5 | Confident | 141 Ų | 141 | 79.6 Ų | 79.6 | 61% | 0.613 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -67.2 | -41.2 | 172.2 | -78.3 | -172.5 | 172.8 | -168.2 | 0 | 112.7 | L80 I81 S82 E86 G87 V90 | L80-K84 WeakPolarHBondContact O-CG 3.1Å; L80-K84 PolarHBondContact O-N 3.33Å; I81-K84 PolarHBondContact O-N 3.23Å; S82-K84 VanDerWaalsContact C-N 3.31Å; S82-K84 PolarHBondContact O-N 2.87Å; K84-E86 PolarHBondContact O-N 3.36Å; K84-G87 PolarHBondContact O-N 2.95Å; K84-G87 VanDerWaalsContact O-N 3.09Å; K84-V90 HydrophobicContact CD-CG2 4.12Å; K84-V90 HydrophobicContact CG-CG2 3.39Å |
| 85 | S | 85 | Confident | 85.2 | Confident | 96 Ų | 96 | 74.5 Ų | 74.5 | 67% | 0.671 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -67.8 | -26.4 | 178.9 | 53.8 | 0 | 0 | 0 | 0 | 113.2 | I81 S82 G87 | I81-S85 PolarHBondContact O-N 3.44Å; I81-S85 PolarHBondContact O-OG 3.42Å; S82-S85 VanDerWaalsContact CA-OG 3.3Å; S82-S85 WeakPolarHBondContact CA-OG 3.46Å; S82-S85 PolarHBondContact O-N 2.97Å; S82-S85 VanDerWaalsContact O-N 3.09Å; S82-S85 PolarHBondContact O-OG 3.33Å; S85-G87 PolarHBondContact O-N 3.25Å |
| 86 | E | 85.9 | Confident | 85 | Confident | 148 Ų | 148 | 72 Ų | 72 | 69% | 0.692 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.5 | -3.4 | 173.5 | -69.5 | 164.4 | -145.9 | 0 | 0 | 112.8 | S82 K84 G88 | S82-E86 WeakPolarHBondContact O-CG 3.47Å; S82-E86 PolarHBondContact O-N 3.47Å; S82-E86 PolarHBondContact OG-OE1 2.91Å; K84-E86 PolarHBondContact O-N 3.36Å; E86-G88 VanDerWaalsContact C-N 3.35Å |
| 87 | G | 82.6 | Confident | 85 | Confident | 68 Ų | 68 | 78 Ų | 78 | 70% | 0.701 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 80.4 | 12.3 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | L83 K84 S85 | L83-G87 PolarHBondContact O-N 2.87Å; K84-G87 PolarHBondContact O-N 2.95Å; K84-G87 VanDerWaalsContact O-N 3.09Å; S85-G87 PolarHBondContact O-N 3.25Å |
| 88 | G | 81.3 | Confident | 85 | Confident | 34 Ų | 34 | 81.7 Ų | 81.7 | 35% | 0.351 | 46% | 0.458 | S | S | . | . | trans | -71.4 | 150.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | L83 E86 V90 | L83-G88 WeakPolarHBondContact O-CA 3.48Å; L83-G88 PolarHBondContact O-N 3.44Å; E86-G88 VanDerWaalsContact C-N 3.35Å; G88-V90 PolarHBondContact O-N 3.04Å | ||
| 89 | S | 80.9 | Confident | 85.1 | Confident | 89 Ų | 89 | 78.9 Ų | 78.9 | 62% | 0.622 | 44% | 0.44 | S | S | * | . | trans | -70.8 | 130.3 | 172.2 | 179 | 0 | 0 | 0 | 0 | 110.6 | L83 K91 | L83-S89 WeakPolarHBondContact CD2-O 3.38Å; S89-K91 PolarHBondContact OG-N 2.88Å | ||
| 90 | V | 78.6 | Confident | 85.3 | Confident | 33 Ų | 33 | 78.8 Ų | 78.8 | 20% | 0.2 | 45% | 0.446 | C | S | . | . | trans | -86.7 | -16.2 | 177.7 | 176 | 0 | 0 | 0 | 0 | 112.2 | L80 L83 K84 G88 D92 S93 L96 | L80-V90 HydrophobicContact CD2-CG1 4.23Å; L83-V90 HydrophobicContact CD2-CG2 4.33Å; K84-V90 HydrophobicContact CD-CG2 4.12Å; K84-V90 HydrophobicContact CG-CG2 3.39Å; G88-V90 PolarHBondContact O-N 3.04Å; V90-D92 PolarHBondContact O-N 3.34Å; V90-S93 PolarHBondContact O-N 3.31Å; V90-S93 PolarHBondContact O-OG 3.02Å; V90-L96 HydrophobicContact CG1-CD1 3.77Å; V90-L96 HydrophobicContact CG1-CD2 4.34Å; V90-L96 HydrophobicContact CG1-CG 4.18Å; V90-L96 WeakPolarHBondContact O-CD1 3.25Å | ||
| 91 | K | 75.4 | Confident | 85.5 | Confident | 172 Ų | 172 | 81 Ų | 81 | 75% | 0.748 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | 127.8 | 178.9 | -63 | -178.3 | 179.9 | 179 | 0 | 108.8 | S89 S93 | S89-K91 PolarHBondContact OG-N 2.88Å; K91-S93 VanDerWaalsContact C-N 3.33Å; K91-S93 PolarHBondContact O-N 2.91Å |
| 92 | D | 69.2 | Low | 85.9 | Confident | 163 Ų | 163 | 76.8 Ų | 76.8 | 87% | 0.872 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.7 | 19.6 | 178.5 | -48.8 | -40.8 | 0 | 0 | 0 | 117.1 | V90 G94 | V90-D92 PolarHBondContact O-N 3.34Å; D92-G94 PolarHBondContact O-N 2.91Å |
| 93 | S | 80.7 | Confident | 86.2 | Confident | 20 Ų | 20 | 81.2 Ų | 81.2 | 14% | 0.14 | 45% | 0.448 | C | S | . | . | trans | -67.8 | 129.4 | 171.7 | 60.7 | 0 | 0 | 0 | 0 | 111 | L80 V90 K91 A95 L96 | L80-S93 WeakPolarHBondContact CD2-OG 3.46Å; V90-S93 PolarHBondContact O-N 3.31Å; V90-S93 PolarHBondContact O-OG 3.02Å; K91-S93 VanDerWaalsContact C-N 3.33Å; K91-S93 PolarHBondContact O-N 2.91Å; S93-A95 PolarHBondContact O-N 2.85Å; S93-L96 WeakPolarHBondContact O-CB 3.47Å; S93-L96 PolarHBondContact O-N 3.37Å; S93-L96 WeakPolarHBondContact OG-CG 3.48Å | ||
| 94 | G | 85.9 | Confident | 86.5 | Confident | 46 Ų | 46 | 82.9 Ų | 82.9 | 47% | 0.474 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -57.4 | -24 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | D92 H97 R98 | D92-G94 PolarHBondContact O-N 2.91Å; G94-H97 PolarHBondContact O-N 2.8Å; G94-R98 WeakPolarHBondContact O-CG 3.07Å; G94-R98 PolarHBondContact O-N 3.32Å |
| 95 | A | 85.9 | Confident | 87 | Confident | 3 Ų | 3 | 78.9 Ų | 78.9 | 3% | 0.025 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -63.6 | -38.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | L80 S93 R98 L99 | L80-A95 HydrophobicContact CD2-CB 3.97Å; L80-A95 HydrophobicContact CG-CB 4.15Å; S93-A95 PolarHBondContact O-N 2.85Å; A95-R98 PolarHBondContact O-N 3.5Å; A95-L99 VanDerWaalsContact O-CB 3.3Å; A95-L99 WeakPolarHBondContact O-CB 3.36Å; A95-L99 PolarHBondContact O-N 2.8Å |
| 96 | L | 89.7 | Confident | 87.4 | Confident | 62 Ų | 62 | 76 Ų | 76 | 33% | 0.325 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.7 | -43.8 | 173 | -78.6 | 174.5 | 0 | 0 | 0 | 111.7 | L80 V90 S93 R98 L99 V100 | L80-L96 HydrophobicContact CD1-CD2 3.72Å; L80-L96 HydrophobicContact CD1-CG 4.23Å; L80-L96 HydrophobicContact CD2-CD2 4.37Å; L80-L96 HydrophobicContact CD2-CG 4.12Å; V90-L96 HydrophobicContact CG1-CD1 3.77Å; V90-L96 HydrophobicContact CG1-CD2 4.34Å; V90-L96 HydrophobicContact CG1-CG 4.18Å; V90-L96 WeakPolarHBondContact O-CD1 3.25Å; S93-L96 WeakPolarHBondContact O-CB 3.47Å; S93-L96 PolarHBondContact O-N 3.37Å; S93-L96 WeakPolarHBondContact OG-CG 3.48Å; L96-R98 PolarHBondContact O-N 3.35Å; L96-L99 WeakPolarHBondContact O-CB 3.43Å; L96-L99 PolarHBondContact O-N 3.34Å; L96-V100 WeakPolarHBondContact O-CG2 3.21Å; L96-V100 PolarHBondContact O-N 2.94Å |
| 97 | H | 91.2 | Very high | 87.8 | Confident | 138 Ų | 138 | 72.8 Ų | 72.8 | 64% | 0.639 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -63 | -43.5 | 179.1 | -171.6 | -73.4 | 0 | 0 | 0 | 111.2 | G94 V100 T101 | G94-H97 PolarHBondContact O-N 2.8Å; H97-V100 PolarHBondContact O-N 2.97Å; H97-T101 PolarHBondContact ND1-OG1 2.88Å; H97-T101 WeakPolarHBondContact O-CB 3.45Å; H97-T101 PolarHBondContact O-N 3.2Å; H97-T101 PolarHBondContact O-OG1 3.47Å |
| 98 | R | 92.2 | Very high | 88.4 | Confident | 119 Ų | 119 | 77.7 Ų | 77.7 | 45% | 0.449 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -60.5 | -44.8 | 173.2 | -69.8 | -168.1 | -54.8 | -94.3 | 4.2 | 111.7 | D76 G94 A95 L96 V100 T101 V102 | D76-R98 IonicContact OD1-CZ 3.54Å; D76-R98 VanDerWaalsContact OD1-CZ 3.3Å; D76-R98 IonicContact OD1-NE 2.76Å; D76-R98 PolarHBondContact OD1-NE 3.45Å; D76-R98 IonicContact OD1-NH2 3.3Å; D76-R98 PolarHBondContact OD1-NH2 3.35Å; D76-R98 VanDerWaalsContact OD2-CB 3.3Å; D76-R98 WeakPolarHBondContact OD2-CB 3.36Å; D76-R98 IonicContact OD2-NE 3.66Å; G94-R98 WeakPolarHBondContact O-CG 3.07Å; G94-R98 PolarHBondContact O-N 3.32Å; A95-R98 PolarHBondContact O-N 3.5Å; L96-R98 PolarHBondContact O-N 3.35Å; R98-V100 PolarHBondContact O-N 3.47Å; R98-T101 WeakPolarHBondContact O-CB 3.34Å; R98-T101 PolarHBondContact O-N 2.96Å; R98-T101 VanDerWaalsContact O-N 3.16Å; R98-V102 WeakPolarHBondContact O-CG2 3.39Å; R98-V102 PolarHBondContact O-N 3.49Å |
| 99 | L | 92.5 | Very high | 88.9 | Confident | 26 Ų | 26 | 76.9 Ų | 76.9 | 14% | 0.136 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -59.9 | -46.6 | 179.6 | -169.4 | 72.8 | 0 | 0 | 0 | 112.3 | Y73 D76 V77 L80 A95 L96 T101 V102 R103 | Y73-L99 HydrophobicContact CD1-CD1 4.46Å; Y73-L99 HydrophobicContact CD2-CD1 3.27Å; Y73-L99 HydrophobicContact CD2-CG 4.13Å; Y73-L99 HydrophobicContact CE1-CD1 4.48Å; Y73-L99 HydrophobicContact CE2-CD1 3.31Å; Y73-L99 HydrophobicContact CE2-CG 3.82Å; Y73-L99 HydrophobicContact CG-CD1 3.89Å; D76-L99 HydrophobicContact CB-CB 4.5Å; D76-L99 HydrophobicContact CB-CD1 4.07Å; V77-L99 HydrophobicContact CG2-CD1 3.63Å; V77-L99 HydrophobicContact CG2-CD2 4.22Å; L80-L99 HydrophobicContact CD1-CD2 4.01Å; A95-L99 VanDerWaalsContact O-CB 3.3Å; A95-L99 WeakPolarHBondContact O-CB 3.36Å; A95-L99 PolarHBondContact O-N 2.8Å; L96-L99 WeakPolarHBondContact O-CB 3.43Å; L96-L99 PolarHBondContact O-N 3.34Å; L99-T101 VanDerWaalsContact C-N 3.34Å; L99-V102 PolarHBondContact O-N 3.26Å; L99-R103 WeakPolarHBondContact O-CB 3.39Å; L99-R103 PolarHBondContact O-N 3.3Å |
| 100 | V | 93.8 | Very high | 89.4 | Confident | 90 Ų | 90 | 78.7 Ų | 78.7 | 55% | 0.545 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -63.1 | -43.9 | 175.9 | 174 | 0 | 0 | 0 | 0 | 110.1 | L96 H97 R98 R103 T104 | L96-V100 WeakPolarHBondContact O-CG2 3.21Å; L96-V100 PolarHBondContact O-N 2.94Å; H97-V100 PolarHBondContact O-N 2.97Å; R98-V100 PolarHBondContact O-N 3.47Å; V100-R103 PolarHBondContact O-N 3.49Å; V100-T104 HydrophobicContact CG1-CG2 4.4Å; V100-T104 WeakPolarHBondContact O-CG2 3.45Å; V100-T104 PolarHBondContact O-N 3.49Å; V100-T104 PolarHBondContact O-OG1 3.22Å |
| 101 | T | 94.2 | Very high | 90.1 | Very high | 61 Ų | 61 | 80.4 Ų | 80.4 | 37% | 0.374 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -58.7 | -53.1 | 177.4 | -55.3 | 0 | 0 | 0 | 0 | 110.9 | H97 R98 L99 R103 T104 V105 | H97-T101 PolarHBondContact ND1-OG1 2.88Å; H97-T101 WeakPolarHBondContact O-CB 3.45Å; H97-T101 PolarHBondContact O-N 3.2Å; H97-T101 PolarHBondContact O-OG1 3.47Å; R98-T101 WeakPolarHBondContact O-CB 3.34Å; R98-T101 PolarHBondContact O-N 2.96Å; R98-T101 VanDerWaalsContact O-N 3.16Å; L99-T101 VanDerWaalsContact C-N 3.34Å; T101-R103 VanDerWaalsContact C-N 3.27Å; T101-R103 PolarHBondContact O-N 2.93Å; T101-T104 PolarHBondContact O-N 3.25Å; T101-T104 VanDerWaalsContact O-N 3.1Å; T101-T104 PolarHBondContact O-OG1 2.99Å; T101-V105 WeakPolarHBondContact O-CG2 3.41Å; T101-V105 PolarHBondContact O-N 3.41Å |
| 102 | V | 94.9 | Very high | 90.9 | Very high | 17 Ų | 17 | 76.1 Ų | 76.1 | 10% | 0.103 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -57.9 | -41.3 | 178 | 173.4 | 0 | 0 | 0 | 0 | 110.8 | L69 Y73 R98 L99 T104 V105 L106 | L69-V102 HydrophobicContact CB-CG1 4.3Å; L69-V102 WeakPolarHBondContact O-CG1 3.47Å; Y73-V102 HydrophobicContact CD2-CG1 4.4Å; R98-V102 WeakPolarHBondContact O-CG2 3.39Å; R98-V102 PolarHBondContact O-N 3.49Å; L99-V102 PolarHBondContact O-N 3.26Å; V102-T104 PolarHBondContact O-N 3.41Å; V102-V105 PolarHBondContact O-N 3.32Å; V102-L106 HydrophobicContact CG1-CD1 4.21Å; V102-L106 HydrophobicContact CG1-CG 4.47Å; V102-L106 WeakPolarHBondContact O-CG 3.47Å; V102-L106 PolarHBondContact O-N 2.91Å |
| 103 | R | 94.9 | Very high | 91.8 | Very high | 141 Ų | 141 | 69.7 Ų | 69.7 | 53% | 0.532 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -63.4 | -42.4 | 176.6 | -176.9 | 141.5 | -177.7 | 174.6 | -2.8 | 112.6 | L99 V100 T101 V105 L106 E107 | L99-R103 WeakPolarHBondContact O-CB 3.39Å; L99-R103 PolarHBondContact O-N 3.3Å; V100-R103 PolarHBondContact O-N 3.49Å; T101-R103 VanDerWaalsContact C-N 3.27Å; T101-R103 PolarHBondContact O-N 2.93Å; R103-V105 VanDerWaalsContact C-N 3.33Å; R103-V105 PolarHBondContact O-N 3Å; R103-L106 PolarHBondContact O-N 3.32Å; R103-E107 WeakPolarHBondContact O-CG 3.47Å; R103-E107 PolarHBondContact O-N 3.21Å |
| 104 | T | 95.9 | Very high | 92.2 | Very high | 73 Ų | 73 | 75.7 Ų | 75.7 | 45% | 0.448 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -64.2 | -38.4 | 175.6 | 62.2 | 0 | 0 | 0 | 0 | 111.9 | V100 T101 V102 E107 K108 | V100-T104 HydrophobicContact CG1-CG2 4.4Å; V100-T104 WeakPolarHBondContact O-CG2 3.45Å; V100-T104 PolarHBondContact O-N 3.49Å; V100-T104 PolarHBondContact O-OG1 3.22Å; T101-T104 PolarHBondContact O-N 3.25Å; T101-T104 VanDerWaalsContact O-N 3.1Å; T101-T104 PolarHBondContact O-OG1 2.99Å; V102-T104 PolarHBondContact O-N 3.41Å; T104-E107 WeakPolarHBondContact O-CB 3.25Å; T104-E107 PolarHBondContact O-N 2.92Å; T104-K108 VanDerWaalsContact O-CG 3.31Å; T104-K108 WeakPolarHBondContact O-CG 3.45Å; T104-K108 PolarHBondContact O-N 3.01Å |
| 105 | V | 95.4 | Very high | 92.4 | Very high | 58 Ų | 58 | 81 Ų | 81 | 35% | 0.352 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -63.1 | -46.6 | 175.1 | 175.1 | 0 | 0 | 0 | 0 | 110.5 | L69 T101 V102 R103 E107 K108 M109 | L69-V105 HydrophobicContact CD1-CG1 3.63Å; T101-V105 WeakPolarHBondContact O-CG2 3.41Å; T101-V105 PolarHBondContact O-N 3.41Å; V102-V105 PolarHBondContact O-N 3.32Å; R103-V105 VanDerWaalsContact C-N 3.33Å; R103-V105 PolarHBondContact O-N 3Å; V105-E107 VanDerWaalsContact C-N 3.32Å; V105-E107 PolarHBondContact O-N 3.01Å; V105-K108 PolarHBondContact O-N 3.37Å; V105-K108 VanDerWaalsContact O-N 3.1Å; V105-M109 HydrophobicContact CG1-CG 4.38Å; V105-M109 HydrophobicContact CG1-SD 3.99Å; V105-M109 VanDerWaalsContact O-CG 3.31Å; V105-M109 WeakPolarHBondContact O-CG 3.4Å; V105-M109 PolarHBondContact O-N 3.39Å |
| 106 | L | 94.1 | Very high | 92.5 | Very high | 35 Ų | 35 | 82.7 Ų | 82.7 | 18% | 0.183 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -60.6 | -38.2 | 176.7 | -71.3 | 174.5 | 0 | 0 | 0 | 112.6 | R66 L69 L70 V102 R103 M109 | R66-L106 HydrophobicContact CG-CD2 4.43Å; L69-L106 HydrophobicContact CB-CD2 4.08Å; L69-L106 HydrophobicContact CD1-CD2 4.2Å; L70-L106 HydrophobicContact CD2-CD1 4.26Å; V102-L106 HydrophobicContact CG1-CD1 4.21Å; V102-L106 HydrophobicContact CG1-CG 4.47Å; V102-L106 WeakPolarHBondContact O-CG 3.47Å; V102-L106 PolarHBondContact O-N 2.91Å; R103-L106 PolarHBondContact O-N 3.32Å; L106-M109 PolarHBondContact O-N 3.24Å |
| 107 | E | 94.5 | Very high | 92.5 | Very high | 80 Ų | 80 | 87.8 Ų | 87.8 | 37% | 0.374 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -60.9 | -46.3 | 172.2 | -74 | -86.5 | 168.9 | 0 | 0 | 111.5 | R103 T104 V105 M109 R110 | R103-E107 WeakPolarHBondContact O-CG 3.47Å; R103-E107 PolarHBondContact O-N 3.21Å; T104-E107 WeakPolarHBondContact O-CB 3.25Å; T104-E107 PolarHBondContact O-N 2.92Å; V105-E107 VanDerWaalsContact C-N 3.32Å; V105-E107 PolarHBondContact O-N 3.01Å; E107-M109 VanDerWaalsContact C-N 3.28Å; E107-M109 PolarHBondContact O-N 3.39Å; E107-R110 WeakPolarHBondContact O-CB 3.45Å; E107-R110 WeakPolarHBondContact O-CG 3.32Å; E107-R110 PolarHBondContact O-N 3.28Å; E107-R110 IonicContact OE1-CZ 3.93Å; E107-R110 IonicContact OE1-NH1 2.61Å; E107-R110 IonicContact OE1-NH2 3.82Å; E107-R110 PolarHBondContact OE1-NH2 2.87Å; E107-R110 IonicContact OE2-CZ 2.7Å; E107-R110 IonicContact OE2-NE 2.77Å; E107-R110 IonicContact OE2-NH1 3.62Å; E107-R110 PolarHBondContact OE2-NH1 3.39Å; E107-R110 IonicContact OE2-NH2 3.88Å; E107-R110 PolarHBondContact OE2-NH2 2.96Å |
| 108 | K | 94.5 | Very high | 92.3 | Very high | 172 Ų | 172 | 85.7 Ų | 85.7 | 75% | 0.748 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -69.7 | -22.7 | 179.9 | -66.7 | -63.4 | -178 | -177.3 | 0 | 113.6 | T104 V105 P111 | T104-K108 VanDerWaalsContact O-CG 3.31Å; T104-K108 WeakPolarHBondContact O-CG 3.45Å; T104-K108 PolarHBondContact O-N 3.01Å; V105-K108 PolarHBondContact O-N 3.37Å; V105-K108 VanDerWaalsContact O-N 3.1Å; K108-P111 VanDerWaalsContact O-CD 3.31Å; K108-P111 WeakPolarHBondContact O-CD 3.32Å |
| 109 | M | 92.3 | Very high | 92 | Very high | 17 Ų | 17 | 83.9 Ų | 83.9 | 8% | 0.084 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -77.1 | -17.8 | 175.6 | -72.2 | 176.6 | 71.6 | 0 | 0 | 113.8 | F62 L65 R66 L69 V105 L106 E107 P111 L112 D113 | F62-M109 HydrophobicContact CD2-CE 3.93Å; F62-M109 HydrophobicContact CE2-CB 4.49Å; F62-M109 HydrophobicContact CE2-CE 3.28Å; F62-M109 HydrophobicContact CE2-CG 4.49Å; F62-M109 HydrophobicContact CZ-CB 4.38Å; F62-M109 HydrophobicContact CZ-CE 3.63Å; L65-M109 HydrophobicContact CD2-CE 3.43Å; L65-M109 VanDerWaalsContact CD2-CE 3.43Å; L65-M109 HydrophobicContact CD2-SD 3.75Å; R66-M109 HydrophobicContact CB-CE 4.1Å; L69-M109 HydrophobicContact CD1-SD 3.56Å; L69-M109 VanDerWaalsContact CD1-SD 3.56Å; V105-M109 HydrophobicContact CG1-CG 4.38Å; V105-M109 HydrophobicContact CG1-SD 3.99Å; V105-M109 VanDerWaalsContact O-CG 3.31Å; V105-M109 WeakPolarHBondContact O-CG 3.4Å; V105-M109 PolarHBondContact O-N 3.39Å; L106-M109 PolarHBondContact O-N 3.24Å; E107-M109 VanDerWaalsContact C-N 3.28Å; E107-M109 PolarHBondContact O-N 3.39Å; M109-P111 VanDerWaalsContact C-CD 3.49Å; M109-L112 WeakPolarHBondContact O-CA 3.36Å; M109-L112 WeakPolarHBondContact O-CB 3.41Å; M109-L112 PolarHBondContact O-N 3.31Å; M109-D113 PolarHBondContact O-N 3.36Å; M109-D113 VanDerWaalsContact O-N 3.09Å |
| 110 | R | 91.8 | Very high | 91.8 | Very high | 126 Ų | 126 | 84.5 Ų | 84.5 | 48% | 0.475 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -55.2 | -40.9 | -175.9 | -65.7 | -177.8 | -173.6 | 169 | 7 | 115.4 | E107 L112 D113 Q114 | E107-R110 WeakPolarHBondContact O-CB 3.45Å; E107-R110 WeakPolarHBondContact O-CG 3.32Å; E107-R110 PolarHBondContact O-N 3.28Å; E107-R110 IonicContact OE1-CZ 3.93Å; E107-R110 IonicContact OE1-NH1 2.61Å; E107-R110 IonicContact OE1-NH2 3.82Å; E107-R110 PolarHBondContact OE1-NH2 2.87Å; E107-R110 IonicContact OE2-CZ 2.7Å; E107-R110 IonicContact OE2-NE 2.77Å; E107-R110 IonicContact OE2-NH1 3.62Å; E107-R110 PolarHBondContact OE2-NH1 3.39Å; E107-R110 IonicContact OE2-NH2 3.88Å; E107-R110 PolarHBondContact OE2-NH2 2.96Å; R110-L112 PolarHBondContact O-N 2.93Å; R110-D113 WeakPolarHBondContact O-CB 3.35Å; R110-D113 PolarHBondContact O-N 2.88Å; R110-Q114 WeakPolarHBondContact O-CG 3.24Å; R110-Q114 PolarHBondContact O-N 2.99Å |
| 111 | P | 93.9 | Very high | 91.5 | Very high | 69 Ų | 69 | 83.5 Ų | 83.5 | 45% | 0.448 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -63.8 | -30.8 | 176.6 | -22.3 | 35 | 0 | 0 | 0 | 112.6 | K108 M109 Q114 K115 | K108-P111 VanDerWaalsContact O-CD 3.31Å; K108-P111 WeakPolarHBondContact O-CD 3.32Å; M109-P111 VanDerWaalsContact C-CD 3.49Å; P111-Q114 PolarHBondContact O-N 3.49Å; P111-K115 WeakPolarHBondContact O-CG 3.45Å; P111-K115 PolarHBondContact O-N 3.45Å |
| 112 | L | 90.4 | Very high | 91.1 | Very high | 82 Ų | 82 | 83.2 Ų | 83.2 | 43% | 0.429 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -72.2 | -40.4 | 175.1 | -62.1 | 176.1 | 0 | 0 | 0 | 110.9 | F62 M109 R110 Q114 K115 L116 | F62-L112 HydrophobicContact CE2-CB 3.79Å; F62-L112 HydrophobicContact CE2-CD1 3.97Å; F62-L112 HydrophobicContact CZ-CB 3.81Å; M109-L112 WeakPolarHBondContact O-CA 3.36Å; M109-L112 WeakPolarHBondContact O-CB 3.41Å; M109-L112 PolarHBondContact O-N 3.31Å; R110-L112 PolarHBondContact O-N 2.93Å; L112-Q114 VanDerWaalsContact C-N 3.26Å; L112-Q114 PolarHBondContact O-N 2.83Å; L112-K115 PolarHBondContact O-N 3.4Å; L112-L116 WeakPolarHBondContact O-CB 3.4Å; L112-L116 WeakPolarHBondContact O-CG 3.49Å; L112-L116 PolarHBondContact O-N 2.92Å |
| 113 | D | 88.4 | Confident | 90.5 | Very high | 29 Ų | 29 | 86.8 Ų | 86.8 | 16% | 0.155 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -55.2 | -44.6 | 171.7 | -70.4 | -44.3 | 0 | 0 | 0 | 111.3 | F62 R66 M109 R110 K115 L116 R117 | F62-D113 WeakPolarHBondContact CE1-OD1 3.33Å; F62-D113 WeakPolarHBondContact CZ-OD1 3.38Å; R66-D113 IonicContact CZ-OD1 3.69Å; R66-D113 IonicContact CZ-OD2 2.96Å; R66-D113 IonicContact NH1-OD1 2.76Å; R66-D113 PolarHBondContact NH1-OD1 3.16Å; R66-D113 IonicContact NH1-OD2 3.3Å; R66-D113 PolarHBondContact NH1-OD2 3.19Å; M109-D113 PolarHBondContact O-N 3.36Å; M109-D113 VanDerWaalsContact O-N 3.09Å; R110-D113 WeakPolarHBondContact O-CB 3.35Å; R110-D113 PolarHBondContact O-N 2.88Å; D113-K115 PolarHBondContact O-N 2.89Å; D113-L116 CarbonylContact O-C 3.48Å; D113-L116 PolarHBondContact O-N 3.12Å; D113-R117 WeakPolarHBondContact O-CB 3.4Å; D113-R117 PolarHBondContact O-N 2.93Å |
| 114 | Q | 90.8 | Very high | 90 | Very high | 145 Ų | 145 | 84 Ų | 84 | 68% | 0.678 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -63.2 | -41.6 | 179.6 | -70.3 | 173.9 | 3.7 | 0 | 0 | 112.1 | R110 P111 L112 L116 R117 | R110-Q114 WeakPolarHBondContact O-CG 3.24Å; R110-Q114 PolarHBondContact O-N 2.99Å; P111-Q114 PolarHBondContact O-N 3.49Å; L112-Q114 VanDerWaalsContact C-N 3.26Å; L112-Q114 PolarHBondContact O-N 2.83Å; Q114-L116 VanDerWaalsContact C-N 3.33Å; Q114-R117 WeakPolarHBondContact O-CB 3.47Å; Q114-R117 PolarHBondContact O-N 3.32Å |
| 115 | K | 89.5 | Confident | 89.5 | Confident | 159 Ų | 159 | 89 Ų | 89 | 69% | 0.691 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -66 | -36.1 | 176.2 | -71.3 | 176.9 | -178.2 | -177.4 | 0 | 112.3 | P111 L112 D113 | P111-K115 WeakPolarHBondContact O-CG 3.45Å; P111-K115 PolarHBondContact O-N 3.45Å; L112-K115 PolarHBondContact O-N 3.4Å; D113-K115 PolarHBondContact O-N 2.89Å |
| 116 | L | 88.3 | Confident | 88.8 | Confident | 38 Ų | 38 | 88.3 Ų | 88.3 | 20% | 0.199 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -85.8 | -14.9 | -179.3 | -66.4 | 175.8 | 0 | 0 | 0 | 113.3 | F62 L112 D113 Q114 Y118 Q119 I120 | F62-L116 HydrophobicContact CB-CD1 4.04Å; F62-L116 HydrophobicContact CD1-CD1 3.37Å; F62-L116 HydrophobicContact CD2-CD1 4.33Å; F62-L116 HydrophobicContact CE1-CD1 3.82Å; F62-L116 HydrophobicContact CG-CD1 3.65Å; F62-L116 HydrophobicContact CZ-CD1 4.47Å; L112-L116 WeakPolarHBondContact O-CB 3.4Å; L112-L116 WeakPolarHBondContact O-CG 3.49Å; L112-L116 PolarHBondContact O-N 2.92Å; D113-L116 CarbonylContact O-C 3.48Å; D113-L116 PolarHBondContact O-N 3.12Å; Q114-L116 VanDerWaalsContact C-N 3.33Å; L116-Y118 VanDerWaalsContact C-N 3.27Å; L116-Y118 PolarHBondContact O-N 2.92Å; L116-Q119 WeakPolarHBondContact O-CA 3.44Å; L116-Q119 WeakPolarHBondContact O-CB 3.33Å; L116-Q119 PolarHBondContact O-N 3.32Å; L116-I120 HydrophobicContact CB-CD1 4.15Å; L116-I120 WeakPolarHBondContact O-CG1 3.27Å; L116-I120 PolarHBondContact O-N 2.88Å |
| 117 | R | 89.3 | Confident | 88.2 | Confident | 168 Ų | 168 | 90.8 Ų | 90.8 | 63% | 0.634 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -49.6 | -47.4 | -179 | -176.8 | 175.3 | -179.6 | 178.4 | 3.4 | 112.3 | D113 Q114 Q119 I120 D121 | D113-R117 WeakPolarHBondContact O-CB 3.4Å; D113-R117 PolarHBondContact O-N 2.93Å; Q114-R117 WeakPolarHBondContact O-CB 3.47Å; Q114-R117 PolarHBondContact O-N 3.32Å; R117-Q119 VanDerWaalsContact C-N 3.33Å; R117-Q119 PolarHBondContact O-N 3.47Å; R117-I120 PolarHBondContact O-N 2.86Å; R117-D121 IonicContact NE-OD2 2.96Å; R117-D121 WeakPolarHBondContact O-CB 3.46Å; R117-D121 VanDerWaalsContact O-CG 3.22Å; R117-D121 PolarHBondContact O-N 3.39Å |
| 118 | Y | 86.8 | Confident | 87.6 | Confident | 95 Ų | 95 | 92.7 Ų | 92.7 | 37% | 0.373 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -61.3 | -42 | 178.3 | -175.9 | -103.9 | 0 | 0 | 0 | 112.5 | L116 K122 D136 P137 L138 | L116-Y118 VanDerWaalsContact C-N 3.27Å; L116-Y118 PolarHBondContact O-N 2.92Å; Y118-K122 HydrophobicContact CE1-CD 4.25Å; Y118-K122 WeakPolarHBondContact O-CB 3.13Å; Y118-K122 PolarHBondContact O-N 3.09Å; Y118-D136 WeakPolarHBondContact CE1-OD1 3.29Å; Y118-D136 PolarHBondContact OH-OD1 3.5Å; Y118-P137 VanDerWaalsContact OH-CD 3.27Å; Y118-P137 WeakPolarHBondContact OH-CD 3.39Å; Y118-L138 HydrophobicContact CD1-CD1 3.83Å; Y118-L138 HydrophobicContact CE1-CD1 3.7Å; Y118-L138 HydrophobicContact CE1-CG 4.1Å |
| 119 | Q | 86.6 | Confident | 86.8 | Confident | 81 Ų | 81 | 89.3 Ų | 89.3 | 38% | 0.379 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -67.4 | -41 | 179.6 | -61 | -178.5 | 3.2 | 0 | 0 | 111.3 | L116 R117 K122 L123 | L116-Q119 WeakPolarHBondContact O-CA 3.44Å; L116-Q119 WeakPolarHBondContact O-CB 3.33Å; L116-Q119 PolarHBondContact O-N 3.32Å; R117-Q119 VanDerWaalsContact C-N 3.33Å; R117-Q119 PolarHBondContact O-N 3.47Å; Q119-K122 PolarHBondContact O-N 3.08Å; Q119-L123 WeakPolarHBondContact O-CB 3.44Å; Q119-L123 VanDerWaalsContact O-CG 3.27Å; Q119-L123 WeakPolarHBondContact O-CG 3.05Å; Q119-L123 PolarHBondContact O-N 3.13Å |
| 120 | I | 87.8 | Confident | 85.8 | Confident | 39 Ų | 39 | 92 Ų | 92 | 20% | 0.2 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -63.6 | -51.7 | 175.9 | -64.1 | 165.5 | 0 | 0 | 0 | 109.8 | L60 L63 L116 R117 K122 L123 V124 | L60-I120 HydrophobicContact CD1-CG1 3.71Å; L63-I120 HydrophobicContact CD1-CD1 4.3Å; L63-I120 HydrophobicContact CD1-CG1 4.34Å; L63-I120 HydrophobicContact CD2-CD1 4.13Å; L63-I120 HydrophobicContact CG-CD1 4.42Å; L116-I120 HydrophobicContact CB-CD1 4.15Å; L116-I120 WeakPolarHBondContact O-CG1 3.27Å; L116-I120 PolarHBondContact O-N 2.88Å; R117-I120 PolarHBondContact O-N 2.86Å; I120-K122 VanDerWaalsContact C-N 3.27Å; I120-K122 PolarHBondContact O-N 3.15Å; I120-L123 PolarHBondContact O-N 2.92Å; I120-L123 VanDerWaalsContact O-N 3.12Å; I120-V124 HydrophobicContact CG2-CG2 4.4Å; I120-V124 WeakPolarHBondContact O-CG2 3.49Å; I120-V124 PolarHBondContact O-N 3.44Å |
| 121 | D | 87.4 | Confident | 84.3 | Confident | 68 Ų | 68 | 89.6 Ų | 89.6 | 36% | 0.364 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60.5 | -38.8 | 179.6 | -71.4 | -17.6 | 0 | 0 | 0 | 111.2 | R117 R125 | R117-D121 IonicContact NE-OD2 2.96Å; R117-D121 WeakPolarHBondContact O-CB 3.46Å; R117-D121 VanDerWaalsContact O-CG 3.22Å; R117-D121 PolarHBondContact O-N 3.39Å; D121-R125 WeakPolarHBondContact O-CB 3.29Å; D121-R125 WeakPolarHBondContact O-CG 3.47Å; D121-R125 PolarHBondContact O-N 2.86Å |
| 122 | K | 84.8 | Confident | 82.8 | Confident | 55 Ų | 55 | 90.4 Ų | 90.4 | 24% | 0.239 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -62.4 | -49 | 173.9 | 179.5 | 178.7 | 174 | 174.2 | 0 | 111.4 | Y118 Q119 I120 V124 R125 T126 L132 D136 | Y118-K122 HydrophobicContact CE1-CD 4.25Å; Y118-K122 WeakPolarHBondContact O-CB 3.13Å; Y118-K122 PolarHBondContact O-N 3.09Å; Q119-K122 PolarHBondContact O-N 3.08Å; I120-K122 VanDerWaalsContact C-N 3.27Å; I120-K122 PolarHBondContact O-N 3.15Å; K122-V124 VanDerWaalsContact C-N 3.35Å; K122-V124 PolarHBondContact O-N 2.93Å; K122-R125 PolarHBondContact O-N 3.2Å; K122-T126 WeakPolarHBondContact O-CG2 3.49Å; K122-T126 PolarHBondContact O-N 3.39Å; K122-T126 PolarHBondContact O-OG1 3.31Å; K122-L132 HydrophobicContact CD-CD2 4.31Å; K122-L132 HydrophobicContact CG-CD2 4.17Å; K122-D136 WeakPolarHBondContact CE-OD2 3.21Å; K122-D136 IonicContact NZ-OD2 2.91Å; K122-D136 PolarHBondContact NZ-OD2 2.89Å |
| 123 | L | 82.9 | Confident | 81.4 | Confident | 93 Ų | 93 | 89.1 Ų | 89.1 | 49% | 0.487 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.5 | -41.7 | 179.1 | -73.4 | 171.6 | 0 | 0 | 0 | 111.9 | L60 Q119 I120 T126 A127 | L60-L123 HydrophobicContact CD1-CD1 3.98Å; L60-L123 HydrophobicContact CD2-CD1 4.37Å; L60-L123 HydrophobicContact CG-CD1 4.25Å; Q119-L123 WeakPolarHBondContact O-CB 3.44Å; Q119-L123 VanDerWaalsContact O-CG 3.27Å; Q119-L123 WeakPolarHBondContact O-CG 3.05Å; Q119-L123 PolarHBondContact O-N 3.13Å; I120-L123 PolarHBondContact O-N 2.92Å; I120-L123 VanDerWaalsContact O-N 3.12Å; L123-T126 VanDerWaalsContact CA-OG1 3.3Å; L123-T126 WeakPolarHBondContact CA-OG1 3Å; L123-T126 PolarHBondContact O-N 2.98Å; L123-T126 PolarHBondContact O-OG1 3.35Å; L123-A127 WeakPolarHBondContact O-CB 3.27Å; L123-A127 PolarHBondContact O-N 3.17Å |
| 124 | V | 85.3 | Confident | 80.1 | Confident | 83 Ų | 83 | 97.1 Ų | 97.1 | 50% | 0.503 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.1 | -45.7 | 175.4 | 173 | 0 | 0 | 0 | 0 | 110.6 | I120 K122 T126 A127 V128 | I120-V124 HydrophobicContact CG2-CG2 4.4Å; I120-V124 WeakPolarHBondContact O-CG2 3.49Å; I120-V124 PolarHBondContact O-N 3.44Å; K122-V124 VanDerWaalsContact C-N 3.35Å; K122-V124 PolarHBondContact O-N 2.93Å; V124-T126 PolarHBondContact O-N 2.82Å; V124-A127 PolarHBondContact O-N 2.84Å; V124-V128 HydrophobicContact CG1-CG2 4.49Å; V124-V128 WeakPolarHBondContact O-CG2 3.48Å; V124-V128 PolarHBondContact O-N 3.19Å |
| 125 | R | 84.3 | Confident | 78.5 | Confident | 177 Ų | 177 | 97.6 Ų | 97.6 | 67% | 0.668 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -59.6 | -46.3 | 175.3 | -75.4 | 173.4 | -174.6 | -157.7 | 2 | 111.3 | D121 K122 A127 V128 T129 | D121-R125 WeakPolarHBondContact O-CB 3.29Å; D121-R125 WeakPolarHBondContact O-CG 3.47Å; D121-R125 PolarHBondContact O-N 2.86Å; K122-R125 PolarHBondContact O-N 3.2Å; R125-A127 VanDerWaalsContact C-N 3.29Å; R125-A127 PolarHBondContact O-N 2.52Å; R125-V128 PolarHBondContact O-N 3.27Å; R125-T129 PolarHBondContact O-N 3.49Å; R125-T129 PolarHBondContact O-OG1 2.96Å |
| 126 | T | 81.8 | Confident | 77.3 | Confident | 43 Ų | 43 | 90.4 Ų | 90.4 | 26% | 0.264 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.6 | -37.7 | 177.7 | 53 | 0 | 0 | 0 | 0 | 112.6 | K122 L123 V124 G130 L132 | K122-T126 WeakPolarHBondContact O-CG2 3.49Å; K122-T126 PolarHBondContact O-N 3.39Å; K122-T126 PolarHBondContact O-OG1 3.31Å; L123-T126 VanDerWaalsContact CA-OG1 3.3Å; L123-T126 WeakPolarHBondContact CA-OG1 3Å; L123-T126 PolarHBondContact O-N 2.98Å; L123-T126 PolarHBondContact O-OG1 3.35Å; V124-T126 PolarHBondContact O-N 2.82Å; T126-G130 VanDerWaalsContact O-CA 3.26Å; T126-G130 WeakPolarHBondContact O-CA 3.48Å; T126-G130 PolarHBondContact O-N 3.35Å; T126-L132 HydrophobicContact CG2-CD2 3.4Å; T126-L132 VanDerWaalsContact CG2-CD2 3.4Å; T126-L132 HydrophobicContact CG2-CG 3.82Å |
| 127 | A | 80.5 | Confident | 76.2 | Confident | 88 Ų | 88 | 93.1 Ų | 93.1 | 73% | 0.727 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -68.4 | -35.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L123 V124 R125 | L123-A127 WeakPolarHBondContact O-CB 3.27Å; L123-A127 PolarHBondContact O-N 3.17Å; V124-A127 PolarHBondContact O-N 2.84Å; R125-A127 VanDerWaalsContact C-N 3.29Å; R125-A127 PolarHBondContact O-N 2.52Å |
| 128 | V | 82.3 | Confident | 75 | Confident | 119 Ų | 119 | 87.9 Ų | 87.9 | 72% | 0.721 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -83.8 | -42.4 | -178.6 | 175.5 | 0 | 0 | 0 | 0 | 112.7 | V124 R125 | V124-V128 HydrophobicContact CG1-CG2 4.49Å; V124-V128 WeakPolarHBondContact O-CG2 3.48Å; V124-V128 PolarHBondContact O-N 3.19Å; R125-V128 PolarHBondContact O-N 3.27Å |
| 129 | T | 77.2 | Confident | 73.9 | Confident | 101 Ų | 101 | 90 Ų | 90 | 62% | 0.62 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -102.6 | -9.8 | -173 | 37.1 | 0 | 0 | 0 | 0 | 114.4 | R125 S131 | R125-T129 PolarHBondContact O-N 3.49Å; R125-T129 PolarHBondContact O-OG1 2.96Å; T129-S131 PolarHBondContact O-N 3.1Å |
| 130 | G | 70.9 | Confident | 72.9 | Confident | 73 Ų | 73 | 94.4 Ų | 94.4 | 75% | 0.753 | 53% | 0.534 | S | S | * | . | S | Bend | trans | 65.6 | 2.7 | 179 | 0 | 0 | 0 | 0 | 0 | 115.1 | T126 | T126-G130 VanDerWaalsContact O-CA 3.26Å; T126-G130 WeakPolarHBondContact O-CA 3.48Å; T126-G130 PolarHBondContact O-N 3.35Å |
| 131 | S | 61.1 | Low | 72 | Confident | 77 Ų | 77 | 101.1 Ų | 101.1 | 54% | 0.538 | 56% | 0.557 | S | S | . | * | S | Bend | trans | -137.2 | 140.2 | -176.9 | 179 | 0 | 0 | 0 | 0 | 110.8 | T129 | T129-S131 PolarHBondContact O-N 3.1Š|
| 132 | L | 62.7 | Low | 71.2 | Confident | 85 Ų | 85 | 103.8 Ų | 103.8 | 45% | 0.445 | 58% | 0.578 | S | S | . | * | trans | -78.7 | 117.6 | 169.3 | -71.4 | 156.9 | 0 | 0 | 0 | 107.2 | K122 T126 | K122-L132 HydrophobicContact CD-CD2 4.31Å; K122-L132 HydrophobicContact CG-CD2 4.17Å; T126-L132 HydrophobicContact CG2-CD2 3.4Å; T126-L132 VanDerWaalsContact CG2-CD2 3.4Å; T126-L132 HydrophobicContact CG2-CG 3.82Å | ||
| 133 | G | 62 | Low | 70.5 | Confident | 56 Ų | 56 | 105.2 Ų | 105.2 | 58% | 0.577 | 59% | 0.589 | S | S | * | * | trans | -54.2 | 141.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | N135 D136 | G133-N135 PolarHBondContact O-N 2.94Å; G133-D136 PolarHBondContact O-N 2.61Å | ||
| 134 | E | 59.2 | Low | 69.9 | Low | 197 Ų | 197 | 104.5 Ų | 104.5 | 92% | 0.921 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.7 | -18.5 | -177.9 | -102.6 | 178.4 | 152.8 | 0 | 0 | 114.5 | ||
| 135 | N | 58.5 | Low | 69.4 | Low | 155 Ų | 155 | 105.8 Ų | 105.8 | 83% | 0.829 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.3 | 45.1 | -176.2 | -61.4 | -51.3 | 0 | 0 | 0 | 113.1 | G133 P137 | G133-N135 PolarHBondContact O-N 2.94Å; N135-P137 WeakPolarHBondContact O-CD 3.35Å |
| 136 | D | 64.9 | Low | 68.7 | Low | 8 Ų | 8 | 102.6 Ų | 102.6 | 4% | 0.043 | 59% | 0.59 | C | S | . | * | trans | -89.6 | 114.2 | 174 | 179.4 | 4.4 | 0 | 0 | 0 | 111.4 | Y118 K122 G133 L138 H139 | Y118-D136 WeakPolarHBondContact CE1-OD1 3.29Å; Y118-D136 PolarHBondContact OH-OD1 3.5Å; K122-D136 WeakPolarHBondContact CE-OD2 3.21Å; K122-D136 IonicContact NZ-OD2 2.91Å; K122-D136 PolarHBondContact NZ-OD2 2.89Å; G133-D136 PolarHBondContact O-N 2.61Å; D136-L138 PolarHBondContact O-N 3.28Å; D136-L138 VanDerWaalsContact O-N 3.1Å; D136-L138 WeakPolarHBondContact OD1-CB 3.28Å; D136-L138 PolarHBondContact OD1-N 3.24Å; D136-H139 HydrophobicContact CB-CB 4.2Å; D136-H139 VanDerWaalsContact O-CB 3.24Å; D136-H139 WeakPolarHBondContact O-CB 3.3Å; D136-H139 PolarHBondContact O-N 3.23Å | ||
| 137 | P | 63.8 | Low | 68 | Low | 94 Ų | 94 | 106.1 Ų | 106.1 | 61% | 0.61 | 61% | 0.606 | S | S | * | * | G | 310 helix | trans | -58.2 | -24 | 178.2 | -22.4 | 33.6 | 0 | 0 | 0 | 114.1 | Y118 N135 | Y118-P137 VanDerWaalsContact OH-CD 3.27Å; Y118-P137 WeakPolarHBondContact OH-CD 3.39Å; N135-P137 WeakPolarHBondContact O-CD 3.35Å |
| 138 | L | 64.7 | Low | 67.2 | Low | 59 Ų | 59 | 106 Ų | 106 | 31% | 0.309 | 60% | 0.596 | S | S | . | * | G | 310 helix | trans | -86.3 | -5.4 | 177.4 | -68.5 | 176.2 | 0 | 0 | 0 | 113.6 | Y118 D136 F140 R141 | Y118-L138 HydrophobicContact CD1-CD1 3.83Å; Y118-L138 HydrophobicContact CE1-CD1 3.7Å; Y118-L138 HydrophobicContact CE1-CG 4.1Å; D136-L138 PolarHBondContact O-N 3.28Å; D136-L138 VanDerWaalsContact O-N 3.1Å; D136-L138 WeakPolarHBondContact OD1-CB 3.28Å; D136-L138 PolarHBondContact OD1-N 3.24Å; L138-F140 PolarHBondContact O-N 2.73Å; L138-R141 WeakPolarHBondContact O-CG 3.37Å; L138-R141 PolarHBondContact O-N 3.34Å |
| 139 | H | 64.3 | Low | 66.2 | Low | 139 Ų | 139 | 103.5 Ų | 103.5 | 64% | 0.644 | 58% | 0.584 | S | S | * | * | G | 310 helix | trans | -69.2 | -18.7 | 175.3 | -168.1 | -90.2 | 0 | 0 | 0 | 112.3 | D136 R141 | D136-H139 HydrophobicContact CB-CB 4.2Å; D136-H139 VanDerWaalsContact O-CB 3.24Å; D136-H139 WeakPolarHBondContact O-CB 3.3Å; D136-H139 PolarHBondContact O-N 3.23Å; H139-R141 PolarHBondContact O-N 2.93Å |
| 140 | F | 65.1 | Low | 65.4 | Low | 173 Ų | 173 | 106.6 Ų | 106.6 | 76% | 0.759 | 59% | 0.589 | S | S | * | * | G | 310 helix | trans | -85.6 | 21.7 | 177.9 | -57.7 | -70.6 | 0 | 0 | 0 | 114 | L138 | L138-F140 PolarHBondContact O-N 2.73Š|
| 141 | R | 68.3 | Low | 64.6 | Low | 180 Ų | 180 | 109.5 Ų | 109.5 | 68% | 0.679 | 59% | 0.587 | S | S | * | * | trans | -67 | 134.4 | 171.8 | -78.3 | -177.9 | 169.4 | -167.7 | -2.6 | 109.7 | L138 H139 N143 | L138-R141 WeakPolarHBondContact O-CG 3.37Å; L138-R141 PolarHBondContact O-N 3.34Å; H139-R141 PolarHBondContact O-N 2.93Å; R141-N143 PolarHBondContact O-N 2.86Å | ||
| 142 | P | 70.4 | Confident | 64.1 | Low | 125 Ų | 125 | 110.1 Ų | 110.1 | 81% | 0.812 | 59% | 0.591 | S | S | * | * | trans | -55.7 | 127.2 | 172 | -21.3 | 31.2 | 0 | 0 | 0 | 109.4 | P144 | P142-P144 VanDerWaalsContact O-CD 3.28Å; P142-P144 WeakPolarHBondContact O-CD 3.44Å | ||
| 143 | N | 69.8 | Low | 63.6 | Low | 85 Ų | 85 | 114.3 Ų | 114.3 | 46% | 0.455 | 61% | 0.608 | S | S | . | * | trans | -89.3 | 105.9 | 175.8 | -164.7 | 5.3 | 0 | 0 | 0 | 108.8 | R141 D145 N146 | R141-N143 PolarHBondContact O-N 2.86Å; N143-D145 PolarHBondContact O-N 3.23Å; N143-N146 WeakPolarHBondContact O-CB 3.35Å; N143-N146 PolarHBondContact O-N 3.36Å | ||
| 144 | P | 71.4 | Confident | 62.9 | Low | 78 Ų | 78 | 116 Ų | 116 | 51% | 0.506 | 61% | 0.611 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64.3 | -25.3 | -175.6 | 27.5 | -34.8 | 0 | 0 | 0 | 112.4 | P142 N146 L147 V148 | P142-P144 VanDerWaalsContact O-CD 3.28Å; P142-P144 WeakPolarHBondContact O-CD 3.44Å; P144-N146 PolarHBondContact O-N 3.01Å; P144-L147 VanDerWaalsContact O-CB 3.3Å; P144-L147 WeakPolarHBondContact O-CB 3.49Å; P144-L147 PolarHBondContact O-N 3.46Å; P144-V148 WeakPolarHBondContact O-CG2 3.3Å; P144-V148 PolarHBondContact O-N 3.48Å |
| 145 | D | 73.5 | Confident | 62.2 | Low | 110 Ų | 110 | 115.1 Ų | 115.1 | 59% | 0.588 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -62.9 | -26.3 | 178.2 | -62.5 | -18.8 | 0 | 0 | 0 | 112.9 | N143 L147 V148 | N143-D145 PolarHBondContact O-N 3.23Å; D145-L147 PolarHBondContact O-N 3.29Å; D145-V148 PolarHBondContact O-N 2.9Å |
| 146 | N | 71.4 | Confident | 61 | Low | 109 Ų | 109 | 115 Ų | 115 | 58% | 0.583 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -70.7 | -10.7 | 173.1 | -79.2 | -19.4 | 0 | 0 | 0 | 113.5 | N143 P144 | N143-N146 WeakPolarHBondContact O-CB 3.35Å; N143-N146 PolarHBondContact O-N 3.36Å; P144-N146 PolarHBondContact O-N 3.01Å |
| 147 | L | 65.6 | Low | 59.8 | Low | 117 Ų | 117 | 120.7 Ų | 120.7 | 61% | 0.613 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -96.4 | -33 | 174.9 | -60 | 171.5 | 0 | 0 | 0 | 111.5 | P144 D145 K150 | P144-L147 VanDerWaalsContact O-CB 3.3Å; P144-L147 WeakPolarHBondContact O-CB 3.49Å; P144-L147 PolarHBondContact O-N 3.46Å; D145-L147 PolarHBondContact O-N 3.29Å; L147-K150 PolarHBondContact O-N 3.26Å |
| 148 | V | 64.4 | Low | 58.3 | Low | 86 Ų | 86 | 119.2 Ų | 119.2 | 52% | 0.521 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -69.4 | -39.3 | -174.4 | -167.7 | 0 | 0 | 0 | 0 | 111.6 | P144 D145 K150 L151 S152 | P144-V148 WeakPolarHBondContact O-CG2 3.3Å; P144-V148 PolarHBondContact O-N 3.48Å; D145-V148 PolarHBondContact O-N 2.9Å; V148-K150 PolarHBondContact O-N 3.21Å; V148-K150 VanDerWaalsContact O-N 3.1Å; V148-L151 PolarHBondContact O-N 3.23Å; V148-L151 VanDerWaalsContact O-N 3.07Å; V148-S152 PolarHBondContact O-N 3.27Å |
| 149 | S | 61.3 | Low | 56.7 | Low | 67 Ų | 67 | 124 Ų | 124 | 47% | 0.469 | 68% | 0.675 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64.8 | -15.7 | 177.6 | 58 | 0 | 0 | 0 | 0 | 114.4 | ||
| 150 | K | 59.4 | Low | 55 | Low | 165 Ų | 165 | 126.1 Ų | 126.1 | 72% | 0.717 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.7 | -13 | 176 | -67.4 | -175.7 | -179.8 | 176.1 | 0 | 114 | L147 V148 | L147-K150 PolarHBondContact O-N 3.26Å; V148-K150 PolarHBondContact O-N 3.21Å; V148-K150 VanDerWaalsContact O-N 3.1Å |
| 151 | L | 54.9 | Low | 53.2 | Low | 134 Ų | 134 | 126 Ų | 126 | 70% | 0.702 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.4 | -26.3 | 179.3 | -79.3 | 162.4 | 0 | 0 | 0 | 112 | V148 S154 | V148-L151 PolarHBondContact O-N 3.23Å; V148-L151 VanDerWaalsContact O-N 3.07Å; L151-S154 PolarHBondContact O-OG 3.41Å |
| 152 | S | 51.5 | Low | 51.2 | Low | 90 Ų | 90 | 120.6 Ų | 120.6 | 63% | 0.629 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.2 | -9.3 | 177 | 67.1 | 0 | 0 | 0 | 0 | 114.3 | V148 | V148-S152 PolarHBondContact O-N 3.27Š|
| 153 | E | 51.4 | Low | 49.2 | Very low | 174 Ų | 174 | 118.2 Ų | 118.2 | 81% | 0.813 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.7 | 4.4 | -178.2 | -157.2 | 167.8 | -175 | 0 | 0 | 113 | ||
| 154 | S | 48.2 | Very low | 47.1 | Very low | 90 Ų | 90 | 123.9 Ų | 123.9 | 63% | 0.629 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -100 | -3.3 | 177.3 | 54.6 | 0 | 0 | 0 | 0 | 115.1 | L151 | L151-S154 PolarHBondContact O-OG 3.41Š|
| 155 | E | 43.2 | Very low | 45.4 | Very low | 180 Ų | 180 | 130.1 Ų | 130.1 | 84% | 0.841 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -142.7 | 68.8 | 177.8 | -67.4 | -158 | -176.2 | 0 | 0 | 111.9 | ||
| 156 | D | 34.1 | Very low | 43.2 | Very low | 152 Ų | 152 | 129.8 Ų | 129.8 | 81% | 0.813 | 75% | 0.746 | S | S | * | * | trans | -167 | 105.8 | 140.1 | -161.3 | 18.5 | 0 | 0 | 0 | 109.2 | ||||
| 157 | S | 39.8 | Very low | 41.6 | Very low | 128 Ų | 128 | 134.2 Ų | 134.2 | 90% | 0.895 | 76% | 0.763 | S | S | * | * | trans | -110.6 | 92.8 | 168.1 | 60.4 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 158 | G | 31 | Very low | 39.8 | Very low | 63 Ų | 63 | 132.2 Ų | 132.2 | 65% | 0.649 | 77% | 0.771 | S | S | * | * | trans | -144.7 | 117.6 | 175 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 159 | D | 31 | Very low | 38.3 | Very low | 159 Ų | 159 | 132.7 Ų | 132.7 | 85% | 0.85 | 78% | 0.784 | S | S | * | * | trans | -69.6 | 138 | -176.6 | -157.1 | 8.4 | 0 | 0 | 0 | 111.9 | ||||
| 160 | E | 28.6 | Very low | 36.9 | Very low | 184 Ų | 184 | 138.2 Ų | 138.2 | 86% | 0.86 | 80% | 0.802 | S | S | * | * | 168.3 | 145.9 | 122.6 | -91 | -173.5 | -179.8 | 0 | 0 | 114.3 | |||||
| 161 | D | 28.6 | Very low | 35.9 | Very low | 170 Ų | 170 | 139.4 Ų | 139.4 | 91% | 0.909 | 81% | 0.808 | S | S | * | * | trans | -27.7 | 155.4 | 178.8 | -162.6 | 24 | 0 | 0 | 0 | 122.1 | ||||
| 162 | G | 26.2 | Very low | 35 | Very low | 67 Ų | 67 | 141.9 Ų | 141.9 | 69% | 0.691 | 81% | 0.812 | S | S | * | * | trans | 132.4 | 99.3 | 149.8 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 163 | G | 27.1 | Very low | 34.4 | Very low | 75 Ų | 75 | 143.6 Ų | 143.6 | 77% | 0.773 | 82% | 0.819 | S | S | * | * | 84.6 | 111.3 | 127.2 | 0 | 0 | 0 | 0 | 0 | 122 | |||||
| 164 | E | 26.3 | Very low | 34.2 | Very low | 203 Ų | 203 | 140.7 Ų | 140.7 | 95% | 0.949 | 82% | 0.815 | S | S | * | * | trans | 86 | 147.7 | 137.6 | -56.4 | -161.6 | 164 | 0 | 0 | 122.6 | ||||
| 165 | K | 36.5 | Very low | 33.9 | Very low | 209 Ų | 209 | 140.6 Ų | 140.6 | 91% | 0.909 | 82% | 0.815 | S | S | * | * | trans | -80.5 | 144.9 | -160.8 | -63 | 175.8 | 173.4 | 176.7 | 0 | 112.9 | ||||
| 166 | A | 26.8 | Very low | 34.3 | Very low | 103 Ų | 103 | 137.9 Ų | 137.9 | 85% | 0.851 | 82% | 0.816 | S | S | * | * | trans | -150 | 132.7 | 147.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 167 | E | 37 | Very low | 35.2 | Very low | 203 Ų | 203 | 134.3 Ų | 134.3 | 95% | 0.949 | 81% | 0.814 | S | S | * | * | trans | -72.5 | 139.1 | -178.5 | -60 | -176 | 152.4 | 0 | 0 | 111.8 | ||||
| 168 | G | 28.1 | Very low | 36.4 | Very low | 74 Ų | 74 | 137 Ų | 137 | 76% | 0.763 | 81% | 0.81 | S | S | * | * | trans | 179 | 90 | 175 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 169 | A | 33.3 | Very low | 38.4 | Very low | 97 Ų | 97 | 143.2 Ų | 143.2 | 80% | 0.802 | 82% | 0.819 | S | S | * | * | trans | 38.1 | 98.1 | 156.8 | 0 | 0 | 0 | 0 | 0 | 118.3 | K171 | A169-K171 PolarHBondContact O-N 3.28Š| ||
| 170 | E | 32 | Very low | 40.9 | Very low | 182 Ų | 182 | 144.4 Ų | 144.4 | 85% | 0.85 | 81% | 0.813 | S | S | * | * | trans | -57.5 | 92.5 | 168 | -65.9 | -172.8 | 165.6 | 0 | 0 | 112.7 | K172 | E170-K172 PolarHBondContact O-N 3.2Š| ||
| 171 | K | 37.4 | Very low | 43.5 | Very low | 191 Ų | 191 | 141.2 Ų | 141.2 | 83% | 0.83 | 81% | 0.805 | S | S | * | * | trans | -77.2 | 106.4 | 151.1 | -80.3 | -175.8 | -179.2 | 174 | 0 | 107.1 | A169 V173 | A169-K171 PolarHBondContact O-N 3.28Å; K171-V173 VanDerWaalsContact C-N 3.34Å; K171-V173 PolarHBondContact O-N 3.07Å | ||
| 172 | K | 37.2 | Very low | 46 | Very low | 185 Ų | 185 | 136.9 Ų | 136.9 | 80% | 0.804 | 79% | 0.787 | S | S | * | * | trans | -55.9 | 94.3 | 173.4 | -69.1 | -174.6 | 178.1 | 177.5 | 0 | 110.4 | E170 | E170-K172 PolarHBondContact O-N 3.2Š| ||
| 173 | V | 38.1 | Very low | 48.6 | Very low | 127 Ų | 127 | 138.2 Ų | 138.2 | 77% | 0.77 | 78% | 0.783 | S | S | * | * | trans | -62.9 | 121.8 | 164.5 | -174.3 | 0 | 0 | 0 | 0 | 106.5 | K171 S175 | K171-V173 VanDerWaalsContact C-N 3.34Å; K171-V173 PolarHBondContact O-N 3.07Å; V173-S175 PolarHBondContact O-N 3.37Å | ||
| 174 | P | 47.1 | Very low | 51.1 | Low | 112 Ų | 112 | 144.5 Ų | 144.5 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | trans | -68.4 | 113.2 | 177.1 | 27.4 | -29.6 | 0 | 0 | 0 | 107.7 | S176 | P174-S176 PolarHBondContact O-N 3.1Š| ||
| 175 | S | 41.6 | Very low | 53.3 | Low | 89 Ų | 89 | 142 Ų | 142 | 62% | 0.622 | 78% | 0.781 | S | S | * | * | trans | 1.9 | 109.5 | 160.3 | 153.1 | 0 | 0 | 0 | 0 | 114.1 | V173 G177 | V173-S175 PolarHBondContact O-N 3.37Å; S175-G177 PolarHBondContact O-N 3.38Å | ||
| 176 | S | 52.3 | Low | 55.3 | Low | 123 Ų | 123 | 135.4 Ų | 135.4 | 86% | 0.86 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -43.6 | 120.5 | 157.5 | 45.3 | 0 | 0 | 0 | 0 | 109.1 | P174 | P174-S176 PolarHBondContact O-N 3.1Š|
| 177 | G | 53.8 | Low | 57.8 | Low | 76 Ų | 76 | 136.9 Ų | 136.9 | 78% | 0.784 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 139.1 | -11 | 175.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | S175 K179 | S175-G177 PolarHBondContact O-N 3.38Å; G177-K179 PolarHBondContact O-N 2.83Å |
| 178 | K | 64.1 | Low | 59.6 | Low | 185 Ų | 185 | 135.5 Ų | 135.5 | 80% | 0.804 | 76% | 0.762 | S | S | * | * | trans | -85.3 | 104.1 | 172.8 | -70 | -178.8 | -174.3 | 173 | 0 | 110.4 | Y180 | K178-Y180 PolarHBondContact O-N 3.09Å; K178-Y180 VanDerWaalsContact O-N 3.17Å | ||
| 179 | K | 73.9 | Confident | 61.6 | Low | 194 Ų | 194 | 140.7 Ų | 140.7 | 84% | 0.843 | 77% | 0.766 | S | S | * | * | trans | -48.3 | 119.3 | 169 | -162.3 | 170.8 | -168.4 | 175.6 | 0 | 108.8 | G177 V181 | G177-K179 PolarHBondContact O-N 2.83Å; K179-V181 PolarHBondContact O-N 2.92Å | ||
| 180 | Y | 83.1 | Confident | 63.5 | Low | 184 Ų | 184 | 144.7 Ų | 144.7 | 72% | 0.722 | 76% | 0.761 | S | S | * | * | trans | -61.2 | 121 | 179.6 | 176.9 | -101.5 | 0 | 0 | 0 | 109.2 | K178 P182 | K178-Y180 PolarHBondContact O-N 3.09Å; K178-Y180 VanDerWaalsContact O-N 3.17Å; Y180-P182 HydrophobicContact CE1-CB 3.96Å | ||
| 181 | V | 82.4 | Confident | 64.9 | Low | 116 Ų | 116 | 142 Ų | 142 | 70% | 0.703 | 75% | 0.749 | S | S | * | * | trans | -106.5 | 111.1 | 172.9 | -179.6 | 0 | 0 | 0 | 0 | 107 | K179 | K179-V181 PolarHBondContact O-N 2.92Š| ||
| 182 | P | 81.9 | Confident | 66.6 | Low | 80 Ų | 80 | 134.4 Ų | 134.4 | 52% | 0.519 | 73% | 0.725 | S | S | . | * | trans | -61.6 | 137.6 | 177.3 | 21.8 | -29.7 | 0 | 0 | 0 | 110 | Y180 K184 | Y180-P182 HydrophobicContact CE1-CB 3.96Å; P182-K184 PolarHBondContact O-N 3.24Å | ||
| 183 | P | 80.3 | Confident | 68.2 | Low | 95 Ų | 95 | 132.7 Ų | 132.7 | 62% | 0.617 | 73% | 0.725 | S | S | * | * | trans | -61.6 | 129.6 | 174.9 | 25.8 | -32.3 | 0 | 0 | 0 | 109.1 | I185 | P183-I185 PolarHBondContact O-N 3.07Å; P183-I185 VanDerWaalsContact O-N 3.08Å | ||
| 184 | K | 79.3 | Confident | 69.6 | Low | 207 Ų | 207 | 129.5 Ų | 129.5 | 90% | 0.9 | 70% | 0.703 | S | S | * | * | trans | -77.9 | 94.4 | 175.1 | -65.8 | -176.9 | 178.9 | -175.7 | 0 | 108.2 | P182 A186 | P182-K184 PolarHBondContact O-N 3.24Å; K184-A186 PolarHBondContact O-N 3.23Å | ||
| 185 | I | 73.9 | Confident | 71 | Confident | 151 Ų | 151 | 127.9 Ų | 127.9 | 77% | 0.774 | 69% | 0.691 | S | S | * | * | trans | -77.9 | 108.1 | 174.1 | -56.4 | 173.7 | 0 | 0 | 0 | 107.1 | P183 | P183-I185 PolarHBondContact O-N 3.07Å; P183-I185 VanDerWaalsContact O-N 3.08Å | ||
| 186 | A | 78.6 | Confident | 72.8 | Confident | 70 Ų | 70 | 128.9 Ų | 128.9 | 58% | 0.579 | 69% | 0.69 | S | S | * | * | trans | -78.4 | 137.5 | 167.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | K184 M188 | K184-A186 PolarHBondContact O-N 3.23Å; A186-M188 PolarHBondContact O-N 3.35Å; A186-M188 VanDerWaalsContact O-N 3.1Å | ||
| 187 | P | 77.9 | Confident | 74.3 | Confident | 133 Ų | 133 | 125.6 Ų | 125.6 | 86% | 0.864 | 67% | 0.67 | S | S | * | * | trans | -57.3 | 118.4 | 169.8 | -18 | 29.4 | 0 | 0 | 0 | 108.7 | ||||
| 188 | M | 75.7 | Confident | 75.7 | Confident | 175 Ų | 175 | 124.7 Ų | 124.7 | 86% | 0.862 | 65% | 0.647 | S | S | * | * | trans | -106.5 | 135.7 | 168.3 | -66.3 | -171.6 | 85.1 | 0 | 0 | 107.4 | A186 Y190 | A186-M188 PolarHBondContact O-N 3.35Å; A186-M188 VanDerWaalsContact O-N 3.1Å; M188-Y190 PolarHBondContact O-N 3.27Å | ||
| 189 | H | 70.3 | Confident | 76.6 | Confident | 183 Ų | 183 | 120.5 Ų | 120.5 | 85% | 0.847 | 63% | 0.629 | S | S | * | * | trans | -61.2 | 126.7 | 173 | -71.4 | -84.9 | 0 | 0 | 0 | 108.8 | E191 | H189-E191 PolarHBondContact O-N 2.91Š| ||
| 190 | Y | 71.7 | Confident | 77.1 | Confident | 180 Ų | 180 | 118.7 Ų | 118.7 | 71% | 0.706 | 62% | 0.621 | S | S | * | * | trans | -79.4 | 108.7 | 175.2 | 179.6 | -106.6 | 0 | 0 | 0 | 108.3 | M188 G192 D193 | M188-Y190 PolarHBondContact O-N 3.27Å; Y190-G192 VanDerWaalsContact CE1-CA 3.43Å; Y190-G192 PolarHBondContact O-N 3.1Å; Y190-D193 PolarHBondContact OH-OD1 3.31Å | ||
| 191 | E | 63.3 | Low | 77.3 | Confident | 125 Ų | 125 | 116 Ų | 116 | 58% | 0.584 | 61% | 0.613 | S | S | * | * | trans | -83.4 | 11.2 | -179.7 | -61.2 | -165.2 | 166.6 | 0 | 0 | 113.5 | H189 L194 | H189-E191 PolarHBondContact O-N 2.91Å; E191-L194 HydrophobicContact CB-CD1 3.58Å; E191-L194 HydrophobicContact CB-CG 4.22Å; E191-L194 WeakPolarHBondContact OE2-CD1 3.5Å | ||
| 192 | G | 72.2 | Confident | 77.5 | Confident | 33 Ų | 33 | 115 Ų | 115 | 34% | 0.34 | 60% | 0.601 | S | S | . | * | trans | 88.3 | -173.7 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y190 L194 | Y190-G192 VanDerWaalsContact CE1-CA 3.43Å; Y190-G192 PolarHBondContact O-N 3.1Å; G192-L194 PolarHBondContact O-N 3.08Å | ||
| 193 | D | 71.4 | Confident | 77.7 | Confident | 148 Ų | 148 | 116 Ų | 116 | 79% | 0.791 | 60% | 0.602 | S | S | * | * | S | Bend | trans | -76.9 | 65.2 | 172.8 | -71.3 | -17.4 | 0 | 0 | 0 | 110.2 | Y190 T195 | Y190-D193 PolarHBondContact OH-OD1 3.31Å; D193-T195 PolarHBondContact O-N 3.36Å |
| 194 | L | 66 | Low | 78 | Confident | 61 Ų | 61 | 113.2 Ų | 113.2 | 32% | 0.319 | 59% | 0.586 | S | S | . | * | trans | -63.2 | 123.5 | 172.7 | -68.4 | 176.2 | 0 | 0 | 0 | 109.2 | E191 G192 D198 K199 | E191-L194 HydrophobicContact CB-CD1 3.58Å; E191-L194 HydrophobicContact CB-CG 4.22Å; E191-L194 WeakPolarHBondContact OE2-CD1 3.5Å; G192-L194 PolarHBondContact O-N 3.08Å; L194-D198 HydrophobicContact CB-CB 4.35Å; L194-D198 HydrophobicContact CD2-CB 4.16Å; L194-K199 HydrophobicContact CB-CG 4.41Å; L194-K199 WeakPolarHBondContact O-CE 3.35Å | ||
| 195 | T | 78.3 | Confident | 78.3 | Confident | 78 Ų | 78 | 106.4 Ų | 106.4 | 48% | 0.479 | 56% | 0.559 | S | S | . | * | trans | -62.6 | 155.7 | 174.6 | 69.1 | 0 | 0 | 0 | 0 | 109.8 | D193 A197 D198 K199 | D193-T195 PolarHBondContact O-N 3.36Å; T195-A197 PolarHBondContact O-N 2.92Å; T195-A197 VanDerWaalsContact O-N 3.09Å; T195-D198 PolarHBondContact N-OD2 3.06Å; T195-D198 PolarHBondContact O-N 3Å; T195-D198 PolarHBondContact OG1-N 2.92Å; T195-D198 PolarHBondContact OG1-OD2 3.5Å; T195-K199 PolarHBondContact O-N 2.89Å | ||
| 196 | D | 78.6 | Confident | 78.9 | Confident | 110 Ų | 110 | 106 Ų | 106 | 59% | 0.588 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -62.4 | -19.8 | 177.2 | -67 | -29.7 | 0 | 0 | 0 | 112.6 | K199 K200 | D196-K199 IonicContact OD1-NZ 3.64Å; D196-K199 PolarHBondContact OD1-NZ 3.12Å; D196-K200 VanDerWaalsContact O-CG 3.31Å; D196-K200 WeakPolarHBondContact O-CG 3.43Å; D196-K200 PolarHBondContact O-N 2.89Å |
| 197 | A | 83.3 | Confident | 79.2 | Confident | 54 Ų | 54 | 108.5 Ų | 108.5 | 45% | 0.446 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -69.2 | -39.8 | 170.4 | 0 | 0 | 0 | 0 | 0 | 112 | T195 K200 K201 | T195-A197 PolarHBondContact O-N 2.92Å; T195-A197 VanDerWaalsContact O-N 3.09Å; A197-K200 PolarHBondContact O-N 3.29Å; A197-K201 WeakPolarHBondContact O-CG 3.45Å; A197-K201 PolarHBondContact O-N 3.04Å |
| 198 | D | 82.9 | Confident | 79.5 | Confident | 57 Ų | 57 | 108.2 Ų | 108.2 | 31% | 0.305 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -70.8 | -38.8 | -179.9 | -58.4 | -40.5 | 0 | 0 | 0 | 111.4 | L194 T195 K200 K201 E202 | L194-D198 HydrophobicContact CB-CB 4.35Å; L194-D198 HydrophobicContact CD2-CB 4.16Å; T195-D198 PolarHBondContact N-OD2 3.06Å; T195-D198 PolarHBondContact O-N 3Å; T195-D198 PolarHBondContact OG1-N 2.92Å; T195-D198 PolarHBondContact OG1-OD2 3.5Å; D198-K200 VanDerWaalsContact C-N 3.31Å; D198-K200 PolarHBondContact O-N 2.63Å; D198-K201 WeakPolarHBondContact O-CB 3.31Å; D198-K201 PolarHBondContact O-N 2.82Å; D198-K201 IonicContact OD1-NZ 3.02Å; D198-E202 PolarHBondContact O-N 3.21Å |
| 199 | K | 83.2 | Confident | 80 | Confident | 97 Ų | 97 | 108.3 Ų | 108.3 | 42% | 0.422 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.8 | -41.3 | 171.9 | -62.3 | 175.3 | -165.5 | 153.8 | 0 | 112 | L194 T195 D196 E202 L203 | L194-K199 HydrophobicContact CB-CG 4.41Å; L194-K199 WeakPolarHBondContact O-CE 3.35Å; T195-K199 PolarHBondContact O-N 2.89Å; D196-K199 IonicContact OD1-NZ 3.64Å; D196-K199 PolarHBondContact OD1-NZ 3.12Å; K199-E202 PolarHBondContact O-N 3.09Å; K199-L203 VanDerWaalsContact O-CG 3.29Å; K199-L203 WeakPolarHBondContact O-CG 3.33Å; K199-L203 PolarHBondContact O-N 2.76Å |
| 200 | K | 85 | Confident | 80.7 | Confident | 155 Ų | 155 | 102.4 Ų | 102.4 | 67% | 0.674 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.5 | -40.4 | 176.5 | -75.6 | 176 | -176.9 | -178.8 | 0 | 111.9 | D196 A197 D198 L203 A204 | D196-K200 VanDerWaalsContact O-CG 3.31Å; D196-K200 WeakPolarHBondContact O-CG 3.43Å; D196-K200 PolarHBondContact O-N 2.89Å; A197-K200 PolarHBondContact O-N 3.29Å; D198-K200 VanDerWaalsContact C-N 3.31Å; D198-K200 PolarHBondContact O-N 2.63Å; K200-L203 PolarHBondContact O-N 2.64Å; K200-A204 WeakPolarHBondContact O-CB 3.43Å; K200-A204 PolarHBondContact O-N 3.29Å |
| 201 | K | 87.5 | Confident | 81.3 | Confident | 127 Ų | 127 | 94 Ų | 94 | 55% | 0.552 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -62.6 | -45.3 | 174.8 | -71.2 | 172.1 | -174.4 | 168.7 | 0 | 111.4 | A197 D198 L203 A204 D205 | A197-K201 WeakPolarHBondContact O-CG 3.45Å; A197-K201 PolarHBondContact O-N 3.04Å; D198-K201 WeakPolarHBondContact O-CB 3.31Å; D198-K201 PolarHBondContact O-N 2.82Å; D198-K201 IonicContact OD1-NZ 3.02Å; K201-L203 VanDerWaalsContact C-N 3.33Å; K201-L203 PolarHBondContact O-N 2.86Å; K201-A204 WeakPolarHBondContact O-CB 3.39Å; K201-A204 PolarHBondContact O-N 2.96Å; K201-A204 VanDerWaalsContact O-N 3.16Å; K201-D205 WeakPolarHBondContact O-CB 3.24Å; K201-D205 PolarHBondContact O-N 3.18Å |
| 202 | E | 86.3 | Confident | 82.2 | Confident | 96 Ų | 96 | 92.3 Ų | 92.3 | 45% | 0.449 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -61.8 | -41.9 | 178.6 | -163.2 | -153.6 | 152.4 | 0 | 0 | 111.8 | D198 K199 D205 K206 | D198-E202 PolarHBondContact O-N 3.21Å; K199-E202 PolarHBondContact O-N 3.09Å; E202-D205 PolarHBondContact O-N 3.19Å; E202-K206 VanDerWaalsContact O-CB 3.3Å; E202-K206 WeakPolarHBondContact O-CB 3.26Å; E202-K206 PolarHBondContact O-N 2.92Å |
| 203 | L | 85.9 | Confident | 82.6 | Confident | 102 Ų | 102 | 100.6 Ų | 100.6 | 53% | 0.534 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.6 | -43.2 | 174.1 | -71.7 | 174.7 | 0 | 0 | 0 | 111.9 | K199 K200 K201 K206 Q207 | K199-L203 VanDerWaalsContact O-CG 3.29Å; K199-L203 WeakPolarHBondContact O-CG 3.33Å; K199-L203 PolarHBondContact O-N 2.76Å; K200-L203 PolarHBondContact O-N 2.64Å; K201-L203 VanDerWaalsContact C-N 3.33Å; K201-L203 PolarHBondContact O-N 2.86Å; L203-K206 PolarHBondContact O-N 3.36Å; L203-Q207 WeakPolarHBondContact O-CG 3.4Å; L203-Q207 PolarHBondContact O-N 3.35Å |
| 204 | A | 86.4 | Confident | 83.1 | Confident | 35 Ų | 35 | 93.8 Ų | 93.8 | 29% | 0.289 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -63.6 | -42.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | K200 K201 K206 Q207 R208 | K200-A204 WeakPolarHBondContact O-CB 3.43Å; K200-A204 PolarHBondContact O-N 3.29Å; K201-A204 WeakPolarHBondContact O-CB 3.39Å; K201-A204 PolarHBondContact O-N 2.96Å; K201-A204 VanDerWaalsContact O-N 3.16Å; A204-K206 VanDerWaalsContact C-N 3.34Å; A204-K206 PolarHBondContact O-N 2.64Å; A204-Q207 WeakPolarHBondContact O-CB 3.45Å; A204-Q207 PolarHBondContact O-N 3.09Å; A204-R208 WeakPolarHBondContact O-CG 3.35Å; A204-R208 PolarHBondContact O-N 2.91Å |
| 205 | D | 85.9 | Confident | 83.7 | Confident | 64 Ų | 64 | 93.8 Ų | 93.8 | 34% | 0.342 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -68.5 | -34.8 | 177.6 | -72.4 | -20.7 | 0 | 0 | 0 | 112.1 | K201 E202 R208 R209 | K201-D205 WeakPolarHBondContact O-CB 3.24Å; K201-D205 PolarHBondContact O-N 3.18Å; E202-D205 PolarHBondContact O-N 3.19Å; D205-R208 PolarHBondContact O-N 3.39Å; D205-R208 IonicContact OD1-CZ 2.95Å; D205-R208 IonicContact OD1-NH1 3.24Å; D205-R208 PolarHBondContact OD1-NH1 2.91Å; D205-R209 WeakPolarHBondContact O-CB 3.46Å; D205-R209 VanDerWaalsContact O-CG 3.23Å; D205-R209 WeakPolarHBondContact O-CG 3.35Å; D205-R209 PolarHBondContact O-N 3.17Å |
| 206 | K | 86.6 | Confident | 83.9 | Confident | 142 Ų | 142 | 92 Ų | 92 | 62% | 0.617 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -64.3 | -41 | 171.4 | -172.8 | 175.4 | -177.4 | 173.5 | 0 | 111.6 | E202 L203 A204 R209 A210 | E202-K206 VanDerWaalsContact O-CB 3.3Å; E202-K206 WeakPolarHBondContact O-CB 3.26Å; E202-K206 PolarHBondContact O-N 2.92Å; L203-K206 PolarHBondContact O-N 3.36Å; A204-K206 VanDerWaalsContact C-N 3.34Å; A204-K206 PolarHBondContact O-N 2.64Å; K206-R209 PolarHBondContact O-N 3.3Å; K206-A210 WeakPolarHBondContact O-CB 3.41Å; K206-A210 PolarHBondContact O-N 2.83Å |
| 207 | Q | 84.3 | Confident | 84.2 | Confident | 123 Ų | 123 | 88 Ų | 88 | 58% | 0.575 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -64.7 | -44.2 | 174.3 | -73.2 | 174.2 | -0.6 | 0 | 0 | 111.5 | L203 A204 R209 A210 A211 A292 | L203-Q207 WeakPolarHBondContact O-CG 3.4Å; L203-Q207 PolarHBondContact O-N 3.35Å; A204-Q207 WeakPolarHBondContact O-CB 3.45Å; A204-Q207 PolarHBondContact O-N 3.09Å; Q207-R209 PolarHBondContact O-N 3.24Å; Q207-A210 PolarHBondContact O-N 2.79Å; Q207-A211 WeakPolarHBondContact O-CB 3.31Å; Q207-A211 PolarHBondContact O-N 3.35Å; Q207-A292 HydrophobicContact CB-CB 4.08Å |
| 208 | R | 85.2 | Confident | 84.1 | Confident | 127 Ų | 127 | 88 Ų | 88 | 48% | 0.479 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -59.5 | -46.6 | 174 | -72.3 | 169.4 | 177.9 | 166.6 | -6.5 | 112.2 | A204 D205 A210 A211 L212 A292 | A204-R208 WeakPolarHBondContact O-CG 3.35Å; A204-R208 PolarHBondContact O-N 2.91Å; D205-R208 PolarHBondContact O-N 3.39Å; D205-R208 IonicContact OD1-CZ 2.95Å; D205-R208 IonicContact OD1-NH1 3.24Å; D205-R208 PolarHBondContact OD1-NH1 2.91Å; R208-A210 VanDerWaalsContact C-N 3.3Å; R208-A210 PolarHBondContact O-N 2.76Å; R208-A211 PolarHBondContact O-N 3.33Å; R208-L212 WeakPolarHBondContact O-CG 3.15Å; R208-L212 PolarHBondContact O-N 3.21Å; R208-A292 HydrophobicContact CG-CB 4.44Å |
| 209 | R | 86.1 | Confident | 84.2 | Confident | 178 Ų | 178 | 90.6 Ų | 90.6 | 67% | 0.672 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -62.6 | -36.6 | 176.1 | -73 | 173 | -175.6 | 178.5 | 3.6 | 112 | D205 K206 Q207 R213 | D205-R209 WeakPolarHBondContact O-CB 3.46Å; D205-R209 VanDerWaalsContact O-CG 3.23Å; D205-R209 WeakPolarHBondContact O-CG 3.35Å; D205-R209 PolarHBondContact O-N 3.17Å; K206-R209 PolarHBondContact O-N 3.3Å; Q207-R209 PolarHBondContact O-N 3.24Å; R209-R213 WeakPolarHBondContact O-CB 3.36Å; R209-R213 VanDerWaalsContact O-CG 3.26Å; R209-R213 WeakPolarHBondContact O-CG 3.23Å; R209-R213 PolarHBondContact O-N 3.19Å |
| 210 | A | 83.7 | Confident | 84.4 | Confident | 59 Ų | 59 | 89.9 Ų | 89.9 | 49% | 0.488 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -68.8 | -42.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | K206 Q207 R208 R213 S214 | K206-A210 WeakPolarHBondContact O-CB 3.41Å; K206-A210 PolarHBondContact O-N 2.83Å; Q207-A210 PolarHBondContact O-N 2.79Å; R208-A210 VanDerWaalsContact C-N 3.3Å; R208-A210 PolarHBondContact O-N 2.76Å; A210-R213 CarbonylContact O-C 3.42Å; A210-R213 WeakPolarHBondContact O-CA 3.48Å; A210-R213 WeakPolarHBondContact O-CB 3.39Å; A210-R213 PolarHBondContact O-N 2.87Å; A210-R213 VanDerWaalsContact O-N 3.08Å; A210-S214 PolarHBondContact O-N 3.02Å; A210-S214 VanDerWaalsContact O-N 3.15Å |
| 211 | A | 84.3 | Confident | 84.5 | Confident | 2 Ų | 2 | 91.9 Ų | 91.9 | 2% | 0.017 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -61.5 | -44.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q207 R208 R213 S214 I217 A292 | Q207-A211 WeakPolarHBondContact O-CB 3.31Å; Q207-A211 PolarHBondContact O-N 3.35Å; R208-A211 PolarHBondContact O-N 3.33Å; A211-R213 PolarHBondContact O-N 3.46Å; A211-S214 WeakPolarHBondContact O-CB 3.38Å; A211-S214 PolarHBondContact O-N 2.95Å; A211-S214 PolarHBondContact O-OG 3.36Å; A211-I217 WeakPolarHBondContact O-CD1 3.48Å; A211-A292 HydrophobicContact CB-CB 4.44Å |
| 212 | L | 83.6 | Confident | 84.4 | Confident | 91 Ų | 91 | 89.4 Ų | 89.4 | 48% | 0.476 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63.2 | -23 | 173.8 | -70.3 | 174.3 | 0 | 0 | 0 | 113.8 | R208 S214 I217 L293 | R208-L212 WeakPolarHBondContact O-CG 3.15Å; R208-L212 PolarHBondContact O-N 3.21Å; L212-S214 VanDerWaalsContact C-N 3.35Å; L212-I217 HydrophobicContact CD2-CG2 4.19Å; L212-L293 HydrophobicContact CD2-CD1 3.75Å; L212-L293 HydrophobicContact CD2-CD2 3.8Å; L212-L293 HydrophobicContact CD2-CG 4.47Å; L212-L293 HydrophobicContact CG-CD1 4.04Å |
| 213 | R | 79.9 | Confident | 84.5 | Confident | 207 Ų | 207 | 90.9 Ų | 90.9 | 78% | 0.781 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | 4.1 | 174.8 | -74.4 | 177.1 | 168.9 | -176.5 | -2.6 | 113 | R209 A210 A211 | R209-R213 WeakPolarHBondContact O-CB 3.36Å; R209-R213 VanDerWaalsContact O-CG 3.26Å; R209-R213 WeakPolarHBondContact O-CG 3.23Å; R209-R213 PolarHBondContact O-N 3.19Å; A210-R213 CarbonylContact O-C 3.42Å; A210-R213 WeakPolarHBondContact O-CA 3.48Å; A210-R213 WeakPolarHBondContact O-CB 3.39Å; A210-R213 PolarHBondContact O-N 2.87Å; A210-R213 VanDerWaalsContact O-N 3.08Å; A211-R213 PolarHBondContact O-N 3.46Å |
| 214 | S | 82.3 | Confident | 84.7 | Confident | 5 Ų | 5 | 95.5 Ų | 95.5 | 4% | 0.035 | 44% | 0.44 | C | S | . | . | S | Bend | trans | -61.1 | 149.6 | 171.5 | 66 | 0 | 0 | 0 | 0 | 110.9 | A210 A211 L212 V216 I217 Q218 S288 | A210-S214 PolarHBondContact O-N 3.02Å; A210-S214 VanDerWaalsContact O-N 3.15Å; A211-S214 WeakPolarHBondContact O-CB 3.38Å; A211-S214 PolarHBondContact O-N 2.95Å; A211-S214 PolarHBondContact O-OG 3.36Å; L212-S214 VanDerWaalsContact C-N 3.35Å; S214-V216 VanDerWaalsContact C-N 3.31Å; S214-V216 PolarHBondContact O-N 2.84Å; S214-I217 PolarHBondContact O-N 3.49Å; S214-I217 VanDerWaalsContact OG-CB 3.3Å; S214-I217 WeakPolarHBondContact OG-CB 3.49Å; S214-I217 WeakPolarHBondContact OG-CD1 3.49Å; S214-I217 WeakPolarHBondContact OG-CG1 3.38Å; S214-I217 PolarHBondContact OG-N 3.42Å; S214-Q218 WeakPolarHBondContact O-CB 3.46Å; S214-Q218 PolarHBondContact O-N 3.36Å; S214-S288 WeakPolarHBondContact CB-OG 3.3Å |
| 215 | S | 78.6 | Confident | 84.8 | Confident | 60 Ų | 60 | 96 Ų | 96 | 42% | 0.42 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -57.4 | -45.7 | 177.3 | 45.3 | 0 | 0 | 0 | 0 | 111.4 | Q218 E219 | S215-Q218 PolarHBondContact O-N 2.82Å; S215-E219 WeakPolarHBondContact O-CB 3.29Å; S215-E219 PolarHBondContact O-N 3.16Å |
| 216 | V | 82.6 | Confident | 85 | Confident | 42 Ų | 42 | 101.3 Ų | 101.3 | 26% | 0.255 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -59.5 | -49.7 | -179.4 | -179.9 | 0 | 0 | 0 | 0 | 111.7 | S214 Q218 E219 L220 F287 I290 | S214-V216 VanDerWaalsContact C-N 3.31Å; S214-V216 PolarHBondContact O-N 2.84Å; V216-Q218 VanDerWaalsContact C-N 3.35Å; V216-E219 PolarHBondContact O-N 3.41Å; V216-L220 HydrophobicContact CG1-CD1 4.3Å; V216-L220 WeakPolarHBondContact O-CG 3.31Å; V216-L220 PolarHBondContact O-N 3.03Å; V216-F287 HydrophobicContact CG2-CD1 3.87Å; V216-F287 HydrophobicContact CG2-CE1 4.37Å; V216-I290 HydrophobicContact CB-CD1 4.31Å; V216-I290 HydrophobicContact CG1-CD1 4.22Å |
| 217 | I | 84.6 | Confident | 85.1 | Confident | 26 Ų | 26 | 97.6 Ų | 97.6 | 13% | 0.133 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -70.1 | -35.2 | -179.2 | -68.2 | 167 | 0 | 0 | 0 | 111.1 | A211 L212 S214 R221 I290 L293 | A211-I217 WeakPolarHBondContact O-CD1 3.48Å; L212-I217 HydrophobicContact CD2-CG2 4.19Å; S214-I217 PolarHBondContact O-N 3.49Å; S214-I217 VanDerWaalsContact OG-CB 3.3Å; S214-I217 WeakPolarHBondContact OG-CB 3.49Å; S214-I217 WeakPolarHBondContact OG-CD1 3.49Å; S214-I217 WeakPolarHBondContact OG-CG1 3.38Å; S214-I217 PolarHBondContact OG-N 3.42Å; I217-R221 VanDerWaalsContact O-CB 3.31Å; I217-R221 WeakPolarHBondContact O-CB 3.26Å; I217-R221 PolarHBondContact O-N 3.45Å; I217-I290 HydrophobicContact CD1-CB 4.4Å; I217-I290 HydrophobicContact CD1-CD1 4.24Å; I217-I290 HydrophobicContact CD1-CG1 4.09Å; I217-I290 HydrophobicContact CD1-CG2 3.56Å; I217-I290 HydrophobicContact CG1-CD1 4.25Å; I217-I290 HydrophobicContact CG1-CG2 4.44Å; I217-L293 HydrophobicContact CD1-CD2 3.69Å |
| 218 | Q | 82 | Confident | 85.2 | Confident | 54 Ų | 54 | 98 Ų | 98 | 25% | 0.252 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -67.4 | -39.5 | 177.9 | -162.5 | -168.1 | -58.7 | 0 | 0 | 111.8 | S214 S215 V216 R221 Q222 | S214-Q218 WeakPolarHBondContact O-CB 3.46Å; S214-Q218 PolarHBondContact O-N 3.36Å; S215-Q218 PolarHBondContact O-N 2.82Å; V216-Q218 VanDerWaalsContact C-N 3.35Å; Q218-R221 PolarHBondContact O-N 3.43Å; Q218-Q222 VanDerWaalsContact O-CG 3.31Å; Q218-Q222 WeakPolarHBondContact O-CG 3.33Å; Q218-Q222 PolarHBondContact O-N 2.97Å |
| 219 | E | 84.4 | Confident | 84.8 | Confident | 111 Ų | 111 | 96.7 Ų | 96.7 | 52% | 0.519 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -67.2 | -44.8 | 176.4 | -173.4 | 177 | 177.8 | 0 | 0 | 111.4 | S215 V216 R221 Q222 Q223 | S215-E219 WeakPolarHBondContact O-CB 3.29Å; S215-E219 PolarHBondContact O-N 3.16Å; V216-E219 PolarHBondContact O-N 3.41Å; E219-R221 VanDerWaalsContact C-N 3.29Å; E219-R221 PolarHBondContact O-N 3.02Å; E219-Q222 WeakPolarHBondContact O-CB 3.03Å; E219-Q222 PolarHBondContact O-N 3.33Å; E219-Q222 VanDerWaalsContact O-N 3.12Å; E219-Q223 WeakPolarHBondContact O-CG 3.36Å; E219-Q223 PolarHBondContact O-N 3.09Å |
| 220 | L | 86.8 | Confident | 84.5 | Confident | 82 Ų | 82 | 95.1 Ų | 95.1 | 43% | 0.429 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -56.8 | -45.5 | 171.5 | -72.2 | 172.5 | 0 | 0 | 0 | 111 | V216 Q222 Q223 Y224 | V216-L220 HydrophobicContact CG1-CD1 4.3Å; V216-L220 WeakPolarHBondContact O-CG 3.31Å; V216-L220 PolarHBondContact O-N 3.03Å; L220-Q222 VanDerWaalsContact C-N 3.28Å; L220-Q222 PolarHBondContact O-N 3.25Å; L220-Q223 PolarHBondContact O-N 3.06Å; L220-Y224 VanDerWaalsContact O-CD2 3.26Å; L220-Y224 WeakPolarHBondContact O-CD2 3.39Å; L220-Y224 PolarHBondContact O-N 3.03Å |
| 221 | R | 87.5 | Confident | 84.1 | Confident | 196 Ų | 196 | 98.7 Ų | 98.7 | 74% | 0.74 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -59.9 | -38.5 | 177.2 | -178.8 | 178.7 | 176.1 | -173.8 | -0.8 | 112.4 | I217 Q218 E219 S225 | I217-R221 VanDerWaalsContact O-CB 3.31Å; I217-R221 WeakPolarHBondContact O-CB 3.26Å; I217-R221 PolarHBondContact O-N 3.45Å; Q218-R221 PolarHBondContact O-N 3.43Å; E219-R221 VanDerWaalsContact C-N 3.29Å; E219-R221 PolarHBondContact O-N 3.02Å; R221-S225 VanDerWaalsContact O-CB 3.26Å; R221-S225 WeakPolarHBondContact O-CB 3.47Å; R221-S225 PolarHBondContact O-N 3.03Å; R221-S225 PolarHBondContact O-OG 2.79Å |
| 222 | Q | 85.9 | Confident | 83.5 | Confident | 75 Ų | 75 | 103.3 Ų | 103.3 | 35% | 0.35 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67 | -42.4 | 177.9 | -76.1 | 168 | -20.6 | 0 | 0 | 111.6 | Q218 E219 L220 Y224 S225 | Q218-Q222 VanDerWaalsContact O-CG 3.31Å; Q218-Q222 WeakPolarHBondContact O-CG 3.33Å; Q218-Q222 PolarHBondContact O-N 2.97Å; E219-Q222 WeakPolarHBondContact O-CB 3.03Å; E219-Q222 PolarHBondContact O-N 3.33Å; E219-Q222 VanDerWaalsContact O-N 3.12Å; L220-Q222 VanDerWaalsContact C-N 3.28Å; L220-Q222 PolarHBondContact O-N 3.25Å; Q222-Y224 VanDerWaalsContact C-N 3.32Å; Q222-Y224 PolarHBondContact O-N 3.21Å; Q222-S225 WeakPolarHBondContact CA-OG 3.39Å; Q222-S225 PolarHBondContact O-N 3.35Å; Q222-S225 PolarHBondContact O-OG 3.37Å |
| 223 | Q | 88.9 | Confident | 83.1 | Confident | 128 Ų | 128 | 108.2 Ų | 108.2 | 60% | 0.598 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62.7 | -35.9 | 179 | -69.9 | 174.8 | 9.1 | 0 | 0 | 113.4 | E219 L220 | E219-Q223 WeakPolarHBondContact O-CG 3.36Å; E219-Q223 PolarHBondContact O-N 3.09Å; L220-Q223 PolarHBondContact O-N 3.06Å |
| 224 | Y | 89.6 | Confident | 82.2 | Confident | 198 Ų | 198 | 105.8 Ų | 105.8 | 78% | 0.776 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93 | 1.6 | 178.7 | -71.2 | -78.3 | 0 | 0 | 0 | 113.7 | L220 Q222 | L220-Y224 VanDerWaalsContact O-CD2 3.26Å; L220-Y224 WeakPolarHBondContact O-CD2 3.39Å; L220-Y224 PolarHBondContact O-N 3.03Å; Q222-Y224 VanDerWaalsContact C-N 3.32Å; Q222-Y224 PolarHBondContact O-N 3.21Å |
| 225 | S | 88.2 | Confident | 81.2 | Confident | 47 Ų | 47 | 113 Ų | 113 | 33% | 0.329 | 55% | 0.55 | S | S | . | . | trans | -99.6 | 128.7 | 177.8 | 67.9 | 0 | 0 | 0 | 0 | 111.4 | R221 Q222 A227 | R221-S225 VanDerWaalsContact O-CB 3.26Å; R221-S225 WeakPolarHBondContact O-CB 3.47Å; R221-S225 PolarHBondContact O-N 3.03Å; R221-S225 PolarHBondContact O-OG 2.79Å; Q222-S225 WeakPolarHBondContact CA-OG 3.39Å; Q222-S225 PolarHBondContact O-N 3.35Å; Q222-S225 PolarHBondContact O-OG 3.37Å; S225-A227 PolarHBondContact O-N 2.86Å | ||
| 226 | D | 91.1 | Very high | 80.4 | Confident | 175 Ų | 175 | 113.4 Ų | 113.4 | 94% | 0.936 | 55% | 0.547 | S | S | * | . | trans | -78 | 9.5 | 171.6 | -62.4 | -25.9 | 0 | 0 | 0 | 113 | ||||
| 227 | A | 88.7 | Confident | 79.3 | Confident | 63 Ų | 63 | 120 Ų | 120 | 52% | 0.521 | 57% | 0.572 | S | S | . | * | S | Bend | trans | -75.6 | 135.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | S225 E229 | S225-A227 PolarHBondContact O-N 2.86Å; A227-E229 PolarHBondContact O-N 3.19Å |
| 228 | P | 85.2 | Confident | 78.2 | Confident | 132 Ų | 132 | 121.8 Ų | 121.8 | 86% | 0.857 | 58% | 0.58 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 135.7 | 179.9 | 26.2 | -33.9 | 0 | 0 | 0 | 111.3 | ||
| 229 | E | 77.9 | Confident | 77.4 | Confident | 99 Ų | 99 | 121.9 Ų | 121.9 | 46% | 0.463 | 59% | 0.585 | S | S | . | * | P | Polyproline II helix | trans | -85 | 137.3 | 174.5 | -64 | -162.8 | 149.4 | 0 | 0 | 111.6 | A227 I231 R235 | A227-E229 PolarHBondContact O-N 3.19Å; E229-I231 PolarHBondContact O-N 3.46Å; E229-I231 VanDerWaalsContact O-N 3.11Å; E229-R235 IonicContact OE2-NH2 3.37Å; E229-R235 PolarHBondContact OE2-NH2 3.29Å; E229-R235 VanDerWaalsContact OE2-NH2 3.08Å |
| 230 | E | 78.4 | Confident | 76.8 | Confident | 145 Ų | 145 | 119.8 Ų | 119.8 | 68% | 0.678 | 58% | 0.577 | S | S | * | * | trans | -75.8 | 97.6 | 170.1 | -168.4 | -169.2 | 153.9 | 0 | 0 | 109.2 | R232 | E230-R232 HydrophobicContact CG-CG 4.5Å; E230-R232 IonicContact OE1-CZ 2.79Å; E230-R232 VanDerWaalsContact OE1-CZ 3.25Å; E230-R232 IonicContact OE1-NE 3.95Å; E230-R232 PolarHBondContact OE1-NE 3.11Å; E230-R232 IonicContact OE1-NH2 2.64Å; E230-R232 PolarHBondContact OE1-NH2 3Å; E230-R232 IonicContact OE2-NH2 3.19Å; E230-R232 PolarHBondContact OE2-NH2 3.46Å | ||
| 231 | I | 75.9 | Confident | 76.2 | Confident | 134 Ų | 134 | 124.2 Ų | 124.2 | 69% | 0.687 | 59% | 0.588 | S | S | * | * | trans | -81.2 | 120.3 | 175.6 | -56.9 | 173.3 | 0 | 0 | 0 | 108.5 | E229 | E229-I231 PolarHBondContact O-N 3.46Å; E229-I231 VanDerWaalsContact O-N 3.11Å | ||
| 232 | R | 71.2 | Confident | 75.7 | Confident | 100 Ų | 100 | 116.8 Ų | 116.8 | 38% | 0.377 | 56% | 0.561 | S | S | . | * | trans | -107.6 | 151.3 | 173.3 | -62.3 | -179.2 | 178.9 | 161.9 | 3.2 | 110 | E230 H234 S243 | E230-R232 HydrophobicContact CG-CG 4.5Å; E230-R232 IonicContact OE1-CZ 2.79Å; E230-R232 VanDerWaalsContact OE1-CZ 3.25Å; E230-R232 IonicContact OE1-NE 3.95Å; E230-R232 PolarHBondContact OE1-NE 3.11Å; E230-R232 IonicContact OE1-NH2 2.64Å; E230-R232 PolarHBondContact OE1-NH2 3Å; E230-R232 IonicContact OE2-NH2 3.19Å; E230-R232 PolarHBondContact OE2-NH2 3.46Å; R232-H234 PolarHBondContact O-N 2.65Å; R232-H234 VanDerWaalsContact O-N 3.13Å; R232-S243 PolarHBondContact NH1-OG 2.87Å | ||
| 233 | E | 75.3 | Confident | 75.5 | Confident | 193 Ų | 193 | 114.6 Ų | 114.6 | 90% | 0.902 | 56% | 0.555 | S | S | * | * | S | Bend | trans | -60.9 | -22.3 | -176.5 | -67.4 | -178.2 | 160.2 | 0 | 0 | 114.3 | ||
| 234 | H | 62 | Low | 75.2 | Confident | 156 Ų | 156 | 115.4 Ų | 115.4 | 72% | 0.722 | 55% | 0.552 | S | S | * | * | trans | -122.1 | 99.2 | 176.1 | -70.7 | -57.7 | 0 | 0 | 0 | 111.2 | R232 D236 | R232-H234 PolarHBondContact O-N 2.65Å; R232-H234 VanDerWaalsContact O-N 3.13Å; H234-D236 PolarHBondContact O-N 3.45Å | ||
| 235 | R | 59.5 | Low | 74.9 | Confident | 158 Ų | 158 | 110.8 Ų | 110.8 | 60% | 0.596 | 54% | 0.538 | S | S | * | . | trans | -86.6 | 91.8 | 172 | -86.2 | -176.4 | 165.1 | -172.9 | -6 | 110.5 | E229 | E229-R235 IonicContact OE2-NH2 3.37Å; E229-R235 PolarHBondContact OE2-NH2 3.29Å; E229-R235 VanDerWaalsContact OE2-NH2 3.08Å | ||
| 236 | D | 63.3 | Low | 74.8 | Confident | 67 Ų | 67 | 113.3 Ų | 113.3 | 36% | 0.358 | 54% | 0.544 | S | S | . | . | trans | -112.2 | 111.9 | 163.5 | -86.7 | -44.9 | 0 | 0 | 0 | 108.5 | H234 Q238 T239 D240 Q280 | H234-D236 PolarHBondContact O-N 3.45Å; D236-Q238 PolarHBondContact O-N 3.28Å; D236-T239 HydrophobicContact CB-CG2 3.38Å; D236-T239 WeakPolarHBondContact CB-OG1 3.45Å; D236-T239 WeakPolarHBondContact O-CA 3.26Å; D236-T239 WeakPolarHBondContact O-CB 3.5Å; D236-T239 PolarHBondContact O-N 3.47Å; D236-T239 PolarHBondContact O-OG1 2.86Å; D236-D240 PolarHBondContact O-N 3.08Å; D236-Q280 PolarHBondContact OD1-NE2 3.5Å; D236-Q280 VanDerWaalsContact OD1-NE2 3.13Å | ||
| 237 | F | 59 | Low | 74.7 | Confident | 181 Ų | 181 | 109.1 Ų | 109.1 | 79% | 0.794 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -53.5 | -28.4 | 179.9 | -70.6 | -82.1 | 0 | 0 | 0 | 114.2 | ||
| 238 | Q | 60.7 | Low | 74.7 | Confident | 64 Ų | 64 | 112.7 Ų | 112.7 | 30% | 0.299 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -74.6 | -31.2 | 174.2 | -164.8 | 112.7 | 21.8 | 0 | 0 | 112.5 | D236 D240 Q242 G279 | D236-Q238 PolarHBondContact O-N 3.28Å; Q238-D240 VanDerWaalsContact C-N 3.34Å; Q238-Q242 WeakPolarHBondContact O-CG 3.43Å; Q238-Q242 PolarHBondContact O-N 3.21Å; Q238-G279 VanDerWaalsContact OE1-CA 3.25Å; Q238-G279 PolarHBondContact OE1-O 3.49Å |
| 239 | T | 65.3 | Low | 75 | Confident | 56 Ų | 56 | 109.9 Ų | 109.9 | 34% | 0.344 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -72.4 | -29.1 | 177 | 69 | 0 | 0 | 0 | 0 | 111.5 | D236 R241 Q242 S243 | D236-T239 HydrophobicContact CB-CG2 3.38Å; D236-T239 WeakPolarHBondContact CB-OG1 3.45Å; D236-T239 WeakPolarHBondContact O-CA 3.26Å; D236-T239 WeakPolarHBondContact O-CB 3.5Å; D236-T239 PolarHBondContact O-N 3.47Å; D236-T239 PolarHBondContact O-OG1 2.86Å; T239-R241 PolarHBondContact O-N 3.44Å; T239-Q242 CarbonylContact O-C 3.54Å; T239-Q242 PolarHBondContact O-N 3.19Å; T239-S243 WeakPolarHBondContact O-CA 3.34Å; T239-S243 WeakPolarHBondContact O-CB 3.47Å; T239-S243 PolarHBondContact O-N 3.2Å |
| 240 | D | 72.4 | Confident | 75.6 | Confident | 67 Ų | 67 | 110.9 Ų | 110.9 | 36% | 0.358 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.9 | -46.4 | 178.8 | -77.8 | -19.2 | 0 | 0 | 0 | 112.7 | D236 Q238 Q242 S243 R244 | D236-D240 PolarHBondContact O-N 3.08Å; Q238-D240 VanDerWaalsContact C-N 3.34Å; D240-Q242 PolarHBondContact O-N 3.42Å; D240-S243 PolarHBondContact O-N 2.92Å; D240-R244 WeakPolarHBondContact O-CB 3.45Å; D240-R244 WeakPolarHBondContact O-CG 3.45Å; D240-R244 PolarHBondContact O-N 2.9Å |
| 241 | R | 74.4 | Confident | 76.4 | Confident | 175 Ų | 175 | 107.9 Ų | 107.9 | 66% | 0.66 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.5 | -45.6 | 175.6 | -179.4 | 176.6 | 172.6 | 166.5 | 3.1 | 111.2 | T239 S243 R244 E245 | T239-R241 PolarHBondContact O-N 3.44Å; R241-S243 VanDerWaalsContact C-N 3.29Å; R241-S243 PolarHBondContact O-N 3.49Å; R241-R244 PolarHBondContact O-N 3.27Å; R241-E245 IonicContact NE-OE1 3.08Å; R241-E245 PolarHBondContact NE-OE1 2.94Å; R241-E245 WeakPolarHBondContact O-CG 3.34Å; R241-E245 PolarHBondContact O-N 3.24Å |
| 242 | Q | 77.2 | Confident | 77.3 | Confident | 39 Ų | 39 | 105.7 Ų | 105.7 | 18% | 0.182 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -66.6 | -32.6 | 178.4 | -66.8 | -178.8 | 29.6 | 0 | 0 | 112.1 | Q238 T239 D240 Q246 | Q238-Q242 WeakPolarHBondContact O-CG 3.43Å; Q238-Q242 PolarHBondContact O-N 3.21Å; T239-Q242 CarbonylContact O-C 3.54Å; T239-Q242 PolarHBondContact O-N 3.19Å; D240-Q242 PolarHBondContact O-N 3.42Å; Q242-Q246 WeakPolarHBondContact O-CB 3.33Å; Q242-Q246 WeakPolarHBondContact O-CG 3.31Å; Q242-Q246 PolarHBondContact O-N 3.23Å; Q242-Q246 PolarHBondContact O-NE2 3.13Å |
| 243 | S | 80.8 | Confident | 78.4 | Confident | 30 Ų | 30 | 102.8 Ų | 102.8 | 21% | 0.21 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -70.9 | -44.5 | 178.1 | 174.1 | 0 | 0 | 0 | 0 | 110.1 | R232 T239 D240 R241 E245 Q246 L247 | R232-S243 PolarHBondContact NH1-OG 2.87Å; T239-S243 WeakPolarHBondContact O-CA 3.34Å; T239-S243 WeakPolarHBondContact O-CB 3.47Å; T239-S243 PolarHBondContact O-N 3.2Å; D240-S243 PolarHBondContact O-N 2.92Å; R241-S243 VanDerWaalsContact C-N 3.29Å; R241-S243 PolarHBondContact O-N 3.49Å; S243-E245 VanDerWaalsContact C-N 3.34Å; S243-E245 PolarHBondContact O-N 3.48Å; S243-Q246 CarbonylContact O-C 3.58Å; S243-Q246 WeakPolarHBondContact O-CB 3.44Å; S243-Q246 PolarHBondContact O-N 2.86Å; S243-L247 VanDerWaalsContact O-CB 3.31Å; S243-L247 WeakPolarHBondContact O-CB 3.47Å; S243-L247 PolarHBondContact O-N 3.31Å |
| 244 | R | 83 | Confident | 79.3 | Confident | 145 Ų | 145 | 100 Ų | 100 | 55% | 0.547 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -58.7 | -44.9 | 171.8 | -73.1 | 176.7 | 178.2 | -178.8 | 1.2 | 111.6 | D240 R241 Q246 L247 H248 | D240-R244 WeakPolarHBondContact O-CB 3.45Å; D240-R244 WeakPolarHBondContact O-CG 3.45Å; D240-R244 PolarHBondContact O-N 2.9Å; R241-R244 PolarHBondContact O-N 3.27Å; R244-Q246 VanDerWaalsContact C-N 3.35Å; R244-L247 PolarHBondContact O-N 3.43Å; R244-H248 WeakPolarHBondContact O-CB 3.31Å; R244-H248 PolarHBondContact O-N 3.47Å |
| 245 | E | 84.4 | Confident | 81 | Confident | 101 Ų | 101 | 97 Ų | 97 | 47% | 0.472 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -63.8 | -38.9 | 175.6 | -73 | 173.3 | -166.4 | 0 | 0 | 112.1 | R241 S243 R249 | R241-E245 IonicContact NE-OE1 3.08Å; R241-E245 PolarHBondContact NE-OE1 2.94Å; R241-E245 WeakPolarHBondContact O-CG 3.34Å; R241-E245 PolarHBondContact O-N 3.24Å; S243-E245 VanDerWaalsContact C-N 3.34Å; S243-E245 PolarHBondContact O-N 3.48Å; E245-R249 WeakPolarHBondContact O-CB 3.34Å; E245-R249 PolarHBondContact O-N 2.92Å |
| 246 | Q | 84.6 | Confident | 82.6 | Confident | 100 Ų | 100 | 94.8 Ų | 94.8 | 47% | 0.467 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -67 | -41.4 | 174.4 | -76.3 | 171.7 | 47.3 | 0 | 0 | 112.3 | Q242 S243 R244 R249 K250 | Q242-Q246 WeakPolarHBondContact O-CB 3.33Å; Q242-Q246 WeakPolarHBondContact O-CG 3.31Å; Q242-Q246 PolarHBondContact O-N 3.23Å; Q242-Q246 PolarHBondContact O-NE2 3.13Å; S243-Q246 CarbonylContact O-C 3.58Å; S243-Q246 WeakPolarHBondContact O-CB 3.44Å; S243-Q246 PolarHBondContact O-N 2.86Å; R244-Q246 VanDerWaalsContact C-N 3.35Å; Q246-R249 WeakPolarHBondContact O-CB 3.5Å; Q246-R249 PolarHBondContact O-N 2.89Å; Q246-K250 WeakPolarHBondContact O-CG 3.39Å; Q246-K250 PolarHBondContact O-N 3.47Å |
| 247 | L | 89.9 | Confident | 84 | Confident | 86 Ų | 86 | 99.8 Ų | 99.8 | 45% | 0.45 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -66.7 | -45.5 | 178.4 | -170.9 | 144 | 0 | 0 | 0 | 110.4 | S243 R244 R249 K250 N251 | S243-L247 VanDerWaalsContact O-CB 3.31Å; S243-L247 WeakPolarHBondContact O-CB 3.47Å; S243-L247 PolarHBondContact O-N 3.31Å; R244-L247 PolarHBondContact O-N 3.43Å; L247-R249 PolarHBondContact O-N 3.08Å; L247-K250 PolarHBondContact O-N 3.08Å; L247-K250 VanDerWaalsContact O-N 3.12Å; L247-N251 WeakPolarHBondContact CD2-ND2 3.37Å; L247-N251 PolarHBondContact O-N 3.27Å; L247-N251 PolarHBondContact O-OD1 3.18Å; L247-N251 VanDerWaalsContact O-OD1 3.06Å |
| 248 | H | 88.9 | Confident | 85.7 | Confident | 139 Ų | 139 | 95.3 Ų | 95.3 | 64% | 0.644 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -57 | -40.9 | 173.2 | -174.5 | -83.4 | 0 | 0 | 0 | 111.8 | R244 F252 | R244-H248 WeakPolarHBondContact O-CB 3.31Å; R244-H248 PolarHBondContact O-N 3.47Å; H248-F252 PolarHBondContact O-N 3.38Å; H248-F252 VanDerWaalsContact O-N 3.07Å |
| 249 | R | 89.9 | Confident | 87.1 | Confident | 72 Ų | 72 | 102.8 Ų | 102.8 | 27% | 0.272 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.8 | -45.5 | 175.3 | 179.4 | 174.4 | 167.1 | -168.5 | -8.2 | 112.2 | E245 Q246 L247 N251 F252 E253 L260 | E245-R249 WeakPolarHBondContact O-CB 3.34Å; E245-R249 PolarHBondContact O-N 2.92Å; Q246-R249 WeakPolarHBondContact O-CB 3.5Å; Q246-R249 PolarHBondContact O-N 2.89Å; L247-R249 PolarHBondContact O-N 3.08Å; R249-N251 PolarHBondContact O-N 3.21Å; R249-F252 PolarHBondContact O-N 3.21Å; R249-E253 HydrophobicContact CG-CG 4.32Å; R249-E253 IonicContact CZ-OE1 3.24Å; R249-E253 VanDerWaalsContact CZ-OE1 3.3Å; R249-E253 IonicContact NE-OE1 3.25Å; R249-E253 PolarHBondContact NE-OE1 3.34Å; R249-E253 IonicContact NH2-OE1 2.83Å; R249-E253 PolarHBondContact NH2-OE1 2.98Å; R249-E253 WeakPolarHBondContact O-CG 3.37Å; R249-E253 PolarHBondContact O-N 3Å; R249-L260 HydrophobicContact CG-CD1 4.19Å; R249-L260 PolarHBondContact NH2-O 3.08Å |
| 250 | K | 91.6 | Very high | 88.3 | Confident | 120 Ų | 120 | 103.9 Ų | 103.9 | 52% | 0.522 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -57.3 | -48.7 | 175.5 | -73.7 | 178.3 | 178.8 | -174.6 | 0 | 111.1 | Q246 L247 F252 E253 E254 | Q246-K250 WeakPolarHBondContact O-CG 3.39Å; Q246-K250 PolarHBondContact O-N 3.47Å; L247-K250 PolarHBondContact O-N 3.08Å; L247-K250 VanDerWaalsContact O-N 3.12Å; K250-F252 PolarHBondContact O-N 3Å; K250-E253 PolarHBondContact O-N 3.26Å; K250-E253 VanDerWaalsContact O-N 3.09Å; K250-E254 WeakPolarHBondContact O-CB 3.4Å; K250-E254 WeakPolarHBondContact O-CG 3.33Å; K250-E254 PolarHBondContact O-N 3.36Å |
| 251 | N | 94.8 | Very high | 89.1 | Confident | 82 Ų | 82 | 109.6 Ų | 109.6 | 44% | 0.439 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.1 | -35.9 | 178.6 | -64.1 | 6.9 | 0 | 0 | 0 | 112.5 | L247 R249 S255 | L247-N251 WeakPolarHBondContact CD2-ND2 3.37Å; L247-N251 PolarHBondContact O-N 3.27Å; L247-N251 PolarHBondContact O-OD1 3.18Å; L247-N251 VanDerWaalsContact O-OD1 3.06Å; R249-N251 PolarHBondContact O-N 3.21Å; N251-S255 VanDerWaalsContact O-CB 3.29Å; N251-S255 WeakPolarHBondContact O-CB 3.3Å; N251-S255 PolarHBondContact O-N 3.38Å; N251-S255 PolarHBondContact O-OG 2.91Å |
| 252 | F | 94.8 | Very high | 89.7 | Confident | 89 Ų | 89 | 103.8 Ų | 103.8 | 39% | 0.39 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -71.2 | -45.7 | 174.5 | -178.1 | -86.9 | 0 | 0 | 0 | 112 | H248 R249 K250 E254 S255 M256 L260 | H248-F252 PolarHBondContact O-N 3.38Å; H248-F252 VanDerWaalsContact O-N 3.07Å; R249-F252 PolarHBondContact O-N 3.21Å; K250-F252 PolarHBondContact O-N 3Å; F252-E254 VanDerWaalsContact C-N 3.26Å; F252-E254 PolarHBondContact O-N 2.9Å; F252-S255 WeakPolarHBondContact CA-OG 3.42Å; F252-S255 PolarHBondContact O-N 3.46Å; F252-S255 PolarHBondContact O-OG 3.38Å; F252-M256 HydrophobicContact CE1-CB 4.21Å; F252-M256 HydrophobicContact CE1-CG 4.45Å; F252-M256 HydrophobicContact CZ-CB 4.33Å; F252-M256 HydrophobicContact CZ-CG 4.36Å; F252-M256 VanDerWaalsContact O-CB 3.31Å; F252-M256 WeakPolarHBondContact O-CB 3.32Å; F252-M256 PolarHBondContact O-N 3.22Å; F252-L260 HydrophobicContact CD1-CD1 3.43Å; F252-L260 VanDerWaalsContact CD1-CD1 3.43Å; F252-L260 HydrophobicContact CD1-CG 4.43Å; F252-L260 HydrophobicContact CE1-CD1 3.86Å; F252-L260 HydrophobicContact CE1-CG 4.45Å; F252-L260 HydrophobicContact CG-CD1 4.37Å |
| 253 | E | 94.8 | Very high | 90.3 | Very high | 39 Ų | 39 | 105 Ų | 105 | 18% | 0.182 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -61.6 | -36.2 | 177.7 | -67.4 | -176.5 | 179.4 | 0 | 0 | 111.5 | R249 K250 M257 V258 L260 | R249-E253 HydrophobicContact CG-CG 4.32Å; R249-E253 IonicContact CZ-OE1 3.24Å; R249-E253 VanDerWaalsContact CZ-OE1 3.3Å; R249-E253 IonicContact NE-OE1 3.25Å; R249-E253 PolarHBondContact NE-OE1 3.34Å; R249-E253 IonicContact NH2-OE1 2.83Å; R249-E253 PolarHBondContact NH2-OE1 2.98Å; R249-E253 WeakPolarHBondContact O-CG 3.37Å; R249-E253 PolarHBondContact O-N 3Å; K250-E253 PolarHBondContact O-N 3.26Å; K250-E253 VanDerWaalsContact O-N 3.09Å; E253-M257 CarbonylContact O-C 3.57Å; E253-M257 WeakPolarHBondContact O-CA 3.06Å; E253-M257 PolarHBondContact O-N 2.63Å; E253-V258 WeakPolarHBondContact CA-O 2.86Å; E253-V258 WeakPolarHBondContact CG-O 3.08Å; E253-V258 PolarHBondContact O-N 3.13Å; E253-V258 VanDerWaalsContact O-N 3.17Å; E253-L260 HydrophobicContact CG-CD1 4.09Å; E253-L260 PolarHBondContact OE1-N 3.12Å; E253-L260 VanDerWaalsContact OE1-N 3.09Å |
| 254 | E | 94.5 | Very high | 90.7 | Very high | 134 Ų | 134 | 113.9 Ų | 113.9 | 63% | 0.626 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -72.5 | -45.7 | 176.3 | -72.6 | 169 | -167.6 | 0 | 0 | 112.3 | K250 F252 M257 | K250-E254 WeakPolarHBondContact O-CB 3.4Å; K250-E254 WeakPolarHBondContact O-CG 3.33Å; K250-E254 PolarHBondContact O-N 3.36Å; F252-E254 VanDerWaalsContact C-N 3.26Å; F252-E254 PolarHBondContact O-N 2.9Å; E254-M257 PolarHBondContact O-N 2.76Å |
| 255 | S | 96.8 | Very high | 90.8 | Very high | 93 Ų | 93 | 113.2 Ų | 113.2 | 65% | 0.65 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -69.7 | -34.6 | -179.4 | 58.7 | 0 | 0 | 0 | 0 | 113.2 | N251 F252 | N251-S255 VanDerWaalsContact O-CB 3.29Å; N251-S255 WeakPolarHBondContact O-CB 3.3Å; N251-S255 PolarHBondContact O-N 3.38Å; N251-S255 PolarHBondContact O-OG 2.91Å; F252-S255 WeakPolarHBondContact CA-OG 3.42Å; F252-S255 PolarHBondContact O-N 3.46Å; F252-S255 PolarHBondContact O-OG 3.38Å |
| 256 | M | 94.2 | Very high | 90.9 | Very high | 112 Ų | 112 | 113.4 Ų | 113.4 | 55% | 0.552 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -94.7 | -7.7 | 178 | -164.3 | 58.2 | 61.5 | 0 | 0 | 112.8 | F252 V258 | F252-M256 HydrophobicContact CE1-CB 4.21Å; F252-M256 HydrophobicContact CE1-CG 4.45Å; F252-M256 HydrophobicContact CZ-CB 4.33Å; F252-M256 HydrophobicContact CZ-CG 4.36Å; F252-M256 VanDerWaalsContact O-CB 3.31Å; F252-M256 WeakPolarHBondContact O-CB 3.32Å; F252-M256 PolarHBondContact O-N 3.22Å; M256-V258 HydrophobicContact CG-CB 4.46Å; M256-V258 HydrophobicContact CG-CG2 4.45Å; M256-V258 WeakPolarHBondContact O-CG2 3.45Å; M256-V258 PolarHBondContact O-N 3.01Å |
| 257 | M | 92.7 | Very high | 90.9 | Very high | 172 Ų | 172 | 117.6 Ų | 117.6 | 85% | 0.847 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 50.9 | 33.9 | -174.2 | -64 | -171.7 | -76.3 | 0 | 0 | 114.3 | E253 E254 | E253-M257 CarbonylContact O-C 3.57Å; E253-M257 WeakPolarHBondContact O-CA 3.06Å; E253-M257 PolarHBondContact O-N 2.63Å; E254-M257 PolarHBondContact O-N 2.76Å |
| 258 | V | 93.1 | Very high | 90.6 | Very high | 86 Ų | 86 | 116.9 Ų | 116.9 | 52% | 0.521 | 56% | 0.558 | S | S | . | * | trans | -133.3 | 127.4 | -178.3 | 173.5 | 0 | 0 | 0 | 0 | 110.5 | E253 M256 | E253-V258 WeakPolarHBondContact CA-O 2.86Å; E253-V258 WeakPolarHBondContact CG-O 3.08Å; E253-V258 PolarHBondContact O-N 3.13Å; E253-V258 VanDerWaalsContact O-N 3.17Å; M256-V258 HydrophobicContact CG-CB 4.46Å; M256-V258 HydrophobicContact CG-CG2 4.45Å; M256-V258 WeakPolarHBondContact O-CG2 3.45Å; M256-V258 PolarHBondContact O-N 3.01Å | ||
| 259 | R | 91.8 | Very high | 90.2 | Very high | 221 Ų | 221 | 113.2 Ų | 113.2 | 83% | 0.834 | 55% | 0.552 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 130.3 | 175.5 | -73.8 | -166 | -178.6 | 148.5 | 1.8 | 112.1 | ||
| 260 | L | 90 | Very high | 89.7 | Confident | 80 Ų | 80 | 113.5 Ų | 113.5 | 42% | 0.419 | 56% | 0.555 | S | S | . | * | P | Polyproline II helix | trans | -81.7 | 133 | 174.2 | -83.6 | 140.8 | 0 | 0 | 0 | 111.3 | R249 F252 E253 | R249-L260 HydrophobicContact CG-CD1 4.19Å; R249-L260 PolarHBondContact NH2-O 3.08Å; F252-L260 HydrophobicContact CD1-CD1 3.43Å; F252-L260 VanDerWaalsContact CD1-CD1 3.43Å; F252-L260 HydrophobicContact CD1-CG 4.43Å; F252-L260 HydrophobicContact CE1-CD1 3.86Å; F252-L260 HydrophobicContact CE1-CG 4.45Å; F252-L260 HydrophobicContact CG-CD1 4.37Å; E253-L260 HydrophobicContact CG-CD1 4.09Å; E253-L260 PolarHBondContact OE1-N 3.12Å; E253-L260 VanDerWaalsContact OE1-N 3.09Å |
| 261 | Q | 89.3 | Confident | 89.1 | Confident | 186 Ų | 186 | 114.9 Ų | 114.9 | 87% | 0.869 | 56% | 0.561 | S | S | * | * | P | Polyproline II helix | trans | -83 | 135.3 | 173.4 | -62.8 | -175.8 | 3.4 | 0 | 0 | 110.6 | ||
| 262 | V | 86.9 | Confident | 88.2 | Confident | 53 Ų | 53 | 121.2 Ų | 121.2 | 32% | 0.321 | 58% | 0.579 | S | S | . | * | P | Polyproline II helix | trans | -89.7 | 123.6 | 176.2 | -174 | 0 | 0 | 0 | 0 | 109.6 | E266 R267 | V262-E266 HydrophobicContact CG1-CB 3.81Å; V262-R267 HydrophobicContact CG1-CB 4.18Å |
| 263 | P | 89.7 | Confident | 87.1 | Confident | 65 Ų | 65 | 118.3 Ų | 118.3 | 42% | 0.422 | 57% | 0.574 | S | S | . | * | P | Polyproline II helix | trans | -65.5 | 148.7 | 175.1 | 27.7 | -33.7 | 0 | 0 | 0 | 111 | N265 E266 R267 | P263-N265 PolarHBondContact O-N 2.99Å; P263-E266 WeakPolarHBondContact CD-OE2 3.46Å; P263-E266 HydrophobicContact CG-CB 3.95Å; P263-E266 VanDerWaalsContact CG-CD 3.45Å; P263-E266 HydrophobicContact CG-CG 3.71Å; P263-E266 PolarHBondContact O-N 3.3Å; P263-R267 PolarHBondContact O-N 3.45Å; P263-R267 VanDerWaalsContact O-N 3.09Å |
| 264 | R | 88.1 | Confident | 85.8 | Confident | 217 Ų | 217 | 123.3 Ų | 123.3 | 82% | 0.819 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -52.5 | -35.3 | -177.2 | -174.1 | 177.9 | 177.4 | -178.9 | 0 | 113.2 | R267 S268 | R264-R267 PolarHBondContact O-N 3.15Å; R264-S268 PolarHBondContact O-N 2.83Å; R264-S268 VanDerWaalsContact O-N 3.08Å; R264-S268 PolarHBondContact O-OG 3.18Å |
| 265 | N | 86.9 | Confident | 84.4 | Confident | 131 Ų | 131 | 123.7 Ų | 123.7 | 70% | 0.701 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -70 | -38.5 | -179.3 | -62.8 | -12.5 | 0 | 0 | 0 | 112.7 | P263 S268 A269 | P263-N265 PolarHBondContact O-N 2.99Å; N265-S268 PolarHBondContact O-OG 2.8Å; N265-A269 WeakPolarHBondContact O-CB 3.44Å; N265-A269 PolarHBondContact O-N 2.98Å; N265-A269 VanDerWaalsContact O-N 3.08Å |
| 266 | E | 85.3 | Confident | 82.8 | Confident | 104 Ų | 104 | 120.6 Ų | 120.6 | 49% | 0.486 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -72.2 | -37 | 175.1 | -75.1 | 178.1 | -164.1 | 0 | 0 | 111.2 | V262 P263 S268 A269 K270 | V262-E266 HydrophobicContact CG1-CB 3.81Å; P263-E266 WeakPolarHBondContact CD-OE2 3.46Å; P263-E266 HydrophobicContact CG-CB 3.95Å; P263-E266 VanDerWaalsContact CG-CD 3.45Å; P263-E266 HydrophobicContact CG-CG 3.71Å; P263-E266 PolarHBondContact O-N 3.3Å; E266-S268 VanDerWaalsContact C-N 3.31Å; E266-S268 PolarHBondContact O-N 3.43Å; E266-A269 PolarHBondContact O-N 2.65Å; E266-K270 WeakPolarHBondContact O-CB 3.41Å; E266-K270 WeakPolarHBondContact O-CG 3.44Å; E266-K270 PolarHBondContact O-N 3.11Å |
| 267 | R | 84.6 | Confident | 81.2 | Confident | 189 Ų | 189 | 122.4 Ų | 122.4 | 71% | 0.713 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -61.1 | -40.6 | 175.7 | -169.6 | 176.9 | -179.9 | -176.9 | 0.1 | 111.7 | V262 P263 R264 K271 | V262-R267 HydrophobicContact CG1-CB 4.18Å; P263-R267 PolarHBondContact O-N 3.45Å; P263-R267 VanDerWaalsContact O-N 3.09Å; R264-R267 PolarHBondContact O-N 3.15Å; R267-K271 PolarHBondContact O-N 2.98Å; R267-K271 VanDerWaalsContact O-N 3.13Å |
| 268 | S | 83.1 | Confident | 79.7 | Confident | 71 Ų | 71 | 119 Ų | 119 | 50% | 0.497 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -71.9 | -38.4 | 176.5 | 65.5 | 0 | 0 | 0 | 0 | 112.5 | R264 N265 E266 K271 R272 | R264-S268 PolarHBondContact O-N 2.83Å; R264-S268 VanDerWaalsContact O-N 3.08Å; R264-S268 PolarHBondContact O-OG 3.18Å; N265-S268 PolarHBondContact O-OG 2.8Å; E266-S268 VanDerWaalsContact C-N 3.31Å; E266-S268 PolarHBondContact O-N 3.43Å; S268-K271 PolarHBondContact O-N 2.9Å; S268-R272 WeakPolarHBondContact O-CB 3.48Å; S268-R272 PolarHBondContact O-N 3.28Å |
| 269 | A | 80.9 | Confident | 78.3 | Confident | 61 Ų | 61 | 115.5 Ų | 115.5 | 50% | 0.504 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -62.1 | -44.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112 | N265 E266 R272 G273 | N265-A269 WeakPolarHBondContact O-CB 3.44Å; N265-A269 PolarHBondContact O-N 2.98Å; N265-A269 VanDerWaalsContact O-N 3.08Å; E266-A269 PolarHBondContact O-N 2.65Å; A269-R272 PolarHBondContact O-N 3Å; A269-G273 PolarHBondContact O-N 3.39Å |
| 270 | K | 79 | Confident | 76.9 | Confident | 79 Ų | 79 | 108.5 Ų | 108.5 | 34% | 0.343 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -60.2 | -47.7 | 174.7 | -75.1 | 178.5 | 178.5 | -178 | 0 | 111.8 | E266 R272 G273 M274 | E266-K270 WeakPolarHBondContact O-CB 3.41Å; E266-K270 WeakPolarHBondContact O-CG 3.44Å; E266-K270 PolarHBondContact O-N 3.11Å; K270-R272 PolarHBondContact O-N 3.22Å; K270-G273 PolarHBondContact O-N 3.04Å; K270-G273 VanDerWaalsContact O-N 3.11Å; K270-M274 WeakPolarHBondContact O-CG 3.4Å; K270-M274 PolarHBondContact O-N 3.13Å |
| 271 | K | 79.8 | Confident | 75.9 | Confident | 149 Ų | 149 | 110.4 Ų | 110.4 | 65% | 0.648 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -58.6 | -37.7 | 176.7 | -170.5 | 175.2 | -178.6 | 179.3 | 0 | 112 | R267 S268 L275 | R267-K271 PolarHBondContact O-N 2.98Å; R267-K271 VanDerWaalsContact O-N 3.13Å; S268-K271 PolarHBondContact O-N 2.9Å; K271-L275 HydrophobicContact CG-CD1 4.35Å; K271-L275 WeakPolarHBondContact O-CD1 3.26Å; K271-L275 PolarHBondContact O-N 3.27Å |
| 272 | R | 76.4 | Confident | 74.8 | Confident | 214 Ų | 214 | 103.1 Ų | 103.1 | 81% | 0.808 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -72.8 | -34.1 | 177.6 | -156.8 | 176.9 | -171.2 | 179 | 2.4 | 112.7 | S268 A269 K270 | S268-R272 WeakPolarHBondContact O-CB 3.48Å; S268-R272 PolarHBondContact O-N 3.28Å; A269-R272 PolarHBondContact O-N 3Å; K270-R272 PolarHBondContact O-N 3.22Å |
| 273 | G | 70.2 | Confident | 73.8 | Confident | 28 Ų | 28 | 102.5 Ų | 102.5 | 29% | 0.289 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -71.7 | -26.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114 | A269 K270 | A269-G273 PolarHBondContact O-N 3.39Å; K270-G273 PolarHBondContact O-N 3.04Å; K270-G273 VanDerWaalsContact O-N 3.11Å |
| 274 | M | 68.3 | Low | 72.9 | Confident | 145 Ų | 145 | 105 Ų | 105 | 71% | 0.714 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -81.5 | -25.5 | 175.9 | -70.1 | 179 | 72.7 | 0 | 0 | 113.7 | K270 | K270-M274 WeakPolarHBondContact O-CG 3.4Å; K270-M274 PolarHBondContact O-N 3.13Å |
| 275 | L | 65.8 | Low | 72.1 | Confident | 142 Ų | 142 | 99.5 Ų | 99.5 | 74% | 0.743 | 53% | 0.531 | S | S | * | . | S | Bend | trans | -96.1 | -2.5 | -172.9 | -101 | 85.5 | 0 | 0 | 0 | 115.1 | K271 | K271-L275 HydrophobicContact CG-CD1 4.35Å; K271-L275 WeakPolarHBondContact O-CD1 3.26Å; K271-L275 PolarHBondContact O-N 3.27Å |
| 276 | G | 62.6 | Low | 71.1 | Confident | 27 Ų | 27 | 101.1 Ų | 101.1 | 28% | 0.278 | 53% | 0.527 | S | S | . | . | trans | -125.5 | 113.5 | -171.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | S278 G279 | G276-S278 PolarHBondContact O-N 3.02Å; G276-S278 VanDerWaalsContact O-N 3.09Å; G276-G279 PolarHBondContact O-N 2.98Å; G276-G279 VanDerWaalsContact O-N 3.15Å | ||
| 277 | M | 60.7 | Low | 70.3 | Confident | 150 Ų | 150 | 103.4 Ų | 103.4 | 74% | 0.739 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.5 | -18.4 | 169.8 | -67.2 | -179.3 | 71.8 | 0 | 0 | 113.3 | G279 Q280 | M277-G279 PolarHBondContact O-N 3.13Å; M277-Q280 WeakPolarHBondContact O-CB 3.34Å; M277-Q280 PolarHBondContact O-N 3.11Å; M277-Q280 VanDerWaalsContact O-N 3.09Å |
| 278 | S | 61.5 | Low | 69.6 | Low | 100 Ų | 100 | 96.7 Ų | 96.7 | 70% | 0.699 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.6 | -22.1 | 175.6 | 63.3 | 0 | 0 | 0 | 0 | 113.7 | G276 | G276-S278 PolarHBondContact O-N 3.02Å; G276-S278 VanDerWaalsContact O-N 3.09Å |
| 279 | G | 63.3 | Low | 69 | Low | 14 Ų | 14 | 98.8 Ų | 98.8 | 14% | 0.144 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -68.7 | -40.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q238 G276 M277 L281 S282 | Q238-G279 VanDerWaalsContact OE1-CA 3.25Å; Q238-G279 PolarHBondContact OE1-O 3.49Å; G276-G279 PolarHBondContact O-N 2.98Å; G276-G279 VanDerWaalsContact O-N 3.15Å; M277-G279 PolarHBondContact O-N 3.13Å; G279-L281 VanDerWaalsContact C-N 3.31Å; G279-L281 PolarHBondContact O-N 3.15Å; G279-S282 WeakPolarHBondContact O-CB 3.39Å; G279-S282 PolarHBondContact O-N 3.11Å; G279-S282 PolarHBondContact O-OG 3.38Å |
| 280 | Q | 62.4 | Low | 68.6 | Low | 73 Ų | 73 | 98.2 Ų | 98.2 | 34% | 0.341 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.6 | -41.3 | -173.9 | -66.6 | 167.9 | -48.9 | 0 | 0 | 111.1 | D236 M277 S282 G283 I284 | D236-Q280 PolarHBondContact OD1-NE2 3.5Å; D236-Q280 VanDerWaalsContact OD1-NE2 3.13Å; M277-Q280 WeakPolarHBondContact O-CB 3.34Å; M277-Q280 PolarHBondContact O-N 3.11Å; M277-Q280 VanDerWaalsContact O-N 3.09Å; Q280-S282 VanDerWaalsContact C-N 3.27Å; Q280-S282 PolarHBondContact O-N 3.08Å; Q280-G283 PolarHBondContact O-N 3.02Å; Q280-I284 WeakPolarHBondContact O-CD1 3.29Å |
| 281 | L | 69.4 | Low | 68.6 | Low | 121 Ų | 121 | 97.4 Ų | 97.4 | 63% | 0.634 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -68.7 | -24.5 | 176.7 | -59 | 177.5 | 0 | 0 | 0 | 113.3 | G279 G283 I284 T285 | G279-L281 VanDerWaalsContact C-N 3.31Å; G279-L281 PolarHBondContact O-N 3.15Å; L281-G283 VanDerWaalsContact C-N 3.32Å; L281-G283 PolarHBondContact O-N 3.09Å; L281-I284 HydrophobicContact CD2-CD1 4.48Å; L281-I284 PolarHBondContact O-N 2.93Å; L281-T285 PolarHBondContact O-N 3.5Å; L281-T285 PolarHBondContact O-OG1 3.09Å |
| 282 | S | 66.4 | Low | 68.5 | Low | 33 Ų | 33 | 91.9 Ų | 91.9 | 23% | 0.231 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -78.4 | -14 | 179.5 | 81.7 | 0 | 0 | 0 | 0 | 114.1 | G279 Q280 R286 | G279-S282 WeakPolarHBondContact O-CB 3.39Å; G279-S282 PolarHBondContact O-N 3.11Å; G279-S282 PolarHBondContact O-OG 3.38Å; Q280-S282 VanDerWaalsContact C-N 3.27Å; Q280-S282 PolarHBondContact O-N 3.08Å; S282-R286 WeakPolarHBondContact O-CD 3.4Å; S282-R286 WeakPolarHBondContact O-CG 3.37Å; S282-R286 PolarHBondContact O-NE 2.96Å; S282-R286 VanDerWaalsContact O-NE 3.08Å |
| 283 | G | 66.4 | Low | 68.5 | Low | 39 Ų | 39 | 85.8 Ų | 85.8 | 40% | 0.402 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -79.6 | -33.7 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q280 L281 | Q280-G283 PolarHBondContact O-N 3.02Å; L281-G283 VanDerWaalsContact C-N 3.32Å; L281-G283 PolarHBondContact O-N 3.09Å |
| 284 | I | 70.8 | Confident | 68.7 | Low | 118 Ų | 118 | 89.6 Ų | 89.6 | 61% | 0.605 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -76.5 | -30.7 | -178.1 | -63.4 | 150.1 | 0 | 0 | 0 | 111.2 | Q280 L281 | Q280-I284 WeakPolarHBondContact O-CD1 3.29Å; L281-I284 HydrophobicContact CD2-CD1 4.48Å; L281-I284 PolarHBondContact O-N 2.93Å |
| 285 | T | 69.9 | Low | 68.7 | Low | 102 Ų | 102 | 86.2 Ų | 86.2 | 63% | 0.626 | 50% | 0.498 | S | S | * | . | S | Bend | trans | -90.3 | -1.9 | 179.2 | 57.4 | 0 | 0 | 0 | 0 | 114.6 | L281 F287 | L281-T285 PolarHBondContact O-N 3.5Å; L281-T285 PolarHBondContact O-OG1 3.09Å; T285-F287 PolarHBondContact O-N 3.08Å |
| 286 | R | 66.6 | Low | 68.6 | Low | 165 Ų | 165 | 81.5 Ų | 81.5 | 62% | 0.623 | 48% | 0.484 | S | S | * | . | trans | -90.7 | 79.6 | 176 | -79 | 178.7 | -146.4 | -111.9 | 4.2 | 110.9 | S282 S288 | S282-R286 WeakPolarHBondContact O-CD 3.4Å; S282-R286 WeakPolarHBondContact O-CG 3.37Å; S282-R286 PolarHBondContact O-NE 2.96Å; S282-R286 VanDerWaalsContact O-NE 3.08Å; R286-S288 PolarHBondContact O-N 2.67Å | ||
| 287 | F | 68.3 | Low | 68.2 | Low | 152 Ų | 152 | 89.7 Ų | 89.7 | 67% | 0.667 | 52% | 0.515 | S | S | * | . | trans | -74.8 | 82.9 | 158 | -53.7 | -79.5 | 0 | 0 | 0 | 106.9 | V216 T285 | V216-F287 HydrophobicContact CG2-CD1 3.87Å; V216-F287 HydrophobicContact CG2-CE1 4.37Å; T285-F287 PolarHBondContact O-N 3.08Å | ||
| 288 | S | 68.8 | Low | 67.7 | Low | 48 Ų | 48 | 84.8 Ų | 84.8 | 34% | 0.336 | 50% | 0.502 | S | S | . | . | trans | -61.3 | 144.6 | 177.3 | 54.3 | 0 | 0 | 0 | 0 | 110.2 | S214 R286 I290 | S214-S288 WeakPolarHBondContact CB-OG 3.3Å; R286-S288 PolarHBondContact O-N 2.67Å; S288-I290 VanDerWaalsContact O-CG1 3.29Å; S288-I290 WeakPolarHBondContact O-CG1 3.22Å; S288-I290 PolarHBondContact O-N 2.99Å | ||
| 289 | D | 71.3 | Confident | 67.1 | Low | 114 Ų | 114 | 88.3 Ų | 88.3 | 61% | 0.61 | 51% | 0.508 | S | S | * | . | trans | -50.6 | 107.5 | -178.1 | -56.5 | -22.3 | 0 | 0 | 0 | 112.7 | ||||
| 290 | I | 73.6 | Confident | 66.3 | Low | 49 Ų | 49 | 95.3 Ų | 95.3 | 25% | 0.251 | 54% | 0.542 | S | S | . | . | trans | -86.7 | -1.3 | 173.9 | -50.3 | 175.4 | 0 | 0 | 0 | 110.4 | V216 I217 S288 A292 L293 T294 | V216-I290 HydrophobicContact CB-CD1 4.31Å; V216-I290 HydrophobicContact CG1-CD1 4.22Å; I217-I290 HydrophobicContact CD1-CB 4.4Å; I217-I290 HydrophobicContact CD1-CD1 4.24Å; I217-I290 HydrophobicContact CD1-CG1 4.09Å; I217-I290 HydrophobicContact CD1-CG2 3.56Å; I217-I290 HydrophobicContact CG1-CD1 4.25Å; I217-I290 HydrophobicContact CG1-CG2 4.44Å; S288-I290 VanDerWaalsContact O-CG1 3.29Å; S288-I290 WeakPolarHBondContact O-CG1 3.22Å; S288-I290 PolarHBondContact O-N 2.99Å; I290-A292 PolarHBondContact O-N 2.77Å; I290-A292 VanDerWaalsContact O-N 3.08Å; I290-L293 HydrophobicContact CG2-CB 3.98Å; I290-L293 HydrophobicContact CG2-CD2 4.47Å; I290-L293 WeakPolarHBondContact O-CA 3.34Å; I290-L293 WeakPolarHBondContact O-CB 3.44Å; I290-L293 PolarHBondContact O-N 2.88Å; I290-T294 HydrophobicContact CG2-CG2 4.37Å; I290-T294 PolarHBondContact O-N 3.16Å; I290-T294 VanDerWaalsContact O-N 3.11Å; I290-T294 PolarHBondContact O-OG1 2.97Å; I290-T294 VanDerWaalsContact O-OG1 3.13Å | ||
| 291 | T | 77.8 | Confident | 65.8 | Low | 63 Ų | 63 | 96.4 Ų | 96.4 | 39% | 0.387 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -51.5 | -36.3 | -178.2 | 53.3 | 0 | 0 | 0 | 0 | 112.7 | L293 G295 | T291-L293 PolarHBondContact O-N 2.92Å; T291-G295 PolarHBondContact O-N 3.26Å; T291-G295 VanDerWaalsContact O-N 3.11Å |
| 292 | A | 78.2 | Confident | 64.5 | Low | 33 Ų | 33 | 98 Ų | 98 | 27% | 0.273 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -63.3 | -19.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | Q207 R208 A211 I290 | Q207-A292 HydrophobicContact CB-CB 4.08Å; R208-A292 HydrophobicContact CG-CB 4.44Å; A211-A292 HydrophobicContact CB-CB 4.44Å; I290-A292 PolarHBondContact O-N 2.77Å; I290-A292 VanDerWaalsContact O-N 3.08Å |
| 293 | L | 75.5 | Confident | 63.3 | Low | 85 Ų | 85 | 103.1 Ų | 103.1 | 45% | 0.445 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -104.9 | -36.9 | -179.2 | -156.8 | 76.5 | 0 | 0 | 0 | 112.5 | L212 I217 I290 T291 | L212-L293 HydrophobicContact CD2-CD1 3.75Å; L212-L293 HydrophobicContact CD2-CD2 3.8Å; L212-L293 HydrophobicContact CD2-CG 4.47Å; L212-L293 HydrophobicContact CG-CD1 4.04Å; I217-L293 HydrophobicContact CD1-CD2 3.69Å; I290-L293 HydrophobicContact CG2-CB 3.98Å; I290-L293 HydrophobicContact CG2-CD2 4.47Å; I290-L293 WeakPolarHBondContact O-CA 3.34Å; I290-L293 WeakPolarHBondContact O-CB 3.44Å; I290-L293 PolarHBondContact O-N 2.88Å; T291-L293 PolarHBondContact O-N 2.92Å |
| 294 | T | 75.6 | Confident | 62.3 | Low | 109 Ų | 109 | 107 Ų | 107 | 67% | 0.669 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -83.6 | -8.7 | 179.7 | 38.2 | 0 | 0 | 0 | 0 | 113.8 | I290 G296 | I290-T294 HydrophobicContact CG2-CG2 4.37Å; I290-T294 PolarHBondContact O-N 3.16Å; I290-T294 VanDerWaalsContact O-N 3.11Å; I290-T294 PolarHBondContact O-OG1 2.97Å; I290-T294 VanDerWaalsContact O-OG1 3.13Å; T294-G296 PolarHBondContact O-N 3.34Å |
| 295 | G | 67.7 | Low | 60.7 | Low | 73 Ų | 73 | 103.2 Ų | 103.2 | 75% | 0.753 | 60% | 0.595 | S | S | * | * | trans | 64.8 | 8.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | T291 | T291-G295 PolarHBondContact O-N 3.26Å; T291-G295 VanDerWaalsContact O-N 3.11Å | ||
| 296 | G | 63.1 | Low | 59.3 | Low | 43 Ų | 43 | 104.4 Ų | 104.4 | 44% | 0.443 | 61% | 0.605 | S | S | . | * | trans | -73.1 | 139.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | T294 G298 | T294-G296 PolarHBondContact O-N 3.34Å; G296-G298 PolarHBondContact O-N 3.36Å | ||
| 297 | E | 55.5 | Low | 58.3 | Low | 200 Ų | 200 | 106.1 Ų | 106.1 | 94% | 0.935 | 62% | 0.617 | S | S | * | * | trans | -56.6 | 109.1 | 166.9 | -67.4 | -173.8 | 157.9 | 0 | 0 | 108.1 | Q299 | E297-Q299 PolarHBondContact O-N 3.36Å; E297-Q299 VanDerWaalsContact O-N 3.09Å | ||
| 298 | G | 50.4 | Low | 57.1 | Low | 46 Ų | 46 | 108.4 Ų | 108.4 | 47% | 0.474 | 63% | 0.627 | S | S | . | * | trans | -63.5 | 113 | -176.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | G296 D300 | G296-G298 PolarHBondContact O-N 3.36Å; G298-D300 PolarHBondContact O-N 3.34Å | ||
| 299 | Q | 47.6 | Very low | 55.8 | Low | 175 Ų | 175 | 115.8 Ų | 115.8 | 82% | 0.818 | 65% | 0.653 | S | S | * | * | trans | -65.7 | 112.6 | 157.9 | -165.8 | 169.5 | 24.8 | 0 | 0 | 106.4 | E297 T301 | E297-Q299 PolarHBondContact O-N 3.36Å; E297-Q299 VanDerWaalsContact O-N 3.09Å; Q299-T301 VanDerWaalsContact C-N 3.26Å; Q299-T301 PolarHBondContact O-N 3.45Å | ||
| 300 | D | 47.9 | Very low | 54.7 | Low | 160 Ų | 160 | 119.7 Ų | 119.7 | 86% | 0.856 | 66% | 0.664 | S | S | * | * | trans | -59.3 | 86.1 | 175.7 | -82.4 | -36.8 | 0 | 0 | 0 | 110.1 | G298 | G298-D300 PolarHBondContact O-N 3.34Š| ||
| 301 | T | 50.7 | Low | 53.4 | Low | 96 Ų | 96 | 127.3 Ų | 127.3 | 59% | 0.589 | 70% | 0.696 | S | S | * | * | trans | -101.5 | 111 | 161 | 54.6 | 0 | 0 | 0 | 0 | 107.7 | Q299 | Q299-T301 VanDerWaalsContact C-N 3.26Å; Q299-T301 PolarHBondContact O-N 3.45Å | ||
| 302 | D | 42.3 | Very low | 51.8 | Low | 154 Ų | 154 | 133.3 Ų | 133.3 | 82% | 0.824 | 72% | 0.716 | S | S | * | * | trans | 83.1 | 66.5 | 166.9 | -56.3 | -32.5 | 0 | 0 | 0 | 118.4 | P304 | D302-P304 WeakPolarHBondContact O-CD 3.49Š| ||
| 303 | N | 42.2 | Very low | 50.5 | Low | 141 Ų | 141 | 139.8 Ų | 139.8 | 75% | 0.754 | 75% | 0.745 | S | S | * | * | trans | -82.4 | 109 | 150.7 | -179.2 | 28.8 | 0 | 0 | 0 | 111 | G305 | N303-G305 WeakPolarHBondContact OD1-CA 3.1Å; N303-G305 PolarHBondContact OD1-N 3.26Å | ||
| 304 | P | 44.5 | Very low | 49.2 | Very low | 122 Ų | 122 | 143.6 Ų | 143.6 | 79% | 0.792 | 76% | 0.763 | S | S | * | * | trans | -103.4 | 64.9 | 150.9 | 36.9 | -30.1 | 0 | 0 | 0 | 109.3 | D302 | D302-P304 WeakPolarHBondContact O-CD 3.49Š| ||
| 305 | G | 38.3 | Very low | 48 | Very low | 37 Ų | 37 | 147.6 Ų | 147.6 | 38% | 0.381 | 77% | 0.771 | S | S | . | * | trans | -60.6 | 152.4 | 157.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | N303 K307 | N303-G305 WeakPolarHBondContact OD1-CA 3.1Å; N303-G305 PolarHBondContact OD1-N 3.26Å; G305-K307 PolarHBondContact O-N 3.2Å | ||
| 306 | P | 40.8 | Very low | 47.1 | Very low | 127 Ų | 127 | 153.7 Ų | 153.7 | 83% | 0.825 | 78% | 0.777 | S | S | * | * | trans | -65.2 | 123.6 | -154.1 | 26.1 | -34 | 0 | 0 | 0 | 112.2 | K308 | P306-K308 PolarHBondContact O-N 3.09Š| ||
| 307 | K | 44.1 | Very low | 46.3 | Very low | 201 Ų | 201 | 160.9 Ų | 160.9 | 87% | 0.874 | 80% | 0.796 | S | S | * | * | trans | -53.8 | 105.9 | 164.8 | -69.5 | -175.6 | -179 | 179 | 0 | 108.4 | G305 K309 | G305-K307 PolarHBondContact O-N 3.2Å; K307-K309 PolarHBondContact O-N 3.26Å | ||
| 308 | K | 43.4 | Very low | 46 | Very low | 201 Ų | 201 | 157.6 Ų | 157.6 | 87% | 0.874 | 79% | 0.79 | S | S | * | * | trans | -53.1 | 109.1 | 163.2 | -71.9 | -177.7 | -179.1 | 175.4 | 0 | 106.4 | P306 K310 | P306-K308 PolarHBondContact O-N 3.09Å; K308-K310 PolarHBondContact O-N 2.77Å | ||
| 309 | K | 42.7 | Very low | 46 | Very low | 203 Ų | 203 | 164.6 Ų | 164.6 | 88% | 0.883 | 81% | 0.807 | S | S | * | * | trans | -58.1 | 112.4 | 175.5 | -72.1 | -174.8 | -179.7 | 177.4 | 0 | 107.2 | K307 K311 | K307-K309 PolarHBondContact O-N 3.26Å; K309-K311 PolarHBondContact O-N 3.22Å; K309-K311 VanDerWaalsContact O-N 3.16Å | ||
| 310 | K | 47.2 | Very low | 46 | Very low | 195 Ų | 195 | 167.6 Ų | 167.6 | 85% | 0.848 | 81% | 0.811 | S | S | * | * | trans | -48.1 | 123 | 165.1 | -74.6 | -177.1 | 176.5 | -179.2 | 0 | 107 | K308 K312 | K308-K310 PolarHBondContact O-N 2.77Å; K310-K312 PolarHBondContact O-N 3.12Å; K310-K312 VanDerWaalsContact O-N 3.1Å | ||
| 311 | K | 46.1 | Very low | 45.9 | Very low | 210 Ų | 210 | 169.3 Ų | 169.3 | 91% | 0.913 | 81% | 0.811 | S | S | * | * | trans | -51.5 | 121.2 | 170 | -78.6 | -178.8 | 177.2 | 176.2 | 0 | 107 | K309 L313 | K309-K311 PolarHBondContact O-N 3.22Å; K309-K311 VanDerWaalsContact O-N 3.16Å; K311-L313 PolarHBondContact O-N 3.1Å; K311-L313 VanDerWaalsContact O-N 3.12Å | ||
| 312 | K | 44.6 | Very low | 45.5 | Very low | 188 Ų | 188 | 169.1 Ų | 169.1 | 82% | 0.817 | 82% | 0.819 | S | S | * | * | trans | -61.2 | 115.4 | 173 | -74.2 | -171.8 | 175.9 | -175.1 | 0 | 107.7 | K310 M314 | K310-K312 PolarHBondContact O-N 3.12Å; K310-K312 VanDerWaalsContact O-N 3.1Å; K312-M314 PolarHBondContact O-N 3.05Å | ||
| 313 | L | 50.3 | Low | 45.7 | Very low | 169 Ų | 169 | 171.2 Ų | 171.2 | 89% | 0.885 | 82% | 0.821 | S | S | * | * | trans | -63.3 | 101.6 | 165.6 | -174 | 71.4 | 0 | 0 | 0 | 107.2 | K311 | K311-L313 PolarHBondContact O-N 3.1Å; K311-L313 VanDerWaalsContact O-N 3.12Å | ||
| 314 | M | 48.2 | Very low | 45.9 | Very low | 166 Ų | 166 | 175.9 Ų | 175.9 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | trans | -85 | 117.1 | 171 | -71.7 | -66.4 | -83.5 | 0 | 0 | 108.5 | K312 | K312-M314 PolarHBondContact O-N 3.05Š| ||
| 315 | K | 50 | Low | 45.9 | Very low | 192 Ų | 192 | 185.6 Ų | 185.6 | 84% | 0.835 | 85% | 0.849 | S | S | * | * | trans | -43.3 | 138.8 | -178.3 | -68 | 171.4 | 172.4 | 179.6 | 0 | 113.1 | K317 | K315-K317 PolarHBondContact O-N 3.23Š| ||
| 316 | K | 50 | Low | 46.3 | Very low | 202 Ų | 202 | 193 Ų | 193 | 88% | 0.878 | 87% | 0.872 | S | S | * | * | trans | -45.6 | 120.8 | 165.9 | -84.1 | 177.4 | 172.8 | 176.6 | 0 | 109.7 | T318 | K316-T318 PolarHBondContact O-N 3.2Š| ||
| 317 | K | 46.5 | Very low | 46.6 | Very low | 193 Ų | 193 | 196.5 Ų | 196.5 | 84% | 0.839 | 88% | 0.875 | S | S | * | * | trans | -84.9 | 98 | 161 | -76.6 | -170.9 | 176.3 | -177.4 | 0 | 107.8 | K315 K319 | K315-K317 PolarHBondContact O-N 3.23Å; K317-K319 PolarHBondContact O-N 3.43Å | ||
| 318 | T | 48.5 | Very low | 46.7 | Very low | 131 Ų | 131 | 196.2 Ų | 196.2 | 80% | 0.804 | 88% | 0.875 | S | S | * | * | trans | -64.8 | 106.9 | 162 | 36.7 | 0 | 0 | 0 | 0 | 108.4 | K316 R320 | K316-T318 PolarHBondContact O-N 3.2Å; T318-R320 PolarHBondContact O-N 3.39Å | ||
| 319 | K | 50.6 | Low | 46.9 | Very low | 193 Ų | 193 | 195.9 Ų | 195.9 | 84% | 0.839 | 88% | 0.875 | S | S | * | * | trans | -90.2 | 100.5 | 166.3 | -78.7 | -169.5 | 178.6 | -177.1 | 0 | 108.8 | K317 | K317-K319 PolarHBondContact O-N 3.43Š| ||
| 320 | R | 47.8 | Very low | 47.2 | Very low | 238 Ų | 238 | 195.5 Ų | 195.5 | 90% | 0.898 | 87% | 0.874 | S | S | * | * | trans | 28.9 | 124 | 141.2 | -57 | 179.3 | 99.8 | 172.7 | 4.7 | 118.5 | T318 A322 | T318-R320 PolarHBondContact O-N 3.39Å; R320-A322 PolarHBondContact O-N 3.48Å | ||
| 321 | K | 45.7 | Very low | 47.2 | Very low | 196 Ų | 196 | 195.5 Ų | 195.5 | 85% | 0.852 | 88% | 0.876 | S | S | * | * | trans | -17.8 | 115.9 | 150.6 | -101.2 | 175.7 | 168.6 | 179.8 | 0 | 113.3 | ||||
| 322 | A | 42.8 | Very low | 47.3 | Very low | 93 Ų | 93 | 194.5 Ų | 194.5 | 77% | 0.769 | 87% | 0.874 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 122.4 | 152.8 | 0 | 0 | 0 | 0 | 0 | 107.6 | R320 R324 | R320-A322 PolarHBondContact O-N 3.48Å; A322-R324 PolarHBondContact O-N 3.45Å |
| 323 | F | 44.8 | Very low | 47.5 | Very low | 198 Ų | 198 | 195 Ų | 195 | 87% | 0.868 | 88% | 0.878 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 122.2 | 159.3 | -90.4 | -94.9 | 0 | 0 | 0 | 107.1 | ||
| 324 | R | 47.8 | Very low | 47.2 | Very low | 238 Ų | 238 | 197.2 Ų | 197.2 | 90% | 0.898 | 88% | 0.877 | S | S | * | * | P | Polyproline II helix | trans | -85.1 | 152.6 | 158.5 | -92.9 | -178.5 | 155.7 | -172.4 | -6.7 | 107.9 | A322 | A322-R324 PolarHBondContact O-N 3.45Š|
| 325 | R | 44.1 | Very low | 47.1 | Very low | 326 Ų | 326 | 200 Ų | 200 | 100% | 1.23 | 88% | 0.883 | S | S | * | * | trans | -27 | 0 | 178.9 | -73.2 | 179 | 172.1 | 179.7 | -3.7 | 115.3 |
Retrieved 325 of 325 residues in 177.7 ms
(Link to these results)