| 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 | 47.4 | Very low | 48.1 | Very low | 240 Ų | 240 | 142.5 Ų | 142.5 | 100% | 1.182 | 82% | 0.823 | S | S | * | * | 0 | 99.9 | 0 | -121.8 | 89.3 | 143.2 | 0 | 0 | 107.9 | |||||
| 2 | N | 41.3 | Very low | 47.7 | Very low | 168 Ų | 168 | 144.7 Ų | 144.7 | 90% | 0.898 | 83% | 0.828 | S | S | * | * | trans | -140.2 | 141.3 | 151.6 | -156.3 | 11.2 | 0 | 0 | 0 | 108.4 | ||||
| 3 | L | 44.4 | Very low | 47.5 | Very low | 150 Ų | 150 | 138.1 Ų | 138.1 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | trans | -92.8 | 149.8 | -141.4 | -145.4 | 68.8 | 0 | 0 | 0 | 111.5 | ||||
| 4 | H | 43.6 | Very low | 47.6 | Very low | 188 Ų | 188 | 135.9 Ų | 135.9 | 87% | 0.87 | 82% | 0.816 | S | S | * | * | trans | -40.7 | 138.2 | 154.2 | -88.4 | 170.4 | 0 | 0 | 0 | 112.4 | ||||
| 5 | S | 55.1 | Low | 47.9 | Very low | 106 Ų | 106 | 134.3 Ų | 134.3 | 74% | 0.741 | 81% | 0.814 | S | S | * | * | -174.3 | 100.5 | 125.9 | -159.6 | 0 | 0 | 0 | 0 | 107.8 | |||||
| 6 | V | 54.6 | Low | 47.6 | Very low | 134 Ų | 134 | 135.7 Ų | 135.7 | 81% | 0.812 | 82% | 0.815 | S | S | * | * | 79.6 | 114.6 | 100.8 | 112.1 | 0 | 0 | 0 | 0 | 113 | |||||
| 7 | G | 52.5 | Low | 47.3 | Very low | 78 Ų | 78 | 131.3 Ų | 131.3 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | -159.3 | 88.9 | 169.5 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 8 | S | 54.8 | Low | 47.3 | Very low | 111 Ų | 111 | 130.3 Ų | 130.3 | 78% | 0.776 | 80% | 0.804 | S | S | * | * | trans | -57.9 | 135.4 | -176.6 | -56.4 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 9 | Q | 46.3 | Very low | 47.5 | Very low | 181 Ų | 181 | 133.6 Ų | 133.6 | 85% | 0.846 | 81% | 0.812 | S | S | * | * | trans | -55.7 | 154.3 | 141.8 | -75.7 | 176.8 | 28.9 | 0 | 0 | 108.2 | ||||
| 10 | P | 45 | Very low | 47.4 | Very low | 97 Ų | 97 | 130.1 Ų | 130.1 | 63% | 0.63 | 80% | 0.803 | S | S | * | * | cis | -155 | -174.8 | 44 | 39.8 | -16.6 | 0 | 0 | 0 | 116.4 | ||||
| 11 | T | 44.3 | Very low | 47.7 | Very low | 115 Ų | 115 | 133.6 Ų | 133.6 | 71% | 0.706 | 81% | 0.81 | S | S | * | * | trans | 70.4 | 138.6 | 145.3 | 60.9 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 12 | L | 43.8 | Very low | 47.8 | Very low | 168 Ų | 168 | 125.4 Ų | 125.4 | 88% | 0.88 | 79% | 0.788 | S | S | * | * | cis | -171.8 | 153.4 | 26.8 | -119.2 | 150.5 | 0 | 0 | 0 | 106.6 | ||||
| 13 | G | 44.2 | Very low | 48.7 | Very low | 59 Ų | 59 | 125.2 Ų | 125.2 | 61% | 0.608 | 77% | 0.774 | S | S | * | * | trans | 99.5 | 70.5 | 146.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | S15 | G13-S15 PolarHBondContact O-N 2.91Š| ||
| 14 | A | 49.2 | Very low | 49.4 | Very low | 107 Ų | 107 | 123.7 Ų | 123.7 | 88% | 0.884 | 77% | 0.774 | S | S | * | * | trans | -57.1 | 89.4 | 136.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | D16 | A14-D16 PolarHBondContact O-N 3.27Š| ||
| 15 | S | 52.9 | Low | 50.3 | Low | 113 Ų | 113 | 119.6 Ų | 119.6 | 79% | 0.79 | 76% | 0.755 | S | S | * | * | trans | -87.5 | 73.5 | 161.6 | 60.2 | 0 | 0 | 0 | 0 | 107.8 | G13 | G13-S15 PolarHBondContact O-N 2.91Š| ||
| 16 | D | 42 | Very low | 50.7 | Low | 156 Ų | 156 | 117.3 Ų | 117.3 | 83% | 0.834 | 74% | 0.739 | S | S | * | * | trans | -61.8 | 126.2 | 149.3 | -179.9 | 26.4 | 0 | 0 | 0 | 107.3 | A14 | A14-D16 PolarHBondContact O-N 3.27Š| ||
| 17 | G | 43 | Very low | 51.6 | Low | 61 Ų | 61 | 118.3 Ų | 118.3 | 63% | 0.629 | 73% | 0.732 | S | S | * | * | trans | 179.4 | 47.3 | -169.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | M19 | G17-M19 PolarHBondContact O-N 2.8Š| ||
| 18 | S | 47.8 | Very low | 52.5 | Low | 113 Ų | 113 | 123.5 Ų | 123.5 | 79% | 0.79 | 73% | 0.727 | S | S | * | * | trans | -47.3 | 121.1 | 168.7 | -176.4 | 0 | 0 | 0 | 0 | 109.5 | G20 | S18-G20 PolarHBondContact O-N 3.18Š| ||
| 19 | M | 50 | Low | 53.2 | Low | 194 Ų | 194 | 123 Ų | 123 | 96% | 0.956 | 72% | 0.716 | S | S | * | * | trans | -54.4 | 91.1 | -176.6 | -80.1 | -167.2 | -93 | 0 | 0 | 112 | G17 | G17-M19 PolarHBondContact O-N 2.8Š| ||
| 20 | G | 46.8 | Very low | 54.5 | Low | 62 Ų | 62 | 120.6 Ų | 120.6 | 64% | 0.639 | 70% | 0.704 | S | S | * | * | trans | -97.7 | 88.4 | 162.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | S18 | S18-G20 PolarHBondContact O-N 3.18Š| ||
| 21 | Q | 53.6 | Low | 56 | Low | 204 Ų | 204 | 122 Ų | 122 | 95% | 0.953 | 70% | 0.703 | S | S | * | * | trans | 178.5 | 96.5 | 144.8 | -100.5 | 166.4 | 65.2 | 0 | 0 | 112 | ||||
| 22 | G | 49.3 | Very low | 57.5 | Low | 69 Ų | 69 | 120.3 Ų | 120.3 | 71% | 0.711 | 69% | 0.692 | S | S | * | * | trans | 168.4 | 127.6 | 163.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 23 | R | 58.8 | Low | 59.1 | Low | 163 Ų | 163 | 118.8 Ų | 118.8 | 62% | 0.615 | 68% | 0.68 | S | S | * | * | cis | -157.1 | 127.4 | 1.7 | -59.1 | 163.3 | 83.4 | 134.3 | -2.7 | 104.6 | Q25 S26 | R23-Q25 HydrophobicContact CB-CB 3.88Å; R23-Q25 VanDerWaalsContact NE-OE1 3.09Å; R23-Q25 PolarHBondContact O-N 2.9Å; R23-S26 PolarHBondContact O-N 3.39Å; R23-S26 PolarHBondContact O-OG 3.39Å | ||
| 24 | P | 59.9 | Low | 60.9 | Low | 119 Ų | 119 | 118.8 Ų | 118.8 | 77% | 0.773 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -55.3 | -19.3 | 166.3 | 20.2 | -29.7 | 0 | 0 | 0 | 112.5 | S26 K27 R28 | P24-S26 VanDerWaalsContact C-N 3.32Å; P24-S26 PolarHBondContact O-N 3.04Å; P24-K27 PolarHBondContact O-N 2.91Å; P24-R28 PolarHBondContact O-N 3.44Å |
| 25 | Q | 61.8 | Low | 62.4 | Low | 102 Ų | 102 | 119.6 Ų | 119.6 | 48% | 0.477 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -56.4 | -36.3 | 171.8 | -164.3 | 175.8 | 12.9 | 0 | 0 | 113.7 | R23 K27 R28 L29 | R23-Q25 HydrophobicContact CB-CB 3.88Å; R23-Q25 VanDerWaalsContact NE-OE1 3.09Å; R23-Q25 PolarHBondContact O-N 2.9Å; Q25-K27 PolarHBondContact O-N 3.26Å; Q25-R28 PolarHBondContact O-N 2.87Å; Q25-L29 HydrophobicContact CG-CD1 4.24Å; Q25-L29 WeakPolarHBondContact O-CG 3.44Å; Q25-L29 PolarHBondContact O-N 3.49Å |
| 26 | S | 64.9 | Low | 63.9 | Low | 57 Ų | 57 | 118.1 Ų | 118.1 | 40% | 0.399 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -68.1 | -36.1 | -178.8 | 58.7 | 0 | 0 | 0 | 0 | 112.4 | R23 P24 L29 Q30 | R23-S26 PolarHBondContact O-N 3.39Å; R23-S26 PolarHBondContact O-OG 3.39Å; P24-S26 VanDerWaalsContact C-N 3.32Å; P24-S26 PolarHBondContact O-N 3.04Å; S26-L29 PolarHBondContact O-N 3.01Å; S26-Q30 WeakPolarHBondContact O-CB 3.33Å; S26-Q30 PolarHBondContact O-N 2.93Å |
| 27 | K | 73.1 | Confident | 66 | Low | 155 Ų | 155 | 116 Ų | 116 | 67% | 0.674 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -65.2 | -42.6 | 175.5 | -66.6 | -173.4 | -179.9 | -178.6 | 0 | 111.9 | P24 Q25 Q30 Q31 | P24-K27 PolarHBondContact O-N 2.91Å; Q25-K27 PolarHBondContact O-N 3.26Å; K27-Q30 PolarHBondContact O-N 3.17Å; K27-Q31 WeakPolarHBondContact O-CG 3.49Å; K27-Q31 PolarHBondContact O-N 2.92Å |
| 28 | R | 71 | Confident | 68.3 | Low | 187 Ų | 187 | 119.5 Ų | 119.5 | 71% | 0.706 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -62.2 | -44.3 | 175.2 | -72.9 | -77 | -170.5 | 170.3 | 0.7 | 111.2 | P24 Q25 Q31 T32 | P24-R28 PolarHBondContact O-N 3.44Å; Q25-R28 PolarHBondContact O-N 2.87Å; R28-Q31 PolarHBondContact O-N 3.04Å; R28-T32 PolarHBondContact O-N 3.39Å; R28-T32 PolarHBondContact O-OG1 3.33Å; R28-T32 VanDerWaalsContact O-OG1 3.1Å |
| 29 | L | 70.1 | Confident | 70.1 | Confident | 102 Ų | 102 | 117.8 Ų | 117.8 | 53% | 0.534 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -65.1 | -41.4 | 177.5 | -69 | 172.6 | 0 | 0 | 0 | 112.5 | Q25 S26 T32 Q33 | Q25-L29 HydrophobicContact CG-CD1 4.24Å; Q25-L29 WeakPolarHBondContact O-CG 3.44Å; Q25-L29 PolarHBondContact O-N 3.49Å; S26-L29 PolarHBondContact O-N 3.01Å; L29-T32 PolarHBondContact O-N 3.44Å; L29-Q33 PolarHBondContact O-N 3.36Å |
| 30 | Q | 73.4 | Confident | 71.9 | Confident | 129 Ų | 129 | 111.6 Ų | 111.6 | 60% | 0.603 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -63.4 | -40.6 | 174.6 | -82.3 | 175.9 | 21.9 | 0 | 0 | 112.2 | S26 K27 T32 Q33 A34 | S26-Q30 WeakPolarHBondContact O-CB 3.33Å; S26-Q30 PolarHBondContact O-N 2.93Å; K27-Q30 PolarHBondContact O-N 3.17Å; Q30-T32 VanDerWaalsContact C-N 3.33Å; Q30-T32 PolarHBondContact O-N 3.38Å; Q30-Q33 PolarHBondContact O-N 3.01Å; Q30-A34 WeakPolarHBondContact O-CB 3.36Å; Q30-A34 PolarHBondContact O-N 3.36Å |
| 31 | Q | 75.5 | Confident | 74 | Confident | 128 Ų | 128 | 110.2 Ų | 110.2 | 60% | 0.598 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -61.3 | -42.2 | 173.6 | -76 | 178 | -29 | 0 | 0 | 111.7 | K27 R28 Q35 | K27-Q31 WeakPolarHBondContact O-CG 3.49Å; K27-Q31 PolarHBondContact O-N 2.92Å; R28-Q31 PolarHBondContact O-N 3.04Å; Q31-Q35 WeakPolarHBondContact O-CB 3.23Å; Q31-Q35 PolarHBondContact O-N 3.49Å |
| 32 | T | 77 | Confident | 75.8 | Confident | 79 Ų | 79 | 104.4 Ų | 104.4 | 49% | 0.485 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -66.3 | -40.3 | 175.9 | -56.6 | 0 | 0 | 0 | 0 | 112.1 | R28 L29 Q30 Q35 V36 | R28-T32 PolarHBondContact O-N 3.39Å; R28-T32 PolarHBondContact O-OG1 3.33Å; R28-T32 VanDerWaalsContact O-OG1 3.1Å; L29-T32 PolarHBondContact O-N 3.44Å; Q30-T32 VanDerWaalsContact C-N 3.33Å; Q30-T32 PolarHBondContact O-N 3.38Å; T32-Q35 PolarHBondContact O-N 2.99Å; T32-V36 VanDerWaalsContact O-CG2 3.31Å; T32-V36 WeakPolarHBondContact O-CG2 3.31Å; T32-V36 PolarHBondContact O-N 3.49Å |
| 33 | Q | 77.4 | Confident | 77.6 | Confident | 135 Ų | 135 | 106 Ų | 106 | 63% | 0.631 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63 | -46.2 | 175.4 | -77.1 | -167.8 | -13.3 | 0 | 0 | 111.9 | L29 Q30 Q35 V36 D37 | L29-Q33 PolarHBondContact O-N 3.36Å; Q30-Q33 PolarHBondContact O-N 3.01Å; Q33-Q35 VanDerWaalsContact C-N 3.31Å; Q33-Q35 PolarHBondContact O-N 3.41Å; Q33-V36 PolarHBondContact O-N 3.1Å; Q33-V36 VanDerWaalsContact O-N 3.17Å; Q33-D37 PolarHBondContact O-N 3Å |
| 34 | A | 82.2 | Confident | 79.1 | Confident | 60 Ų | 60 | 104.7 Ų | 104.7 | 50% | 0.496 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -61.4 | -39.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q30 D37 E38 | Q30-A34 WeakPolarHBondContact O-CB 3.36Å; Q30-A34 PolarHBondContact O-N 3.36Å; A34-D37 PolarHBondContact O-N 3.32Å; A34-E38 PolarHBondContact O-N 3.17Å |
| 35 | Q | 80.9 | Confident | 80.6 | Confident | 124 Ų | 124 | 102 Ų | 102 | 58% | 0.579 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.1 | -38.9 | 175.9 | -176.5 | 174.5 | 68.1 | 0 | 0 | 112.1 | Q31 T32 Q33 E38 V39 | Q31-Q35 WeakPolarHBondContact O-CB 3.23Å; Q31-Q35 PolarHBondContact O-N 3.49Å; T32-Q35 PolarHBondContact O-N 2.99Å; Q33-Q35 VanDerWaalsContact C-N 3.31Å; Q33-Q35 PolarHBondContact O-N 3.41Å; Q35-E38 PolarHBondContact O-N 3.19Å; Q35-V39 VanDerWaalsContact O-CG2 3.3Å; Q35-V39 WeakPolarHBondContact O-CG2 3.41Å; Q35-V39 PolarHBondContact O-N 2.93Å |
| 36 | V | 83.3 | Confident | 82 | Confident | 81 Ų | 81 | 100.4 Ų | 100.4 | 49% | 0.491 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.5 | -43 | 175.5 | 173.2 | 0 | 0 | 0 | 0 | 110.5 | T32 Q33 E38 V39 V40 | T32-V36 VanDerWaalsContact O-CG2 3.31Å; T32-V36 WeakPolarHBondContact O-CG2 3.31Å; T32-V36 PolarHBondContact O-N 3.49Å; Q33-V36 PolarHBondContact O-N 3.1Å; Q33-V36 VanDerWaalsContact O-N 3.17Å; V36-E38 VanDerWaalsContact C-N 3.31Å; V36-E38 PolarHBondContact O-N 3.38Å; V36-V39 PolarHBondContact O-N 3.34Å; V36-V40 HydrophobicContact CG1-CG2 4.15Å; V36-V40 WeakPolarHBondContact O-CB 3.35Å; V36-V40 VanDerWaalsContact O-CG2 3.23Å; V36-V40 WeakPolarHBondContact O-CG2 3.45Å; V36-V40 PolarHBondContact O-N 2.93Å |
| 37 | D | 87.3 | Confident | 83.2 | Confident | 113 Ų | 113 | 101.2 Ų | 101.2 | 60% | 0.604 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61 | -40.1 | 176.8 | -74 | -30.3 | 0 | 0 | 0 | 111.9 | Q33 A34 V40 G41 | Q33-D37 PolarHBondContact O-N 3Å; A34-D37 PolarHBondContact O-N 3.32Å; D37-V40 PolarHBondContact O-N 2.86Å; D37-G41 PolarHBondContact O-N 3.15Å |
| 38 | E | 89.7 | Confident | 84 | Confident | 133 Ų | 133 | 99.5 Ų | 99.5 | 62% | 0.621 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.9 | -48.1 | 174.1 | -175.8 | 177.4 | -171.1 | 0 | 0 | 111.7 | A34 Q35 V36 V40 G41 I42 | A34-E38 PolarHBondContact O-N 3.17Å; Q35-E38 PolarHBondContact O-N 3.19Å; V36-E38 VanDerWaalsContact C-N 3.31Å; V36-E38 PolarHBondContact O-N 3.38Å; E38-V40 PolarHBondContact O-N 3.26Å; E38-G41 CarbonylContact O-C 3.6Å; E38-G41 WeakPolarHBondContact O-CA 3.44Å; E38-G41 PolarHBondContact O-N 3.5Å; E38-G41 VanDerWaalsContact O-N 3.15Å; E38-I42 HydrophobicContact CG-CD1 4.14Å; E38-I42 WeakPolarHBondContact O-CG1 3.44Å; E38-I42 PolarHBondContact O-N 3.47Å |
| 39 | V | 86.3 | Confident | 84.7 | Confident | 78 Ų | 78 | 95.3 Ų | 95.3 | 47% | 0.473 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.9 | -39 | 178.4 | 173.4 | 0 | 0 | 0 | 0 | 111.4 | Q35 V36 G41 I42 M43 | Q35-V39 VanDerWaalsContact O-CG2 3.3Å; Q35-V39 WeakPolarHBondContact O-CG2 3.41Å; Q35-V39 PolarHBondContact O-N 2.93Å; V36-V39 PolarHBondContact O-N 3.34Å; V39-G41 VanDerWaalsContact C-N 3.31Å; V39-G41 PolarHBondContact O-N 2.89Å; V39-I42 PolarHBondContact O-N 3.49Å; V39-M43 HydrophobicContact CG1-CG 4.34Å; V39-M43 WeakPolarHBondContact O-CB 3.3Å; V39-M43 WeakPolarHBondContact O-CG 3.41Å; V39-M43 PolarHBondContact O-N 2.81Å |
| 40 | V | 87.8 | Confident | 85.6 | Confident | 64 Ų | 64 | 94.2 Ų | 94.2 | 39% | 0.388 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.8 | -40.9 | 173.4 | 170.1 | 0 | 0 | 0 | 0 | 110.3 | V36 D37 E38 M43 K44 | V36-V40 HydrophobicContact CG1-CG2 4.15Å; V36-V40 WeakPolarHBondContact O-CB 3.35Å; V36-V40 VanDerWaalsContact O-CG2 3.23Å; V36-V40 WeakPolarHBondContact O-CG2 3.45Å; V36-V40 PolarHBondContact O-N 2.93Å; D37-V40 PolarHBondContact O-N 2.86Å; E38-V40 PolarHBondContact O-N 3.26Å; V40-M43 PolarHBondContact O-N 3.45Å; V40-K44 HydrophobicContact CG1-CD 4.5Å; V40-K44 WeakPolarHBondContact O-CG 3.3Å; V40-K44 PolarHBondContact O-N 3.25Å |
| 41 | G | 91 | Very high | 86.1 | Confident | 32 Ų | 32 | 93.4 Ų | 93.4 | 33% | 0.33 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -57.8 | -49.5 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | D37 E38 V39 M43 K44 V45 | D37-G41 PolarHBondContact O-N 3.15Å; E38-G41 CarbonylContact O-C 3.6Å; E38-G41 WeakPolarHBondContact O-CA 3.44Å; E38-G41 PolarHBondContact O-N 3.5Å; E38-G41 VanDerWaalsContact O-N 3.15Å; V39-G41 VanDerWaalsContact C-N 3.31Å; V39-G41 PolarHBondContact O-N 2.89Å; G41-M43 PolarHBondContact O-N 3.38Å; G41-K44 PolarHBondContact O-N 3.01Å; G41-V45 WeakPolarHBondContact O-CG2 3.36Å; G41-V45 PolarHBondContact O-N 3.41Å |
| 42 | I | 90.8 | Very high | 86.5 | Confident | 83 Ų | 83 | 93 Ų | 93 | 43% | 0.426 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.2 | -41.6 | 177.4 | -66 | 165.8 | 0 | 0 | 0 | 111.3 | E38 V39 V45 N46 | E38-I42 HydrophobicContact CG-CD1 4.14Å; E38-I42 WeakPolarHBondContact O-CG1 3.44Å; E38-I42 PolarHBondContact O-N 3.47Å; V39-I42 PolarHBondContact O-N 3.49Å; I42-V45 PolarHBondContact O-N 3.01Å; I42-N46 WeakPolarHBondContact O-CB 3.44Å; I42-N46 VanDerWaalsContact O-CG 3.23Å; I42-N46 PolarHBondContact O-N 3.22Å |
| 43 | M | 86.8 | Confident | 86.7 | Confident | 102 Ų | 102 | 96.7 Ų | 96.7 | 50% | 0.502 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.4 | -38.9 | 178.5 | -77.1 | -64 | -68.7 | 0 | 0 | 112.3 | V39 V40 G41 V45 N46 V47 | V39-M43 HydrophobicContact CG1-CG 4.34Å; V39-M43 WeakPolarHBondContact O-CB 3.3Å; V39-M43 WeakPolarHBondContact O-CG 3.41Å; V39-M43 PolarHBondContact O-N 2.81Å; V40-M43 PolarHBondContact O-N 3.45Å; G41-M43 PolarHBondContact O-N 3.38Å; M43-V45 VanDerWaalsContact C-N 3.34Å; M43-V45 PolarHBondContact O-N 2.97Å; M43-N46 CarbonylContact O-C 3.49Å; M43-N46 PolarHBondContact O-N 3.44Å; M43-V47 WeakPolarHBondContact O-CB 3.5Å; M43-V47 VanDerWaalsContact O-CG2 3.3Å; M43-V47 WeakPolarHBondContact O-CG2 3.44Å; M43-V47 PolarHBondContact O-N 3.37Å |
| 44 | K | 92 | Very high | 86.9 | Confident | 135 Ų | 135 | 95.4 Ų | 95.4 | 59% | 0.587 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -57.5 | -48.9 | 172.3 | -75.8 | 174.8 | -179.6 | 176.5 | 0 | 110.8 | V40 G41 N46 V47 E48 | V40-K44 HydrophobicContact CG1-CD 4.5Å; V40-K44 WeakPolarHBondContact O-CG 3.3Å; V40-K44 PolarHBondContact O-N 3.25Å; G41-K44 PolarHBondContact O-N 3.01Å; K44-N46 VanDerWaalsContact C-N 3.3Å; K44-N46 PolarHBondContact O-N 3.42Å; K44-V47 PolarHBondContact O-N 3.47Å; K44-E48 WeakPolarHBondContact O-CG 3.36Å; K44-E48 PolarHBondContact O-N 2.99Å |
| 45 | V | 90.6 | Very high | 86.9 | Confident | 63 Ų | 63 | 95 Ų | 95 | 38% | 0.382 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63 | -36.8 | 176.2 | 176.2 | 0 | 0 | 0 | 0 | 111.6 | G41 I42 M43 K49 | G41-V45 WeakPolarHBondContact O-CG2 3.36Å; G41-V45 PolarHBondContact O-N 3.41Å; I42-V45 PolarHBondContact O-N 3.01Å; M43-V45 VanDerWaalsContact C-N 3.34Å; M43-V45 PolarHBondContact O-N 2.97Å; V45-K49 HydrophobicContact CG1-CD 4.21Å; V45-K49 WeakPolarHBondContact O-CB 3.47Å; V45-K49 VanDerWaalsContact O-CG 3.26Å; V45-K49 WeakPolarHBondContact O-CG 3.46Å; V45-K49 PolarHBondContact O-N 3.44Å |
| 46 | N | 90.2 | Very high | 86.7 | Confident | 69 Ų | 69 | 95.1 Ų | 95.1 | 37% | 0.369 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -69.5 | -36.2 | 176.2 | -73.5 | -16.8 | 0 | 0 | 0 | 112.3 | I42 M43 K44 K49 V50 | I42-N46 WeakPolarHBondContact O-CB 3.44Å; I42-N46 VanDerWaalsContact O-CG 3.23Å; I42-N46 PolarHBondContact O-N 3.22Å; M43-N46 CarbonylContact O-C 3.49Å; M43-N46 PolarHBondContact O-N 3.44Å; K44-N46 VanDerWaalsContact C-N 3.3Å; K44-N46 PolarHBondContact O-N 3.42Å; N46-K49 CarbonylContact O-C 3.6Å; N46-K49 PolarHBondContact O-N 3Å; N46-V50 WeakPolarHBondContact O-CB 3.28Å; N46-V50 PolarHBondContact O-N 3.26Å |
| 47 | V | 90 | Very high | 86.3 | Confident | 73 Ų | 73 | 96.3 Ų | 96.3 | 44% | 0.442 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -68 | -40.9 | 174.8 | 169.5 | 0 | 0 | 0 | 0 | 110.5 | M43 K44 K49 V50 L51 | M43-V47 WeakPolarHBondContact O-CB 3.5Å; M43-V47 VanDerWaalsContact O-CG2 3.3Å; M43-V47 WeakPolarHBondContact O-CG2 3.44Å; M43-V47 PolarHBondContact O-N 3.37Å; K44-V47 PolarHBondContact O-N 3.47Å; V47-K49 VanDerWaalsContact C-N 3.33Å; V47-K49 PolarHBondContact O-N 2.95Å; V47-V50 WeakPolarHBondContact O-CG1 3.44Å; V47-V50 PolarHBondContact O-N 2.77Å; V47-L51 HydrophobicContact CG1-CD1 3.96Å; V47-L51 WeakPolarHBondContact O-CB 3.33Å; V47-L51 WeakPolarHBondContact O-CD1 3.42Å; V47-L51 VanDerWaalsContact O-CG 3.28Å; V47-L51 WeakPolarHBondContact O-CG 3.26Å; V47-L51 PolarHBondContact O-N 2.79Å |
| 48 | E | 90 | Very high | 85.9 | Confident | 120 Ų | 120 | 94 Ų | 94 | 56% | 0.561 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -60.1 | -45.6 | 171.3 | -71 | 168.3 | -170.5 | 0 | 0 | 110.9 | K44 V50 L51 E52 | K44-E48 WeakPolarHBondContact O-CG 3.36Å; K44-E48 PolarHBondContact O-N 2.99Å; E48-V50 PolarHBondContact O-N 3.47Å; E48-L51 PolarHBondContact O-N 3.17Å; E48-E52 PolarHBondContact O-N 3.39Å |
| 49 | K | 87.1 | Confident | 85.3 | Confident | 98 Ų | 98 | 93 Ų | 93 | 43% | 0.426 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.2 | -37.4 | 175.2 | -74.8 | 170.7 | -175.8 | 164.9 | 0 | 113.1 | V45 N46 V47 R53 | V45-K49 HydrophobicContact CG1-CD 4.21Å; V45-K49 WeakPolarHBondContact O-CB 3.47Å; V45-K49 VanDerWaalsContact O-CG 3.26Å; V45-K49 WeakPolarHBondContact O-CG 3.46Å; V45-K49 PolarHBondContact O-N 3.44Å; N46-K49 CarbonylContact O-C 3.6Å; N46-K49 PolarHBondContact O-N 3Å; V47-K49 VanDerWaalsContact C-N 3.33Å; V47-K49 PolarHBondContact O-N 2.95Å; K49-R53 WeakPolarHBondContact O-CB 3.45Å; K49-R53 WeakPolarHBondContact O-CG 3.47Å; K49-R53 PolarHBondContact O-N 3.37Å |
| 50 | V | 87.8 | Confident | 84.8 | Confident | 80 Ų | 80 | 94.4 Ų | 94.4 | 49% | 0.485 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -73.3 | -34.9 | -179.8 | 83.8 | 0 | 0 | 0 | 0 | 110.9 | N46 V47 E48 R53 D54 | N46-V50 WeakPolarHBondContact O-CB 3.28Å; N46-V50 PolarHBondContact O-N 3.26Å; V47-V50 WeakPolarHBondContact O-CG1 3.44Å; V47-V50 PolarHBondContact O-N 2.77Å; E48-V50 PolarHBondContact O-N 3.47Å; V50-R53 CarbonylContact O-C 3.6Å; V50-R53 WeakPolarHBondContact O-CB 3.43Å; V50-R53 PolarHBondContact O-N 3.36Å; V50-D54 WeakPolarHBondContact O-CB 3.42Å; V50-D54 PolarHBondContact O-N 2.83Å |
| 51 | L | 83.9 | Confident | 84.4 | Confident | 111 Ų | 111 | 96.1 Ų | 96.1 | 58% | 0.581 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.8 | -44.1 | 171.8 | -73 | 162.9 | 0 | 0 | 0 | 111.7 | V47 E48 R53 D54 A55 | V47-L51 HydrophobicContact CG1-CD1 3.96Å; V47-L51 WeakPolarHBondContact O-CB 3.33Å; V47-L51 WeakPolarHBondContact O-CD1 3.42Å; V47-L51 VanDerWaalsContact O-CG 3.28Å; V47-L51 WeakPolarHBondContact O-CG 3.26Å; V47-L51 PolarHBondContact O-N 2.79Å; E48-L51 PolarHBondContact O-N 3.17Å; L51-R53 VanDerWaalsContact C-N 3.29Å; L51-R53 PolarHBondContact O-N 2.83Å; L51-D54 WeakPolarHBondContact O-CB 3.39Å; L51-D54 PolarHBondContact O-N 2.8Å; L51-A55 PolarHBondContact O-N 2.94Å |
| 52 | E | 84.2 | Confident | 84 | Confident | 120 Ų | 120 | 99.6 Ų | 99.6 | 56% | 0.561 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.2 | -36.9 | 173 | -75.9 | -173.5 | -169 | 0 | 0 | 112.5 | E48 K56 | E48-E52 PolarHBondContact O-N 3.39Å; E52-K56 WeakPolarHBondContact O-CG 3.22Å; E52-K56 PolarHBondContact O-N 2.75Å |
| 53 | R | 81.3 | Confident | 83.5 | Confident | 156 Ų | 156 | 104.1 Ų | 104.1 | 59% | 0.589 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -65.8 | -39.8 | 173.8 | -76.7 | 175.7 | -160.3 | 173.2 | 4.9 | 111.4 | K49 V50 L51 K56 L57 | K49-R53 WeakPolarHBondContact O-CB 3.45Å; K49-R53 WeakPolarHBondContact O-CG 3.47Å; K49-R53 PolarHBondContact O-N 3.37Å; V50-R53 CarbonylContact O-C 3.6Å; V50-R53 WeakPolarHBondContact O-CB 3.43Å; V50-R53 PolarHBondContact O-N 3.36Å; L51-R53 VanDerWaalsContact C-N 3.29Å; L51-R53 PolarHBondContact O-N 2.83Å; R53-K56 CarbonylContact O-C 3.6Å; R53-K56 PolarHBondContact O-N 3.25Å; R53-L57 VanDerWaalsContact O-CB 3.28Å; R53-L57 WeakPolarHBondContact O-CB 3.29Å; R53-L57 VanDerWaalsContact O-CG 3.29Å; R53-L57 WeakPolarHBondContact O-CG 3.28Å; R53-L57 PolarHBondContact O-N 3.38Å |
| 54 | D | 82.9 | Confident | 83.3 | Confident | 108 Ų | 108 | 101.6 Ų | 101.6 | 58% | 0.578 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.4 | -45 | 177.7 | -160.9 | -105.3 | 0 | 0 | 0 | 111.1 | V50 L51 K56 L57 S58 | V50-D54 WeakPolarHBondContact O-CB 3.42Å; V50-D54 PolarHBondContact O-N 2.83Å; L51-D54 WeakPolarHBondContact O-CB 3.39Å; L51-D54 PolarHBondContact O-N 2.8Å; D54-K56 VanDerWaalsContact C-N 3.34Å; D54-K56 PolarHBondContact O-N 3.16Å; D54-L57 PolarHBondContact O-N 2.82Å; D54-L57 VanDerWaalsContact O-N 3.16Å; D54-S58 PolarHBondContact O-N 3.28Å |
| 55 | A | 80.5 | Confident | 83 | Confident | 53 Ų | 53 | 99.3 Ų | 99.3 | 44% | 0.438 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.2 | -39.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | L51 Q59 | L51-A55 PolarHBondContact O-N 2.94Å; A55-Q59 WeakPolarHBondContact O-CG 3.34Å; A55-Q59 PolarHBondContact O-N 2.93Å |
| 56 | K | 76.6 | Confident | 82.7 | Confident | 125 Ų | 125 | 99.2 Ų | 99.2 | 54% | 0.543 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -70 | -38.2 | 174 | -73.5 | 172.6 | -177.2 | 166.2 | 0 | 112 | E52 R53 D54 Q59 L60 | E52-K56 WeakPolarHBondContact O-CG 3.22Å; E52-K56 PolarHBondContact O-N 2.75Å; R53-K56 CarbonylContact O-C 3.6Å; R53-K56 PolarHBondContact O-N 3.25Å; D54-K56 VanDerWaalsContact C-N 3.34Å; D54-K56 PolarHBondContact O-N 3.16Å; K56-Q59 PolarHBondContact O-N 3.27Å; K56-L60 WeakPolarHBondContact O-CB 3.46Å; K56-L60 WeakPolarHBondContact O-CD1 3.44Å; K56-L60 PolarHBondContact O-N 3.18Å |
| 57 | L | 76.1 | Confident | 82.3 | Confident | 106 Ų | 106 | 102 Ų | 102 | 56% | 0.555 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.9 | -45.3 | 177.5 | -84 | 162 | 0 | 0 | 0 | 110.8 | R53 D54 Q59 L60 D61 | R53-L57 VanDerWaalsContact O-CB 3.28Å; R53-L57 WeakPolarHBondContact O-CB 3.29Å; R53-L57 VanDerWaalsContact O-CG 3.29Å; R53-L57 WeakPolarHBondContact O-CG 3.28Å; R53-L57 PolarHBondContact O-N 3.38Å; D54-L57 PolarHBondContact O-N 2.82Å; D54-L57 VanDerWaalsContact O-N 3.16Å; L57-Q59 VanDerWaalsContact C-N 3.3Å; L57-Q59 PolarHBondContact O-N 3.42Å; L57-L60 CarbonylContact O-C 3.55Å; L57-L60 WeakPolarHBondContact O-CA 3.34Å; L57-L60 WeakPolarHBondContact O-CB 3.41Å; L57-L60 PolarHBondContact O-N 3.29Å; L57-D61 WeakPolarHBondContact O-CB 3.23Å; L57-D61 PolarHBondContact O-N 3.01Å |
| 58 | S | 78 | Confident | 81.9 | Confident | 65 Ų | 65 | 105 Ų | 105 | 46% | 0.455 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -57.9 | -43 | 174.2 | 170.2 | 0 | 0 | 0 | 0 | 111.5 | D54 L60 D61 D62 | D54-S58 PolarHBondContact O-N 3.28Å; S58-L60 VanDerWaalsContact C-N 3.32Å; S58-L60 PolarHBondContact O-N 3.05Å; S58-D61 PolarHBondContact O-N 3.31Å; S58-D62 PolarHBondContact O-N 3.44Å |
| 59 | Q | 76.9 | Confident | 81.5 | Confident | 111 Ų | 111 | 105.8 Ų | 105.8 | 52% | 0.519 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.2 | -33 | 173.5 | -71.7 | -178.5 | 23.9 | 0 | 0 | 113.4 | A55 K56 L57 R63 | A55-Q59 WeakPolarHBondContact O-CG 3.34Å; A55-Q59 PolarHBondContact O-N 2.93Å; K56-Q59 PolarHBondContact O-N 3.27Å; L57-Q59 VanDerWaalsContact C-N 3.3Å; L57-Q59 PolarHBondContact O-N 3.42Å; Q59-R63 WeakPolarHBondContact O-CB 3.14Å; Q59-R63 VanDerWaalsContact O-CG 3.23Å; Q59-R63 WeakPolarHBondContact O-CG 3.48Å; Q59-R63 PolarHBondContact O-N 2.74Å |
| 60 | L | 75.8 | Confident | 81.2 | Confident | 109 Ų | 109 | 102.9 Ų | 102.9 | 57% | 0.571 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -72.5 | -36.1 | 175.5 | -99.3 | 73.4 | 0 | 0 | 0 | 111.5 | K56 L57 S58 R63 A64 | K56-L60 WeakPolarHBondContact O-CB 3.46Å; K56-L60 WeakPolarHBondContact O-CD1 3.44Å; K56-L60 PolarHBondContact O-N 3.18Å; L57-L60 CarbonylContact O-C 3.55Å; L57-L60 WeakPolarHBondContact O-CA 3.34Å; L57-L60 WeakPolarHBondContact O-CB 3.41Å; L57-L60 PolarHBondContact O-N 3.29Å; S58-L60 VanDerWaalsContact C-N 3.32Å; S58-L60 PolarHBondContact O-N 3.05Å; L60-R63 CarbonylContact O-C 3.57Å; L60-R63 PolarHBondContact O-N 2.89Å; L60-A64 WeakPolarHBondContact O-CA 3.3Å; L60-A64 WeakPolarHBondContact O-CB 3.19Å; L60-A64 PolarHBondContact O-N 3.02Å |
| 61 | D | 80.4 | Confident | 81 | Confident | 100 Ų | 100 | 101.5 Ų | 101.5 | 54% | 0.535 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -65.5 | -50.4 | 177.4 | -157.9 | 49.7 | 0 | 0 | 0 | 109.9 | L57 S58 R63 A64 D65 | L57-D61 WeakPolarHBondContact O-CB 3.23Å; L57-D61 PolarHBondContact O-N 3.01Å; S58-D61 PolarHBondContact O-N 3.31Å; D61-R63 VanDerWaalsContact C-N 3.28Å; D61-R63 PolarHBondContact O-N 2.79Å; D61-A64 CarbonylContact O-C 3.58Å; D61-A64 PolarHBondContact O-N 2.74Å; D61-D65 PolarHBondContact O-N 2.81Å |
| 62 | D | 81.6 | Confident | 80.7 | Confident | 104 Ų | 104 | 97.9 Ų | 97.9 | 56% | 0.556 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -57.2 | -41.7 | 174.2 | -70.1 | -25.1 | 0 | 0 | 0 | 112 | S58 A66 | S58-D62 PolarHBondContact O-N 3.44Å; D62-A66 WeakPolarHBondContact O-CB 3.36Å; D62-A66 PolarHBondContact O-N 3.01Å |
| 63 | R | 80.2 | Confident | 80.4 | Confident | 179 Ų | 179 | 97 Ų | 97 | 68% | 0.675 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -71.9 | -33.7 | 176.6 | -76.2 | -179.6 | -176.6 | -165.9 | 3.5 | 112.3 | Q59 L60 D61 L67 | Q59-R63 WeakPolarHBondContact O-CB 3.14Å; Q59-R63 VanDerWaalsContact O-CG 3.23Å; Q59-R63 WeakPolarHBondContact O-CG 3.48Å; Q59-R63 PolarHBondContact O-N 2.74Å; L60-R63 CarbonylContact O-C 3.57Å; L60-R63 PolarHBondContact O-N 2.89Å; D61-R63 VanDerWaalsContact C-N 3.28Å; D61-R63 PolarHBondContact O-N 2.79Å; R63-L67 WeakPolarHBondContact O-CB 3.12Å; R63-L67 PolarHBondContact O-N 2.81Å |
| 64 | A | 84.2 | Confident | 80.3 | Confident | 48 Ų | 48 | 97 Ų | 97 | 40% | 0.397 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -71.1 | -40.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | L60 D61 L67 Q68 | L60-A64 WeakPolarHBondContact O-CA 3.3Å; L60-A64 WeakPolarHBondContact O-CB 3.19Å; L60-A64 PolarHBondContact O-N 3.02Å; D61-A64 CarbonylContact O-C 3.58Å; D61-A64 PolarHBondContact O-N 2.74Å; A64-L67 CarbonylContact O-C 3.58Å; A64-L67 PolarHBondContact O-N 3.25Å; A64-Q68 WeakPolarHBondContact O-CB 3.13Å; A64-Q68 PolarHBondContact O-N 3.36Å |
| 65 | D | 84.7 | Confident | 80 | Confident | 88 Ų | 88 | 98.3 Ų | 98.3 | 47% | 0.471 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.7 | -48.8 | 171.4 | -81.7 | -12.9 | 0 | 0 | 0 | 110.7 | D61 L67 Q68 E69 | D61-D65 PolarHBondContact O-N 2.81Å; D65-L67 VanDerWaalsContact C-N 3.29Å; D65-L67 PolarHBondContact O-N 2.7Å; D65-Q68 PolarHBondContact O-N 3.3Å; D65-E69 VanDerWaalsContact O-CB 3.3Å; D65-E69 WeakPolarHBondContact O-CB 3.49Å; D65-E69 PolarHBondContact O-N 3.02Å |
| 66 | A | 83.6 | Confident | 79.7 | Confident | 61 Ų | 61 | 101.6 Ų | 101.6 | 50% | 0.504 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.5 | -37.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | D62 G70 | D62-A66 WeakPolarHBondContact O-CB 3.36Å; D62-A66 PolarHBondContact O-N 3.01Å; A66-G70 PolarHBondContact O-N 2.85Å |
| 67 | L | 82.1 | Confident | 79.5 | Confident | 128 Ų | 128 | 98.4 Ų | 98.4 | 67% | 0.67 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -73.2 | -37.2 | 177.2 | -172.6 | 66.5 | 0 | 0 | 0 | 111.6 | R63 A64 D65 A71 | R63-L67 WeakPolarHBondContact O-CB 3.12Å; R63-L67 PolarHBondContact O-N 2.81Å; A64-L67 CarbonylContact O-C 3.58Å; A64-L67 PolarHBondContact O-N 3.25Å; D65-L67 VanDerWaalsContact C-N 3.29Å; D65-L67 PolarHBondContact O-N 2.7Å; L67-A71 WeakPolarHBondContact O-CA 3.42Å; L67-A71 WeakPolarHBondContact O-CB 3.3Å; L67-A71 PolarHBondContact O-N 2.79Å |
| 68 | Q | 81.7 | Confident | 79.6 | Confident | 136 Ų | 136 | 95 Ų | 95 | 64% | 0.636 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -69 | -42.7 | 176.2 | 179.6 | 172.1 | 11.7 | 0 | 0 | 110.3 | A64 D65 A71 S72 | A64-Q68 WeakPolarHBondContact O-CB 3.13Å; A64-Q68 PolarHBondContact O-N 3.36Å; D65-Q68 PolarHBondContact O-N 3.3Å; Q68-A71 PolarHBondContact O-N 2.87Å; Q68-S72 VanDerWaalsContact O-CB 3.23Å; Q68-S72 WeakPolarHBondContact O-CB 3.2Å; Q68-S72 PolarHBondContact O-N 2.8Å; Q68-S72 PolarHBondContact O-OG 3.28Å |
| 69 | E | 81.5 | Confident | 79.6 | Confident | 135 Ų | 135 | 94.4 Ų | 94.4 | 63% | 0.631 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.4 | -50.1 | 173.5 | -168.4 | 174.7 | -167.6 | 0 | 0 | 109.8 | D65 A71 S72 Q73 | D65-E69 VanDerWaalsContact O-CB 3.3Å; D65-E69 WeakPolarHBondContact O-CB 3.49Å; D65-E69 PolarHBondContact O-N 3.02Å; E69-A71 PolarHBondContact O-N 3.43Å; E69-S72 PolarHBondContact O-N 3.39Å; E69-S72 PolarHBondContact O-OG 2.78Å; E69-Q73 WeakPolarHBondContact O-CB 3.41Å; E69-Q73 WeakPolarHBondContact O-CG 3.17Å; E69-Q73 PolarHBondContact O-N 3.45Å |
| 70 | G | 81.8 | Confident | 79.5 | Confident | 38 Ų | 38 | 93.1 Ų | 93.1 | 39% | 0.392 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.7 | -41.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | A66 Q73 F74 | A66-G70 PolarHBondContact O-N 2.85Å; G70-Q73 PolarHBondContact O-N 3.49Å; G70-F74 VanDerWaalsContact O-CB 3.3Å; G70-F74 WeakPolarHBondContact O-CB 3.23Å; G70-F74 PolarHBondContact O-N 2.69Å |
| 71 | A | 83 | Confident | 79.4 | Confident | 51 Ų | 51 | 92.3 Ų | 92.3 | 42% | 0.421 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -69.9 | -39.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | L67 Q68 E69 Q73 F74 E75 | L67-A71 WeakPolarHBondContact O-CA 3.42Å; L67-A71 WeakPolarHBondContact O-CB 3.3Å; L67-A71 PolarHBondContact O-N 2.79Å; Q68-A71 PolarHBondContact O-N 2.87Å; E69-A71 PolarHBondContact O-N 3.43Å; A71-Q73 VanDerWaalsContact C-N 3.33Å; A71-F74 CarbonylContact O-C 3.59Å; A71-F74 PolarHBondContact O-N 2.69Å; A71-E75 VanDerWaalsContact O-CB 3.27Å; A71-E75 WeakPolarHBondContact O-CB 3.01Å; A71-E75 PolarHBondContact O-N 3.36Å |
| 72 | S | 77.6 | Confident | 79.4 | Confident | 34 Ų | 34 | 94.9 Ų | 94.9 | 24% | 0.238 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -66.1 | -37.5 | 173.8 | 80.9 | 0 | 0 | 0 | 0 | 111.2 | Q68 E69 E75 K76 | Q68-S72 VanDerWaalsContact O-CB 3.23Å; Q68-S72 WeakPolarHBondContact O-CB 3.2Å; Q68-S72 PolarHBondContact O-N 2.8Å; Q68-S72 PolarHBondContact O-OG 3.28Å; E69-S72 PolarHBondContact O-N 3.39Å; E69-S72 PolarHBondContact O-OG 2.78Å; S72-E75 PolarHBondContact O-N 3.4Å; S72-K76 VanDerWaalsContact O-CB 3.25Å; S72-K76 WeakPolarHBondContact O-CB 3.15Å; S72-K76 WeakPolarHBondContact O-CG 3.22Å; S72-K76 PolarHBondContact O-N 2.83Å |
| 73 | Q | 78.2 | Confident | 79.3 | Confident | 102 Ų | 102 | 98 Ų | 98 | 48% | 0.477 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -69.3 | -39.3 | 174.4 | -70.3 | -71.5 | 86.2 | 0 | 0 | 110.9 | E69 G70 A71 S77 | E69-Q73 WeakPolarHBondContact O-CB 3.41Å; E69-Q73 WeakPolarHBondContact O-CG 3.17Å; E69-Q73 PolarHBondContact O-N 3.45Å; G70-Q73 PolarHBondContact O-N 3.49Å; A71-Q73 VanDerWaalsContact C-N 3.33Å; Q73-S77 WeakPolarHBondContact O-CB 3.27Å; Q73-S77 PolarHBondContact O-N 3.38Å; Q73-S77 PolarHBondContact O-OG 3.31Å |
| 74 | F | 79.3 | Confident | 79.2 | Confident | 157 Ų | 157 | 96.6 Ų | 96.6 | 69% | 0.689 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -66.3 | -42.1 | 173.6 | -175.7 | -98.4 | 0 | 0 | 0 | 111.6 | G70 A71 S77 A78 | G70-F74 VanDerWaalsContact O-CB 3.3Å; G70-F74 WeakPolarHBondContact O-CB 3.23Å; G70-F74 PolarHBondContact O-N 2.69Å; A71-F74 CarbonylContact O-C 3.59Å; A71-F74 PolarHBondContact O-N 2.69Å; F74-S77 PolarHBondContact O-N 2.73Å; F74-A78 WeakPolarHBondContact O-CB 3.25Å; F74-A78 PolarHBondContact O-N 2.83Å |
| 75 | E | 76.5 | Confident | 79 | Confident | 135 Ų | 135 | 100.9 Ų | 100.9 | 63% | 0.631 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.7 | -52.1 | 175.4 | -172 | -156.5 | 166.2 | 0 | 0 | 110.4 | A71 S72 S77 A78 A79 | A71-E75 VanDerWaalsContact O-CB 3.27Å; A71-E75 WeakPolarHBondContact O-CB 3.01Å; A71-E75 PolarHBondContact O-N 3.36Å; S72-E75 PolarHBondContact O-N 3.4Å; E75-S77 VanDerWaalsContact C-N 3.28Å; E75-S77 PolarHBondContact O-N 2.75Å; E75-A78 PolarHBondContact O-N 2.82Å; E75-A79 WeakPolarHBondContact O-CB 3.27Å; E75-A79 PolarHBondContact O-N 2.71Å |
| 76 | K | 74.7 | Confident | 78.9 | Confident | 121 Ų | 121 | 106.2 Ų | 106.2 | 53% | 0.526 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -57.7 | -43.1 | 175.6 | -74.8 | 170.5 | -175.1 | 168 | 0 | 110.9 | S72 T80 | S72-K76 VanDerWaalsContact O-CB 3.25Å; S72-K76 WeakPolarHBondContact O-CB 3.15Å; S72-K76 WeakPolarHBondContact O-CG 3.22Å; S72-K76 PolarHBondContact O-N 2.83Å; K76-T80 VanDerWaalsContact O-CB 3.27Å; K76-T80 WeakPolarHBondContact O-CB 3.19Å; K76-T80 WeakPolarHBondContact O-CG2 3.34Å; K76-T80 PolarHBondContact O-N 3.38Å; K76-T80 PolarHBondContact O-OG1 3.27Å |
| 77 | S | 71.6 | Confident | 78.9 | Confident | 58 Ų | 58 | 110.7 Ų | 110.7 | 41% | 0.406 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.2 | -51.6 | 177 | -62.7 | 0 | 0 | 0 | 0 | 110.7 | Q73 F74 E75 A79 T80 L81 | Q73-S77 WeakPolarHBondContact O-CB 3.27Å; Q73-S77 PolarHBondContact O-N 3.38Å; Q73-S77 PolarHBondContact O-OG 3.31Å; F74-S77 PolarHBondContact O-N 2.73Å; E75-S77 VanDerWaalsContact C-N 3.28Å; E75-S77 PolarHBondContact O-N 2.75Å; S77-A79 PolarHBondContact O-N 3.4Å; S77-T80 PolarHBondContact O-N 2.79Å; S77-T80 PolarHBondContact O-OG1 2.97Å; S77-T80 VanDerWaalsContact O-OG1 3.14Å; S77-L81 VanDerWaalsContact O-CB 3.23Å; S77-L81 WeakPolarHBondContact O-CB 3.18Å; S77-L81 WeakPolarHBondContact O-CD1 3.23Å; S77-L81 PolarHBondContact O-N 2.84Å |
| 78 | A | 77.5 | Confident | 79.1 | Confident | 34 Ų | 34 | 110.3 Ų | 110.3 | 28% | 0.281 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.5 | -41 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | F74 E75 K82 | F74-A78 WeakPolarHBondContact O-CB 3.25Å; F74-A78 PolarHBondContact O-N 2.83Å; E75-A78 PolarHBondContact O-N 2.82Å; A78-K82 WeakPolarHBondContact O-CG 2.98Å; A78-K82 PolarHBondContact O-N 3.14Å |
| 79 | A | 78.5 | Confident | 79.4 | Confident | 54 Ų | 54 | 108.1 Ų | 108.1 | 45% | 0.446 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -69.3 | -46.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | E75 S77 K82 R83 | E75-A79 WeakPolarHBondContact O-CB 3.27Å; E75-A79 PolarHBondContact O-N 2.71Å; S77-A79 PolarHBondContact O-N 3.4Å; A79-K82 PolarHBondContact O-N 2.9Å; A79-R83 PolarHBondContact O-N 3.45Å |
| 80 | T | 75.6 | Confident | 79.7 | Confident | 84 Ų | 84 | 105.1 Ų | 105.1 | 52% | 0.515 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.6 | -35.8 | 177.6 | 57.6 | 0 | 0 | 0 | 0 | 111.7 | K76 S77 R83 K84 | K76-T80 VanDerWaalsContact O-CB 3.27Å; K76-T80 WeakPolarHBondContact O-CB 3.19Å; K76-T80 WeakPolarHBondContact O-CG2 3.34Å; K76-T80 PolarHBondContact O-N 3.38Å; K76-T80 PolarHBondContact O-OG1 3.27Å; S77-T80 PolarHBondContact O-N 2.79Å; S77-T80 PolarHBondContact O-OG1 2.97Å; S77-T80 VanDerWaalsContact O-OG1 3.14Å; T80-R83 PolarHBondContact O-N 3.02Å; T80-K84 WeakPolarHBondContact O-CB 3.3Å; T80-K84 PolarHBondContact O-N 3.37Å |
| 81 | L | 73.6 | Confident | 80.2 | Confident | 92 Ų | 92 | 109.8 Ų | 109.8 | 48% | 0.482 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -57.7 | -55.7 | 170.9 | -94.1 | 67.1 | 0 | 0 | 0 | 109.6 | S77 R83 K84 Y85 | S77-L81 VanDerWaalsContact O-CB 3.23Å; S77-L81 WeakPolarHBondContact O-CB 3.18Å; S77-L81 WeakPolarHBondContact O-CD1 3.23Å; S77-L81 PolarHBondContact O-N 2.84Å; L81-R83 VanDerWaalsContact C-N 3.32Å; L81-R83 PolarHBondContact O-N 3.02Å; L81-K84 PolarHBondContact O-N 3.48Å; L81-Y85 HydrophobicContact CB-CD2 4.39Å; L81-Y85 HydrophobicContact CB-CE2 4.47Å; L81-Y85 HydrophobicContact CG-CE2 4.35Å; L81-Y85 WeakPolarHBondContact O-CD2 3.15Å; L81-Y85 PolarHBondContact O-N 3.05Å |
| 82 | K | 79.3 | Confident | 80.6 | Confident | 154 Ų | 154 | 112.5 Ų | 112.5 | 67% | 0.67 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -52.9 | -48.9 | 179.1 | -76.7 | 179.6 | -179.6 | -177.4 | 0 | 112 | A78 A79 Y85 W86 | A78-K82 WeakPolarHBondContact O-CG 2.98Å; A78-K82 PolarHBondContact O-N 3.14Å; A79-K82 PolarHBondContact O-N 2.9Å; K82-Y85 PolarHBondContact O-N 3.37Å; K82-W86 VanDerWaalsContact O-CD1 3.28Å; K82-W86 PolarHBondContact O-N 3.2Å |
| 83 | R | 80.3 | Confident | 81.3 | Confident | 170 Ų | 170 | 115.9 Ų | 115.9 | 64% | 0.642 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -66.2 | -42.9 | -179.3 | -167.7 | 174 | 178.3 | -179.6 | 0.8 | 112.5 | A79 T80 L81 W86 W87 | A79-R83 PolarHBondContact O-N 3.45Å; T80-R83 PolarHBondContact O-N 3.02Å; L81-R83 VanDerWaalsContact C-N 3.32Å; L81-R83 PolarHBondContact O-N 3.02Å; R83-W86 PolarHBondContact O-N 3.29Å; R83-W87 PolarHBondContact O-N 3.42Å; R83-W87 VanDerWaalsContact O-N 3.13Å |
| 84 | K | 79 | Confident | 82.1 | Confident | 148 Ų | 148 | 116.2 Ų | 116.2 | 64% | 0.643 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65.4 | -39.9 | 179.2 | -167.4 | 174.6 | -175.2 | 178 | 0 | 111.4 | T80 L81 K88 | T80-K84 WeakPolarHBondContact O-CB 3.3Å; T80-K84 PolarHBondContact O-N 3.37Å; L81-K84 PolarHBondContact O-N 3.48Å; K84-K88 HydrophobicContact CG-CD 4.38Å; K84-K88 WeakPolarHBondContact O-CB 3.39Å; K84-K88 VanDerWaalsContact O-CG 3.3Å; K84-K88 WeakPolarHBondContact O-CG 3.36Å; K84-K88 PolarHBondContact O-N 2.89Å |
| 85 | Y | 79.6 | Confident | 82.9 | Confident | 139 Ų | 139 | 113.1 Ų | 113.1 | 55% | 0.545 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -66.3 | -41.3 | 174.8 | -82.9 | -75.8 | 0 | 0 | 0 | 112.3 | L81 K82 W87 K88 N89 | L81-Y85 HydrophobicContact CB-CD2 4.39Å; L81-Y85 HydrophobicContact CB-CE2 4.47Å; L81-Y85 HydrophobicContact CG-CE2 4.35Å; L81-Y85 WeakPolarHBondContact O-CD2 3.15Å; L81-Y85 PolarHBondContact O-N 3.05Å; K82-Y85 PolarHBondContact O-N 3.37Å; Y85-W87 VanDerWaalsContact C-N 3.35Å; Y85-W87 PolarHBondContact O-N 3.35Å; Y85-K88 PolarHBondContact O-N 3.48Å; Y85-N89 VanDerWaalsContact O-CB 3.27Å; Y85-N89 WeakPolarHBondContact O-CB 3.22Å; Y85-N89 PolarHBondContact O-N 2.84Å; Y85-N89 PolarHBondContact O-ND2 3.04Å; Y85-N89 PolarHBondContact O-OD1 3.4Å |
| 86 | W | 81.4 | Confident | 83.8 | Confident | 200 Ų | 200 | 111.2 Ų | 111.2 | 76% | 0.758 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -58.7 | -45.7 | 175.5 | -88.3 | 43.9 | 0 | 0 | 0 | 112.5 | K82 R83 N89 C90 | K82-W86 VanDerWaalsContact O-CD1 3.28Å; K82-W86 PolarHBondContact O-N 3.2Å; R83-W86 PolarHBondContact O-N 3.29Å; W86-N89 PolarHBondContact O-N 2.99Å; W86-C90 WeakPolarHBondContact O-CB 3.27Å; W86-C90 PolarHBondContact O-N 3.13Å |
| 87 | W | 84.2 | Confident | 84.8 | Confident | 154 Ų | 154 | 108.6 Ų | 108.6 | 58% | 0.583 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -69.6 | -40.2 | -179.9 | -74.4 | 38.6 | 0 | 0 | 0 | 112 | R83 Y85 K91 | R83-W87 PolarHBondContact O-N 3.42Å; R83-W87 VanDerWaalsContact O-N 3.13Å; Y85-W87 VanDerWaalsContact C-N 3.35Å; Y85-W87 PolarHBondContact O-N 3.35Å; W87-K91 WeakPolarHBondContact O-CG 3.14Å; W87-K91 PolarHBondContact O-N 3.46Å |
| 88 | K | 85.3 | Confident | 86 | Confident | 121 Ų | 121 | 108.2 Ų | 108.2 | 53% | 0.526 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.1 | -45.3 | 174.5 | -75.4 | -177.2 | 69.3 | 178.2 | 0 | 111.4 | K84 Y85 C90 K91 M92 | K84-K88 HydrophobicContact CG-CD 4.38Å; K84-K88 WeakPolarHBondContact O-CB 3.39Å; K84-K88 VanDerWaalsContact O-CG 3.3Å; K84-K88 WeakPolarHBondContact O-CG 3.36Å; K84-K88 PolarHBondContact O-N 2.89Å; Y85-K88 PolarHBondContact O-N 3.48Å; K88-C90 PolarHBondContact O-N 2.82Å; K88-K91 PolarHBondContact O-N 3.27Å; K88-M92 WeakPolarHBondContact O-CB 3.4Å; K88-M92 VanDerWaalsContact O-CG 3.22Å; K88-M92 WeakPolarHBondContact O-CG 3.47Å; K88-M92 PolarHBondContact O-N 3.48Å |
| 89 | N | 88.8 | Confident | 86.9 | Confident | 89 Ų | 89 | 111.2 Ų | 111.2 | 48% | 0.476 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.7 | -43.3 | 179 | -70.4 | -10.6 | 0 | 0 | 0 | 111.4 | Y85 W86 K91 M92 I93 | Y85-N89 VanDerWaalsContact O-CB 3.27Å; Y85-N89 WeakPolarHBondContact O-CB 3.22Å; Y85-N89 PolarHBondContact O-N 2.84Å; Y85-N89 PolarHBondContact O-ND2 3.04Å; Y85-N89 PolarHBondContact O-OD1 3.4Å; W86-N89 PolarHBondContact O-N 2.99Å; N89-K91 PolarHBondContact O-N 3.06Å; N89-M92 PolarHBondContact O-N 3.27Å; N89-I93 VanDerWaalsContact O-CG1 3.3Å; N89-I93 WeakPolarHBondContact O-CG1 3.48Å; N89-I93 PolarHBondContact O-N 3.44Å |
| 90 | C | 88.5 | Confident | 87.8 | Confident | 72 Ų | 72 | 112.1 Ų | 112.1 | 49% | 0.486 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -60 | -46.3 | 174.7 | -176.1 | 0 | 0 | 0 | 0 | 111.9 | W86 K88 M92 I93 I94 | W86-C90 WeakPolarHBondContact O-CB 3.27Å; W86-C90 PolarHBondContact O-N 3.13Å; K88-C90 PolarHBondContact O-N 2.82Å; C90-M92 VanDerWaalsContact C-N 3.34Å; C90-M92 PolarHBondContact O-N 2.91Å; C90-I93 PolarHBondContact O-N 3.23Å; C90-I94 WeakPolarHBondContact O-CG1 3.3Å; C90-I94 PolarHBondContact O-N 3.34Å; C90-I94 VanDerWaalsContact O-N 3.09Å |
| 91 | K | 91.6 | Very high | 88.8 | Confident | 136 Ų | 136 | 113.1 Ų | 113.1 | 59% | 0.591 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -60.3 | -41.7 | 174.1 | -74.2 | 177.3 | 177.8 | -176.9 | 0 | 112.5 | W87 K88 N89 I94 I95 | W87-K91 WeakPolarHBondContact O-CG 3.14Å; W87-K91 PolarHBondContact O-N 3.46Å; K88-K91 PolarHBondContact O-N 3.27Å; N89-K91 PolarHBondContact O-N 3.06Å; K91-I94 PolarHBondContact O-N 3.42Å; K91-I95 VanDerWaalsContact O-CG1 3.3Å; K91-I95 WeakPolarHBondContact O-CG1 3.36Å; K91-I95 PolarHBondContact O-N 3.01Å |
| 92 | M | 90.8 | Very high | 90 | Very high | 108 Ų | 108 | 112.8 Ų | 112.8 | 53% | 0.532 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63 | -41.7 | 177 | -71.2 | -63.9 | -68.2 | 0 | 0 | 111.6 | K88 N89 C90 I95 I96 | K88-M92 WeakPolarHBondContact O-CB 3.4Å; K88-M92 VanDerWaalsContact O-CG 3.22Å; K88-M92 WeakPolarHBondContact O-CG 3.47Å; K88-M92 PolarHBondContact O-N 3.48Å; N89-M92 PolarHBondContact O-N 3.27Å; C90-M92 VanDerWaalsContact C-N 3.34Å; C90-M92 PolarHBondContact O-N 2.91Å; M92-I95 PolarHBondContact O-N 3.26Å; M92-I96 WeakPolarHBondContact O-CB 3.3Å; M92-I96 WeakPolarHBondContact O-CD1 3.22Å; M92-I96 WeakPolarHBondContact O-CG1 3.47Å; M92-I96 PolarHBondContact O-N 2.91Å |
| 93 | I | 93.6 | Very high | 90.8 | Very high | 105 Ų | 105 | 109.7 Ų | 109.7 | 54% | 0.538 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -60.8 | -46.4 | 176.3 | -69.7 | 164.3 | 0 | 0 | 0 | 110.7 | N89 C90 I95 I96 C97 | N89-I93 VanDerWaalsContact O-CG1 3.3Å; N89-I93 WeakPolarHBondContact O-CG1 3.48Å; N89-I93 PolarHBondContact O-N 3.44Å; C90-I93 PolarHBondContact O-N 3.23Å; I93-I95 VanDerWaalsContact C-N 3.34Å; I93-I95 PolarHBondContact O-N 3.4Å; I93-I96 PolarHBondContact O-N 3.37Å; I93-C97 PolarHBondContact O-N 3.49Å; I93-C97 PolarHBondContact O-SG 3.09Å |
| 94 | I | 94.8 | Very high | 91.6 | Very high | 109 Ų | 109 | 105.7 Ų | 105.7 | 56% | 0.559 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -60.3 | -44.4 | 178.5 | -66.4 | 167 | 0 | 0 | 0 | 111.2 | C90 K91 C97 A98 | C90-I94 WeakPolarHBondContact O-CG1 3.3Å; C90-I94 PolarHBondContact O-N 3.34Å; C90-I94 VanDerWaalsContact O-N 3.09Å; K91-I94 PolarHBondContact O-N 3.42Å; I94-C97 PolarHBondContact O-N 3.32Å; I94-A98 PolarHBondContact O-N 2.99Å |
| 95 | I | 95 | Very high | 92.5 | Very high | 93 Ų | 93 | 103.7 Ų | 103.7 | 48% | 0.477 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.3 | -43.8 | 177.8 | -67.6 | 166.1 | 0 | 0 | 0 | 110.8 | K91 M92 I93 A98 I99 | K91-I95 VanDerWaalsContact O-CG1 3.3Å; K91-I95 WeakPolarHBondContact O-CG1 3.36Å; K91-I95 PolarHBondContact O-N 3.01Å; M92-I95 PolarHBondContact O-N 3.26Å; I93-I95 VanDerWaalsContact C-N 3.34Å; I93-I95 PolarHBondContact O-N 3.4Å; I95-A98 PolarHBondContact O-N 3.35Å; I95-I99 HydrophobicContact CG2-CD1 3.92Å; I95-I99 WeakPolarHBondContact O-CG1 3.43Å; I95-I99 PolarHBondContact O-N 2.97Å |
| 96 | I | 95.3 | Very high | 93.3 | Very high | 94 Ų | 94 | 102.2 Ų | 102.2 | 48% | 0.482 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.8 | -46.1 | 176.4 | -70.3 | 164.5 | 0 | 0 | 0 | 110.5 | M92 I93 A98 I99 V100 | M92-I96 WeakPolarHBondContact O-CB 3.3Å; M92-I96 WeakPolarHBondContact O-CD1 3.22Å; M92-I96 WeakPolarHBondContact O-CG1 3.47Å; M92-I96 PolarHBondContact O-N 2.91Å; I93-I96 PolarHBondContact O-N 3.37Å; I96-A98 VanDerWaalsContact C-N 3.32Å; I96-A98 PolarHBondContact O-N 3.28Å; I96-I99 PolarHBondContact O-N 3Å; I96-V100 HydrophobicContact CG2-CG2 4.43Å; I96-V100 WeakPolarHBondContact O-CG2 3.33Å; I96-V100 PolarHBondContact O-N 3.36Å |
| 97 | C | 95.9 | Very high | 94 | Very high | 66 Ų | 66 | 97.1 Ų | 97.1 | 45% | 0.446 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.7 | -42.7 | 176.1 | -69.9 | 0 | 0 | 0 | 0 | 111.9 | I93 I94 V100 L101 | I93-C97 PolarHBondContact O-N 3.49Å; I93-C97 PolarHBondContact O-SG 3.09Å; I94-C97 PolarHBondContact O-N 3.32Å; C97-V100 PolarHBondContact O-N 3.24Å; C97-L101 WeakPolarHBondContact O-CG 3.32Å; C97-L101 PolarHBondContact O-N 3.47Å |
| 98 | A | 96.9 | Very high | 94.5 | Very high | 51 Ų | 51 | 94.1 Ų | 94.1 | 42% | 0.421 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.5 | -43.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | I94 I95 I96 L101 V102 | I94-A98 PolarHBondContact O-N 2.99Å; I95-A98 PolarHBondContact O-N 3.35Å; I96-A98 VanDerWaalsContact C-N 3.32Å; I96-A98 PolarHBondContact O-N 3.28Å; A98-L101 PolarHBondContact O-N 2.88Å; A98-V102 WeakPolarHBondContact O-CG2 3.33Å; A98-V102 PolarHBondContact O-N 3.25Å |
| 99 | I | 97.1 | Very high | 95.1 | Very high | 97 Ų | 97 | 92.6 Ų | 92.6 | 50% | 0.497 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.6 | -45.6 | 176.3 | -66.9 | 165.2 | 0 | 0 | 0 | 110.7 | I95 I96 L101 V102 I103 | I95-I99 HydrophobicContact CG2-CD1 3.92Å; I95-I99 WeakPolarHBondContact O-CG1 3.43Å; I95-I99 PolarHBondContact O-N 2.97Å; I96-I99 PolarHBondContact O-N 3Å; I99-L101 VanDerWaalsContact C-N 3.34Å; I99-L101 PolarHBondContact O-N 3.27Å; I99-V102 PolarHBondContact O-N 3.45Å; I99-I103 HydrophobicContact CG2-CD1 3.9Å; I99-I103 WeakPolarHBondContact O-CG1 3.34Å; I99-I103 PolarHBondContact O-N 2.95Å |
| 100 | V | 97.5 | Very high | 95.4 | Very high | 73 Ų | 73 | 96.8 Ų | 96.8 | 44% | 0.442 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61 | -43 | 177.6 | 172.1 | 0 | 0 | 0 | 0 | 111.1 | I96 C97 V102 I103 I104 | I96-V100 HydrophobicContact CG2-CG2 4.43Å; I96-V100 WeakPolarHBondContact O-CG2 3.33Å; I96-V100 PolarHBondContact O-N 3.36Å; C97-V100 PolarHBondContact O-N 3.24Å; V100-V102 PolarHBondContact O-N 2.95Å; V100-I103 PolarHBondContact O-N 3.27Å; V100-I104 HydrophobicContact CG1-CD1 3.89Å; V100-I104 HydrophobicContact CG1-CG1 4.49Å; V100-I104 VanDerWaalsContact O-CG1 3.3Å; V100-I104 WeakPolarHBondContact O-CG1 3.33Å; V100-I104 PolarHBondContact O-N 2.96Å |
| 101 | L | 97.2 | Very high | 95.8 | Very high | 105 Ų | 105 | 97.1 Ų | 97.1 | 55% | 0.55 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.7 | -42.9 | 176.2 | -74.6 | 174.2 | 0 | 0 | 0 | 112.4 | C97 A98 I99 I103 I104 I105 | C97-L101 WeakPolarHBondContact O-CG 3.32Å; C97-L101 PolarHBondContact O-N 3.47Å; A98-L101 PolarHBondContact O-N 2.88Å; I99-L101 VanDerWaalsContact C-N 3.34Å; I99-L101 PolarHBondContact O-N 3.27Å; L101-I103 VanDerWaalsContact C-N 3.34Å; L101-I103 PolarHBondContact O-N 2.98Å; L101-I104 PolarHBondContact O-N 2.93Å; L101-I105 WeakPolarHBondContact O-CG1 3.33Å; L101-I105 PolarHBondContact O-N 3.28Å |
| 102 | V | 97.5 | Very high | 96 | Very high | 84 Ų | 84 | 94.9 Ų | 94.9 | 51% | 0.509 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.9 | -43.5 | 176.3 | 171.6 | 0 | 0 | 0 | 0 | 111 | A98 I99 V100 I104 I105 I106 | A98-V102 WeakPolarHBondContact O-CG2 3.33Å; A98-V102 PolarHBondContact O-N 3.25Å; I99-V102 PolarHBondContact O-N 3.45Å; V100-V102 PolarHBondContact O-N 2.95Å; V102-I104 VanDerWaalsContact C-N 3.34Å; V102-I104 PolarHBondContact O-N 2.95Å; V102-I105 PolarHBondContact O-N 3.49Å; V102-I106 HydrophobicContact CG1-CD1 3.92Å; V102-I106 WeakPolarHBondContact O-CG1 3.3Å; V102-I106 PolarHBondContact O-N 3.3Å |
| 103 | I | 97.1 | Very high | 96.2 | Very high | 89 Ų | 89 | 94.9 Ų | 94.9 | 46% | 0.456 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61 | -44.2 | 176.3 | -67.8 | 167.3 | 0 | 0 | 0 | 110.7 | I99 V100 L101 I105 I106 I107 | I99-I103 HydrophobicContact CG2-CD1 3.9Å; I99-I103 WeakPolarHBondContact O-CG1 3.34Å; I99-I103 PolarHBondContact O-N 2.95Å; V100-I103 PolarHBondContact O-N 3.27Å; L101-I103 VanDerWaalsContact C-N 3.34Å; L101-I103 PolarHBondContact O-N 2.98Å; I103-I105 VanDerWaalsContact C-N 3.35Å; I103-I105 PolarHBondContact O-N 3.45Å; I103-I106 PolarHBondContact O-N 3.45Å; I103-I107 HydrophobicContact CG2-CD1 3.77Å; I103-I107 HydrophobicContact CG2-CG1 4.43Å; I103-I107 VanDerWaalsContact O-CG1 3.3Å; I103-I107 WeakPolarHBondContact O-CG1 3.3Å; I103-I107 PolarHBondContact O-N 3.49Å |
| 104 | I | 97.1 | Very high | 96.1 | Very high | 87 Ų | 87 | 94 Ų | 94 | 45% | 0.446 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.1 | -45 | 176.8 | -69.6 | 167.1 | 0 | 0 | 0 | 110.8 | V100 L101 V102 I106 I107 V108 | V100-I104 HydrophobicContact CG1-CD1 3.89Å; V100-I104 HydrophobicContact CG1-CG1 4.49Å; V100-I104 VanDerWaalsContact O-CG1 3.3Å; V100-I104 WeakPolarHBondContact O-CG1 3.33Å; V100-I104 PolarHBondContact O-N 2.96Å; L101-I104 PolarHBondContact O-N 2.93Å; V102-I104 VanDerWaalsContact C-N 3.34Å; V102-I104 PolarHBondContact O-N 2.95Å; I104-I106 VanDerWaalsContact C-N 3.35Å; I104-I106 PolarHBondContact O-N 3.31Å; I104-I107 PolarHBondContact O-N 2.92Å; I104-V108 HydrophobicContact CG2-CG2 4.29Å; I104-V108 VanDerWaalsContact O-CG2 3.3Å; I104-V108 WeakPolarHBondContact O-CG2 3.3Å; I104-V108 PolarHBondContact O-N 3.48Å |
| 105 | I | 96.5 | Very high | 95.6 | Very high | 105 Ų | 105 | 97.9 Ų | 97.9 | 54% | 0.538 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61 | -44.7 | 177.9 | -68.3 | 165.4 | 0 | 0 | 0 | 110.8 | L101 V102 I103 I107 V108 V109 | L101-I105 WeakPolarHBondContact O-CG1 3.33Å; L101-I105 PolarHBondContact O-N 3.28Å; V102-I105 PolarHBondContact O-N 3.49Å; I103-I105 VanDerWaalsContact C-N 3.35Å; I103-I105 PolarHBondContact O-N 3.45Å; I105-I107 VanDerWaalsContact C-N 3.33Å; I105-I107 PolarHBondContact O-N 3.28Å; I105-V108 PolarHBondContact O-N 3.46Å; I105-V109 HydrophobicContact CG2-CG2 4.38Å; I105-V109 WeakPolarHBondContact O-CB 3.27Å; I105-V109 VanDerWaalsContact O-CG2 3.31Å; I105-V109 WeakPolarHBondContact O-CG2 3.48Å; I105-V109 PolarHBondContact O-N 2.89Å |
| 106 | I | 96.3 | Very high | 95.7 | Very high | 108 Ų | 108 | 98.1 Ų | 98.1 | 55% | 0.554 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -60.4 | -44.4 | 177.4 | -68.3 | 167.3 | 0 | 0 | 0 | 110.7 | V102 I103 I104 V109 W110 | V102-I106 HydrophobicContact CG1-CD1 3.92Å; V102-I106 WeakPolarHBondContact O-CG1 3.3Å; V102-I106 PolarHBondContact O-N 3.3Å; I103-I106 PolarHBondContact O-N 3.45Å; I104-I106 VanDerWaalsContact C-N 3.35Å; I104-I106 PolarHBondContact O-N 3.31Å; I106-V109 PolarHBondContact O-N 3.26Å; I106-W110 VanDerWaalsContact O-CB 3.27Å; I106-W110 WeakPolarHBondContact O-CB 3.34Å; I106-W110 PolarHBondContact O-N 2.88Å |
| 107 | I | 96.2 | Very high | 95.7 | Very high | 94 Ų | 94 | 98.3 Ų | 98.3 | 48% | 0.482 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.2 | -45.7 | 178 | -68.3 | 167.4 | 0 | 0 | 0 | 110.8 | I103 I104 I105 V109 W110 V111 | I103-I107 HydrophobicContact CG2-CD1 3.77Å; I103-I107 HydrophobicContact CG2-CG1 4.43Å; I103-I107 VanDerWaalsContact O-CG1 3.3Å; I103-I107 WeakPolarHBondContact O-CG1 3.3Å; I103-I107 PolarHBondContact O-N 3.49Å; I104-I107 PolarHBondContact O-N 2.92Å; I105-I107 VanDerWaalsContact C-N 3.33Å; I105-I107 PolarHBondContact O-N 3.28Å; I107-V109 PolarHBondContact O-N 3.29Å; I107-W110 PolarHBondContact O-N 3.11Å; I107-V111 HydrophobicContact CG2-CG2 4.36Å; I107-V111 WeakPolarHBondContact O-CB 3.31Å; I107-V111 WeakPolarHBondContact O-CG2 3.49Å; I107-V111 PolarHBondContact O-N 3.46Å |
| 108 | V | 96.3 | Very high | 95.7 | Very high | 90 Ų | 90 | 100.1 Ų | 100.1 | 55% | 0.545 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -61.7 | -44.5 | 179.1 | 169.5 | 0 | 0 | 0 | 0 | 111.1 | I104 I105 S112 | I104-V108 HydrophobicContact CG2-CG2 4.29Å; I104-V108 VanDerWaalsContact O-CG2 3.3Å; I104-V108 WeakPolarHBondContact O-CG2 3.3Å; I104-V108 PolarHBondContact O-N 3.48Å; I105-V108 PolarHBondContact O-N 3.46Å; V108-S112 VanDerWaalsContact O-CB 3.27Å; V108-S112 WeakPolarHBondContact O-CB 3.28Å; V108-S112 PolarHBondContact O-N 2.9Å |
| 109 | V | 96.4 | Very high | 95.6 | Very high | 89 Ų | 89 | 103 Ų | 103 | 54% | 0.539 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -64.2 | -44 | 176.7 | 171.7 | 0 | 0 | 0 | 0 | 110.8 | I105 I106 I107 S112 T113 | I105-V109 HydrophobicContact CG2-CG2 4.38Å; I105-V109 WeakPolarHBondContact O-CB 3.27Å; I105-V109 VanDerWaalsContact O-CG2 3.31Å; I105-V109 WeakPolarHBondContact O-CG2 3.48Å; I105-V109 PolarHBondContact O-N 2.89Å; I106-V109 PolarHBondContact O-N 3.26Å; I107-V109 PolarHBondContact O-N 3.29Å; V109-S112 PolarHBondContact O-N 2.89Å; V109-T113 WeakPolarHBondContact O-CB 3.49Å; V109-T113 VanDerWaalsContact O-CG2 3.28Å; V109-T113 WeakPolarHBondContact O-CG2 3.24Å; V109-T113 PolarHBondContact O-N 3.45Å |
| 110 | W | 96.5 | Very high | 95.5 | Very high | 177 Ų | 177 | 103.4 Ų | 103.4 | 67% | 0.67 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -63.7 | -42.1 | 179.4 | -172.9 | 77.4 | 0 | 0 | 0 | 112.6 | I106 I107 T113 S114 | I106-W110 VanDerWaalsContact O-CB 3.27Å; I106-W110 WeakPolarHBondContact O-CB 3.34Å; I106-W110 PolarHBondContact O-N 2.88Å; I107-W110 PolarHBondContact O-N 3.11Å; W110-T113 WeakPolarHBondContact O-CG2 3.27Å; W110-S114 VanDerWaalsContact O-CB 3.24Å; W110-S114 WeakPolarHBondContact O-CB 3.32Å; W110-S114 PolarHBondContact O-N 2.92Å; W110-S114 VanDerWaalsContact O-N 3.11Å |
| 111 | V | 96.7 | Very high | 95.4 | Very high | 80 Ų | 80 | 105.4 Ų | 105.4 | 49% | 0.485 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -66.4 | -43.8 | 174.4 | 170.9 | 0 | 0 | 0 | 0 | 111 | I107 T113 S114 N115 | I107-V111 HydrophobicContact CG2-CG2 4.36Å; I107-V111 WeakPolarHBondContact O-CB 3.31Å; I107-V111 WeakPolarHBondContact O-CG2 3.49Å; I107-V111 PolarHBondContact O-N 3.46Å; V111-T113 VanDerWaalsContact C-N 3.35Å; V111-T113 PolarHBondContact O-N 3.32Å; V111-S114 PolarHBondContact O-N 3.23Å; V111-N115 PolarHBondContact O-N 3.36Å |
| 112 | S | 95 | Very high | 95.3 | Very high | 89 Ų | 89 | 105.4 Ų | 105.4 | 62% | 0.622 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -70.2 | -26.7 | -179 | -174.1 | 0 | 0 | 0 | 0 | 114 | V108 V109 | V108-S112 VanDerWaalsContact O-CB 3.27Å; V108-S112 WeakPolarHBondContact O-CB 3.28Å; V108-S112 PolarHBondContact O-N 2.9Å; V109-S112 PolarHBondContact O-N 2.89Å |
| 113 | T | 95.1 | Very high | 95.1 | Very high | 107 Ų | 107 | 107.1 Ų | 107.1 | 66% | 0.656 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -86.7 | -21.5 | 175.2 | -172.2 | 0 | 0 | 0 | 0 | 112.9 | V109 W110 V111 | V109-T113 WeakPolarHBondContact O-CB 3.49Å; V109-T113 VanDerWaalsContact O-CG2 3.28Å; V109-T113 WeakPolarHBondContact O-CG2 3.24Å; V109-T113 PolarHBondContact O-N 3.45Å; W110-T113 WeakPolarHBondContact O-CG2 3.27Å; V111-T113 VanDerWaalsContact C-N 3.35Å; V111-T113 PolarHBondContact O-N 3.32Å |
| 114 | S | 92.2 | Very high | 94.9 | Very high | 88 Ų | 88 | 108.6 Ų | 108.6 | 62% | 0.615 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -85.5 | -18.9 | 178.9 | -176.5 | 0 | 0 | 0 | 0 | 113.1 | W110 V111 | W110-S114 VanDerWaalsContact O-CB 3.24Å; W110-S114 WeakPolarHBondContact O-CB 3.32Å; W110-S114 PolarHBondContact O-N 2.92Å; W110-S114 VanDerWaalsContact O-N 3.11Å; V111-S114 PolarHBondContact O-N 3.23Å |
| 115 | N | 84.8 | Confident | 94.7 | Very high | 189 Ų | 189 | 110.5 Ų | 110.5 | 100% | 1.011 | 61% | 0.611 | S | S | * | * | trans | -94.6 | 0 | 176.4 | -167 | 107.9 | 0 | 0 | 0 | 111 | V111 | V111-N115 PolarHBondContact O-N 3.36Š|
Retrieved 115 of 115 residues in 67.4 ms
(Link to these results)