| 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 | 39.7 | Very low | 51.4 | Low | 240 Ų | 240 | 117.9 Ų | 117.9 | 100% | 1.182 | 68% | 0.676 | S | S | * | * | 0 | 67.2 | 0 | -69.5 | 168.9 | 71.2 | 0 | 0 | 109.9 | |||||
| 2 | S | 47.1 | Very low | 51.7 | Low | 104 Ų | 104 | 124.4 Ų | 124.4 | 73% | 0.727 | 68% | 0.681 | S | S | * | * | trans | -117.6 | 2.7 | -169.2 | -43.3 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 3 | S | 46.3 | Very low | 52.1 | Low | 104 Ų | 104 | 119.6 Ų | 119.6 | 73% | 0.727 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -92 | -9.4 | -168 | -28.6 | 0 | 0 | 0 | 0 | 114.9 | ||
| 4 | C | 50.4 | Low | 52.2 | Low | 103 Ų | 103 | 119.3 Ų | 119.3 | 70% | 0.696 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -85.5 | -14.5 | -177 | -96.3 | 0 | 0 | 0 | 0 | 114.4 | ||
| 5 | S | 51.2 | Low | 52.1 | Low | 89 Ų | 89 | 115.9 Ų | 115.9 | 62% | 0.622 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -80.6 | -30.8 | -170.8 | -34.7 | 0 | 0 | 0 | 0 | 113.5 | ||
| 6 | S | 55 | Low | 52.3 | Low | 73 Ų | 73 | 112.9 Ų | 112.9 | 51% | 0.51 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -78.7 | -39.6 | -172.7 | 61.6 | 0 | 0 | 0 | 0 | 112.7 | S9 F10 | S6-S9 PolarHBondContact O-OG 3.37Å; S6-F10 PolarHBondContact O-N 2.71Å |
| 7 | S | 53.9 | Low | 52.5 | Low | 72 Ų | 72 | 112.8 Ų | 112.8 | 50% | 0.503 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -71.1 | -36 | -177.5 | -52.3 | 0 | 0 | 0 | 0 | 112.1 | F11 | S7-F11 PolarHBondContact O-N 3.37Å; S7-F11 VanDerWaalsContact O-N 3.09Å |
| 8 | Q | 52.9 | Low | 52.7 | Low | 136 Ų | 136 | 109.9 Ų | 109.9 | 64% | 0.636 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -71.4 | -34.7 | 177.8 | -78.3 | -174.2 | 1.9 | 0 | 0 | 113 | R12 | Q8-R12 VanDerWaalsContact O-CB 3.3Å; Q8-R12 WeakPolarHBondContact O-CB 3.34Å; Q8-R12 PolarHBondContact O-N 2.91Å |
| 9 | S | 56.8 | Low | 53.1 | Low | 68 Ų | 68 | 109.2 Ų | 109.2 | 48% | 0.476 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -69.7 | -40.6 | 177.7 | 68.2 | 0 | 0 | 0 | 0 | 111.3 | S6 R12 S13 | S6-S9 PolarHBondContact O-OG 3.37Å; S9-R12 PolarHBondContact O-N 3.34Å; S9-S13 VanDerWaalsContact O-CB 3.22Å; S9-S13 WeakPolarHBondContact O-CB 3.42Å; S9-S13 PolarHBondContact O-N 3.01Å |
| 10 | F | 56.2 | Low | 53.7 | Low | 146 Ų | 146 | 112 Ų | 112 | 64% | 0.64 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -60.7 | -50.7 | 173.9 | -107.8 | -81.8 | 0 | 0 | 0 | 111.6 | S6 S13 H14 | S6-F10 PolarHBondContact O-N 2.71Å; F10-S13 PolarHBondContact O-N 3.43Å; F10-H14 WeakPolarHBondContact O-CB 3.43Å; F10-H14 PolarHBondContact O-N 2.98Å |
| 11 | F | 55.4 | Low | 54.4 | Low | 162 Ų | 162 | 109.4 Ų | 109.4 | 71% | 0.711 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -65.6 | -41.1 | 179.3 | -96.3 | -84.6 | 0 | 0 | 0 | 112.5 | S7 C15 | S7-F11 PolarHBondContact O-N 3.37Å; S7-F11 VanDerWaalsContact O-N 3.09Å; F11-C15 WeakPolarHBondContact O-CB 3.26Å; F11-C15 PolarHBondContact O-N 2.84Å |
| 12 | R | 55.6 | Low | 55.8 | Low | 196 Ų | 196 | 102 Ų | 102 | 74% | 0.74 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -65.1 | -40.4 | 176.6 | -90.9 | -174.4 | 170.7 | -159.8 | -1.5 | 112.6 | Q8 S9 S16 | Q8-R12 VanDerWaalsContact O-CB 3.3Å; Q8-R12 WeakPolarHBondContact O-CB 3.34Å; Q8-R12 PolarHBondContact O-N 2.91Å; S9-R12 PolarHBondContact O-N 3.34Å; R12-S16 VanDerWaalsContact O-CB 3.25Å; R12-S16 WeakPolarHBondContact O-CB 3.26Å; R12-S16 PolarHBondContact O-N 3.39Å; R12-S16 PolarHBondContact O-OG 3.36Å |
| 13 | S | 57.1 | Low | 56.6 | Low | 62 Ų | 62 | 102.4 Ų | 102.4 | 43% | 0.434 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.8 | -52 | 178.5 | -176.4 | 0 | 0 | 0 | 0 | 110.5 | S9 F10 C15 S16 I17 | S9-S13 VanDerWaalsContact O-CB 3.22Å; S9-S13 WeakPolarHBondContact O-CB 3.42Å; S9-S13 PolarHBondContact O-N 3.01Å; F10-S13 PolarHBondContact O-N 3.43Å; S13-C15 PolarHBondContact O-N 2.8Å; S13-S16 PolarHBondContact O-N 3.45Å; S13-I17 WeakPolarHBondContact O-CB 3.49Å; S13-I17 WeakPolarHBondContact O-CD1 3.18Å; S13-I17 WeakPolarHBondContact O-CG1 3.41Å; S13-I17 PolarHBondContact O-N 3.46Å; S13-I17 WeakPolarHBondContact OG-CD1 3.4Å |
| 14 | H | 52.8 | Low | 57.7 | Low | 115 Ų | 115 | 100.1 Ų | 100.1 | 53% | 0.532 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.5 | -45.2 | 177.5 | -103.2 | -78.2 | 0 | 0 | 0 | 112.1 | F10 S16 I17 V18 | F10-H14 WeakPolarHBondContact O-CB 3.43Å; F10-H14 PolarHBondContact O-N 2.98Å; H14-S16 VanDerWaalsContact C-N 3.31Å; H14-S16 PolarHBondContact O-N 3.17Å; H14-I17 PolarHBondContact O-N 2.84Å; H14-V18 WeakPolarHBondContact O-CB 3.36Å; H14-V18 WeakPolarHBondContact O-CG2 3.31Å; H14-V18 PolarHBondContact O-N 2.87Å |
| 15 | C | 50.9 | Low | 58.8 | Low | 68 Ų | 68 | 102.1 Ų | 102.1 | 46% | 0.459 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.5 | -36.3 | -179.7 | -156.8 | 0 | 0 | 0 | 0 | 111.5 | F11 S13 N19 | F11-C15 WeakPolarHBondContact O-CB 3.26Å; F11-C15 PolarHBondContact O-N 2.84Å; S13-C15 PolarHBondContact O-N 2.8Å; C15-N19 WeakPolarHBondContact O-CB 3.44Å; C15-N19 VanDerWaalsContact O-CG 3.32Å; C15-N19 PolarHBondContact O-N 3.32Å; C15-N19 PolarHBondContact O-ND2 2.86Å |
| 16 | S | 55.5 | Low | 59.5 | Low | 69 Ų | 69 | 101.4 Ų | 101.4 | 48% | 0.483 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -70.3 | -43.7 | 175.8 | -66.2 | 0 | 0 | 0 | 0 | 113.2 | R12 S13 H14 K20 | R12-S16 VanDerWaalsContact O-CB 3.25Å; R12-S16 WeakPolarHBondContact O-CB 3.26Å; R12-S16 PolarHBondContact O-N 3.39Å; R12-S16 PolarHBondContact O-OG 3.36Å; S13-S16 PolarHBondContact O-N 3.45Å; H14-S16 VanDerWaalsContact C-N 3.31Å; H14-S16 PolarHBondContact O-N 3.17Å; S16-K20 PolarHBondContact O-N 3.5Å; S16-K20 VanDerWaalsContact O-N 3.17Å |
| 17 | I | 56.3 | Low | 60 | Low | 111 Ų | 111 | 101.7 Ų | 101.7 | 57% | 0.569 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -72.8 | -44.4 | -176.7 | -64.4 | 166.7 | 0 | 0 | 0 | 110.5 | S13 H14 S21 | S13-I17 WeakPolarHBondContact O-CB 3.49Å; S13-I17 WeakPolarHBondContact O-CD1 3.18Å; S13-I17 WeakPolarHBondContact O-CG1 3.41Å; S13-I17 PolarHBondContact O-N 3.46Å; S13-I17 WeakPolarHBondContact OG-CD1 3.4Å; H14-I17 PolarHBondContact O-N 2.84Å; I17-S21 PolarHBondContact O-N 3.25Å; I17-S21 PolarHBondContact O-OG 2.9Å |
| 18 | V | 55.7 | Low | 60.8 | Low | 61 Ų | 61 | 105.4 Ų | 105.4 | 37% | 0.37 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -66.6 | -43.1 | 179 | 176.5 | 0 | 0 | 0 | 0 | 109.8 | H14 S21 I22 | H14-V18 WeakPolarHBondContact O-CB 3.36Å; H14-V18 WeakPolarHBondContact O-CG2 3.31Å; H14-V18 PolarHBondContact O-N 2.87Å; V18-S21 PolarHBondContact O-OG 2.83Å; V18-I22 HydrophobicContact CG1-CD1 3.43Å; V18-I22 VanDerWaalsContact CG1-CD1 3.43Å; V18-I22 HydrophobicContact CG1-CG1 4.36Å; V18-I22 VanDerWaalsContact O-CB 3.32Å; V18-I22 WeakPolarHBondContact O-CB 3.45Å; V18-I22 VanDerWaalsContact O-CG1 3.24Å; V18-I22 WeakPolarHBondContact O-CG1 3.28Å; V18-I22 PolarHBondContact O-N 3.36Å; V18-I22 VanDerWaalsContact O-N 3.13Å |
| 19 | N | 59.9 | Low | 61.5 | Low | 96 Ų | 96 | 104.4 Ų | 104.4 | 51% | 0.513 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.3 | -46.2 | 179.3 | -84 | -31 | 0 | 0 | 0 | 112.9 | C15 S21 L23 | C15-N19 WeakPolarHBondContact O-CB 3.44Å; C15-N19 VanDerWaalsContact O-CG 3.32Å; C15-N19 PolarHBondContact O-N 3.32Å; C15-N19 PolarHBondContact O-ND2 2.86Å; N19-S21 PolarHBondContact O-N 3.27Å; N19-L23 WeakPolarHBondContact O-CA 3.46Å; N19-L23 WeakPolarHBondContact O-CB 3.39Å; N19-L23 PolarHBondContact O-N 2.87Å |
| 20 | K | 64.7 | Low | 61.9 | Low | 164 Ų | 164 | 108 Ų | 108 | 71% | 0.713 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -66.1 | -41.4 | -175.5 | -75 | -175.3 | -179.6 | -179.4 | 0 | 112.6 | S16 S24 | S16-K20 PolarHBondContact O-N 3.5Å; S16-K20 VanDerWaalsContact O-N 3.17Å; K20-S24 WeakPolarHBondContact O-CB 3.48Å; K20-S24 PolarHBondContact O-N 3.44Å |
| 21 | S | 69.2 | Low | 62.2 | Low | 59 Ų | 59 | 104.5 Ų | 104.5 | 41% | 0.413 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -69.7 | -43.2 | -178.9 | 61.2 | 0 | 0 | 0 | 0 | 112.1 | I17 V18 N19 K25 | I17-S21 PolarHBondContact O-N 3.25Å; I17-S21 PolarHBondContact O-OG 2.9Å; V18-S21 PolarHBondContact O-OG 2.83Å; N19-S21 PolarHBondContact O-N 3.27Å; S21-K25 WeakPolarHBondContact O-CG 3.22Å; S21-K25 PolarHBondContact O-N 2.92Å; S21-K25 VanDerWaalsContact O-N 3.07Å |
| 22 | I | 68.3 | Low | 62.7 | Low | 84 Ų | 84 | 99.7 Ų | 99.7 | 43% | 0.431 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.3 | -46.3 | 176.7 | -65.4 | 176.5 | 0 | 0 | 0 | 110.5 | V18 S24 K25 L26 | V18-I22 HydrophobicContact CG1-CD1 3.43Å; V18-I22 VanDerWaalsContact CG1-CD1 3.43Å; V18-I22 HydrophobicContact CG1-CG1 4.36Å; V18-I22 VanDerWaalsContact O-CB 3.32Å; V18-I22 WeakPolarHBondContact O-CB 3.45Å; V18-I22 VanDerWaalsContact O-CG1 3.24Å; V18-I22 WeakPolarHBondContact O-CG1 3.28Å; V18-I22 PolarHBondContact O-N 3.36Å; V18-I22 VanDerWaalsContact O-N 3.13Å; I22-S24 VanDerWaalsContact C-N 3.32Å; I22-S24 PolarHBondContact O-N 3.48Å; I22-K25 PolarHBondContact O-N 3.39Å; I22-K25 VanDerWaalsContact O-N 3.13Å; I22-L26 HydrophobicContact CG2-CD1 3.87Å; I22-L26 HydrophobicContact CG2-CG 4.23Å; I22-L26 WeakPolarHBondContact O-CG 3.31Å; I22-L26 PolarHBondContact O-N 3.48Å |
| 23 | L | 63.8 | Low | 62.8 | Low | 112 Ų | 112 | 95.5 Ų | 95.5 | 59% | 0.586 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62 | -41.2 | 179.1 | -160.7 | 77.9 | 0 | 0 | 0 | 110.9 | N19 K25 L26 T27 | N19-L23 WeakPolarHBondContact O-CA 3.46Å; N19-L23 WeakPolarHBondContact O-CB 3.39Å; N19-L23 PolarHBondContact O-N 2.87Å; L23-K25 PolarHBondContact O-N 3.2Å; L23-L26 PolarHBondContact O-N 2.96Å; L23-T27 WeakPolarHBondContact O-CB 3.46Å; L23-T27 PolarHBondContact O-N 3.47Å; L23-T27 PolarHBondContact O-OG1 2.99Å |
| 24 | S | 71 | Confident | 62.8 | Low | 56 Ų | 56 | 97.4 Ų | 97.4 | 39% | 0.392 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.1 | -43.3 | 173.8 | -176.3 | 0 | 0 | 0 | 0 | 112.3 | K20 I22 K28 | K20-S24 WeakPolarHBondContact O-CB 3.48Å; K20-S24 PolarHBondContact O-N 3.44Å; I22-S24 VanDerWaalsContact C-N 3.32Å; I22-S24 PolarHBondContact O-N 3.48Å; S24-K28 WeakPolarHBondContact O-CB 3.31Å; S24-K28 WeakPolarHBondContact O-CG 3.29Å; S24-K28 PolarHBondContact O-N 3.48Å |
| 25 | K | 72.6 | Confident | 63.4 | Low | 145 Ų | 145 | 96.9 Ų | 96.9 | 63% | 0.63 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.8 | -46.6 | 176.7 | -76.6 | 177.5 | -179.2 | -179.8 | 0 | 111.7 | S21 I22 L23 K28 Q29 | S21-K25 WeakPolarHBondContact O-CG 3.22Å; S21-K25 PolarHBondContact O-N 2.92Å; S21-K25 VanDerWaalsContact O-N 3.07Å; I22-K25 PolarHBondContact O-N 3.39Å; I22-K25 VanDerWaalsContact O-N 3.13Å; L23-K25 PolarHBondContact O-N 3.2Å; K25-K28 PolarHBondContact O-N 2.92Å; K25-Q29 WeakPolarHBondContact O-CG 3.38Å; K25-Q29 PolarHBondContact O-N 3.43Å |
| 26 | L | 65.7 | Low | 63.8 | Low | 74 Ų | 74 | 99.1 Ų | 99.1 | 39% | 0.387 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.8 | -47.1 | 176.8 | -71.6 | 174.7 | 0 | 0 | 0 | 111 | I22 L23 K28 Q29 F30 | I22-L26 HydrophobicContact CG2-CD1 3.87Å; I22-L26 HydrophobicContact CG2-CG 4.23Å; I22-L26 WeakPolarHBondContact O-CG 3.31Å; I22-L26 PolarHBondContact O-N 3.48Å; L23-L26 PolarHBondContact O-N 2.96Å; L26-K28 VanDerWaalsContact C-N 3.28Å; L26-K28 PolarHBondContact O-N 3.07Å; L26-Q29 CarbonylContact O-C 3.58Å; L26-Q29 PolarHBondContact O-N 3.38Å; L26-Q29 VanDerWaalsContact O-N 3.09Å; L26-F30 HydrophobicContact CB-CD2 4.46Å; L26-F30 VanDerWaalsContact O-CD2 3.27Å; L26-F30 WeakPolarHBondContact O-CD2 3.37Å; L26-F30 PolarHBondContact O-N 3.26Å |
| 27 | T | 66.4 | Low | 64 | Low | 79 Ų | 79 | 101.8 Ų | 101.8 | 49% | 0.485 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60 | -38 | 177.8 | -60.6 | 0 | 0 | 0 | 0 | 112 | L23 S31 | L23-T27 WeakPolarHBondContact O-CB 3.46Å; L23-T27 PolarHBondContact O-N 3.47Å; L23-T27 PolarHBondContact O-OG1 2.99Å; T27-S31 VanDerWaalsContact O-CB 3.29Å; T27-S31 WeakPolarHBondContact O-CB 3.3Å; T27-S31 PolarHBondContact O-N 2.94Å; T27-S31 PolarHBondContact O-OG 3.34Å |
| 28 | K | 70.1 | Confident | 64.3 | Low | 150 Ų | 150 | 102.3 Ų | 102.3 | 65% | 0.652 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -67 | -41.5 | 174 | -74.6 | 179.5 | -178.1 | -176.5 | 0 | 112.1 | S24 K25 L26 S31 S32 | S24-K28 WeakPolarHBondContact O-CB 3.31Å; S24-K28 WeakPolarHBondContact O-CG 3.29Å; S24-K28 PolarHBondContact O-N 3.48Å; K25-K28 PolarHBondContact O-N 2.92Å; L26-K28 VanDerWaalsContact C-N 3.28Å; L26-K28 PolarHBondContact O-N 3.07Å; K28-S31 PolarHBondContact O-N 3.49Å; K28-S32 PolarHBondContact O-N 2.91Å; K28-S32 PolarHBondContact O-OG 3.44Å |
| 29 | Q | 67.5 | Low | 64.8 | Low | 115 Ų | 115 | 103.3 Ų | 103.3 | 54% | 0.537 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.4 | -40.8 | 175.6 | -73.1 | 179.1 | -39.9 | 0 | 0 | 112.4 | K25 L26 S32 L33 | K25-Q29 WeakPolarHBondContact O-CG 3.38Å; K25-Q29 PolarHBondContact O-N 3.43Å; L26-Q29 CarbonylContact O-C 3.58Å; L26-Q29 PolarHBondContact O-N 3.38Å; L26-Q29 VanDerWaalsContact O-N 3.09Å; Q29-S32 PolarHBondContact O-N 2.96Å; Q29-S32 PolarHBondContact O-OG 3.39Å; Q29-L33 WeakPolarHBondContact O-CB 3.19Å; Q29-L33 VanDerWaalsContact O-CG 3.28Å; Q29-L33 WeakPolarHBondContact O-CG 3.33Å; Q29-L33 PolarHBondContact O-N 3.34Å |
| 30 | F | 65.5 | Low | 64.8 | Low | 144 Ų | 144 | 106 Ų | 106 | 63% | 0.632 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65.3 | -40.4 | 173.6 | -86.8 | -72.1 | 0 | 0 | 0 | 111.8 | L26 L33 H34 | L26-F30 HydrophobicContact CB-CD2 4.46Å; L26-F30 VanDerWaalsContact O-CD2 3.27Å; L26-F30 WeakPolarHBondContact O-CD2 3.37Å; L26-F30 PolarHBondContact O-N 3.26Å; F30-L33 PolarHBondContact O-N 3.4Å; F30-H34 VanDerWaalsContact O-CB 3.28Å; F30-H34 WeakPolarHBondContact O-CB 3.25Å; F30-H34 PolarHBondContact O-N 3.35Å |
| 31 | S | 62.7 | Low | 64.6 | Low | 72 Ų | 72 | 101.3 Ų | 101.3 | 50% | 0.503 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.9 | -39.6 | 178.1 | -62.3 | 0 | 0 | 0 | 0 | 112.1 | T27 K28 H34 N35 | T27-S31 VanDerWaalsContact O-CB 3.29Å; T27-S31 WeakPolarHBondContact O-CB 3.3Å; T27-S31 PolarHBondContact O-N 2.94Å; T27-S31 PolarHBondContact O-OG 3.34Å; K28-S31 PolarHBondContact O-N 3.49Å; S31-H34 PolarHBondContact O-N 2.92Å; S31-N35 WeakPolarHBondContact O-CB 3.48Å; S31-N35 PolarHBondContact O-N 2.85Å |
| 32 | S | 65.8 | Low | 64.1 | Low | 62 Ų | 62 | 102.3 Ų | 102.3 | 43% | 0.434 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -67.8 | -42.5 | 175.3 | 63.1 | 0 | 0 | 0 | 0 | 111.8 | K28 Q29 H34 N35 L36 | K28-S32 PolarHBondContact O-N 2.91Å; K28-S32 PolarHBondContact O-OG 3.44Å; Q29-S32 PolarHBondContact O-N 2.96Å; Q29-S32 PolarHBondContact O-OG 3.39Å; S32-H34 PolarHBondContact O-N 3.05Å; S32-N35 PolarHBondContact O-N 2.98Å; S32-L36 WeakPolarHBondContact O-CB 3.42Å; S32-L36 WeakPolarHBondContact O-CG 3.38Å; S32-L36 PolarHBondContact O-N 2.99Å |
| 33 | L | 56.5 | Low | 63.6 | Low | 107 Ų | 107 | 101.8 Ų | 101.8 | 56% | 0.56 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.7 | -42.7 | 174.5 | -74.4 | 170.5 | 0 | 0 | 0 | 111.8 | Q29 F30 N35 L36 Q37 | Q29-L33 WeakPolarHBondContact O-CB 3.19Å; Q29-L33 VanDerWaalsContact O-CG 3.28Å; Q29-L33 WeakPolarHBondContact O-CG 3.33Å; Q29-L33 PolarHBondContact O-N 3.34Å; F30-L33 PolarHBondContact O-N 3.4Å; L33-N35 VanDerWaalsContact C-N 3.35Å; L33-N35 PolarHBondContact O-N 2.88Å; L33-L36 PolarHBondContact O-N 2.77Å; L33-Q37 WeakPolarHBondContact O-CB 3.49Å; L33-Q37 PolarHBondContact O-N 3.29Å |
| 34 | H | 57.9 | Low | 63.3 | Low | 103 Ų | 103 | 100 Ų | 100 | 48% | 0.477 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.9 | -36.3 | 177.2 | -171.1 | -120 | 0 | 0 | 0 | 112.1 | F30 S31 S32 Q37 K38 | F30-H34 VanDerWaalsContact O-CB 3.28Å; F30-H34 WeakPolarHBondContact O-CB 3.25Å; F30-H34 PolarHBondContact O-N 3.35Å; S31-H34 PolarHBondContact O-N 2.92Å; S32-H34 PolarHBondContact O-N 3.05Å; H34-Q37 PolarHBondContact O-N 3.5Å; H34-K38 WeakPolarHBondContact CE1-CE 3.38Å; H34-K38 WeakPolarHBondContact O-CG 3.18Å; H34-K38 PolarHBondContact O-N 2.85Å |
| 35 | N | 65.5 | Low | 62.7 | Low | 103 Ų | 103 | 102.6 Ų | 102.6 | 55% | 0.551 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -68.9 | -41.6 | 175.2 | -154.1 | 22.8 | 0 | 0 | 0 | 111.6 | S31 S32 L33 Q37 K38 V39 | S31-N35 WeakPolarHBondContact O-CB 3.48Å; S31-N35 PolarHBondContact O-N 2.85Å; S32-N35 PolarHBondContact O-N 2.98Å; L33-N35 VanDerWaalsContact C-N 3.35Å; L33-N35 PolarHBondContact O-N 2.88Å; N35-Q37 VanDerWaalsContact C-N 3.34Å; N35-Q37 PolarHBondContact O-N 2.82Å; N35-K38 WeakPolarHBondContact O-CB 3.34Å; N35-K38 PolarHBondContact O-N 3.45Å; N35-V39 WeakPolarHBondContact O-CG2 3.28Å; N35-V39 PolarHBondContact O-N 2.85Å |
| 36 | L | 60.3 | Low | 62.2 | Low | 116 Ų | 116 | 100 Ų | 100 | 61% | 0.607 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.4 | -42.1 | 172.6 | -75 | 170.6 | 0 | 0 | 0 | 111.7 | S32 L33 K38 V39 Y40 | S32-L36 WeakPolarHBondContact O-CB 3.42Å; S32-L36 WeakPolarHBondContact O-CG 3.38Å; S32-L36 PolarHBondContact O-N 2.99Å; L33-L36 PolarHBondContact O-N 2.77Å; L36-K38 VanDerWaalsContact C-N 3.34Å; L36-K38 PolarHBondContact O-N 3.47Å; L36-V39 PolarHBondContact O-N 3.48Å; L36-Y40 WeakPolarHBondContact O-CB 3.42Å; L36-Y40 PolarHBondContact O-N 2.94Å |
| 37 | Q | 58.4 | Low | 61.8 | Low | 124 Ų | 124 | 99.7 Ų | 99.7 | 58% | 0.579 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -62.5 | -42 | 175.9 | -166.1 | 177.7 | 5.1 | 0 | 0 | 111 | L33 H34 N35 Y40 T41 | L33-Q37 WeakPolarHBondContact O-CB 3.49Å; L33-Q37 PolarHBondContact O-N 3.29Å; H34-Q37 PolarHBondContact O-N 3.5Å; N35-Q37 VanDerWaalsContact C-N 3.34Å; N35-Q37 PolarHBondContact O-N 2.82Å; Q37-Y40 PolarHBondContact O-N 2.6Å; Q37-T41 VanDerWaalsContact O-CB 3.25Å; Q37-T41 WeakPolarHBondContact O-CB 3.28Å; Q37-T41 PolarHBondContact O-N 3.43Å; Q37-T41 PolarHBondContact O-OG1 3.48Å |
| 38 | K | 64 | Low | 61.7 | Low | 122 Ų | 122 | 104.2 Ų | 104.2 | 53% | 0.53 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -60.9 | -46.7 | 173.4 | -78.6 | -179.6 | 176.4 | -179.9 | 0 | 112.5 | H34 N35 L36 T41 S42 | H34-K38 WeakPolarHBondContact CE1-CE 3.38Å; H34-K38 WeakPolarHBondContact O-CG 3.18Å; H34-K38 PolarHBondContact O-N 2.85Å; N35-K38 WeakPolarHBondContact O-CB 3.34Å; N35-K38 PolarHBondContact O-N 3.45Å; L36-K38 VanDerWaalsContact C-N 3.34Å; L36-K38 PolarHBondContact O-N 3.47Å; K38-T41 PolarHBondContact O-N 2.83Å; K38-S42 WeakPolarHBondContact O-CB 3.4Å; K38-S42 PolarHBondContact O-N 2.93Å |
| 39 | V | 65.7 | Low | 61.5 | Low | 83 Ų | 83 | 103.3 Ų | 103.3 | 50% | 0.503 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.6 | -44 | 178.7 | 172.7 | 0 | 0 | 0 | 0 | 111.1 | N35 L36 S42 S43 | N35-V39 WeakPolarHBondContact O-CG2 3.28Å; N35-V39 PolarHBondContact O-N 2.85Å; L36-V39 PolarHBondContact O-N 3.48Å; V39-S42 PolarHBondContact O-N 3.49Å; V39-S43 VanDerWaalsContact O-CB 3.31Å; V39-S43 WeakPolarHBondContact O-CB 3.27Å; V39-S43 PolarHBondContact O-N 3.26Å; V39-S43 PolarHBondContact O-OG 2.89Å |
| 40 | Y | 59.9 | Low | 61.5 | Low | 153 Ų | 153 | 106.2 Ų | 106.2 | 60% | 0.6 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -65.2 | -45.3 | 178.2 | -169 | -100.4 | 0 | 0 | 0 | 111.6 | L36 Q37 S43 Q44 | L36-Y40 WeakPolarHBondContact O-CB 3.42Å; L36-Y40 PolarHBondContact O-N 2.94Å; Q37-Y40 PolarHBondContact O-N 2.6Å; Y40-S43 PolarHBondContact O-N 3.28Å; Y40-Q44 HydrophobicContact CD1-CG 3.99Å; Y40-Q44 HydrophobicContact CE1-CG 3.75Å; Y40-Q44 VanDerWaalsContact CZ-NE2 3.33Å; Y40-Q44 VanDerWaalsContact O-CB 3.3Å; Y40-Q44 WeakPolarHBondContact O-CB 3.4Å; Y40-Q44 VanDerWaalsContact O-CG 3.22Å; Y40-Q44 WeakPolarHBondContact O-CG 3.43Å; Y40-Q44 PolarHBondContact O-N 3.01Å; Y40-Q44 PolarHBondContact OH-NE2 2.84Å |
| 41 | T | 59.2 | Low | 61.9 | Low | 64 Ų | 64 | 106.1 Ų | 106.1 | 39% | 0.393 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -66.7 | -41.4 | 179 | -46.9 | 0 | 0 | 0 | 0 | 110.9 | Q37 K38 Q44 I45 | Q37-T41 VanDerWaalsContact O-CB 3.25Å; Q37-T41 WeakPolarHBondContact O-CB 3.28Å; Q37-T41 PolarHBondContact O-N 3.43Å; Q37-T41 PolarHBondContact O-OG1 3.48Å; K38-T41 PolarHBondContact O-N 2.83Å; T41-Q44 PolarHBondContact O-N 3.41Å; T41-I45 HydrophobicContact CG2-CD1 3.79Å; T41-I45 HydrophobicContact CG2-CG1 4.3Å; T41-I45 WeakPolarHBondContact O-CB 3.37Å; T41-I45 WeakPolarHBondContact O-CG1 3.33Å; T41-I45 PolarHBondContact O-N 3.49Å |
| 42 | S | 59.1 | Low | 62.5 | Low | 81 Ų | 81 | 109.5 Ų | 109.5 | 57% | 0.566 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -62.5 | -42.9 | 175.3 | -176.1 | 0 | 0 | 0 | 0 | 111.7 | K38 V39 N46 | K38-S42 WeakPolarHBondContact O-CB 3.4Å; K38-S42 PolarHBondContact O-N 2.93Å; V39-S42 PolarHBondContact O-N 3.49Å; S42-N46 WeakPolarHBondContact O-CB 3.34Å; S42-N46 PolarHBondContact O-N 3.36Å |
| 43 | S | 58.6 | Low | 63 | Low | 72 Ų | 72 | 110.1 Ų | 110.1 | 50% | 0.503 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -65.9 | -41.6 | 177.3 | -58.5 | 0 | 0 | 0 | 0 | 112.2 | V39 Y40 S47 | V39-S43 VanDerWaalsContact O-CB 3.31Å; V39-S43 WeakPolarHBondContact O-CB 3.27Å; V39-S43 PolarHBondContact O-N 3.26Å; V39-S43 PolarHBondContact O-OG 2.89Å; Y40-S43 PolarHBondContact O-N 3.28Å; S43-S47 PolarHBondContact O-N 3.49Å |
| 44 | Q | 57.9 | Low | 63.9 | Low | 74 Ų | 74 | 109.9 Ų | 109.9 | 35% | 0.346 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -67.1 | -44.9 | 176.7 | -78 | -91.4 | 0.9 | 0 | 0 | 112.5 | Y40 T41 N46 S47 R48 | Y40-Q44 HydrophobicContact CD1-CG 3.99Å; Y40-Q44 HydrophobicContact CE1-CG 3.75Å; Y40-Q44 VanDerWaalsContact CZ-NE2 3.33Å; Y40-Q44 VanDerWaalsContact O-CB 3.3Å; Y40-Q44 WeakPolarHBondContact O-CB 3.4Å; Y40-Q44 VanDerWaalsContact O-CG 3.22Å; Y40-Q44 WeakPolarHBondContact O-CG 3.43Å; Y40-Q44 PolarHBondContact O-N 3.01Å; Y40-Q44 PolarHBondContact OH-NE2 2.84Å; T41-Q44 PolarHBondContact O-N 3.41Å; Q44-N46 VanDerWaalsContact C-N 3.3Å; Q44-N46 PolarHBondContact O-N 2.9Å; Q44-S47 PolarHBondContact O-N 3.48Å; Q44-S47 PolarHBondContact O-OG 2.98Å; Q44-R48 WeakPolarHBondContact O-CB 3.5Å; Q44-R48 VanDerWaalsContact O-CG 3.31Å; Q44-R48 WeakPolarHBondContact O-CG 3.29Å; Q44-R48 PolarHBondContact O-N 3.39Å |
| 45 | I | 58.5 | Low | 65.1 | Low | 111 Ų | 111 | 111.5 Ų | 111.5 | 57% | 0.569 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -60.7 | -44.2 | 177.2 | -71 | 167.5 | 0 | 0 | 0 | 109.6 | T41 R48 F49 | T41-I45 HydrophobicContact CG2-CD1 3.79Å; T41-I45 HydrophobicContact CG2-CG1 4.3Å; T41-I45 WeakPolarHBondContact O-CB 3.37Å; T41-I45 WeakPolarHBondContact O-CG1 3.33Å; T41-I45 PolarHBondContact O-N 3.49Å; I45-R48 PolarHBondContact O-N 2.95Å; I45-F49 VanDerWaalsContact O-CB 3.29Å; I45-F49 WeakPolarHBondContact O-CB 3.49Å; I45-F49 PolarHBondContact O-N 3.31Å |
| 46 | N | 60.2 | Low | 65.7 | Low | 91 Ų | 91 | 110 Ų | 110 | 49% | 0.487 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.2 | -43.4 | 178.8 | -163.9 | -0.9 | 0 | 0 | 0 | 111.8 | S42 Q44 R48 F49 R50 | S42-N46 WeakPolarHBondContact O-CB 3.34Å; S42-N46 PolarHBondContact O-N 3.36Å; Q44-N46 VanDerWaalsContact C-N 3.3Å; Q44-N46 PolarHBondContact O-N 2.9Å; N46-R48 PolarHBondContact O-N 2.78Å; N46-F49 PolarHBondContact O-N 2.95Å; N46-R50 WeakPolarHBondContact O-CB 3.32Å; N46-R50 VanDerWaalsContact O-CG 3.28Å; N46-R50 WeakPolarHBondContact O-CG 3.19Å; N46-R50 PolarHBondContact O-N 3.02Å |
| 47 | S | 57.3 | Low | 66.8 | Low | 68 Ų | 68 | 109 Ų | 109 | 48% | 0.476 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.6 | -42.9 | 178.4 | 94.2 | 0 | 0 | 0 | 0 | 112.2 | S43 Q44 F49 R50 F51 | S43-S47 PolarHBondContact O-N 3.49Å; Q44-S47 PolarHBondContact O-N 3.48Å; Q44-S47 PolarHBondContact O-OG 2.98Å; S47-F49 VanDerWaalsContact C-N 3.34Å; S47-F49 PolarHBondContact O-N 3.3Å; S47-R50 PolarHBondContact O-N 3.37Å; S47-F51 WeakPolarHBondContact O-CB 2.99Å; S47-F51 PolarHBondContact O-N 2.84Å |
| 48 | R | 64.7 | Low | 67.5 | Low | 174 Ų | 174 | 106.3 Ų | 106.3 | 66% | 0.657 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.9 | -37 | 177.4 | -68 | -178.7 | 84.3 | 168.5 | 6.2 | 111.8 | Q44 I45 N46 K52 | Q44-R48 WeakPolarHBondContact O-CB 3.5Å; Q44-R48 VanDerWaalsContact O-CG 3.31Å; Q44-R48 WeakPolarHBondContact O-CG 3.29Å; Q44-R48 PolarHBondContact O-N 3.39Å; I45-R48 PolarHBondContact O-N 2.95Å; N46-R48 PolarHBondContact O-N 2.78Å; R48-K52 WeakPolarHBondContact O-CB 3.34Å; R48-K52 WeakPolarHBondContact O-CG 3.1Å; R48-K52 PolarHBondContact O-N 3.09Å |
| 49 | F | 66.3 | Low | 68 | Low | 131 Ų | 131 | 104.2 Ų | 104.2 | 58% | 0.575 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -67 | -46.8 | 175.8 | -171.9 | -106 | 0 | 0 | 0 | 111.6 | I45 N46 S47 F51 K52 I53 | I45-F49 VanDerWaalsContact O-CB 3.29Å; I45-F49 WeakPolarHBondContact O-CB 3.49Å; I45-F49 PolarHBondContact O-N 3.31Å; N46-F49 PolarHBondContact O-N 2.95Å; S47-F49 VanDerWaalsContact C-N 3.34Å; S47-F49 PolarHBondContact O-N 3.3Å; F49-F51 VanDerWaalsContact C-N 3.34Å; F49-F51 PolarHBondContact O-N 3.41Å; F49-K52 PolarHBondContact O-N 3.4Å; F49-I53 HydrophobicContact CD1-CD1 3.57Å; F49-I53 HydrophobicContact CE1-CD1 3.22Å; F49-I53 HydrophobicContact CE1-CG1 4.32Å; F49-I53 HydrophobicContact CE2-CD1 4.48Å; F49-I53 HydrophobicContact CG-CD1 4.35Å; F49-I53 HydrophobicContact CZ-CD1 3.74Å; F49-I53 HydrophobicContact CZ-CG1 4.49Å; F49-I53 WeakPolarHBondContact O-CG1 3.24Å; F49-I53 PolarHBondContact O-N 2.84Å |
| 50 | R | 67.9 | Low | 68.5 | Low | 175 Ų | 175 | 107.4 Ų | 107.4 | 66% | 0.66 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -61.7 | -40.7 | 175.7 | -69.5 | 177.9 | 77.4 | -175.1 | 4.9 | 112 | N46 S47 I53 L54 | N46-R50 WeakPolarHBondContact O-CB 3.32Å; N46-R50 VanDerWaalsContact O-CG 3.28Å; N46-R50 WeakPolarHBondContact O-CG 3.19Å; N46-R50 PolarHBondContact O-N 3.02Å; S47-R50 PolarHBondContact O-N 3.37Å; R50-I53 PolarHBondContact O-N 2.77Å; R50-L54 WeakPolarHBondContact O-CB 3.46Å; R50-L54 PolarHBondContact O-N 2.9Å |
| 51 | F | 73 | Confident | 69.1 | Low | 142 Ų | 142 | 103.1 Ų | 103.1 | 62% | 0.623 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -65 | -42.8 | 176.1 | -170 | -92.7 | 0 | 0 | 0 | 111.8 | S47 F49 I53 L54 Y55 | S47-F51 WeakPolarHBondContact O-CB 2.99Å; S47-F51 PolarHBondContact O-N 2.84Å; F49-F51 VanDerWaalsContact C-N 3.34Å; F49-F51 PolarHBondContact O-N 3.41Å; F51-I53 PolarHBondContact O-N 3.13Å; F51-L54 PolarHBondContact O-N 3.07Å; F51-Y55 VanDerWaalsContact O-CB 3.26Å; F51-Y55 WeakPolarHBondContact O-CB 3.02Å; F51-Y55 PolarHBondContact O-N 3.47Å |
| 52 | K | 75.1 | Confident | 69.6 | Low | 143 Ų | 143 | 103.6 Ų | 103.6 | 62% | 0.622 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -60.9 | -43.3 | 174.6 | -80.5 | -176.7 | 176.1 | -172.9 | 0 | 112.2 | R48 F49 Y55 S56 | R48-K52 WeakPolarHBondContact O-CB 3.34Å; R48-K52 WeakPolarHBondContact O-CG 3.1Å; R48-K52 PolarHBondContact O-N 3.09Å; F49-K52 PolarHBondContact O-N 3.4Å; K52-Y55 PolarHBondContact O-N 3.3Å; K52-S56 WeakPolarHBondContact O-CB 3.1Å; K52-S56 PolarHBondContact O-N 3.44Å; K52-S56 PolarHBondContact O-OG 2.91Å; K52-S56 VanDerWaalsContact O-OG 3.07Å |
| 53 | I | 76.1 | Confident | 69.9 | Low | 76 Ų | 76 | 104.3 Ų | 104.3 | 39% | 0.39 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.1 | -49.8 | 176.2 | -71.2 | 167.1 | 0 | 0 | 0 | 110.5 | F49 R50 F51 Y55 S56 I57 | F49-I53 HydrophobicContact CD1-CD1 3.57Å; F49-I53 HydrophobicContact CE1-CD1 3.22Å; F49-I53 HydrophobicContact CE1-CG1 4.32Å; F49-I53 HydrophobicContact CE2-CD1 4.48Å; F49-I53 HydrophobicContact CG-CD1 4.35Å; F49-I53 HydrophobicContact CZ-CD1 3.74Å; F49-I53 HydrophobicContact CZ-CG1 4.49Å; F49-I53 WeakPolarHBondContact O-CG1 3.24Å; F49-I53 PolarHBondContact O-N 2.84Å; R50-I53 PolarHBondContact O-N 2.77Å; F51-I53 PolarHBondContact O-N 3.13Å; I53-Y55 VanDerWaalsContact C-N 3.33Å; I53-Y55 PolarHBondContact O-N 3.32Å; I53-S56 PolarHBondContact O-N 3.17Å; I53-I57 HydrophobicContact CG2-CD1 3.68Å; I53-I57 HydrophobicContact CG2-CG1 4.38Å; I53-I57 VanDerWaalsContact O-CG1 3.31Å; I53-I57 WeakPolarHBondContact O-CG1 3.11Å; I53-I57 PolarHBondContact O-N 3.2Å |
| 54 | L | 76.1 | Confident | 69.8 | Low | 102 Ų | 102 | 108.1 Ų | 108.1 | 53% | 0.534 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.5 | -43.8 | 179.8 | -175 | 63.8 | 0 | 0 | 0 | 111.4 | R50 F51 S56 I57 C58 | R50-L54 WeakPolarHBondContact O-CB 3.46Å; R50-L54 PolarHBondContact O-N 2.9Å; F51-L54 PolarHBondContact O-N 3.07Å; L54-S56 PolarHBondContact O-N 2.91Å; L54-I57 PolarHBondContact O-N 2.97Å; L54-C58 WeakPolarHBondContact O-CB 3.48Å; L54-C58 PolarHBondContact O-N 2.82Å; L54-C58 PolarHBondContact O-SG 3.35Å |
| 55 | Y | 83.1 | Confident | 69.8 | Low | 137 Ų | 137 | 112 Ų | 112 | 54% | 0.537 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -59.9 | -45.6 | 174.9 | -179.6 | -96.4 | 0 | 0 | 0 | 111.8 | F51 K52 I53 I57 C58 L59 | F51-Y55 VanDerWaalsContact O-CB 3.26Å; F51-Y55 WeakPolarHBondContact O-CB 3.02Å; F51-Y55 PolarHBondContact O-N 3.47Å; K52-Y55 PolarHBondContact O-N 3.3Å; I53-Y55 VanDerWaalsContact C-N 3.33Å; I53-Y55 PolarHBondContact O-N 3.32Å; Y55-I57 VanDerWaalsContact C-N 3.34Å; Y55-I57 PolarHBondContact O-N 2.82Å; Y55-C58 PolarHBondContact O-N 3.13Å; Y55-L59 HydrophobicContact CE1-CD2 4.04Å; Y55-L59 WeakPolarHBondContact O-CB 3.48Å; Y55-L59 PolarHBondContact O-N 3.03Å |
| 56 | S | 78.3 | Confident | 69.5 | Low | 71 Ų | 71 | 117.2 Ų | 117.2 | 50% | 0.497 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -63.1 | -38.5 | 176.5 | -66.4 | 0 | 0 | 0 | 0 | 112.6 | K52 I53 L54 Y60 | K52-S56 WeakPolarHBondContact O-CB 3.1Å; K52-S56 PolarHBondContact O-N 3.44Å; K52-S56 PolarHBondContact O-OG 2.91Å; K52-S56 VanDerWaalsContact O-OG 3.07Å; I53-S56 PolarHBondContact O-N 3.17Å; L54-S56 PolarHBondContact O-N 2.91Å; S56-Y60 VanDerWaalsContact O-CB 3.26Å; S56-Y60 WeakPolarHBondContact O-CB 3.43Å; S56-Y60 PolarHBondContact O-N 3.46Å |
| 57 | I | 82.9 | Confident | 70 | Confident | 96 Ų | 96 | 118.5 Ų | 118.5 | 49% | 0.492 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -66.1 | -49.1 | 175.2 | -66.4 | 165.8 | 0 | 0 | 0 | 110 | I53 L54 Y55 L59 Y60 S61 | I53-I57 HydrophobicContact CG2-CD1 3.68Å; I53-I57 HydrophobicContact CG2-CG1 4.38Å; I53-I57 VanDerWaalsContact O-CG1 3.31Å; I53-I57 WeakPolarHBondContact O-CG1 3.11Å; I53-I57 PolarHBondContact O-N 3.2Å; L54-I57 PolarHBondContact O-N 2.97Å; Y55-I57 VanDerWaalsContact C-N 3.34Å; Y55-I57 PolarHBondContact O-N 2.82Å; I57-L59 VanDerWaalsContact C-N 3.3Å; I57-L59 PolarHBondContact O-N 2.94Å; I57-Y60 PolarHBondContact O-N 2.81Å; I57-S61 WeakPolarHBondContact O-CB 3.22Å; I57-S61 PolarHBondContact O-N 3.29Å; I57-S61 PolarHBondContact O-OG 3.39Å |
| 58 | C | 72.9 | Confident | 70.7 | Confident | 66 Ų | 66 | 121.2 Ų | 121.2 | 45% | 0.446 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -59.3 | -41.8 | 176.8 | -71.4 | 0 | 0 | 0 | 0 | 111.7 | L54 Y55 S62 | L54-C58 WeakPolarHBondContact O-CB 3.48Å; L54-C58 PolarHBondContact O-N 2.82Å; L54-C58 PolarHBondContact O-SG 3.35Å; Y55-C58 PolarHBondContact O-N 3.13Å; C58-S62 WeakPolarHBondContact O-CB 3.21Å; C58-S62 PolarHBondContact O-N 3.36Å; C58-S62 PolarHBondContact O-OG 2.95Å |
| 59 | L | 74.3 | Confident | 71 | Confident | 79 Ų | 79 | 118.2 Ų | 118.2 | 41% | 0.414 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -67.1 | -41.4 | 177.9 | -172.7 | 67.6 | 0 | 0 | 0 | 111.4 | Y55 I57 S62 N63 | Y55-L59 HydrophobicContact CE1-CD2 4.04Å; Y55-L59 WeakPolarHBondContact O-CB 3.48Å; Y55-L59 PolarHBondContact O-N 3.03Å; I57-L59 VanDerWaalsContact C-N 3.3Å; I57-L59 PolarHBondContact O-N 2.94Å; L59-S62 PolarHBondContact O-N 2.92Å; L59-N63 WeakPolarHBondContact O-CB 3.3Å; L59-N63 PolarHBondContact O-N 3.09Å; L59-N63 PolarHBondContact O-ND2 2.88Å |
| 60 | Y | 77.6 | Confident | 71.3 | Confident | 150 Ų | 150 | 117.5 Ų | 117.5 | 59% | 0.588 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -65.6 | -45.4 | 175.6 | -178.8 | -99.5 | 0 | 0 | 0 | 111.7 | S56 I57 S62 N63 K64 | S56-Y60 VanDerWaalsContact O-CB 3.26Å; S56-Y60 WeakPolarHBondContact O-CB 3.43Å; S56-Y60 PolarHBondContact O-N 3.46Å; I57-Y60 PolarHBondContact O-N 2.81Å; Y60-S62 VanDerWaalsContact C-N 3.31Å; Y60-S62 PolarHBondContact O-N 2.9Å; Y60-N63 PolarHBondContact O-N 3.49Å; Y60-K64 HydrophobicContact CE1-CD 4.11Å; Y60-K64 WeakPolarHBondContact O-CB 3.25Å; Y60-K64 PolarHBondContact O-N 2.93Å |
| 61 | S | 72.1 | Confident | 71.5 | Confident | 62 Ų | 62 | 113.9 Ų | 113.9 | 43% | 0.434 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -61.9 | -38.1 | 175.9 | -68.1 | 0 | 0 | 0 | 0 | 112.3 | I57 L65 | I57-S61 WeakPolarHBondContact O-CB 3.22Å; I57-S61 PolarHBondContact O-N 3.29Å; I57-S61 PolarHBondContact O-OG 3.39Å; S61-L65 PolarHBondContact O-N 3.27Å |
| 62 | S | 69.6 | Low | 71.4 | Confident | 74 Ų | 74 | 112 Ų | 112 | 52% | 0.517 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -69.4 | -41 | 177.7 | -56.6 | 0 | 0 | 0 | 0 | 111.9 | C58 L59 Y60 K64 L65 | C58-S62 WeakPolarHBondContact O-CB 3.21Å; C58-S62 PolarHBondContact O-N 3.36Å; C58-S62 PolarHBondContact O-OG 2.95Å; L59-S62 PolarHBondContact O-N 2.92Å; Y60-S62 VanDerWaalsContact C-N 3.31Å; Y60-S62 PolarHBondContact O-N 2.9Å; S62-K64 VanDerWaalsContact C-N 3.34Å; S62-L65 PolarHBondContact O-N 3.01Å |
| 63 | N | 64.9 | Low | 71.1 | Confident | 97 Ų | 97 | 109.8 Ų | 109.8 | 52% | 0.519 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -73 | -24.2 | 177.8 | -77.5 | -64.4 | 0 | 0 | 0 | 113.5 | L59 Y60 L65 | L59-N63 WeakPolarHBondContact O-CB 3.3Å; L59-N63 PolarHBondContact O-N 3.09Å; L59-N63 PolarHBondContact O-ND2 2.88Å; Y60-N63 PolarHBondContact O-N 3.49Å; N63-L65 VanDerWaalsContact C-N 3.32Å |
| 64 | K | 56.6 | Low | 70.7 | Confident | 152 Ų | 152 | 112.4 Ų | 112.4 | 66% | 0.661 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -79.9 | -15.8 | 175.5 | -169.4 | 167.9 | -178.9 | 174.2 | 0 | 113.1 | Y60 S62 | Y60-K64 HydrophobicContact CE1-CD 4.11Å; Y60-K64 WeakPolarHBondContact O-CB 3.25Å; Y60-K64 PolarHBondContact O-N 2.93Å; S62-K64 VanDerWaalsContact C-N 3.34Å |
| 65 | L | 58.3 | Low | 70.3 | Confident | 156 Ų | 156 | 113.3 Ų | 113.3 | 82% | 0.817 | 58% | 0.583 | S | S | * | * | trans | -87.8 | -8.8 | 174.4 | -96.8 | 157.3 | 0 | 0 | 0 | 113 | S61 S62 N63 | S61-L65 PolarHBondContact O-N 3.27Å; S62-L65 PolarHBondContact O-N 3.01Å; N63-L65 VanDerWaalsContact C-N 3.32Å | ||
| 66 | M | 53 | Low | 69.1 | Low | 219 Ų | 219 | 111.1 Ų | 111.1 | 100% | 1.079 | 59% | 0.588 | S | S | * | * | trans | -93.9 | 0 | 165.4 | -76.8 | -174.4 | 134.7 | 0 | 0 | 110.1 |
Retrieved 66 of 66 residues in 125.8 ms
(Link to these results)