| 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 | 55.8 | Low | 79.6 | Confident | 225 Ų | 225 | 120.3 Ų | 120.3 | 100% | 1.108 | 63% | 0.625 | S | S | * | * | 0 | 24.3 | 0 | -72.4 | 178.1 | 160.1 | 0 | 0 | 110.3 | |||||
| 2 | S | 66.8 | Low | 80.6 | Confident | 88 Ų | 88 | 119.8 Ų | 119.8 | 62% | 0.615 | 62% | 0.617 | S | S | * | * | trans | -96 | -23.1 | -169.4 | 37.8 | 0 | 0 | 0 | 0 | 114.4 | A4 E5 E6 | S2-A4 VanDerWaalsContact C-N 3.31Å; S2-A4 PolarHBondContact O-N 3.24Å; S2-E5 PolarHBondContact O-N 2.83Å; S2-E6 WeakPolarHBondContact O-CB 3.48Å; S2-E6 PolarHBondContact O-N 3.22Å; S2-E6 VanDerWaalsContact O-N 3.1Å | ||
| 3 | D | 81.6 | Confident | 81.2 | Confident | 124 Ų | 124 | 121.5 Ų | 121.5 | 66% | 0.663 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -68.4 | -27.5 | -174.4 | -153.4 | 3.1 | 0 | 0 | 0 | 113.2 | V7 | D3-V7 VanDerWaalsContact O-CG2 3.28Å; D3-V7 WeakPolarHBondContact O-CG2 3.37Å |
| 4 | A | 80.1 | Confident | 81.7 | Confident | 73 Ų | 73 | 119.5 Ų | 119.5 | 60% | 0.603 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -87.2 | -25.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | S2 V8 | S2-A4 VanDerWaalsContact C-N 3.31Å; S2-A4 PolarHBondContact O-N 3.24Å; A4-V8 WeakPolarHBondContact O-CG2 3.5Å; A4-V8 PolarHBondContact O-N 3.17Å |
| 5 | E | 78.9 | Confident | 82.4 | Confident | 142 Ų | 142 | 119.4 Ų | 119.4 | 66% | 0.664 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -78.7 | -38 | 174.9 | -70 | -174.5 | 156 | 0 | 0 | 110.2 | S2 V7 V8 E9 | S2-E5 PolarHBondContact O-N 2.83Å; E5-V7 VanDerWaalsContact C-N 3.35Å; E5-V7 PolarHBondContact O-N 3.03Å; E5-V8 PolarHBondContact O-N 3.15Å; E5-V8 VanDerWaalsContact O-N 3.13Å; E5-E9 PolarHBondContact O-N 3.4Å |
| 6 | E | 80.1 | Confident | 82.8 | Confident | 131 Ų | 131 | 120.7 Ų | 120.7 | 61% | 0.612 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -58.9 | -42.2 | 174.5 | -176.3 | 174.9 | 175.1 | 0 | 0 | 112.5 | S2 V8 E9 E10 | S2-E6 WeakPolarHBondContact O-CB 3.48Å; S2-E6 PolarHBondContact O-N 3.22Å; S2-E6 VanDerWaalsContact O-N 3.1Å; E6-V8 VanDerWaalsContact C-N 3.34Å; E6-V8 PolarHBondContact O-N 3.06Å; E6-E9 PolarHBondContact O-N 3.41Å; E6-E10 PolarHBondContact O-N 2.97Å; E6-E10 VanDerWaalsContact O-N 3.08Å |
| 7 | V | 83.8 | Confident | 83.1 | Confident | 64 Ų | 64 | 121.8 Ų | 121.8 | 39% | 0.388 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -68.7 | -31.7 | 176.7 | 173.2 | 0 | 0 | 0 | 0 | 112 | D3 E5 Y11 | D3-V7 VanDerWaalsContact O-CG2 3.28Å; D3-V7 WeakPolarHBondContact O-CG2 3.37Å; E5-V7 VanDerWaalsContact C-N 3.35Å; E5-V7 PolarHBondContact O-N 3.03Å; V7-Y11 HydrophobicContact CG1-CD2 3.99Å; V7-Y11 HydrophobicContact CG1-CE2 3.79Å; V7-Y11 WeakPolarHBondContact O-CD2 3.42Å; V7-Y11 PolarHBondContact O-N 3.39Å |
| 8 | V | 88.4 | Confident | 83.4 | Confident | 78 Ų | 78 | 122.3 Ų | 122.3 | 47% | 0.473 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -73.5 | -40.3 | 178 | 172.6 | 0 | 0 | 0 | 0 | 110.6 | A4 E5 E6 E10 Y11 E12 | A4-V8 WeakPolarHBondContact O-CG2 3.5Å; A4-V8 PolarHBondContact O-N 3.17Å; E5-V8 PolarHBondContact O-N 3.15Å; E5-V8 VanDerWaalsContact O-N 3.13Å; E6-V8 VanDerWaalsContact C-N 3.34Å; E6-V8 PolarHBondContact O-N 3.06Å; V8-E10 VanDerWaalsContact C-N 3.34Å; V8-E10 PolarHBondContact O-N 2.89Å; V8-Y11 PolarHBondContact O-N 3.2Å; V8-E12 HydrophobicContact CG1-CG 4.45Å; V8-E12 WeakPolarHBondContact O-CG 3.4Å; V8-E12 PolarHBondContact O-N 3.36Å |
| 9 | E | 85.7 | Confident | 83.6 | Confident | 137 Ų | 137 | 122.5 Ų | 122.5 | 64% | 0.64 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -61.1 | -41.6 | 174.7 | -71.8 | -177.2 | 172.1 | 0 | 0 | 111.6 | E5 E6 Y11 E12 E13 | E5-E9 PolarHBondContact O-N 3.4Å; E6-E9 PolarHBondContact O-N 3.41Å; E9-Y11 PolarHBondContact O-N 3.18Å; E9-E12 PolarHBondContact O-N 3.34Å; E9-E13 WeakPolarHBondContact O-CB 3.19Å; E9-E13 PolarHBondContact O-N 3.14Å |
| 10 | E | 87.8 | Confident | 83.6 | Confident | 107 Ų | 107 | 123.2 Ų | 123.2 | 50% | 0.5 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -59.1 | -44.1 | 175.3 | -174.3 | -177.5 | -163.7 | 0 | 0 | 112 | E6 V8 E13 E14 | E6-E10 PolarHBondContact O-N 2.97Å; E6-E10 VanDerWaalsContact O-N 3.08Å; V8-E10 VanDerWaalsContact C-N 3.34Å; V8-E10 PolarHBondContact O-N 2.89Å; E10-E13 PolarHBondContact O-N 3.42Å; E10-E14 WeakPolarHBondContact O-CB 3.34Å; E10-E14 WeakPolarHBondContact O-CG 3.44Å; E10-E14 PolarHBondContact O-N 2.94Å |
| 11 | Y | 87.1 | Confident | 83.7 | Confident | 154 Ų | 154 | 119.8 Ų | 119.8 | 60% | 0.604 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -71 | -33.1 | 179.7 | -86.1 | -109.7 | 0 | 0 | 0 | 113.2 | V7 V8 E9 Q15 | V7-Y11 HydrophobicContact CG1-CD2 3.99Å; V7-Y11 HydrophobicContact CG1-CE2 3.79Å; V7-Y11 WeakPolarHBondContact O-CD2 3.42Å; V7-Y11 PolarHBondContact O-N 3.39Å; V8-Y11 PolarHBondContact O-N 3.2Å; E9-Y11 PolarHBondContact O-N 3.18Å; Y11-Q15 VanDerWaalsContact O-CB 3.3Å; Y11-Q15 WeakPolarHBondContact O-CB 3.2Å; Y11-Q15 PolarHBondContact O-N 3.37Å |
| 12 | E | 90.6 | Very high | 84.9 | Confident | 114 Ų | 114 | 113.9 Ų | 113.9 | 53% | 0.533 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -68.4 | -42.8 | 174.3 | -73.8 | -180 | 178 | 0 | 0 | 110.3 | V8 E9 Q15 E16 | V8-E12 HydrophobicContact CG1-CG 4.45Å; V8-E12 WeakPolarHBondContact O-CG 3.4Å; V8-E12 PolarHBondContact O-N 3.36Å; E9-E12 PolarHBondContact O-N 3.34Å; E12-Q15 WeakPolarHBondContact O-CB 3.45Å; E12-Q15 PolarHBondContact O-N 2.97Å; E12-Q15 VanDerWaalsContact O-N 3.17Å; E12-E16 WeakPolarHBondContact O-CG 3.41Å; E12-E16 PolarHBondContact O-N 2.83Å |
| 13 | E | 89.2 | Confident | 85.4 | Confident | 142 Ų | 142 | 116.4 Ų | 116.4 | 66% | 0.664 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -64.1 | -43.6 | 175.7 | -165.7 | 172 | -167.9 | 0 | 0 | 111.7 | E9 E10 Q15 E16 E17 | E9-E13 WeakPolarHBondContact O-CB 3.19Å; E9-E13 PolarHBondContact O-N 3.14Å; E10-E13 PolarHBondContact O-N 3.42Å; E13-Q15 VanDerWaalsContact C-N 3.26Å; E13-Q15 PolarHBondContact O-N 2.99Å; E13-E16 PolarHBondContact O-N 3.45Å; E13-E17 PolarHBondContact O-N 3.28Å |
| 14 | E | 88.2 | Confident | 85 | Confident | 94 Ų | 94 | 117.4 Ų | 117.4 | 44% | 0.439 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -63.2 | -30.3 | 173.3 | -75.7 | -173.5 | 131.1 | 0 | 0 | 112.8 | E10 Q18 | E10-E14 WeakPolarHBondContact O-CB 3.34Å; E10-E14 WeakPolarHBondContact O-CG 3.44Å; E10-E14 PolarHBondContact O-N 2.94Å; E14-Q18 WeakPolarHBondContact O-CG 3.28Å; E14-Q18 PolarHBondContact O-N 2.85Å; E14-Q18 PolarHBondContact O-NE2 2.99Å |
| 15 | Q | 91.3 | Very high | 84.5 | Confident | 118 Ų | 118 | 121.7 Ų | 121.7 | 55% | 0.551 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -74.7 | -42.7 | 176.9 | -173.6 | 172.6 | 103.8 | 0 | 0 | 111.2 | Y11 E12 E13 Q18 E19 | Y11-Q15 VanDerWaalsContact O-CB 3.3Å; Y11-Q15 WeakPolarHBondContact O-CB 3.2Å; Y11-Q15 PolarHBondContact O-N 3.37Å; E12-Q15 WeakPolarHBondContact O-CB 3.45Å; E12-Q15 PolarHBondContact O-N 2.97Å; E12-Q15 VanDerWaalsContact O-N 3.17Å; E13-Q15 VanDerWaalsContact C-N 3.26Å; E13-Q15 PolarHBondContact O-N 2.99Å; Q15-Q18 PolarHBondContact O-N 3.45Å; Q15-E19 WeakPolarHBondContact O-CG 3.33Å; Q15-E19 PolarHBondContact O-N 3.29Å |
| 16 | E | 89 | Confident | 84.2 | Confident | 140 Ų | 140 | 122.3 Ų | 122.3 | 65% | 0.654 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -61.6 | -42.1 | 174.8 | -71.8 | -174.7 | 177.1 | 0 | 0 | 111.5 | E12 E13 Q18 E19 E20 | E12-E16 WeakPolarHBondContact O-CG 3.41Å; E12-E16 PolarHBondContact O-N 2.83Å; E13-E16 PolarHBondContact O-N 3.45Å; E16-Q18 VanDerWaalsContact C-N 3.33Å; E16-Q18 PolarHBondContact O-N 3.49Å; E16-E19 PolarHBondContact O-N 3.13Å; E16-E20 PolarHBondContact O-N 3.48Å |
| 17 | E | 88.3 | Confident | 83.6 | Confident | 139 Ų | 139 | 119.8 Ų | 119.8 | 65% | 0.65 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -65.7 | -35.4 | 178.1 | -154.8 | -177.6 | -158.7 | 0 | 0 | 112 | E13 A21 | E13-E17 PolarHBondContact O-N 3.28Å; E17-A21 WeakPolarHBondContact O-CB 3.07Å; E17-A21 PolarHBondContact O-N 3Å; E17-A21 VanDerWaalsContact O-N 3.09Å |
| 18 | Q | 88.1 | Confident | 82.2 | Confident | 131 Ų | 131 | 119.9 Ų | 119.9 | 61% | 0.612 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -67.9 | -39.4 | 172.6 | -81.2 | 171 | 94.6 | 0 | 0 | 112.6 | E14 Q15 E16 V22 | E14-Q18 WeakPolarHBondContact O-CG 3.28Å; E14-Q18 PolarHBondContact O-N 2.85Å; E14-Q18 PolarHBondContact O-NE2 2.99Å; Q15-Q18 PolarHBondContact O-N 3.45Å; E16-Q18 VanDerWaalsContact C-N 3.33Å; E16-Q18 PolarHBondContact O-N 3.49Å; Q18-V22 VanDerWaalsContact O-CG2 3.32Å; Q18-V22 WeakPolarHBondContact O-CG2 3.43Å; Q18-V22 PolarHBondContact O-N 3.04Å |
| 19 | E | 87.2 | Confident | 80.3 | Confident | 127 Ų | 127 | 119 Ų | 119 | 59% | 0.593 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -66.2 | -42.7 | 176.5 | -73.2 | -174.6 | 177.9 | 0 | 0 | 111.6 | Q15 E16 A21 V22 E23 | Q15-E19 WeakPolarHBondContact O-CG 3.33Å; Q15-E19 PolarHBondContact O-N 3.29Å; E16-E19 PolarHBondContact O-N 3.13Å; E19-A21 PolarHBondContact O-N 3.27Å; E19-V22 PolarHBondContact O-N 3.42Å; E19-E23 PolarHBondContact O-N 3.5Å |
| 20 | E | 84.3 | Confident | 78.6 | Confident | 135 Ų | 135 | 116 Ų | 116 | 63% | 0.631 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -61.5 | -42.6 | 175.6 | -172.4 | 178.9 | -175.2 | 0 | 0 | 111.6 | E16 V22 E23 E24 | E16-E20 PolarHBondContact O-N 3.48Å; E20-V22 VanDerWaalsContact C-N 3.32Å; E20-V22 PolarHBondContact O-N 3.1Å; E20-E23 PolarHBondContact O-N 3.34Å; E20-E24 PolarHBondContact O-N 2.76Å |
| 21 | A | 85.6 | Confident | 76.7 | Confident | 52 Ų | 52 | 119.2 Ų | 119.2 | 43% | 0.43 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -62.7 | -36.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | E17 E19 E25 | E17-A21 WeakPolarHBondContact O-CB 3.07Å; E17-A21 PolarHBondContact O-N 3Å; E17-A21 VanDerWaalsContact O-N 3.09Å; E19-A21 PolarHBondContact O-N 3.27Å; A21-E25 PolarHBondContact O-N 3.01Å; A21-E25 VanDerWaalsContact O-N 3.08Å |
| 22 | V | 81.8 | Confident | 74.8 | Confident | 101 Ų | 101 | 117.5 Ų | 117.5 | 61% | 0.612 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -69.2 | -39.8 | 175.7 | 172.5 | 0 | 0 | 0 | 0 | 111 | Q18 E19 E20 E25 E26 | Q18-V22 VanDerWaalsContact O-CG2 3.32Å; Q18-V22 WeakPolarHBondContact O-CG2 3.43Å; Q18-V22 PolarHBondContact O-N 3.04Å; E19-V22 PolarHBondContact O-N 3.42Å; E20-V22 VanDerWaalsContact C-N 3.32Å; E20-V22 PolarHBondContact O-N 3.1Å; V22-E25 PolarHBondContact O-N 2.93Å; V22-E26 PolarHBondContact O-N 3.46Å |
| 23 | E | 76.9 | Confident | 72.8 | Confident | 141 Ų | 141 | 120.3 Ų | 120.3 | 66% | 0.659 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -67.5 | -37 | 177.4 | -148.4 | -179.8 | -169.5 | 0 | 0 | 111.5 | E19 E20 E26 A27 | E19-E23 PolarHBondContact O-N 3.5Å; E20-E23 PolarHBondContact O-N 3.34Å; E23-E26 PolarHBondContact O-N 3.28Å; E23-A27 VanDerWaalsContact O-CB 3.31Å; E23-A27 WeakPolarHBondContact O-CB 3.48Å; E23-A27 PolarHBondContact O-N 3.41Å |
| 24 | E | 72.4 | Confident | 70.5 | Confident | 146 Ų | 146 | 119.2 Ų | 119.2 | 68% | 0.682 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -67.2 | -40.4 | 174.4 | -163.6 | -175.1 | 175.3 | 0 | 0 | 112.1 | E20 A27 G28 | E20-E24 PolarHBondContact O-N 2.76Å; E24-A27 PolarHBondContact O-N 2.93Å; E24-G28 PolarHBondContact O-N 2.97Å |
| 25 | E | 70.9 | Confident | 68.5 | Low | 163 Ų | 163 | 123.8 Ų | 123.8 | 76% | 0.762 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -66.6 | -37.8 | 173.9 | -74.6 | -127.1 | 145.8 | 0 | 0 | 112.4 | A21 V22 G29 | A21-E25 PolarHBondContact O-N 3.01Å; A21-E25 VanDerWaalsContact O-N 3.08Å; V22-E25 PolarHBondContact O-N 2.93Å; E25-G29 PolarHBondContact O-N 3.42Å |
| 26 | E | 71.5 | Confident | 66.1 | Low | 155 Ų | 155 | 121.5 Ų | 121.5 | 72% | 0.724 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -65.6 | -43.8 | 174.8 | -168.1 | -169.5 | 146.2 | 0 | 0 | 111.2 | V22 E23 | V22-E26 PolarHBondContact O-N 3.46Å; E23-E26 PolarHBondContact O-N 3.28Å |
| 27 | A | 67.9 | Low | 63.8 | Low | 77 Ų | 77 | 123 Ų | 123 | 64% | 0.636 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -70.6 | -34.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | E23 E24 | E23-A27 VanDerWaalsContact O-CB 3.31Å; E23-A27 WeakPolarHBondContact O-CB 3.48Å; E23-A27 PolarHBondContact O-N 3.41Å; E24-A27 PolarHBondContact O-N 2.93Å |
| 28 | G | 53.4 | Low | 61.8 | Low | 66 Ų | 66 | 121.5 Ų | 121.5 | 68% | 0.68 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -80.9 | -21.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | E24 A30 | E24-G28 PolarHBondContact O-N 2.97Å; G28-A30 VanDerWaalsContact C-N 3.34Å |
| 29 | G | 48.2 | Very low | 59.8 | Low | 59 Ų | 59 | 123.4 Ų | 123.4 | 61% | 0.608 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -79.9 | -9.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | E25 E31 | E25-G29 PolarHBondContact O-N 3.42Å; G29-E31 PolarHBondContact O-N 3.39Å |
| 30 | A | 50.3 | Low | 57.2 | Low | 75 Ų | 75 | 123.4 Ų | 123.4 | 62% | 0.62 | 72% | 0.718 | S | S | * | * | trans | -72.8 | 79.1 | 167.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | G28 | G28-A30 VanDerWaalsContact C-N 3.34Š| ||
| 31 | E | 47.9 | Very low | 55.1 | Low | 175 Ų | 175 | 125.9 Ų | 125.9 | 82% | 0.818 | 73% | 0.729 | S | S | * | * | trans | -49.9 | 134.4 | 156.4 | -85 | -159 | 135 | 0 | 0 | 107.4 | G29 E33 | G29-E31 PolarHBondContact O-N 3.39Å; E31-E33 PolarHBondContact O-N 3.01Å | ||
| 32 | P | 46.9 | Very low | 53.2 | Low | 118 Ų | 118 | 132.4 Ų | 132.4 | 77% | 0.766 | 75% | 0.751 | S | S | * | * | trans | -57.5 | 114.9 | 166.6 | 26 | -31.3 | 0 | 0 | 0 | 106.1 | P34 | P32-P34 WeakPolarHBondContact O-CD 2.95Š| ||
| 33 | E | 48.8 | Very low | 51 | Low | 173 Ų | 173 | 131.9 Ų | 131.9 | 81% | 0.808 | 76% | 0.757 | S | S | * | * | trans | -44.2 | 122.5 | 161.3 | -72.5 | -117.3 | 149.8 | 0 | 0 | 105.8 | E31 E35 | E31-E33 PolarHBondContact O-N 3.01Å; E33-E35 PolarHBondContact O-N 3.37Å | ||
| 34 | P | 41.2 | Very low | 49.6 | Very low | 119 Ų | 119 | 132.9 Ų | 132.9 | 77% | 0.773 | 77% | 0.767 | S | S | * | * | trans | -57.5 | 112.7 | 170.4 | 23.5 | -30.3 | 0 | 0 | 0 | 105.2 | P32 G36 | P32-P34 WeakPolarHBondContact O-CD 2.95Å; P34-G36 PolarHBondContact O-N 3.35Å | ||
| 35 | E | 46.3 | Very low | 48.2 | Very low | 189 Ų | 189 | 131.7 Ų | 131.7 | 88% | 0.883 | 77% | 0.769 | S | S | * | * | trans | -51.7 | 93 | 164.3 | -70.9 | -171.7 | 165.5 | 0 | 0 | 105.6 | E33 E37 | E33-E35 PolarHBondContact O-N 3.37Å; E35-E37 VanDerWaalsContact C-N 3.3Å; E35-E37 PolarHBondContact O-N 2.96Å | ||
| 36 | G | 40.5 | Very low | 46.8 | Very low | 70 Ų | 70 | 131.6 Ų | 131.6 | 72% | 0.722 | 77% | 0.769 | S | S | * | * | trans | -63.9 | 99.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 106.3 | P34 A38 | P34-G36 PolarHBondContact O-N 3.35Å; G36-A38 PolarHBondContact O-N 2.79Å | ||
| 37 | E | 42.1 | Very low | 45.3 | Very low | 173 Ų | 173 | 132.5 Ų | 132.5 | 81% | 0.808 | 77% | 0.773 | S | S | * | * | trans | -33.6 | 105.4 | 167.1 | -63.6 | 172.1 | 153.8 | 0 | 0 | 109.2 | E35 E39 | E35-E37 VanDerWaalsContact C-N 3.3Å; E35-E37 PolarHBondContact O-N 2.96Å; E37-E39 PolarHBondContact O-N 2.68Å | ||
| 38 | A | 44.5 | Very low | 43.9 | Very low | 106 Ų | 106 | 134 Ų | 134 | 88% | 0.876 | 77% | 0.774 | S | S | * | * | trans | -72.3 | 63.9 | 162.5 | 0 | 0 | 0 | 0 | 0 | 108.4 | G36 | G36-A38 PolarHBondContact O-N 2.79Š| ||
| 39 | E | 47 | Very low | 43.2 | Very low | 172 Ų | 172 | 132.8 Ų | 132.8 | 80% | 0.804 | 76% | 0.762 | S | S | * | * | trans | -115.2 | 80.8 | 158.8 | -85.3 | -158.2 | 130.6 | 0 | 0 | 107.4 | E37 | E37-E39 PolarHBondContact O-N 2.68Š| ||
| 40 | T | 32.2 | Very low | 42.8 | Very low | 126 Ų | 126 | 135.2 Ų | 135.2 | 77% | 0.773 | 77% | 0.767 | S | S | * | * | trans | -135.6 | 106.5 | 151.5 | 36.1 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 41 | E | 40.1 | Very low | 42.1 | Very low | 187 Ų | 187 | 137.8 Ų | 137.8 | 87% | 0.874 | 77% | 0.77 | S | S | * | * | trans | 83 | 112.7 | 135.4 | -59.4 | -164.4 | 144.2 | 0 | 0 | 118.3 | ||||
| 42 | E | 45.3 | Very low | 41.6 | Very low | 190 Ų | 190 | 138.3 Ų | 138.3 | 89% | 0.888 | 77% | 0.773 | S | S | * | * | trans | -40.2 | 142.6 | 165.1 | -62.7 | -159.8 | 123.1 | 0 | 0 | 112.9 | N44 | E42-N44 PolarHBondContact O-N 2.87Š| ||
| 43 | A | 36.5 | Very low | 41.1 | Very low | 89 Ų | 89 | 139.5 Ų | 139.5 | 74% | 0.736 | 77% | 0.768 | S | S | * | * | trans | -43.1 | 114.1 | 165.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | V45 | A43-V45 PolarHBondContact O-N 3.35Š| ||
| 44 | N | 47.5 | Very low | 40.8 | Very low | 162 Ų | 162 | 135.6 Ų | 135.6 | 87% | 0.866 | 77% | 0.765 | S | S | * | * | trans | -8.1 | 95.7 | 140.5 | -174.6 | -97.8 | 0 | 0 | 0 | 114.3 | E42 | E42-N44 PolarHBondContact O-N 2.87Š| ||
| 45 | V | 42.8 | Very low | 40.5 | Very low | 121 Ų | 121 | 139.2 Ų | 139.2 | 73% | 0.733 | 77% | 0.769 | S | S | * | * | trans | -145.9 | 126.5 | 158.1 | -178.9 | 0 | 0 | 0 | 0 | 109.4 | A43 | A43-V45 PolarHBondContact O-N 3.35Š| ||
| 46 | E | 42.1 | Very low | 40.2 | Very low | 161 Ų | 161 | 138 Ų | 138 | 75% | 0.752 | 77% | 0.768 | S | S | * | * | trans | 74.3 | 76.9 | 167.7 | -103.8 | 174 | 122.4 | 0 | 0 | 118.8 | V48 | E46-V48 VanDerWaalsContact C-N 3.27Å; E46-V48 HydrophobicContact CB-CG2 4.36Å; E46-V48 HydrophobicContact CG-CG2 3.99Å; E46-V48 PolarHBondContact O-N 3.04Å; E46-V48 VanDerWaalsContact O-N 3.07Å | ||
| 47 | E | 40.1 | Very low | 40 | Very low | 174 Ų | 174 | 138.9 Ų | 138.9 | 81% | 0.813 | 77% | 0.769 | S | S | * | * | trans | -65.5 | 90.8 | 141.6 | -174.3 | -102.7 | 146.6 | 0 | 0 | 108.4 | G49 | E47-G49 PolarHBondContact O-N 2.92Å; E47-G49 VanDerWaalsContact OE1-CA 3.22Å; E47-G49 WeakPolarHBondContact OE1-CA 3.44Å; E47-G49 PolarHBondContact OE1-N 3.17Å | ||
| 48 | V | 38.4 | Very low | 39.8 | Very low | 109 Ų | 109 | 138.1 Ų | 138.1 | 66% | 0.661 | 77% | 0.765 | S | S | * | * | trans | -82.8 | 92.9 | 158.2 | 174.7 | 0 | 0 | 0 | 0 | 106.3 | E46 | E46-V48 VanDerWaalsContact C-N 3.27Å; E46-V48 HydrophobicContact CB-CG2 4.36Å; E46-V48 HydrophobicContact CG-CG2 3.99Å; E46-V48 PolarHBondContact O-N 3.04Å; E46-V48 VanDerWaalsContact O-N 3.07Å | ||
| 49 | G | 38.4 | Very low | 39.5 | Very low | 40 Ų | 40 | 141.8 Ų | 141.8 | 41% | 0.412 | 76% | 0.764 | S | S | . | * | trans | -61.4 | 138.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | E47 | E47-G49 PolarHBondContact O-N 2.92Å; E47-G49 VanDerWaalsContact OE1-CA 3.22Å; E47-G49 WeakPolarHBondContact OE1-CA 3.44Å; E47-G49 PolarHBondContact OE1-N 3.17Å | ||
| 50 | P | 39.9 | Very low | 38.7 | Very low | 111 Ų | 111 | 136.6 Ų | 136.6 | 72% | 0.721 | 76% | 0.757 | S | S | * | * | trans | -86.9 | 98.4 | 140.5 | 31 | -19.3 | 0 | 0 | 0 | 106.6 | E52 | P50-E52 PolarHBondContact O-N 3.42Š| ||
| 51 | D | 34.6 | Very low | 39.2 | Very low | 129 Ų | 129 | 136.9 Ų | 136.9 | 69% | 0.69 | 76% | 0.761 | S | S | * | * | trans | -51.5 | 83.8 | 149.9 | -171.6 | -114.6 | 0 | 0 | 0 | 108.2 | E53 | D51-E53 PolarHBondContact O-N 2.95Å; D51-E53 WeakPolarHBondContact OD1-CB 3.45Å | ||
| 52 | E | 38.7 | Very low | 39 | Very low | 186 Ų | 186 | 134.3 Ų | 134.3 | 87% | 0.869 | 76% | 0.758 | S | S | * | * | trans | -79.4 | 60.3 | 160.3 | -76.7 | -92.3 | 144.9 | 0 | 0 | 106.9 | P50 A54 | P50-E52 PolarHBondContact O-N 3.42Å; E52-A54 PolarHBondContact O-N 2.94Å | ||
| 53 | E | 35.7 | Very low | 38.8 | Very low | 143 Ų | 143 | 134.2 Ų | 134.2 | 67% | 0.668 | 76% | 0.758 | S | S | * | * | trans | -60 | 125.2 | 163 | -172.1 | 169.4 | -143.9 | 0 | 0 | 107.3 | D51 K55 | D51-E53 PolarHBondContact O-N 2.95Å; D51-E53 WeakPolarHBondContact OD1-CB 3.45Å; E53-K55 PolarHBondContact O-N 3.44Å | ||
| 54 | A | 43.4 | Very low | 39.4 | Very low | 90 Ų | 90 | 137 Ų | 137 | 74% | 0.744 | 76% | 0.76 | S | S | * | * | trans | -33.5 | 100.5 | 169 | 0 | 0 | 0 | 0 | 0 | 112.4 | E52 D56 | E52-A54 PolarHBondContact O-N 2.94Å; A54-D56 VanDerWaalsContact C-N 3.27Å; A54-D56 PolarHBondContact O-N 3.32Å | ||
| 55 | K | 35.3 | Very low | 39.6 | Very low | 196 Ų | 196 | 136 Ų | 136 | 85% | 0.852 | 76% | 0.76 | S | S | * | * | trans | -91.3 | 73.1 | 159.4 | -69.8 | -173.2 | -178.1 | 173.8 | 0 | 108.8 | E53 A57 | E53-K55 PolarHBondContact O-N 3.44Å; K55-A57 PolarHBondContact O-N 3.08Å | ||
| 56 | D | 39.6 | Very low | 40.2 | Very low | 162 Ų | 162 | 139 Ų | 139 | 87% | 0.866 | 76% | 0.763 | S | S | * | * | trans | -66.4 | 85.5 | 149.3 | -148.4 | -80.5 | 0 | 0 | 0 | 106.2 | A54 | A54-D56 VanDerWaalsContact C-N 3.27Å; A54-D56 PolarHBondContact O-N 3.32Å | ||
| 57 | A | 34.9 | Very low | 40.8 | Very low | 89 Ų | 89 | 137.1 Ų | 137.1 | 74% | 0.736 | 77% | 0.765 | S | S | * | * | trans | -113.5 | 90.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 107.8 | K55 | K55-A57 PolarHBondContact O-N 3.08Š| ||
| 58 | E | 39.8 | Very low | 41.9 | Very low | 157 Ų | 157 | 137.6 Ų | 137.6 | 73% | 0.734 | 76% | 0.764 | S | S | * | * | trans | -36.3 | 143.1 | 155.4 | 178.1 | 172.7 | -172.9 | 0 | 0 | 113.4 | ||||
| 59 | E | 37.9 | Very low | 43 | Very low | 183 Ų | 183 | 138 Ų | 138 | 86% | 0.855 | 77% | 0.769 | S | S | * | * | trans | 78.3 | 114.9 | 161.7 | -79 | -178.4 | 174.7 | 0 | 0 | 121.9 | ||||
| 60 | G | 30.2 | Very low | 43.8 | Very low | 64 Ų | 64 | 140.2 Ų | 140.2 | 66% | 0.66 | 78% | 0.778 | S | S | * | * | trans | 164 | 107.5 | 156.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | V62 | G60-V62 PolarHBondContact O-N 3.47Š| ||
| 61 | P | 42.9 | Very low | 44.8 | Very low | 132 Ų | 132 | 146.1 Ų | 146.1 | 86% | 0.857 | 79% | 0.786 | S | S | * | * | trans | -85.9 | 111.9 | 179.7 | 32.8 | -27.6 | 0 | 0 | 0 | 109.9 | ||||
| 62 | V | 35.6 | Very low | 45.8 | Very low | 132 Ų | 132 | 146.1 Ų | 146.1 | 80% | 0.8 | 79% | 0.786 | S | S | * | * | trans | -137.9 | 106.5 | 166.6 | -75.4 | 0 | 0 | 0 | 0 | 110.9 | G60 | G60-V62 PolarHBondContact O-N 3.47Š| ||
| 63 | E | 41.2 | Very low | 46.7 | Very low | 189 Ų | 189 | 147.3 Ų | 147.3 | 88% | 0.883 | 79% | 0.788 | S | S | * | * | trans | 34.1 | 132.8 | 141.4 | -66.9 | -176 | 137.8 | 0 | 0 | 122 | ||||
| 64 | D | 48.5 | Very low | 48.1 | Very low | 146 Ų | 146 | 147.1 Ų | 147.1 | 78% | 0.781 | 79% | 0.789 | S | S | * | * | trans | -27.1 | 158 | 167.3 | -66.3 | -90 | 0 | 0 | 0 | 121 | ||||
| 65 | T | 50.8 | Low | 49.3 | Very low | 143 Ų | 143 | 147.7 Ų | 147.7 | 88% | 0.877 | 79% | 0.785 | S | S | * | * | trans | 108 | 50.1 | 156.7 | 67.4 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 66 | K | 56.2 | Low | 50.7 | Low | 184 Ų | 184 | 145.8 Ų | 145.8 | 80% | 0.8 | 78% | 0.784 | S | S | * | * | trans | -144.4 | 127.1 | 142.8 | -158.3 | 158.6 | -172.7 | 169.8 | 0 | 109.3 | K68 | K66-K68 PolarHBondContact O-N 2.95Š| ||
| 67 | P | 55.4 | Low | 51.9 | Low | 120 Ų | 120 | 144.6 Ų | 144.6 | 78% | 0.779 | 78% | 0.777 | S | S | * | * | trans | -65.9 | 98.3 | 168.5 | 28.1 | -29.4 | 0 | 0 | 0 | 105.5 | P69 | P67-P69 WeakPolarHBondContact O-CD 3.44Š| ||
| 68 | K | 61.6 | Low | 53.7 | Low | 184 Ų | 184 | 145.6 Ų | 145.6 | 80% | 0.8 | 77% | 0.774 | S | S | * | * | trans | -51.7 | 111 | 159.9 | -67 | 170.4 | -179.2 | 171.5 | 0 | 102.8 | K66 S70 | K66-K68 PolarHBondContact O-N 2.95Å; K68-S70 VanDerWaalsContact C-N 3.34Å; K68-S70 PolarHBondContact O-N 3.38Å | ||
| 69 | P | 62.2 | Low | 55.5 | Low | 118 Ų | 118 | 143 Ų | 143 | 77% | 0.766 | 77% | 0.77 | S | S | * | * | trans | -52.7 | 116.4 | 172.6 | 22.4 | -30.2 | 0 | 0 | 0 | 103 | P67 R71 | P67-P69 WeakPolarHBondContact O-CD 3.44Å; P69-R71 PolarHBondContact O-N 3.07Å; P69-R71 VanDerWaalsContact O-N 3.07Å | ||
| 70 | S | 56.3 | Low | 57.3 | Low | 87 Ų | 87 | 139.9 Ų | 139.9 | 61% | 0.608 | 77% | 0.766 | S | S | * | * | trans | -43.9 | 130.4 | -177.9 | 63.2 | 0 | 0 | 0 | 0 | 104.6 | K68 L72 | K68-S70 VanDerWaalsContact C-N 3.34Å; K68-S70 PolarHBondContact O-N 3.38Å; S70-L72 PolarHBondContact O-N 3.16Å | ||
| 71 | R | 59.9 | Low | 59.6 | Low | 235 Ų | 235 | 146.1 Ų | 146.1 | 89% | 0.887 | 78% | 0.775 | S | S | * | * | trans | -51.3 | 87.3 | 159.4 | -64.8 | 179.5 | -162.9 | 112.3 | -3.1 | 104 | P69 F73 | P69-R71 PolarHBondContact O-N 3.07Å; P69-R71 VanDerWaalsContact O-N 3.07Å; R71-F73 PolarHBondContact O-N 3.28Å | ||
| 72 | L | 55.2 | Low | 61.3 | Low | 129 Ų | 129 | 146.7 Ų | 146.7 | 68% | 0.675 | 77% | 0.769 | S | S | * | * | trans | -47.9 | 120.6 | 160 | -85.9 | 126.3 | 0 | 0 | 0 | 99.7 | S70 M74 | S70-L72 PolarHBondContact O-N 3.16Å; L72-M74 HydrophobicContact CB-CG 4.24Å; L72-M74 PolarHBondContact O-N 3.48Å | ||
| 73 | F | 58.9 | Low | 63.3 | Low | 211 Ų | 211 | 145.7 Ų | 145.7 | 93% | 0.925 | 77% | 0.766 | S | S | * | * | trans | -55.8 | 74.7 | 168.6 | -75.9 | -107 | 0 | 0 | 0 | 106 | R71 P75 | R71-F73 PolarHBondContact O-N 3.28Å; F73-P75 VanDerWaalsContact C-N 3.32Å; F73-P75 WeakPolarHBondContact O-CD 3.43Å | ||
| 74 | M | 64.5 | Low | 64.7 | Low | 139 Ų | 139 | 144.5 Ų | 144.5 | 69% | 0.685 | 77% | 0.765 | S | S | * | * | trans | -73.8 | 101 | 162.2 | -65 | 178 | 92.6 | 0 | 0 | 99.4 | L72 N76 L77 | L72-M74 HydrophobicContact CB-CG 4.24Å; L72-M74 PolarHBondContact O-N 3.48Å; M74-N76 PolarHBondContact O-N 3.15Å; M74-L77 HydrophobicContact CB-CD1 4.49Å | ||
| 75 | P | 67.9 | Low | 65.9 | Low | 102 Ų | 102 | 140.8 Ų | 140.8 | 66% | 0.662 | 76% | 0.762 | S | S | * | * | trans | -49.9 | 125.8 | 173.7 | 23.7 | -32.9 | 0 | 0 | 0 | 105.2 | F73 L77 | F73-P75 VanDerWaalsContact C-N 3.32Å; F73-P75 WeakPolarHBondContact O-CD 3.43Å; P75-L77 VanDerWaalsContact C-N 3.29Å; P75-L77 VanDerWaalsContact O-CD1 3.28Å; P75-L77 WeakPolarHBondContact O-CD1 3.31Å; P75-L77 WeakPolarHBondContact O-CG 3.22Å; P75-L77 PolarHBondContact O-N 3.36Å | ||
| 76 | N | 64.3 | Low | 67.5 | Low | 155 Ų | 155 | 142.3 Ų | 142.3 | 83% | 0.829 | 76% | 0.759 | S | S | * | * | trans | -40.5 | 95.8 | -175.1 | -71.9 | -11 | 0 | 0 | 0 | 109.4 | M74 V78 | M74-N76 PolarHBondContact O-N 3.15Å; N76-V78 HydrophobicContact CB-CG2 4.46Å; N76-V78 PolarHBondContact O-N 2.89Å | ||
| 77 | L | 66 | Low | 68.8 | Low | 137 Ų | 137 | 145 Ų | 145 | 72% | 0.717 | 76% | 0.764 | S | S | * | * | trans | -80.2 | 70.6 | 179.2 | -80.6 | 115.2 | 0 | 0 | 0 | 104.4 | M74 P75 P79 | M74-L77 HydrophobicContact CB-CD1 4.49Å; P75-L77 VanDerWaalsContact C-N 3.29Å; P75-L77 VanDerWaalsContact O-CD1 3.28Å; P75-L77 WeakPolarHBondContact O-CD1 3.31Å; P75-L77 WeakPolarHBondContact O-CG 3.22Å; P75-L77 PolarHBondContact O-N 3.36Å; L77-P79 WeakPolarHBondContact O-CD 3.28Å; L77-P79 VanDerWaalsContact O-N 3.14Å | ||
| 78 | V | 72.6 | Confident | 70.3 | Confident | 111 Ų | 111 | 143.7 Ų | 143.7 | 67% | 0.673 | 75% | 0.753 | S | S | * | * | trans | -60 | 114.4 | 163.3 | 179.1 | 0 | 0 | 0 | 0 | 104.2 | N76 | N76-V78 HydrophobicContact CB-CG2 4.46Å; N76-V78 PolarHBondContact O-N 2.89Å | ||
| 79 | P | 77.4 | Confident | 71.8 | Confident | 101 Ų | 101 | 138.5 Ų | 138.5 | 66% | 0.656 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 131.2 | 175.9 | -24.2 | 34.7 | 0 | 0 | 0 | 107.5 | L77 K81 | L77-P79 WeakPolarHBondContact O-CD 3.28Å; L77-P79 VanDerWaalsContact O-N 3.14Å; P79-K81 PolarHBondContact O-N 3Å; P79-K81 VanDerWaalsContact O-N 3.12Å |
| 80 | P | 76.6 | Confident | 73.3 | Confident | 119 Ų | 119 | 140.5 Ų | 140.5 | 77% | 0.773 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 127.4 | 179.8 | 22.5 | -31.8 | 0 | 0 | 0 | 107.6 | I82 | P80-I82 PolarHBondContact O-N 2.89Š|
| 81 | K | 78.2 | Confident | 75.2 | Confident | 194 Ų | 194 | 142.3 Ų | 142.3 | 84% | 0.843 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 119.9 | 175.3 | -73.3 | 179.8 | 173.9 | 175.1 | 0 | 106.9 | P79 | P79-K81 PolarHBondContact O-N 3Å; P79-K81 VanDerWaalsContact O-N 3.12Å |
| 82 | I | 77.6 | Confident | 76.9 | Confident | 144 Ų | 144 | 133.4 Ų | 133.4 | 74% | 0.738 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 129 | 169.3 | -59.4 | -177.4 | 0 | 0 | 0 | 104.9 | P80 D84 | P80-I82 PolarHBondContact O-N 2.89Å; I82-D84 PolarHBondContact O-N 3.4Å; I82-D84 VanDerWaalsContact O-N 3.15Å |
| 83 | P | 78.5 | Confident | 78.9 | Confident | 111 Ų | 111 | 130.7 Ų | 130.7 | 72% | 0.721 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 126.1 | 175.5 | 22.1 | -31.4 | 0 | 0 | 0 | 107.8 | G85 | P83-G85 VanDerWaalsContact C-N 3.31Å; P83-G85 PolarHBondContact O-N 3.18Å |
| 84 | D | 69.7 | Low | 80.7 | Confident | 164 Ų | 164 | 126 Ų | 126 | 88% | 0.877 | 67% | 0.67 | S | S | * | * | trans | -57.4 | 99.1 | 177.8 | -66.6 | -41.9 | 0 | 0 | 0 | 106.9 | I82 E86 | I82-D84 PolarHBondContact O-N 3.4Å; I82-D84 VanDerWaalsContact O-N 3.15Å; D84-E86 PolarHBondContact O-N 3.24Å | ||
| 85 | G | 74.7 | Confident | 82.3 | Confident | 68 Ų | 68 | 125.9 Ų | 125.9 | 70% | 0.701 | 66% | 0.662 | S | S | * | * | trans | -54.3 | 117.1 | -176.9 | 0 | 0 | 0 | 0 | 0 | 107.8 | P83 R87 | P83-G85 VanDerWaalsContact C-N 3.31Å; P83-G85 PolarHBondContact O-N 3.18Å; G85-R87 PolarHBondContact O-N 3.26Å | ||
| 86 | E | 83 | Confident | 83.7 | Confident | 176 Ų | 176 | 127 Ų | 127 | 82% | 0.822 | 66% | 0.657 | S | S | * | * | trans | -50.1 | 127.7 | 172.5 | -177.2 | 173.3 | 176.3 | 0 | 0 | 107.2 | D84 V88 | D84-E86 PolarHBondContact O-N 3.24Å; E86-V88 WeakPolarHBondContact O-CG2 3.45Å; E86-V88 PolarHBondContact O-N 3.44Å | ||
| 87 | R | 83.4 | Confident | 85.3 | Confident | 241 Ų | 241 | 126.4 Ų | 126.4 | 91% | 0.909 | 64% | 0.643 | S | S | * | * | trans | -59.9 | 108.8 | 179.9 | -72.6 | -171.1 | 177.4 | 114.5 | -2.1 | 107.2 | G85 D89 | G85-R87 PolarHBondContact O-N 3.26Å; R87-D89 PolarHBondContact O-N 3.31Å | ||
| 88 | V | 88.4 | Confident | 86.8 | Confident | 91 Ų | 91 | 123.5 Ų | 123.5 | 55% | 0.552 | 63% | 0.631 | S | S | * | * | trans | -75.3 | 118.8 | 177.4 | 178.4 | 0 | 0 | 0 | 0 | 107.2 | E86 I93 | E86-V88 WeakPolarHBondContact O-CG2 3.45Å; E86-V88 PolarHBondContact O-N 3.44Å; V88-I93 HydrophobicContact CG1-CD1 3.24Å; V88-I93 HydrophobicContact CG1-CG1 4.22Å | ||
| 89 | D | 91.9 | Very high | 88 | Confident | 76 Ų | 76 | 123.9 Ų | 123.9 | 41% | 0.406 | 63% | 0.625 | S | S | . | * | trans | -84.1 | 114.6 | 173.1 | -177.4 | -21.3 | 0 | 0 | 0 | 108.8 | R87 D91 D92 I93 | R87-D89 PolarHBondContact O-N 3.31Å; D89-D91 VanDerWaalsContact C-N 3.33Å; D89-D91 WeakPolarHBondContact OD1-CB 3.19Å; D89-D91 PolarHBondContact OD1-N 3.09Å; D89-D92 HydrophobicContact CB-CB 3.87Å; D89-D92 PolarHBondContact OD1-N 2.95Å; D89-D92 VanDerWaalsContact OD1-N 3.15Å; D89-I93 PolarHBondContact O-N 3.04Å; D89-I93 VanDerWaalsContact O-N 3.16Å | ||
| 90 | F | 94.6 | Very high | 89 | Confident | 160 Ų | 160 | 124 Ų | 124 | 70% | 0.702 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -71.4 | -29.5 | -178.2 | -71.9 | -78.7 | 0 | 0 | 0 | 112.3 | D92 I93 H94 | F90-D92 VanDerWaalsContact C-N 3.35Å; F90-I93 PolarHBondContact O-N 3.22Å; F90-H94 WeakPolarHBondContact O-CB 3.41Å; F90-H94 PolarHBondContact O-N 3Å |
| 91 | D | 95.4 | Very high | 90 | Very high | 124 Ų | 124 | 121.3 Ų | 121.3 | 66% | 0.663 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -69.9 | -40.1 | 177.6 | -61.1 | -23 | 0 | 0 | 0 | 109.7 | D89 I93 H94 R95 | D89-D91 VanDerWaalsContact C-N 3.33Å; D89-D91 WeakPolarHBondContact OD1-CB 3.19Å; D89-D91 PolarHBondContact OD1-N 3.09Å; D91-I93 VanDerWaalsContact C-N 3.34Å; D91-I93 PolarHBondContact O-N 2.99Å; D91-H94 PolarHBondContact O-N 3.33Å; D91-R95 VanDerWaalsContact O-CB 3.29Å; D91-R95 WeakPolarHBondContact O-CB 3.28Å; D91-R95 PolarHBondContact O-N 3.15Å |
| 92 | D | 96.3 | Very high | 91 | Very high | 49 Ų | 49 | 116.2 Ų | 116.2 | 26% | 0.262 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -61.5 | -40.7 | 172 | -92.1 | 13.6 | 0 | 0 | 0 | 112.5 | D89 F90 R95 K96 | D89-D92 HydrophobicContact CB-CB 3.87Å; D89-D92 PolarHBondContact OD1-N 2.95Å; D89-D92 VanDerWaalsContact OD1-N 3.15Å; F90-D92 VanDerWaalsContact C-N 3.35Å; D92-R95 IonicContact OD1-CZ 2.93Å; D92-R95 IonicContact OD1-NH1 2.68Å; D92-R95 PolarHBondContact OD1-NH1 2.86Å; D92-R95 IonicContact OD1-NH2 3.17Å; D92-R95 PolarHBondContact OD1-NH2 3.38Å; D92-R95 IonicContact OD2-NH2 3.8Å; D92-K96 VanDerWaalsContact O-CB 3.31Å; D92-K96 WeakPolarHBondContact O-CB 3.47Å; D92-K96 WeakPolarHBondContact O-CD 3.3Å; D92-K96 WeakPolarHBondContact O-CG 3.48Å; D92-K96 PolarHBondContact O-N 2.91Å |
| 93 | I | 96.5 | Very high | 91.9 | Very high | 71 Ų | 71 | 113 Ų | 113 | 36% | 0.364 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.7 | -46.1 | 176.2 | -73.2 | 179.4 | 0 | 0 | 0 | 110.8 | V88 D89 F90 D91 K96 R97 | V88-I93 HydrophobicContact CG1-CD1 3.24Å; V88-I93 HydrophobicContact CG1-CG1 4.22Å; D89-I93 PolarHBondContact O-N 3.04Å; D89-I93 VanDerWaalsContact O-N 3.16Å; F90-I93 PolarHBondContact O-N 3.22Å; D91-I93 VanDerWaalsContact C-N 3.34Å; D91-I93 PolarHBondContact O-N 2.99Å; I93-K96 PolarHBondContact O-N 2.87Å; I93-R97 WeakPolarHBondContact O-CB 3.5Å; I93-R97 PolarHBondContact O-N 3.42Å |
| 94 | H | 97.6 | Very high | 92.9 | Very high | 113 Ų | 113 | 112.7 Ų | 112.7 | 52% | 0.523 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.4 | -48.4 | -179.3 | -170.6 | 89.2 | 0 | 0 | 0 | 110.6 | F90 D91 K96 R97 V98 | F90-H94 WeakPolarHBondContact O-CB 3.41Å; F90-H94 PolarHBondContact O-N 3Å; D91-H94 PolarHBondContact O-N 3.33Å; H94-K96 VanDerWaalsContact C-N 3.34Å; H94-K96 PolarHBondContact O-N 2.99Å; H94-R97 WeakPolarHBondContact O-CB 3.45Å; H94-R97 PolarHBondContact O-N 3.08Å; H94-R97 VanDerWaalsContact O-N 3.07Å; H94-V98 WeakPolarHBondContact O-CG2 3.29Å; H94-V98 PolarHBondContact O-N 2.9Å |
| 95 | R | 97.8 | Very high | 94.2 | Very high | 137 Ų | 137 | 110 Ų | 110 | 52% | 0.517 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -56.7 | -46.9 | 176.4 | -171.4 | 174.7 | 69.6 | -110.9 | 0.5 | 111.9 | D91 D92 R97 V98 E99 | D91-R95 VanDerWaalsContact O-CB 3.29Å; D91-R95 WeakPolarHBondContact O-CB 3.28Å; D91-R95 PolarHBondContact O-N 3.15Å; D92-R95 IonicContact OD1-CZ 2.93Å; D92-R95 IonicContact OD1-NH1 2.68Å; D92-R95 PolarHBondContact OD1-NH1 2.86Å; D92-R95 IonicContact OD1-NH2 3.17Å; D92-R95 PolarHBondContact OD1-NH2 3.38Å; D92-R95 IonicContact OD2-NH2 3.8Å; R95-R97 VanDerWaalsContact C-N 3.29Å; R95-R97 PolarHBondContact O-N 3.47Å; R95-V98 PolarHBondContact O-N 3.01Å; R95-E99 WeakPolarHBondContact O-CB 3.37Å; R95-E99 PolarHBondContact O-N 3.18Å |
| 96 | K | 97.8 | Very high | 95.3 | Very high | 126 Ų | 126 | 111.1 Ų | 111.1 | 55% | 0.548 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.4 | -35.2 | 177.1 | -77.5 | 170.3 | -178.5 | 163.2 | 0 | 112.7 | D92 I93 H94 K100 | D92-K96 VanDerWaalsContact O-CB 3.31Å; D92-K96 WeakPolarHBondContact O-CB 3.47Å; D92-K96 WeakPolarHBondContact O-CD 3.3Å; D92-K96 WeakPolarHBondContact O-CG 3.48Å; D92-K96 PolarHBondContact O-N 2.91Å; I93-K96 PolarHBondContact O-N 2.87Å; H94-K96 VanDerWaalsContact C-N 3.34Å; H94-K96 PolarHBondContact O-N 2.99Å; K96-K100 VanDerWaalsContact O-CB 3.22Å; K96-K100 WeakPolarHBondContact O-CB 3.48Å; K96-K100 PolarHBondContact O-N 3.44Å |
| 97 | R | 98 | Very high | 96.1 | Very high | 142 Ų | 142 | 107.1 Ų | 107.1 | 54% | 0.536 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.1 | -51.3 | 176.5 | -178.2 | -179 | -64 | 159 | 2.2 | 110.7 | I93 H94 R95 E99 K100 D101 | I93-R97 WeakPolarHBondContact O-CB 3.5Å; I93-R97 PolarHBondContact O-N 3.42Å; H94-R97 WeakPolarHBondContact O-CB 3.45Å; H94-R97 PolarHBondContact O-N 3.08Å; H94-R97 VanDerWaalsContact O-N 3.07Å; R95-R97 VanDerWaalsContact C-N 3.29Å; R95-R97 PolarHBondContact O-N 3.47Å; R97-E99 VanDerWaalsContact C-N 3.32Å; R97-E99 PolarHBondContact O-N 2.94Å; R97-K100 PolarHBondContact O-N 3.12Å; R97-D101 WeakPolarHBondContact CG-OD2 3.4Å; R97-D101 WeakPolarHBondContact O-CB 3.42Å; R97-D101 PolarHBondContact O-N 2.81Å |
| 98 | V | 97.5 | Very high | 96.8 | Very high | 76 Ų | 76 | 101.3 Ų | 101.3 | 46% | 0.461 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.7 | -46.2 | 179.3 | 176.4 | 0 | 0 | 0 | 0 | 110.8 | H94 R95 D101 L102 | H94-V98 WeakPolarHBondContact O-CG2 3.29Å; H94-V98 PolarHBondContact O-N 2.9Å; R95-V98 PolarHBondContact O-N 3.01Å; V98-D101 PolarHBondContact O-N 3.46Å; V98-L102 VanDerWaalsContact O-CB 3.28Å; V98-L102 WeakPolarHBondContact O-CB 3.49Å; V98-L102 PolarHBondContact O-N 3.05Å |
| 99 | E | 98 | Very high | 97.2 | Very high | 118 Ų | 118 | 101.5 Ų | 101.5 | 55% | 0.551 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62 | -45.5 | 178.5 | -176.9 | 178 | -172.3 | 0 | 0 | 112.3 | R95 R97 N103 | R95-E99 WeakPolarHBondContact O-CB 3.37Å; R95-E99 PolarHBondContact O-N 3.18Å; R97-E99 VanDerWaalsContact C-N 3.32Å; R97-E99 PolarHBondContact O-N 2.94Å; E99-N103 PolarHBondContact O-N 3.22Å; E99-N103 VanDerWaalsContact O-N 3.14Å; E99-N103 PolarHBondContact O-ND2 2.84Å |
| 100 | K | 98.1 | Very high | 97.5 | Very high | 103 Ų | 103 | 104.4 Ų | 104.4 | 45% | 0.448 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.5 | -51.3 | 177 | 174.3 | -169.6 | 160.3 | -65.1 | 0 | 111.1 | K96 R97 L102 N103 E104 | K96-K100 VanDerWaalsContact O-CB 3.22Å; K96-K100 WeakPolarHBondContact O-CB 3.48Å; K96-K100 PolarHBondContact O-N 3.44Å; R97-K100 PolarHBondContact O-N 3.12Å; K100-L102 VanDerWaalsContact C-N 3.33Å; K100-L102 PolarHBondContact O-N 2.79Å; K100-N103 PolarHBondContact O-N 2.82Å; K100-E104 WeakPolarHBondContact CE-OE1 3.48Å; K100-E104 WeakPolarHBondContact CG-OE1 3.48Å; K100-E104 IonicContact NZ-OE1 2.79Å; K100-E104 PolarHBondContact NZ-OE1 3.38Å; K100-E104 IonicContact NZ-OE2 2.76Å; K100-E104 PolarHBondContact NZ-OE2 2.9Å; K100-E104 WeakPolarHBondContact O-CG 3.43Å; K100-E104 PolarHBondContact O-N 2.92Å |
| 101 | D | 97.7 | Very high | 97.6 | Very high | 63 Ų | 63 | 100 Ų | 100 | 34% | 0.337 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -68.7 | -35.5 | -172.7 | -64 | -12.2 | 0 | 0 | 0 | 110.7 | R97 V98 E104 L105 | R97-D101 WeakPolarHBondContact CG-OD2 3.4Å; R97-D101 WeakPolarHBondContact O-CB 3.42Å; R97-D101 PolarHBondContact O-N 2.81Å; V98-D101 PolarHBondContact O-N 3.46Å; D101-E104 PolarHBondContact O-N 2.57Å; D101-L105 WeakPolarHBondContact O-CB 3.46Å; D101-L105 VanDerWaalsContact O-CG 3.28Å; D101-L105 WeakPolarHBondContact O-CG 3.37Å; D101-L105 PolarHBondContact O-N 3.31Å |
| 102 | L | 98.2 | Very high | 97.7 | Very high | 88 Ų | 88 | 101 Ų | 101 | 46% | 0.461 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.4 | -45.1 | 173 | -176.1 | 136.2 | 0 | 0 | 0 | 112.2 | V98 K100 L105 Q106 | V98-L102 VanDerWaalsContact O-CB 3.28Å; V98-L102 WeakPolarHBondContact O-CB 3.49Å; V98-L102 PolarHBondContact O-N 3.05Å; K100-L102 VanDerWaalsContact C-N 3.33Å; K100-L102 PolarHBondContact O-N 2.79Å; L102-L105 PolarHBondContact O-N 2.84Å; L102-Q106 WeakPolarHBondContact O-CG 3.32Å; L102-Q106 PolarHBondContact O-N 2.64Å |
| 103 | N | 97.9 | Very high | 97.7 | Very high | 76 Ų | 76 | 106.6 Ų | 106.6 | 41% | 0.406 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.2 | -40.6 | 176.4 | -73.7 | -50.1 | 0 | 0 | 0 | 112.3 | E99 K100 Q106 T107 | E99-N103 PolarHBondContact O-N 3.22Å; E99-N103 VanDerWaalsContact O-N 3.14Å; E99-N103 PolarHBondContact O-ND2 2.84Å; K100-N103 PolarHBondContact O-N 2.82Å; N103-Q106 PolarHBondContact O-N 3.04Å; N103-T107 WeakPolarHBondContact O-CB 3.16Å; N103-T107 PolarHBondContact O-N 2.67Å; N103-T107 PolarHBondContact O-OG1 2.55Å |
| 104 | E | 98.1 | Very high | 96.9 | Very high | 104 Ų | 104 | 114.3 Ų | 114.3 | 49% | 0.486 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -64.2 | -42.9 | 177.1 | -75.9 | 175.8 | -170.9 | 0 | 0 | 111.6 | K100 D101 T107 L108 | K100-E104 WeakPolarHBondContact CE-OE1 3.48Å; K100-E104 WeakPolarHBondContact CG-OE1 3.48Å; K100-E104 IonicContact NZ-OE1 2.79Å; K100-E104 PolarHBondContact NZ-OE1 3.38Å; K100-E104 IonicContact NZ-OE2 2.76Å; K100-E104 PolarHBondContact NZ-OE2 2.9Å; K100-E104 WeakPolarHBondContact O-CG 3.43Å; K100-E104 PolarHBondContact O-N 2.92Å; D101-E104 PolarHBondContact O-N 2.57Å; E104-T107 PolarHBondContact O-N 3.01Å; E104-L108 WeakPolarHBondContact O-CB 3.37Å; E104-L108 PolarHBondContact O-N 3.3Å |
| 105 | L | 98.4 | Very high | 96.9 | Very high | 107 Ų | 107 | 114.4 Ų | 114.4 | 56% | 0.56 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -62.3 | -46.4 | 175.5 | -74.2 | 172.7 | 0 | 0 | 0 | 111.7 | D101 L102 T107 L108 I109 | D101-L105 WeakPolarHBondContact O-CB 3.46Å; D101-L105 VanDerWaalsContact O-CG 3.28Å; D101-L105 WeakPolarHBondContact O-CG 3.37Å; D101-L105 PolarHBondContact O-N 3.31Å; L102-L105 PolarHBondContact O-N 2.84Å; L105-T107 VanDerWaalsContact C-N 3.34Å; L105-T107 PolarHBondContact O-N 2.94Å; L105-L108 PolarHBondContact O-N 3.07Å; L105-I109 WeakPolarHBondContact O-CB 3.31Å; L105-I109 WeakPolarHBondContact O-CD1 3.46Å; L105-I109 WeakPolarHBondContact O-CG1 3.28Å; L105-I109 PolarHBondContact O-N 2.89Å |
| 106 | Q | 97.8 | Very high | 96.8 | Very high | 92 Ų | 92 | 113.2 Ų | 113.2 | 43% | 0.43 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -58.7 | -46.5 | 176.6 | -74.7 | 176 | -8.5 | 0 | 0 | 111.7 | L102 N103 L108 I109 E110 | L102-Q106 WeakPolarHBondContact O-CG 3.32Å; L102-Q106 PolarHBondContact O-N 2.64Å; N103-Q106 PolarHBondContact O-N 3.04Å; Q106-L108 VanDerWaalsContact C-N 3.27Å; Q106-L108 PolarHBondContact O-N 3.02Å; Q106-I109 WeakPolarHBondContact O-CB 3.45Å; Q106-I109 PolarHBondContact O-N 2.85Å; Q106-E110 WeakPolarHBondContact O-CG 3.07Å; Q106-E110 PolarHBondContact O-N 3.01Å |
| 107 | T | 98.1 | Very high | 96.8 | Very high | 92 Ų | 92 | 112.5 Ų | 112.5 | 56% | 0.564 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -59.3 | -41.1 | 177.1 | -55.5 | 0 | 0 | 0 | 0 | 111.4 | N103 E104 L105 A111 | N103-T107 WeakPolarHBondContact O-CB 3.16Å; N103-T107 PolarHBondContact O-N 2.67Å; N103-T107 PolarHBondContact O-OG1 2.55Å; E104-T107 PolarHBondContact O-N 3.01Å; L105-T107 VanDerWaalsContact C-N 3.34Å; L105-T107 PolarHBondContact O-N 2.94Å; T107-A111 WeakPolarHBondContact O-CB 3.2Å; T107-A111 PolarHBondContact O-N 2.81Å |
| 108 | L | 98.3 | Very high | 96.7 | Very high | 120 Ų | 120 | 110.8 Ų | 110.8 | 63% | 0.628 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -69.8 | -37.8 | 179 | -174.4 | 63 | 0 | 0 | 0 | 112.3 | E104 L105 Q106 H112 | E104-L108 WeakPolarHBondContact O-CB 3.37Å; E104-L108 PolarHBondContact O-N 3.3Å; L105-L108 PolarHBondContact O-N 3.07Å; Q106-L108 VanDerWaalsContact C-N 3.27Å; Q106-L108 PolarHBondContact O-N 3.02Å; L108-H112 PolarHBondContact O-N 3.07Å; L108-H112 VanDerWaalsContact O-N 3.15Å |
| 109 | I | 97.8 | Very high | 96.6 | Very high | 95 Ų | 95 | 112.9 Ų | 112.9 | 49% | 0.487 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -62 | -50.9 | 174.3 | -71.5 | 162.6 | 0 | 0 | 0 | 109.4 | L105 Q106 A111 H112 F113 | L105-I109 WeakPolarHBondContact O-CB 3.31Å; L105-I109 WeakPolarHBondContact O-CD1 3.46Å; L105-I109 WeakPolarHBondContact O-CG1 3.28Å; L105-I109 PolarHBondContact O-N 2.89Å; Q106-I109 WeakPolarHBondContact O-CB 3.45Å; Q106-I109 PolarHBondContact O-N 2.85Å; I109-A111 VanDerWaalsContact C-N 3.34Å; I109-A111 PolarHBondContact O-N 3.36Å; I109-H112 WeakPolarHBondContact O-CB 3.22Å; I109-H112 PolarHBondContact O-N 3.03Å; I109-F113 HydrophobicContact CG2-CD2 4.01Å; I109-F113 HydrophobicContact CG2-CE2 4.01Å; I109-F113 WeakPolarHBondContact O-CD2 3.18Å; I109-F113 PolarHBondContact O-N 2.8Å |
| 110 | E | 97.3 | Very high | 96.5 | Very high | 136 Ų | 136 | 112.6 Ų | 112.6 | 64% | 0.636 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -57.2 | -47.4 | 178.3 | -72.4 | 177.4 | -174.4 | 0 | 0 | 111.6 | Q106 H112 F113 E114 | Q106-E110 WeakPolarHBondContact O-CG 3.07Å; Q106-E110 PolarHBondContact O-N 3.01Å; E110-H112 PolarHBondContact O-N 3.06Å; E110-H112 VanDerWaalsContact O-N 3.17Å; E110-F113 PolarHBondContact O-N 3.48Å; E110-E114 PolarHBondContact O-N 2.79Å |
| 111 | A | 97.6 | Very high | 96.4 | Very high | 68 Ų | 68 | 113.3 Ų | 113.3 | 56% | 0.562 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65.2 | -17.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | T107 I109 | T107-A111 WeakPolarHBondContact O-CB 3.2Å; T107-A111 PolarHBondContact O-N 2.81Å; I109-A111 VanDerWaalsContact C-N 3.34Å; I109-A111 PolarHBondContact O-N 3.36Å |
| 112 | H | 98.2 | Very high | 96.3 | Very high | 144 Ų | 144 | 117.2 Ų | 117.2 | 67% | 0.667 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -82.9 | -30.4 | 177.6 | -170.7 | 74.7 | 0 | 0 | 0 | 112.9 | L108 I109 E110 | L108-H112 PolarHBondContact O-N 3.07Å; L108-H112 VanDerWaalsContact O-N 3.15Å; I109-H112 WeakPolarHBondContact O-CB 3.22Å; I109-H112 PolarHBondContact O-N 3.03Å; E110-H112 PolarHBondContact O-N 3.06Å; E110-H112 VanDerWaalsContact O-N 3.17Å |
| 113 | F | 95.6 | Very high | 96.2 | Very high | 168 Ų | 168 | 119.6 Ų | 119.6 | 74% | 0.737 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -104.4 | -6.4 | -172 | -68.1 | -69.8 | 0 | 0 | 0 | 114.5 | I109 E110 | I109-F113 HydrophobicContact CG2-CD2 4.01Å; I109-F113 HydrophobicContact CG2-CE2 4.01Å; I109-F113 WeakPolarHBondContact O-CD2 3.18Å; I109-F113 PolarHBondContact O-N 2.8Å; E110-F113 PolarHBondContact O-N 3.48Å |
| 114 | E | 79.1 | Confident | 96 | Very high | 233 Ų | 233 | 123.5 Ų | 123.5 | 100% | 1.089 | 62% | 0.622 | S | S | * | * | trans | -80.5 | 0 | 169.5 | -162.6 | 166.6 | -153.5 | 0 | 0 | 112.4 | E110 | E110-E114 PolarHBondContact O-N 2.79Š|
Retrieved 114 of 114 residues in 313.6 ms
(Link to these results)