| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 39.6 | Very low | 47.6 | Very low | 242 Ų | 242 | 143.5 Ų | 143.5 | 100% | 1.192 | 82% | 0.822 | S | S | * | * | 0 | 128 | 0 | -76.7 | -177.7 | 166.8 | 0 | 0 | 109.2 | |||||
| 2 | S | 47.4 | Very low | 47.7 | Very low | 101 Ų | 101 | 142.9 Ų | 142.9 | 71% | 0.706 | 81% | 0.807 | S | S | * | * | trans | 65.2 | 77.9 | 152 | -145.2 | 0 | 0 | 0 | 0 | 120.3 | V4 | S2-V4 PolarHBondContact O-N 3.2Š| ||
| 3 | W | 50.2 | Low | 48 | Very low | 259 Ų | 259 | 141.5 Ų | 141.5 | 98% | 0.981 | 80% | 0.796 | S | S | * | * | trans | -83.7 | 69.9 | 147 | -75.1 | 57.9 | 0 | 0 | 0 | 108.7 | ||||
| 4 | V | 57.2 | Low | 48.7 | Very low | 122 Ų | 122 | 139.1 Ų | 139.1 | 74% | 0.739 | 79% | 0.786 | S | S | * | * | trans | -150.2 | 91.2 | 170.4 | -177.1 | 0 | 0 | 0 | 0 | 108.9 | S2 | S2-V4 PolarHBondContact O-N 3.2Š| ||
| 5 | K | 47.8 | Very low | 49 | Very low | 210 Ų | 210 | 141.2 Ų | 141.2 | 91% | 0.913 | 78% | 0.784 | S | S | * | * | trans | 175.9 | 125.3 | 156.9 | -139.1 | 159 | 178.4 | 172 | 0 | 106.4 | ||||
| 6 | A | 46.4 | Very low | 49.6 | Very low | 73 Ų | 73 | 137.9 Ų | 137.9 | 60% | 0.603 | 76% | 0.764 | S | S | * | * | cis | -157.7 | 117 | -0.4 | 0 | 0 | 0 | 0 | 0 | 105.6 | S8 | A6-S8 PolarHBondContact O-N 2.97Å; A6-S8 VanDerWaalsContact O-N 3.17Å | ||
| 7 | A | 45.6 | Very low | 50 | Low | 112 Ų | 112 | 139.6 Ų | 139.6 | 93% | 0.926 | 77% | 0.765 | S | S | * | * | trans | -77.9 | 84.9 | 150.5 | 0 | 0 | 0 | 0 | 0 | 105.2 | S9 | A7-S9 PolarHBondContact O-N 3.2Š| ||
| 8 | S | 45.1 | Very low | 50.4 | Low | 98 Ų | 98 | 138.3 Ų | 138.3 | 69% | 0.685 | 76% | 0.757 | S | S | * | * | trans | -62.7 | 120.2 | 168.4 | -89.9 | 0 | 0 | 0 | 0 | 108.5 | A6 N10 | A6-S8 PolarHBondContact O-N 2.97Å; A6-S8 VanDerWaalsContact O-N 3.17Å; S8-N10 PolarHBondContact O-N 3.39Å | ||
| 9 | S | 50.9 | Low | 50.8 | Low | 100 Ų | 100 | 133.1 Ų | 133.1 | 70% | 0.699 | 73% | 0.734 | S | S | * | * | S | Bend | trans | 38.2 | 85.4 | 143.7 | 62.6 | 0 | 0 | 0 | 0 | 115.6 | A7 | A7-S9 PolarHBondContact O-N 3.2Š|
| 10 | N | 45.6 | Very low | 51.5 | Low | 137 Ų | 137 | 132.4 Ų | 132.4 | 73% | 0.733 | 73% | 0.73 | S | S | * | * | trans | -163 | 77.5 | 132.6 | -103.9 | 21.5 | 0 | 0 | 0 | 106.3 | S8 E12 | S8-N10 PolarHBondContact O-N 3.39Å; N10-E12 PolarHBondContact O-N 3.43Å | ||
| 11 | S | 48.2 | Very low | 52.5 | Low | 124 Ų | 124 | 130.2 Ų | 130.2 | 87% | 0.867 | 72% | 0.717 | S | S | * | * | trans | -73.3 | 59.1 | 154.7 | 60.8 | 0 | 0 | 0 | 0 | 107.9 | D13 | S11-D13 PolarHBondContact O-N 2.98Š| ||
| 12 | E | 48.9 | Very low | 54.3 | Low | 137 Ų | 137 | 124.3 Ų | 124.3 | 64% | 0.64 | 69% | 0.689 | S | S | * | * | trans | -65.7 | 112.4 | 157.6 | -155.9 | 97.1 | 176.1 | 0 | 0 | 103.3 | N10 V14 | N10-E12 PolarHBondContact O-N 3.43Å; E12-V14 HydrophobicContact CB-CG2 4.26Å; E12-V14 WeakPolarHBondContact O-CG2 3.34Å; E12-V14 PolarHBondContact O-N 3.06Å | ||
| 13 | D | 50.9 | Low | 55.9 | Low | 124 Ų | 124 | 127.1 Ų | 127.1 | 66% | 0.663 | 69% | 0.686 | S | S | * | * | trans | -67.1 | 87.7 | 174.7 | -167.9 | 7.7 | 0 | 0 | 0 | 107.4 | S11 F15 | S11-D13 PolarHBondContact O-N 2.98Å; D13-F15 PolarHBondContact O-N 3.42Å | ||
| 14 | V | 58 | Low | 57.4 | Low | 108 Ų | 108 | 118.8 Ų | 118.8 | 66% | 0.655 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -72.6 | -8.4 | -173.2 | 176.4 | 0 | 0 | 0 | 0 | 111.7 | E12 | E12-V14 HydrophobicContact CB-CG2 4.26Å; E12-V14 WeakPolarHBondContact O-CG2 3.34Å; E12-V14 PolarHBondContact O-N 3.06Å |
| 15 | F | 53.3 | Low | 58.7 | Low | 171 Ų | 171 | 118.6 Ų | 118.6 | 75% | 0.75 | 65% | 0.651 | S | S | * | * | trans | -141.7 | 79.1 | 178.7 | -65.5 | -81.3 | 0 | 0 | 0 | 110.8 | D13 E17 | D13-F15 PolarHBondContact O-N 3.42Å; F15-E17 PolarHBondContact O-N 3.3Å | ||
| 16 | D | 58.9 | Low | 60.5 | Low | 89 Ų | 89 | 112.1 Ų | 112.1 | 48% | 0.476 | 63% | 0.632 | S | S | . | * | trans | -72.4 | 76.5 | 157.8 | -170.3 | -11 | 0 | 0 | 0 | 108.4 | N18 A19 | D16-N18 PolarHBondContact O-N 3.04Å; D16-N18 PolarHBondContact OD1-N 3.18Å; D16-A19 HydrophobicContact CB-CB 3.82Å; D16-A19 PolarHBondContact O-N 3.29Å; D16-A19 VanDerWaalsContact O-N 3.08Å; D16-A19 PolarHBondContact OD1-N 2.87Å; D16-A19 VanDerWaalsContact OD2-CB 3.23Å; D16-A19 WeakPolarHBondContact OD2-CB 3.49Å | ||
| 17 | E | 56.6 | Low | 62.5 | Low | 167 Ų | 167 | 115 Ų | 115 | 78% | 0.78 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -54.3 | -22.4 | 178.6 | -172.1 | 174.7 | -165.9 | 0 | 0 | 111.7 | F15 | F15-E17 PolarHBondContact O-N 3.3Å |
| 18 | N | 56.6 | Low | 64.6 | Low | 115 Ų | 115 | 114.7 Ų | 114.7 | 62% | 0.615 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -95.5 | -18.7 | -178 | -139 | 109.4 | 0 | 0 | 0 | 113.6 | D16 L22 | D16-N18 PolarHBondContact O-N 3.04Å; D16-N18 PolarHBondContact OD1-N 3.18Å; N18-L22 PolarHBondContact O-N 3.4Å |
| 19 | A | 58 | Low | 66.7 | Low | 40 Ų | 40 | 118.2 Ų | 118.2 | 33% | 0.331 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -72.4 | -36.4 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | D16 D21 L22 Y23 | D16-A19 HydrophobicContact CB-CB 3.82Å; D16-A19 PolarHBondContact O-N 3.29Å; D16-A19 VanDerWaalsContact O-N 3.08Å; D16-A19 PolarHBondContact OD1-N 2.87Å; D16-A19 VanDerWaalsContact OD2-CB 3.23Å; D16-A19 WeakPolarHBondContact OD2-CB 3.49Å; A19-D21 VanDerWaalsContact C-N 3.34Å; A19-D21 PolarHBondContact O-N 3.16Å; A19-L22 PolarHBondContact O-N 2.98Å; A19-Y23 WeakPolarHBondContact O-CB 3.47Å; A19-Y23 PolarHBondContact O-N 3.43Å |
| 20 | D | 64.6 | Low | 68.4 | Low | 119 Ų | 119 | 115.8 Ų | 115.8 | 64% | 0.636 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -64.6 | -39.3 | 176.7 | -87.9 | -11.8 | 0 | 0 | 0 | 111.3 | L24 | D20-L24 WeakPolarHBondContact O-CB 3.48Å; D20-L24 PolarHBondContact O-N 3.2Å |
| 21 | D | 72.9 | Confident | 70.4 | Confident | 87 Ų | 87 | 112.9 Ų | 112.9 | 47% | 0.465 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -68.9 | -43.8 | 176.4 | -87.3 | -3 | 0 | 0 | 0 | 112.8 | A19 Y23 L24 Q25 | A19-D21 VanDerWaalsContact C-N 3.34Å; A19-D21 PolarHBondContact O-N 3.16Å; D21-Y23 VanDerWaalsContact C-N 3.34Å; D21-L24 PolarHBondContact O-N 2.98Å; D21-Q25 WeakPolarHBondContact O-CB 3.47Å; D21-Q25 VanDerWaalsContact O-CG 3.24Å; D21-Q25 WeakPolarHBondContact O-CG 3.26Å; D21-Q25 PolarHBondContact O-N 3.39Å |
| 22 | L | 77.4 | Confident | 72.3 | Confident | 117 Ų | 117 | 111 Ų | 111 | 61% | 0.613 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -67.6 | -37.6 | 178.6 | -151.9 | 95.5 | 0 | 0 | 0 | 111.4 | N18 A19 S26 | N18-L22 PolarHBondContact O-N 3.4Å; A19-L22 PolarHBondContact O-N 2.98Å; L22-S26 WeakPolarHBondContact O-CB 3.45Å; L22-S26 PolarHBondContact O-N 2.97Å |
| 23 | Y | 79.9 | Confident | 74.2 | Confident | 160 Ų | 160 | 108.4 Ų | 108.4 | 63% | 0.627 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -68.6 | -42 | 175.8 | 178.5 | -107.2 | 0 | 0 | 0 | 111.9 | A19 D21 S26 K27 | A19-Y23 WeakPolarHBondContact O-CB 3.47Å; A19-Y23 PolarHBondContact O-N 3.43Å; D21-Y23 VanDerWaalsContact C-N 3.34Å; Y23-S26 PolarHBondContact O-N 3.29Å; Y23-K27 WeakPolarHBondContact O-CB 3.49Å; Y23-K27 PolarHBondContact O-N 3.33Å |
| 24 | L | 82.4 | Confident | 75.9 | Confident | 84 Ų | 84 | 110.4 Ų | 110.4 | 44% | 0.44 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -59.4 | -48.7 | 173.5 | -171.8 | 82.2 | 0 | 0 | 0 | 110.7 | D20 D21 S26 K27 E28 | D20-L24 WeakPolarHBondContact O-CB 3.48Å; D20-L24 PolarHBondContact O-N 3.2Å; D21-L24 PolarHBondContact O-N 2.98Å; L24-S26 VanDerWaalsContact C-N 3.35Å; L24-S26 PolarHBondContact O-N 2.94Å; L24-K27 PolarHBondContact O-N 3.4Å; L24-E28 WeakPolarHBondContact O-CB 3.3Å; L24-E28 WeakPolarHBondContact O-CG 3.33Å; L24-E28 PolarHBondContact O-N 3.31Å |
| 25 | Q | 84.8 | Confident | 77.3 | Confident | 119 Ų | 119 | 111.1 Ų | 111.1 | 56% | 0.556 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -60.1 | -42.8 | 177.7 | -73.7 | 174.8 | 25.3 | 0 | 0 | 112.3 | D21 E28 W29 | D21-Q25 WeakPolarHBondContact O-CB 3.47Å; D21-Q25 VanDerWaalsContact O-CG 3.24Å; D21-Q25 WeakPolarHBondContact O-CG 3.26Å; D21-Q25 PolarHBondContact O-N 3.39Å; Q25-E28 PolarHBondContact O-N 2.94Å; Q25-W29 WeakPolarHBondContact O-CB 3.32Å; Q25-W29 PolarHBondContact O-N 3.26Å |
| 26 | S | 84.9 | Confident | 78.7 | Confident | 74 Ų | 74 | 110.6 Ų | 110.6 | 52% | 0.517 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.6 | -42.7 | 176.3 | -178 | 0 | 0 | 0 | 0 | 112.1 | L22 Y23 L24 W29 A30 | L22-S26 WeakPolarHBondContact O-CB 3.45Å; L22-S26 PolarHBondContact O-N 2.97Å; Y23-S26 PolarHBondContact O-N 3.29Å; L24-S26 VanDerWaalsContact C-N 3.35Å; L24-S26 PolarHBondContact O-N 2.94Å; S26-W29 PolarHBondContact O-N 3.37Å; S26-A30 WeakPolarHBondContact O-CB 3.39Å; S26-A30 PolarHBondContact O-N 3.17Å |
| 27 | K | 88.4 | Confident | 79.8 | Confident | 134 Ų | 134 | 111.9 Ų | 111.9 | 58% | 0.583 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -65.9 | -42.5 | 176.7 | -176.7 | -178.2 | 174.9 | -175.5 | 0 | 112.2 | Y23 L24 A30 S31 | Y23-K27 WeakPolarHBondContact O-CB 3.49Å; Y23-K27 PolarHBondContact O-N 3.33Å; L24-K27 PolarHBondContact O-N 3.4Å; K27-A30 PolarHBondContact O-N 3.12Å; K27-S31 VanDerWaalsContact O-CB 3.26Å; K27-S31 WeakPolarHBondContact O-CB 3.49Å; K27-S31 PolarHBondContact O-N 3.4Å |
| 28 | E | 89.9 | Confident | 81.2 | Confident | 105 Ų | 105 | 110.9 Ų | 110.9 | 49% | 0.491 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.3 | -40.7 | 175.9 | -74.1 | -176.9 | 172.7 | 0 | 0 | 111.9 | L24 Q25 S31 N32 | L24-E28 WeakPolarHBondContact O-CB 3.3Å; L24-E28 WeakPolarHBondContact O-CG 3.33Å; L24-E28 PolarHBondContact O-N 3.31Å; Q25-E28 PolarHBondContact O-N 2.94Å; E28-S31 PolarHBondContact O-N 3.17Å; E28-N32 VanDerWaalsContact O-CB 3.29Å; E28-N32 WeakPolarHBondContact O-CB 3.44Å; E28-N32 PolarHBondContact O-N 3.11Å; E28-N32 PolarHBondContact O-ND2 3.07Å |
| 29 | W | 88.9 | Confident | 82.6 | Confident | 171 Ų | 171 | 108.6 Ų | 108.6 | 65% | 0.648 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.2 | -48.1 | 174.5 | 178.1 | 84.5 | 0 | 0 | 0 | 111.6 | Q25 S26 S31 N32 M33 | Q25-W29 WeakPolarHBondContact O-CB 3.32Å; Q25-W29 PolarHBondContact O-N 3.26Å; S26-W29 PolarHBondContact O-N 3.37Å; W29-S31 PolarHBondContact O-N 2.96Å; W29-N32 PolarHBondContact O-N 3.42Å; W29-M33 WeakPolarHBondContact O-CB 3.49Å; W29-M33 PolarHBondContact O-N 3.17Å |
| 30 | A | 87.6 | Confident | 84 | Confident | 49 Ų | 49 | 108.7 Ų | 108.7 | 41% | 0.405 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.2 | -41.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | S26 K27 M33 K34 | S26-A30 WeakPolarHBondContact O-CB 3.39Å; S26-A30 PolarHBondContact O-N 3.17Å; K27-A30 PolarHBondContact O-N 3.12Å; A30-M33 PolarHBondContact O-N 3.17Å; A30-K34 WeakPolarHBondContact O-CB 3.5Å; A30-K34 PolarHBondContact O-N 2.91Å |
| 31 | S | 86.6 | Confident | 85 | Confident | 77 Ų | 77 | 111.1 Ų | 111.1 | 54% | 0.538 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.7 | -47.5 | 175.6 | -174.1 | 0 | 0 | 0 | 0 | 111.7 | K27 E28 W29 M33 K34 K35 | K27-S31 VanDerWaalsContact O-CB 3.26Å; K27-S31 WeakPolarHBondContact O-CB 3.49Å; K27-S31 PolarHBondContact O-N 3.4Å; E28-S31 PolarHBondContact O-N 3.17Å; W29-S31 PolarHBondContact O-N 2.96Å; S31-M33 PolarHBondContact O-N 2.97Å; S31-K34 PolarHBondContact O-N 2.96Å; S31-K35 WeakPolarHBondContact O-CB 3.42Å; S31-K35 PolarHBondContact O-N 3.24Å |
| 32 | N | 88.3 | Confident | 85.7 | Confident | 83 Ų | 83 | 110 Ų | 110 | 44% | 0.444 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63.1 | -40.3 | 176.9 | -84.6 | -50.1 | 0 | 0 | 0 | 112.2 | E28 W29 K35 R36 | E28-N32 VanDerWaalsContact O-CB 3.29Å; E28-N32 WeakPolarHBondContact O-CB 3.44Å; E28-N32 PolarHBondContact O-N 3.11Å; E28-N32 PolarHBondContact O-ND2 3.07Å; W29-N32 PolarHBondContact O-N 3.42Å; N32-K35 PolarHBondContact O-N 2.88Å; N32-R36 WeakPolarHBondContact O-CG 3.29Å; N32-R36 PolarHBondContact O-N 3.06Å |
| 33 | M | 89.4 | Confident | 86.3 | Confident | 84 Ų | 84 | 109.3 Ų | 109.3 | 41% | 0.414 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.9 | -44.9 | 177.8 | -169.2 | 61.4 | 170.4 | 0 | 0 | 111.3 | W29 A30 S31 K35 R36 I37 | W29-M33 WeakPolarHBondContact O-CB 3.49Å; W29-M33 PolarHBondContact O-N 3.17Å; A30-M33 PolarHBondContact O-N 3.17Å; S31-M33 PolarHBondContact O-N 2.97Å; M33-K35 VanDerWaalsContact C-N 3.29Å; M33-K35 PolarHBondContact O-N 3.43Å; M33-R36 PolarHBondContact O-N 2.96Å; M33-I37 WeakPolarHBondContact O-CG1 3.48Å; M33-I37 PolarHBondContact O-N 3.07Å; M33-I37 VanDerWaalsContact O-N 3.14Å |
| 34 | K | 86.6 | Confident | 86.8 | Confident | 165 Ų | 165 | 103.9 Ų | 103.9 | 72% | 0.717 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -61 | -39.7 | 174.5 | -174.1 | 174.4 | -177.3 | 175 | 0 | 111.8 | A30 S31 I37 K38 | A30-K34 WeakPolarHBondContact O-CB 3.5Å; A30-K34 PolarHBondContact O-N 2.91Å; S31-K34 PolarHBondContact O-N 2.96Å; K34-I37 PolarHBondContact O-N 3.32Å; K34-K38 PolarHBondContact O-N 2.75Å |
| 35 | K | 87.7 | Confident | 87.1 | Confident | 123 Ų | 123 | 103.1 Ų | 103.1 | 54% | 0.535 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.4 | -47.4 | 176.2 | -170.2 | -176.4 | 172.7 | -174.7 | 0 | 111.4 | S31 N32 M33 I37 K38 D39 | S31-K35 WeakPolarHBondContact O-CB 3.42Å; S31-K35 PolarHBondContact O-N 3.24Å; N32-K35 PolarHBondContact O-N 2.88Å; M33-K35 VanDerWaalsContact C-N 3.29Å; M33-K35 PolarHBondContact O-N 3.43Å; K35-I37 VanDerWaalsContact C-N 3.3Å; K35-I37 PolarHBondContact O-N 2.88Å; K35-K38 PolarHBondContact O-N 2.94Å; K35-K38 VanDerWaalsContact O-N 3.11Å; K35-D39 WeakPolarHBondContact CE-OD2 3.41Å; K35-D39 WeakPolarHBondContact CG-OD2 3.45Å; K35-D39 WeakPolarHBondContact O-CB 3.41Å; K35-D39 PolarHBondContact O-N 3.4Å |
| 36 | R | 83.1 | Confident | 87.2 | Confident | 161 Ų | 161 | 101 Ų | 101 | 61% | 0.608 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -59.7 | -36.6 | 177.7 | -72 | -167.6 | -159.6 | 121.3 | 0.6 | 113.6 | N32 M33 G40 | N32-R36 WeakPolarHBondContact O-CG 3.29Å; N32-R36 PolarHBondContact O-N 3.06Å; M33-R36 PolarHBondContact O-N 2.96Å; R36-G40 PolarHBondContact O-N 2.93Å |
| 37 | I | 80.9 | Confident | 87.5 | Confident | 116 Ų | 116 | 100.1 Ų | 100.1 | 60% | 0.595 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -66 | -44.2 | 176.4 | -65.9 | 166.7 | 0 | 0 | 0 | 110.3 | M33 K34 K35 G40 Y41 | M33-I37 WeakPolarHBondContact O-CG1 3.48Å; M33-I37 PolarHBondContact O-N 3.07Å; M33-I37 VanDerWaalsContact O-N 3.14Å; K34-I37 PolarHBondContact O-N 3.32Å; K35-I37 VanDerWaalsContact C-N 3.3Å; K35-I37 PolarHBondContact O-N 2.88Å; I37-G40 PolarHBondContact O-N 3.36Å; I37-Y41 PolarHBondContact O-N 3.39Å |
| 38 | K | 85.2 | Confident | 87.6 | Confident | 145 Ų | 145 | 95.4 Ų | 95.4 | 63% | 0.63 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.1 | -45.7 | 176.9 | -173.5 | -177.9 | 177.3 | -175.1 | 0 | 111.6 | K34 K35 G40 Y41 V42 | K34-K38 PolarHBondContact O-N 2.75Å; K35-K38 PolarHBondContact O-N 2.94Å; K35-K38 VanDerWaalsContact O-N 3.11Å; K38-G40 VanDerWaalsContact C-N 3.34Å; K38-Y41 PolarHBondContact O-N 2.84Å; K38-V42 WeakPolarHBondContact O-CG2 3.3Å; K38-V42 PolarHBondContact O-N 3.19Å |
| 39 | D | 87.1 | Confident | 87.5 | Confident | 67 Ų | 67 | 95.9 Ų | 95.9 | 36% | 0.358 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62 | -44.5 | 178.4 | -66.2 | -7.5 | 0 | 0 | 0 | 109.7 | K35 Y41 V42 D43 | K35-D39 WeakPolarHBondContact CE-OD2 3.41Å; K35-D39 WeakPolarHBondContact CG-OD2 3.45Å; K35-D39 WeakPolarHBondContact O-CB 3.41Å; K35-D39 PolarHBondContact O-N 3.4Å; D39-Y41 VanDerWaalsContact C-N 3.34Å; D39-Y41 PolarHBondContact O-N 3.33Å; D39-V42 PolarHBondContact O-N 3.46Å; D39-D43 WeakPolarHBondContact O-CB 3.45Å; D39-D43 VanDerWaalsContact O-CG 3.22Å; D39-D43 PolarHBondContact O-N 2.93Å |
| 40 | G | 87.6 | Confident | 87.7 | Confident | 42 Ų | 42 | 94.3 Ų | 94.3 | 43% | 0.433 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.6 | -33.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | R36 I37 K38 G44 | R36-G40 PolarHBondContact O-N 2.93Å; I37-G40 PolarHBondContact O-N 3.36Å; K38-G40 VanDerWaalsContact C-N 3.34Å; G40-G44 PolarHBondContact O-N 3.14Å |
| 41 | Y | 84.3 | Confident | 87.8 | Confident | 170 Ų | 170 | 94.9 Ų | 94.9 | 67% | 0.667 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -66.9 | -46.9 | 172.2 | 175.2 | -96 | 0 | 0 | 0 | 111.6 | I37 K38 D39 G44 V45 | I37-Y41 PolarHBondContact O-N 3.39Å; K38-Y41 PolarHBondContact O-N 2.84Å; D39-Y41 VanDerWaalsContact C-N 3.34Å; D39-Y41 PolarHBondContact O-N 3.33Å; Y41-G44 PolarHBondContact O-N 3.23Å; Y41-V45 HydrophobicContact CD1-CG2 4.39Å; Y41-V45 HydrophobicContact CE1-CG2 3.94Å; Y41-V45 HydrophobicContact CE2-CG2 4.23Å; Y41-V45 WeakPolarHBondContact O-CG2 3.4Å; Y41-V45 PolarHBondContact O-N 2.84Å |
| 42 | V | 88.1 | Confident | 87.8 | Confident | 64 Ų | 64 | 95.2 Ų | 95.2 | 39% | 0.388 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.7 | -45.5 | 177.7 | 172.6 | 0 | 0 | 0 | 0 | 110.6 | K38 D39 G44 V45 N46 | K38-V42 WeakPolarHBondContact O-CG2 3.3Å; K38-V42 PolarHBondContact O-N 3.19Å; D39-V42 PolarHBondContact O-N 3.46Å; V42-G44 VanDerWaalsContact C-N 3.31Å; V42-G44 PolarHBondContact O-N 3.48Å; V42-V45 PolarHBondContact O-N 3.12Å; V42-N46 VanDerWaalsContact O-CG 3.26Å; V42-N46 PolarHBondContact O-N 3.35Å; V42-N46 PolarHBondContact O-ND2 3.32Å |
| 43 | D | 91.1 | Very high | 87.9 | Confident | 103 Ų | 103 | 96.6 Ų | 96.6 | 55% | 0.551 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.7 | -40.3 | 176.2 | -71.2 | -11.9 | 0 | 0 | 0 | 111.4 | D39 N46 A47 | D39-D43 WeakPolarHBondContact O-CB 3.45Å; D39-D43 VanDerWaalsContact O-CG 3.22Å; D39-D43 PolarHBondContact O-N 2.93Å; D43-N46 PolarHBondContact O-N 3.08Å; D43-A47 WeakPolarHBondContact O-CB 3.4Å; D43-A47 PolarHBondContact O-N 2.94Å |
| 44 | G | 89.9 | Confident | 88.1 | Confident | 45 Ų | 45 | 97.4 Ų | 97.4 | 46% | 0.464 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.5 | -41.7 | 177 | 0 | 0 | 0 | 0 | 0 | 113.2 | G40 Y41 V42 G48 | G40-G44 PolarHBondContact O-N 3.14Å; Y41-G44 PolarHBondContact O-N 3.23Å; V42-G44 VanDerWaalsContact C-N 3.31Å; V42-G44 PolarHBondContact O-N 3.48Å; G44-G48 PolarHBondContact O-N 3.45Å |
| 45 | V | 88 | Confident | 88.3 | Confident | 69 Ų | 69 | 96.3 Ų | 96.3 | 42% | 0.418 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.6 | -49.8 | 175 | 171 | 0 | 0 | 0 | 0 | 110.5 | Y41 V42 A47 G48 E49 | Y41-V45 HydrophobicContact CD1-CG2 4.39Å; Y41-V45 HydrophobicContact CE1-CG2 3.94Å; Y41-V45 HydrophobicContact CE2-CG2 4.23Å; Y41-V45 WeakPolarHBondContact O-CG2 3.4Å; Y41-V45 PolarHBondContact O-N 2.84Å; V42-V45 PolarHBondContact O-N 3.12Å; V45-A47 PolarHBondContact O-N 3.4Å; V45-G48 PolarHBondContact O-N 3.32Å; V45-E49 PolarHBondContact O-N 3.48Å |
| 46 | N | 88.1 | Confident | 88.4 | Confident | 73 Ų | 73 | 92.6 Ų | 92.6 | 39% | 0.39 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.1 | -45.7 | 178.9 | -68.2 | -21.2 | 0 | 0 | 0 | 111.4 | V42 D43 G48 E49 E50 | V42-N46 VanDerWaalsContact O-CG 3.26Å; V42-N46 PolarHBondContact O-N 3.35Å; V42-N46 PolarHBondContact O-ND2 3.32Å; D43-N46 PolarHBondContact O-N 3.08Å; N46-G48 VanDerWaalsContact C-N 3.3Å; N46-G48 PolarHBondContact O-N 3.14Å; N46-E49 PolarHBondContact O-N 3.07Å; N46-E50 WeakPolarHBondContact O-CB 3.33Å; N46-E50 WeakPolarHBondContact O-CG 3.45Å; N46-E50 PolarHBondContact O-N 3.36Å |
| 47 | A | 91.8 | Very high | 88.8 | Confident | 56 Ų | 56 | 90.8 Ų | 90.8 | 46% | 0.463 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.9 | -36.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | D43 V45 A51 | D43-A47 WeakPolarHBondContact O-CB 3.4Å; D43-A47 PolarHBondContact O-N 2.94Å; V45-A47 PolarHBondContact O-N 3.4Å; A47-A51 WeakPolarHBondContact O-CB 3.45Å; A47-A51 PolarHBondContact O-N 3.03Å |
| 48 | G | 89.4 | Confident | 89.4 | Confident | 35 Ų | 35 | 89.1 Ų | 89.1 | 36% | 0.361 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.8 | -41.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113 | G44 V45 N46 S52 | G44-G48 PolarHBondContact O-N 3.45Å; V45-G48 PolarHBondContact O-N 3.32Å; N46-G48 VanDerWaalsContact C-N 3.3Å; N46-G48 PolarHBondContact O-N 3.14Å; G48-S52 WeakPolarHBondContact O-CB 3.44Å; G48-S52 PolarHBondContact O-N 3.32Å; G48-S52 PolarHBondContact O-OG 2.9Å |
| 49 | E | 89 | Confident | 89.6 | Confident | 116 Ų | 116 | 87.6 Ų | 87.6 | 54% | 0.542 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.8 | -52.1 | 175.4 | -174.9 | -178.8 | 168.4 | 0 | 0 | 110.8 | V45 N46 A51 S52 L53 | V45-E49 PolarHBondContact O-N 3.48Å; N46-E49 PolarHBondContact O-N 3.07Å; E49-A51 VanDerWaalsContact C-N 3.33Å; E49-A51 PolarHBondContact O-N 2.99Å; E49-S52 PolarHBondContact O-N 3.4Å; E49-L53 HydrophobicContact CG-CD1 4.09Å; E49-L53 WeakPolarHBondContact O-CG 3.48Å; E49-L53 PolarHBondContact O-N 2.97Å |
| 50 | E | 91.1 | Very high | 89.8 | Confident | 138 Ų | 138 | 86.3 Ų | 86.3 | 65% | 0.645 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -58.8 | -43.5 | 178.2 | -72.6 | -178.1 | 179.9 | 0 | 0 | 112 | N46 S52 L53 Q54 | N46-E50 WeakPolarHBondContact O-CB 3.33Å; N46-E50 WeakPolarHBondContact O-CG 3.45Å; N46-E50 PolarHBondContact O-N 3.36Å; E50-S52 VanDerWaalsContact C-N 3.35Å; E50-S52 PolarHBondContact O-N 3.11Å; E50-L53 PolarHBondContact O-N 2.91Å; E50-Q54 WeakPolarHBondContact O-CB 3.37Å; E50-Q54 PolarHBondContact O-N 3.21Å |
| 51 | A | 89.7 | Confident | 90 | Very high | 60 Ų | 60 | 90.8 Ų | 90.8 | 50% | 0.496 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.4 | -40.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A47 E49 M55 | A47-A51 WeakPolarHBondContact O-CB 3.45Å; A47-A51 PolarHBondContact O-N 3.03Å; E49-A51 VanDerWaalsContact C-N 3.33Å; E49-A51 PolarHBondContact O-N 2.99Å; A51-M55 WeakPolarHBondContact O-CB 3.45Å; A51-M55 PolarHBondContact O-N 3.31Å |
| 52 | S | 88.4 | Confident | 90.4 | Very high | 84 Ų | 84 | 91.1 Ų | 91.1 | 59% | 0.587 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -68.4 | -43.2 | 178.8 | -59.8 | 0 | 0 | 0 | 0 | 111.5 | G48 E49 E50 M55 G56 | G48-S52 WeakPolarHBondContact O-CB 3.44Å; G48-S52 PolarHBondContact O-N 3.32Å; G48-S52 PolarHBondContact O-OG 2.9Å; E49-S52 PolarHBondContact O-N 3.4Å; E50-S52 VanDerWaalsContact C-N 3.35Å; E50-S52 PolarHBondContact O-N 3.11Å; S52-M55 PolarHBondContact O-N 3.46Å; S52-G56 PolarHBondContact O-N 2.96Å |
| 53 | L | 90.1 | Very high | 90.4 | Very high | 112 Ų | 112 | 93.1 Ų | 93.1 | 59% | 0.586 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.4 | -46.3 | 174.7 | -73.2 | 172.5 | 0 | 0 | 0 | 111.6 | E49 E50 M55 G56 F57 | E49-L53 HydrophobicContact CG-CD1 4.09Å; E49-L53 WeakPolarHBondContact O-CG 3.48Å; E49-L53 PolarHBondContact O-N 2.97Å; E50-L53 PolarHBondContact O-N 2.91Å; L53-M55 VanDerWaalsContact C-N 3.32Å; L53-M55 PolarHBondContact O-N 3.01Å; L53-G56 PolarHBondContact O-N 3.2Å; L53-F57 PolarHBondContact O-N 3.38Å |
| 54 | Q | 93.1 | Very high | 90.4 | Very high | 102 Ų | 102 | 89 Ų | 89 | 48% | 0.477 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.9 | -38.1 | 179.6 | -171.4 | 61.4 | 41 | 0 | 0 | 111.8 | E50 F57 N58 | E50-Q54 WeakPolarHBondContact O-CB 3.37Å; E50-Q54 PolarHBondContact O-N 3.21Å; Q54-F57 PolarHBondContact O-N 3.4Å; Q54-N58 PolarHBondContact NE2-OD1 2.7Å; Q54-N58 WeakPolarHBondContact O-CB 3.45Å; Q54-N58 PolarHBondContact O-N 3.12Å; Q54-N58 PolarHBondContact O-ND2 2.94Å |
| 55 | M | 90.6 | Very high | 90.5 | Very high | 141 Ų | 141 | 88.1 Ų | 88.1 | 70% | 0.695 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61.9 | -46.3 | 174.9 | -173.9 | -179.4 | -67.7 | 0 | 0 | 111.2 | A51 S52 L53 N58 M59 | A51-M55 WeakPolarHBondContact O-CB 3.45Å; A51-M55 PolarHBondContact O-N 3.31Å; S52-M55 PolarHBondContact O-N 3.46Å; L53-M55 VanDerWaalsContact C-N 3.32Å; L53-M55 PolarHBondContact O-N 3.01Å; M55-N58 PolarHBondContact O-N 3.22Å; M55-M59 PolarHBondContact O-N 2.98Å |
| 56 | G | 90.1 | Very high | 90.6 | Very high | 46 Ų | 46 | 88 Ų | 88 | 47% | 0.474 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.9 | -45.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | S52 L53 M59 G60 | S52-G56 PolarHBondContact O-N 2.96Å; L53-G56 PolarHBondContact O-N 3.2Å; G56-M59 PolarHBondContact O-N 3.42Å; G56-G60 PolarHBondContact O-N 2.92Å |
| 57 | F | 92.3 | Very high | 90.5 | Very high | 122 Ų | 122 | 88.5 Ų | 88.5 | 54% | 0.535 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.1 | -48.7 | 176.1 | 177.2 | -93.4 | 0 | 0 | 0 | 112.1 | L53 Q54 M59 G60 F61 | L53-F57 PolarHBondContact O-N 3.38Å; Q54-F57 PolarHBondContact O-N 3.4Å; F57-M59 VanDerWaalsContact C-N 3.27Å; F57-M59 PolarHBondContact O-N 2.95Å; F57-G60 PolarHBondContact O-N 3.49Å; F57-F61 HydrophobicContact CE1-CB 4.17Å; F57-F61 HydrophobicContact CE1-CG 4.43Å; F57-F61 HydrophobicContact CZ-CB 4.33Å; F57-F61 HydrophobicContact CZ-CD2 4.22Å; F57-F61 HydrophobicContact CZ-CG 4.5Å; F57-F61 WeakPolarHBondContact O-CB 3.39Å; F57-F61 PolarHBondContact O-N 3.4Å |
| 58 | N | 93.1 | Very high | 90.5 | Very high | 82 Ų | 82 | 87.9 Ų | 87.9 | 44% | 0.439 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.4 | -40 | -179.3 | -72.5 | -18.1 | 0 | 0 | 0 | 111.6 | Q54 M55 R62 | Q54-N58 PolarHBondContact NE2-OD1 2.7Å; Q54-N58 WeakPolarHBondContact O-CB 3.45Å; Q54-N58 PolarHBondContact O-N 3.12Å; Q54-N58 PolarHBondContact O-ND2 2.94Å; M55-N58 PolarHBondContact O-N 3.22Å; N58-R62 VanDerWaalsContact O-CB 3.31Å; N58-R62 WeakPolarHBondContact O-CB 3.49Å; N58-R62 PolarHBondContact O-N 3.41Å |
| 59 | M | 89.8 | Confident | 90.7 | Very high | 112 Ų | 112 | 89.1 Ų | 89.1 | 55% | 0.552 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -66.1 | -51.3 | 177.1 | -178 | 166.4 | 171.4 | 0 | 0 | 111.4 | M55 G56 F57 F61 R62 E63 | M55-M59 PolarHBondContact O-N 2.98Å; G56-M59 PolarHBondContact O-N 3.42Å; F57-M59 VanDerWaalsContact C-N 3.27Å; F57-M59 PolarHBondContact O-N 2.95Å; M59-F61 PolarHBondContact O-N 3.42Å; M59-R62 PolarHBondContact O-N 3.05Å; M59-E63 PolarHBondContact O-N 3.27Å |
| 60 | G | 89.6 | Confident | 90.9 | Very high | 41 Ų | 41 | 83.7 Ų | 83.7 | 42% | 0.423 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.3 | -39.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | G56 F57 E63 G64 | G56-G60 PolarHBondContact O-N 2.92Å; F57-G60 PolarHBondContact O-N 3.49Å; G60-E63 PolarHBondContact O-N 3.38Å; G60-G64 PolarHBondContact O-N 2.93Å |
| 61 | F | 92.1 | Very high | 91 | Very high | 135 Ų | 135 | 77.2 Ų | 77.2 | 59% | 0.592 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -62.2 | -46.9 | 175.5 | 179.5 | -95.4 | 0 | 0 | 0 | 111.3 | F57 M59 E63 A65 | F57-F61 HydrophobicContact CE1-CB 4.17Å; F57-F61 HydrophobicContact CE1-CG 4.43Å; F57-F61 HydrophobicContact CZ-CB 4.33Å; F57-F61 HydrophobicContact CZ-CD2 4.22Å; F57-F61 HydrophobicContact CZ-CG 4.5Å; F57-F61 WeakPolarHBondContact O-CB 3.39Å; F57-F61 PolarHBondContact O-N 3.4Å; M59-F61 PolarHBondContact O-N 3.42Å; F61-E63 VanDerWaalsContact C-N 3.35Å; F61-E63 PolarHBondContact O-N 3.17Å; F61-A65 HydrophobicContact CE1-CB 4.49Å; F61-A65 WeakPolarHBondContact O-CB 3.45Å; F61-A65 PolarHBondContact O-N 3.36Å |
| 62 | R | 92.5 | Very high | 91.2 | Very high | 178 Ų | 178 | 75.9 Ų | 75.9 | 67% | 0.672 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -61.3 | -44.4 | 178.7 | -177.5 | 179.6 | 62.7 | 165.6 | -0.7 | 111.5 | N58 M59 A66 | N58-R62 VanDerWaalsContact O-CB 3.31Å; N58-R62 WeakPolarHBondContact O-CB 3.49Å; N58-R62 PolarHBondContact O-N 3.41Å; M59-R62 PolarHBondContact O-N 3.05Å; R62-A66 VanDerWaalsContact O-CB 3.29Å; R62-A66 WeakPolarHBondContact O-CB 3.49Å; R62-A66 PolarHBondContact O-N 2.92Å |
| 63 | E | 89.7 | Confident | 91.5 | Very high | 106 Ų | 106 | 78.4 Ų | 78.4 | 50% | 0.495 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -67.3 | -48.3 | 179.3 | -177.5 | 173.2 | 178 | 0 | 0 | 112 | M59 G60 F61 A65 A66 Q67 | M59-E63 PolarHBondContact O-N 3.27Å; G60-E63 PolarHBondContact O-N 3.38Å; F61-E63 VanDerWaalsContact C-N 3.35Å; F61-E63 PolarHBondContact O-N 3.17Å; E63-A65 PolarHBondContact O-N 2.92Å; E63-A66 PolarHBondContact O-N 2.99Å; E63-Q67 WeakPolarHBondContact O-CG 3.49Å; E63-Q67 PolarHBondContact O-N 3.46Å; E63-Q67 VanDerWaalsContact O-N 3.15Å |
| 64 | G | 90.6 | Very high | 91.7 | Very high | 17 Ų | 17 | 73 Ų | 73 | 18% | 0.175 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -62.6 | -41.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | G60 Q67 T68 | G60-G64 PolarHBondContact O-N 2.93Å; G64-Q67 PolarHBondContact O-N 3.47Å; G64-T68 WeakPolarHBondContact O-CB 3.33Å; G64-T68 WeakPolarHBondContact O-CG2 3.34Å; G64-T68 PolarHBondContact O-N 2.84Å; G64-T68 PolarHBondContact O-OG1 3.49Å |
| 65 | A | 91.3 | Very high | 91.8 | Very high | 25 Ų | 25 | 73.2 Ų | 73.2 | 21% | 0.207 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -64.5 | -45.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | F61 E63 Q67 T68 V69 | F61-A65 HydrophobicContact CE1-CB 4.49Å; F61-A65 WeakPolarHBondContact O-CB 3.45Å; F61-A65 PolarHBondContact O-N 3.36Å; E63-A65 PolarHBondContact O-N 2.92Å; A65-Q67 PolarHBondContact O-N 3.37Å; A65-T68 PolarHBondContact O-N 2.89Å; A65-V69 HydrophobicContact CB-CG2 4.18Å; A65-V69 VanDerWaalsContact O-CB 3.28Å; A65-V69 WeakPolarHBondContact O-CB 3.42Å; A65-V69 WeakPolarHBondContact O-CG2 3.3Å; A65-V69 PolarHBondContact O-N 3.48Å |
| 66 | A | 89.4 | Confident | 92 | Very high | 66 Ų | 66 | 68.5 Ų | 68.5 | 55% | 0.545 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -56.6 | -38.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | R62 E63 | R62-A66 VanDerWaalsContact O-CB 3.29Å; R62-A66 WeakPolarHBondContact O-CB 3.49Å; R62-A66 PolarHBondContact O-N 2.92Å; E63-A66 PolarHBondContact O-N 2.99Å |
| 67 | Q | 87.2 | Confident | 92.2 | Very high | 85 Ų | 85 | 67.8 Ų | 67.8 | 40% | 0.397 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -80.2 | -27.7 | -179.4 | -64.1 | 178.1 | 24.2 | 0 | 0 | 114 | E63 G64 A65 I112 | E63-Q67 WeakPolarHBondContact O-CG 3.49Å; E63-Q67 PolarHBondContact O-N 3.46Å; E63-Q67 VanDerWaalsContact O-N 3.15Å; G64-Q67 PolarHBondContact O-N 3.47Å; A65-Q67 PolarHBondContact O-N 3.37Å; Q67-I112 HydrophobicContact CB-CG2 4.06Å |
| 68 | T | 91 | Very high | 92.4 | Very high | 43 Ų | 43 | 62 Ų | 62 | 26% | 0.264 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -107.8 | -22.2 | -169.2 | 58.5 | 0 | 0 | 0 | 0 | 114.7 | G64 A65 V71 G72 I112 I116 | G64-T68 WeakPolarHBondContact O-CB 3.33Å; G64-T68 WeakPolarHBondContact O-CG2 3.34Å; G64-T68 PolarHBondContact O-N 2.84Å; G64-T68 PolarHBondContact O-OG1 3.49Å; A65-T68 PolarHBondContact O-N 2.89Å; T68-V71 PolarHBondContact O-N 2.79Å; T68-G72 PolarHBondContact O-N 3.23Å; T68-I112 HydrophobicContact CG2-CG2 3.82Å; T68-I116 HydrophobicContact CG2-CD1 4.21Å |
| 69 | V | 93.4 | Very high | 92.4 | Very high | 60 Ų | 60 | 59.8 Ų | 59.8 | 36% | 0.364 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -62.9 | -47.7 | -175.4 | 165.6 | 0 | 0 | 0 | 0 | 111.8 | A65 G72 R73 M212 | A65-V69 HydrophobicContact CB-CG2 4.18Å; A65-V69 VanDerWaalsContact O-CB 3.28Å; A65-V69 WeakPolarHBondContact O-CB 3.42Å; A65-V69 WeakPolarHBondContact O-CG2 3.3Å; A65-V69 PolarHBondContact O-N 3.48Å; V69-G72 PolarHBondContact O-N 3.36Å; V69-R73 WeakPolarHBondContact O-CB 3.28Å; V69-R73 WeakPolarHBondContact O-CG 3.46Å; V69-R73 PolarHBondContact O-N 3.43Å; V69-M212 HydrophobicContact CG1-CE 3.51Å |
| 70 | A | 93.1 | Very high | 92.6 | Very high | 3 Ų | 3 | 57.2 Ų | 57.2 | 3% | 0.025 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -63.8 | -45.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | R73 L74 L182 M212 | A70-R73 PolarHBondContact O-N 2.92Å; A70-L74 PolarHBondContact O-N 2.95Å; A70-L182 HydrophobicContact CB-CD2 3.73Å; A70-M212 HydrophobicContact CB-CB 4.12Å |
| 71 | V | 93.2 | Very high | 92.8 | Very high | 2 Ų | 2 | 56 Ų | 56 | 1% | 0.012 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -65 | -41.1 | 177.2 | -178.2 | 0 | 0 | 0 | 0 | 111.3 | T68 L74 R75 V105 Q109 I112 L182 | T68-V71 PolarHBondContact O-N 2.79Å; V71-L74 PolarHBondContact O-N 2.97Å; V71-R75 WeakPolarHBondContact O-CB 3.41Å; V71-R75 PolarHBondContact O-N 3.24Å; V71-V105 HydrophobicContact CG1-CG1 4.34Å; V71-Q109 HydrophobicContact CG1-CB 3.83Å; V71-Q109 HydrophobicContact CG1-CG 4.4Å; V71-I112 HydrophobicContact CG2-CD1 3.72Å; V71-L182 HydrophobicContact CG2-CD1 4Å; V71-L182 HydrophobicContact CG2-CD2 4.41Å |
| 72 | G | 94.1 | Very high | 92.8 | Very high | 32 Ų | 32 | 52.7 Ų | 52.7 | 33% | 0.33 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -63.6 | -41.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | T68 V69 R75 G76 | T68-G72 PolarHBondContact O-N 3.23Å; V69-G72 PolarHBondContact O-N 3.36Å; G72-R75 PolarHBondContact O-N 3.41Å; G72-G76 PolarHBondContact O-N 2.94Å |
| 73 | R | 94.8 | Very high | 92.7 | Very high | 136 Ų | 136 | 47.6 Ų | 47.6 | 51% | 0.513 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -63.2 | -46.9 | 172.4 | -76.1 | -178.6 | 175.1 | -163.1 | -1.8 | 111.6 | V69 A70 R75 G76 I77 L209 M212 | V69-R73 WeakPolarHBondContact O-CB 3.28Å; V69-R73 WeakPolarHBondContact O-CG 3.46Å; V69-R73 PolarHBondContact O-N 3.43Å; A70-R73 PolarHBondContact O-N 2.92Å; R73-R75 VanDerWaalsContact C-N 3.32Å; R73-R75 PolarHBondContact O-N 2.91Å; R73-G76 WeakPolarHBondContact O-CA 3.31Å; R73-G76 PolarHBondContact O-N 2.8Å; R73-G76 VanDerWaalsContact O-N 3.11Å; R73-I77 WeakPolarHBondContact O-CG1 3.31Å; R73-I77 PolarHBondContact O-N 3.24Å; R73-L209 HydrophobicContact CB-CD1 4.43Å; R73-L209 HydrophobicContact CB-CD2 3.64Å; R73-L209 HydrophobicContact CG-CD2 4.36Å; R73-M212 PolarHBondContact NH1-SD 3.17Å; R73-M212 VanDerWaalsContact NH1-SD 3.36Å |
| 74 | L | 94.7 | Very high | 92.9 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -56.9 | -46.8 | 176.7 | -176.7 | 61.1 | 0 | 0 | 0 | 111.2 | A70 V71 G76 I77 V78 V105 L182 L185 V186 C189 L209 | A70-L74 PolarHBondContact O-N 2.95Å; V71-L74 PolarHBondContact O-N 2.97Å; L74-G76 VanDerWaalsContact C-N 3.31Å; L74-G76 PolarHBondContact O-N 3.04Å; L74-I77 PolarHBondContact O-N 2.97Å; L74-V78 HydrophobicContact CD1-CG2 4.25Å; L74-V78 HydrophobicContact CG-CG2 4.45Å; L74-V78 WeakPolarHBondContact O-CG2 3.39Å; L74-V78 PolarHBondContact O-N 3.43Å; L74-V105 HydrophobicContact CD2-CG1 4.44Å; L74-V105 HydrophobicContact CD2-CG2 3.91Å; L74-V105 HydrophobicContact CG-CG1 4.36Å; L74-V105 HydrophobicContact CG-CG2 4.15Å; L74-L182 HydrophobicContact CD2-CD1 3.85Å; L74-L185 HydrophobicContact CD2-CB 3.73Å; L74-V186 HydrophobicContact CD1-CG2 4.42Å; L74-V186 HydrophobicContact CD2-CG2 4.03Å; L74-C189 HydrophobicContact CD1-CB 3.87Å; L74-L209 HydrophobicContact CB-CD1 3.86Å; L74-L209 HydrophobicContact CD1-CD1 4.1Å |
| 75 | R | 95.2 | Very high | 92.9 | Very high | 105 Ų | 105 | 47.5 Ų | 47.5 | 40% | 0.396 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -59 | -43 | 176 | -172.9 | 175.1 | 170.7 | -102.6 | -0.3 | 111.9 | V71 G72 R73 S79 L102 V105 | V71-R75 WeakPolarHBondContact O-CB 3.41Å; V71-R75 PolarHBondContact O-N 3.24Å; G72-R75 PolarHBondContact O-N 3.41Å; R73-R75 VanDerWaalsContact C-N 3.32Å; R73-R75 PolarHBondContact O-N 2.91Å; R75-S79 VanDerWaalsContact O-CB 3.3Å; R75-S79 WeakPolarHBondContact O-CB 3.29Å; R75-S79 PolarHBondContact O-N 3.31Å; R75-S79 PolarHBondContact O-OG 3.21Å; R75-L102 HydrophobicContact CG-CD1 4.04Å; R75-V105 HydrophobicContact CB-CG1 3.68Å; R75-V105 HydrophobicContact CG-CG1 4.29Å |
| 76 | G | 95.4 | Very high | 92.8 | Very high | 42 Ų | 42 | 51 Ų | 51 | 43% | 0.433 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -59.2 | -47.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | G72 R73 L74 S79 A80 | G72-G76 PolarHBondContact O-N 2.94Å; R73-G76 WeakPolarHBondContact O-CA 3.31Å; R73-G76 PolarHBondContact O-N 2.8Å; R73-G76 VanDerWaalsContact O-N 3.11Å; L74-G76 VanDerWaalsContact C-N 3.31Å; L74-G76 PolarHBondContact O-N 3.04Å; G76-S79 PolarHBondContact O-N 3.31Å; G76-A80 WeakPolarHBondContact O-CB 3.11Å; G76-A80 PolarHBondContact O-N 3.06Å |
| 77 | I | 94.6 | Very high | 92.9 | Very high | 32 Ų | 32 | 54 Ų | 54 | 16% | 0.164 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.6 | -51.3 | 178.2 | -66.8 | 164.7 | 0 | 0 | 0 | 110.9 | R73 L74 S79 A80 V81 L202 I206 L209 | R73-I77 WeakPolarHBondContact O-CG1 3.31Å; R73-I77 PolarHBondContact O-N 3.24Å; L74-I77 PolarHBondContact O-N 2.97Å; I77-S79 VanDerWaalsContact C-N 3.27Å; I77-S79 PolarHBondContact O-N 3.46Å; I77-A80 WeakPolarHBondContact O-CB 3.48Å; I77-A80 PolarHBondContact O-N 2.84Å; I77-A80 VanDerWaalsContact O-N 3.07Å; I77-V81 HydrophobicContact CG2-CG2 4.38Å; I77-V81 WeakPolarHBondContact O-CG2 3.4Å; I77-V81 PolarHBondContact O-N 3.15Å; I77-L202 HydrophobicContact CG2-CD1 4.03Å; I77-I206 HydrophobicContact CD1-CG1 3.98Å; I77-I206 HydrophobicContact CG2-CD1 3.96Å; I77-I206 HydrophobicContact CG2-CG1 3.88Å; I77-L209 HydrophobicContact CD1-CD1 4.01Å |
| 78 | V | 94.6 | Very high | 93.1 | Very high | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -60.6 | -39.2 | -179.6 | 177.6 | 0 | 0 | 0 | 0 | 111.1 | L74 V81 W82 L98 L101 L102 | L74-V78 HydrophobicContact CD1-CG2 4.25Å; L74-V78 HydrophobicContact CG-CG2 4.45Å; L74-V78 WeakPolarHBondContact O-CG2 3.39Å; L74-V78 PolarHBondContact O-N 3.43Å; V78-V81 PolarHBondContact O-N 2.68Å; V78-W82 WeakPolarHBondContact O-CB 3.37Å; V78-W82 PolarHBondContact O-N 2.91Å; V78-L98 HydrophobicContact CG1-CD1 3.93Å; V78-L101 HydrophobicContact CG1-CD2 4.19Å; V78-L101 HydrophobicContact CG1-CG 4.2Å; V78-L101 HydrophobicContact CG2-CD2 3.8Å; V78-L101 HydrophobicContact CG2-CG 4.18Å; V78-L102 HydrophobicContact CB-CD1 4.09Å; V78-L102 HydrophobicContact CG1-CB 3.85Å; V78-L102 HydrophobicContact CG1-CD1 3.86Å; V78-L102 HydrophobicContact CG1-CG 4.46Å |
| 79 | S | 94.8 | Very high | 92.9 | Very high | 36 Ų | 36 | 56.3 Ų | 56.3 | 25% | 0.252 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -64.2 | -41.7 | 175.1 | -56.8 | 0 | 0 | 0 | 0 | 111.8 | R75 G76 I77 W82 C83 L102 | R75-S79 VanDerWaalsContact O-CB 3.3Å; R75-S79 WeakPolarHBondContact O-CB 3.29Å; R75-S79 PolarHBondContact O-N 3.31Å; R75-S79 PolarHBondContact O-OG 3.21Å; G76-S79 PolarHBondContact O-N 3.31Å; I77-S79 VanDerWaalsContact C-N 3.27Å; I77-S79 PolarHBondContact O-N 3.46Å; S79-W82 PolarHBondContact O-N 3.42Å; S79-C83 PolarHBondContact O-N 3.47Å; S79-C83 PolarHBondContact O-SG 3.04Å; S79-C83 VanDerWaalsContact O-SG 3.42Å; S79-L102 WeakPolarHBondContact OG-CD1 3.42Å |
| 80 | A | 94.1 | Very high | 92.5 | Very high | 58 Ų | 58 | 58.5 Ų | 58.5 | 48% | 0.479 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -65.1 | -41.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | G76 I77 W82 C83 W84 | G76-A80 WeakPolarHBondContact O-CB 3.11Å; G76-A80 PolarHBondContact O-N 3.06Å; I77-A80 WeakPolarHBondContact O-CB 3.48Å; I77-A80 PolarHBondContact O-N 2.84Å; I77-A80 VanDerWaalsContact O-N 3.07Å; A80-W82 VanDerWaalsContact C-N 3.34Å; A80-C83 PolarHBondContact O-N 3.25Å; A80-W84 WeakPolarHBondContact O-CB 3.4Å; A80-W84 PolarHBondContact O-N 3.39Å |
| 81 | V | 92.3 | Very high | 92.2 | Very high | 14 Ų | 14 | 67 Ų | 67 | 9% | 0.085 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -62 | -42.4 | 174.7 | 173.3 | 0 | 0 | 0 | 0 | 110.9 | I77 V78 W84 Y85 L98 L196 L198 L202 | I77-V81 HydrophobicContact CG2-CG2 4.38Å; I77-V81 WeakPolarHBondContact O-CG2 3.4Å; I77-V81 PolarHBondContact O-N 3.15Å; V78-V81 PolarHBondContact O-N 2.68Å; V81-W84 PolarHBondContact O-N 3.1Å; V81-Y85 WeakPolarHBondContact O-CB 3.28Å; V81-Y85 PolarHBondContact O-N 3.34Å; V81-L98 HydrophobicContact CG1-CD1 4.13Å; V81-L98 HydrophobicContact CG1-CD2 4.16Å; V81-L196 HydrophobicContact CG1-CD1 3.79Å; V81-L198 HydrophobicContact CB-CD1 4.47Å; V81-L198 HydrophobicContact CG1-CD1 3.88Å; V81-L198 HydrophobicContact CG2-CD1 3.73Å; V81-L202 HydrophobicContact CG2-CD2 4.18Å |
| 82 | W | 92.1 | Very high | 91.9 | Very high | 67 Ų | 67 | 73 Ų | 73 | 25% | 0.254 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -60.6 | -51.7 | 173.8 | -179.4 | -3 | 0 | 0 | 0 | 111.1 | V78 S79 A80 W84 Y85 Q86 V94 L98 I99 L102 | V78-W82 WeakPolarHBondContact O-CB 3.37Å; V78-W82 PolarHBondContact O-N 2.91Å; S79-W82 PolarHBondContact O-N 3.42Å; A80-W82 VanDerWaalsContact C-N 3.34Å; W82-W84 VanDerWaalsContact C-N 3.31Å; W82-W84 PolarHBondContact O-N 3.41Å; W82-Y85 PolarHBondContact O-N 3.34Å; W82-Q86 PolarHBondContact O-N 3.41Å; W82-Q86 VanDerWaalsContact O-N 3.12Å; W82-V94 HydrophobicContact CG-CG1 4.24Å; W82-L98 HydrophobicContact CB-CD2 3.94Å; W82-L98 HydrophobicContact CB-CG 4.23Å; W82-L98 HydrophobicContact CG-CD2 4.48Å; W82-I99 HydrophobicContact CH2-CG1 4.38Å; W82-I99 HydrophobicContact CH2-CG2 4.41Å; W82-I99 HydrophobicContact CZ2-CG1 4.45Å; W82-L102 HydrophobicContact CE3-CB 4.04Å; W82-L102 HydrophobicContact CE3-CD2 3.31Å; W82-L102 HydrophobicContact CE3-CG 4.25Å; W82-L102 HydrophobicContact CZ3-CB 4.11Å; W82-L102 HydrophobicContact CZ3-CD2 3.34Å; W82-L102 HydrophobicContact CZ3-CG 4.27Å |
| 83 | C | 92.1 | Very high | 91.5 | Very high | 71 Ų | 71 | 76.9 Ų | 76.9 | 48% | 0.48 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -57.2 | -44.5 | 176.9 | -72.1 | 0 | 0 | 0 | 0 | 112.3 | S79 A80 Y85 Q86 I87 | S79-C83 PolarHBondContact O-N 3.47Å; S79-C83 PolarHBondContact O-SG 3.04Å; S79-C83 VanDerWaalsContact O-SG 3.42Å; A80-C83 PolarHBondContact O-N 3.25Å; C83-Y85 PolarHBondContact O-N 3.22Å; C83-Q86 PolarHBondContact O-N 3.47Å; C83-I87 VanDerWaalsContact O-CG1 3.32Å; C83-I87 WeakPolarHBondContact O-CG1 3.35Å; C83-I87 PolarHBondContact O-N 2.93Å; C83-I87 VanDerWaalsContact O-N 3.12Å |
| 84 | W | 92.2 | Very high | 91.1 | Very high | 93 Ų | 93 | 71.7 Ų | 71.7 | 35% | 0.352 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -58.8 | -45.5 | 176.8 | 172.8 | 88.4 | 0 | 0 | 0 | 111.9 | A80 V81 W82 Q86 I87 Q88 L198 | A80-W84 WeakPolarHBondContact O-CB 3.4Å; A80-W84 PolarHBondContact O-N 3.39Å; V81-W84 PolarHBondContact O-N 3.1Å; W82-W84 VanDerWaalsContact C-N 3.31Å; W82-W84 PolarHBondContact O-N 3.41Å; W84-Q86 VanDerWaalsContact C-N 3.34Å; W84-Q86 PolarHBondContact O-N 2.93Å; W84-I87 PolarHBondContact O-N 2.9Å; W84-I87 VanDerWaalsContact O-N 3.17Å; W84-Q88 HydrophobicContact CD2-CG 4.05Å; W84-Q88 HydrophobicContact CG-CG 4.37Å; W84-Q88 HydrophobicContact CZ2-CG 3.93Å; W84-Q88 WeakPolarHBondContact O-CG 3.47Å; W84-Q88 PolarHBondContact O-N 3.2Å; W84-L198 HydrophobicContact CD2-CD2 4.17Å; W84-L198 HydrophobicContact CE3-CD2 3.88Å; W84-L198 HydrophobicContact CH2-CD2 3.63Å; W84-L198 HydrophobicContact CZ2-CD2 3.91Å; W84-L198 HydrophobicContact CZ3-CD2 3.61Å |
| 85 | Y | 91.1 | Very high | 90.8 | Very high | 27 Ų | 27 | 73.6 Ų | 73.6 | 11% | 0.106 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -60.7 | -43.1 | 179.3 | -174.8 | -82.4 | 0 | 0 | 0 | 111.8 | V81 W82 C83 I87 Q88 H89 V94 P95 L196 | V81-Y85 WeakPolarHBondContact O-CB 3.28Å; V81-Y85 PolarHBondContact O-N 3.34Å; W82-Y85 PolarHBondContact O-N 3.34Å; C83-Y85 PolarHBondContact O-N 3.22Å; Y85-I87 VanDerWaalsContact C-N 3.3Å; Y85-I87 PolarHBondContact O-N 3.26Å; Y85-Q88 PolarHBondContact O-N 2.87Å; Y85-H89 AromaticContact CD2-CD2 3.89Å; Y85-H89 HydrophobicContact CE1-CB 4.17Å; Y85-H89 AromaticContact CE2-CD2 3.59Å; Y85-H89 AromaticContact CZ-CD2 3.82Å; Y85-H89 PolarHBondContact O-N 2.97Å; Y85-V94 HydrophobicContact CD1-CB 4.47Å; Y85-V94 HydrophobicContact CD1-CG2 4.17Å; Y85-P95 HydrophobicContact CD2-CG 4.36Å; Y85-P95 HydrophobicContact CE1-CG 4.28Å; Y85-P95 HydrophobicContact CE2-CG 3.82Å; Y85-L196 HydrophobicContact CD2-CD2 3.95Å; Y85-L196 HydrophobicContact CE2-CD2 3.98Å |
| 86 | Q | 90.4 | Very high | 90.5 | Very high | 98 Ų | 98 | 72.3 Ų | 72.3 | 46% | 0.458 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62 | -38.9 | 177 | -73.2 | -171.3 | 62.5 | 0 | 0 | 112.5 | W82 C83 W84 H89 P90 V94 | W82-Q86 PolarHBondContact O-N 3.41Å; W82-Q86 VanDerWaalsContact O-N 3.12Å; C83-Q86 PolarHBondContact O-N 3.47Å; W84-Q86 VanDerWaalsContact C-N 3.34Å; W84-Q86 PolarHBondContact O-N 2.93Å; Q86-H89 CarbonylContact O-C 3.55Å; Q86-P90 WeakPolarHBondContact O-CA 3.43Å; Q86-V94 HydrophobicContact CG-CG2 3.5Å |
| 87 | I | 91.4 | Very high | 90.3 | Very high | 131 Ų | 131 | 77.2 Ų | 77.2 | 67% | 0.672 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -68.9 | -42.6 | 179.3 | -67 | 165 | 0 | 0 | 0 | 110.7 | C83 W84 Y85 | C83-I87 VanDerWaalsContact O-CG1 3.32Å; C83-I87 WeakPolarHBondContact O-CG1 3.35Å; C83-I87 PolarHBondContact O-N 2.93Å; C83-I87 VanDerWaalsContact O-N 3.12Å; W84-I87 PolarHBondContact O-N 2.9Å; W84-I87 VanDerWaalsContact O-N 3.17Å; Y85-I87 VanDerWaalsContact C-N 3.3Å; Y85-I87 PolarHBondContact O-N 3.26Å |
| 88 | Q | 90.1 | Very high | 90.1 | Very high | 106 Ų | 106 | 75.9 Ų | 75.9 | 50% | 0.495 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -76.1 | -27.9 | -178.3 | -64.6 | -64.3 | 7.6 | 0 | 0 | 113.3 | W84 Y85 | W84-Q88 HydrophobicContact CD2-CG 4.05Å; W84-Q88 HydrophobicContact CG-CG 4.37Å; W84-Q88 HydrophobicContact CZ2-CG 3.93Å; W84-Q88 WeakPolarHBondContact O-CG 3.47Å; W84-Q88 PolarHBondContact O-N 3.2Å; Y85-Q88 PolarHBondContact O-N 2.87Å |
| 89 | H | 88 | Confident | 89.9 | Confident | 70 Ų | 70 | 78.8 Ų | 78.8 | 32% | 0.324 | 41% | 0.411 | S | S | . | . | trans | -132.3 | 66.7 | -175.8 | -57.3 | -43.9 | 0 | 0 | 0 | 111.9 | Y85 Q86 E91 K92 | Y85-H89 AromaticContact CD2-CD2 3.89Å; Y85-H89 HydrophobicContact CE1-CB 4.17Å; Y85-H89 AromaticContact CE2-CD2 3.59Å; Y85-H89 AromaticContact CZ-CD2 3.82Å; Y85-H89 PolarHBondContact O-N 2.97Å; Q86-H89 CarbonylContact O-C 3.55Å; H89-E91 PolarHBondContact O-N 2.79Å; H89-K92 HydrophobicContact CB-CB 4.1Å; H89-K92 HydrophobicContact CB-CD 4.38Å; H89-K92 HydrophobicContact CB-CG 4.46Å; H89-K92 PolarHBondContact O-N 2.87Å; H89-K92 VanDerWaalsContact O-N 3.11Å | ||
| 90 | P | 84.7 | Confident | 89.9 | Confident | 106 Ų | 106 | 80.9 Ų | 80.9 | 69% | 0.688 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.8 | -26.9 | -176.4 | 24.6 | -34.2 | 0 | 0 | 0 | 113.5 | Q86 | Q86-P90 WeakPolarHBondContact O-CA 3.43Š|
| 91 | E | 87.5 | Confident | 89.8 | Confident | 182 Ų | 182 | 78.3 Ų | 78.3 | 85% | 0.85 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.9 | -11 | -179.2 | -61.2 | -64 | 154.8 | 0 | 0 | 113.5 | H89 | H89-E91 PolarHBondContact O-N 2.79Š|
| 92 | K | 86.4 | Confident | 89.9 | Confident | 127 Ų | 127 | 78.8 Ų | 78.8 | 55% | 0.552 | 40% | 0.399 | S | S | * | . | S | Bend | trans | -108.6 | 134.3 | -177.7 | -64 | -178.3 | -179.1 | 174.4 | 0 | 110 | H89 | H89-K92 HydrophobicContact CB-CB 4.1Å; H89-K92 HydrophobicContact CB-CD 4.38Å; H89-K92 HydrophobicContact CB-CG 4.46Å; H89-K92 PolarHBondContact O-N 2.87Å; H89-K92 VanDerWaalsContact O-N 3.11Å |
| 93 | P | 85.8 | Confident | 90.1 | Very high | 114 Ų | 114 | 80.6 Ų | 80.6 | 74% | 0.74 | 41% | 0.411 | S | S | * | . | P | Polyproline II helix | trans | -62 | 149 | 170.8 | 28.2 | -33.6 | 0 | 0 | 0 | 110.1 | ||
| 94 | V | 86.3 | Confident | 90.2 | Very high | 27 Ų | 27 | 80.2 Ų | 80.2 | 16% | 0.164 | 40% | 0.402 | C | S | . | . | P | Polyproline II helix | trans | -62.7 | 139.2 | 176.7 | 178.9 | 0 | 0 | 0 | 0 | 108.9 | W82 Y85 Q86 S96 L98 I99 | W82-V94 HydrophobicContact CG-CG1 4.24Å; Y85-V94 HydrophobicContact CD1-CB 4.47Å; Y85-V94 HydrophobicContact CD1-CG2 4.17Å; Q86-V94 HydrophobicContact CG-CG2 3.5Å; V94-S96 PolarHBondContact O-N 3.04Å; V94-L98 HydrophobicContact CG1-CB 4.32Å; V94-L98 HydrophobicContact CG1-CD2 4Å; V94-L98 HydrophobicContact CG1-CG 4.41Å; V94-I99 HydrophobicContact CB-CD1 4.22Å; V94-I99 HydrophobicContact CB-CG1 4.36Å; V94-I99 HydrophobicContact CG1-CD1 4.31Å; V94-I99 HydrophobicContact CG1-CG1 3.9Å |
| 95 | P | 88 | Confident | 90.3 | Very high | 39 Ų | 39 | 75.8 Ų | 75.8 | 25% | 0.253 | 39% | 0.385 | S | S | . | . | P | Polyproline II helix | trans | -60 | 134 | -179.2 | -22.3 | 34.5 | 0 | 0 | 0 | 110.6 | Y85 R97 L98 I99 | Y85-P95 HydrophobicContact CD2-CG 4.36Å; Y85-P95 HydrophobicContact CE1-CG 4.28Å; Y85-P95 HydrophobicContact CE2-CG 3.82Å; P95-R97 PolarHBondContact O-N 2.83Å; P95-L98 HydrophobicContact CB-CB 4.47Å; P95-L98 WeakPolarHBondContact O-CB 3.28Å; P95-L98 PolarHBondContact O-N 3.39Å; P95-I99 PolarHBondContact O-N 3.47Å |
| 96 | S | 89.6 | Confident | 90.4 | Very high | 78 Ų | 78 | 76.2 Ų | 76.2 | 55% | 0.545 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -55.6 | -38.6 | 179.3 | 59.5 | 0 | 0 | 0 | 0 | 111.8 | V94 L98 I99 D100 | V94-S96 PolarHBondContact O-N 3.04Å; S96-L98 PolarHBondContact O-N 3.06Å; S96-I99 PolarHBondContact O-N 3.36Å; S96-I99 VanDerWaalsContact O-N 3.12Å; S96-D100 WeakPolarHBondContact O-CB 3.1Å; S96-D100 PolarHBondContact O-N 3.34Å |
| 97 | R | 89.6 | Confident | 90.6 | Very high | 145 Ų | 145 | 76.5 Ų | 76.5 | 55% | 0.547 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -55.9 | -36.5 | 176.2 | -65.9 | -177 | 169.4 | -168.6 | -5.8 | 113.7 | P95 L101 L192 E195 | P95-R97 PolarHBondContact O-N 2.83Å; R97-L101 WeakPolarHBondContact O-CB 3.46Å; R97-L101 PolarHBondContact O-N 3.1Å; R97-L192 HydrophobicContact CB-CD1 4.42Å; R97-L192 HydrophobicContact CB-CD2 3.84Å; R97-E195 VanDerWaalsContact NH1-CD 3.28Å; R97-E195 IonicContact NH1-OE1 3.61Å; R97-E195 PolarHBondContact NH1-OE1 3.33Å; R97-E195 IonicContact NH1-OE2 2.93Å; R97-E195 PolarHBondContact NH1-OE2 3.03Å |
| 98 | L | 90.4 | Very high | 90.7 | Very high | 4 Ų | 4 | 72 Ų | 72 | 2% | 0.021 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -74.8 | -38.6 | 179.6 | -177 | 58.2 | 0 | 0 | 0 | 111.4 | V78 V81 W82 V94 P95 S96 L101 L102 | V78-L98 HydrophobicContact CG1-CD1 3.93Å; V81-L98 HydrophobicContact CG1-CD1 4.13Å; V81-L98 HydrophobicContact CG1-CD2 4.16Å; W82-L98 HydrophobicContact CB-CD2 3.94Å; W82-L98 HydrophobicContact CB-CG 4.23Å; W82-L98 HydrophobicContact CG-CD2 4.48Å; V94-L98 HydrophobicContact CG1-CB 4.32Å; V94-L98 HydrophobicContact CG1-CD2 4Å; V94-L98 HydrophobicContact CG1-CG 4.41Å; P95-L98 HydrophobicContact CB-CB 4.47Å; P95-L98 WeakPolarHBondContact O-CB 3.28Å; P95-L98 PolarHBondContact O-N 3.39Å; S96-L98 PolarHBondContact O-N 3.06Å; L98-L101 PolarHBondContact O-N 2.93Å; L98-L102 PolarHBondContact O-N 3.32Å |
| 99 | I | 91.4 | Very high | 90.8 | Very high | 62 Ų | 62 | 69.2 Ų | 69.2 | 32% | 0.318 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -64.7 | -47.2 | 174.4 | -58.6 | 172.5 | 0 | 0 | 0 | 109.7 | W82 V94 P95 S96 L101 L102 Q103 | W82-I99 HydrophobicContact CH2-CG1 4.38Å; W82-I99 HydrophobicContact CH2-CG2 4.41Å; W82-I99 HydrophobicContact CZ2-CG1 4.45Å; V94-I99 HydrophobicContact CB-CD1 4.22Å; V94-I99 HydrophobicContact CB-CG1 4.36Å; V94-I99 HydrophobicContact CG1-CD1 4.31Å; V94-I99 HydrophobicContact CG1-CG1 3.9Å; P95-I99 PolarHBondContact O-N 3.47Å; S96-I99 PolarHBondContact O-N 3.36Å; S96-I99 VanDerWaalsContact O-N 3.12Å; I99-L101 VanDerWaalsContact C-N 3.32Å; I99-L101 PolarHBondContact O-N 2.94Å; I99-L102 PolarHBondContact O-N 3.4Å; I99-Q103 WeakPolarHBondContact O-CB 3.17Å; I99-Q103 PolarHBondContact O-N 3.43Å |
| 100 | D | 93.8 | Very high | 91.1 | Very high | 79 Ų | 79 | 71.1 Ų | 71.1 | 42% | 0.422 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -60.5 | -41.7 | 177.7 | -65.5 | -22.6 | 0 | 0 | 0 | 111.1 | S96 Q103 Q104 | S96-D100 WeakPolarHBondContact O-CB 3.1Å; S96-D100 PolarHBondContact O-N 3.34Å; D100-Q103 PolarHBondContact O-N 3.33Å; D100-Q104 WeakPolarHBondContact O-CB 3.37Å; D100-Q104 VanDerWaalsContact O-CG 3.28Å; D100-Q104 WeakPolarHBondContact O-CG 3.39Å; D100-Q104 PolarHBondContact O-N 2.85Å |
| 101 | L | 93.6 | Very high | 91.5 | Very high | 4 Ų | 4 | 68.3 Ų | 68.3 | 2% | 0.021 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -63.3 | -47.4 | 175.7 | 179.6 | 63.1 | 0 | 0 | 0 | 111.3 | V78 R97 L98 I99 Q103 Q104 V105 L185 R188 C189 L192 | V78-L101 HydrophobicContact CG1-CD2 4.19Å; V78-L101 HydrophobicContact CG1-CG 4.2Å; V78-L101 HydrophobicContact CG2-CD2 3.8Å; V78-L101 HydrophobicContact CG2-CG 4.18Å; R97-L101 WeakPolarHBondContact O-CB 3.46Å; R97-L101 PolarHBondContact O-N 3.1Å; L98-L101 PolarHBondContact O-N 2.93Å; I99-L101 VanDerWaalsContact C-N 3.32Å; I99-L101 PolarHBondContact O-N 2.94Å; L101-Q103 VanDerWaalsContact C-N 3.27Å; L101-Q103 PolarHBondContact O-N 3.16Å; L101-Q104 PolarHBondContact O-N 3.41Å; L101-V105 HydrophobicContact CD1-CG2 4.1Å; L101-V105 HydrophobicContact CG-CG2 4.37Å; L101-V105 VanDerWaalsContact O-CG2 3.31Å; L101-V105 WeakPolarHBondContact O-CG2 3.37Å; L101-V105 PolarHBondContact O-N 3.42Å; L101-L185 HydrophobicContact CD1-CD2 4.06Å; L101-R188 HydrophobicContact CD1-CB 4.02Å; L101-C189 HydrophobicContact CD2-CB 3.87Å; L101-L192 HydrophobicContact CB-CD1 4.11Å; L101-L192 HydrophobicContact CD2-CD1 3.65Å; L101-L192 HydrophobicContact CG-CD1 4.48Å |
| 102 | L | 94.4 | Very high | 91.6 | Very high | 24 Ų | 24 | 60.3 Ų | 60.3 | 13% | 0.126 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -61.6 | -39.9 | 178.7 | -172.4 | 65.8 | 0 | 0 | 0 | 111.3 | R75 V78 S79 W82 L98 I99 V105 T106 | R75-L102 HydrophobicContact CG-CD1 4.04Å; V78-L102 HydrophobicContact CB-CD1 4.09Å; V78-L102 HydrophobicContact CG1-CB 3.85Å; V78-L102 HydrophobicContact CG1-CD1 3.86Å; V78-L102 HydrophobicContact CG1-CG 4.46Å; S79-L102 WeakPolarHBondContact OG-CD1 3.42Å; W82-L102 HydrophobicContact CE3-CB 4.04Å; W82-L102 HydrophobicContact CE3-CD2 3.31Å; W82-L102 HydrophobicContact CE3-CG 4.25Å; W82-L102 HydrophobicContact CZ3-CB 4.11Å; W82-L102 HydrophobicContact CZ3-CD2 3.34Å; W82-L102 HydrophobicContact CZ3-CG 4.27Å; L98-L102 PolarHBondContact O-N 3.32Å; I99-L102 PolarHBondContact O-N 3.4Å; L102-V105 PolarHBondContact O-N 2.76Å; L102-T106 WeakPolarHBondContact O-CB 3.43Å; L102-T106 PolarHBondContact O-N 3.22Å; L102-T106 PolarHBondContact O-OG1 2.97Å |
| 103 | Q | 95 | Very high | 91.9 | Very high | 106 Ų | 106 | 57.7 Ų | 57.7 | 50% | 0.495 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -62.9 | -45.4 | 176.6 | -178.4 | 171.5 | -12 | 0 | 0 | 111.4 | I99 D100 L101 T106 Q107 | I99-Q103 WeakPolarHBondContact O-CB 3.17Å; I99-Q103 PolarHBondContact O-N 3.43Å; D100-Q103 PolarHBondContact O-N 3.33Å; L101-Q103 VanDerWaalsContact C-N 3.27Å; L101-Q103 PolarHBondContact O-N 3.16Å; Q103-T106 PolarHBondContact O-N 2.88Å; Q103-Q107 WeakPolarHBondContact O-CG 3.34Å; Q103-Q107 PolarHBondContact O-N 3.01Å |
| 104 | Q | 94.1 | Very high | 92.2 | Very high | 63 Ų | 63 | 55.4 Ų | 55.4 | 29% | 0.294 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -64.3 | -41.5 | 178 | -74.1 | 171.2 | 6.1 | 0 | 0 | 112.5 | D100 L101 T106 Q107 H108 L185 R188 | D100-Q104 WeakPolarHBondContact O-CB 3.37Å; D100-Q104 VanDerWaalsContact O-CG 3.28Å; D100-Q104 WeakPolarHBondContact O-CG 3.39Å; D100-Q104 PolarHBondContact O-N 2.85Å; L101-Q104 PolarHBondContact O-N 3.41Å; Q104-T106 VanDerWaalsContact C-N 3.3Å; Q104-T106 PolarHBondContact O-N 3.01Å; Q104-Q107 PolarHBondContact O-N 2.9Å; Q104-H108 WeakPolarHBondContact O-CB 3.41Å; Q104-H108 PolarHBondContact O-N 3.43Å; Q104-L185 HydrophobicContact CB-CD2 3.71Å; Q104-R188 VanDerWaalsContact NE2-NH1 3.19Å |
| 105 | V | 94.5 | Very high | 92.4 | Very high | 0 Ų | 0 | 55.7 Ų | 55.7 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -63.1 | -40 | 175.4 | 175.5 | 0 | 0 | 0 | 0 | 110.8 | V71 L74 R75 L101 L102 H108 Q109 L185 | V71-V105 HydrophobicContact CG1-CG1 4.34Å; L74-V105 HydrophobicContact CD2-CG1 4.44Å; L74-V105 HydrophobicContact CD2-CG2 3.91Å; L74-V105 HydrophobicContact CG-CG1 4.36Å; L74-V105 HydrophobicContact CG-CG2 4.15Å; R75-V105 HydrophobicContact CB-CG1 3.68Å; R75-V105 HydrophobicContact CG-CG1 4.29Å; L101-V105 HydrophobicContact CD1-CG2 4.1Å; L101-V105 HydrophobicContact CG-CG2 4.37Å; L101-V105 VanDerWaalsContact O-CG2 3.31Å; L101-V105 WeakPolarHBondContact O-CG2 3.37Å; L101-V105 PolarHBondContact O-N 3.42Å; L102-V105 PolarHBondContact O-N 2.76Å; V105-H108 PolarHBondContact O-N 2.94Å; V105-Q109 PolarHBondContact O-N 3.4Å; V105-L185 HydrophobicContact CG2-CB 4.3Å; V105-L185 HydrophobicContact CG2-CD1 4.19Å; V105-L185 HydrophobicContact CG2-CD2 4.18Å; V105-L185 HydrophobicContact CG2-CG 4.46Å |
| 106 | T | 94.1 | Very high | 92.4 | Very high | 35 Ų | 35 | 56.2 Ų | 56.2 | 22% | 0.215 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -65.5 | -45.8 | 177.5 | -58 | 0 | 0 | 0 | 0 | 111.4 | L102 Q103 Q104 H108 Q109 E110 | L102-T106 WeakPolarHBondContact O-CB 3.43Å; L102-T106 PolarHBondContact O-N 3.22Å; L102-T106 PolarHBondContact O-OG1 2.97Å; Q103-T106 PolarHBondContact O-N 2.88Å; Q104-T106 VanDerWaalsContact C-N 3.3Å; Q104-T106 PolarHBondContact O-N 3.01Å; T106-H108 VanDerWaalsContact C-N 3.31Å; T106-H108 PolarHBondContact O-N 2.85Å; T106-Q109 WeakPolarHBondContact O-CB 3.2Å; T106-Q109 PolarHBondContact O-N 3.4Å; T106-E110 WeakPolarHBondContact O-CG 3.38Å; T106-E110 PolarHBondContact O-N 3.25Å |
| 107 | Q | 93.9 | Very high | 92.4 | Very high | 104 Ų | 104 | 58.6 Ų | 58.6 | 49% | 0.486 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.7 | -38.7 | 176.2 | -72.6 | 174.6 | 1.2 | 0 | 0 | 112.2 | Q103 Q104 E110 G111 | Q103-Q107 WeakPolarHBondContact O-CG 3.34Å; Q103-Q107 PolarHBondContact O-N 3.01Å; Q104-Q107 PolarHBondContact O-N 2.9Å; Q107-E110 PolarHBondContact O-N 2.76Å; Q107-G111 PolarHBondContact O-N 3.06Å |
| 108 | H | 93.2 | Very high | 92.4 | Very high | 37 Ų | 37 | 58.1 Ų | 58.1 | 17% | 0.171 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -64.5 | -42.6 | 175.9 | -174.3 | 63.9 | 0 | 0 | 0 | 111.5 | Q104 V105 T106 G111 I112 L185 | Q104-H108 WeakPolarHBondContact O-CB 3.41Å; Q104-H108 PolarHBondContact O-N 3.43Å; V105-H108 PolarHBondContact O-N 2.94Å; T106-H108 VanDerWaalsContact C-N 3.31Å; T106-H108 PolarHBondContact O-N 2.85Å; H108-G111 PolarHBondContact O-N 3.43Å; H108-I112 WeakPolarHBondContact O-CG1 3.43Å; H108-I112 PolarHBondContact O-N 2.82Å; H108-I112 VanDerWaalsContact O-N 3.1Å; H108-L185 HydrophobicContact CB-CD1 3.75Å |
| 109 | Q | 93.1 | Very high | 92.1 | Very high | 48 Ų | 48 | 62.2 Ų | 62.2 | 22% | 0.224 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -61.1 | -47.2 | 174.4 | -175 | -175.7 | -22.5 | 0 | 0 | 112 | V71 V105 T106 G111 I112 I113 | V71-Q109 HydrophobicContact CG1-CB 3.83Å; V71-Q109 HydrophobicContact CG1-CG 4.4Å; V105-Q109 PolarHBondContact O-N 3.4Å; T106-Q109 WeakPolarHBondContact O-CB 3.2Å; T106-Q109 PolarHBondContact O-N 3.4Å; Q109-G111 VanDerWaalsContact C-N 3.3Å; Q109-G111 PolarHBondContact O-N 2.74Å; Q109-I112 PolarHBondContact O-N 3.32Å; Q109-I113 HydrophobicContact CG-CD1 3.96Å; Q109-I113 WeakPolarHBondContact O-CG1 3.43Å; Q109-I113 PolarHBondContact O-N 3.19Å |
| 110 | E | 93.3 | Very high | 91.7 | Very high | 109 Ų | 109 | 65.6 Ų | 65.6 | 51% | 0.509 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -59.8 | -41.6 | 177.1 | -73.6 | 172.9 | 179 | 0 | 0 | 111.4 | T106 Q107 I112 I113 D114 | T106-E110 WeakPolarHBondContact O-CG 3.38Å; T106-E110 PolarHBondContact O-N 3.25Å; Q107-E110 PolarHBondContact O-N 2.76Å; E110-I112 VanDerWaalsContact C-N 3.34Å; E110-I112 PolarHBondContact O-N 3.28Å; E110-I113 PolarHBondContact O-N 3.03Å; E110-D114 WeakPolarHBondContact O-CB 3.36Å; E110-D114 PolarHBondContact O-N 2.94Å |
| 111 | G | 92.4 | Very high | 91.2 | Very high | 47 Ų | 47 | 68 Ų | 68 | 49% | 0.485 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -60.3 | -39.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q107 H108 Q109 G115 | Q107-G111 PolarHBondContact O-N 3.06Å; H108-G111 PolarHBondContact O-N 3.43Å; Q109-G111 VanDerWaalsContact C-N 3.3Å; Q109-G111 PolarHBondContact O-N 2.74Å; G111-G115 PolarHBondContact O-N 3.19Å |
| 112 | I | 91.3 | Very high | 90.4 | Very high | 15 Ų | 15 | 73.6 Ų | 73.6 | 8% | 0.077 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -66.5 | -47.6 | 175 | -67 | 165.6 | 0 | 0 | 0 | 110.5 | Q67 T68 V71 H108 Q109 E110 D114 G115 I116 | Q67-I112 HydrophobicContact CB-CG2 4.06Å; T68-I112 HydrophobicContact CG2-CG2 3.82Å; V71-I112 HydrophobicContact CG2-CD1 3.72Å; H108-I112 WeakPolarHBondContact O-CG1 3.43Å; H108-I112 PolarHBondContact O-N 2.82Å; H108-I112 VanDerWaalsContact O-N 3.1Å; Q109-I112 PolarHBondContact O-N 3.32Å; E110-I112 VanDerWaalsContact C-N 3.34Å; E110-I112 PolarHBondContact O-N 3.28Å; I112-D114 VanDerWaalsContact C-N 3.32Å; I112-D114 PolarHBondContact O-N 3.15Å; I112-G115 PolarHBondContact O-N 3.42Å; I112-G115 VanDerWaalsContact O-N 3.16Å; I112-I116 HydrophobicContact CG2-CD1 3.95Å; I112-I116 WeakPolarHBondContact O-CG1 3.48Å; I112-I116 PolarHBondContact O-N 2.99Å |
| 113 | I | 91.7 | Very high | 89.2 | Confident | 71 Ų | 71 | 76.5 Ų | 76.5 | 36% | 0.364 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -61.1 | -42.5 | -180 | -68 | 168.7 | 0 | 0 | 0 | 111 | Q109 E110 G115 I116 R117 | Q109-I113 HydrophobicContact CG-CD1 3.96Å; Q109-I113 WeakPolarHBondContact O-CG1 3.43Å; Q109-I113 PolarHBondContact O-N 3.19Å; E110-I113 PolarHBondContact O-N 3.03Å; I113-G115 VanDerWaalsContact C-N 3.34Å; I113-I116 PolarHBondContact O-N 3.44Å; I113-R117 WeakPolarHBondContact O-CB 3.2Å; I113-R117 PolarHBondContact O-N 2.89Å |
| 114 | D | 92.5 | Very high | 87.7 | Confident | 66 Ų | 66 | 76 Ų | 76 | 35% | 0.353 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -70 | -32.5 | 177.4 | -77.9 | -11.7 | 0 | 0 | 0 | 112.4 | E110 I112 R117 K118 | E110-D114 WeakPolarHBondContact O-CB 3.36Å; E110-D114 PolarHBondContact O-N 2.94Å; I112-D114 VanDerWaalsContact C-N 3.32Å; I112-D114 PolarHBondContact O-N 3.15Å; D114-R117 PolarHBondContact O-N 3.44Å; D114-R117 IonicContact OD1-CZ 3.49Å; D114-R117 IonicContact OD1-NE 3.4Å; D114-R117 PolarHBondContact OD1-NE 3.38Å; D114-R117 IonicContact OD1-NH2 2.84Å; D114-R117 PolarHBondContact OD1-NH2 2.92Å; D114-K118 VanDerWaalsContact O-CG 3.28Å; D114-K118 WeakPolarHBondContact O-CG 3.39Å; D114-K118 PolarHBondContact O-N 3.47Å |
| 115 | G | 89.6 | Confident | 86.1 | Confident | 33 Ų | 33 | 79 Ų | 79 | 34% | 0.34 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -58.3 | -51.4 | 168.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | G111 I112 I113 R117 K118 T119 | G111-G115 PolarHBondContact O-N 3.19Å; I112-G115 PolarHBondContact O-N 3.42Å; I112-G115 VanDerWaalsContact O-N 3.16Å; I113-G115 VanDerWaalsContact C-N 3.34Å; G115-R117 VanDerWaalsContact C-N 3.34Å; G115-R117 PolarHBondContact O-N 3.26Å; G115-K118 PolarHBondContact O-N 3.02Å; G115-T119 PolarHBondContact O-N 2.92Å; G115-T119 VanDerWaalsContact O-N 3.15Å; G115-T119 PolarHBondContact O-OG1 2.93Å |
| 116 | I | 89.1 | Confident | 84.6 | Confident | 51 Ų | 51 | 81.4 Ų | 81.4 | 26% | 0.262 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -58.3 | -45.9 | 177 | -65.9 | 165 | 0 | 0 | 0 | 110.7 | T68 I112 I113 K118 T119 L120 | T68-I116 HydrophobicContact CG2-CD1 4.21Å; I112-I116 HydrophobicContact CG2-CD1 3.95Å; I112-I116 WeakPolarHBondContact O-CG1 3.48Å; I112-I116 PolarHBondContact O-N 2.99Å; I113-I116 PolarHBondContact O-N 3.44Å; I116-K118 PolarHBondContact O-N 3.45Å; I116-T119 PolarHBondContact O-N 3.43Å; I116-L120 HydrophobicContact CG2-CD1 4.12Å; I116-L120 WeakPolarHBondContact O-CG 3.28Å; I116-L120 PolarHBondContact O-N 3.11Å |
| 117 | R | 89.1 | Confident | 82.8 | Confident | 127 Ų | 127 | 85.8 Ų | 85.8 | 48% | 0.479 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -58.9 | -46 | 178.7 | -168.5 | -164.5 | -43.7 | -133.9 | 5.3 | 112.2 | I113 D114 G115 T119 L120 E121 | I113-R117 WeakPolarHBondContact O-CB 3.2Å; I113-R117 PolarHBondContact O-N 2.89Å; D114-R117 PolarHBondContact O-N 3.44Å; D114-R117 IonicContact OD1-CZ 3.49Å; D114-R117 IonicContact OD1-NE 3.4Å; D114-R117 PolarHBondContact OD1-NE 3.38Å; D114-R117 IonicContact OD1-NH2 2.84Å; D114-R117 PolarHBondContact OD1-NH2 2.92Å; G115-R117 VanDerWaalsContact C-N 3.34Å; G115-R117 PolarHBondContact O-N 3.26Å; R117-T119 VanDerWaalsContact C-N 3.29Å; R117-T119 PolarHBondContact O-N 2.86Å; R117-L120 WeakPolarHBondContact O-CB 3.49Å; R117-L120 PolarHBondContact O-N 3.04Å; R117-L120 VanDerWaalsContact O-N 3.11Å; R117-E121 WeakPolarHBondContact O-CG 3.4Å; R117-E121 PolarHBondContact O-N 3.39Å |
| 118 | K | 89 | Confident | 81 | Confident | 136 Ų | 136 | 85 Ų | 85 | 59% | 0.591 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -62.3 | -37.4 | 179.4 | -75 | 171.3 | -177.6 | 175.6 | 0 | 112.3 | D114 G115 I116 L120 E121 N122 | D114-K118 VanDerWaalsContact O-CG 3.28Å; D114-K118 WeakPolarHBondContact O-CG 3.39Å; D114-K118 PolarHBondContact O-N 3.47Å; G115-K118 PolarHBondContact O-N 3.02Å; I116-K118 PolarHBondContact O-N 3.45Å; K118-L120 VanDerWaalsContact C-N 3.34Å; K118-E121 PolarHBondContact O-N 3Å; K118-N122 PolarHBondContact O-N 2.84Å; K118-N122 VanDerWaalsContact O-N 3.11Å; K118-N122 PolarHBondContact O-ND2 3.4Å |
| 119 | T | 85.9 | Confident | 79.2 | Confident | 89 Ų | 89 | 87.6 Ų | 87.6 | 55% | 0.546 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.3 | -34.6 | 174.7 | -57.1 | 0 | 0 | 0 | 0 | 112 | G115 I116 R117 N122 | G115-T119 PolarHBondContact O-N 2.92Å; G115-T119 VanDerWaalsContact O-N 3.15Å; G115-T119 PolarHBondContact O-OG1 2.93Å; I116-T119 PolarHBondContact O-N 3.43Å; R117-T119 VanDerWaalsContact C-N 3.29Å; R117-T119 PolarHBondContact O-N 2.86Å; T119-N122 CarbonylContact O-C 3.34Å |
| 120 | L | 82.8 | Confident | 77.5 | Confident | 134 Ų | 134 | 90.1 Ų | 90.1 | 70% | 0.702 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -73 | -37 | 174.9 | -68.9 | 171.1 | 0 | 0 | 0 | 112.9 | I116 R117 K118 N122 | I116-L120 HydrophobicContact CG2-CD1 4.12Å; I116-L120 WeakPolarHBondContact O-CG 3.28Å; I116-L120 PolarHBondContact O-N 3.11Å; R117-L120 WeakPolarHBondContact O-CB 3.49Å; R117-L120 PolarHBondContact O-N 3.04Å; R117-L120 VanDerWaalsContact O-N 3.11Å; K118-L120 VanDerWaalsContact C-N 3.34Å; L120-N122 VanDerWaalsContact C-N 3.34Å |
| 121 | E | 83.2 | Confident | 75.6 | Confident | 130 Ų | 130 | 88 Ų | 88 | 61% | 0.607 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -71.2 | -29.3 | 178 | -74.5 | 173.7 | -178.2 | 0 | 0 | 112.7 | R117 K118 | R117-E121 WeakPolarHBondContact O-CG 3.4Å; R117-E121 PolarHBondContact O-N 3.39Å; K118-E121 PolarHBondContact O-N 3Å |
| 122 | N | 76.3 | Confident | 73.8 | Confident | 121 Ų | 121 | 92.7 Ų | 92.7 | 65% | 0.647 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -126.3 | 73.8 | 177.1 | -58.7 | -85.6 | 0 | 0 | 0 | 109.3 | K118 T119 L120 | K118-N122 PolarHBondContact O-N 2.84Å; K118-N122 VanDerWaalsContact O-N 3.11Å; K118-N122 PolarHBondContact O-ND2 3.4Å; T119-N122 CarbonylContact O-C 3.34Å; L120-N122 VanDerWaalsContact C-N 3.34Å |
| 123 | P | 68.7 | Low | 71.9 | Confident | 84 Ų | 84 | 96.1 Ų | 96.1 | 55% | 0.545 | 55% | 0.546 | S | S | . | . | P | Polyproline II helix | trans | -62.1 | 141.6 | -179.6 | 26.4 | -32.9 | 0 | 0 | 0 | 109.7 | ||
| 124 | P | 64.6 | Low | 70.1 | Confident | 95 Ų | 95 | 99 Ų | 99 | 62% | 0.617 | 56% | 0.559 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 144.6 | 168.5 | 23.8 | -30.5 | 0 | 0 | 0 | 109.1 | S126 | P124-S126 PolarHBondContact O-N 3.26Š|
| 125 | P | 59.6 | Low | 68.3 | Low | 127 Ų | 127 | 103.4 Ų | 103.4 | 83% | 0.825 | 58% | 0.577 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 118.7 | -174 | 21.8 | -32.9 | 0 | 0 | 0 | 109.7 | ||
| 126 | S | 62.8 | Low | 66.4 | Low | 50 Ų | 50 | 108.9 Ų | 108.9 | 35% | 0.35 | 60% | 0.599 | S | S | . | * | P | Polyproline II helix | trans | -95 | 159.5 | -175.6 | 81.9 | 0 | 0 | 0 | 0 | 110.2 | P124 S128 D129 | P124-S126 PolarHBondContact O-N 3.26Å; S126-S128 PolarHBondContact O-N 3.11Å; S126-S128 WeakPolarHBondContact OG-CB 3.49Å; S126-S128 PolarHBondContact OG-N 3.18Å; S126-D129 WeakPolarHBondContact CB-OD2 3.37Å; S126-D129 PolarHBondContact N-OD2 3.49Å; S126-D129 WeakPolarHBondContact O-CB 3.49Å; S126-D129 PolarHBondContact O-N 3.49Å; S126-D129 VanDerWaalsContact O-N 3.1Å; S126-D129 PolarHBondContact OG-OD2 2.84Å |
| 127 | V | 56.5 | Low | 64.8 | Low | 127 Ų | 127 | 112.1 Ų | 112.1 | 77% | 0.77 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -64.1 | -21.9 | 176.7 | -165.3 | 0 | 0 | 0 | 0 | 111.4 | D129 V130 S131 | V127-D129 VanDerWaalsContact C-N 3.35Å; V127-V130 PolarHBondContact O-N 2.99Å; V127-S131 PolarHBondContact O-N 3.38Å |
| 128 | S | 55.7 | Low | 62.8 | Low | 88 Ų | 88 | 114.6 Ų | 114.6 | 62% | 0.615 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -66.9 | -36 | 174.5 | -160.5 | 0 | 0 | 0 | 0 | 112.1 | S126 V130 S131 E132 | S126-S128 PolarHBondContact O-N 3.11Å; S126-S128 WeakPolarHBondContact OG-CB 3.49Å; S126-S128 PolarHBondContact OG-N 3.18Å; S128-V130 PolarHBondContact O-N 3.29Å; S128-S131 WeakPolarHBondContact O-CB 3.42Å; S128-S131 PolarHBondContact O-N 2.91Å; S128-E132 PolarHBondContact O-N 3.37Å |
| 129 | D | 55.8 | Low | 60.9 | Low | 92 Ų | 92 | 114.4 Ų | 114.4 | 49% | 0.492 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -67 | -21.7 | 177.2 | -54.1 | -52.2 | 0 | 0 | 0 | 111.7 | S126 V127 | S126-D129 WeakPolarHBondContact CB-OD2 3.37Å; S126-D129 PolarHBondContact N-OD2 3.49Å; S126-D129 WeakPolarHBondContact O-CB 3.49Å; S126-D129 PolarHBondContact O-N 3.49Å; S126-D129 VanDerWaalsContact O-N 3.1Å; S126-D129 PolarHBondContact OG-OD2 2.84Å; V127-D129 VanDerWaalsContact C-N 3.35Å |
| 130 | V | 57 | Low | 58.8 | Low | 100 Ų | 100 | 118.5 Ų | 118.5 | 61% | 0.606 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -84.7 | -27.7 | 173.5 | -172.6 | 0 | 0 | 0 | 0 | 111.4 | V127 S128 S133 | V127-V130 PolarHBondContact O-N 2.99Å; S128-V130 PolarHBondContact O-N 3.29Å; V130-S133 WeakPolarHBondContact O-CB 3.43Å; V130-S133 PolarHBondContact O-N 2.95Å |
| 131 | S | 54.9 | Low | 56.8 | Low | 64 Ų | 64 | 118.2 Ų | 118.2 | 45% | 0.448 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -70.1 | -34.8 | 179.4 | -167.6 | 0 | 0 | 0 | 0 | 112.5 | V127 S128 S133 M134 | V127-S131 PolarHBondContact O-N 3.38Å; S128-S131 WeakPolarHBondContact O-CB 3.42Å; S128-S131 PolarHBondContact O-N 2.91Å; S131-S133 PolarHBondContact O-N 3.02Å; S131-M134 WeakPolarHBondContact O-CB 3.29Å; S131-M134 PolarHBondContact O-N 3.27Å |
| 132 | E | 53.3 | Low | 54.7 | Low | 146 Ų | 146 | 116.6 Ų | 116.6 | 68% | 0.682 | 67% | 0.668 | S | S | * | * | G | 310 helix | trans | -62.2 | -26.9 | 174.7 | -142.4 | 177.8 | -157.4 | 0 | 0 | 111.3 | S128 M134 | S128-E132 PolarHBondContact O-N 3.37Å; E132-M134 VanDerWaalsContact C-N 3.32Å; E132-M134 PolarHBondContact O-N 3.43Å |
| 133 | S | 51.6 | Low | 52.8 | Low | 88 Ų | 88 | 113.9 Ų | 113.9 | 62% | 0.615 | 67% | 0.669 | S | S | * | * | G | 310 helix | trans | -77.8 | -11.2 | 172.7 | -177 | 0 | 0 | 0 | 0 | 114 | V130 S131 | V130-S133 WeakPolarHBondContact O-CB 3.43Å; V130-S133 PolarHBondContact O-N 2.95Å; S131-S133 PolarHBondContact O-N 3.02Å |
| 134 | M | 53.3 | Low | 51.1 | Low | 130 Ų | 130 | 116.4 Ų | 116.4 | 64% | 0.64 | 69% | 0.687 | S | S | * | * | G | 310 helix | trans | -93.2 | -12.6 | -179.6 | -154 | 167.5 | 79.7 | 0 | 0 | 112.6 | S131 E132 D136 L137 | S131-M134 WeakPolarHBondContact O-CB 3.29Å; S131-M134 PolarHBondContact O-N 3.27Å; E132-M134 VanDerWaalsContact C-N 3.32Å; E132-M134 PolarHBondContact O-N 3.43Å; M134-D136 PolarHBondContact O-N 2.92Å; M134-L137 HydrophobicContact CG-CD1 4.22Å; M134-L137 PolarHBondContact O-N 3.25Å |
| 135 | E | 54.8 | Low | 49.9 | Very low | 159 Ų | 159 | 120.3 Ų | 120.3 | 74% | 0.743 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.2 | -15 | 175.7 | -64.8 | 178.4 | 167.1 | 0 | 0 | 113 | ||
| 136 | D | 51.5 | Low | 49.2 | Very low | 148 Ų | 148 | 123.2 Ų | 123.2 | 79% | 0.791 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.1 | -1.1 | 177.2 | -154.3 | 31.1 | 0 | 0 | 0 | 113.5 | M134 E138 | M134-D136 PolarHBondContact O-N 2.92Å; D136-E138 PolarHBondContact O-N 3.47Å |
| 137 | L | 54.1 | Low | 47.9 | Very low | 120 Ų | 120 | 127.4 Ų | 127.4 | 63% | 0.628 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -89 | 91 | 167.8 | -80 | 159.2 | 0 | 0 | 0 | 108 | M134 V139 | M134-L137 HydrophobicContact CG-CD1 4.22Å; M134-L137 PolarHBondContact O-N 3.25Å; L137-V139 WeakPolarHBondContact O-CG2 3.4Å; L137-V139 PolarHBondContact O-N 2.81Å |
| 138 | E | 46.7 | Very low | 47.2 | Very low | 179 Ų | 179 | 129 Ų | 129 | 84% | 0.836 | 73% | 0.727 | S | S | * | * | trans | -56 | 86.1 | 167.1 | -73.2 | -175.4 | 163.9 | 0 | 0 | 110.1 | D136 K140 | D136-E138 PolarHBondContact O-N 3.47Å; E138-K140 VanDerWaalsContact C-N 3.3Å; E138-K140 PolarHBondContact O-N 3.33Å | ||
| 139 | V | 50.9 | Low | 46.2 | Very low | 132 Ų | 132 | 134.6 Ų | 134.6 | 80% | 0.8 | 74% | 0.741 | S | S | * | * | trans | -73.4 | 94.1 | 170.1 | -159.1 | 0 | 0 | 0 | 0 | 106.1 | L137 | L137-V139 WeakPolarHBondContact O-CG2 3.4Å; L137-V139 PolarHBondContact O-N 2.81Å | ||
| 140 | K | 41.7 | Very low | 45.2 | Very low | 175 Ų | 175 | 136.7 Ų | 136.7 | 76% | 0.761 | 76% | 0.761 | S | S | * | * | trans | -48.9 | 127.9 | 166.6 | -81.1 | 177.2 | 175.8 | 170.1 | 0 | 107.5 | E138 A142 | E138-K140 VanDerWaalsContact C-N 3.3Å; E138-K140 PolarHBondContact O-N 3.33Å; K140-A142 VanDerWaalsContact C-N 3.27Å; K140-A142 PolarHBondContact O-N 2.99Å | ||
| 141 | P | 40 | Very low | 44.2 | Very low | 128 Ų | 128 | 143.1 Ų | 143.1 | 83% | 0.831 | 78% | 0.775 | S | S | * | * | trans | -64 | 99.3 | 168.3 | 26.3 | -30.4 | 0 | 0 | 0 | 106.2 | G143 | P141-G143 PolarHBondContact O-N 3.32Š| ||
| 142 | A | 39.8 | Very low | 43.2 | Very low | 96 Ų | 96 | 144.9 Ų | 144.9 | 79% | 0.793 | 79% | 0.787 | S | S | * | * | trans | -61.5 | 109 | 163.8 | 0 | 0 | 0 | 0 | 0 | 105 | K140 C144 | K140-A142 VanDerWaalsContact C-N 3.27Å; K140-A142 PolarHBondContact O-N 2.99Å; A142-C144 PolarHBondContact O-N 2.96Å; A142-C144 VanDerWaalsContact O-N 3.13Å | ||
| 143 | G | 35.8 | Very low | 42.3 | Very low | 63 Ų | 63 | 146.3 Ų | 146.3 | 65% | 0.649 | 79% | 0.793 | S | S | * | * | trans | -48.1 | 123.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | P141 E145 | P141-G143 PolarHBondContact O-N 3.32Å; G143-E145 PolarHBondContact O-N 2.84Å | ||
| 144 | C | 33.1 | Very low | 41.5 | Very low | 137 Ų | 137 | 150.7 Ų | 150.7 | 93% | 0.926 | 80% | 0.804 | S | S | * | * | trans | -72.8 | 82.3 | 167.7 | -158.9 | 0 | 0 | 0 | 0 | 105.9 | A142 | A142-C144 PolarHBondContact O-N 2.96Å; A142-C144 VanDerWaalsContact O-N 3.13Å | ||
| 145 | E | 39.4 | Very low | 40.4 | Very low | 178 Ų | 178 | 153.6 Ų | 153.6 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | trans | -79.4 | 129.5 | 160.1 | -70.1 | -161 | 161.2 | 0 | 0 | 107.6 | G143 T147 | G143-E145 PolarHBondContact O-N 2.84Å; E145-T147 PolarHBondContact O-N 3.05Å | ||
| 146 | E | 44.5 | Very low | 39.6 | Very low | 188 Ų | 188 | 154.9 Ų | 154.9 | 88% | 0.879 | 82% | 0.821 | S | S | * | * | trans | -41 | 118 | -178.9 | -69.7 | 173 | 126.7 | 0 | 0 | 111.8 | ||||
| 147 | T | 34.9 | Very low | 38.4 | Very low | 138 Ų | 138 | 155 Ų | 155 | 85% | 0.847 | 82% | 0.822 | S | S | * | * | trans | -159.2 | 130.7 | 141.9 | 15.9 | 0 | 0 | 0 | 0 | 109.9 | E145 F149 | E145-T147 PolarHBondContact O-N 3.05Å; T147-F149 PolarHBondContact O-N 3.26Å | ||
| 148 | D | 41.8 | Very low | 37.7 | Very low | 160 Ų | 160 | 157 Ų | 157 | 86% | 0.856 | 83% | 0.833 | S | S | * | * | trans | -39.7 | 111.1 | -176.7 | -69.7 | -61.7 | 0 | 0 | 0 | 115.5 | ||||
| 149 | F | 35.4 | Very low | 37 | Very low | 205 Ų | 205 | 158.1 Ų | 158.1 | 90% | 0.899 | 84% | 0.838 | S | S | * | * | trans | -154.5 | 64.3 | 154.9 | -133.8 | -86.1 | 0 | 0 | 0 | 112.9 | T147 | T147-F149 PolarHBondContact O-N 3.26Š| ||
| 150 | C | 34 | Very low | 35.9 | Very low | 136 Ų | 136 | 155.2 Ų | 155.2 | 92% | 0.919 | 84% | 0.835 | S | S | * | * | trans | -163.9 | 69.3 | 153.3 | -97.2 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 151 | R | 36.8 | Very low | 35.8 | Very low | 236 Ų | 236 | 151.9 Ų | 151.9 | 89% | 0.891 | 83% | 0.834 | S | S | * | * | trans | -119.6 | 95.8 | 162.2 | -149.9 | -178.6 | -159.7 | -166.3 | 6.5 | 109.3 | ||||
| 152 | S | 33.1 | Very low | 35.5 | Very low | 101 Ų | 101 | 154.3 Ų | 154.3 | 71% | 0.706 | 83% | 0.833 | S | S | * | * | trans | -150.8 | 88.1 | 160.4 | 169.5 | 0 | 0 | 0 | 0 | 107.7 | Q154 | S152-Q154 PolarHBondContact O-N 3.22Š| ||
| 153 | E | 35.3 | Very low | 35.1 | Very low | 175 Ų | 175 | 155 Ų | 155 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | trans | -63 | 121.6 | 159.1 | -67.4 | 177.4 | 109.9 | 0 | 0 | 108.4 | ||||
| 154 | Q | 33.9 | Very low | 35.4 | Very low | 181 Ų | 181 | 160.5 Ų | 160.5 | 85% | 0.846 | 84% | 0.837 | S | S | * | * | trans | -149.5 | 105.2 | 155.2 | -111.4 | 169 | 59.7 | 0 | 0 | 110.5 | S152 | S152-Q154 PolarHBondContact O-N 3.22Š| ||
| 155 | K | 30.5 | Very low | 35.5 | Very low | 190 Ų | 190 | 162.3 Ų | 162.3 | 83% | 0.826 | 83% | 0.832 | S | S | * | * | trans | 18.3 | 128.2 | 151 | -85 | 178.2 | 164.8 | -172.3 | 0 | 119.7 | ||||
| 156 | M | 38.8 | Very low | 35.3 | Very low | 186 Ų | 186 | 160.6 Ų | 160.6 | 92% | 0.916 | 83% | 0.828 | S | S | * | * | trans | -58.5 | 132.5 | 147.7 | -73.3 | 176.6 | 178.4 | 0 | 0 | 110.5 | ||||
| 157 | D | 26.8 | Very low | 34.8 | Very low | 151 Ų | 151 | 159.2 Ų | 159.2 | 81% | 0.807 | 83% | 0.826 | S | S | * | * | trans | -145.3 | 138 | 145.6 | -93 | -44.1 | 0 | 0 | 0 | 109.8 | ||||
| 158 | L | 39.3 | Very low | 34.6 | Very low | 163 Ų | 163 | 161.2 Ų | 161.2 | 85% | 0.853 | 82% | 0.818 | S | S | * | * | trans | -68.5 | 152.7 | 176.1 | -101.6 | 80.3 | 0 | 0 | 0 | 111.8 | ||||
| 159 | Q | 31.2 | Very low | 33.9 | Very low | 201 Ų | 201 | 159.4 Ų | 159.4 | 94% | 0.939 | 82% | 0.817 | S | S | * | * | trans | 87.4 | 112.5 | 148.6 | -156.3 | 163.9 | 14.5 | 0 | 0 | 118.3 | ||||
| 160 | G | 28.3 | Very low | 33.9 | Very low | 72 Ų | 72 | 156.6 Ų | 156.6 | 74% | 0.742 | 81% | 0.806 | S | S | * | * | trans | 172.4 | 89.9 | 167.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 161 | S | 38.9 | Very low | 34.4 | Very low | 105 Ų | 105 | 154.4 Ų | 154.4 | 73% | 0.734 | 79% | 0.792 | S | S | * | * | trans | -44.7 | 131.8 | 168.5 | 48.9 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 162 | H | 34.2 | Very low | 34.5 | Very low | 178 Ų | 178 | 146.9 Ų | 146.9 | 82% | 0.824 | 79% | 0.788 | S | S | * | * | trans | -167.3 | 99 | 146.4 | -91.9 | -62.9 | 0 | 0 | 0 | 107.7 | ||||
| 163 | T | 30.6 | Very low | 34.3 | Very low | 110 Ų | 110 | 147 Ų | 147 | 68% | 0.675 | 79% | 0.788 | S | S | * | * | 111 | 114.3 | 85.9 | -68.4 | 0 | 0 | 0 | 0 | 107.4 | Q165 | T163-Q165 PolarHBondContact O-N 3.1Š| |||
| 164 | Q | 43.4 | Very low | 34.4 | Very low | 180 Ų | 180 | 142.9 Ų | 142.9 | 84% | 0.841 | 78% | 0.784 | S | S | * | * | trans | -35.4 | 116.4 | 170.1 | -69.7 | 159.6 | -51.9 | 0 | 0 | 111.9 | ||||
| 165 | Q | 34.3 | Very low | 34.7 | Very low | 175 Ų | 175 | 139 Ų | 139 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -111 | 88.9 | 150.9 | -64.6 | -165.2 | 0.1 | 0 | 0 | 106.5 | T163 L167 | T163-Q165 PolarHBondContact O-N 3.1Å; Q165-L167 PolarHBondContact O-N 3.2Å | ||
| 166 | N | 35.8 | Very low | 35.3 | Very low | 142 Ų | 142 | 135.5 Ų | 135.5 | 76% | 0.759 | 78% | 0.782 | S | S | * | * | trans | -59.7 | 84.1 | 167.8 | -160.3 | -4.6 | 0 | 0 | 0 | 107.2 | R168 | N166-R168 PolarHBondContact O-N 2.82Š| ||
| 167 | L | 34.3 | Very low | 35.6 | Very low | 159 Ų | 159 | 129.9 Ų | 129.9 | 83% | 0.832 | 77% | 0.772 | S | S | * | * | trans | -74.7 | 75.5 | 165.1 | -81.9 | 159.8 | 0 | 0 | 0 | 106.8 | Q165 C169 | Q165-L167 PolarHBondContact O-N 3.2Å; L167-C169 PolarHBondContact O-N 3.03Å | ||
| 168 | R | 29.8 | Very low | 36.8 | Very low | 179 Ų | 179 | 125.2 Ų | 125.2 | 68% | 0.675 | 75% | 0.751 | S | S | * | * | trans | -60.7 | 101.7 | 163.9 | -164.5 | -176.3 | -161.1 | -164.9 | 11 | 105.4 | N166 E170 | N166-R168 PolarHBondContact O-N 2.82Å; R168-E170 HydrophobicContact CG-CG 3.95Å; R168-E170 IonicContact CZ-OE1 3.56Å; R168-E170 IonicContact NE-OE1 3.79Å; R168-E170 IonicContact NH1-OE1 2.79Å; R168-E170 PolarHBondContact NH1-OE1 2.87Å; R168-E170 PolarHBondContact O-N 3.34Å | ||
| 169 | C | 26.8 | Very low | 37.4 | Very low | 122 Ų | 122 | 121.3 Ų | 121.3 | 82% | 0.824 | 74% | 0.742 | S | S | * | * | trans | -63 | 89.3 | 160.6 | -86.6 | 0 | 0 | 0 | 0 | 107 | L167 S171 | L167-C169 PolarHBondContact O-N 3.03Å; C169-S171 PolarHBondContact O-N 3.49Å | ||
| 170 | E | 36.3 | Very low | 38.8 | Very low | 147 Ų | 147 | 114.5 Ų | 114.5 | 69% | 0.687 | 73% | 0.726 | S | S | * | * | trans | -73.5 | 59.9 | 158.6 | -67 | -170.7 | 160.8 | 0 | 0 | 108.2 | R168 G172 | R168-E170 HydrophobicContact CG-CG 3.95Å; R168-E170 IonicContact CZ-OE1 3.56Å; R168-E170 IonicContact NE-OE1 3.79Å; R168-E170 IonicContact NH1-OE1 2.79Å; R168-E170 PolarHBondContact NH1-OE1 2.87Å; R168-E170 PolarHBondContact O-N 3.34Å; E170-G172 PolarHBondContact O-N 3.02Å | ||
| 171 | S | 43.9 | Very low | 41.5 | Very low | 89 Ų | 89 | 112.1 Ų | 112.1 | 62% | 0.622 | 70% | 0.701 | S | S | * | * | trans | -87.4 | 92.3 | 155.6 | -173.8 | 0 | 0 | 0 | 0 | 105.4 | C169 C173 | C169-S171 PolarHBondContact O-N 3.49Å; S171-C173 PolarHBondContact O-N 3.21Å | ||
| 172 | G | 38.9 | Very low | 43.9 | Very low | 78 Ų | 78 | 108.3 Ų | 108.3 | 80% | 0.804 | 67% | 0.673 | S | S | * | * | trans | -63.1 | 74.4 | 165.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | E170 A174 | E170-G172 PolarHBondContact O-N 3.02Å; G172-A174 PolarHBondContact O-N 3.43Å | ||
| 173 | C | 29.7 | Very low | 46.6 | Very low | 104 Ų | 104 | 102.7 Ų | 102.7 | 70% | 0.703 | 65% | 0.649 | S | S | * | * | trans | -71.9 | 95.3 | 155.4 | -64 | 0 | 0 | 0 | 0 | 104.6 | S171 A175 | S171-C173 PolarHBondContact O-N 3.21Å; C173-A175 PolarHBondContact O-N 2.86Å | ||
| 174 | A | 36 | Very low | 49.5 | Very low | 88 Ų | 88 | 102 Ų | 102 | 73% | 0.727 | 64% | 0.64 | S | S | * | * | trans | -58 | 90.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | G172 S176 | G172-A174 PolarHBondContact O-N 3.43Å; A174-S176 PolarHBondContact O-N 2.97Å | ||
| 175 | A | 41.6 | Very low | 51.9 | Low | 100 Ų | 100 | 94 Ų | 94 | 83% | 0.826 | 60% | 0.603 | S | S | * | * | trans | -69.4 | 58.3 | 154.4 | 0 | 0 | 0 | 0 | 0 | 107.9 | C173 G177 | C173-A175 PolarHBondContact O-N 2.86Å; A175-G177 PolarHBondContact O-N 3.46Å; A175-G177 VanDerWaalsContact O-N 3.1Å | ||
| 176 | S | 43.3 | Very low | 54.8 | Low | 117 Ų | 117 | 85.6 Ų | 85.6 | 82% | 0.818 | 56% | 0.564 | S | S | * | * | trans | -79.3 | 92.3 | 175.6 | -156.3 | 0 | 0 | 0 | 0 | 106.4 | A174 | A174-S176 PolarHBondContact O-N 2.97Š| ||
| 177 | G | 44.1 | Very low | 57.6 | Low | 67 Ų | 67 | 82.6 Ų | 82.6 | 69% | 0.691 | 55% | 0.545 | S | S | * | . | S | Bend | trans | 159.7 | -15.7 | 162.7 | 0 | 0 | 0 | 0 | 0 | 120.4 | A175 | A175-G177 PolarHBondContact O-N 3.46Å; A175-G177 VanDerWaalsContact O-N 3.1Å |
| 178 | S | 52.3 | Low | 60.4 | Low | 54 Ų | 54 | 80 Ų | 80 | 38% | 0.378 | 53% | 0.525 | S | S | . | . | S | Bend | trans | -97.5 | -38.6 | -168.5 | -159.5 | 0 | 0 | 0 | 0 | 115.6 | G180 G181 L182 | S178-G180 VanDerWaalsContact C-N 3.31Å; S178-G180 PolarHBondContact O-N 3.47Å; S178-G181 PolarHBondContact O-N 3.3Å; S178-L182 PolarHBondContact O-N 3.41Å |
| 179 | A | 52 | Low | 63.5 | Low | 80 Ų | 80 | 71.8 Ų | 71.8 | 66% | 0.661 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -59.4 | -39.6 | -174 | 0 | 0 | 0 | 0 | 0 | 113.2 | G181 D183 | A179-G181 VanDerWaalsContact C-N 3.3Å; A179-G181 PolarHBondContact O-N 3.35Å; A179-D183 PolarHBondContact O-N 3.47Å |
| 180 | G | 61.5 | Low | 66.7 | Low | 58 Ų | 58 | 66.6 Ų | 66.6 | 60% | 0.598 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -72.3 | -19.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | S178 L184 | S178-G180 VanDerWaalsContact C-N 3.31Å; S178-G180 PolarHBondContact O-N 3.47Å; G180-L184 WeakPolarHBondContact O-CB 3.45Å; G180-L184 PolarHBondContact O-N 3.14Å |
| 181 | G | 83.9 | Confident | 69.4 | Low | 22 Ų | 22 | 63.2 Ų | 63.2 | 23% | 0.227 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -75.8 | -49.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | S178 A179 L184 L185 | S178-G181 PolarHBondContact O-N 3.3Å; A179-G181 VanDerWaalsContact C-N 3.3Å; A179-G181 PolarHBondContact O-N 3.35Å; G181-L184 PolarHBondContact O-N 3.29Å; G181-L185 VanDerWaalsContact O-CG 3.28Å; G181-L185 WeakPolarHBondContact O-CG 3.44Å; G181-L185 PolarHBondContact O-N 2.91Å |
| 182 | L | 89.1 | Confident | 71.7 | Confident | 25 Ų | 25 | 59.8 Ų | 59.8 | 13% | 0.131 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -65.1 | -47.1 | 179.3 | 176.3 | 60.8 | 0 | 0 | 0 | 111.7 | A70 V71 L74 S178 L184 L185 V186 | A70-L182 HydrophobicContact CB-CD2 3.73Å; V71-L182 HydrophobicContact CG2-CD1 4Å; V71-L182 HydrophobicContact CG2-CD2 4.41Å; L74-L182 HydrophobicContact CD2-CD1 3.85Å; S178-L182 PolarHBondContact O-N 3.41Å; L182-L184 VanDerWaalsContact C-N 3.26Å; L182-L184 PolarHBondContact O-N 3.3Å; L182-L185 PolarHBondContact O-N 2.89Å; L182-V186 HydrophobicContact CD1-CG2 3.82Å; L182-V186 HydrophobicContact CG-CG2 4.13Å; L182-V186 WeakPolarHBondContact O-CG2 3.41Å; L182-V186 PolarHBondContact O-N 3.37Å |
| 183 | D | 91.5 | Very high | 74.2 | Confident | 60 Ų | 60 | 56.2 Ų | 56.2 | 32% | 0.321 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -55.7 | -41.6 | 178.8 | -87.1 | -39.7 | 0 | 0 | 0 | 112.1 | A179 V186 Q187 R210 | A179-D183 PolarHBondContact O-N 3.47Å; D183-V186 PolarHBondContact O-N 2.8Å; D183-Q187 WeakPolarHBondContact O-CB 3.49Å; D183-Q187 PolarHBondContact O-N 3.19Å; D183-R210 IonicContact OD1-CZ 2.75Å; D183-R210 IonicContact OD1-NE 3.7Å; D183-R210 PolarHBondContact OD1-NE 3.35Å; D183-R210 IonicContact OD1-NH2 2.96Å |
| 184 | L | 92.3 | Very high | 77.2 | Confident | 96 Ų | 96 | 54.2 Ų | 54.2 | 50% | 0.503 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -64.5 | -42.2 | 176.9 | -174.7 | 78.3 | 0 | 0 | 0 | 111.9 | G180 G181 L182 Q187 R188 | G180-L184 WeakPolarHBondContact O-CB 3.45Å; G180-L184 PolarHBondContact O-N 3.14Å; G181-L184 PolarHBondContact O-N 3.29Å; L182-L184 VanDerWaalsContact C-N 3.26Å; L182-L184 PolarHBondContact O-N 3.3Å; L184-Q187 PolarHBondContact O-N 3.36Å; L184-R188 WeakPolarHBondContact O-CG 3.38Å; L184-R188 PolarHBondContact O-N 3.43Å |
| 185 | L | 93.4 | Very high | 79.8 | Confident | 11 Ų | 11 | 55.6 Ų | 55.6 | 6% | 0.058 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -69 | -39 | 179.4 | -67.1 | 170 | 0 | 0 | 0 | 111.6 | L74 L101 Q104 V105 H108 G181 L182 R188 C189 | L74-L185 HydrophobicContact CD2-CB 3.73Å; L101-L185 HydrophobicContact CD1-CD2 4.06Å; Q104-L185 HydrophobicContact CB-CD2 3.71Å; V105-L185 HydrophobicContact CG2-CB 4.3Å; V105-L185 HydrophobicContact CG2-CD1 4.19Å; V105-L185 HydrophobicContact CG2-CD2 4.18Å; V105-L185 HydrophobicContact CG2-CG 4.46Å; H108-L185 HydrophobicContact CB-CD1 3.75Å; G181-L185 VanDerWaalsContact O-CG 3.28Å; G181-L185 WeakPolarHBondContact O-CG 3.44Å; G181-L185 PolarHBondContact O-N 2.91Å; L182-L185 PolarHBondContact O-N 2.89Å; L185-R188 PolarHBondContact O-N 2.89Å; L185-C189 WeakPolarHBondContact O-CB 3.41Å; L185-C189 PolarHBondContact O-N 2.86Å |
| 186 | V | 94.6 | Very high | 82 | Confident | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -61.9 | -48.4 | 173.8 | 172.2 | 0 | 0 | 0 | 0 | 110.1 | L74 L182 D183 R188 C189 I190 I206 L209 R210 | L74-V186 HydrophobicContact CD1-CG2 4.42Å; L74-V186 HydrophobicContact CD2-CG2 4.03Å; L182-V186 HydrophobicContact CD1-CG2 3.82Å; L182-V186 HydrophobicContact CG-CG2 4.13Å; L182-V186 WeakPolarHBondContact O-CG2 3.41Å; L182-V186 PolarHBondContact O-N 3.37Å; D183-V186 PolarHBondContact O-N 2.8Å; V186-R188 PolarHBondContact O-N 3.43Å; V186-C189 WeakPolarHBondContact O-CB 3.48Å; V186-C189 PolarHBondContact O-N 3.11Å; V186-I190 HydrophobicContact CG1-CD1 4.02Å; V186-I190 WeakPolarHBondContact O-CG1 3.4Å; V186-I190 PolarHBondContact O-N 3Å; V186-I206 HydrophobicContact CG1-CG2 3.85Å; V186-I206 WeakPolarHBondContact CG1-O 3.42Å; V186-L209 HydrophobicContact CG2-CB 4.27Å; V186-R210 HydrophobicContact CB-CG 4.3Å; V186-R210 HydrophobicContact CG1-CG 3.72Å |
| 187 | Q | 94.6 | Very high | 84.2 | Confident | 78 Ų | 78 | 55.8 Ų | 55.8 | 36% | 0.364 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -59 | -45.8 | 178.1 | -171.3 | 61.8 | 49.2 | 0 | 0 | 111.8 | D183 L184 C189 I190 D191 | D183-Q187 WeakPolarHBondContact O-CB 3.49Å; D183-Q187 PolarHBondContact O-N 3.19Å; L184-Q187 PolarHBondContact O-N 3.36Å; Q187-C189 VanDerWaalsContact C-N 3.26Å; Q187-C189 PolarHBondContact O-N 3.42Å; Q187-I190 WeakPolarHBondContact O-CB 3.38Å; Q187-I190 PolarHBondContact O-N 2.95Å; Q187-I190 VanDerWaalsContact O-N 3.14Å; Q187-D191 PolarHBondContact NE2-OD1 3.47Å; Q187-D191 VanDerWaalsContact NE2-OD1 3.07Å; Q187-D191 PolarHBondContact O-N 3.49Å |
| 188 | R | 93.4 | Very high | 86.4 | Confident | 105 Ų | 105 | 53.2 Ų | 53.2 | 40% | 0.396 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60.6 | -35.7 | 175.5 | -76.4 | -176.1 | -179.1 | -172.1 | -1.9 | 112.9 | L101 Q104 L184 L185 V186 L192 | L101-R188 HydrophobicContact CD1-CB 4.02Å; Q104-R188 VanDerWaalsContact NE2-NH1 3.19Å; L184-R188 WeakPolarHBondContact O-CG 3.38Å; L184-R188 PolarHBondContact O-N 3.43Å; L185-R188 PolarHBondContact O-N 2.89Å; V186-R188 PolarHBondContact O-N 3.43Å; R188-L192 WeakPolarHBondContact O-CB 3.26Å; R188-L192 WeakPolarHBondContact O-CG 3.44Å; R188-L192 PolarHBondContact O-N 2.91Å |
| 189 | C | 93.8 | Very high | 88.3 | Confident | 6 Ų | 6 | 54.5 Ų | 54.5 | 4% | 0.041 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -67.8 | -38.7 | 176.4 | -167.5 | 0 | 0 | 0 | 0 | 111.8 | L74 L101 L185 V186 Q187 A193 I206 | L74-C189 HydrophobicContact CD1-CB 3.87Å; L101-C189 HydrophobicContact CD2-CB 3.87Å; L185-C189 WeakPolarHBondContact O-CB 3.41Å; L185-C189 PolarHBondContact O-N 2.86Å; V186-C189 WeakPolarHBondContact O-CB 3.48Å; V186-C189 PolarHBondContact O-N 3.11Å; Q187-C189 VanDerWaalsContact C-N 3.26Å; Q187-C189 PolarHBondContact O-N 3.42Å; C189-A193 VanDerWaalsContact O-CB 3.3Å; C189-A193 WeakPolarHBondContact O-CB 3.38Å; C189-A193 PolarHBondContact O-N 3.25Å; C189-I206 HydrophobicContact CB-CG2 4.16Å |
| 190 | I | 93.9 | Very high | 90.2 | Very high | 14 Ų | 14 | 57.5 Ų | 57.5 | 7% | 0.072 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -64.8 | -46 | 175.5 | -68 | 169.4 | 0 | 0 | 0 | 110.8 | V186 Q187 L192 A193 S194 I203 I206 E207 | V186-I190 HydrophobicContact CG1-CD1 4.02Å; V186-I190 WeakPolarHBondContact O-CG1 3.4Å; V186-I190 PolarHBondContact O-N 3Å; Q187-I190 WeakPolarHBondContact O-CB 3.38Å; Q187-I190 PolarHBondContact O-N 2.95Å; Q187-I190 VanDerWaalsContact O-N 3.14Å; I190-L192 VanDerWaalsContact C-N 3.32Å; I190-L192 PolarHBondContact O-N 2.88Å; I190-A193 PolarHBondContact O-N 2.95Å; I190-S194 WeakPolarHBondContact O-CB 3.17Å; I190-S194 PolarHBondContact O-N 3.5Å; I190-S194 PolarHBondContact O-OG 3.25Å; I190-I203 HydrophobicContact CG2-CG2 3.95Å; I190-I206 HydrophobicContact CD1-CG2 4.24Å; I190-I206 HydrophobicContact CG1-CB 4.24Å; I190-I206 HydrophobicContact CG1-CG2 3.61Å; I190-E207 HydrophobicContact CD1-CB 4.32Å; I190-E207 HydrophobicContact CD1-CG 4.17Å |
| 191 | D | 93.5 | Very high | 91.7 | Very high | 76 Ų | 76 | 62 Ų | 62 | 41% | 0.406 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.1 | -45.2 | 178.9 | -61.2 | -18.9 | 0 | 0 | 0 | 110.2 | Q187 S194 E195 | Q187-D191 PolarHBondContact NE2-OD1 3.47Å; Q187-D191 VanDerWaalsContact NE2-OD1 3.07Å; Q187-D191 PolarHBondContact O-N 3.49Å; D191-S194 WeakPolarHBondContact O-CB 3.42Å; D191-S194 PolarHBondContact O-N 3.27Å; D191-E195 WeakPolarHBondContact O-CG 3.33Å; D191-E195 PolarHBondContact O-N 2.93Å |
| 192 | L | 92.6 | Very high | 92 | Very high | 17 Ų | 17 | 63.2 Ų | 63.2 | 9% | 0.089 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -66 | -40.2 | 175.9 | -80.6 | 170.9 | 0 | 0 | 0 | 113.3 | R97 L101 R188 I190 S194 E195 L196 | R97-L192 HydrophobicContact CB-CD1 4.42Å; R97-L192 HydrophobicContact CB-CD2 3.84Å; L101-L192 HydrophobicContact CB-CD1 4.11Å; L101-L192 HydrophobicContact CD2-CD1 3.65Å; L101-L192 HydrophobicContact CG-CD1 4.48Å; R188-L192 WeakPolarHBondContact O-CB 3.26Å; R188-L192 WeakPolarHBondContact O-CG 3.44Å; R188-L192 PolarHBondContact O-N 2.91Å; I190-L192 VanDerWaalsContact C-N 3.32Å; I190-L192 PolarHBondContact O-N 2.88Å; L192-S194 PolarHBondContact O-N 3.27Å; L192-E195 PolarHBondContact O-N 3.26Å; L192-L196 WeakPolarHBondContact O-CB 3.39Å; L192-L196 VanDerWaalsContact O-CG 3.3Å; L192-L196 WeakPolarHBondContact O-CG 3.24Å; L192-L196 PolarHBondContact O-N 2.95Å |
| 193 | A | 91.9 | Very high | 92.2 | Very high | 3 Ų | 3 | 62.7 Ų | 62.7 | 3% | 0.025 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -62.7 | -35.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | C189 I190 E197 L198 I203 I206 | C189-A193 VanDerWaalsContact O-CB 3.3Å; C189-A193 WeakPolarHBondContact O-CB 3.38Å; C189-A193 PolarHBondContact O-N 3.25Å; I190-A193 PolarHBondContact O-N 2.95Å; A193-E197 PolarHBondContact O-N 3.47Å; A193-L198 HydrophobicContact CB-CB 4.32Å; A193-L198 HydrophobicContact CB-CD1 3.99Å; A193-L198 WeakPolarHBondContact O-CB 3.49Å; A193-L198 PolarHBondContact O-N 3.43Å; A193-I203 HydrophobicContact CB-CD1 4.5Å; A193-I203 HydrophobicContact CB-CG1 3.96Å; A193-I206 HydrophobicContact CB-CD1 4.3Å |
| 194 | S | 91.7 | Very high | 92.2 | Very high | 62 Ų | 62 | 62.5 Ų | 62.5 | 43% | 0.434 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -70.1 | -42.5 | 175 | -54.8 | 0 | 0 | 0 | 0 | 111.9 | I190 D191 L192 L196 E197 | I190-S194 WeakPolarHBondContact O-CB 3.17Å; I190-S194 PolarHBondContact O-N 3.5Å; I190-S194 PolarHBondContact O-OG 3.25Å; D191-S194 WeakPolarHBondContact O-CB 3.42Å; D191-S194 PolarHBondContact O-N 3.27Å; L192-S194 PolarHBondContact O-N 3.27Å; S194-L196 VanDerWaalsContact C-N 3.27Å; S194-L196 PolarHBondContact O-N 3.21Å; S194-E197 PolarHBondContact O-N 3.27Å |
| 195 | E | 90.7 | Very high | 92.2 | Very high | 117 Ų | 117 | 63 Ų | 63 | 55% | 0.547 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62.1 | -33 | 175 | -75 | -179.3 | 179.1 | 0 | 0 | 112.7 | R97 D191 L192 E197 | R97-E195 VanDerWaalsContact NH1-CD 3.28Å; R97-E195 IonicContact NH1-OE1 3.61Å; R97-E195 PolarHBondContact NH1-OE1 3.33Å; R97-E195 IonicContact NH1-OE2 2.93Å; R97-E195 PolarHBondContact NH1-OE2 3.03Å; D191-E195 WeakPolarHBondContact O-CG 3.33Å; D191-E195 PolarHBondContact O-N 2.93Å; L192-E195 PolarHBondContact O-N 3.26Å; E195-E197 VanDerWaalsContact C-N 3.31Å |
| 196 | L | 88.3 | Confident | 92.2 | Very high | 38 Ų | 38 | 62.5 Ų | 62.5 | 20% | 0.199 | 32% | 0.315 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.4 | 5.2 | 178.9 | -66.7 | 175 | 0 | 0 | 0 | 113.7 | V81 Y85 L192 S194 L198 | V81-L196 HydrophobicContact CG1-CD1 3.79Å; Y85-L196 HydrophobicContact CD2-CD2 3.95Å; Y85-L196 HydrophobicContact CE2-CD2 3.98Å; L192-L196 WeakPolarHBondContact O-CB 3.39Å; L192-L196 VanDerWaalsContact O-CG 3.3Å; L192-L196 WeakPolarHBondContact O-CG 3.24Å; L192-L196 PolarHBondContact O-N 2.95Å; S194-L196 VanDerWaalsContact C-N 3.27Å; S194-L196 PolarHBondContact O-N 3.21Å; L196-L198 HydrophobicContact CB-CD1 4.42Å; L196-L198 HydrophobicContact CB-CG 4.04Å; L196-L198 PolarHBondContact O-N 2.92Å |
| 197 | E | 89.9 | Confident | 92.1 | Very high | 182 Ų | 182 | 67.3 Ų | 67.3 | 85% | 0.85 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.9 | 37.3 | -178.7 | -58.3 | -177.3 | 172 | 0 | 0 | 113.3 | A193 S194 E195 | A193-E197 PolarHBondContact O-N 3.47Å; S194-E197 PolarHBondContact O-N 3.27Å; E195-E197 VanDerWaalsContact C-N 3.31Å |
| 198 | L | 90.4 | Very high | 92 | Very high | 13 Ų | 13 | 68.4 Ų | 68.4 | 7% | 0.068 | 34% | 0.342 | C | S | . | . | trans | -71.8 | 157.6 | 178.6 | -67.1 | 177.9 | 0 | 0 | 0 | 112 | V81 W84 A193 L196 L202 | V81-L198 HydrophobicContact CB-CD1 4.47Å; V81-L198 HydrophobicContact CG1-CD1 3.88Å; V81-L198 HydrophobicContact CG2-CD1 3.73Å; W84-L198 HydrophobicContact CD2-CD2 4.17Å; W84-L198 HydrophobicContact CE3-CD2 3.88Å; W84-L198 HydrophobicContact CH2-CD2 3.63Å; W84-L198 HydrophobicContact CZ2-CD2 3.91Å; W84-L198 HydrophobicContact CZ3-CD2 3.61Å; A193-L198 HydrophobicContact CB-CB 4.32Å; A193-L198 HydrophobicContact CB-CD1 3.99Å; A193-L198 WeakPolarHBondContact O-CB 3.49Å; A193-L198 PolarHBondContact O-N 3.43Å; L196-L198 HydrophobicContact CB-CD1 4.42Å; L196-L198 HydrophobicContact CB-CG 4.04Å; L196-L198 PolarHBondContact O-N 2.92Å; L198-L202 HydrophobicContact CB-CD2 4.14Å; L198-L202 HydrophobicContact CD1-CD2 3.71Å; L198-L202 HydrophobicContact CG-CD2 4.43Å | ||
| 199 | P | 92.3 | Very high | 91.9 | Very high | 81 Ų | 81 | 63.5 Ų | 63.5 | 53% | 0.526 | 32% | 0.324 | S | S | . | . | trans | -55.9 | 140.2 | -179.5 | -25.2 | 34.2 | 0 | 0 | 0 | 113.1 | E201 L202 I203 | P199-E201 PolarHBondContact O-N 3.2Å; P199-L202 WeakPolarHBondContact O-CB 3.45Å; P199-L202 PolarHBondContact O-N 2.91Å; P199-I203 PolarHBondContact O-N 3.08Å | ||
| 200 | Q | 90.8 | Very high | 91.7 | Very high | 143 Ų | 143 | 68.5 Ų | 68.5 | 67% | 0.668 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -61 | -28.5 | 179 | -67.8 | -62.3 | -47 | 0 | 0 | 113.1 | L202 I203 S204 | Q200-L202 VanDerWaalsContact C-N 3.27Å; Q200-L202 PolarHBondContact O-N 2.85Å; Q200-I203 PolarHBondContact O-N 2.89Å; Q200-S204 PolarHBondContact O-N 3.04Å |
| 201 | E | 92.5 | Very high | 91.2 | Very high | 154 Ų | 154 | 75 Ų | 75 | 72% | 0.72 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -58.4 | -40.2 | 172.8 | -65.3 | 168.8 | -175.7 | 0 | 0 | 111.7 | P199 S204 H205 | P199-E201 PolarHBondContact O-N 3.2Å; E201-S204 PolarHBondContact O-N 2.88Å; E201-H205 PolarHBondContact O-CD2 2.79Å; E201-H205 VanDerWaalsContact O-CD2 3.3Å; E201-H205 PolarHBondContact O-N 3.26Å |
| 202 | L | 91.4 | Very high | 90.4 | Very high | 46 Ų | 46 | 76.9 Ų | 76.9 | 24% | 0.241 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -67.9 | -39.6 | 177.6 | -178.4 | 63.3 | 0 | 0 | 0 | 111.3 | I77 V81 L198 P199 Q200 H205 I206 | I77-L202 HydrophobicContact CG2-CD1 4.03Å; V81-L202 HydrophobicContact CG2-CD2 4.18Å; L198-L202 HydrophobicContact CB-CD2 4.14Å; L198-L202 HydrophobicContact CD1-CD2 3.71Å; L198-L202 HydrophobicContact CG-CD2 4.43Å; P199-L202 WeakPolarHBondContact O-CB 3.45Å; P199-L202 PolarHBondContact O-N 2.91Å; Q200-L202 VanDerWaalsContact C-N 3.27Å; Q200-L202 PolarHBondContact O-N 2.85Å; L202-H205 PolarHBondContact O-N 2.86Å; L202-I206 HydrophobicContact CD1-CD1 4.48Å; L202-I206 HydrophobicContact CG-CD1 4.03Å; L202-I206 WeakPolarHBondContact O-CD1 3.42Å; L202-I206 VanDerWaalsContact O-CG1 3.26Å; L202-I206 WeakPolarHBondContact O-CG1 3.41Å; L202-I206 PolarHBondContact O-N 3.13Å |
| 203 | I | 92.4 | Very high | 90.3 | Very high | 14 Ų | 14 | 79.9 Ų | 79.9 | 7% | 0.072 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -62.9 | -45.1 | 177.1 | -65.4 | 170.8 | 0 | 0 | 0 | 110.1 | I190 A193 P199 Q200 H205 I206 E207 | I190-I203 HydrophobicContact CG2-CG2 3.95Å; A193-I203 HydrophobicContact CB-CD1 4.5Å; A193-I203 HydrophobicContact CB-CG1 3.96Å; P199-I203 PolarHBondContact O-N 3.08Å; Q200-I203 PolarHBondContact O-N 2.89Å; I203-H205 VanDerWaalsContact C-N 3.33Å; I203-H205 PolarHBondContact O-N 2.99Å; I203-I206 PolarHBondContact O-N 3.27Å; I203-I206 VanDerWaalsContact O-N 3.16Å; I203-E207 PolarHBondContact O-N 2.92Å |
| 204 | S | 91.7 | Very high | 90.2 | Very high | 57 Ų | 57 | 83.9 Ų | 83.9 | 40% | 0.399 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -57.2 | -45.1 | 174.2 | -172.5 | 0 | 0 | 0 | 0 | 111.9 | Q200 E201 I206 E207 E208 | Q200-S204 PolarHBondContact O-N 3.04Å; E201-S204 PolarHBondContact O-N 2.88Å; S204-I206 VanDerWaalsContact C-N 3.32Å; S204-I206 PolarHBondContact O-N 3.31Å; S204-E207 WeakPolarHBondContact O-CB 3.39Å; S204-E207 PolarHBondContact O-N 3.49Å; S204-E208 WeakPolarHBondContact O-CG 3.23Å; S204-E208 PolarHBondContact O-N 3.21Å |
| 205 | H | 92.2 | Very high | 90.1 | Very high | 107 Ų | 107 | 85.1 Ų | 85.1 | 50% | 0.495 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -65.3 | -33.2 | 178.1 | -73.1 | -168.2 | 0 | 0 | 0 | 113.2 | E201 L202 I203 E207 | E201-H205 PolarHBondContact O-CD2 2.79Å; E201-H205 VanDerWaalsContact O-CD2 3.3Å; E201-H205 PolarHBondContact O-N 3.26Å; L202-H205 PolarHBondContact O-N 2.86Å; I203-H205 VanDerWaalsContact C-N 3.33Å; I203-H205 PolarHBondContact O-N 2.99Å; H205-E207 VanDerWaalsContact C-N 3.35Å |
| 206 | I | 93.2 | Very high | 90.1 | Very high | 0 Ų | 0 | 83.2 Ų | 83.2 | 0% | 0 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -69.1 | -38.5 | 174.4 | -67.6 | 161 | 0 | 0 | 0 | 110 | I77 V186 C189 I190 A193 L202 I203 S204 L209 | I77-I206 HydrophobicContact CD1-CG1 3.98Å; I77-I206 HydrophobicContact CG2-CD1 3.96Å; I77-I206 HydrophobicContact CG2-CG1 3.88Å; V186-I206 HydrophobicContact CG1-CG2 3.85Å; V186-I206 WeakPolarHBondContact CG1-O 3.42Å; C189-I206 HydrophobicContact CB-CG2 4.16Å; I190-I206 HydrophobicContact CD1-CG2 4.24Å; I190-I206 HydrophobicContact CG1-CB 4.24Å; I190-I206 HydrophobicContact CG1-CG2 3.61Å; A193-I206 HydrophobicContact CB-CD1 4.3Å; L202-I206 HydrophobicContact CD1-CD1 4.48Å; L202-I206 HydrophobicContact CG-CD1 4.03Å; L202-I206 WeakPolarHBondContact O-CD1 3.42Å; L202-I206 VanDerWaalsContact O-CG1 3.26Å; L202-I206 WeakPolarHBondContact O-CG1 3.41Å; L202-I206 PolarHBondContact O-N 3.13Å; I203-I206 PolarHBondContact O-N 3.27Å; I203-I206 VanDerWaalsContact O-N 3.16Å; S204-I206 VanDerWaalsContact C-N 3.32Å; S204-I206 PolarHBondContact O-N 3.31Å; I206-L209 VanDerWaalsContact O-CB 3.29Å; I206-L209 WeakPolarHBondContact O-CB 3.08Å; I206-L209 WeakPolarHBondContact O-CG 3.36Å; I206-L209 PolarHBondContact O-N 3.5Å |
| 207 | E | 93.1 | Very high | 90.2 | Very high | 100 Ų | 100 | 86.1 Ų | 86.1 | 47% | 0.467 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -67.9 | -34.3 | -179.2 | -149 | 168.9 | -157 | 0 | 0 | 112.4 | I190 I203 S204 H205 L209 R210 | I190-E207 HydrophobicContact CD1-CB 4.32Å; I190-E207 HydrophobicContact CD1-CG 4.17Å; I203-E207 PolarHBondContact O-N 2.92Å; S204-E207 WeakPolarHBondContact O-CB 3.39Å; S204-E207 PolarHBondContact O-N 3.49Å; H205-E207 VanDerWaalsContact C-N 3.35Å; E207-L209 PolarHBondContact O-N 2.71Å; E207-R210 WeakPolarHBondContact O-CB 3.4Å; E207-R210 PolarHBondContact O-N 3.33Å |
| 208 | E | 92.7 | Very high | 90.3 | Very high | 101 Ų | 101 | 79.7 Ų | 79.7 | 47% | 0.472 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -57 | -27.9 | 173.1 | -75.5 | 173.8 | -161.8 | 0 | 0 | 113.3 | S204 R210 N211 | S204-E208 WeakPolarHBondContact O-CG 3.23Å; S204-E208 PolarHBondContact O-N 3.21Å; E208-R210 PolarHBondContact O-N 3.3Å; E208-R210 VanDerWaalsContact O-N 3.14Å; E208-N211 PolarHBondContact O-N 2.96Å; E208-N211 VanDerWaalsContact O-N 3.08Å |
| 209 | L | 91.1 | Very high | 90.2 | Very high | 3 Ų | 3 | 84.4 Ų | 84.4 | 2% | 0.016 | 42% | 0.419 | C | S | . | . | G | 310 helix | trans | -64 | -18.4 | -179.8 | -58.7 | 179.6 | 0 | 0 | 0 | 113.6 | R73 L74 I77 V186 I206 E207 N211 M212 | R73-L209 HydrophobicContact CB-CD1 4.43Å; R73-L209 HydrophobicContact CB-CD2 3.64Å; R73-L209 HydrophobicContact CG-CD2 4.36Å; L74-L209 HydrophobicContact CB-CD1 3.86Å; L74-L209 HydrophobicContact CD1-CD1 4.1Å; I77-L209 HydrophobicContact CD1-CD1 4.01Å; V186-L209 HydrophobicContact CG2-CB 4.27Å; I206-L209 VanDerWaalsContact O-CB 3.29Å; I206-L209 WeakPolarHBondContact O-CB 3.08Å; I206-L209 WeakPolarHBondContact O-CG 3.36Å; I206-L209 PolarHBondContact O-N 3.5Å; E207-L209 PolarHBondContact O-N 2.71Å; L209-N211 VanDerWaalsContact C-N 3.28Å; L209-M212 HydrophobicContact CD2-SD 3.77Å |
| 210 | R | 88.7 | Confident | 90.1 | Very high | 111 Ų | 111 | 84.7 Ų | 84.7 | 42% | 0.419 | 41% | 0.411 | S | S | . | . | G | 310 helix | trans | -73.8 | -22.2 | 176.7 | -59 | -177.9 | 65.9 | -170.7 | -4.6 | 113 | D183 V186 E207 E208 | D183-R210 IonicContact OD1-CZ 2.75Å; D183-R210 IonicContact OD1-NE 3.7Å; D183-R210 PolarHBondContact OD1-NE 3.35Å; D183-R210 IonicContact OD1-NH2 2.96Å; V186-R210 HydrophobicContact CB-CG 4.3Å; V186-R210 HydrophobicContact CG1-CG 3.72Å; E207-R210 WeakPolarHBondContact O-CB 3.4Å; E207-R210 PolarHBondContact O-N 3.33Å; E208-R210 PolarHBondContact O-N 3.3Å; E208-R210 VanDerWaalsContact O-N 3.14Å |
| 211 | N | 83.6 | Confident | 90 | Very high | 150 Ų | 150 | 79.8 Ų | 79.8 | 80% | 0.802 | 39% | 0.389 | S | S | * | . | G | 310 helix | trans | -103.8 | 6.7 | -175 | -60.6 | -46.6 | 0 | 0 | 0 | 112.8 | E208 L209 | E208-N211 PolarHBondContact O-N 2.96Å; E208-N211 VanDerWaalsContact O-N 3.08Å; L209-N211 VanDerWaalsContact C-N 3.28Å |
| 212 | M | 77.8 | Confident | 89.8 | Confident | 115 Ų | 115 | 73.1 Ų | 73.1 | 57% | 0.567 | 36% | 0.359 | S | S | * | . | trans | -90.7 | 0 | 177.7 | -67.3 | -169.1 | 72.5 | 0 | 0 | 111.4 | V69 A70 R73 L209 | V69-M212 HydrophobicContact CG1-CE 3.51Å; A70-M212 HydrophobicContact CB-CB 4.12Å; R73-M212 PolarHBondContact NH1-SD 3.17Å; R73-M212 VanDerWaalsContact NH1-SD 3.36Å; L209-M212 HydrophobicContact CD2-SD 3.77Å |
Retrieved 212 of 212 residues in 451.3 ms
(Link to these results)