| 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 | 52.1 | Low | 239 Ų | 239 | 149.2 Ų | 149.2 | 100% | 1.177 | 80% | 0.801 | S | S | * | * | 0 | 100.6 | 0 | -94.9 | 105.4 | 114.7 | 0 | 0 | 108.5 | |||||
| 2 | N | 50.4 | Low | 52.4 | Low | 147 Ų | 147 | 143.5 Ų | 143.5 | 79% | 0.786 | 78% | 0.776 | S | S | * | * | trans | -97.3 | 106.5 | 166.9 | -68.7 | -9.1 | 0 | 0 | 0 | 106.5 | Y4 | N2-Y4 PolarHBondContact O-N 3.42Å; N2-Y4 VanDerWaalsContact O-N 3.14Å | ||
| 3 | H | 52.6 | Low | 52.5 | Low | 183 Ų | 183 | 134.4 Ų | 134.4 | 85% | 0.847 | 73% | 0.729 | S | S | * | * | trans | -77.7 | 93.1 | 173.5 | -166.9 | 74.9 | 0 | 0 | 0 | 107 | ||||
| 4 | Y | 54.4 | Low | 52.7 | Low | 195 Ų | 195 | 133.6 Ų | 133.6 | 77% | 0.765 | 72% | 0.718 | S | S | * | * | P | Polyproline II helix | trans | -71 | 124.6 | 168.7 | -98.3 | -87.9 | 0 | 0 | 0 | 107.8 | N2 S6 | N2-Y4 PolarHBondContact O-N 3.42Å; N2-Y4 VanDerWaalsContact O-N 3.14Å; Y4-S6 PolarHBondContact O-N 3.23Å |
| 5 | P | 55.6 | Low | 53 | Low | 99 Ų | 99 | 128.8 Ų | 128.8 | 64% | 0.643 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 123 | 174.8 | 26.7 | -31 | 0 | 0 | 0 | 107.9 | V7 | P5-V7 PolarHBondContact O-N 3.42Š|
| 6 | S | 54.7 | Low | 53 | Low | 104 Ų | 104 | 132.4 Ų | 132.4 | 73% | 0.727 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 120.9 | 170.6 | -74.3 | 0 | 0 | 0 | 0 | 108.7 | Y4 T8 | Y4-S6 PolarHBondContact O-N 3.23Å; S6-T8 WeakPolarHBondContact CB-OG1 3.43Å; S6-T8 PolarHBondContact O-N 3.13Å |
| 7 | V | 58.1 | Low | 53.3 | Low | 138 Ų | 138 | 126.9 Ų | 126.9 | 84% | 0.836 | 68% | 0.678 | S | S | * | * | trans | -66.5 | 23.3 | 180 | -70 | 0 | 0 | 0 | 0 | 114 | P5 S9 | P5-V7 PolarHBondContact O-N 3.42Å; V7-S9 VanDerWaalsContact C-N 3.33Å; V7-S9 PolarHBondContact O-N 3.39Å | ||
| 8 | T | 57 | Low | 53.5 | Low | 113 Ų | 113 | 132.3 Ų | 132.3 | 69% | 0.693 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.9 | 18.9 | -164.2 | -25.9 | 0 | 0 | 0 | 0 | 114.2 | S6 | S6-T8 WeakPolarHBondContact CB-OG1 3.43Å; S6-T8 PolarHBondContact O-N 3.13Å |
| 9 | S | 48.7 | Very low | 53.9 | Low | 119 Ų | 119 | 128.7 Ų | 128.7 | 83% | 0.832 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -145.9 | 13.1 | 177.9 | -59.7 | 0 | 0 | 0 | 0 | 116.2 | V7 E11 | V7-S9 VanDerWaalsContact C-N 3.33Å; V7-S9 PolarHBondContact O-N 3.39Å; S9-E11 PolarHBondContact O-N 3.33Å |
| 10 | L | 51.1 | Low | 54.1 | Low | 154 Ų | 154 | 127 Ų | 127 | 81% | 0.806 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -83.7 | 110.7 | 157.3 | -98.5 | 99.4 | 0 | 0 | 0 | 107.7 | T12 | L10-T12 PolarHBondContact O-N 3.33Š|
| 11 | E | 51 | Low | 54.7 | Low | 150 Ų | 150 | 125.5 Ų | 125.5 | 70% | 0.701 | 68% | 0.684 | S | S | * | * | trans | -37.4 | 113.1 | 163.7 | -122.8 | -176.5 | 117.1 | 0 | 0 | 108.8 | S9 | S9-E11 PolarHBondContact O-N 3.33Š| ||
| 12 | T | 55.5 | Low | 55.7 | Low | 81 Ų | 81 | 119.3 Ų | 119.3 | 50% | 0.497 | 66% | 0.662 | S | S | . | * | trans | -63.1 | 135 | 176.8 | 51.1 | 0 | 0 | 0 | 0 | 107.7 | L10 E14 A15 | L10-T12 PolarHBondContact O-N 3.33Å; T12-E14 PolarHBondContact O-N 3.37Å; T12-A15 WeakPolarHBondContact O-CB 3.28Å; T12-A15 PolarHBondContact O-N 2.81Å | ||
| 13 | P | 53.2 | Low | 56.3 | Low | 25 Ų | 25 | 116.2 Ų | 116.2 | 16% | 0.162 | 65% | 0.65 | C | S | . | * | H | α-helix | trans | -53.6 | -23.4 | 176.4 | 32.3 | -46.4 | 0 | 0 | 0 | 112.2 | A15 R16 C17 Y34 | P13-A15 VanDerWaalsContact C-N 3.32Å; P13-R16 PolarHBondContact O-N 3.41Å; P13-C17 PolarHBondContact O-N 2.94Å; P13-C17 PolarHBondContact O-SG 3.09Å; P13-Y34 HydrophobicContact CB-CD2 4.18Å; P13-Y34 HydrophobicContact CB-CE2 3.61Å; P13-Y34 HydrophobicContact CG-CD1 4.03Å; P13-Y34 HydrophobicContact CG-CD2 3.53Å; P13-Y34 HydrophobicContact CG-CE1 3.69Å; P13-Y34 HydrophobicContact CG-CE2 3.26Å; P13-Y34 HydrophobicContact CG-CG 3.97Å |
| 14 | E | 56.3 | Low | 57 | Low | 123 Ų | 123 | 113 Ų | 113 | 58% | 0.575 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -66.4 | -33.7 | -179.3 | -49 | -169.3 | -171.3 | 0 | 0 | 111.7 | T12 R16 C17 R18 | T12-E14 PolarHBondContact O-N 3.37Å; E14-R16 VanDerWaalsContact C-N 3.28Å; E14-R16 PolarHBondContact O-N 2.82Å; E14-C17 PolarHBondContact O-N 2.89Å; E14-R18 PolarHBondContact O-N 3.38Å |
| 15 | A | 56.3 | Low | 57.7 | Low | 62 Ų | 62 | 109.1 Ų | 109.1 | 51% | 0.512 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -67 | -31.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | T12 P13 | T12-A15 WeakPolarHBondContact O-CB 3.28Å; T12-A15 PolarHBondContact O-N 2.81Å; P13-A15 VanDerWaalsContact C-N 3.32Å |
| 16 | R | 54.1 | Low | 58.3 | Low | 186 Ų | 186 | 106.4 Ų | 106.4 | 70% | 0.702 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -81.7 | -29.7 | 179.1 | -160 | 140.1 | -172.8 | 163.3 | 0.5 | 113 | P13 E14 R18 S19 | P13-R16 PolarHBondContact O-N 3.41Å; E14-R16 VanDerWaalsContact C-N 3.28Å; E14-R16 PolarHBondContact O-N 2.82Å; R16-R18 VanDerWaalsContact C-N 3.32Å; R16-S19 PolarHBondContact O-OG 3.46Å |
| 17 | C | 57.4 | Low | 59 | Low | 39 Ų | 39 | 102 Ų | 102 | 26% | 0.264 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -78.3 | -13.8 | 179.7 | -59.3 | 0 | 0 | 0 | 0 | 113.7 | P13 E14 C27 | P13-C17 PolarHBondContact O-N 2.94Å; P13-C17 PolarHBondContact O-SG 3.09Å; E14-C17 PolarHBondContact O-N 2.89Å; C17-C27 VanDerWaalsContact SG-CB 3.57Å; C17-C27 PolarHBondContact SG-SG 3.12Å |
| 18 | R | 57.9 | Low | 59.5 | Low | 224 Ų | 224 | 104.1 Ų | 104.1 | 85% | 0.845 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.4 | -1.7 | 174.3 | -86.2 | -170.8 | -170.2 | -177.1 | 5.9 | 115.2 | E14 R16 G20 | E14-R18 PolarHBondContact O-N 3.38Å; R16-R18 VanDerWaalsContact C-N 3.32Å; R18-G20 PolarHBondContact O-N 3.41Å |
| 19 | S | 60.4 | Low | 60.4 | Low | 65 Ų | 65 | 104.5 Ų | 104.5 | 46% | 0.455 | 58% | 0.579 | S | S | . | * | S | Bend | trans | -65 | 132.5 | 163.3 | 64.3 | 0 | 0 | 0 | 0 | 107.4 | R16 V21 | R16-S19 PolarHBondContact O-OG 3.46Å; S19-V21 PolarHBondContact O-N 3.26Å |
| 20 | G | 58.6 | Low | 61.5 | Low | 93 Ų | 93 | 105.1 Ų | 105.1 | 96% | 0.959 | 56% | 0.563 | S | S | * | * | S | Bend | trans | -64.9 | 30 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | R18 | R18-G20 PolarHBondContact O-N 3.41Š|
| 21 | V | 65.8 | Low | 62.5 | Low | 97 Ų | 97 | 103.1 Ų | 103.1 | 59% | 0.588 | 55% | 0.549 | S | S | * | . | S | Bend | trans | -92 | 136.9 | 176.4 | -172.7 | 0 | 0 | 0 | 0 | 107.7 | S19 | S19-V21 PolarHBondContact O-N 3.26Š|
| 22 | P | 61.1 | Low | 63.8 | Low | 108 Ų | 108 | 98.6 Ų | 98.6 | 70% | 0.701 | 54% | 0.535 | S | S | * | . | P | Polyproline II helix | trans | -54.1 | 135.5 | 177.9 | 21.1 | -32.7 | 0 | 0 | 0 | 110.6 | L24 | P22-L24 PolarHBondContact O-N 3.1Å; P22-L24 VanDerWaalsContact O-N 3.16Å |
| 23 | P | 62.7 | Low | 65.3 | Low | 82 Ų | 82 | 98.3 Ų | 98.3 | 53% | 0.532 | 53% | 0.529 | S | S | . | . | P | Polyproline II helix | trans | -62.5 | 122.1 | -171.7 | 22.9 | -31.8 | 0 | 0 | 0 | 110 | C27 | P23-C27 HydrophobicContact CB-CB 4.23Š|
| 24 | L | 67.5 | Low | 66.9 | Low | 116 Ų | 116 | 101.8 Ų | 101.8 | 61% | 0.607 | 54% | 0.54 | S | S | * | . | P | Polyproline II helix | trans | -57.2 | 148.4 | 168.9 | -67.8 | 170.7 | 0 | 0 | 0 | 108.9 | P22 A26 C27 | P22-L24 PolarHBondContact O-N 3.1Å; P22-L24 VanDerWaalsContact O-N 3.16Å; L24-A26 PolarHBondContact O-N 3.14Å; L24-C27 WeakPolarHBondContact O-CB 3.31Å; L24-C27 PolarHBondContact O-N 3Å |
| 25 | P | 68.3 | Low | 68.4 | Low | 114 Ų | 114 | 98 Ų | 98 | 74% | 0.74 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -55.1 | -26.8 | 176.6 | 19.3 | -30.8 | 0 | 0 | 0 | 112.7 | C27 Q29 | P25-C27 VanDerWaalsContact C-N 3.32Å; P25-C27 PolarHBondContact O-N 3.01Å; P25-Q29 PolarHBondContact O-N 3.26Å |
| 26 | A | 69.3 | Low | 70.2 | Confident | 41 Ų | 41 | 100.6 Ų | 100.6 | 34% | 0.339 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.5 | -26.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | L24 R30 | L24-A26 PolarHBondContact O-N 3.14Å; A26-R30 WeakPolarHBondContact O-CB 3.36Å; A26-R30 WeakPolarHBondContact O-CD 3.41Å; A26-R30 WeakPolarHBondContact O-CG 3.28Å; A26-R30 PolarHBondContact O-N 2.7Å; A26-R30 VanDerWaalsContact O-N 3.08Å |
| 27 | C | 68.3 | Low | 72.1 | Confident | 13 Ų | 13 | 95.7 Ų | 95.7 | 9% | 0.088 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -70.8 | -44.8 | 179 | -61.5 | 0 | 0 | 0 | 0 | 111.3 | C17 P23 L24 P25 Q29 R30 E31 | C17-C27 VanDerWaalsContact SG-CB 3.57Å; C17-C27 PolarHBondContact SG-SG 3.12Å; P23-C27 HydrophobicContact CB-CB 4.23Å; L24-C27 WeakPolarHBondContact O-CB 3.31Å; L24-C27 PolarHBondContact O-N 3Å; P25-C27 VanDerWaalsContact C-N 3.32Å; P25-C27 PolarHBondContact O-N 3.01Å; C27-Q29 PolarHBondContact O-N 2.87Å; C27-R30 PolarHBondContact O-N 3.4Å; C27-R30 VanDerWaalsContact O-N 3.17Å; C27-E31 WeakPolarHBondContact O-CG 3.33Å; C27-E31 PolarHBondContact O-N 2.9Å |
| 28 | R | 69.5 | Low | 73.7 | Confident | 182 Ų | 182 | 98.5 Ų | 98.5 | 69% | 0.687 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.7 | -42.8 | 177.2 | -68.6 | -170.4 | 173.7 | -159.8 | -1.5 | 112.5 | R30 E31 S32 | R28-R30 VanDerWaalsContact C-N 3.31Å; R28-E31 PolarHBondContact O-N 3.45Å; R28-S32 PolarHBondContact O-N 2.89Å |
| 29 | Q | 74.8 | Confident | 75.5 | Confident | 121 Ų | 121 | 92.2 Ų | 92.2 | 57% | 0.565 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -67.2 | -34.9 | 177.1 | -172.2 | 64.8 | 9.7 | 0 | 0 | 111.8 | P25 C27 S32 I33 | P25-Q29 PolarHBondContact O-N 3.26Å; C27-Q29 PolarHBondContact O-N 2.87Å; Q29-S32 PolarHBondContact O-OG 3.49Å; Q29-I33 HydrophobicContact CG-CD1 4.1Å; Q29-I33 WeakPolarHBondContact O-CD1 3.27Å; Q29-I33 VanDerWaalsContact O-CG1 3.22Å; Q29-I33 WeakPolarHBondContact O-CG1 3.24Å; Q29-I33 PolarHBondContact O-N 3.45Å |
| 30 | R | 71.8 | Confident | 77.1 | Confident | 132 Ų | 132 | 95.6 Ų | 95.6 | 50% | 0.498 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.5 | -51.8 | 174 | -78.7 | 172.8 | -172.6 | 148.6 | 1.4 | 110.3 | A26 C27 R28 S32 I33 Y34 | A26-R30 WeakPolarHBondContact O-CB 3.36Å; A26-R30 WeakPolarHBondContact O-CD 3.41Å; A26-R30 WeakPolarHBondContact O-CG 3.28Å; A26-R30 PolarHBondContact O-N 2.7Å; A26-R30 VanDerWaalsContact O-N 3.08Å; C27-R30 PolarHBondContact O-N 3.4Å; C27-R30 VanDerWaalsContact O-N 3.17Å; R28-R30 VanDerWaalsContact C-N 3.31Å; R30-S32 VanDerWaalsContact C-N 3.25Å; R30-S32 PolarHBondContact O-N 3.44Å; R30-I33 CarbonylContact O-C 3.56Å; R30-I33 WeakPolarHBondContact O-CA 3.41Å; R30-I33 PolarHBondContact O-N 2.87Å; R30-Y34 HydrophobicContact CB-CD2 4Å; R30-Y34 HydrophobicContact CB-CE2 3.88Å; R30-Y34 HydrophobicContact CG-CE2 4.25Å; R30-Y34 WeakPolarHBondContact O-CD2 3.3Å; R30-Y34 PolarHBondContact O-N 2.91Å |
| 31 | E | 72.7 | Confident | 78.9 | Confident | 111 Ų | 111 | 95.5 Ų | 95.5 | 52% | 0.519 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -51.8 | -42.3 | 179.6 | -74.7 | 167.1 | -168.3 | 0 | 0 | 112.7 | C27 R28 Y34 G35 | C27-E31 WeakPolarHBondContact O-CG 3.33Å; C27-E31 PolarHBondContact O-N 2.9Å; R28-E31 PolarHBondContact O-N 3.45Å; E31-Y34 PolarHBondContact O-N 3.22Å; E31-G35 PolarHBondContact O-N 3.21Å |
| 32 | S | 77.9 | Confident | 80.3 | Confident | 56 Ų | 56 | 94.9 Ų | 94.9 | 39% | 0.392 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.4 | -42.9 | 175.4 | 65.4 | 0 | 0 | 0 | 0 | 112.6 | R28 Q29 R30 G35 L36 | R28-S32 PolarHBondContact O-N 2.89Å; Q29-S32 PolarHBondContact O-OG 3.49Å; R30-S32 VanDerWaalsContact C-N 3.25Å; R30-S32 PolarHBondContact O-N 3.44Å; S32-G35 PolarHBondContact O-N 3.2Å; S32-L36 VanDerWaalsContact O-CG 3.31Å; S32-L36 WeakPolarHBondContact O-CG 3.46Å; S32-L36 PolarHBondContact O-N 3.05Å |
| 33 | I | 87.7 | Confident | 82 | Confident | 74 Ų | 74 | 93.5 Ų | 93.5 | 38% | 0.379 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64.8 | -43.6 | 176.6 | -67.9 | 167.2 | 0 | 0 | 0 | 111.2 | Q29 R30 G35 L36 I37 | Q29-I33 HydrophobicContact CG-CD1 4.1Å; Q29-I33 WeakPolarHBondContact O-CD1 3.27Å; Q29-I33 VanDerWaalsContact O-CG1 3.22Å; Q29-I33 WeakPolarHBondContact O-CG1 3.24Å; Q29-I33 PolarHBondContact O-N 3.45Å; R30-I33 CarbonylContact O-C 3.56Å; R30-I33 WeakPolarHBondContact O-CA 3.41Å; R30-I33 PolarHBondContact O-N 2.87Å; I33-G35 PolarHBondContact O-N 2.86Å; I33-L36 PolarHBondContact O-N 3.09Å; I33-I37 HydrophobicContact CG2-CD1 3.68Å; I33-I37 HydrophobicContact CG2-CG1 4.26Å; I33-I37 VanDerWaalsContact O-CG1 3.29Å; I33-I37 WeakPolarHBondContact O-CG1 3.35Å; I33-I37 PolarHBondContact O-N 2.91Å |
| 34 | Y | 85.8 | Confident | 83.5 | Confident | 98 Ų | 98 | 93 Ų | 93 | 38% | 0.384 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63.4 | -41.3 | 177.9 | -78.3 | -79.6 | 0 | 0 | 0 | 111.5 | P13 R30 E31 L36 I37 E38 | P13-Y34 HydrophobicContact CB-CD2 4.18Å; P13-Y34 HydrophobicContact CB-CE2 3.61Å; P13-Y34 HydrophobicContact CG-CD1 4.03Å; P13-Y34 HydrophobicContact CG-CD2 3.53Å; P13-Y34 HydrophobicContact CG-CE1 3.69Å; P13-Y34 HydrophobicContact CG-CE2 3.26Å; P13-Y34 HydrophobicContact CG-CG 3.97Å; R30-Y34 HydrophobicContact CB-CD2 4Å; R30-Y34 HydrophobicContact CB-CE2 3.88Å; R30-Y34 HydrophobicContact CG-CE2 4.25Å; R30-Y34 WeakPolarHBondContact O-CD2 3.3Å; R30-Y34 PolarHBondContact O-N 2.91Å; E31-Y34 PolarHBondContact O-N 3.22Å; Y34-L36 VanDerWaalsContact C-N 3.33Å; Y34-L36 PolarHBondContact O-N 2.97Å; Y34-I37 PolarHBondContact O-N 3.22Å; Y34-E38 WeakPolarHBondContact O-CB 3.45Å; Y34-E38 PolarHBondContact O-N 3.49Å |
| 35 | G | 88.9 | Confident | 84.8 | Confident | 45 Ų | 45 | 93.6 Ų | 93.6 | 46% | 0.464 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -60.9 | -39.8 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | E31 S32 I33 L39 | E31-G35 PolarHBondContact O-N 3.21Å; S32-G35 PolarHBondContact O-N 3.2Å; I33-G35 PolarHBondContact O-N 2.86Å; G35-L39 WeakPolarHBondContact O-CB 3.2Å; G35-L39 PolarHBondContact O-N 3.36Å; G35-L39 VanDerWaalsContact O-N 3.08Å |
| 36 | L | 93.9 | Very high | 85.9 | Confident | 116 Ų | 116 | 96.6 Ų | 96.6 | 61% | 0.607 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -67.7 | -40.1 | 175.2 | -71.2 | 174.4 | 0 | 0 | 0 | 112.6 | S32 I33 Y34 L39 F40 | S32-L36 VanDerWaalsContact O-CG 3.31Å; S32-L36 WeakPolarHBondContact O-CG 3.46Å; S32-L36 PolarHBondContact O-N 3.05Å; I33-L36 PolarHBondContact O-N 3.09Å; Y34-L36 VanDerWaalsContact C-N 3.33Å; Y34-L36 PolarHBondContact O-N 2.97Å; L36-L39 PolarHBondContact O-N 3.48Å; L36-F40 WeakPolarHBondContact O-CB 3.26Å; L36-F40 PolarHBondContact O-N 2.88Å |
| 37 | I | 93.3 | Very high | 87.1 | Confident | 82 Ų | 82 | 100 Ų | 100 | 42% | 0.421 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64 | -46 | 177 | -70.2 | 166.9 | 0 | 0 | 0 | 110.3 | I33 Y34 L39 F40 I41 | I33-I37 HydrophobicContact CG2-CD1 3.68Å; I33-I37 HydrophobicContact CG2-CG1 4.26Å; I33-I37 VanDerWaalsContact O-CG1 3.29Å; I33-I37 WeakPolarHBondContact O-CG1 3.35Å; I33-I37 PolarHBondContact O-N 2.91Å; Y34-I37 PolarHBondContact O-N 3.22Å; I37-L39 PolarHBondContact O-N 3.32Å; I37-F40 PolarHBondContact O-N 2.93Å; I37-I41 HydrophobicContact CG2-CD1 3.73Å; I37-I41 HydrophobicContact CG2-CG1 4.36Å; I37-I41 VanDerWaalsContact O-CG1 3.28Å; I37-I41 WeakPolarHBondContact O-CG1 3.44Å; I37-I41 PolarHBondContact O-N 2.66Å |
| 38 | E | 91.7 | Very high | 88.3 | Confident | 99 Ų | 99 | 101.7 Ų | 101.7 | 46% | 0.463 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.1 | -45.3 | 178.5 | -176.5 | 54.3 | -141.6 | 0 | 0 | 111.2 | Y34 F40 I41 Q42 | Y34-E38 WeakPolarHBondContact O-CB 3.45Å; Y34-E38 PolarHBondContact O-N 3.49Å; E38-F40 VanDerWaalsContact C-N 3.34Å; E38-F40 PolarHBondContact O-N 2.85Å; E38-I41 PolarHBondContact O-N 3.26Å; E38-Q42 VanDerWaalsContact O-CG 3.29Å; E38-Q42 WeakPolarHBondContact O-CG 3.2Å; E38-Q42 PolarHBondContact O-N 2.89Å; E38-Q42 PolarHBondContact OE1-NE2 3.5Å |
| 39 | L | 94.8 | Very high | 89.4 | Confident | 91 Ų | 91 | 94.9 Ų | 94.9 | 48% | 0.476 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.4 | -43.7 | 174.3 | -179.9 | 63.5 | 0 | 0 | 0 | 111.9 | G35 L36 I37 Q42 I43 | G35-L39 WeakPolarHBondContact O-CB 3.2Å; G35-L39 PolarHBondContact O-N 3.36Å; G35-L39 VanDerWaalsContact O-N 3.08Å; L36-L39 PolarHBondContact O-N 3.48Å; I37-L39 PolarHBondContact O-N 3.32Å; L39-Q42 PolarHBondContact O-N 3.41Å; L39-I43 HydrophobicContact CD1-CD1 4.21Å; L39-I43 HydrophobicContact CD1-CG1 4.47Å; L39-I43 HydrophobicContact CG-CD1 3.94Å; L39-I43 VanDerWaalsContact O-CG1 3.27Å; L39-I43 WeakPolarHBondContact O-CG1 3.44Å; L39-I43 PolarHBondContact O-N 3.47Å |
| 40 | F | 95.7 | Very high | 90.2 | Very high | 137 Ų | 137 | 96.1 Ų | 96.1 | 60% | 0.601 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -62.5 | -45 | 178.6 | -179.8 | -107.2 | 0 | 0 | 0 | 111.9 | L36 I37 E38 Q42 I43 V44 | L36-F40 WeakPolarHBondContact O-CB 3.26Å; L36-F40 PolarHBondContact O-N 2.88Å; I37-F40 PolarHBondContact O-N 2.93Å; E38-F40 VanDerWaalsContact C-N 3.34Å; E38-F40 PolarHBondContact O-N 2.85Å; F40-Q42 VanDerWaalsContact C-N 3.32Å; F40-Q42 PolarHBondContact O-N 3.48Å; F40-I43 PolarHBondContact O-N 3.29Å; F40-V44 HydrophobicContact CD1-CG2 4.33Å; F40-V44 HydrophobicContact CD2-CG2 4.39Å; F40-V44 HydrophobicContact CE1-CG2 3.91Å; F40-V44 HydrophobicContact CE2-CG2 3.97Å; F40-V44 HydrophobicContact CZ-CG2 3.71Å; F40-V44 WeakPolarHBondContact O-CG2 3.34Å; F40-V44 PolarHBondContact O-N 3.15Å |
| 41 | I | 95.3 | Very high | 91.2 | Very high | 91 Ų | 91 | 92.9 Ų | 92.9 | 47% | 0.467 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -58.1 | -46 | 175.5 | -69.3 | 166.7 | 0 | 0 | 0 | 110.3 | I37 E38 I43 V44 H45 | I37-I41 HydrophobicContact CG2-CD1 3.73Å; I37-I41 HydrophobicContact CG2-CG1 4.36Å; I37-I41 VanDerWaalsContact O-CG1 3.28Å; I37-I41 WeakPolarHBondContact O-CG1 3.44Å; I37-I41 PolarHBondContact O-N 2.66Å; E38-I41 PolarHBondContact O-N 3.26Å; I41-I43 VanDerWaalsContact C-N 3.33Å; I41-I43 PolarHBondContact O-N 3.06Å; I41-V44 PolarHBondContact O-N 3.38Å; I41-H45 WeakPolarHBondContact O-CB 3.34Å; I41-H45 PolarHBondContact O-N 2.67Å |
| 42 | Q | 94.9 | Very high | 92 | Very high | 83 Ų | 83 | 92.9 Ų | 92.9 | 39% | 0.388 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -61.8 | -40.3 | 178 | -71.1 | 177.3 | 21.3 | 0 | 0 | 112.5 | E38 L39 F40 R46 | E38-Q42 VanDerWaalsContact O-CG 3.29Å; E38-Q42 WeakPolarHBondContact O-CG 3.2Å; E38-Q42 PolarHBondContact O-N 2.89Å; E38-Q42 PolarHBondContact OE1-NE2 3.5Å; L39-Q42 PolarHBondContact O-N 3.41Å; F40-Q42 VanDerWaalsContact C-N 3.32Å; F40-Q42 PolarHBondContact O-N 3.48Å; Q42-R46 WeakPolarHBondContact O-CB 3.34Å; Q42-R46 VanDerWaalsContact O-CG 3.23Å; Q42-R46 WeakPolarHBondContact O-CG 3.44Å; Q42-R46 PolarHBondContact O-N 3.17Å |
| 43 | I | 96.4 | Very high | 92.7 | Very high | 80 Ų | 80 | 98.4 Ų | 98.4 | 41% | 0.41 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.8 | -48.9 | 177 | -68.7 | 165.1 | 0 | 0 | 0 | 110.5 | L39 F40 I41 H45 R46 L47 | L39-I43 HydrophobicContact CD1-CD1 4.21Å; L39-I43 HydrophobicContact CD1-CG1 4.47Å; L39-I43 HydrophobicContact CG-CD1 3.94Å; L39-I43 VanDerWaalsContact O-CG1 3.27Å; L39-I43 WeakPolarHBondContact O-CG1 3.44Å; L39-I43 PolarHBondContact O-N 3.47Å; F40-I43 PolarHBondContact O-N 3.29Å; I41-I43 VanDerWaalsContact C-N 3.33Å; I41-I43 PolarHBondContact O-N 3.06Å; I43-H45 PolarHBondContact O-N 3.34Å; I43-R46 PolarHBondContact O-N 2.95Å; I43-L47 HydrophobicContact CG2-CD1 4.27Å; I43-L47 WeakPolarHBondContact O-CB 3.48Å; I43-L47 PolarHBondContact O-N 3.37Å |
| 44 | V | 95.5 | Very high | 92.7 | Very high | 71 Ų | 71 | 101.9 Ų | 101.9 | 43% | 0.43 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.1 | -44.7 | 179.8 | 172.3 | 0 | 0 | 0 | 0 | 110.9 | F40 I41 R46 L47 S48 | F40-V44 HydrophobicContact CD1-CG2 4.33Å; F40-V44 HydrophobicContact CD2-CG2 4.39Å; F40-V44 HydrophobicContact CE1-CG2 3.91Å; F40-V44 HydrophobicContact CE2-CG2 3.97Å; F40-V44 HydrophobicContact CZ-CG2 3.71Å; F40-V44 WeakPolarHBondContact O-CG2 3.34Å; F40-V44 PolarHBondContact O-N 3.15Å; I41-V44 PolarHBondContact O-N 3.38Å; V44-R46 PolarHBondContact O-N 3.44Å; V44-L47 PolarHBondContact O-N 3.33Å; V44-S48 PolarHBondContact O-N 2.92Å |
| 45 | H | 93.7 | Very high | 92.9 | Very high | 128 Ų | 128 | 102 Ų | 102 | 59% | 0.593 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -59.9 | -45.7 | 176.7 | -178.4 | -97 | 0 | 0 | 0 | 111.7 | I41 I43 L47 S48 V49 | I41-H45 WeakPolarHBondContact O-CB 3.34Å; I41-H45 PolarHBondContact O-N 2.67Å; I43-H45 PolarHBondContact O-N 3.34Å; H45-L47 VanDerWaalsContact C-N 3.32Å; H45-L47 PolarHBondContact O-N 3.06Å; H45-S48 PolarHBondContact O-N 3.2Å; H45-V49 WeakPolarHBondContact O-CG2 3.2Å; H45-V49 PolarHBondContact O-N 2.99Å |
| 46 | R | 92.7 | Very high | 92.9 | Very high | 177 Ų | 177 | 103.6 Ų | 103.6 | 67% | 0.668 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62.9 | -38.1 | 175.7 | -72.7 | 173.4 | -172.4 | -85.6 | 1.3 | 112.2 | Q42 I43 V44 R50 | Q42-R46 WeakPolarHBondContact O-CB 3.34Å; Q42-R46 VanDerWaalsContact O-CG 3.23Å; Q42-R46 WeakPolarHBondContact O-CG 3.44Å; Q42-R46 PolarHBondContact O-N 3.17Å; I43-R46 PolarHBondContact O-N 2.95Å; V44-R46 PolarHBondContact O-N 3.44Å; R46-R50 WeakPolarHBondContact O-CB 3.37Å; R46-R50 PolarHBondContact O-N 3.37Å |
| 47 | L | 94.7 | Very high | 92.6 | Very high | 112 Ų | 112 | 105.5 Ų | 105.5 | 59% | 0.586 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.8 | -48.2 | 175.8 | -108.6 | 66.1 | 0 | 0 | 0 | 111.7 | I43 V44 H45 V49 R50 S51 | I43-L47 HydrophobicContact CG2-CD1 4.27Å; I43-L47 WeakPolarHBondContact O-CB 3.48Å; I43-L47 PolarHBondContact O-N 3.37Å; V44-L47 PolarHBondContact O-N 3.33Å; H45-L47 VanDerWaalsContact C-N 3.32Å; H45-L47 PolarHBondContact O-N 3.06Å; L47-V49 PolarHBondContact O-N 2.95Å; L47-R50 CarbonylContact O-C 3.57Å; L47-R50 PolarHBondContact O-N 3.37Å; L47-R50 VanDerWaalsContact O-N 3.14Å; L47-S51 WeakPolarHBondContact O-CB 3.34Å; L47-S51 PolarHBondContact O-N 3.44Å; L47-S51 PolarHBondContact O-OG 3.18Å; L47-S51 VanDerWaalsContact O-OG 3.09Å |
| 48 | S | 91.9 | Very high | 92.1 | Very high | 50 Ų | 50 | 105.3 Ų | 105.3 | 35% | 0.35 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.6 | -49.7 | 179.3 | -161.4 | 0 | 0 | 0 | 0 | 111.3 | V44 H45 R50 S51 E52 | V44-S48 PolarHBondContact O-N 2.92Å; H45-S48 PolarHBondContact O-N 3.2Å; S48-R50 VanDerWaalsContact C-N 3.27Å; S48-R50 PolarHBondContact O-N 3.41Å; S48-S51 WeakPolarHBondContact CA-OG 3.33Å; S48-S51 PolarHBondContact O-N 2.8Å; S48-S51 PolarHBondContact O-OG 3.04Å; S48-E52 WeakPolarHBondContact O-CB 3.42Å; S48-E52 VanDerWaalsContact O-CG 3.31Å; S48-E52 WeakPolarHBondContact O-CG 3.38Å; S48-E52 PolarHBondContact O-N 3Å; S48-E52 PolarHBondContact OG-OE1 3.09Å |
| 49 | V | 92.5 | Very high | 91.7 | Very high | 38 Ų | 38 | 104.5 Ų | 104.5 | 23% | 0.23 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -61.9 | -38 | 178 | 173.9 | 0 | 0 | 0 | 0 | 111 | H45 L47 R53 | H45-V49 WeakPolarHBondContact O-CG2 3.2Å; H45-V49 PolarHBondContact O-N 2.99Å; L47-V49 PolarHBondContact O-N 2.95Å; V49-R53 WeakPolarHBondContact O-CB 3.42Å; V49-R53 WeakPolarHBondContact O-CD 3.48Å; V49-R53 WeakPolarHBondContact O-CG 3.42Å; V49-R53 PolarHBondContact O-N 2.7Å; V49-R53 VanDerWaalsContact O-N 3.13Å |
| 50 | R | 92.5 | Very high | 91.1 | Very high | 147 Ų | 147 | 104.8 Ų | 104.8 | 56% | 0.555 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -71.3 | -40.6 | 177.8 | -174.6 | 177.8 | -179.6 | 88.9 | -8.3 | 112.1 | R46 L47 S48 R54 | R46-R50 WeakPolarHBondContact O-CB 3.37Å; R46-R50 PolarHBondContact O-N 3.37Å; L47-R50 CarbonylContact O-C 3.57Å; L47-R50 PolarHBondContact O-N 3.37Å; L47-R50 VanDerWaalsContact O-N 3.14Å; S48-R50 VanDerWaalsContact C-N 3.27Å; S48-R50 PolarHBondContact O-N 3.41Å; R50-R54 WeakPolarHBondContact O-CB 3.5Å; R50-R54 VanDerWaalsContact O-CG 3.3Å; R50-R54 WeakPolarHBondContact O-CG 3.25Å; R50-R54 PolarHBondContact O-N 3.23Å |
| 51 | S | 92.3 | Very high | 90.1 | Very high | 65 Ų | 65 | 100.7 Ų | 100.7 | 46% | 0.455 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67.8 | -44.3 | 178.6 | 54.2 | 0 | 0 | 0 | 0 | 111.2 | L47 S48 R53 R54 L55 | L47-S51 WeakPolarHBondContact O-CB 3.34Å; L47-S51 PolarHBondContact O-N 3.44Å; L47-S51 PolarHBondContact O-OG 3.18Å; L47-S51 VanDerWaalsContact O-OG 3.09Å; S48-S51 WeakPolarHBondContact CA-OG 3.33Å; S48-S51 PolarHBondContact O-N 2.8Å; S48-S51 PolarHBondContact O-OG 3.04Å; S51-R53 PolarHBondContact O-N 3.38Å; S51-R54 PolarHBondContact O-N 2.88Å; S51-L55 VanDerWaalsContact O-CB 3.26Å; S51-L55 WeakPolarHBondContact O-CB 3.01Å; S51-L55 PolarHBondContact O-N 3.29Å |
| 52 | E | 90.2 | Very high | 89.1 | Confident | 111 Ų | 111 | 100.3 Ų | 100.3 | 52% | 0.519 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.5 | -48.1 | 175.5 | -73.9 | 166.8 | -145.4 | 0 | 0 | 110.9 | S48 R54 L55 V56 | S48-E52 WeakPolarHBondContact O-CB 3.42Å; S48-E52 VanDerWaalsContact O-CG 3.31Å; S48-E52 WeakPolarHBondContact O-CG 3.38Å; S48-E52 PolarHBondContact O-N 3Å; S48-E52 PolarHBondContact OG-OE1 3.09Å; E52-R54 VanDerWaalsContact C-N 3.32Å; E52-R54 PolarHBondContact O-N 3.14Å; E52-L55 PolarHBondContact O-N 2.76Å; E52-V56 WeakPolarHBondContact O-CB 3.5Å; E52-V56 VanDerWaalsContact O-CG2 3.27Å; E52-V56 WeakPolarHBondContact O-CG2 3.46Å; E52-V56 PolarHBondContact O-N 2.81Å |
| 53 | R | 91.6 | Very high | 87.8 | Confident | 172 Ų | 172 | 102 Ų | 102 | 65% | 0.649 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.8 | -38 | 176.8 | -73.8 | 174.4 | -174.8 | -179.1 | 3.8 | 112.7 | V49 S51 K57 | V49-R53 WeakPolarHBondContact O-CB 3.42Å; V49-R53 WeakPolarHBondContact O-CD 3.48Å; V49-R53 WeakPolarHBondContact O-CG 3.42Å; V49-R53 PolarHBondContact O-N 2.7Å; V49-R53 VanDerWaalsContact O-N 3.13Å; S51-R53 PolarHBondContact O-N 3.38Å; R53-K57 WeakPolarHBondContact O-CB 3.38Å; R53-K57 VanDerWaalsContact O-CG 3.26Å; R53-K57 WeakPolarHBondContact O-CG 3.42Å; R53-K57 PolarHBondContact O-N 2.94Å |
| 54 | R | 89.5 | Confident | 86.4 | Confident | 146 Ų | 146 | 103.2 Ų | 103.2 | 55% | 0.551 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -68.5 | -46.4 | 176.5 | -79.6 | 178.8 | 169.1 | -163.6 | -8.9 | 111.1 | R50 S51 E52 K57 T58 | R50-R54 WeakPolarHBondContact O-CB 3.5Å; R50-R54 VanDerWaalsContact O-CG 3.3Å; R50-R54 WeakPolarHBondContact O-CG 3.25Å; R50-R54 PolarHBondContact O-N 3.23Å; S51-R54 PolarHBondContact O-N 2.88Å; E52-R54 VanDerWaalsContact C-N 3.32Å; E52-R54 PolarHBondContact O-N 3.14Å; R54-K57 PolarHBondContact O-N 3.06Å; R54-T58 PolarHBondContact O-N 3.23Å; R54-T58 PolarHBondContact O-OG1 3.23Å |
| 55 | L | 89.7 | Confident | 84.9 | Confident | 100 Ų | 100 | 109.1 Ų | 109.1 | 52% | 0.524 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.8 | -47.9 | 178.8 | -175.4 | 160.5 | 0 | 0 | 0 | 110.9 | S51 E52 K57 T58 L59 | S51-L55 VanDerWaalsContact O-CB 3.26Å; S51-L55 WeakPolarHBondContact O-CB 3.01Å; S51-L55 PolarHBondContact O-N 3.29Å; E52-L55 PolarHBondContact O-N 2.76Å; L55-K57 VanDerWaalsContact C-N 3.29Å; L55-K57 PolarHBondContact O-N 3.09Å; L55-T58 PolarHBondContact O-N 3.42Å; L55-L59 HydrophobicContact CD2-CD1 3.32Å; L55-L59 HydrophobicContact CD2-CG 3.79Å; L55-L59 HydrophobicContact CG-CD1 4.4Å; L55-L59 HydrophobicContact CG-CG 4.46Å; L55-L59 WeakPolarHBondContact O-CB 3.38Å; L55-L59 WeakPolarHBondContact O-CG 3.49Å; L55-L59 PolarHBondContact O-N 3.28Å |
| 56 | V | 88 | Confident | 83.3 | Confident | 80 Ų | 80 | 107 Ų | 107 | 49% | 0.485 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59.4 | -41.7 | 177.4 | 171.6 | 0 | 0 | 0 | 0 | 111 | E52 L60 | E52-V56 WeakPolarHBondContact O-CB 3.5Å; E52-V56 VanDerWaalsContact O-CG2 3.27Å; E52-V56 WeakPolarHBondContact O-CG2 3.46Å; E52-V56 PolarHBondContact O-N 2.81Å; V56-L60 HydrophobicContact CG1-CD1 3.86Å; V56-L60 HydrophobicContact CG1-CG 4.33Å; V56-L60 VanDerWaalsContact O-CB 3.24Å; V56-L60 WeakPolarHBondContact O-CB 3.37Å; V56-L60 WeakPolarHBondContact O-CG 3.15Å; V56-L60 PolarHBondContact O-N 3.42Å |
| 57 | K | 87.5 | Confident | 81.9 | Confident | 155 Ų | 155 | 103.4 Ų | 103.4 | 67% | 0.674 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.1 | -45.4 | 175.9 | -75.8 | 178.1 | -179.8 | -168.4 | 0 | 112.6 | R53 R54 L55 L60 A61 | R53-K57 WeakPolarHBondContact O-CB 3.38Å; R53-K57 VanDerWaalsContact O-CG 3.26Å; R53-K57 WeakPolarHBondContact O-CG 3.42Å; R53-K57 PolarHBondContact O-N 2.94Å; R54-K57 PolarHBondContact O-N 3.06Å; L55-K57 VanDerWaalsContact C-N 3.29Å; L55-K57 PolarHBondContact O-N 3.09Å; K57-L60 PolarHBondContact O-N 3.44Å; K57-A61 WeakPolarHBondContact O-CB 3.3Å; K57-A61 PolarHBondContact O-N 2.82Å |
| 58 | T | 83.6 | Confident | 80.5 | Confident | 79 Ų | 79 | 98.8 Ų | 98.8 | 49% | 0.485 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.7 | -48.9 | 178.6 | -61.3 | 0 | 0 | 0 | 0 | 111 | R54 L55 L60 A61 D62 | R54-T58 PolarHBondContact O-N 3.23Å; R54-T58 PolarHBondContact O-OG1 3.23Å; L55-T58 PolarHBondContact O-N 3.42Å; T58-L60 VanDerWaalsContact C-N 3.35Å; T58-L60 PolarHBondContact O-N 2.91Å; T58-A61 WeakPolarHBondContact O-CB 3.45Å; T58-A61 PolarHBondContact O-N 3.16Å; T58-A61 VanDerWaalsContact O-N 3.1Å; T58-D62 PolarHBondContact O-N 3.39Å |
| 59 | L | 83.5 | Confident | 79.4 | Confident | 82 Ų | 82 | 102.8 Ų | 102.8 | 43% | 0.429 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.6 | -46.3 | 175.7 | -74 | -172.5 | 0 | 0 | 0 | 111.3 | L55 A61 D62 F63 | L55-L59 HydrophobicContact CD2-CD1 3.32Å; L55-L59 HydrophobicContact CD2-CG 3.79Å; L55-L59 HydrophobicContact CG-CD1 4.4Å; L55-L59 HydrophobicContact CG-CG 4.46Å; L55-L59 WeakPolarHBondContact O-CB 3.38Å; L55-L59 WeakPolarHBondContact O-CG 3.49Å; L55-L59 PolarHBondContact O-N 3.28Å; L59-A61 VanDerWaalsContact C-N 3.29Å; L59-A61 PolarHBondContact O-N 3.49Å; L59-D62 PolarHBondContact O-N 3.36Å; L59-F63 HydrophobicContact CB-CD2 4.26Å; L59-F63 HydrophobicContact CB-CE2 4.23Å; L59-F63 WeakPolarHBondContact O-CB 3.47Å; L59-F63 WeakPolarHBondContact O-CD2 3.16Å; L59-F63 WeakPolarHBondContact O-CG 3.44Å; L59-F63 PolarHBondContact O-N 3.27Å |
| 60 | L | 80.7 | Confident | 78.4 | Confident | 96 Ų | 96 | 104.3 Ų | 104.3 | 50% | 0.503 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.2 | -37.9 | 176.6 | -77.1 | 174.5 | 0 | 0 | 0 | 112.1 | V56 K57 T58 Q64 | V56-L60 HydrophobicContact CG1-CD1 3.86Å; V56-L60 HydrophobicContact CG1-CG 4.33Å; V56-L60 VanDerWaalsContact O-CB 3.24Å; V56-L60 WeakPolarHBondContact O-CB 3.37Å; V56-L60 WeakPolarHBondContact O-CG 3.15Å; V56-L60 PolarHBondContact O-N 3.42Å; K57-L60 PolarHBondContact O-N 3.44Å; T58-L60 VanDerWaalsContact C-N 3.35Å; T58-L60 PolarHBondContact O-N 2.91Å; L60-Q64 VanDerWaalsContact O-CB 3.3Å; L60-Q64 WeakPolarHBondContact O-CB 3.26Å; L60-Q64 WeakPolarHBondContact O-CG 3.24Å; L60-Q64 PolarHBondContact O-N 3.43Å; L60-Q64 PolarHBondContact O-NE2 3.49Å |
| 61 | A | 76.5 | Confident | 77.4 | Confident | 51 Ų | 51 | 98.4 Ų | 98.4 | 42% | 0.421 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -68.2 | -40.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | K57 T58 L59 Q64 R65 | K57-A61 WeakPolarHBondContact O-CB 3.3Å; K57-A61 PolarHBondContact O-N 2.82Å; T58-A61 WeakPolarHBondContact O-CB 3.45Å; T58-A61 PolarHBondContact O-N 3.16Å; T58-A61 VanDerWaalsContact O-N 3.1Å; L59-A61 VanDerWaalsContact C-N 3.29Å; L59-A61 PolarHBondContact O-N 3.49Å; A61-Q64 PolarHBondContact O-N 2.96Å; A61-R65 WeakPolarHBondContact O-CB 3.27Å; A61-R65 PolarHBondContact O-N 3.3Å |
| 62 | D | 72.4 | Confident | 76.7 | Confident | 83 Ų | 83 | 97.5 Ų | 97.5 | 44% | 0.444 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -67.2 | -42.8 | 177 | -69.3 | -24.9 | 0 | 0 | 0 | 111.3 | T58 L59 R65 V66 | T58-D62 PolarHBondContact O-N 3.39Å; L59-D62 PolarHBondContact O-N 3.36Å; D62-R65 WeakPolarHBondContact O-CB 3.41Å; D62-R65 PolarHBondContact O-N 3.05Å; D62-V66 WeakPolarHBondContact O-CG2 3.45Å; D62-V66 PolarHBondContact O-N 3.31Å |
| 63 | F | 67.7 | Low | 76.1 | Confident | 119 Ų | 119 | 97.6 Ų | 97.6 | 52% | 0.522 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61 | -46.4 | 172.1 | -79.3 | -62.4 | 0 | 0 | 0 | 110.9 | L59 R65 V66 H67 | L59-F63 HydrophobicContact CB-CD2 4.26Å; L59-F63 HydrophobicContact CB-CE2 4.23Å; L59-F63 WeakPolarHBondContact O-CB 3.47Å; L59-F63 WeakPolarHBondContact O-CD2 3.16Å; L59-F63 WeakPolarHBondContact O-CG 3.44Å; L59-F63 PolarHBondContact O-N 3.27Å; F63-R65 VanDerWaalsContact C-N 3.29Å; F63-R65 PolarHBondContact O-N 3.11Å; F63-V66 PolarHBondContact O-N 3.28Å; F63-V66 VanDerWaalsContact O-N 3.11Å; F63-H67 VanDerWaalsContact C-CD2 3.42Å; F63-H67 WeakPolarHBondContact O-CB 3.21Å; F63-H67 PolarHBondContact O-CD2 3.25Å; F63-H67 VanDerWaalsContact O-CG 3.29Å; F63-H67 PolarHBondContact O-N 3.35Å |
| 64 | Q | 67 | Low | 75.4 | Confident | 105 Ų | 105 | 90.6 Ų | 90.6 | 49% | 0.491 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -57 | -42.9 | 174.9 | -79.1 | 169.3 | 84.2 | 0 | 0 | 112 | L60 A61 V66 H67 G68 | L60-Q64 VanDerWaalsContact O-CB 3.3Å; L60-Q64 WeakPolarHBondContact O-CB 3.26Å; L60-Q64 WeakPolarHBondContact O-CG 3.24Å; L60-Q64 PolarHBondContact O-N 3.43Å; L60-Q64 PolarHBondContact O-NE2 3.49Å; A61-Q64 PolarHBondContact O-N 2.96Å; Q64-V66 VanDerWaalsContact C-N 3.32Å; Q64-V66 PolarHBondContact O-N 3.28Å; Q64-H67 PolarHBondContact O-N 2.8Å; Q64-G68 PolarHBondContact O-N 3.37Å |
| 65 | R | 64.8 | Low | 74.9 | Confident | 195 Ų | 195 | 87.9 Ų | 87.9 | 74% | 0.736 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -62.5 | -37.4 | 176.5 | -175.6 | 178.3 | 178.7 | 163.5 | 1 | 112.3 | A61 D62 F63 | A61-R65 WeakPolarHBondContact O-CB 3.27Å; A61-R65 PolarHBondContact O-N 3.3Å; D62-R65 WeakPolarHBondContact O-CB 3.41Å; D62-R65 PolarHBondContact O-N 3.05Å; F63-R65 VanDerWaalsContact C-N 3.29Å; F63-R65 PolarHBondContact O-N 3.11Å |
| 66 | V | 60.7 | Low | 74.6 | Confident | 85 Ų | 85 | 85.5 Ų | 85.5 | 52% | 0.515 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -76.7 | -38.8 | 177.7 | 175.8 | 0 | 0 | 0 | 0 | 111.6 | D62 F63 Q64 G68 K69 | D62-V66 WeakPolarHBondContact O-CG2 3.45Å; D62-V66 PolarHBondContact O-N 3.31Å; F63-V66 PolarHBondContact O-N 3.28Å; F63-V66 VanDerWaalsContact O-N 3.11Å; Q64-V66 VanDerWaalsContact C-N 3.32Å; Q64-V66 PolarHBondContact O-N 3.28Å; V66-G68 VanDerWaalsContact C-N 3.26Å; V66-G68 PolarHBondContact O-N 2.86Å; V66-K69 WeakPolarHBondContact O-CB 3.39Å; V66-K69 PolarHBondContact O-N 2.81Å |
| 67 | H | 62 | Low | 74.3 | Confident | 101 Ų | 101 | 83.4 Ų | 83.4 | 47% | 0.468 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -60.8 | -32.8 | 179.6 | -74.2 | -57.3 | 0 | 0 | 0 | 113.1 | F63 Q64 K69 T70 | F63-H67 VanDerWaalsContact C-CD2 3.42Å; F63-H67 WeakPolarHBondContact O-CB 3.21Å; F63-H67 PolarHBondContact O-CD2 3.25Å; F63-H67 VanDerWaalsContact O-CG 3.29Å; F63-H67 PolarHBondContact O-N 3.35Å; Q64-H67 PolarHBondContact O-N 2.8Å; H67-K69 PolarHBondContact O-N 3.25Å; H67-T70 PolarHBondContact O-N 3.35Å |
| 68 | G | 66 | Low | 74.1 | Confident | 15 Ų | 15 | 79.6 Ų | 79.6 | 16% | 0.155 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -62.7 | -27.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114 | Q64 V66 A71 L72 | Q64-G68 PolarHBondContact O-N 3.37Å; V66-G68 VanDerWaalsContact C-N 3.26Å; V66-G68 PolarHBondContact O-N 2.86Å; G68-A71 PolarHBondContact O-N 2.84Å; G68-L72 WeakPolarHBondContact O-CB 3.26Å; G68-L72 PolarHBondContact O-N 3.1Å |
| 69 | K | 69.8 | Low | 74.1 | Confident | 133 Ų | 133 | 76.7 Ų | 76.7 | 58% | 0.578 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -70 | -39.6 | 179.6 | -65.9 | -175.5 | 176.1 | -177.8 | 0 | 112.1 | V66 H67 A71 L72 L73 | V66-K69 WeakPolarHBondContact O-CB 3.39Å; V66-K69 PolarHBondContact O-N 2.81Å; H67-K69 PolarHBondContact O-N 3.25Å; K69-A71 VanDerWaalsContact C-N 3.33Å; K69-L72 PolarHBondContact O-N 2.9Å; K69-L73 WeakPolarHBondContact O-CG 3.5Å; K69-L73 PolarHBondContact O-N 2.9Å |
| 70 | T | 70.3 | Confident | 74.1 | Confident | 70 Ų | 70 | 75 Ų | 75 | 43% | 0.429 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -64.9 | -41 | 177.5 | -49.1 | 0 | 0 | 0 | 0 | 111 | H67 L73 F74 | H67-T70 PolarHBondContact O-N 3.35Å; T70-L73 PolarHBondContact O-N 3.36Å; T70-F74 WeakPolarHBondContact O-CB 3.3Å; T70-F74 PolarHBondContact O-N 3.29Å |
| 71 | A | 72.3 | Confident | 74.3 | Confident | 23 Ų | 23 | 71.9 Ų | 71.9 | 19% | 0.19 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -64.3 | -40.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | G68 K69 F74 R75 | G68-A71 PolarHBondContact O-N 2.84Å; K69-A71 VanDerWaalsContact C-N 3.33Å; A71-F74 WeakPolarHBondContact O-CB 3.39Å; A71-F74 PolarHBondContact O-N 3.28Å; A71-R75 WeakPolarHBondContact O-CG 3.49Å; A71-R75 PolarHBondContact O-N 3.47Å |
| 72 | L | 76.7 | Confident | 74.6 | Confident | 46 Ų | 46 | 73.5 Ų | 73.5 | 24% | 0.241 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -63.5 | -46.4 | 174.9 | -176.1 | 66.8 | 0 | 0 | 0 | 111.8 | G68 K69 F74 R75 I76 L95 I97 | G68-L72 WeakPolarHBondContact O-CB 3.26Å; G68-L72 PolarHBondContact O-N 3.1Å; K69-L72 PolarHBondContact O-N 2.9Å; L72-F74 VanDerWaalsContact C-N 3.26Å; L72-F74 PolarHBondContact O-N 2.87Å; L72-R75 PolarHBondContact O-N 2.88Å; L72-I76 HydrophobicContact CG-CD1 4.02Å; L72-I76 VanDerWaalsContact O-CG1 3.3Å; L72-I76 WeakPolarHBondContact O-CG1 3.4Å; L72-I76 PolarHBondContact O-N 3.41Å; L72-L95 HydrophobicContact CD1-CB 4.41Å; L72-I97 HydrophobicContact CD1-CG1 4.41Å; L72-I97 HydrophobicContact CD2-CG1 4.31Å |
| 73 | L | 78.5 | Confident | 75 | Confident | 114 Ų | 114 | 74.4 Ų | 74.4 | 60% | 0.597 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -60.4 | -37.8 | 176.3 | -72.2 | 175.2 | 0 | 0 | 0 | 111.9 | K69 T70 I76 A77 | K69-L73 WeakPolarHBondContact O-CG 3.5Å; K69-L73 PolarHBondContact O-N 2.9Å; T70-L73 PolarHBondContact O-N 3.36Å; L73-I76 HydrophobicContact CD2-CD1 4.46Å; L73-I76 PolarHBondContact O-N 2.87Å; L73-A77 WeakPolarHBondContact O-CB 3.41Å; L73-A77 PolarHBondContact O-N 3.11Å |
| 74 | F | 76.8 | Confident | 75.5 | Confident | 25 Ų | 25 | 72.6 Ų | 72.6 | 11% | 0.11 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -62.1 | -46.5 | 174.6 | -171.6 | -96.9 | 0 | 0 | 0 | 111.8 | T70 A71 L72 I76 A77 E78 Q113 L114 V117 | T70-F74 WeakPolarHBondContact O-CB 3.3Å; T70-F74 PolarHBondContact O-N 3.29Å; A71-F74 WeakPolarHBondContact O-CB 3.39Å; A71-F74 PolarHBondContact O-N 3.28Å; L72-F74 VanDerWaalsContact C-N 3.26Å; L72-F74 PolarHBondContact O-N 2.87Å; F74-I76 VanDerWaalsContact C-N 3.32Å; F74-I76 PolarHBondContact O-N 2.72Å; F74-A77 PolarHBondContact O-N 2.56Å; F74-E78 WeakPolarHBondContact O-CB 3.47Å; F74-E78 PolarHBondContact O-N 3.1Å; F74-Q113 HydrophobicContact CD2-CB 4.33Å; F74-Q113 HydrophobicContact CE1-CB 4.07Å; F74-Q113 HydrophobicContact CE1-CG 4.26Å; F74-Q113 HydrophobicContact CE2-CB 3.59Å; F74-Q113 WeakPolarHBondContact CE2-O 3.31Å; F74-Q113 HydrophobicContact CZ-CB 3.43Å; F74-Q113 VanDerWaalsContact CZ-CB 3.43Å; F74-Q113 HydrophobicContact CZ-CG 4.03Å; F74-Q113 WeakPolarHBondContact CZ-O 3.22Å; F74-L114 HydrophobicContact CD2-CD2 4.19Å; F74-V117 HydrophobicContact CD2-CG2 4.16Å; F74-V117 HydrophobicContact CE1-CG2 4.11Å; F74-V117 HydrophobicContact CE2-CB 3.71Å; F74-V117 HydrophobicContact CE2-CG1 4.4Å; F74-V117 HydrophobicContact CE2-CG2 3.24Å; F74-V117 HydrophobicContact CZ-CB 4.15Å; F74-V117 HydrophobicContact CZ-CG2 3.21Å |
| 75 | R | 78.5 | Confident | 76 | Confident | 89 Ų | 89 | 75.3 Ų | 75.3 | 34% | 0.336 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -63.1 | -38 | 175.9 | -69.4 | 174.5 | -177.5 | -170.6 | -0.6 | 112.6 | A71 L72 E78 A79 L95 H96 V98 | A71-R75 WeakPolarHBondContact O-CG 3.49Å; A71-R75 PolarHBondContact O-N 3.47Å; L72-R75 PolarHBondContact O-N 2.88Å; R75-E78 PolarHBondContact O-N 2.95Å; R75-A79 WeakPolarHBondContact O-CB 3.18Å; R75-A79 PolarHBondContact O-N 3.16Å; R75-L95 HydrophobicContact CB-CD1 4.49Å; R75-H96 PolarHBondContact NH1-O 3.48Å; R75-V98 VanDerWaalsContact NH1-CB 3.29Å |
| 76 | I | 83.2 | Confident | 76.6 | Confident | 49 Ų | 49 | 67.4 Ų | 67.4 | 25% | 0.251 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -62.7 | -46.8 | 174.5 | -68.5 | 165.2 | 0 | 0 | 0 | 110 | L72 L73 F74 A79 A80 V92 L95 | L72-I76 HydrophobicContact CG-CD1 4.02Å; L72-I76 VanDerWaalsContact O-CG1 3.3Å; L72-I76 WeakPolarHBondContact O-CG1 3.4Å; L72-I76 PolarHBondContact O-N 3.41Å; L73-I76 HydrophobicContact CD2-CD1 4.46Å; L73-I76 PolarHBondContact O-N 2.87Å; F74-I76 VanDerWaalsContact C-N 3.32Å; F74-I76 PolarHBondContact O-N 2.72Å; I76-A79 PolarHBondContact O-N 3.36Å; I76-A80 WeakPolarHBondContact O-CB 3.36Å; I76-A80 PolarHBondContact O-N 3.22Å; I76-V92 HydrophobicContact CD1-CG1 4.47Å; I76-V92 HydrophobicContact CG1-CG1 4.28Å; I76-V92 HydrophobicContact CG2-CG2 4.32Å; I76-L95 HydrophobicContact CB-CD1 4.19Å; I76-L95 HydrophobicContact CG1-CD1 3.45Å; I76-L95 VanDerWaalsContact CG1-CD1 3.45Å |
| 77 | A | 82.6 | Confident | 77.4 | Confident | 37 Ų | 37 | 68.7 Ų | 68.7 | 31% | 0.306 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -61.9 | -45.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | L73 F74 A79 A80 L81 V117 | L73-A77 WeakPolarHBondContact O-CB 3.41Å; L73-A77 PolarHBondContact O-N 3.11Å; F74-A77 PolarHBondContact O-N 2.56Å; A77-A79 PolarHBondContact O-N 2.8Å; A77-A80 PolarHBondContact O-N 3.24Å; A77-L81 VanDerWaalsContact O-CG 3.27Å; A77-L81 WeakPolarHBondContact O-CG 3.48Å; A77-L81 PolarHBondContact O-N 2.93Å; A77-V117 HydrophobicContact CB-CG1 3.83Å |
| 78 | E | 82.6 | Confident | 78.1 | Confident | 74 Ų | 74 | 68.7 Ų | 68.7 | 35% | 0.346 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.8 | -44.2 | 177.4 | -172.8 | 174.9 | -158.8 | 0 | 0 | 112.2 | F74 R75 A80 L81 N82 | F74-E78 WeakPolarHBondContact O-CB 3.47Å; F74-E78 PolarHBondContact O-N 3.1Å; R75-E78 PolarHBondContact O-N 2.95Å; E78-A80 PolarHBondContact O-N 2.91Å; E78-L81 PolarHBondContact O-N 2.92Å; E78-N82 PolarHBondContact O-N 2.87Å; E78-N82 PolarHBondContact O-ND2 2.8Å |
| 79 | A | 84 | Confident | 78.6 | Confident | 18 Ų | 18 | 75.1 Ų | 75.1 | 15% | 0.149 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -64.1 | -40.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | R75 I76 A77 L81 N82 N83 V91 L95 | R75-A79 WeakPolarHBondContact O-CB 3.18Å; R75-A79 PolarHBondContact O-N 3.16Å; I76-A79 PolarHBondContact O-N 3.36Å; A77-A79 PolarHBondContact O-N 2.8Å; A79-L81 VanDerWaalsContact C-N 3.33Å; A79-L81 PolarHBondContact O-N 2.89Å; A79-N82 PolarHBondContact O-N 3.09Å; A79-N83 PolarHBondContact O-N 3.22Å; A79-V91 VanDerWaalsContact C-CG1 3.43Å; A79-V91 HydrophobicContact CB-CG1 3.41Å; A79-V91 VanDerWaalsContact CB-CG1 3.41Å; A79-V91 WeakPolarHBondContact O-CG1 3.33Å; A79-L95 HydrophobicContact CB-CD1 4.4Å; A79-L95 HydrophobicContact CB-CD2 4.4Å |
| 80 | A | 84.4 | Confident | 78.8 | Confident | 48 Ų | 48 | 74.7 Ų | 74.7 | 40% | 0.397 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -66.5 | -31.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | I76 A77 E78 N83 P84 | I76-A80 WeakPolarHBondContact O-CB 3.36Å; I76-A80 PolarHBondContact O-N 3.22Å; A77-A80 PolarHBondContact O-N 3.24Å; E78-A80 PolarHBondContact O-N 2.91Å; A80-N83 CarbonylContact O-C 3.59Å; A80-P84 WeakPolarHBondContact O-CA 3.21Å |
| 81 | L | 83.7 | Confident | 78.7 | Confident | 30 Ų | 30 | 72.3 Ų | 72.3 | 16% | 0.157 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -76.4 | -28.6 | 176.1 | -70.4 | 177.7 | 0 | 0 | 0 | 113.7 | A77 E78 A79 V117 R120 V124 | A77-L81 VanDerWaalsContact O-CG 3.27Å; A77-L81 WeakPolarHBondContact O-CG 3.48Å; A77-L81 PolarHBondContact O-N 2.93Å; E78-L81 PolarHBondContact O-N 2.92Å; A79-L81 VanDerWaalsContact C-N 3.33Å; A79-L81 PolarHBondContact O-N 2.89Å; L81-V117 HydrophobicContact CD1-CB 4.27Å; L81-V117 HydrophobicContact CD1-CG1 3.74Å; L81-V117 HydrophobicContact CD1-CG2 4.43Å; L81-V117 VanDerWaalsContact CD1-O 3.24Å; L81-V117 WeakPolarHBondContact CD1-O 3.21Å; L81-R120 HydrophobicContact CD1-CB 3.88Å; L81-V124 HydrophobicContact CD2-CG2 4.36Å |
| 82 | N | 82.3 | Confident | 78.9 | Confident | 85 Ų | 85 | 73.3 Ų | 73.3 | 46% | 0.455 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -74.4 | -40.3 | 177.4 | -73.2 | -32.3 | 0 | 0 | 0 | 112.1 | E78 A79 R120 | E78-N82 PolarHBondContact O-N 2.87Å; E78-N82 PolarHBondContact O-ND2 2.8Å; A79-N82 PolarHBondContact O-N 3.09Å; N82-R120 PolarHBondContact OD1-NH2 2.81Å |
| 83 | N | 80.7 | Confident | 78.6 | Confident | 102 Ų | 102 | 79.7 Ų | 79.7 | 55% | 0.545 | 42% | 0.422 | S | S | . | . | trans | -129.1 | 77.8 | -178.5 | -73.6 | -38.2 | 0 | 0 | 0 | 110.2 | A79 A80 D85 G86 V91 | A79-N83 PolarHBondContact O-N 3.22Å; A80-N83 CarbonylContact O-C 3.59Å; N83-D85 VanDerWaalsContact C-N 3.27Å; N83-D85 PolarHBondContact O-N 3.24Å; N83-G86 PolarHBondContact O-N 3.48Å; N83-G86 VanDerWaalsContact O-N 3.12Å; N83-V91 HydrophobicContact CB-CG2 4.11Å | ||
| 84 | P | 78.2 | Confident | 78.2 | Confident | 80 Ų | 80 | 80.3 Ų | 80.3 | 52% | 0.519 | 42% | 0.422 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.5 | -31.1 | -175.1 | 25.8 | -34.4 | 0 | 0 | 0 | 113 | A80 V124 | A80-P84 WeakPolarHBondContact O-CA 3.21Å; P84-V124 HydrophobicContact CB-CG1 4.4Å |
| 85 | D | 78.7 | Confident | 78.1 | Confident | 162 Ų | 162 | 81.3 Ų | 81.3 | 87% | 0.866 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.1 | -0.7 | 178.7 | -57 | -50.4 | 0 | 0 | 0 | 113 | N83 | N83-D85 VanDerWaalsContact C-N 3.27Å; N83-D85 PolarHBondContact O-N 3.24Å |
| 86 | G | 77.1 | Confident | 77.7 | Confident | 30 Ų | 30 | 84.3 Ų | 84.3 | 31% | 0.309 | 45% | 0.446 | S | S | . | . | S | Bend | trans | -68.4 | 141.6 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | N83 V88 | N83-G86 PolarHBondContact O-N 3.48Å; N83-G86 VanDerWaalsContact O-N 3.12Å; G86-V88 PolarHBondContact O-N 2.86Å |
| 87 | L | 77.4 | Confident | 76.9 | Confident | 112 Ų | 112 | 88.4 Ų | 88.4 | 59% | 0.586 | 47% | 0.466 | S | S | * | . | trans | -61.2 | 135.3 | 172.9 | -67.5 | 175.1 | 0 | 0 | 0 | 109.1 | K89 E90 V91 | L87-K89 PolarHBondContact O-N 3.3Å; L87-E90 HydrophobicContact CB-CG 4.23Å; L87-E90 PolarHBondContact O-N 3.37Å; L87-V91 PolarHBondContact O-N 2.77Å; L87-V91 VanDerWaalsContact O-N 3.09Å | ||
| 88 | V | 77.3 | Confident | 76 | Confident | 101 Ų | 101 | 90.6 Ų | 90.6 | 61% | 0.612 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -49.3 | -33.8 | 174.7 | 177.8 | 0 | 0 | 0 | 0 | 110.7 | G86 E90 V91 V92 | G86-V88 PolarHBondContact O-N 2.86Å; V88-E90 VanDerWaalsContact C-N 3.32Å; V88-E90 PolarHBondContact O-N 2.98Å; V88-V91 PolarHBondContact O-N 2.94Å; V88-V92 HydrophobicContact CG1-CB 4.04Å; V88-V92 HydrophobicContact CG1-CG2 3.88Å; V88-V92 VanDerWaalsContact O-CB 3.28Å; V88-V92 WeakPolarHBondContact O-CB 3.34Å; V88-V92 PolarHBondContact O-N 2.84Å |
| 89 | K | 76.9 | Confident | 74.9 | Confident | 150 Ų | 150 | 95.1 Ų | 95.1 | 65% | 0.652 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -61.8 | -39 | 178.5 | -167.5 | -174.1 | 179.6 | -178.1 | 0 | 113.3 | L87 Y93 | L87-K89 PolarHBondContact O-N 3.3Å; K89-Y93 HydrophobicContact CB-CD2 3.9Å; K89-Y93 HydrophobicContact CB-CE2 3.98Å; K89-Y93 HydrophobicContact CG-CD2 3.52Å; K89-Y93 HydrophobicContact CG-CE2 3.78Å; K89-Y93 WeakPolarHBondContact O-CD2 3.38Å |
| 90 | E | 72.1 | Confident | 73.8 | Confident | 123 Ų | 123 | 96.7 Ų | 96.7 | 58% | 0.575 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -85.2 | -28.8 | -176 | -65.5 | 174.3 | 179.6 | 0 | 0 | 112 | L87 V88 H94 | L87-E90 HydrophobicContact CB-CG 4.23Å; L87-E90 PolarHBondContact O-N 3.37Å; V88-E90 VanDerWaalsContact C-N 3.32Å; V88-E90 PolarHBondContact O-N 2.98Å; E90-H94 PolarHBondContact O-CE1 3.13Å; E90-H94 PolarHBondContact O-ND1 3.21Å |
| 91 | V | 69.3 | Low | 72.6 | Confident | 21 Ų | 21 | 100.3 Ų | 100.3 | 13% | 0.127 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -93.4 | -41.7 | -176.1 | -179 | 0 | 0 | 0 | 0 | 111.8 | A79 N83 L87 V88 | A79-V91 VanDerWaalsContact C-CG1 3.43Å; A79-V91 HydrophobicContact CB-CG1 3.41Å; A79-V91 VanDerWaalsContact CB-CG1 3.41Å; A79-V91 WeakPolarHBondContact O-CG1 3.33Å; N83-V91 HydrophobicContact CB-CG2 4.11Å; L87-V91 PolarHBondContact O-N 2.77Å; L87-V91 VanDerWaalsContact O-N 3.09Å; V88-V91 PolarHBondContact O-N 2.94Å |
| 92 | V | 75.2 | Confident | 71.4 | Confident | 43 Ų | 43 | 110.2 Ų | 110.2 | 26% | 0.261 | 55% | 0.554 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -95.9 | -38.9 | -168.7 | -179.1 | 0 | 0 | 0 | 0 | 113 | I76 V88 H94 L95 | I76-V92 HydrophobicContact CD1-CG1 4.47Å; I76-V92 HydrophobicContact CG1-CG1 4.28Å; I76-V92 HydrophobicContact CG2-CG2 4.32Å; V88-V92 HydrophobicContact CG1-CB 4.04Å; V88-V92 HydrophobicContact CG1-CG2 3.88Å; V88-V92 VanDerWaalsContact O-CB 3.28Å; V88-V92 WeakPolarHBondContact O-CB 3.34Å; V88-V92 PolarHBondContact O-N 2.84Å; V92-H94 PolarHBondContact O-N 3.39Å; V92-L95 WeakPolarHBondContact O-CB 3.27Å; V92-L95 WeakPolarHBondContact O-CG 3.23Å; V92-L95 PolarHBondContact O-N 3.45Å; V92-L95 VanDerWaalsContact O-N 3.15Å |
| 93 | Y | 71.9 | Confident | 70.1 | Confident | 181 Ų | 181 | 108.4 Ų | 108.4 | 71% | 0.71 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.5 | -18.1 | -176.6 | -67.5 | -58.1 | 0 | 0 | 0 | 114.1 | K89 L95 | K89-Y93 HydrophobicContact CB-CD2 3.9Å; K89-Y93 HydrophobicContact CB-CE2 3.98Å; K89-Y93 HydrophobicContact CG-CD2 3.52Å; K89-Y93 HydrophobicContact CG-CE2 3.78Å; K89-Y93 WeakPolarHBondContact O-CD2 3.38Å; Y93-L95 PolarHBondContact O-N 3.31Å |
| 94 | H | 70 | Confident | 68.8 | Low | 126 Ų | 126 | 107.3 Ų | 107.3 | 58% | 0.583 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.6 | -1 | 174.7 | -58.2 | 99.8 | 0 | 0 | 0 | 113 | E90 V92 H96 | E90-H94 PolarHBondContact O-CE1 3.13Å; E90-H94 PolarHBondContact O-ND1 3.21Å; V92-H94 PolarHBondContact O-N 3.39Å; H94-H96 PolarHBondContact O-CD2 3.18Å; H94-H96 PolarHBondContact O-N 3.05Å; H94-H96 VanDerWaalsContact O-N 3.14Å |
| 95 | L | 74.5 | Confident | 67.7 | Low | 47 Ų | 47 | 111.4 Ų | 111.4 | 25% | 0.246 | 57% | 0.57 | C | S | . | * | trans | -79.8 | 101.3 | 179 | -60.6 | 178 | 0 | 0 | 0 | 110.3 | L72 R75 I76 A79 V92 Y93 I97 | L72-L95 HydrophobicContact CD1-CB 4.41Å; R75-L95 HydrophobicContact CB-CD1 4.49Å; I76-L95 HydrophobicContact CB-CD1 4.19Å; I76-L95 HydrophobicContact CG1-CD1 3.45Å; I76-L95 VanDerWaalsContact CG1-CD1 3.45Å; A79-L95 HydrophobicContact CB-CD1 4.4Å; A79-L95 HydrophobicContact CB-CD2 4.4Å; V92-L95 WeakPolarHBondContact O-CB 3.27Å; V92-L95 WeakPolarHBondContact O-CG 3.23Å; V92-L95 PolarHBondContact O-N 3.45Å; V92-L95 VanDerWaalsContact O-N 3.15Å; Y93-L95 PolarHBondContact O-N 3.31Å; L95-I97 PolarHBondContact O-N 3.14Å | ||
| 96 | H | 69.3 | Low | 66.5 | Low | 152 Ų | 152 | 113.7 Ų | 113.7 | 70% | 0.704 | 57% | 0.566 | S | S | * | * | trans | -68.7 | 130.2 | 171 | -67.1 | -87.3 | 0 | 0 | 0 | 110.4 | R75 H94 V98 | R75-H96 PolarHBondContact NH1-O 3.48Å; H94-H96 PolarHBondContact O-CD2 3.18Å; H94-H96 PolarHBondContact O-N 3.05Å; H94-H96 VanDerWaalsContact O-N 3.14Å; H96-V98 PolarHBondContact O-N 3.06Å | ||
| 97 | I | 66.7 | Low | 65.4 | Low | 134 Ų | 134 | 116.7 Ų | 116.7 | 69% | 0.687 | 58% | 0.583 | S | S | * | * | trans | -66.9 | 97.9 | 168.5 | -55.8 | 173.1 | 0 | 0 | 0 | 106.5 | L72 L95 | L72-I97 HydrophobicContact CD1-CG1 4.41Å; L72-I97 HydrophobicContact CD2-CG1 4.31Å; L95-I97 PolarHBondContact O-N 3.14Å | ||
| 98 | V | 63.5 | Low | 64.6 | Low | 84 Ų | 84 | 115.3 Ų | 115.3 | 51% | 0.509 | 58% | 0.582 | S | S | . | * | P | Polyproline II helix | trans | -82.9 | 127.4 | 171.9 | 176.8 | 0 | 0 | 0 | 0 | 106.8 | R75 H96 | R75-V98 VanDerWaalsContact NH1-CB 3.29Å; H96-V98 PolarHBondContact O-N 3.06Å |
| 99 | E | 59.5 | Low | 64.2 | Low | 169 Ų | 169 | 113.1 Ų | 113.1 | 79% | 0.79 | 57% | 0.572 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 138.1 | 173.3 | -68.3 | -170.1 | 154.3 | 0 | 0 | 109.8 | D101 | E99-D101 PolarHBondContact O-N 3.14Š|
| 100 | P | 60.1 | Low | 63.7 | Low | 50 Ų | 50 | 109.9 Ų | 109.9 | 33% | 0.325 | 56% | 0.556 | S | S | . | * | P | Polyproline II helix | trans | -59.9 | 132.6 | -177.1 | 25.6 | -33.2 | 0 | 0 | 0 | 109.8 | R102 | P100-R102 PolarHBondContact O-N 2.86Š|
| 101 | D | 59.9 | Low | 63.4 | Low | 124 Ų | 124 | 108.5 Ų | 108.5 | 66% | 0.663 | 55% | 0.552 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 127.4 | 174.1 | 177.9 | 13.4 | 0 | 0 | 0 | 109.6 | E99 S103 | E99-D101 PolarHBondContact O-N 3.14Å; D101-S103 PolarHBondContact O-N 3.35Å; D101-S103 VanDerWaalsContact O-N 3.1Å; D101-S103 WeakPolarHBondContact OD1-CB 3.44Å; D101-S103 PolarHBondContact OD1-N 3.42Å; D101-S103 WeakPolarHBondContact OD2-CB 3.29Å; D101-S103 PolarHBondContact OD2-OG 2.91Å |
| 102 | R | 57.8 | Low | 63.8 | Low | 239 Ų | 239 | 109.9 Ų | 109.9 | 90% | 0.902 | 57% | 0.566 | S | S | * | * | S | Bend | trans | -65.1 | -8.5 | 175.9 | -67.2 | -171.3 | -166.5 | 160.4 | 6.2 | 112.2 | P100 G104 | P100-R102 PolarHBondContact O-N 2.86Å; R102-G104 PolarHBondContact O-N 3.36Å; R102-G104 VanDerWaalsContact O-N 3.11Å |
| 103 | S | 55.4 | Low | 63.8 | Low | 47 Ų | 47 | 111.2 Ų | 111.2 | 33% | 0.329 | 57% | 0.569 | S | S | . | * | trans | -67.6 | 110.4 | 175.3 | 94.6 | 0 | 0 | 0 | 0 | 109.5 | D101 K105 | D101-S103 PolarHBondContact O-N 3.35Å; D101-S103 VanDerWaalsContact O-N 3.1Å; D101-S103 WeakPolarHBondContact OD1-CB 3.44Å; D101-S103 PolarHBondContact OD1-N 3.42Å; D101-S103 WeakPolarHBondContact OD2-CB 3.29Å; D101-S103 PolarHBondContact OD2-OG 2.91Å; S103-K105 PolarHBondContact O-N 2.88Å | ||
| 104 | G | 54.4 | Low | 64.1 | Low | 79 Ų | 79 | 106.7 Ų | 106.7 | 81% | 0.814 | 56% | 0.557 | S | S | * | * | trans | -66.6 | 38 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | R102 R106 | R102-G104 PolarHBondContact O-N 3.36Å; R102-G104 VanDerWaalsContact O-N 3.11Å; G104-R106 PolarHBondContact O-N 3.43Å | ||
| 105 | K | 54.9 | Low | 64.8 | Low | 165 Ų | 165 | 109 Ų | 109 | 72% | 0.717 | 56% | 0.56 | S | S | * | * | trans | -77.2 | 79.1 | 179.3 | -66.8 | -167.4 | -177.3 | -175.7 | 0 | 109.8 | S103 | S103-K105 PolarHBondContact O-N 2.88Š| ||
| 106 | R | 53.9 | Low | 65.2 | Low | 210 Ų | 210 | 111 Ų | 111 | 79% | 0.792 | 57% | 0.571 | S | S | * | * | trans | 34.7 | 124.9 | 150.6 | -63.6 | -174.7 | -178.8 | -175.5 | 0.9 | 117.5 | G104 S108 S109 | G104-R106 PolarHBondContact O-N 3.43Å; R106-S108 PolarHBondContact O-N 3.46Å; R106-S109 PolarHBondContact O-N 2.93Å | ||
| 107 | S | 54.3 | Low | 66 | Low | 93 Ų | 93 | 104.4 Ų | 104.4 | 65% | 0.65 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -36.7 | -27.8 | 165.8 | -172.7 | 0 | 0 | 0 | 0 | 115.8 | S109 Y110 L111 | S107-S109 VanDerWaalsContact C-N 3.26Å; S107-S109 PolarHBondContact O-N 3.2Å; S107-Y110 PolarHBondContact O-N 2.97Å; S107-L111 PolarHBondContact O-N 3.44Å |
| 108 | S | 59.6 | Low | 66.8 | Low | 83 Ų | 83 | 101.3 Ų | 101.3 | 58% | 0.58 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -58.1 | -31.5 | 172.9 | -168.8 | 0 | 0 | 0 | 0 | 114.4 | R106 L111 A112 | R106-S108 PolarHBondContact O-N 3.46Å; S108-L111 PolarHBondContact O-N 2.91Å; S108-A112 PolarHBondContact O-N 3.04Å; S108-A112 VanDerWaalsContact O-N 3.16Å |
| 109 | S | 69.7 | Low | 67.9 | Low | 55 Ų | 55 | 100.1 Ų | 100.1 | 39% | 0.385 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.2 | -44.2 | 178.6 | -172.6 | 0 | 0 | 0 | 0 | 111.1 | R106 S107 L111 A112 Q113 | R106-S109 PolarHBondContact O-N 2.93Å; S107-S109 VanDerWaalsContact C-N 3.26Å; S107-S109 PolarHBondContact O-N 3.2Å; S109-L111 PolarHBondContact O-N 3.31Å; S109-A112 PolarHBondContact O-N 3.21Å; S109-Q113 WeakPolarHBondContact O-CB 3.37Å; S109-Q113 WeakPolarHBondContact O-CG 3.47Å; S109-Q113 PolarHBondContact O-N 3.2Å; S109-Q113 PolarHBondContact OG-NE2 3.47Å |
| 110 | Y | 65.4 | Low | 69 | Low | 82 Ų | 82 | 93.8 Ų | 93.8 | 32% | 0.322 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63 | -38.7 | 177.1 | -71.8 | -76.1 | 0 | 0 | 0 | 112.5 | S107 Q113 L114 | S107-Y110 PolarHBondContact O-N 2.97Å; Y110-Q113 PolarHBondContact O-N 3.42Å; Y110-L114 WeakPolarHBondContact O-CB 3.31Å; Y110-L114 VanDerWaalsContact O-CG 3.25Å; Y110-L114 WeakPolarHBondContact O-CG 3.44Å; Y110-L114 PolarHBondContact O-N 3.19Å |
| 111 | L | 66.4 | Low | 70 | Confident | 94 Ų | 94 | 92.4 Ų | 92.4 | 49% | 0.492 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -70.2 | -32.4 | 177.5 | -63.4 | -168.1 | 0 | 0 | 0 | 112.8 | S107 S108 S109 L114 R115 | S107-L111 PolarHBondContact O-N 3.44Å; S108-L111 PolarHBondContact O-N 2.91Å; S109-L111 PolarHBondContact O-N 3.31Å; L111-L114 HydrophobicContact CD2-CD1 4.23Å; L111-R115 WeakPolarHBondContact O-CG 3.28Å; L111-R115 PolarHBondContact O-N 3.25Å; L111-R115 VanDerWaalsContact O-N 3.09Å |
| 112 | A | 76.7 | Confident | 71.2 | Confident | 51 Ų | 51 | 90.5 Ų | 90.5 | 42% | 0.421 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -68.3 | -46.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | S108 S109 R115 D116 | S108-A112 PolarHBondContact O-N 3.04Å; S108-A112 VanDerWaalsContact O-N 3.16Å; S109-A112 PolarHBondContact O-N 3.21Å; A112-R115 PolarHBondContact O-N 3.49Å; A112-D116 PolarHBondContact O-N 3.19Å; A112-D116 VanDerWaalsContact O-N 3.09Å |
| 113 | Q | 76.5 | Confident | 72.2 | Confident | 71 Ų | 71 | 80 Ų | 80 | 33% | 0.332 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -55.9 | -49.3 | 173.2 | -79.5 | 176.2 | 19.2 | 0 | 0 | 111.9 | F74 S109 Y110 R115 D116 V117 | F74-Q113 HydrophobicContact CD2-CB 4.33Å; F74-Q113 HydrophobicContact CE1-CB 4.07Å; F74-Q113 HydrophobicContact CE1-CG 4.26Å; F74-Q113 HydrophobicContact CE2-CB 3.59Å; F74-Q113 WeakPolarHBondContact CE2-O 3.31Å; F74-Q113 HydrophobicContact CZ-CB 3.43Å; F74-Q113 VanDerWaalsContact CZ-CB 3.43Å; F74-Q113 HydrophobicContact CZ-CG 4.03Å; F74-Q113 WeakPolarHBondContact CZ-O 3.22Å; S109-Q113 WeakPolarHBondContact O-CB 3.37Å; S109-Q113 WeakPolarHBondContact O-CG 3.47Å; S109-Q113 PolarHBondContact O-N 3.2Å; S109-Q113 PolarHBondContact OG-NE2 3.47Å; Y110-Q113 PolarHBondContact O-N 3.42Å; Q113-R115 VanDerWaalsContact C-N 3.35Å; Q113-R115 PolarHBondContact O-N 2.86Å; Q113-D116 PolarHBondContact O-N 3.44Å; Q113-V117 PolarHBondContact O-N 3.02Å |
| 114 | L | 76.9 | Confident | 73.3 | Confident | 86 Ų | 86 | 80.4 Ų | 80.4 | 45% | 0.45 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63 | -37.8 | 178.5 | -76.3 | 170.5 | 0 | 0 | 0 | 112.8 | F74 Y110 L111 D116 S118 | F74-L114 HydrophobicContact CD2-CD2 4.19Å; Y110-L114 WeakPolarHBondContact O-CB 3.31Å; Y110-L114 VanDerWaalsContact O-CG 3.25Å; Y110-L114 WeakPolarHBondContact O-CG 3.44Å; Y110-L114 PolarHBondContact O-N 3.19Å; L111-L114 HydrophobicContact CD2-CD1 4.23Å; L114-D116 VanDerWaalsContact C-N 3.35Å; L114-S118 VanDerWaalsContact O-CB 3.26Å; L114-S118 WeakPolarHBondContact O-CB 3.05Å; L114-S118 PolarHBondContact O-N 2.94Å |
| 115 | R | 84.6 | Confident | 74.4 | Confident | 174 Ų | 174 | 85 Ų | 85 | 66% | 0.657 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -62.5 | -42.6 | 174.2 | -86.6 | -174.1 | -110.2 | 141.1 | -6.2 | 111.8 | L111 A112 Q113 A119 | L111-R115 WeakPolarHBondContact O-CG 3.28Å; L111-R115 PolarHBondContact O-N 3.25Å; L111-R115 VanDerWaalsContact O-N 3.09Å; A112-R115 PolarHBondContact O-N 3.49Å; Q113-R115 VanDerWaalsContact C-N 3.35Å; Q113-R115 PolarHBondContact O-N 2.86Å; R115-A119 WeakPolarHBondContact O-CB 3.29Å; R115-A119 PolarHBondContact O-N 3.44Å |
| 116 | D | 84.6 | Confident | 75.4 | Confident | 88 Ų | 88 | 81.6 Ų | 81.6 | 47% | 0.471 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -65.6 | -49.6 | 178.5 | -175 | 56.4 | 0 | 0 | 0 | 111.9 | A112 Q113 L114 S118 A119 R120 | A112-D116 PolarHBondContact O-N 3.19Å; A112-D116 VanDerWaalsContact O-N 3.09Å; Q113-D116 PolarHBondContact O-N 3.44Å; L114-D116 VanDerWaalsContact C-N 3.35Å; D116-S118 VanDerWaalsContact C-N 3.32Å; D116-S118 PolarHBondContact O-N 3.28Å; D116-A119 PolarHBondContact O-N 3.08Å; D116-R120 WeakPolarHBondContact O-CB 3.38Å; D116-R120 WeakPolarHBondContact O-CG 3.49Å; D116-R120 PolarHBondContact O-N 3Å |
| 117 | V | 84.6 | Confident | 75.9 | Confident | 15 Ų | 15 | 74.9 Ų | 74.9 | 9% | 0.091 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -61.5 | -39.2 | 176.6 | 161.9 | 0 | 0 | 0 | 0 | 112 | F74 A77 L81 Q113 G121 | F74-V117 HydrophobicContact CD2-CG2 4.16Å; F74-V117 HydrophobicContact CE1-CG2 4.11Å; F74-V117 HydrophobicContact CE2-CB 3.71Å; F74-V117 HydrophobicContact CE2-CG1 4.4Å; F74-V117 HydrophobicContact CE2-CG2 3.24Å; F74-V117 HydrophobicContact CZ-CB 4.15Å; F74-V117 HydrophobicContact CZ-CG2 3.21Å; A77-V117 HydrophobicContact CB-CG1 3.83Å; L81-V117 HydrophobicContact CD1-CB 4.27Å; L81-V117 HydrophobicContact CD1-CG1 3.74Å; L81-V117 HydrophobicContact CD1-CG2 4.43Å; L81-V117 VanDerWaalsContact CD1-O 3.24Å; L81-V117 WeakPolarHBondContact CD1-O 3.21Å; Q113-V117 PolarHBondContact O-N 3.02Å; V117-G121 PolarHBondContact O-N 3.26Å |
| 118 | S | 85.2 | Confident | 76.2 | Confident | 68 Ų | 68 | 78.3 Ų | 78.3 | 48% | 0.476 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -63.6 | -46.5 | 174 | -168.6 | 0 | 0 | 0 | 0 | 111.7 | L114 D116 R120 G121 D122 | L114-S118 VanDerWaalsContact O-CB 3.26Å; L114-S118 WeakPolarHBondContact O-CB 3.05Å; L114-S118 PolarHBondContact O-N 2.94Å; D116-S118 VanDerWaalsContact C-N 3.32Å; D116-S118 PolarHBondContact O-N 3.28Å; S118-R120 VanDerWaalsContact C-N 3.33Å; S118-R120 PolarHBondContact O-N 3.48Å; S118-G121 PolarHBondContact O-N 2.97Å; S118-D122 PolarHBondContact O-N 3.23Å |
| 119 | A | 84.8 | Confident | 76.2 | Confident | 59 Ų | 59 | 80.8 Ų | 80.8 | 49% | 0.488 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.1 | -40 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | R115 D116 D122 A123 | R115-A119 WeakPolarHBondContact O-CB 3.29Å; R115-A119 PolarHBondContact O-N 3.44Å; D116-A119 PolarHBondContact O-N 3.08Å; A119-D122 PolarHBondContact O-N 3.44Å; A119-A123 PolarHBondContact O-N 3.44Å |
| 120 | R | 82.8 | Confident | 75.5 | Confident | 36 Ų | 36 | 82 Ų | 82 | 14% | 0.136 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -65.5 | -41.5 | 173.8 | -72.1 | -180 | 59.9 | -172.3 | -4.4 | 111.9 | L81 N82 D116 S118 A123 V124 L130 | L81-R120 HydrophobicContact CD1-CB 3.88Å; N82-R120 PolarHBondContact OD1-NH2 2.81Å; D116-R120 WeakPolarHBondContact O-CB 3.38Å; D116-R120 WeakPolarHBondContact O-CG 3.49Å; D116-R120 PolarHBondContact O-N 3Å; S118-R120 VanDerWaalsContact C-N 3.33Å; S118-R120 PolarHBondContact O-N 3.48Å; R120-A123 WeakPolarHBondContact O-CB 3.45Å; R120-A123 PolarHBondContact O-N 3.49Å; R120-V124 WeakPolarHBondContact O-CG2 3.37Å; R120-V124 PolarHBondContact O-N 2.97Å; R120-L130 HydrophobicContact CB-CD1 4.32Å; R120-L130 HydrophobicContact CG-CD1 4.18Å |
| 121 | G | 82.8 | Confident | 74.8 | Confident | 22 Ų | 22 | 83.3 Ų | 83.3 | 23% | 0.227 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -61.7 | -41.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | V117 S118 A123 V124 K125 | V117-G121 PolarHBondContact O-N 3.26Å; S118-G121 PolarHBondContact O-N 2.97Å; G121-A123 VanDerWaalsContact C-N 3.31Å; G121-A123 PolarHBondContact O-N 3.17Å; G121-V124 PolarHBondContact O-N 3.08Å; G121-K125 VanDerWaalsContact O-CB 3.31Å; G121-K125 WeakPolarHBondContact O-CB 3.46Å; G121-K125 PolarHBondContact O-N 2.9Å |
| 122 | D | 84.2 | Confident | 73.9 | Confident | 84 Ų | 84 | 87.3 Ų | 87.3 | 45% | 0.449 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -66.3 | -33.3 | 174.7 | -68.5 | -34.8 | 0 | 0 | 0 | 112 | S118 A119 N126 | S118-D122 PolarHBondContact O-N 3.23Å; A119-D122 PolarHBondContact O-N 3.44Å; D122-N126 VanDerWaalsContact O-CB 3.28Å; D122-N126 WeakPolarHBondContact O-CB 3.33Å; D122-N126 PolarHBondContact O-N 3.18Å; D122-N126 VanDerWaalsContact O-N 3.1Å; D122-N126 PolarHBondContact O-ND2 3.46Å |
| 123 | A | 79.3 | Confident | 72.6 | Confident | 17 Ų | 17 | 93 Ų | 93 | 14% | 0.14 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -67 | -47.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | A119 R120 G121 N126 G127 R128 | A119-A123 PolarHBondContact O-N 3.44Å; R120-A123 WeakPolarHBondContact O-CB 3.45Å; R120-A123 PolarHBondContact O-N 3.49Å; G121-A123 VanDerWaalsContact C-N 3.31Å; G121-A123 PolarHBondContact O-N 3.17Å; A123-N126 PolarHBondContact O-N 3Å; A123-G127 PolarHBondContact O-N 3.46Å; A123-R128 PolarHBondContact O-N 2.8Å |
| 124 | V | 77.4 | Confident | 70.8 | Confident | 56 Ų | 56 | 96.6 Ų | 96.6 | 34% | 0.339 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.2 | -45.7 | 176.5 | 174 | 0 | 0 | 0 | 0 | 110.7 | L81 P84 R120 G121 N126 G127 | L81-V124 HydrophobicContact CD2-CG2 4.36Å; P84-V124 HydrophobicContact CB-CG1 4.4Å; R120-V124 WeakPolarHBondContact O-CG2 3.37Å; R120-V124 PolarHBondContact O-N 2.97Å; G121-V124 PolarHBondContact O-N 3.08Å; V124-N126 VanDerWaalsContact C-N 3.28Å; V124-N126 PolarHBondContact O-N 3.21Å; V124-G127 PolarHBondContact O-N 2.99Å; V124-G127 VanDerWaalsContact O-N 3.13Å |
| 125 | K | 78.7 | Confident | 69.1 | Low | 175 Ų | 175 | 96.7 Ų | 96.7 | 76% | 0.761 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.3 | -34.9 | 177.8 | -173.7 | -179.6 | 178.4 | -175.4 | 0 | 113 | G121 G127 | G121-K125 VanDerWaalsContact O-CB 3.31Å; G121-K125 WeakPolarHBondContact O-CB 3.46Å; G121-K125 PolarHBondContact O-N 2.9Å; K125-G127 VanDerWaalsContact C-N 3.25Å; K125-G127 PolarHBondContact O-N 2.95Å |
| 126 | N | 75.1 | Confident | 66.9 | Low | 95 Ų | 95 | 91.7 Ų | 91.7 | 51% | 0.508 | 53% | 0.529 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.7 | 12 | 179.9 | -68.5 | -37.1 | 0 | 0 | 0 | 113.4 | D122 A123 V124 R128 | D122-N126 VanDerWaalsContact O-CB 3.28Å; D122-N126 WeakPolarHBondContact O-CB 3.33Å; D122-N126 PolarHBondContact O-N 3.18Å; D122-N126 VanDerWaalsContact O-N 3.1Å; D122-N126 PolarHBondContact O-ND2 3.46Å; A123-N126 PolarHBondContact O-N 3Å; V124-N126 VanDerWaalsContact C-N 3.28Å; V124-N126 PolarHBondContact O-N 3.21Å; N126-R128 HydrophobicContact CB-CG 4.5Å; N126-R128 PolarHBondContact O-N 2.87Å |
| 127 | G | 65.5 | Low | 64.7 | Low | 68 Ų | 68 | 94.5 Ų | 94.5 | 70% | 0.701 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.7 | 19.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114 | A123 V124 K125 | A123-G127 PolarHBondContact O-N 3.46Å; V124-G127 PolarHBondContact O-N 2.99Å; V124-G127 VanDerWaalsContact O-N 3.13Å; K125-G127 VanDerWaalsContact C-N 3.25Å; K125-G127 PolarHBondContact O-N 2.95Å |
| 128 | R | 60.5 | Low | 62.8 | Low | 165 Ų | 165 | 99.1 Ų | 99.1 | 62% | 0.623 | 57% | 0.574 | S | S | * | * | trans | -88.2 | 110.2 | 173.8 | -58.7 | -171.1 | -167.3 | 118.2 | 2.7 | 107.9 | A123 N126 L130 | A123-R128 PolarHBondContact O-N 2.8Å; N126-R128 HydrophobicContact CB-CG 4.5Å; N126-R128 PolarHBondContact O-N 2.87Å; R128-L130 PolarHBondContact O-N 3.02Å; R128-L130 VanDerWaalsContact O-N 3.14Å | ||
| 129 | T | 59.3 | Low | 60.6 | Low | 136 Ų | 136 | 100.1 Ų | 100.1 | 83% | 0.834 | 59% | 0.586 | S | S | * | * | trans | -59.9 | 114.7 | 166 | 49.6 | 0 | 0 | 0 | 0 | 108 | ||||
| 130 | L | 53.4 | Low | 58.4 | Low | 81 Ų | 81 | 105.7 Ų | 105.7 | 42% | 0.424 | 61% | 0.607 | S | S | . | * | trans | -53.7 | 144.8 | 166.4 | -87.2 | 153.4 | 0 | 0 | 0 | 108.3 | R120 R128 E132 | R120-L130 HydrophobicContact CB-CD1 4.32Å; R120-L130 HydrophobicContact CG-CD1 4.18Å; R128-L130 PolarHBondContact O-N 3.02Å; R128-L130 VanDerWaalsContact O-N 3.14Å; L130-E132 PolarHBondContact O-N 3.29Å; L130-E132 VanDerWaalsContact O-N 3.09Å | ||
| 131 | P | 51.7 | Low | 56.6 | Low | 109 Ų | 109 | 109.2 Ų | 109.2 | 71% | 0.708 | 63% | 0.632 | S | S | * | * | trans | -54.2 | 126.1 | 174.1 | 25.4 | -31.7 | 0 | 0 | 0 | 106.8 | Q133 | P131-Q133 PolarHBondContact O-N 3.28Š| ||
| 132 | E | 47 | Very low | 54.5 | Low | 178 Ų | 178 | 113.4 Ų | 113.4 | 83% | 0.832 | 66% | 0.658 | S | S | * | * | trans | -46.3 | 114.6 | 172.9 | -125.1 | -157.5 | 134.6 | 0 | 0 | 106.5 | L130 D134 | L130-E132 PolarHBondContact O-N 3.29Å; L130-E132 VanDerWaalsContact O-N 3.09Å; E132-D134 PolarHBondContact O-N 3.2Å | ||
| 133 | Q | 50.2 | Low | 52.6 | Low | 171 Ų | 171 | 116.7 Ų | 116.7 | 80% | 0.799 | 68% | 0.675 | S | S | * | * | trans | -68 | 96.3 | 159.9 | -70.5 | -164.5 | -80.8 | 0 | 0 | 103.1 | P131 S135 | P131-Q133 PolarHBondContact O-N 3.28Å; Q133-S135 PolarHBondContact O-N 3.01Å | ||
| 134 | D | 37.5 | Very low | 51.1 | Low | 145 Ų | 145 | 121.7 Ų | 121.7 | 78% | 0.775 | 71% | 0.706 | S | S | * | * | trans | -50.1 | 88.7 | 163.1 | -165 | 4.8 | 0 | 0 | 0 | 105.5 | E132 G136 | E132-D134 PolarHBondContact O-N 3.2Å; D134-G136 PolarHBondContact O-N 3.43Å | ||
| 135 | S | 42.8 | Very low | 49.7 | Very low | 88 Ų | 88 | 122 Ų | 122 | 62% | 0.615 | 72% | 0.722 | S | S | * | * | trans | -68.7 | 86.9 | 169.9 | 50.7 | 0 | 0 | 0 | 0 | 103.4 | Q133 L137 | Q133-S135 PolarHBondContact O-N 3.01Å; S135-L137 PolarHBondContact O-N 2.81Å | ||
| 136 | G | 37.7 | Very low | 48.3 | Very low | 70 Ų | 70 | 121.9 Ų | 121.9 | 72% | 0.722 | 73% | 0.728 | S | S | * | * | trans | -59.1 | 67.1 | 157.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | D134 | D134-G136 PolarHBondContact O-N 3.43Š| ||
| 137 | L | 39.6 | Very low | 47.1 | Very low | 147 Ų | 147 | 123 Ų | 123 | 77% | 0.77 | 74% | 0.741 | S | S | * | * | trans | -75.6 | 113 | 149.7 | -100.5 | 151.3 | 0 | 0 | 0 | 104.2 | S135 A139 | S135-L137 PolarHBondContact O-N 2.81Å; L137-A139 PolarHBondContact O-N 3.01Å | ||
| 138 | P | 42.7 | Very low | 46.1 | Very low | 111 Ų | 111 | 130.3 Ų | 130.3 | 72% | 0.721 | 75% | 0.747 | S | S | * | * | trans | -57.9 | 132.8 | 174.8 | 25.9 | -31.4 | 0 | 0 | 0 | 107.2 | L140 | P138-L140 PolarHBondContact O-N 3.42Š| ||
| 139 | A | 40.4 | Very low | 45.5 | Very low | 89 Ų | 89 | 131.2 Ų | 131.2 | 74% | 0.736 | 76% | 0.761 | S | S | * | * | trans | -34.2 | 118.2 | 165.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | L137 V141 | L137-A139 PolarHBondContact O-N 3.01Å; A139-V141 PolarHBondContact O-N 3.39Å | ||
| 140 | L | 38 | Very low | 45 | Very low | 176 Ų | 176 | 131 Ų | 131 | 92% | 0.921 | 75% | 0.753 | S | S | * | * | trans | -60.1 | 95.2 | 159.2 | -80.3 | 176.9 | 0 | 0 | 0 | 105.7 | P138 S142 | P138-L140 PolarHBondContact O-N 3.42Å; L140-S142 PolarHBondContact O-N 3.41Å | ||
| 141 | V | 44.6 | Very low | 44.4 | Very low | 110 Ų | 110 | 131.9 Ų | 131.9 | 67% | 0.667 | 77% | 0.766 | S | S | * | * | trans | 8.9 | 104.9 | 150.2 | 172.8 | 0 | 0 | 0 | 0 | 111.9 | A139 D143 | A139-V141 PolarHBondContact O-N 3.39Å; V141-D143 PolarHBondContact O-N 3.16Å | ||
| 142 | S | 38.4 | Very low | 44.5 | Very low | 110 Ų | 110 | 132.1 Ų | 132.1 | 77% | 0.769 | 77% | 0.766 | S | S | * | * | trans | -41.5 | 110.1 | 145.5 | -72.3 | 0 | 0 | 0 | 0 | 108.9 | L140 P144 | L140-S142 PolarHBondContact O-N 3.41Å; S142-P144 WeakPolarHBondContact O-CD 3.4Å | ||
| 143 | D | 45.8 | Very low | 44.6 | Very low | 153 Ų | 153 | 129.6 Ų | 129.6 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | trans | -93.4 | 99.6 | 154.6 | -94 | -33.5 | 0 | 0 | 0 | 107.6 | V141 | V141-D143 PolarHBondContact O-N 3.16Š| ||
| 144 | P | 48.1 | Very low | 44.5 | Very low | 122 Ų | 122 | 132.6 Ų | 132.6 | 79% | 0.792 | 78% | 0.782 | S | S | * | * | trans | -92.6 | 90.3 | 164.4 | 35 | -25.1 | 0 | 0 | 0 | 107.2 | S142 | S142-P144 WeakPolarHBondContact O-CD 3.4Š| ||
| 145 | G | 46.5 | Very low | 44.9 | Very low | 64 Ų | 64 | 132 Ų | 132 | 66% | 0.66 | 78% | 0.783 | S | S | * | * | trans | 170.9 | 65.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 146 | L | 50.3 | Low | 45 | Very low | 171 Ų | 171 | 134.3 Ų | 134.3 | 90% | 0.895 | 79% | 0.791 | S | S | * | * | trans | -154.6 | 130.4 | 138.5 | -135.7 | 66.3 | 0 | 0 | 0 | 111.3 | ||||
| 147 | P | 49.8 | Very low | 45.4 | Very low | 120 Ų | 120 | 137.8 Ų | 137.8 | 78% | 0.779 | 80% | 0.795 | S | S | * | * | trans | -76.9 | 151.8 | -170.4 | 16.3 | -6.8 | 0 | 0 | 0 | 112.9 | M149 | P147-M149 PolarHBondContact O-N 3.46Š| ||
| 148 | R | 43.1 | Very low | 45.7 | Very low | 221 Ų | 221 | 137.3 Ų | 137.3 | 83% | 0.834 | 80% | 0.797 | S | S | * | * | trans | -36.6 | 123.3 | 171 | -66.6 | -173.7 | 162 | -174 | -5 | 113.7 | ||||
| 149 | M | 49 | Very low | 45.9 | Very low | 183 Ų | 183 | 138.9 Ų | 138.9 | 90% | 0.901 | 80% | 0.802 | S | S | * | * | trans | -119.4 | 94.2 | 143.1 | -82.5 | -173.3 | 70.9 | 0 | 0 | 108.2 | P147 S151 | P147-M149 PolarHBondContact O-N 3.46Å; M149-S151 PolarHBondContact O-N 3.46Å | ||
| 150 | I | 48.9 | Very low | 46.3 | Very low | 131 Ų | 131 | 142.3 Ų | 142.3 | 67% | 0.672 | 81% | 0.806 | S | S | * | * | trans | -67.3 | 114.9 | 159.6 | -65.3 | 162 | 0 | 0 | 0 | 105.5 | ||||
| 151 | S | 41.1 | Very low | 46.9 | Very low | 100 Ų | 100 | 139.9 Ų | 139.9 | 70% | 0.699 | 80% | 0.798 | S | S | * | * | trans | -126.3 | 95.3 | 158.5 | -169.6 | 0 | 0 | 0 | 0 | 107.7 | M149 V153 | M149-S151 PolarHBondContact O-N 3.46Å; S151-V153 PolarHBondContact O-N 2.68Å | ||
| 152 | T | 52.4 | Low | 47 | Very low | 115 Ų | 115 | 142.2 Ų | 142.2 | 71% | 0.706 | 81% | 0.808 | S | S | * | * | trans | -67.5 | 113.5 | 163.3 | -58 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 153 | V | 49.7 | Very low | 47.8 | Very low | 124 Ų | 124 | 144.8 Ų | 144.8 | 75% | 0.752 | 81% | 0.811 | S | S | * | * | trans | -134.1 | 76.5 | 161.3 | -177.9 | 0 | 0 | 0 | 0 | 106.8 | S151 | S151-V153 PolarHBondContact O-N 2.68Š| ||
| 154 | L | 48.5 | Very low | 47.9 | Very low | 234 Ų | 234 | 144.1 Ų | 144.1 | 100% | 1.225 | 81% | 0.81 | S | S | * | * | trans | 172.7 | 0 | 147.2 | -107.1 | 136.5 | 0 | 0 | 0 | 109.1 |
Retrieved 154 of 154 residues in 130.7 ms
(Link to these results)