| 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 | 48.4 | Very low | 50.1 | Low | 238 Ų | 238 | 119.6 Ų | 119.6 | 100% | 1.172 | 81% | 0.806 | S | S | * | * | 0 | 124.7 | 0 | -98.7 | 103.4 | 102.6 | 0 | 0 | 107 | |||||
| 2 | S | 44.1 | Very low | 50.2 | Low | 115 Ų | 115 | 115.8 Ų | 115.8 | 80% | 0.804 | 79% | 0.789 | S | S | * | * | cis | -155 | 147.9 | 28.8 | -62.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 3 | A | 53.3 | Low | 50.5 | Low | 96 Ų | 96 | 112.5 Ų | 112.5 | 79% | 0.793 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 147.8 | 178 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 4 | P | 48.5 | Very low | 50.6 | Low | 129 Ų | 129 | 109.9 Ų | 109.9 | 84% | 0.838 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 127.8 | 162.8 | 32.9 | -25.4 | 0 | 0 | 0 | 109.5 | ||
| 5 | G | 53.8 | Low | 50.9 | Low | 65 Ų | 65 | 109.6 Ų | 109.6 | 67% | 0.67 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 156.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | E7 | G5-E7 PolarHBondContact O-N 3.31Š|
| 6 | P | 49.1 | Very low | 51.2 | Low | 137 Ų | 137 | 112.3 Ų | 112.3 | 89% | 0.89 | 73% | 0.734 | S | S | * | * | trans | -88.9 | 94.7 | 179.7 | 33.8 | -28.5 | 0 | 0 | 0 | 110.4 | ||||
| 7 | E | 53.3 | Low | 51.3 | Low | 202 Ų | 202 | 116.9 Ų | 116.9 | 94% | 0.944 | 73% | 0.733 | S | S | * | * | trans | -90.6 | 101.8 | 162.8 | -61.4 | -159 | 126 | 0 | 0 | 108.9 | G5 | G5-E7 PolarHBondContact O-N 3.31Š| ||
| 8 | G | 49.5 | Very low | 51.4 | Low | 65 Ų | 65 | 116.6 Ų | 116.6 | 67% | 0.67 | 72% | 0.724 | S | S | * | * | trans | -171.1 | 8.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 9 | S | 51.5 | Low | 51.4 | Low | 112 Ų | 112 | 118.2 Ų | 118.2 | 78% | 0.783 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -90.5 | -5.4 | -173.3 | -179.9 | 0 | 0 | 0 | 0 | 115.2 | ||
| 10 | A | 50.7 | Low | 51.4 | Low | 82 Ų | 82 | 119.2 Ų | 119.2 | 68% | 0.678 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -92.2 | -26.5 | -173.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 11 | A | 49.2 | Very low | 51.4 | Low | 75 Ų | 75 | 117.5 Ų | 117.5 | 62% | 0.62 | 71% | 0.709 | S | S | * | * | H | α-helix | trans | -83 | -20.9 | -174.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 12 | A | 51.3 | Low | 51.2 | Low | 73 Ų | 73 | 112.7 Ų | 112.7 | 60% | 0.603 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -79.3 | -23.9 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 13 | S | 53.8 | Low | 51.5 | Low | 74 Ų | 74 | 110.5 Ų | 110.5 | 52% | 0.517 | 67% | 0.672 | S | S | . | * | H | α-helix | trans | -79.3 | -35 | -177.9 | -166.8 | 0 | 0 | 0 | 0 | 112.6 | N15 K16 | S13-N15 PolarHBondContact O-N 3.35Å; S13-K16 PolarHBondContact O-N 3.49Å |
| 14 | S | 52.5 | Low | 51.3 | Low | 76 Ų | 76 | 112.7 Ų | 112.7 | 53% | 0.531 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -68.2 | -33.5 | 177.8 | -55.4 | 0 | 0 | 0 | 0 | 113 | K16 L18 | S14-K16 VanDerWaalsContact C-N 3.33Å; S14-K16 PolarHBondContact O-N 3.49Å; S14-L18 PolarHBondContact O-N 3.46Å |
| 15 | N | 54.2 | Low | 51.5 | Low | 105 Ų | 105 | 110.5 Ų | 110.5 | 56% | 0.561 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -68.3 | -29.7 | 176.7 | -99.9 | -67.3 | 0 | 0 | 0 | 113.2 | S13 Q19 | S13-N15 PolarHBondContact O-N 3.35Å; N15-Q19 PolarHBondContact O-N 3.24Å |
| 16 | K | 55.4 | Low | 51.3 | Low | 153 Ų | 153 | 113.6 Ų | 113.6 | 67% | 0.665 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -75 | -30.7 | -177.5 | -154.7 | 161.5 | -166.6 | 171.4 | 0 | 113 | S13 S14 Q20 | S13-K16 PolarHBondContact O-N 3.49Å; S14-K16 VanDerWaalsContact C-N 3.33Å; S14-K16 PolarHBondContact O-N 3.49Å; K16-Q20 PolarHBondContact O-N 2.82Å |
| 17 | R | 53.2 | Low | 51.4 | Low | 190 Ų | 190 | 113.7 Ų | 113.7 | 72% | 0.717 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -76.8 | -34.1 | 176.7 | -67.2 | -173.3 | 172.6 | -147.8 | -2.1 | 112.9 | T21 | R17-T21 PolarHBondContact O-N 3.39Å; R17-T21 PolarHBondContact O-OG1 3.41Å |
| 18 | L | 53.4 | Low | 51.4 | Low | 111 Ų | 111 | 108 Ų | 108 | 58% | 0.581 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -71.6 | -39.9 | 176 | -74.7 | 168 | 0 | 0 | 0 | 112 | S14 Q20 T21 Q22 | S14-L18 PolarHBondContact O-N 3.46Å; L18-Q20 PolarHBondContact O-N 3.09Å; L18-T21 PolarHBondContact O-N 3.45Å; L18-T21 VanDerWaalsContact O-N 3.09Å; L18-Q22 PolarHBondContact O-N 3.12Å; L18-Q22 VanDerWaalsContact O-N 3.12Å |
| 19 | Q | 51.8 | Low | 51.6 | Low | 147 Ų | 147 | 107.7 Ų | 107.7 | 69% | 0.687 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -66.7 | -32.5 | 175.5 | -85.9 | -177.6 | -3.3 | 0 | 0 | 114.1 | N15 T21 | N15-Q19 PolarHBondContact O-N 3.24Å; Q19-T21 PolarHBondContact O-N 3.4Å |
| 20 | Q | 50.4 | Low | 51.7 | Low | 139 Ų | 139 | 107 Ų | 107 | 65% | 0.65 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -72 | -17.1 | 172.5 | -77.7 | -173.3 | -58.3 | 0 | 0 | 113.5 | K16 L18 | K16-Q20 PolarHBondContact O-N 2.82Å; L18-Q20 PolarHBondContact O-N 3.09Å |
| 21 | T | 52.4 | Low | 52 | Low | 84 Ų | 84 | 107.9 Ų | 107.9 | 52% | 0.515 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -90.2 | -30.1 | 178 | -49.2 | 0 | 0 | 0 | 0 | 111.3 | R17 L18 Q19 Q24 V25 | R17-T21 PolarHBondContact O-N 3.39Å; R17-T21 PolarHBondContact O-OG1 3.41Å; L18-T21 PolarHBondContact O-N 3.45Å; L18-T21 VanDerWaalsContact O-N 3.09Å; Q19-T21 PolarHBondContact O-N 3.4Å; T21-Q24 PolarHBondContact O-N 3.42Å; T21-V25 WeakPolarHBondContact O-CG2 3.38Å |
| 22 | Q | 44.4 | Very low | 52.3 | Low | 137 Ų | 137 | 110.6 Ų | 110.6 | 64% | 0.64 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -69.6 | -36.2 | 177.4 | -131.6 | 77.9 | 41.5 | 0 | 0 | 112.8 | L18 Q24 V25 | L18-Q22 PolarHBondContact O-N 3.12Å; L18-Q22 VanDerWaalsContact O-N 3.12Å; Q22-Q24 PolarHBondContact O-N 3.35Å; Q22-V25 PolarHBondContact O-N 3.33Å |
| 23 | A | 50.9 | Low | 52.6 | Low | 68 Ų | 68 | 114.4 Ų | 114.4 | 56% | 0.562 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -71.1 | -16.5 | 178 | 0 | 0 | 0 | 0 | 0 | 113.9 | V25 | A23-V25 VanDerWaalsContact C-N 3.33Å |
| 24 | Q | 47.9 | Very low | 52.4 | Low | 143 Ų | 143 | 115 Ų | 115 | 67% | 0.668 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -84.7 | -5 | 177.7 | -111.2 | 176.4 | 78.1 | 0 | 0 | 113.6 | T21 Q22 V28 | T21-Q24 PolarHBondContact O-N 3.42Å; Q22-Q24 PolarHBondContact O-N 3.35Å; Q24-V28 WeakPolarHBondContact O-CG2 3.48Å |
| 25 | V | 51.9 | Low | 52.4 | Low | 82 Ų | 82 | 116 Ų | 116 | 50% | 0.497 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -104.8 | -27.2 | -175.1 | -170.4 | 0 | 0 | 0 | 0 | 112.5 | T21 Q22 A23 V29 | T21-V25 WeakPolarHBondContact O-CG2 3.38Å; Q22-V25 PolarHBondContact O-N 3.33Å; A23-V25 VanDerWaalsContact C-N 3.33Å; V25-V29 WeakPolarHBondContact O-CG2 3.48Å |
| 26 | D | 50.3 | Low | 52.4 | Low | 131 Ų | 131 | 114.6 Ų | 114.6 | 70% | 0.701 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -75 | -25.6 | 175.2 | -81.5 | -34.5 | 0 | 0 | 0 | 113 | ||
| 27 | E | 51.9 | Low | 52.3 | Low | 139 Ų | 139 | 112.6 Ų | 112.6 | 65% | 0.65 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -77.4 | -31.7 | -177.5 | -165.4 | 171.7 | -172.7 | 0 | 0 | 113.1 | I31 | E27-I31 HydrophobicContact CG-CD1 4.5Å; E27-I31 WeakPolarHBondContact O-CD1 3.47Å; E27-I31 VanDerWaalsContact O-CG1 3.29Å; E27-I31 WeakPolarHBondContact O-CG1 3.3Å; E27-I31 PolarHBondContact O-N 3.04Å |
| 28 | V | 53 | Low | 52.3 | Low | 81 Ų | 81 | 110 Ų | 110 | 49% | 0.491 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -78.4 | -19.6 | 178.2 | -92.3 | 0 | 0 | 0 | 0 | 113.9 | Q24 M32 | Q24-V28 WeakPolarHBondContact O-CG2 3.48Å; V28-M32 PolarHBondContact O-N 3.44Å |
| 29 | V | 53.3 | Low | 52.1 | Low | 60 Ų | 60 | 108.9 Ų | 108.9 | 36% | 0.364 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -74.2 | -37.8 | 176.5 | -179.6 | 0 | 0 | 0 | 0 | 110.6 | V25 M32 R33 | V25-V29 WeakPolarHBondContact O-CG2 3.48Å; V29-M32 PolarHBondContact O-N 3.34Å; V29-R33 WeakPolarHBondContact O-CG 3.43Å; V29-R33 PolarHBondContact O-N 3.4Å; V29-R33 VanDerWaalsContact O-N 3.14Å |
| 30 | D | 53.8 | Low | 51.9 | Low | 98 Ų | 98 | 107.2 Ų | 107.2 | 52% | 0.524 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -71.7 | -33.6 | 173.5 | -86.5 | -4.4 | 0 | 0 | 0 | 112.2 | R33 V34 | D30-R33 PolarHBondContact O-N 3.14Å; D30-R33 IonicContact OD1-NH1 2.95Å; D30-R33 PolarHBondContact OD1-NH1 3.32Å; D30-V34 WeakPolarHBondContact O-CG2 3.29Å; D30-V34 PolarHBondContact O-N 2.95Å |
| 31 | I | 58.1 | Low | 51.8 | Low | 100 Ų | 100 | 107.7 Ų | 107.7 | 51% | 0.513 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -63.9 | -42 | 172.5 | -66 | 166.5 | 0 | 0 | 0 | 111.1 | E27 V34 N35 | E27-I31 HydrophobicContact CG-CD1 4.5Å; E27-I31 WeakPolarHBondContact O-CD1 3.47Å; E27-I31 VanDerWaalsContact O-CG1 3.29Å; E27-I31 WeakPolarHBondContact O-CG1 3.3Å; E27-I31 PolarHBondContact O-N 3.04Å; I31-V34 PolarHBondContact O-N 3.09Å; I31-N35 VanDerWaalsContact O-CB 3.27Å; I31-N35 WeakPolarHBondContact O-CB 3.41Å; I31-N35 PolarHBondContact O-N 3.27Å |
| 32 | M | 55.2 | Low | 51.5 | Low | 132 Ų | 132 | 112.5 Ų | 112.5 | 65% | 0.65 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -69.8 | -30.7 | 177.6 | -93.6 | -124.1 | -74.7 | 0 | 0 | 113.9 | V28 V29 N35 V36 | V28-M32 PolarHBondContact O-N 3.44Å; V29-M32 PolarHBondContact O-N 3.34Å; M32-N35 PolarHBondContact O-N 2.92Å; M32-V36 VanDerWaalsContact O-CG2 3.3Å; M32-V36 WeakPolarHBondContact O-CG2 3.4Å; M32-V36 PolarHBondContact O-N 2.87Å |
| 33 | R | 55.8 | Low | 51.8 | Low | 153 Ų | 153 | 111.6 Ų | 111.6 | 58% | 0.577 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -63.1 | -47.8 | 172.4 | -74.5 | 178.5 | -179.5 | 119.9 | 4 | 111.1 | V29 D30 N35 V36 D37 | V29-R33 WeakPolarHBondContact O-CG 3.43Å; V29-R33 PolarHBondContact O-N 3.4Å; V29-R33 VanDerWaalsContact O-N 3.14Å; D30-R33 PolarHBondContact O-N 3.14Å; D30-R33 IonicContact OD1-NH1 2.95Å; D30-R33 PolarHBondContact OD1-NH1 3.32Å; R33-N35 VanDerWaalsContact C-N 3.27Å; R33-N35 PolarHBondContact O-N 3.44Å; R33-V36 PolarHBondContact O-N 3.45Å; R33-D37 PolarHBondContact O-N 3.44Å |
| 34 | V | 50.3 | Low | 51.3 | Low | 86 Ų | 86 | 116 Ų | 116 | 52% | 0.521 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -66.6 | -30 | 176.1 | -179.5 | 0 | 0 | 0 | 0 | 111.8 | D30 I31 K38 | D30-V34 WeakPolarHBondContact O-CG2 3.29Å; D30-V34 PolarHBondContact O-N 2.95Å; I31-V34 PolarHBondContact O-N 3.09Å; V34-K38 WeakPolarHBondContact O-CB 3.49Å; V34-K38 PolarHBondContact O-N 3.26Å; V34-K38 VanDerWaalsContact O-N 3.14Å |
| 35 | N | 53 | Low | 51.2 | Low | 98 Ų | 98 | 117.2 Ų | 117.2 | 52% | 0.524 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -77.7 | -29.1 | 178.6 | -151.4 | 47.7 | 0 | 0 | 0 | 113.1 | I31 M32 R33 K38 V39 | I31-N35 VanDerWaalsContact O-CB 3.27Å; I31-N35 WeakPolarHBondContact O-CB 3.41Å; I31-N35 PolarHBondContact O-N 3.27Å; M32-N35 PolarHBondContact O-N 2.92Å; R33-N35 VanDerWaalsContact C-N 3.27Å; R33-N35 PolarHBondContact O-N 3.44Å; N35-K38 PolarHBondContact O-N 3.31Å; N35-V39 WeakPolarHBondContact O-CB 3.27Å; N35-V39 PolarHBondContact O-N 3.35Å |
| 36 | V | 54.8 | Low | 50.8 | Low | 75 Ų | 75 | 118.4 Ų | 118.4 | 46% | 0.455 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -69 | -42.1 | 172.7 | 167.6 | 0 | 0 | 0 | 0 | 110.8 | M32 R33 K38 V39 L40 | M32-V36 VanDerWaalsContact O-CG2 3.3Å; M32-V36 WeakPolarHBondContact O-CG2 3.4Å; M32-V36 PolarHBondContact O-N 2.87Å; R33-V36 PolarHBondContact O-N 3.45Å; V36-K38 VanDerWaalsContact C-N 3.31Å; V36-K38 PolarHBondContact O-N 2.9Å; V36-V39 PolarHBondContact O-N 3.37Å; V36-L40 HydrophobicContact CG1-CD1 4.21Å; V36-L40 PolarHBondContact O-N 3.15Å; V36-L40 VanDerWaalsContact O-N 3.09Å |
| 37 | D | 51.7 | Low | 50.6 | Low | 110 Ų | 110 | 116.1 Ų | 116.1 | 59% | 0.588 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -63.9 | -38.6 | 173.9 | -67.7 | -28.8 | 0 | 0 | 0 | 111.2 | R33 E41 | R33-D37 PolarHBondContact O-N 3.44Å; D37-E41 PolarHBondContact O-N 3.23Å |
| 38 | K | 54.3 | Low | 50.3 | Low | 136 Ų | 136 | 115 Ų | 115 | 59% | 0.591 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -70.5 | -29.4 | 174.7 | -98.6 | 177.6 | 176.9 | 173 | 0 | 114.6 | V34 N35 V36 R42 | V34-K38 WeakPolarHBondContact O-CB 3.49Å; V34-K38 PolarHBondContact O-N 3.26Å; V34-K38 VanDerWaalsContact O-N 3.14Å; N35-K38 PolarHBondContact O-N 3.31Å; V36-K38 VanDerWaalsContact C-N 3.31Å; V36-K38 PolarHBondContact O-N 2.9Å; K38-R42 WeakPolarHBondContact O-CB 3.39Å; K38-R42 PolarHBondContact O-N 3.14Å |
| 39 | V | 48.5 | Very low | 50 | Low | 88 Ų | 88 | 116.9 Ų | 116.9 | 53% | 0.533 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -79.6 | -29.5 | 178.7 | 93.3 | 0 | 0 | 0 | 0 | 111.2 | N35 V36 R42 D43 | N35-V39 WeakPolarHBondContact O-CB 3.27Å; N35-V39 PolarHBondContact O-N 3.35Å; V36-V39 PolarHBondContact O-N 3.37Å; V39-R42 PolarHBondContact O-N 3.33Å; V39-D43 PolarHBondContact O-N 3.28Å; V39-D43 VanDerWaalsContact O-N 3.15Å |
| 40 | L | 48.8 | Very low | 49.6 | Very low | 112 Ų | 112 | 119.1 Ų | 119.1 | 59% | 0.586 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -66.8 | -38.3 | 172.1 | -92.9 | 153.8 | 0 | 0 | 0 | 112.8 | V36 R42 | V36-L40 HydrophobicContact CG1-CD1 4.21Å; V36-L40 PolarHBondContact O-N 3.15Å; V36-L40 VanDerWaalsContact O-N 3.09Å; L40-R42 VanDerWaalsContact C-N 3.31Å |
| 41 | E | 47.8 | Very low | 49.5 | Very low | 149 Ų | 149 | 120 Ų | 120 | 70% | 0.696 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -73.1 | -23.2 | 172.2 | -75.4 | -172.2 | 159.8 | 0 | 0 | 113.4 | D37 | D37-E41 PolarHBondContact O-N 3.23Å |
| 42 | R | 46.3 | Very low | 49.1 | Very low | 184 Ų | 184 | 123.1 Ų | 123.1 | 69% | 0.694 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -81.9 | -20.6 | 179.6 | -150 | 179.6 | 170.5 | 142.1 | 1.3 | 112.9 | K38 V39 L40 L46 | K38-R42 WeakPolarHBondContact O-CB 3.39Å; K38-R42 PolarHBondContact O-N 3.14Å; V39-R42 PolarHBondContact O-N 3.33Å; L40-R42 VanDerWaalsContact C-N 3.31Å; R42-L46 WeakPolarHBondContact O-CD1 3.47Å |
| 43 | D | 49.3 | Very low | 49 | Very low | 119 Ų | 119 | 119.3 Ų | 119.3 | 64% | 0.636 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -76.9 | -35 | 177.2 | -146 | 39.4 | 0 | 0 | 0 | 111.9 | V39 K45 L46 | V39-D43 PolarHBondContact O-N 3.28Å; V39-D43 VanDerWaalsContact O-N 3.15Å; D43-K45 PolarHBondContact O-N 3.3Å; D43-L46 PolarHBondContact O-N 3.45Å |
| 44 | Q | 42.1 | Very low | 48.7 | Very low | 161 Ų | 161 | 116.8 Ų | 116.8 | 75% | 0.752 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -74.5 | -20.8 | 176.8 | -70.2 | -169.3 | -9 | 0 | 0 | 114.2 | ||
| 45 | K | 46 | Very low | 48.9 | Very low | 168 Ų | 168 | 115.9 Ų | 115.9 | 73% | 0.73 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -90 | -6.3 | 175 | -79.5 | -174.6 | 176.6 | 174.6 | 0 | 114.4 | D43 | D43-K45 PolarHBondContact O-N 3.3Å |
| 46 | L | 42.5 | Very low | 48.9 | Very low | 107 Ų | 107 | 117.7 Ų | 117.7 | 56% | 0.56 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -86.5 | -32.8 | 174.9 | -86.9 | 159.4 | 0 | 0 | 0 | 112.3 | R42 D43 L49 D50 | R42-L46 WeakPolarHBondContact O-CD1 3.47Å; D43-L46 PolarHBondContact O-N 3.45Å; L46-L49 PolarHBondContact O-N 3.42Å; L46-D50 PolarHBondContact O-N 3.46Å |
| 47 | S | 46.4 | Very low | 48.7 | Very low | 82 Ų | 82 | 120.8 Ų | 120.8 | 57% | 0.573 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -66.1 | -39.6 | 178.7 | -171.2 | 0 | 0 | 0 | 0 | 112.9 | L49 | S47-L49 PolarHBondContact O-N 3.38Å |
| 48 | E | 46 | Very low | 48.9 | Very low | 115 Ų | 115 | 118.4 Ų | 118.4 | 54% | 0.537 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -81 | -13.8 | -178.7 | -143.3 | -164.8 | 153.3 | 0 | 0 | 113.9 | R52 | E48-R52 VanDerWaalsContact O-CG 3.31Å; E48-R52 WeakPolarHBondContact O-CG 3.38Å; E48-R52 IonicContact OE1-CZ 3.61Å; E48-R52 IonicContact OE1-NE 3.71Å; E48-R52 IonicContact OE1-NH2 2.78Å; E48-R52 PolarHBondContact OE1-NH2 3.02Å |
| 49 | L | 45.7 | Very low | 49 | Very low | 121 Ų | 121 | 114 Ų | 114 | 63% | 0.634 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -89.3 | -30.4 | 177.1 | -143.8 | 79.5 | 0 | 0 | 0 | 111.9 | L46 S47 A53 | L46-L49 PolarHBondContact O-N 3.42Å; S47-L49 PolarHBondContact O-N 3.38Å; L49-A53 VanDerWaalsContact O-CB 3.28Å; L49-A53 WeakPolarHBondContact O-CB 3.48Å; L49-A53 PolarHBondContact O-N 3.28Å |
| 50 | D | 46.3 | Very low | 49.3 | Very low | 108 Ų | 108 | 112.6 Ų | 112.6 | 58% | 0.578 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -67.7 | -48.1 | 176.9 | -152.8 | 40.8 | 0 | 0 | 0 | 110.7 | L46 R52 A53 D54 | L46-D50 PolarHBondContact O-N 3.46Å; D50-R52 VanDerWaalsContact C-N 3.3Å; D50-R52 PolarHBondContact O-N 3.47Å; D50-A53 PolarHBondContact O-N 3.04Å; D50-A53 VanDerWaalsContact O-N 3.15Å; D50-D54 PolarHBondContact O-N 3.29Å |
| 51 | D | 51.1 | Low | 49.4 | Very low | 117 Ų | 117 | 110.3 Ų | 110.3 | 63% | 0.626 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -62.3 | -34.4 | 175.7 | -79 | -28.4 | 0 | 0 | 0 | 113 | A55 | D51-A55 WeakPolarHBondContact O-CB 3.37Å; D51-A55 PolarHBondContact O-N 2.78Å |
| 52 | R | 49.8 | Very low | 49.5 | Very low | 164 Ų | 164 | 109.8 Ų | 109.8 | 62% | 0.619 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -77.9 | -30.7 | 176.6 | -72.8 | -175.5 | -169.6 | -156.6 | 8.6 | 112.3 | E48 D50 L56 | E48-R52 VanDerWaalsContact O-CG 3.31Å; E48-R52 WeakPolarHBondContact O-CG 3.38Å; E48-R52 IonicContact OE1-CZ 3.61Å; E48-R52 IonicContact OE1-NE 3.71Å; E48-R52 IonicContact OE1-NH2 2.78Å; E48-R52 PolarHBondContact OE1-NH2 3.02Å; D50-R52 VanDerWaalsContact C-N 3.3Å; D50-R52 PolarHBondContact O-N 3.47Å; R52-L56 VanDerWaalsContact O-CB 3.29Å; R52-L56 WeakPolarHBondContact O-CB 3.31Å; R52-L56 PolarHBondContact O-N 2.88Å |
| 53 | A | 52.3 | Low | 49.9 | Very low | 52 Ų | 52 | 108.7 Ų | 108.7 | 43% | 0.43 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -69.9 | -43.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | L49 D50 L56 Q57 | L49-A53 VanDerWaalsContact O-CB 3.28Å; L49-A53 WeakPolarHBondContact O-CB 3.48Å; L49-A53 PolarHBondContact O-N 3.28Å; D50-A53 PolarHBondContact O-N 3.04Å; D50-A53 VanDerWaalsContact O-N 3.15Å; A53-L56 PolarHBondContact O-N 3.15Å; A53-Q57 WeakPolarHBondContact O-CB 3.38Å; A53-Q57 PolarHBondContact O-N 2.92Å |
| 54 | D | 50.4 | Low | 49.9 | Very low | 100 Ų | 100 | 109.7 Ų | 109.7 | 54% | 0.535 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65.7 | -41 | 176.6 | -90.2 | -14.9 | 0 | 0 | 0 | 112.3 | D50 L56 Q57 A58 | D50-D54 PolarHBondContact O-N 3.29Å; D54-L56 VanDerWaalsContact C-N 3.34Å; D54-L56 PolarHBondContact O-N 3.47Å; D54-Q57 PolarHBondContact O-N 3.25Å; D54-A58 WeakPolarHBondContact O-CB 3.28Å; D54-A58 PolarHBondContact O-N 3.42Å |
| 55 | A | 54.1 | Low | 50.3 | Low | 67 Ų | 67 | 104.5 Ų | 104.5 | 55% | 0.554 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -64.5 | -37.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | D51 G59 | D51-A55 WeakPolarHBondContact O-CB 3.37Å; D51-A55 PolarHBondContact O-N 2.78Å; A55-G59 PolarHBondContact O-N 3.17Å; A55-G59 VanDerWaalsContact O-N 3.13Å |
| 56 | L | 51.9 | Low | 50.5 | Low | 136 Ų | 136 | 99.3 Ų | 99.3 | 71% | 0.712 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -72.4 | -37.1 | 177.3 | -151.1 | 85.2 | 0 | 0 | 0 | 111.7 | R52 A53 D54 G59 A60 | R52-L56 VanDerWaalsContact O-CB 3.29Å; R52-L56 WeakPolarHBondContact O-CB 3.31Å; R52-L56 PolarHBondContact O-N 2.88Å; A53-L56 PolarHBondContact O-N 3.15Å; D54-L56 VanDerWaalsContact C-N 3.34Å; D54-L56 PolarHBondContact O-N 3.47Å; L56-G59 PolarHBondContact O-N 2.67Å; L56-A60 VanDerWaalsContact O-CB 3.24Å; L56-A60 WeakPolarHBondContact O-CB 3.33Å; L56-A60 PolarHBondContact O-N 3.5Å |
| 57 | Q | 51.7 | Low | 51.1 | Low | 140 Ų | 140 | 96.7 Ų | 96.7 | 65% | 0.654 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -67.7 | -41 | 177.5 | -178.3 | 164.7 | -15.3 | 0 | 0 | 111.9 | A53 D54 A60 S61 | A53-Q57 WeakPolarHBondContact O-CB 3.38Å; A53-Q57 PolarHBondContact O-N 2.92Å; D54-Q57 PolarHBondContact O-N 3.25Å; Q57-A60 PolarHBondContact O-N 2.97Å; Q57-S61 WeakPolarHBondContact O-CB 3.24Å; Q57-S61 PolarHBondContact O-N 2.82Å |
| 58 | A | 55.3 | Low | 51.6 | Low | 61 Ų | 61 | 95.5 Ų | 95.5 | 50% | 0.504 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.2 | -41 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | D54 Q62 | D54-A58 WeakPolarHBondContact O-CB 3.28Å; D54-A58 PolarHBondContact O-N 3.42Å; A58-Q62 WeakPolarHBondContact O-CG 3.29Å; A58-Q62 PolarHBondContact O-N 2.97Å; A58-Q62 VanDerWaalsContact O-N 3.17Å |
| 59 | G | 57.6 | Low | 52 | Low | 43 Ų | 43 | 97 Ų | 97 | 44% | 0.443 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -66.8 | -41.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | A55 L56 Q62 F63 | A55-G59 PolarHBondContact O-N 3.17Å; A55-G59 VanDerWaalsContact O-N 3.13Å; L56-G59 PolarHBondContact O-N 2.67Å; G59-Q62 PolarHBondContact O-N 3.13Å; G59-F63 WeakPolarHBondContact O-CB 3.4Å; G59-F63 PolarHBondContact O-N 2.97Å |
| 60 | A | 53 | Low | 52.4 | Low | 59 Ų | 59 | 96.1 Ų | 96.1 | 49% | 0.488 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67.4 | -40.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L56 Q57 F63 E64 | L56-A60 VanDerWaalsContact O-CB 3.24Å; L56-A60 WeakPolarHBondContact O-CB 3.33Å; L56-A60 PolarHBondContact O-N 3.5Å; Q57-A60 PolarHBondContact O-N 2.97Å; A60-F63 PolarHBondContact O-N 3.47Å; A60-E64 WeakPolarHBondContact O-CB 3.38Å; A60-E64 PolarHBondContact O-N 3.43Å |
| 61 | S | 51.3 | Low | 53.1 | Low | 63 Ų | 63 | 99 Ų | 99 | 44% | 0.441 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -63.1 | -40.2 | 174.3 | 176.9 | 0 | 0 | 0 | 0 | 112.2 | Q57 F63 T65 | Q57-S61 WeakPolarHBondContact O-CB 3.24Å; Q57-S61 PolarHBondContact O-N 2.82Å; S61-F63 VanDerWaalsContact C-N 3.35Å; S61-F63 PolarHBondContact O-N 3.39Å; S61-T65 WeakPolarHBondContact O-CB 3.15Å; S61-T65 PolarHBondContact O-N 3.05Å; S61-T65 PolarHBondContact O-OG1 3.22Å |
| 62 | Q | 50.6 | Low | 53.5 | Low | 138 Ų | 138 | 101.7 Ų | 101.7 | 65% | 0.645 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -67.3 | -33.2 | 173.2 | -77 | -104.9 | 75.9 | 0 | 0 | 113 | A58 G59 S66 | A58-Q62 WeakPolarHBondContact O-CG 3.29Å; A58-Q62 PolarHBondContact O-N 2.97Å; A58-Q62 VanDerWaalsContact O-N 3.17Å; G59-Q62 PolarHBondContact O-N 3.13Å; Q62-S66 VanDerWaalsContact O-CB 3.31Å; Q62-S66 WeakPolarHBondContact O-CB 3.45Å; Q62-S66 PolarHBondContact O-N 2.89Å; Q62-S66 PolarHBondContact O-OG 3.39Å |
| 63 | F | 55.1 | Low | 54.1 | Low | 161 Ų | 161 | 101 Ų | 101 | 71% | 0.706 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -74.1 | -41.2 | 176 | -154.9 | -93.3 | 0 | 0 | 0 | 112.2 | G59 A60 S61 S66 A67 | G59-F63 WeakPolarHBondContact O-CB 3.4Å; G59-F63 PolarHBondContact O-N 2.97Å; A60-F63 PolarHBondContact O-N 3.47Å; S61-F63 VanDerWaalsContact C-N 3.35Å; S61-F63 PolarHBondContact O-N 3.39Å; F63-S66 PolarHBondContact O-N 3.05Å; F63-A67 WeakPolarHBondContact O-CB 3.24Å; F63-A67 PolarHBondContact O-N 2.86Å |
| 64 | E | 48.6 | Very low | 54.9 | Low | 140 Ų | 140 | 105.7 Ų | 105.7 | 65% | 0.654 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -59.4 | -47.6 | 172.8 | -175.5 | -175.5 | -178.8 | 0 | 0 | 110.8 | A60 S66 A67 A68 | A60-E64 WeakPolarHBondContact O-CB 3.38Å; A60-E64 PolarHBondContact O-N 3.43Å; E64-S66 VanDerWaalsContact C-N 3.29Å; E64-S66 PolarHBondContact O-N 3.41Å; E64-A67 PolarHBondContact O-N 3.37Å; E64-A68 VanDerWaalsContact O-CB 3.24Å; E64-A68 WeakPolarHBondContact O-CB 3.31Å; E64-A68 PolarHBondContact O-N 2.82Å |
| 65 | T | 50.3 | Low | 55.9 | Low | 53 Ų | 53 | 109.4 Ų | 109.4 | 33% | 0.325 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -65 | -36 | 179.6 | -48.3 | 0 | 0 | 0 | 0 | 111.4 | S61 K69 | S61-T65 WeakPolarHBondContact O-CB 3.15Å; S61-T65 PolarHBondContact O-N 3.05Å; S61-T65 PolarHBondContact O-OG1 3.22Å; T65-K69 HydrophobicContact CG2-CD 4.1Å; T65-K69 VanDerWaalsContact O-CB 3.3Å; T65-K69 WeakPolarHBondContact O-CB 3.3Å; T65-K69 WeakPolarHBondContact O-CD 3.34Å; T65-K69 WeakPolarHBondContact O-CG 3.42Å; T65-K69 PolarHBondContact O-N 2.77Å |
| 66 | S | 51.6 | Low | 56.8 | Low | 58 Ų | 58 | 113.6 Ų | 113.6 | 41% | 0.406 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -72.8 | -42.5 | 177.7 | -62.3 | 0 | 0 | 0 | 0 | 112.4 | Q62 F63 E64 K69 L70 | Q62-S66 VanDerWaalsContact O-CB 3.31Å; Q62-S66 WeakPolarHBondContact O-CB 3.45Å; Q62-S66 PolarHBondContact O-N 2.89Å; Q62-S66 PolarHBondContact O-OG 3.39Å; F63-S66 PolarHBondContact O-N 3.05Å; E64-S66 VanDerWaalsContact C-N 3.29Å; E64-S66 PolarHBondContact O-N 3.41Å; S66-K69 PolarHBondContact O-N 3.05Å; S66-L70 WeakPolarHBondContact O-CB 3.39Å; S66-L70 WeakPolarHBondContact O-CD1 3.18Å; S66-L70 WeakPolarHBondContact O-CG 3.38Å; S66-L70 PolarHBondContact O-N 3.13Å |
| 67 | A | 54.6 | Low | 58.2 | Low | 52 Ų | 52 | 113.4 Ų | 113.4 | 43% | 0.43 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.7 | -40 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | F63 E64 L70 K71 | F63-A67 WeakPolarHBondContact O-CB 3.24Å; F63-A67 PolarHBondContact O-N 2.86Å; E64-A67 PolarHBondContact O-N 3.37Å; A67-L70 PolarHBondContact O-N 3.42Å; A67-K71 WeakPolarHBondContact O-CB 3.45Å; A67-K71 PolarHBondContact O-N 3.3Å |
| 68 | A | 55.9 | Low | 59.5 | Low | 58 Ų | 58 | 111.5 Ų | 111.5 | 48% | 0.479 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -67.5 | -40.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | E64 K71 R72 | E64-A68 VanDerWaalsContact O-CB 3.24Å; E64-A68 WeakPolarHBondContact O-CB 3.31Å; E64-A68 PolarHBondContact O-N 2.82Å; A68-K71 PolarHBondContact O-N 3.29Å; A68-R72 PolarHBondContact O-N 3.2Å |
| 69 | K | 54.5 | Low | 60.9 | Low | 147 Ų | 147 | 112.1 Ų | 112.1 | 64% | 0.639 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.9 | -38.3 | 175.1 | -76.9 | 170.2 | -179.5 | 166.4 | 0 | 111.9 | T65 S66 K73 | T65-K69 HydrophobicContact CG2-CD 4.1Å; T65-K69 VanDerWaalsContact O-CB 3.3Å; T65-K69 WeakPolarHBondContact O-CB 3.3Å; T65-K69 WeakPolarHBondContact O-CD 3.34Å; T65-K69 WeakPolarHBondContact O-CG 3.42Å; T65-K69 PolarHBondContact O-N 2.77Å; S66-K69 PolarHBondContact O-N 3.05Å; K69-K73 PolarHBondContact O-N 3.42Å |
| 70 | L | 55.3 | Low | 62.3 | Low | 102 Ų | 102 | 117.3 Ų | 117.3 | 53% | 0.534 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -66.9 | -44.9 | 175.6 | -70.7 | 164.1 | 0 | 0 | 0 | 111.4 | S66 A67 R72 K73 Y74 | S66-L70 WeakPolarHBondContact O-CB 3.39Å; S66-L70 WeakPolarHBondContact O-CD1 3.18Å; S66-L70 WeakPolarHBondContact O-CG 3.38Å; S66-L70 PolarHBondContact O-N 3.13Å; A67-L70 PolarHBondContact O-N 3.42Å; L70-R72 VanDerWaalsContact C-N 3.33Å; L70-R72 PolarHBondContact O-N 3.04Å; L70-K73 PolarHBondContact O-N 2.99Å; L70-Y74 WeakPolarHBondContact O-CD2 3.47Å; L70-Y74 PolarHBondContact O-N 3.22Å |
| 71 | K | 59.3 | Low | 64.1 | Low | 169 Ų | 169 | 120.5 Ų | 120.5 | 74% | 0.735 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -58.7 | -42.3 | 180 | -161.5 | 179.1 | -175.4 | -177 | 0 | 112.2 | A67 A68 W75 | A67-K71 WeakPolarHBondContact O-CB 3.45Å; A67-K71 PolarHBondContact O-N 3.3Å; A68-K71 PolarHBondContact O-N 3.29Å; K71-W75 WeakPolarHBondContact O-CB 3.33Å; K71-W75 PolarHBondContact O-N 3.33Å |
| 72 | R | 61.2 | Low | 66 | Low | 173 Ų | 173 | 125.4 Ų | 125.4 | 65% | 0.653 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -69.5 | -37.7 | 179.7 | -161.7 | 164.6 | -178.1 | 148.2 | -1.5 | 112.5 | A68 L70 W75 W76 | A68-R72 PolarHBondContact O-N 3.2Å; L70-R72 VanDerWaalsContact C-N 3.33Å; L70-R72 PolarHBondContact O-N 3.04Å; R72-W75 PolarHBondContact O-N 3.19Å; R72-W76 PolarHBondContact O-N 2.97Å; R72-W76 VanDerWaalsContact O-N 3.13Å |
| 73 | K | 60.9 | Low | 68.1 | Low | 148 Ų | 148 | 121.6 Ų | 121.6 | 64% | 0.643 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -64.8 | -40.8 | 179.3 | -162.5 | 174.6 | -175.3 | -179.8 | 0 | 112.1 | K69 L70 K77 | K69-K73 PolarHBondContact O-N 3.42Å; L70-K73 PolarHBondContact O-N 2.99Å; K73-K77 WeakPolarHBondContact O-CG 3.45Å; K73-K77 PolarHBondContact O-N 3.45Å |
| 74 | Y | 69.1 | Low | 70 | Confident | 152 Ų | 152 | 118.5 Ų | 118.5 | 60% | 0.596 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -75.7 | -35.3 | 176.8 | -79.2 | -84.5 | 0 | 0 | 0 | 113.1 | L70 W76 K77 N78 | L70-Y74 WeakPolarHBondContact O-CD2 3.47Å; L70-Y74 PolarHBondContact O-N 3.22Å; Y74-W76 VanDerWaalsContact C-N 3.34Å; Y74-W76 PolarHBondContact O-N 3.45Å; Y74-K77 PolarHBondContact O-N 2.96Å; Y74-N78 PolarHBondContact O-N 3.25Å |
| 75 | W | 72.4 | Confident | 72.2 | Confident | 177 Ų | 177 | 116.1 Ų | 116.1 | 67% | 0.67 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -60.9 | -42.9 | 176.3 | -168 | 78 | 0 | 0 | 0 | 112.1 | K71 R72 N78 C79 | K71-W75 WeakPolarHBondContact O-CB 3.33Å; K71-W75 PolarHBondContact O-N 3.33Å; R72-W75 PolarHBondContact O-N 3.19Å; W75-N78 PolarHBondContact O-N 2.96Å; W75-C79 WeakPolarHBondContact O-CB 3.33Å; W75-C79 PolarHBondContact O-N 3.39Å |
| 76 | W | 72.8 | Confident | 74.3 | Confident | 155 Ų | 155 | 118.4 Ų | 118.4 | 59% | 0.587 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -67.6 | -39.4 | 176.9 | -79.1 | 54.3 | 0 | 0 | 0 | 112.6 | R72 Y74 C79 K80 | R72-W76 PolarHBondContact O-N 2.97Å; R72-W76 VanDerWaalsContact O-N 3.13Å; Y74-W76 VanDerWaalsContact C-N 3.34Å; Y74-W76 PolarHBondContact O-N 3.45Å; W76-C79 PolarHBondContact O-N 2.94Å; W76-K80 WeakPolarHBondContact O-CB 3.37Å; W76-K80 PolarHBondContact O-N 3.29Å |
| 77 | K | 80.4 | Confident | 76.5 | Confident | 132 Ų | 132 | 118.1 Ų | 118.1 | 57% | 0.574 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -62.8 | -45.7 | 175.3 | -73.3 | -177.7 | 110.3 | -172.6 | 0 | 111.4 | K73 Y74 K80 M81 | K73-K77 WeakPolarHBondContact O-CG 3.45Å; K73-K77 PolarHBondContact O-N 3.45Å; Y74-K77 PolarHBondContact O-N 2.96Å; K77-K80 PolarHBondContact O-N 3.3Å; K77-M81 VanDerWaalsContact O-CG 3.28Å; K77-M81 WeakPolarHBondContact O-CG 3.29Å; K77-M81 PolarHBondContact O-N 3.49Å |
| 78 | N | 80.8 | Confident | 78.5 | Confident | 100 Ų | 100 | 119.2 Ų | 119.2 | 54% | 0.535 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -60.9 | -50.7 | 175.7 | -93.7 | 15 | 0 | 0 | 0 | 110.9 | Y74 W75 K80 M81 W82 | Y74-N78 PolarHBondContact O-N 3.25Å; W75-N78 PolarHBondContact O-N 2.96Å; N78-K80 VanDerWaalsContact C-N 3.26Å; N78-K80 PolarHBondContact O-N 3.43Å; N78-M81 PolarHBondContact O-N 3.05Å; N78-M81 VanDerWaalsContact O-N 3.09Å; N78-W82 PolarHBondContact O-N 3.29Å |
| 79 | C | 84.2 | Confident | 80.5 | Confident | 74 Ų | 74 | 120.4 Ų | 120.4 | 50% | 0.5 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -57.1 | -40.7 | -179.7 | -160.4 | 0 | 0 | 0 | 0 | 112.3 | W75 W76 A83 | W75-C79 WeakPolarHBondContact O-CB 3.33Å; W75-C79 PolarHBondContact O-N 3.39Å; W76-C79 PolarHBondContact O-N 2.94Å; C79-A83 WeakPolarHBondContact O-CB 3.49Å; C79-A83 PolarHBondContact O-N 3.49Å |
| 80 | K | 87.3 | Confident | 82.6 | Confident | 152 Ų | 152 | 116.9 Ų | 116.9 | 66% | 0.661 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -67.8 | -38.8 | 177.2 | -169.6 | 157.3 | 179 | 156.4 | 0 | 112.6 | W76 K77 N78 A83 I84 | W76-K80 WeakPolarHBondContact O-CB 3.37Å; W76-K80 PolarHBondContact O-N 3.29Å; K77-K80 PolarHBondContact O-N 3.3Å; N78-K80 VanDerWaalsContact C-N 3.26Å; N78-K80 PolarHBondContact O-N 3.43Å; K80-A83 PolarHBondContact O-N 3.33Å; K80-I84 HydrophobicContact CG-CD1 4.28Å; K80-I84 WeakPolarHBondContact O-CD1 3.45Å; K80-I84 VanDerWaalsContact O-CG1 3.29Å; K80-I84 WeakPolarHBondContact O-CG1 3.48Å; K80-I84 PolarHBondContact O-N 3.09Å; K80-I84 VanDerWaalsContact O-N 3.14Å |
| 81 | M | 89.9 | Confident | 84.6 | Confident | 127 Ų | 127 | 116.7 Ų | 116.7 | 63% | 0.626 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -64.8 | -45.1 | 174.8 | -71.9 | -63.3 | -65.1 | 0 | 0 | 112 | K77 N78 A83 I84 L85 | K77-M81 VanDerWaalsContact O-CG 3.28Å; K77-M81 WeakPolarHBondContact O-CG 3.29Å; K77-M81 PolarHBondContact O-N 3.49Å; N78-M81 PolarHBondContact O-N 3.05Å; N78-M81 VanDerWaalsContact O-N 3.09Å; M81-A83 PolarHBondContact O-N 3.14Å; M81-I84 PolarHBondContact O-N 2.97Å; M81-L85 WeakPolarHBondContact O-CB 3.34Å; M81-L85 PolarHBondContact O-N 3.01Å |
| 82 | W | 91.3 | Very high | 86.4 | Confident | 165 Ų | 165 | 112.8 Ų | 112.8 | 63% | 0.625 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -61.4 | -42.1 | 176.5 | -78.2 | 102.5 | 0 | 0 | 0 | 112 | N78 I84 L85 I86 | N78-W82 PolarHBondContact O-N 3.29Å; W82-I84 PolarHBondContact O-N 3.49Å; W82-L85 PolarHBondContact O-N 3.02Å; W82-I86 WeakPolarHBondContact O-CG1 3.28Å; W82-I86 PolarHBondContact O-N 3.47Å |
| 83 | A | 93.8 | Very high | 88.1 | Confident | 59 Ų | 59 | 108.6 Ų | 108.6 | 49% | 0.488 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.7 | -42.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | C79 K80 M81 I86 A87 | C79-A83 WeakPolarHBondContact O-CB 3.49Å; C79-A83 PolarHBondContact O-N 3.49Å; K80-A83 PolarHBondContact O-N 3.33Å; M81-A83 PolarHBondContact O-N 3.14Å; A83-I86 PolarHBondContact O-N 2.93Å; A83-A87 PolarHBondContact O-N 3.01Å |
| 84 | I | 95 | Very high | 89.8 | Confident | 95 Ų | 95 | 105.6 Ų | 105.6 | 49% | 0.487 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.6 | -42.4 | 176.6 | -66.3 | 164.2 | 0 | 0 | 0 | 110.6 | K80 M81 W82 I86 A87 V88 | K80-I84 HydrophobicContact CG-CD1 4.28Å; K80-I84 WeakPolarHBondContact O-CD1 3.45Å; K80-I84 VanDerWaalsContact O-CG1 3.29Å; K80-I84 WeakPolarHBondContact O-CG1 3.48Å; K80-I84 PolarHBondContact O-N 3.09Å; K80-I84 VanDerWaalsContact O-N 3.14Å; M81-I84 PolarHBondContact O-N 2.97Å; W82-I84 PolarHBondContact O-N 3.49Å; I84-I86 PolarHBondContact O-N 3.08Å; I84-A87 PolarHBondContact O-N 3.45Å; I84-V88 HydrophobicContact CG2-CG2 4.49Å; I84-V88 WeakPolarHBondContact O-CG2 3.32Å; I84-V88 PolarHBondContact O-N 3.45Å |
| 85 | L | 94.9 | Very high | 91.2 | Very high | 90 Ų | 90 | 103.4 Ų | 103.4 | 47% | 0.471 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.4 | -47.2 | 179.2 | -156.5 | 174.1 | 0 | 0 | 0 | 110.9 | M81 W82 A87 V88 I89 | M81-L85 WeakPolarHBondContact O-CB 3.34Å; M81-L85 PolarHBondContact O-N 3.01Å; W82-L85 PolarHBondContact O-N 3.02Å; L85-A87 VanDerWaalsContact C-N 3.35Å; L85-A87 PolarHBondContact O-N 3.26Å; L85-V88 PolarHBondContact O-N 3.41Å; L85-I89 HydrophobicContact CD2-CD1 3.29Å; L85-I89 HydrophobicContact CD2-CG1 3.89Å; L85-I89 WeakPolarHBondContact O-CG1 3.3Å; L85-I89 PolarHBondContact O-N 3.29Å |
| 86 | I | 96 | Very high | 92.3 | Very high | 102 Ų | 102 | 99.8 Ų | 99.8 | 52% | 0.523 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.5 | -44.5 | 176.7 | -66.7 | 165.7 | 0 | 0 | 0 | 110.9 | W82 A83 I84 V88 I89 V90 | W82-I86 WeakPolarHBondContact O-CG1 3.28Å; W82-I86 PolarHBondContact O-N 3.47Å; A83-I86 PolarHBondContact O-N 2.93Å; I84-I86 PolarHBondContact O-N 3.08Å; I86-V88 VanDerWaalsContact C-N 3.34Å; I86-V88 PolarHBondContact O-N 3.37Å; I86-I89 PolarHBondContact O-N 2.98Å; I86-V90 HydrophobicContact CG2-CG2 4.4Å; I86-V90 WeakPolarHBondContact O-CG2 3.42Å; I86-V90 PolarHBondContact O-N 3.24Å |
| 87 | A | 96.7 | Very high | 93.5 | Very high | 51 Ų | 51 | 97.3 Ų | 97.3 | 42% | 0.421 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.9 | -43 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | A83 I84 L85 V90 I91 | A83-A87 PolarHBondContact O-N 3.01Å; I84-A87 PolarHBondContact O-N 3.45Å; L85-A87 VanDerWaalsContact C-N 3.35Å; L85-A87 PolarHBondContact O-N 3.26Å; A87-V90 PolarHBondContact O-N 3.41Å; A87-I91 VanDerWaalsContact O-CG1 3.32Å; A87-I91 WeakPolarHBondContact O-CG1 3.36Å; A87-I91 PolarHBondContact O-N 3.04Å; A87-I91 VanDerWaalsContact O-N 3.08Å |
| 88 | V | 97.4 | Very high | 94.3 | Very high | 76 Ų | 76 | 96 Ų | 96 | 46% | 0.461 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.4 | -43.4 | 176.5 | 172.8 | 0 | 0 | 0 | 0 | 111.3 | I84 L85 I86 V90 I91 I92 | I84-V88 HydrophobicContact CG2-CG2 4.49Å; I84-V88 WeakPolarHBondContact O-CG2 3.32Å; I84-V88 PolarHBondContact O-N 3.45Å; L85-V88 PolarHBondContact O-N 3.41Å; I86-V88 VanDerWaalsContact C-N 3.34Å; I86-V88 PolarHBondContact O-N 3.37Å; V88-V90 VanDerWaalsContact C-N 3.35Å; V88-V90 PolarHBondContact O-N 3.48Å; V88-I91 PolarHBondContact O-N 3.29Å; V88-I92 HydrophobicContact CG1-CD1 3.89Å; V88-I92 WeakPolarHBondContact O-CG1 3.32Å; V88-I92 PolarHBondContact O-N 2.95Å |
| 89 | I | 97.5 | Very high | 95 | Very high | 82 Ų | 82 | 101.3 Ų | 101.3 | 42% | 0.421 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.5 | -46.4 | 176.8 | -70.2 | 171.3 | 0 | 0 | 0 | 110.8 | L85 I86 I91 I92 I93 | L85-I89 HydrophobicContact CD2-CD1 3.29Å; L85-I89 HydrophobicContact CD2-CG1 3.89Å; L85-I89 WeakPolarHBondContact O-CG1 3.3Å; L85-I89 PolarHBondContact O-N 3.29Å; I86-I89 PolarHBondContact O-N 2.98Å; I89-I91 VanDerWaalsContact C-N 3.32Å; I89-I91 PolarHBondContact O-N 3.01Å; I89-I92 PolarHBondContact O-N 3.28Å; I89-I93 HydrophobicContact CG2-CD1 3.74Å; I89-I93 HydrophobicContact CG2-CG1 4.35Å; I89-I93 WeakPolarHBondContact O-CG1 3.34Å; I89-I93 PolarHBondContact O-N 3.25Å |
| 90 | V | 97.6 | Very high | 95.5 | Very high | 74 Ų | 74 | 101.5 Ų | 101.5 | 45% | 0.448 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.2 | -42.7 | 179.3 | 171.6 | 0 | 0 | 0 | 0 | 111.2 | I86 A87 V88 I92 I93 I94 | I86-V90 HydrophobicContact CG2-CG2 4.4Å; I86-V90 WeakPolarHBondContact O-CG2 3.42Å; I86-V90 PolarHBondContact O-N 3.24Å; A87-V90 PolarHBondContact O-N 3.41Å; V88-V90 VanDerWaalsContact C-N 3.35Å; V88-V90 PolarHBondContact O-N 3.48Å; V90-I92 PolarHBondContact O-N 3.45Å; V90-I93 PolarHBondContact O-N 3Å; V90-I94 HydrophobicContact CG1-CD1 3.9Å; V90-I94 VanDerWaalsContact O-CG1 3.3Å; V90-I94 WeakPolarHBondContact O-CG1 3.37Å; V90-I94 PolarHBondContact O-N 3.26Å |
| 91 | I | 97.6 | Very high | 95.6 | Very high | 98 Ų | 98 | 99.7 Ų | 99.7 | 50% | 0.503 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.5 | -45.1 | 176.8 | -67.9 | 166.2 | 0 | 0 | 0 | 111 | A87 V88 I89 I93 I94 I95 | A87-I91 VanDerWaalsContact O-CG1 3.32Å; A87-I91 WeakPolarHBondContact O-CG1 3.36Å; A87-I91 PolarHBondContact O-N 3.04Å; A87-I91 VanDerWaalsContact O-N 3.08Å; V88-I91 PolarHBondContact O-N 3.29Å; I89-I91 VanDerWaalsContact C-N 3.32Å; I89-I91 PolarHBondContact O-N 3.01Å; I91-I93 VanDerWaalsContact C-N 3.33Å; I91-I93 PolarHBondContact O-N 3.44Å; I91-I94 PolarHBondContact O-N 2.95Å; I91-I95 HydrophobicContact CG2-CD1 3.96Å; I91-I95 WeakPolarHBondContact O-CG1 3.39Å; I91-I95 PolarHBondContact O-N 3.49Å |
| 92 | I | 97.5 | Very high | 95.4 | Very high | 87 Ų | 87 | 100.8 Ų | 100.8 | 45% | 0.446 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -61.1 | -44.2 | 178.1 | -67.6 | 166.9 | 0 | 0 | 0 | 110.6 | V88 I89 V90 I94 I95 I96 | V88-I92 HydrophobicContact CG1-CD1 3.89Å; V88-I92 WeakPolarHBondContact O-CG1 3.32Å; V88-I92 PolarHBondContact O-N 2.95Å; I89-I92 PolarHBondContact O-N 3.28Å; V90-I92 PolarHBondContact O-N 3.45Å; I92-I94 VanDerWaalsContact C-N 3.32Å; I92-I94 PolarHBondContact O-N 3.46Å; I92-I95 PolarHBondContact O-N 3.02Å; I92-I96 HydrophobicContact CG2-CD1 3.87Å; I92-I96 HydrophobicContact CG2-CG1 4.48Å; I92-I96 WeakPolarHBondContact O-CG1 3.32Å; I92-I96 PolarHBondContact O-N 3.46Å |
| 93 | I | 97.2 | Very high | 95.6 | Very high | 84 Ų | 84 | 97.6 Ų | 97.6 | 43% | 0.431 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -59.9 | -44.2 | 177.1 | -68 | 169 | 0 | 0 | 0 | 110.7 | I89 V90 I91 I95 I96 I97 | I89-I93 HydrophobicContact CG2-CD1 3.74Å; I89-I93 HydrophobicContact CG2-CG1 4.35Å; I89-I93 WeakPolarHBondContact O-CG1 3.34Å; I89-I93 PolarHBondContact O-N 3.25Å; V90-I93 PolarHBondContact O-N 3Å; I91-I93 VanDerWaalsContact C-N 3.33Å; I91-I93 PolarHBondContact O-N 3.44Å; I93-I95 VanDerWaalsContact C-N 3.35Å; I93-I95 PolarHBondContact O-N 3.22Å; I93-I96 PolarHBondContact O-N 3.24Å; I93-I97 HydrophobicContact CG2-CD1 3.8Å; I93-I97 HydrophobicContact CG2-CG1 4.41Å; I93-I97 WeakPolarHBondContact O-CG1 3.35Å; I93-I97 PolarHBondContact O-N 2.98Å |
| 94 | I | 96.8 | Very high | 95.6 | Very high | 86 Ų | 86 | 99.6 Ų | 99.6 | 44% | 0.441 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60.6 | -44.6 | 177.7 | -69.3 | 165.5 | 0 | 0 | 0 | 110.9 | V90 I91 I92 I96 I97 I98 | V90-I94 HydrophobicContact CG1-CD1 3.9Å; V90-I94 VanDerWaalsContact O-CG1 3.3Å; V90-I94 WeakPolarHBondContact O-CG1 3.37Å; V90-I94 PolarHBondContact O-N 3.26Å; I91-I94 PolarHBondContact O-N 2.95Å; I92-I94 VanDerWaalsContact C-N 3.32Å; I92-I94 PolarHBondContact O-N 3.46Å; I94-I96 VanDerWaalsContact C-N 3.33Å; I94-I96 PolarHBondContact O-N 3.31Å; I94-I97 PolarHBondContact O-N 2.95Å; I94-I98 HydrophobicContact CG2-CD1 3.74Å; I94-I98 HydrophobicContact CG2-CG1 4.41Å; I94-I98 VanDerWaalsContact O-CG1 3.32Å; I94-I98 WeakPolarHBondContact O-CG1 3.14Å; I94-I98 PolarHBondContact O-N 2.99Å |
| 95 | I | 97.1 | Very high | 95.7 | Very high | 105 Ų | 105 | 99.8 Ų | 99.8 | 54% | 0.538 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -60.6 | -44.3 | 177.6 | -67.8 | 167 | 0 | 0 | 0 | 110.7 | I91 I92 I93 I97 I98 W99 | I91-I95 HydrophobicContact CG2-CD1 3.96Å; I91-I95 WeakPolarHBondContact O-CG1 3.39Å; I91-I95 PolarHBondContact O-N 3.49Å; I92-I95 PolarHBondContact O-N 3.02Å; I93-I95 VanDerWaalsContact C-N 3.35Å; I93-I95 PolarHBondContact O-N 3.22Å; I95-I97 PolarHBondContact O-N 2.91Å; I95-I98 PolarHBondContact O-N 3.03Å; I95-W99 WeakPolarHBondContact O-CB 3.33Å; I95-W99 PolarHBondContact O-N 3.37Å |
| 96 | I | 97.1 | Very high | 95.7 | Very high | 101 Ų | 101 | 100.4 Ų | 100.4 | 52% | 0.518 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -62.3 | -43.5 | 178.3 | -68.3 | 168.5 | 0 | 0 | 0 | 110.8 | I92 I93 I94 W99 A100 | I92-I96 HydrophobicContact CG2-CD1 3.87Å; I92-I96 HydrophobicContact CG2-CG1 4.48Å; I92-I96 WeakPolarHBondContact O-CG1 3.32Å; I92-I96 PolarHBondContact O-N 3.46Å; I93-I96 PolarHBondContact O-N 3.24Å; I94-I96 VanDerWaalsContact C-N 3.33Å; I94-I96 PolarHBondContact O-N 3.31Å; I96-W99 PolarHBondContact O-N 2.91Å; I96-A100 VanDerWaalsContact O-CB 3.25Å; I96-A100 WeakPolarHBondContact O-CB 3.25Å; I96-A100 PolarHBondContact O-N 3.35Å |
| 97 | I | 97.1 | Very high | 95.7 | Very high | 103 Ų | 103 | 100.3 Ų | 100.3 | 53% | 0.528 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -62.8 | -45.8 | 178.2 | -69.2 | 168.8 | 0 | 0 | 0 | 110.8 | I93 I94 I95 W99 A100 C101 | I93-I97 HydrophobicContact CG2-CD1 3.8Å; I93-I97 HydrophobicContact CG2-CG1 4.41Å; I93-I97 WeakPolarHBondContact O-CG1 3.35Å; I93-I97 PolarHBondContact O-N 2.98Å; I94-I97 PolarHBondContact O-N 2.95Å; I95-I97 PolarHBondContact O-N 2.91Å; I97-W99 VanDerWaalsContact C-N 3.34Å; I97-W99 PolarHBondContact O-N 3.37Å; I97-A100 PolarHBondContact O-N 3.48Å; I97-C101 WeakPolarHBondContact O-CB 3.37Å; I97-C101 PolarHBondContact O-N 3.36Å |
| 98 | I | 96.8 | Very high | 95.6 | Very high | 106 Ų | 106 | 103.6 Ų | 103.6 | 54% | 0.544 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -62 | -44.5 | 178.2 | -67.4 | 167.2 | 0 | 0 | 0 | 110.3 | I94 I95 C101 S102 | I94-I98 HydrophobicContact CG2-CD1 3.74Å; I94-I98 HydrophobicContact CG2-CG1 4.41Å; I94-I98 VanDerWaalsContact O-CG1 3.32Å; I94-I98 WeakPolarHBondContact O-CG1 3.14Å; I94-I98 PolarHBondContact O-N 2.99Å; I95-I98 PolarHBondContact O-N 3.03Å; I98-C101 PolarHBondContact O-N 3.49Å; I98-S102 VanDerWaalsContact O-CB 3.25Å; I98-S102 WeakPolarHBondContact O-CB 3.25Å; I98-S102 PolarHBondContact O-N 2.85Å |
| 99 | W | 96.8 | Very high | 95.5 | Very high | 211 Ų | 211 | 105.6 Ų | 105.6 | 80% | 0.799 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -67.3 | -36 | 179.5 | -169.1 | 72.6 | 0 | 0 | 0 | 112.9 | I95 I96 I97 | I95-W99 WeakPolarHBondContact O-CB 3.33Å; I95-W99 PolarHBondContact O-N 3.37Å; I96-W99 PolarHBondContact O-N 2.91Å; I97-W99 VanDerWaalsContact C-N 3.34Å; I97-W99 PolarHBondContact O-N 3.37Å |
| 100 | A | 94.6 | Very high | 95.4 | Very high | 78 Ų | 78 | 107.4 Ų | 107.4 | 65% | 0.645 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -76.1 | -24.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | I96 I97 | I96-A100 VanDerWaalsContact O-CB 3.25Å; I96-A100 WeakPolarHBondContact O-CB 3.25Å; I96-A100 PolarHBondContact O-N 3.35Å; I97-A100 PolarHBondContact O-N 3.48Å |
| 101 | C | 88.6 | Confident | 95.2 | Very high | 113 Ų | 113 | 110.2 Ų | 110.2 | 76% | 0.764 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -92.3 | -12.5 | -179.8 | -165.7 | 0 | 0 | 0 | 0 | 113.2 | I97 I98 | I97-C101 WeakPolarHBondContact O-CB 3.37Å; I97-C101 PolarHBondContact O-N 3.36Å; I98-C101 PolarHBondContact O-N 3.49Å |
| 102 | S | 84.9 | Confident | 95 | Very high | 150 Ų | 150 | 111.3 Ų | 111.3 | 100% | 1.049 | 61% | 0.609 | S | S | * | * | trans | -97.3 | 0 | 178.6 | -166.5 | 0 | 0 | 0 | 0 | 112.2 | I98 | I98-S102 VanDerWaalsContact O-CB 3.25Å; I98-S102 WeakPolarHBondContact O-CB 3.25Å; I98-S102 PolarHBondContact O-N 2.85Å |
Retrieved 102 of 102 residues in 45.4 ms
(Link to these results)