| 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 | 58.2 | Low | 71.3 | Confident | 220 Ų | 220 | 126.7 Ų | 126.7 | 100% | 1.084 | 64% | 0.638 | S | S | * | * | 0 | 3.6 | 0 | -65.9 | -178 | 122 | 0 | 0 | 114.9 | |||||
| 2 | F | 62.2 | Low | 72.2 | Confident | 180 Ų | 180 | 125.7 Ų | 125.7 | 79% | 0.789 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -74.2 | -32.8 | -179.4 | -103.5 | -99.4 | 0 | 0 | 0 | 118.9 | L4 K6 | F2-L4 PolarHBondContact O-N 3.23Å; F2-K6 PolarHBondContact O-N 3.44Å |
| 3 | P | 64.1 | Low | 73 | Confident | 88 Ų | 88 | 125.2 Ų | 125.2 | 57% | 0.571 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -74.5 | -31.1 | -166.9 | 23.5 | -30.3 | 0 | 0 | 0 | 114 | K6 N7 | P3-K6 PolarHBondContact O-N 3.41Å; P3-N7 PolarHBondContact O-N 3.29Å |
| 4 | L | 73.2 | Confident | 73.7 | Confident | 142 Ų | 142 | 122.1 Ų | 122.1 | 74% | 0.743 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -68.7 | -40.7 | 178 | -66.3 | 174.5 | 0 | 0 | 0 | 111.8 | F2 N7 A8 | F2-L4 PolarHBondContact O-N 3.23Å; L4-N7 PolarHBondContact O-N 3.5Å; L4-A8 WeakPolarHBondContact O-CB 3.42Å; L4-A8 PolarHBondContact O-N 2.85Å |
| 5 | V | 72.4 | Confident | 74.3 | Confident | 89 Ų | 89 | 124.5 Ų | 124.5 | 54% | 0.539 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -63.8 | -43.4 | 176.5 | 177.9 | 0 | 0 | 0 | 0 | 110.4 | N7 A8 L9 | V5-N7 PolarHBondContact O-N 3.29Å; V5-A8 PolarHBondContact O-N 2.8Å; V5-L9 HydrophobicContact CG1-CD1 3.88Å; V5-L9 WeakPolarHBondContact O-CB 3.39Å; V5-L9 PolarHBondContact O-N 3.18Å |
| 6 | K | 69.9 | Low | 74.8 | Confident | 135 Ų | 135 | 120.2 Ų | 120.2 | 59% | 0.587 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -63.2 | -41.8 | 177.3 | -164.8 | 172.5 | -177.9 | 178.9 | 0 | 112.4 | F2 P3 N10 | F2-K6 PolarHBondContact O-N 3.44Å; P3-K6 PolarHBondContact O-N 3.41Å; K6-N10 WeakPolarHBondContact O-CB 3.24Å; K6-N10 VanDerWaalsContact O-CG 3.24Å; K6-N10 PolarHBondContact O-N 3.32Å; K6-N10 PolarHBondContact O-ND2 2.85Å |
| 7 | N | 76.5 | Confident | 75.3 | Confident | 102 Ų | 102 | 118.1 Ų | 118.1 | 55% | 0.545 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -68.7 | -37.2 | 176.8 | -82.5 | 3.2 | 0 | 0 | 0 | 113.1 | P3 L4 V5 R11 | P3-N7 PolarHBondContact O-N 3.29Å; L4-N7 PolarHBondContact O-N 3.5Å; V5-N7 PolarHBondContact O-N 3.29Å; N7-R11 WeakPolarHBondContact O-CG 3.26Å; N7-R11 PolarHBondContact O-N 3.14Å; N7-R11 VanDerWaalsContact O-N 3.08Å |
| 8 | A | 76.9 | Confident | 75.9 | Confident | 51 Ų | 51 | 118.6 Ų | 118.6 | 42% | 0.421 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -65.9 | -45 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | L4 V5 R11 L12 | L4-A8 WeakPolarHBondContact O-CB 3.42Å; L4-A8 PolarHBondContact O-N 2.85Å; V5-A8 PolarHBondContact O-N 2.8Å; A8-R11 PolarHBondContact O-N 3.43Å; A8-L12 WeakPolarHBondContact O-CG 3.45Å; A8-L12 PolarHBondContact O-N 3.36Å |
| 9 | L | 76.2 | Confident | 76.3 | Confident | 106 Ų | 106 | 117.5 Ų | 117.5 | 56% | 0.555 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -59.1 | -47.6 | 174.7 | -86.6 | 154.2 | 0 | 0 | 0 | 112.1 | V5 R11 L12 Q13 | V5-L9 HydrophobicContact CG1-CD1 3.88Å; V5-L9 WeakPolarHBondContact O-CB 3.39Å; V5-L9 PolarHBondContact O-N 3.18Å; L9-R11 VanDerWaalsContact C-N 3.31Å; L9-R11 PolarHBondContact O-N 2.8Å; L9-L12 PolarHBondContact O-N 2.97Å; L9-Q13 WeakPolarHBondContact O-CB 3.37Å; L9-Q13 PolarHBondContact O-N 2.98Å |
| 10 | N | 75.8 | Confident | 76.6 | Confident | 77 Ų | 77 | 115.6 Ų | 115.6 | 41% | 0.412 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -59.9 | -41.1 | 177.6 | -74.3 | -16 | 0 | 0 | 0 | 112 | K6 Q13 V14 | K6-N10 WeakPolarHBondContact O-CB 3.24Å; K6-N10 VanDerWaalsContact O-CG 3.24Å; K6-N10 PolarHBondContact O-N 3.32Å; K6-N10 PolarHBondContact O-ND2 2.85Å; N10-Q13 PolarHBondContact O-N 3.39Å; N10-V14 VanDerWaalsContact O-CG2 3.28Å; N10-V14 WeakPolarHBondContact O-CG2 3.25Å; N10-V14 PolarHBondContact O-N 3.1Å |
| 11 | R | 78.5 | Confident | 76.9 | Confident | 204 Ų | 204 | 115.9 Ų | 115.9 | 77% | 0.77 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -65.5 | -40.1 | 176.3 | -79.3 | -176.9 | 176.9 | -125.5 | 1.3 | 112.6 | N7 A8 L9 R15 | N7-R11 WeakPolarHBondContact O-CG 3.26Å; N7-R11 PolarHBondContact O-N 3.14Å; N7-R11 VanDerWaalsContact O-N 3.08Å; A8-R11 PolarHBondContact O-N 3.43Å; L9-R11 VanDerWaalsContact C-N 3.31Å; L9-R11 PolarHBondContact O-N 2.8Å; R11-R15 WeakPolarHBondContact O-CB 3.41Å; R11-R15 PolarHBondContact O-N 3.22Å |
| 12 | L | 82.4 | Confident | 77.9 | Confident | 114 Ų | 114 | 107.4 Ų | 107.4 | 60% | 0.597 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -65.3 | -42.4 | 176.9 | -72.3 | 169.5 | 0 | 0 | 0 | 111.6 | A8 L9 R15 S16 | A8-L12 WeakPolarHBondContact O-CG 3.45Å; A8-L12 PolarHBondContact O-N 3.36Å; L9-L12 PolarHBondContact O-N 2.97Å; L12-R15 PolarHBondContact O-N 2.92Å; L12-S16 PolarHBondContact O-N 3.45Å |
| 13 | Q | 82.8 | Confident | 78.6 | Confident | 120 Ų | 120 | 107.6 Ų | 107.6 | 56% | 0.561 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -64.6 | -43.8 | 177.6 | -173.1 | 177.7 | -9.1 | 0 | 0 | 112.1 | L9 N10 R15 S16 I17 | L9-Q13 WeakPolarHBondContact O-CB 3.37Å; L9-Q13 PolarHBondContact O-N 2.98Å; N10-Q13 PolarHBondContact O-N 3.39Å; Q13-R15 VanDerWaalsContact C-N 3.3Å; Q13-R15 PolarHBondContact O-N 3.29Å; Q13-S16 PolarHBondContact O-N 2.95Å; Q13-S16 PolarHBondContact O-OG 3.02Å; Q13-I17 HydrophobicContact CG-CD1 4.18Å; Q13-I17 WeakPolarHBondContact O-CD1 3.21Å; Q13-I17 VanDerWaalsContact O-CG1 3.25Å; Q13-I17 WeakPolarHBondContact O-CG1 3.18Å; Q13-I17 PolarHBondContact O-N 3.49Å; Q13-I17 VanDerWaalsContact O-N 3.08Å |
| 14 | V | 83.3 | Confident | 79.1 | Confident | 81 Ų | 81 | 110 Ų | 110 | 49% | 0.491 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.5 | -41.4 | 175.7 | 172.3 | 0 | 0 | 0 | 0 | 110.8 | N10 I17 Q18 | N10-V14 VanDerWaalsContact O-CG2 3.28Å; N10-V14 WeakPolarHBondContact O-CG2 3.25Å; N10-V14 PolarHBondContact O-N 3.1Å; V14-I17 PolarHBondContact O-N 3.43Å; V14-Q18 WeakPolarHBondContact O-CG 3.43Å; V14-Q18 PolarHBondContact O-N 2.89Å |
| 15 | R | 82.6 | Confident | 78.9 | Confident | 158 Ų | 158 | 107.5 Ų | 107.5 | 60% | 0.596 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -67.4 | -38.2 | 178.8 | -165.9 | 177.6 | -175.9 | -175.8 | 2.3 | 112.4 | R11 L12 Q13 Q18 Q19 | R11-R15 WeakPolarHBondContact O-CB 3.41Å; R11-R15 PolarHBondContact O-N 3.22Å; L12-R15 PolarHBondContact O-N 2.92Å; Q13-R15 VanDerWaalsContact C-N 3.3Å; Q13-R15 PolarHBondContact O-N 3.29Å; R15-Q18 PolarHBondContact O-N 3.02Å; R15-Q19 WeakPolarHBondContact O-CB 3.43Å; R15-Q19 VanDerWaalsContact O-CG 3.29Å; R15-Q19 WeakPolarHBondContact O-CG 3.45Å; R15-Q19 PolarHBondContact O-N 3.45Å |
| 16 | S | 81.3 | Confident | 78.7 | Confident | 56 Ų | 56 | 110.5 Ų | 110.5 | 39% | 0.392 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -68.2 | -36.8 | 177.3 | 70.4 | 0 | 0 | 0 | 0 | 112.1 | L12 Q13 Q19 T20 | L12-S16 PolarHBondContact O-N 3.45Å; Q13-S16 PolarHBondContact O-N 2.95Å; Q13-S16 PolarHBondContact O-OG 3.02Å; S16-Q19 PolarHBondContact O-N 3.15Å; S16-T20 WeakPolarHBondContact O-CB 3.23Å; S16-T20 PolarHBondContact O-N 2.93Å; S16-T20 PolarHBondContact O-OG1 2.86Å |
| 17 | I | 83.8 | Confident | 78.7 | Confident | 84 Ų | 84 | 110.8 Ų | 110.8 | 43% | 0.431 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -62.9 | -50.6 | 173.6 | -67.9 | 164.9 | 0 | 0 | 0 | 110 | Q13 V14 Q19 T20 M21 | Q13-I17 HydrophobicContact CG-CD1 4.18Å; Q13-I17 WeakPolarHBondContact O-CD1 3.21Å; Q13-I17 VanDerWaalsContact O-CG1 3.25Å; Q13-I17 WeakPolarHBondContact O-CG1 3.18Å; Q13-I17 PolarHBondContact O-N 3.49Å; Q13-I17 VanDerWaalsContact O-N 3.08Å; V14-I17 PolarHBondContact O-N 3.43Å; I17-Q19 VanDerWaalsContact C-N 3.31Å; I17-Q19 PolarHBondContact O-N 3.33Å; I17-T20 PolarHBondContact O-N 2.67Å; I17-T20 VanDerWaalsContact O-N 3.13Å; I17-M21 HydrophobicContact CG2-CG 4.44Å; I17-M21 HydrophobicContact CG2-SD 4.03Å; I17-M21 WeakPolarHBondContact O-CG 3.44Å; I17-M21 PolarHBondContact O-N 3.45Å |
| 18 | Q | 85.3 | Confident | 78.3 | Confident | 127 Ų | 127 | 114.9 Ų | 114.9 | 59% | 0.593 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -59.7 | -40.3 | 178.2 | -73.9 | -179.3 | -30.7 | 0 | 0 | 112.4 | V14 R15 M21 A22 | V14-Q18 WeakPolarHBondContact O-CG 3.43Å; V14-Q18 PolarHBondContact O-N 2.89Å; R15-Q18 PolarHBondContact O-N 3.02Å; Q18-M21 PolarHBondContact O-N 3.49Å; Q18-A22 VanDerWaalsContact O-CB 3.31Å; Q18-A22 WeakPolarHBondContact O-CB 3.28Å; Q18-A22 PolarHBondContact O-N 2.99Å |
| 19 | Q | 84.2 | Confident | 78.3 | Confident | 99 Ų | 99 | 121.1 Ų | 121.1 | 46% | 0.463 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -66.2 | -37.8 | 175.8 | -76.2 | 176.5 | -21.6 | 0 | 0 | 112.8 | R15 S16 I17 R23 | R15-Q19 WeakPolarHBondContact O-CB 3.43Å; R15-Q19 VanDerWaalsContact O-CG 3.29Å; R15-Q19 WeakPolarHBondContact O-CG 3.45Å; R15-Q19 PolarHBondContact O-N 3.45Å; S16-Q19 PolarHBondContact O-N 3.15Å; I17-Q19 VanDerWaalsContact C-N 3.31Å; I17-Q19 PolarHBondContact O-N 3.33Å; Q19-R23 WeakPolarHBondContact O-CB 3.47Å; Q19-R23 VanDerWaalsContact O-CG 3.26Å; Q19-R23 WeakPolarHBondContact O-CG 3.44Å; Q19-R23 PolarHBondContact O-N 2.96Å |
| 20 | T | 83.4 | Confident | 78.8 | Confident | 78 Ų | 78 | 121.3 Ų | 121.3 | 48% | 0.479 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -67.6 | -43.9 | 176.8 | -56.2 | 0 | 0 | 0 | 0 | 110.8 | S16 I17 R23 Q24 | S16-T20 WeakPolarHBondContact O-CB 3.23Å; S16-T20 PolarHBondContact O-N 2.93Å; S16-T20 PolarHBondContact O-OG1 2.86Å; I17-T20 PolarHBondContact O-N 2.67Å; I17-T20 VanDerWaalsContact O-N 3.13Å; T20-R23 PolarHBondContact O-N 2.95Å; T20-Q24 WeakPolarHBondContact O-CG 3.36Å; T20-Q24 PolarHBondContact O-N 2.93Å |
| 21 | M | 81.3 | Confident | 79.5 | Confident | 122 Ų | 122 | 121 Ų | 121 | 60% | 0.601 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -63.9 | -42.8 | 175.6 | -68.4 | -178.2 | 74.7 | 0 | 0 | 112.1 | I17 Q18 R23 Q24 S25 | I17-M21 HydrophobicContact CG2-CG 4.44Å; I17-M21 HydrophobicContact CG2-SD 4.03Å; I17-M21 WeakPolarHBondContact O-CG 3.44Å; I17-M21 PolarHBondContact O-N 3.45Å; Q18-M21 PolarHBondContact O-N 3.49Å; M21-R23 VanDerWaalsContact C-N 3.33Å; M21-R23 PolarHBondContact O-N 3.49Å; M21-Q24 PolarHBondContact O-N 2.82Å; M21-S25 WeakPolarHBondContact O-CB 3.31Å; M21-S25 PolarHBondContact O-N 2.89Å; M21-S25 PolarHBondContact O-OG 3.45Å |
| 22 | A | 80.3 | Confident | 80.1 | Confident | 42 Ų | 42 | 114.6 Ų | 114.6 | 35% | 0.347 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -63.9 | -38.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q18 S25 H26 | Q18-A22 VanDerWaalsContact O-CB 3.31Å; Q18-A22 WeakPolarHBondContact O-CB 3.28Å; Q18-A22 PolarHBondContact O-N 2.99Å; A22-S25 WeakPolarHBondContact CA-OG 3.45Å; A22-S25 PolarHBondContact O-N 2.9Å; A22-S25 PolarHBondContact O-OG 3.39Å; A22-H26 WeakPolarHBondContact O-CB 3.22Å; A22-H26 PolarHBondContact O-CD2 3.4Å; A22-H26 PolarHBondContact O-N 2.99Å |
| 23 | R | 76.9 | Confident | 80.8 | Confident | 185 Ų | 185 | 114.7 Ų | 114.7 | 70% | 0.698 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -63 | -45 | 173.1 | -77 | 173.7 | 179.1 | -172.4 | -0.1 | 111.2 | Q19 T20 M21 H26 Q27 | Q19-R23 WeakPolarHBondContact O-CB 3.47Å; Q19-R23 VanDerWaalsContact O-CG 3.26Å; Q19-R23 WeakPolarHBondContact O-CG 3.44Å; Q19-R23 PolarHBondContact O-N 2.96Å; T20-R23 PolarHBondContact O-N 2.95Å; M21-R23 VanDerWaalsContact C-N 3.33Å; M21-R23 PolarHBondContact O-N 3.49Å; R23-H26 CarbonylContact O-C 3.58Å; R23-H26 PolarHBondContact O-N 2.91Å; R23-Q27 VanDerWaalsContact O-CB 3.28Å; R23-Q27 WeakPolarHBondContact O-CB 3.26Å; R23-Q27 PolarHBondContact O-N 2.87Å |
| 24 | Q | 73.7 | Confident | 81.5 | Confident | 137 Ų | 137 | 115.4 Ų | 115.4 | 64% | 0.64 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -65 | -37.3 | 175.8 | -73.8 | -168.2 | -38.4 | 0 | 0 | 112.8 | T20 M21 H26 Q27 | T20-Q24 WeakPolarHBondContact O-CG 3.36Å; T20-Q24 PolarHBondContact O-N 2.93Å; M21-Q24 PolarHBondContact O-N 2.82Å; Q24-H26 VanDerWaalsContact C-N 3.34Å; Q24-Q27 PolarHBondContact O-N 3.02Å |
| 25 | S | 69.7 | Low | 82.1 | Confident | 90 Ų | 90 | 115.4 Ų | 115.4 | 63% | 0.629 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -70 | -31.2 | 177.1 | 69.7 | 0 | 0 | 0 | 0 | 112.7 | M21 A22 | M21-S25 WeakPolarHBondContact O-CB 3.31Å; M21-S25 PolarHBondContact O-N 2.89Å; M21-S25 PolarHBondContact O-OG 3.45Å; A22-S25 WeakPolarHBondContact CA-OG 3.45Å; A22-S25 PolarHBondContact O-N 2.9Å; A22-S25 PolarHBondContact O-OG 3.39Å |
| 26 | H | 67.8 | Low | 82.7 | Confident | 152 Ų | 152 | 113.8 Ų | 113.8 | 70% | 0.704 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -88.7 | -11.6 | 175.2 | -73.1 | -62.3 | 0 | 0 | 0 | 113.8 | A22 R23 Q24 K28 | A22-H26 WeakPolarHBondContact O-CB 3.22Å; A22-H26 PolarHBondContact O-CD2 3.4Å; A22-H26 PolarHBondContact O-N 2.99Å; R23-H26 CarbonylContact O-C 3.58Å; R23-H26 PolarHBondContact O-N 2.91Å; Q24-H26 VanDerWaalsContact C-N 3.34Å; H26-K28 VanDerWaalsContact C-N 3.31Å; H26-K28 PolarHBondContact O-N 3.42Å |
| 27 | Q | 70.9 | Confident | 83.6 | Confident | 142 Ų | 142 | 116.9 Ų | 116.9 | 66% | 0.664 | 56% | 0.564 | S | S | * | * | S | Bend | trans | -72.4 | 91.7 | 172.6 | -161.4 | 158.7 | -17.1 | 0 | 0 | 107.3 | R23 Q24 R29 | R23-Q27 VanDerWaalsContact O-CB 3.28Å; R23-Q27 WeakPolarHBondContact O-CB 3.26Å; R23-Q27 PolarHBondContact O-N 2.87Å; Q24-Q27 PolarHBondContact O-N 3.02Å; Q27-R29 PolarHBondContact O-N 2.82Å |
| 28 | K | 66.9 | Low | 84.2 | Confident | 188 Ų | 188 | 113.8 Ų | 113.8 | 82% | 0.817 | 55% | 0.552 | S | S | * | * | trans | -50.4 | 111.1 | 168.8 | -69.9 | -172.9 | -179.9 | -176.9 | 0 | 106.6 | H26 T30 | H26-K28 VanDerWaalsContact C-N 3.31Å; H26-K28 PolarHBondContact O-N 3.42Å; K28-T30 PolarHBondContact O-N 2.82Å | ||
| 29 | R | 77.5 | Confident | 84.9 | Confident | 182 Ų | 182 | 114.5 Ų | 114.5 | 69% | 0.687 | 56% | 0.56 | S | S | * | * | trans | -54.2 | 109.2 | 177.6 | 177.7 | 177.7 | 170.3 | -171.6 | -6.8 | 106.9 | Q27 D32 D35 | Q27-R29 PolarHBondContact O-N 2.82Å; R29-D32 IonicContact NH2-OD2 3.51Å; R29-D35 IonicContact CZ-OD1 3.6Å; R29-D35 IonicContact CZ-OD2 3.97Å; R29-D35 IonicContact NE-OD2 2.89Å; R29-D35 VanDerWaalsContact NH2-CG 3.32Å; R29-D35 IonicContact NH2-OD1 2.97Å; R29-D35 PolarHBondContact NH2-OD1 3.29Å; R29-D35 IonicContact NH2-OD2 3.82Å; R29-D35 PolarHBondContact NH2-OD2 3.26Å | ||
| 30 | T | 85.8 | Confident | 85.6 | Confident | 110 Ų | 110 | 113 Ų | 113 | 68% | 0.675 | 57% | 0.565 | S | S | * | * | trans | -76.4 | 129.1 | 174.6 | -61.4 | 0 | 0 | 0 | 0 | 106.3 | K28 D32 | K28-T30 PolarHBondContact O-N 2.82Å; T30-D32 PolarHBondContact O-N 3.5Å; T30-D32 VanDerWaalsContact O-N 3.14Å | ||
| 31 | P | 91.2 | Very high | 86.3 | Confident | 69 Ų | 69 | 113.3 Ų | 113.3 | 45% | 0.448 | 57% | 0.566 | S | S | . | * | trans | -53.7 | 123.1 | 179.8 | -27.1 | 34.5 | 0 | 0 | 0 | 110.2 | D35 K36 | P31-D35 WeakPolarHBondContact CA-OD2 3.48Å; P31-D35 HydrophobicContact CB-CB 3.76Å; P31-K36 HydrophobicContact CB-CG 4.03Å; P31-K36 WeakPolarHBondContact O-CE 3.28Å | ||
| 32 | D | 91.3 | Very high | 87.1 | Confident | 70 Ų | 70 | 113.4 Ų | 113.4 | 37% | 0.374 | 57% | 0.569 | S | S | . | * | trans | -80 | -172.9 | 175.9 | 68.5 | 33 | 0 | 0 | 0 | 110.8 | R29 T30 H34 D35 K36 | R29-D32 IonicContact NH2-OD2 3.51Å; T30-D32 PolarHBondContact O-N 3.5Å; T30-D32 VanDerWaalsContact O-N 3.14Å; D32-H34 VanDerWaalsContact C-N 3.3Å; D32-H34 PolarHBondContact O-N 3.14Å; D32-H34 WeakPolarHBondContact OD1-CA 3.44Å; D32-H34 WeakPolarHBondContact OD1-CB 3.5Å; D32-H34 IonicContact OD1-CD2 3.98Å; D32-H34 PolarHBondContact OD1-N 3.03Å; D32-D35 PolarHBondContact N-OD2 2.92Å; D32-D35 PolarHBondContact O-N 3.14Å; D32-D35 PolarHBondContact OD1-N 3.06Å; D32-K36 WeakPolarHBondContact O-CG 3.19Å; D32-K36 PolarHBondContact O-N 3.43Å; D32-K36 VanDerWaalsContact O-N 3.14Å | ||
| 33 | F | 96.7 | Very high | 88 | Confident | 117 Ų | 117 | 114.2 Ų | 114.2 | 51% | 0.513 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -60.4 | -40.6 | 179.8 | 178 | -90.7 | 0 | 0 | 0 | 112.5 | K36 Y37 V41 | F33-K36 PolarHBondContact O-N 2.96Å; F33-Y37 AromaticContact CD2-CD2 3.47Å; F33-Y37 HydrophobicContact CD2-CD2 3.47Å; F33-Y37 VanDerWaalsContact CD2-CD2 3.47Å; F33-Y37 HydrophobicContact CD2-CE2 4.1Å; F33-Y37 HydrophobicContact CD2-CG 4.41Å; F33-Y37 AromaticContact CE2-CD2 3.55Å; F33-Y37 HydrophobicContact CE2-CD2 3.55Å; F33-Y37 HydrophobicContact CE2-CE2 4.3Å; F33-Y37 HydrophobicContact CE2-CG 4.12Å; F33-Y37 HydrophobicContact CG-CD2 4.12Å; F33-Y37 HydrophobicContact CZ-CD2 4.25Å; F33-Y37 HydrophobicContact CZ-CG 4.45Å; F33-Y37 WeakPolarHBondContact O-CB 3.43Å; F33-Y37 WeakPolarHBondContact O-CD2 3.42Å; F33-Y37 PolarHBondContact O-N 2.97Å; F33-V41 HydrophobicContact CE1-CG2 4.49Å; F33-V41 HydrophobicContact CZ-CG2 4.21Å |
| 34 | H | 97.3 | Very high | 89 | Confident | 135 Ų | 135 | 107.4 Ų | 107.4 | 63% | 0.625 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -72.4 | -36 | -177.2 | -58.7 | -71.4 | 0 | 0 | 0 | 111 | D32 K36 G38 | D32-H34 VanDerWaalsContact C-N 3.3Å; D32-H34 PolarHBondContact O-N 3.14Å; D32-H34 WeakPolarHBondContact OD1-CA 3.44Å; D32-H34 WeakPolarHBondContact OD1-CB 3.5Å; D32-H34 IonicContact OD1-CD2 3.98Å; D32-H34 PolarHBondContact OD1-N 3.03Å; H34-K36 VanDerWaalsContact C-N 3.28Å; H34-K36 PolarHBondContact O-N 3.42Å; H34-G38 VanDerWaalsContact O-CA 3.28Å; H34-G38 WeakPolarHBondContact O-CA 3.4Å; H34-G38 PolarHBondContact O-N 2.87Å |
| 35 | D | 95.8 | Very high | 90.2 | Very high | 81 Ų | 81 | 102.8 Ų | 102.8 | 43% | 0.433 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.2 | -37.1 | 172.9 | -63.6 | -41.3 | 0 | 0 | 0 | 111.6 | R29 P31 D32 | R29-D35 IonicContact CZ-OD1 3.6Å; R29-D35 IonicContact CZ-OD2 3.97Å; R29-D35 IonicContact NE-OD2 2.89Å; R29-D35 VanDerWaalsContact NH2-CG 3.32Å; R29-D35 IonicContact NH2-OD1 2.97Å; R29-D35 PolarHBondContact NH2-OD1 3.29Å; R29-D35 IonicContact NH2-OD2 3.82Å; R29-D35 PolarHBondContact NH2-OD2 3.26Å; P31-D35 WeakPolarHBondContact CA-OD2 3.48Å; P31-D35 HydrophobicContact CB-CB 3.76Å; D32-D35 PolarHBondContact N-OD2 2.92Å; D32-D35 PolarHBondContact O-N 3.14Å; D32-D35 PolarHBondContact OD1-N 3.06Å |
| 36 | K | 96.9 | Very high | 91.6 | Very high | 123 Ų | 123 | 100.6 Ų | 100.6 | 54% | 0.535 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -85.7 | -39.7 | -177.5 | -70.6 | 179 | -178.2 | 179.3 | 0 | 114.3 | P31 D32 F33 H34 | P31-K36 HydrophobicContact CB-CG 4.03Å; P31-K36 WeakPolarHBondContact O-CE 3.28Å; D32-K36 WeakPolarHBondContact O-CG 3.19Å; D32-K36 PolarHBondContact O-N 3.43Å; D32-K36 VanDerWaalsContact O-N 3.14Å; F33-K36 PolarHBondContact O-N 2.96Å; H34-K36 VanDerWaalsContact C-N 3.28Å; H34-K36 PolarHBondContact O-N 3.42Å |
| 37 | Y | 98.3 | Very high | 93.1 | Very high | 122 Ų | 122 | 98 Ų | 98 | 48% | 0.478 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -127.7 | -10.7 | -166 | -53.3 | -69.3 | 0 | 0 | 0 | 113.5 | F33 N39 A40 V41 | F33-Y37 AromaticContact CD2-CD2 3.47Å; F33-Y37 HydrophobicContact CD2-CD2 3.47Å; F33-Y37 VanDerWaalsContact CD2-CD2 3.47Å; F33-Y37 HydrophobicContact CD2-CE2 4.1Å; F33-Y37 HydrophobicContact CD2-CG 4.41Å; F33-Y37 AromaticContact CE2-CD2 3.55Å; F33-Y37 HydrophobicContact CE2-CD2 3.55Å; F33-Y37 HydrophobicContact CE2-CE2 4.3Å; F33-Y37 HydrophobicContact CE2-CG 4.12Å; F33-Y37 HydrophobicContact CG-CD2 4.12Å; F33-Y37 HydrophobicContact CZ-CD2 4.25Å; F33-Y37 HydrophobicContact CZ-CG 4.45Å; F33-Y37 WeakPolarHBondContact O-CB 3.43Å; F33-Y37 WeakPolarHBondContact O-CD2 3.42Å; F33-Y37 PolarHBondContact O-N 2.97Å; Y37-N39 VanDerWaalsContact C-N 3.34Å; Y37-N39 PolarHBondContact O-N 3.36Å; Y37-A40 PolarHBondContact O-N 2.89Å; Y37-V41 WeakPolarHBondContact O-CB 3.49Å; Y37-V41 WeakPolarHBondContact O-CG2 3.28Å; Y37-V41 PolarHBondContact O-N 2.9Å |
| 38 | G | 98.3 | Very high | 94.4 | Very high | 19 Ų | 19 | 98.2 Ų | 98.2 | 20% | 0.196 | 53% | 0.533 | C | S | . | . | H | α-helix | trans | -53.3 | -49.1 | -172.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | H34 A40 L42 | H34-G38 VanDerWaalsContact O-CA 3.28Å; H34-G38 WeakPolarHBondContact O-CA 3.4Å; H34-G38 PolarHBondContact O-N 2.87Å; G38-A40 PolarHBondContact O-N 2.84Å; G38-L42 WeakPolarHBondContact O-CB 3.49Å; G38-L42 PolarHBondContact O-N 2.9Å |
| 39 | N | 98.5 | Very high | 96 | Very high | 141 Ų | 141 | 92.2 Ų | 92.2 | 75% | 0.754 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.9 | -40.3 | 178.9 | -68.8 | -19 | 0 | 0 | 0 | 112.7 | Y37 A43 | Y37-N39 VanDerWaalsContact C-N 3.34Å; Y37-N39 PolarHBondContact O-N 3.36Å; N39-A43 VanDerWaalsContact O-CB 3.26Å; N39-A43 WeakPolarHBondContact O-CB 3.26Å; N39-A43 PolarHBondContact O-N 2.94Å |
| 40 | A | 98.6 | Very high | 97 | Very high | 68 Ų | 68 | 89 Ų | 89 | 56% | 0.562 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -69.3 | -43.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y37 G38 G44 | Y37-A40 PolarHBondContact O-N 2.89Å; G38-A40 PolarHBondContact O-N 2.84Å; A40-G44 PolarHBondContact O-N 3.25Å |
| 41 | V | 98.8 | Very high | 97.6 | Very high | 85 Ų | 85 | 86.4 Ų | 86.4 | 52% | 0.515 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.7 | -43.9 | 175.4 | 171.9 | 0 | 0 | 0 | 0 | 110.3 | F33 Y37 G45 | F33-V41 HydrophobicContact CE1-CG2 4.49Å; F33-V41 HydrophobicContact CZ-CG2 4.21Å; Y37-V41 WeakPolarHBondContact O-CB 3.49Å; Y37-V41 WeakPolarHBondContact O-CG2 3.28Å; Y37-V41 PolarHBondContact O-N 2.9Å; V41-G45 WeakPolarHBondContact O-CA 3.41Å; V41-G45 PolarHBondContact O-N 3.3Å |
| 42 | L | 98.8 | Very high | 98 | Very high | 124 Ų | 124 | 85.9 Ų | 85.9 | 65% | 0.649 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.9 | -52.4 | 179.1 | -179.3 | 61.2 | 0 | 0 | 0 | 111.4 | G38 A46 | G38-L42 WeakPolarHBondContact O-CB 3.49Å; G38-L42 PolarHBondContact O-N 2.9Å; L42-A46 VanDerWaalsContact O-CB 3.22Å; L42-A46 WeakPolarHBondContact O-CB 3.45Å; L42-A46 PolarHBondContact O-N 2.8Å |
| 43 | A | 98.8 | Very high | 98.3 | Very high | 59 Ų | 59 | 90.9 Ų | 90.9 | 49% | 0.488 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.5 | -50.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | N39 G45 A46 T47 | N39-A43 VanDerWaalsContact O-CB 3.26Å; N39-A43 WeakPolarHBondContact O-CB 3.26Å; N39-A43 PolarHBondContact O-N 2.94Å; A43-G45 PolarHBondContact O-N 3.41Å; A43-A46 PolarHBondContact O-N 2.82Å; A43-T47 WeakPolarHBondContact O-CB 3.45Å; A43-T47 PolarHBondContact O-N 3.48Å; A43-T47 PolarHBondContact O-OG1 3.05Å |
| 44 | G | 98.8 | Very high | 98.4 | Very high | 42 Ų | 42 | 88.9 Ų | 88.9 | 43% | 0.433 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.3 | -44.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | A40 T47 F48 | A40-G44 PolarHBondContact O-N 3.25Å; G44-T47 PolarHBondContact O-N 2.92Å; G44-F48 VanDerWaalsContact O-CB 3.28Å; G44-F48 WeakPolarHBondContact O-CB 3.29Å; G44-F48 PolarHBondContact O-N 3.48Å |
| 45 | G | 98.8 | Very high | 98.5 | Very high | 39 Ų | 39 | 89 Ų | 89 | 40% | 0.402 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.8 | -42.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | V41 A43 C49 | V41-G45 WeakPolarHBondContact O-CA 3.41Å; V41-G45 PolarHBondContact O-N 3.3Å; A43-G45 PolarHBondContact O-N 3.41Å; G45-C49 WeakPolarHBondContact O-CB 3.38Å; G45-C49 PolarHBondContact O-N 2.9Å |
| 46 | A | 98.9 | Very high | 98.6 | Very high | 45 Ų | 45 | 87 Ų | 87 | 37% | 0.372 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.2 | -47.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | L42 A43 F48 C49 I50 | L42-A46 VanDerWaalsContact O-CB 3.22Å; L42-A46 WeakPolarHBondContact O-CB 3.45Å; L42-A46 PolarHBondContact O-N 2.8Å; A43-A46 PolarHBondContact O-N 2.82Å; A46-F48 PolarHBondContact O-N 3.34Å; A46-C49 PolarHBondContact O-N 2.93Å; A46-I50 WeakPolarHBondContact O-CB 3.47Å; A46-I50 VanDerWaalsContact O-CG1 3.31Å; A46-I50 WeakPolarHBondContact O-CG1 3.37Å; A46-I50 PolarHBondContact O-N 3.32Å |
| 47 | T | 98.9 | Very high | 98.7 | Very high | 98 Ų | 98 | 82.8 Ų | 82.8 | 60% | 0.601 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -59.8 | -47.9 | 177.8 | -61.9 | 0 | 0 | 0 | 0 | 111.5 | A43 G44 A51 | A43-T47 WeakPolarHBondContact O-CB 3.45Å; A43-T47 PolarHBondContact O-N 3.48Å; A43-T47 PolarHBondContact O-OG1 3.05Å; G44-T47 PolarHBondContact O-N 2.92Å; T47-A51 VanDerWaalsContact O-CB 3.23Å; T47-A51 WeakPolarHBondContact O-CB 3.25Å; T47-A51 PolarHBondContact O-N 2.89Å |
| 48 | F | 98.8 | Very high | 98.7 | Very high | 146 Ų | 146 | 81 Ų | 81 | 64% | 0.64 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -59.7 | -50.3 | 178 | 173 | -103 | 0 | 0 | 0 | 111.5 | G44 A46 I50 A51 T52 | G44-F48 VanDerWaalsContact O-CB 3.28Å; G44-F48 WeakPolarHBondContact O-CB 3.29Å; G44-F48 PolarHBondContact O-N 3.48Å; A46-F48 PolarHBondContact O-N 3.34Å; F48-I50 PolarHBondContact O-N 2.95Å; F48-A51 PolarHBondContact O-N 3.39Å; F48-T52 WeakPolarHBondContact CE2-OG1 3.44Å; F48-T52 WeakPolarHBondContact O-CB 3.31Å; F48-T52 PolarHBondContact O-N 3.08Å; F48-T52 PolarHBondContact O-OG1 3.37Å |
| 49 | C | 98.8 | Very high | 98.7 | Very high | 62 Ų | 62 | 86 Ų | 86 | 42% | 0.419 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -57.7 | -50.7 | -178.8 | -175.9 | 0 | 0 | 0 | 0 | 111.6 | G45 A46 W53 | G45-C49 WeakPolarHBondContact O-CB 3.38Å; G45-C49 PolarHBondContact O-N 2.9Å; A46-C49 PolarHBondContact O-N 2.93Å; C49-W53 WeakPolarHBondContact O-CB 3.36Å; C49-W53 PolarHBondContact O-N 3.45Å |
| 50 | I | 98.8 | Very high | 98.7 | Very high | 113 Ų | 113 | 83.9 Ų | 83.9 | 58% | 0.579 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -62.9 | -46.8 | -179.5 | -67.4 | 167.8 | 0 | 0 | 0 | 110.5 | A46 F48 T54 | A46-I50 WeakPolarHBondContact O-CB 3.47Å; A46-I50 VanDerWaalsContact O-CG1 3.31Å; A46-I50 WeakPolarHBondContact O-CG1 3.37Å; A46-I50 PolarHBondContact O-N 3.32Å; F48-I50 PolarHBondContact O-N 2.95Å; I50-T54 WeakPolarHBondContact O-CB 3.48Å; I50-T54 PolarHBondContact O-N 2.96Å; I50-T54 PolarHBondContact O-OG1 3.45Å |
| 51 | A | 98.8 | Very high | 98.6 | Very high | 56 Ų | 56 | 84 Ų | 84 | 46% | 0.463 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.9 | -49.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | T47 F48 T54 Y55 | T47-A51 VanDerWaalsContact O-CB 3.23Å; T47-A51 WeakPolarHBondContact O-CB 3.25Å; T47-A51 PolarHBondContact O-N 2.89Å; F48-A51 PolarHBondContact O-N 3.39Å; A51-T54 PolarHBondContact O-N 2.96Å; A51-Y55 WeakPolarHBondContact O-CB 3.37Å; A51-Y55 PolarHBondContact O-N 3.03Å |
| 52 | T | 98.9 | Very high | 98.6 | Very high | 58 Ų | 58 | 83 Ų | 83 | 36% | 0.356 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.8 | -47.5 | -179.2 | -62 | 0 | 0 | 0 | 0 | 111.6 | F48 T54 Y55 V56 | F48-T52 WeakPolarHBondContact CE2-OG1 3.44Å; F48-T52 WeakPolarHBondContact O-CB 3.31Å; F48-T52 PolarHBondContact O-N 3.08Å; F48-T52 PolarHBondContact O-OG1 3.37Å; T52-T54 PolarHBondContact O-N 3.43Å; T52-Y55 PolarHBondContact O-N 2.91Å; T52-V56 WeakPolarHBondContact O-CG2 3.49Å; T52-V56 PolarHBondContact O-N 3.35Å |
| 53 | W | 98.8 | Very high | 98.6 | Very high | 175 Ų | 175 | 85.4 Ų | 85.4 | 66% | 0.663 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -69.8 | -33.4 | -179.5 | -82.5 | 106.6 | 0 | 0 | 0 | 113 | C49 V56 A57 | C49-W53 WeakPolarHBondContact O-CB 3.36Å; C49-W53 PolarHBondContact O-N 3.45Å; W53-V56 HydrophobicContact CE3-CB 4.44Å; W53-V56 HydrophobicContact CE3-CG1 4.29Å; W53-V56 HydrophobicContact CZ3-CG1 4.28Å; W53-V56 PolarHBondContact O-N 3.46Å; W53-A57 VanDerWaalsContact O-CB 3.24Å; W53-A57 WeakPolarHBondContact O-CB 3.35Å; W53-A57 PolarHBondContact O-N 3.35Å |
| 54 | T | 98.8 | Very high | 98.5 | Very high | 75 Ų | 75 | 89.7 Ų | 89.7 | 46% | 0.46 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.6 | -47 | 171.9 | -59.1 | 0 | 0 | 0 | 0 | 110.3 | I50 A51 T52 V56 A57 T58 | I50-T54 WeakPolarHBondContact O-CB 3.48Å; I50-T54 PolarHBondContact O-N 2.96Å; I50-T54 PolarHBondContact O-OG1 3.45Å; A51-T54 PolarHBondContact O-N 2.96Å; T52-T54 PolarHBondContact O-N 3.43Å; T54-V56 PolarHBondContact O-N 3.42Å; T54-A57 PolarHBondContact O-N 3Å; T54-A57 VanDerWaalsContact O-N 3.14Å; T54-T58 PolarHBondContact O-N 3.29Å; T54-T58 PolarHBondContact O-OG1 3.03Å; T54-T58 VanDerWaalsContact O-OG1 3.1Å |
| 55 | Y | 98.7 | Very high | 98.5 | Very high | 137 Ų | 137 | 94.3 Ų | 94.3 | 54% | 0.537 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -58.9 | -46.8 | 176.8 | -179.4 | -88.9 | 0 | 0 | 0 | 112.1 | A51 T52 A57 T58 Q59 I60 | A51-Y55 WeakPolarHBondContact O-CB 3.37Å; A51-Y55 PolarHBondContact O-N 3.03Å; T52-Y55 PolarHBondContact O-N 2.91Å; Y55-A57 VanDerWaalsContact C-N 3.3Å; Y55-A57 PolarHBondContact O-N 3.5Å; Y55-T58 PolarHBondContact O-N 3.13Å; Y55-Q59 HydrophobicContact CD1-CB 4.37Å; Y55-Q59 HydrophobicContact CD2-CB 3.62Å; Y55-Q59 HydrophobicContact CD2-CG 3.5Å; Y55-Q59 HydrophobicContact CE1-CB 4.27Å; Y55-Q59 HydrophobicContact CE2-CB 3.51Å; Y55-Q59 HydrophobicContact CE2-CG 3.77Å; Y55-Q59 HydrophobicContact CG-CB 4.05Å; Y55-Q59 HydrophobicContact CG-CG 4.12Å; Y55-Q59 WeakPolarHBondContact O-CA 3.28Å; Y55-Q59 VanDerWaalsContact O-CB 3.25Å; Y55-Q59 WeakPolarHBondContact O-CB 3.46Å; Y55-Q59 PolarHBondContact O-N 3.19Å; Y55-I60 HydrophobicContact CD1-CG2 4.13Å; Y55-I60 HydrophobicContact CE1-CG2 3.6Å |
| 56 | V | 98.6 | Very high | 98.4 | Very high | 40 Ų | 40 | 97.9 Ų | 97.9 | 24% | 0.242 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -59.8 | -43.6 | 175.1 | 169.3 | 0 | 0 | 0 | 0 | 110.7 | T52 W53 T54 T58 I60 I62 | T52-V56 WeakPolarHBondContact O-CG2 3.49Å; T52-V56 PolarHBondContact O-N 3.35Å; W53-V56 HydrophobicContact CE3-CB 4.44Å; W53-V56 HydrophobicContact CE3-CG1 4.29Å; W53-V56 HydrophobicContact CZ3-CG1 4.28Å; W53-V56 PolarHBondContact O-N 3.46Å; T54-V56 PolarHBondContact O-N 3.42Å; V56-T58 VanDerWaalsContact C-N 3.31Å; V56-T58 PolarHBondContact O-N 2.89Å; V56-I60 HydrophobicContact CB-CD1 4.5Å; V56-I60 HydrophobicContact CG1-CD1 3.98Å; V56-I60 WeakPolarHBondContact O-CG1 3.4Å; V56-I62 HydrophobicContact CG1-CD1 3.87Å; V56-I62 VanDerWaalsContact O-CD1 3.26Å; V56-I62 WeakPolarHBondContact O-CD1 3.44Å |
| 57 | A | 98.5 | Very high | 98.3 | Very high | 34 Ų | 34 | 98.9 Ų | 98.9 | 28% | 0.281 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -67.4 | -30.3 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | W53 T54 Y55 W64 | W53-A57 VanDerWaalsContact O-CB 3.24Å; W53-A57 WeakPolarHBondContact O-CB 3.35Å; W53-A57 PolarHBondContact O-N 3.35Å; T54-A57 PolarHBondContact O-N 3Å; T54-A57 VanDerWaalsContact O-N 3.14Å; Y55-A57 VanDerWaalsContact C-N 3.3Å; Y55-A57 PolarHBondContact O-N 3.5Å; A57-W64 HydrophobicContact CB-CZ2 4.11Å; A57-W64 PolarHBondContact O-NE1 3Å |
| 58 | T | 98.1 | Very high | 98.3 | Very high | 86 Ų | 86 | 97.9 Ų | 97.9 | 53% | 0.528 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -118.4 | -27.3 | -170.3 | 68.2 | 0 | 0 | 0 | 0 | 115.1 | T54 Y55 V56 | T54-T58 PolarHBondContact O-N 3.29Å; T54-T58 PolarHBondContact O-OG1 3.03Å; T54-T58 VanDerWaalsContact O-OG1 3.1Å; Y55-T58 PolarHBondContact O-N 3.13Å; V56-T58 VanDerWaalsContact C-N 3.31Å; V56-T58 PolarHBondContact O-N 2.89Å |
| 59 | Q | 98.4 | Very high | 98.3 | Very high | 122 Ų | 122 | 96.7 Ų | 96.7 | 57% | 0.57 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -104.5 | -17.4 | -165 | -56.1 | -53.6 | 110.8 | 0 | 0 | 115.1 | Y55 | Y55-Q59 HydrophobicContact CD1-CB 4.37Å; Y55-Q59 HydrophobicContact CD2-CB 3.62Å; Y55-Q59 HydrophobicContact CD2-CG 3.5Å; Y55-Q59 HydrophobicContact CE1-CB 4.27Å; Y55-Q59 HydrophobicContact CE2-CB 3.51Å; Y55-Q59 HydrophobicContact CE2-CG 3.77Å; Y55-Q59 HydrophobicContact CG-CB 4.05Å; Y55-Q59 HydrophobicContact CG-CG 4.12Å; Y55-Q59 WeakPolarHBondContact O-CA 3.28Å; Y55-Q59 VanDerWaalsContact O-CB 3.25Å; Y55-Q59 WeakPolarHBondContact O-CB 3.46Å; Y55-Q59 PolarHBondContact O-N 3.19Å |
| 60 | I | 98.2 | Very high | 98.2 | Very high | 98 Ų | 98 | 97.9 Ų | 97.9 | 50% | 0.503 | 55% | 0.55 | S | S | . | * | S | Bend | trans | -98.8 | 9.1 | -176.2 | 73.7 | 177.2 | 0 | 0 | 0 | 113.7 | Y55 V56 I62 | Y55-I60 HydrophobicContact CD1-CG2 4.13Å; Y55-I60 HydrophobicContact CE1-CG2 3.6Å; V56-I60 HydrophobicContact CB-CD1 4.5Å; V56-I60 HydrophobicContact CG1-CD1 3.98Å; V56-I60 WeakPolarHBondContact O-CG1 3.4Å; I60-I62 HydrophobicContact CD1-CD1 4.12Å; I60-I62 HydrophobicContact CD1-CG1 4.09Å; I60-I62 HydrophobicContact CG1-CD1 4.2Å; I60-I62 HydrophobicContact CG1-CG1 3.76Å |
| 61 | G | 97.8 | Very high | 98.1 | Very high | 70 Ų | 70 | 100.5 Ų | 100.5 | 72% | 0.722 | 55% | 0.553 | S | S | * | * | trans | 76 | 30.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | E63 | G61-E63 PolarHBondContact O-N 3.37Š| ||
| 62 | I | 98.2 | Very high | 98.1 | Very high | 65 Ų | 65 | 102.5 Ų | 102.5 | 33% | 0.333 | 56% | 0.559 | S | S | . | * | trans | -61.9 | 121.8 | 171.9 | -60.7 | -178.1 | 0 | 0 | 0 | 109.1 | V56 I60 W64 | V56-I62 HydrophobicContact CG1-CD1 3.87Å; V56-I62 VanDerWaalsContact O-CD1 3.26Å; V56-I62 WeakPolarHBondContact O-CD1 3.44Å; I60-I62 HydrophobicContact CD1-CD1 4.12Å; I60-I62 HydrophobicContact CD1-CG1 4.09Å; I60-I62 HydrophobicContact CG1-CD1 4.2Å; I60-I62 HydrophobicContact CG1-CG1 3.76Å; I62-W64 HydrophobicContact CB-CZ2 4.22Å; I62-W64 HydrophobicContact CD1-CH2 4.48Å; I62-W64 HydrophobicContact CD1-CZ2 3.97Å; I62-W64 HydrophobicContact CG2-CD2 3.81Å; I62-W64 HydrophobicContact CG2-CE3 4.23Å; I62-W64 HydrophobicContact CG2-CG 4.27Å; I62-W64 HydrophobicContact CG2-CH2 4.2Å; I62-W64 HydrophobicContact CG2-CZ2 3.77Å; I62-W64 HydrophobicContact CG2-CZ3 4.41Å; I62-W64 PolarHBondContact O-N 2.93Å | ||
| 63 | E | 98 | Very high | 98 | Very high | 173 Ų | 173 | 105.9 Ų | 105.9 | 81% | 0.808 | 58% | 0.58 | S | S | * | * | trans | -80.9 | 103.8 | 171.3 | -170.9 | 171.5 | -174 | 0 | 0 | 109.8 | G61 | G61-E63 PolarHBondContact O-N 3.37Š| ||
| 64 | W | 97.8 | Very high | 97.9 | Very high | 149 Ų | 149 | 103.4 Ų | 103.4 | 56% | 0.564 | 59% | 0.586 | S | S | * | * | trans | -81.4 | -16.1 | -179.6 | -67 | 105.9 | 0 | 0 | 0 | 114.1 | A57 I62 L66 | A57-W64 HydrophobicContact CB-CZ2 4.11Å; A57-W64 PolarHBondContact O-NE1 3Å; I62-W64 HydrophobicContact CB-CZ2 4.22Å; I62-W64 HydrophobicContact CD1-CH2 4.48Å; I62-W64 HydrophobicContact CD1-CZ2 3.97Å; I62-W64 HydrophobicContact CG2-CD2 3.81Å; I62-W64 HydrophobicContact CG2-CE3 4.23Å; I62-W64 HydrophobicContact CG2-CG 4.27Å; I62-W64 HydrophobicContact CG2-CH2 4.2Å; I62-W64 HydrophobicContact CG2-CZ2 3.77Å; I62-W64 HydrophobicContact CG2-CZ3 4.41Å; I62-W64 PolarHBondContact O-N 2.93Å; W64-L66 VanDerWaalsContact C-N 3.26Å; W64-L66 HydrophobicContact CB-CD2 4.02Å; W64-L66 HydrophobicContact CB-CG 3.91Å; W64-L66 PolarHBondContact O-N 3.01Å | ||
| 65 | N | 97.6 | Very high | 97.7 | Very high | 140 Ų | 140 | 108.7 Ų | 108.7 | 75% | 0.749 | 60% | 0.603 | S | S | * | * | trans | 42.5 | 49.9 | -177 | -167.6 | 25.6 | 0 | 0 | 0 | 113.6 | ||||
| 66 | L | 97.2 | Very high | 97.6 | Very high | 114 Ų | 114 | 110.1 Ų | 110.1 | 60% | 0.597 | 61% | 0.614 | S | S | * | * | trans | -66.1 | 158.6 | -179.5 | -59.6 | 179.7 | 0 | 0 | 0 | 111.1 | W64 | W64-L66 VanDerWaalsContact C-N 3.26Å; W64-L66 HydrophobicContact CB-CD2 4.02Å; W64-L66 HydrophobicContact CB-CG 3.91Å; W64-L66 PolarHBondContact O-N 3.01Å | ||
| 67 | S | 97.6 | Very high | 97.4 | Very high | 65 Ų | 65 | 118.9 Ų | 118.9 | 46% | 0.455 | 64% | 0.643 | S | S | . | * | trans | -49.9 | 131.6 | 179.8 | 176.5 | 0 | 0 | 0 | 0 | 112.3 | V69 R71 | S67-V69 VanDerWaalsContact C-N 3.25Å; S67-V69 PolarHBondContact O-N 3.47Å; S67-V69 PolarHBondContact OG-N 3.23Å; S67-R71 PolarHBondContact O-NH1 3.04Å | ||
| 68 | P | 97.6 | Very high | 97.1 | Very high | 78 Ų | 78 | 126.6 Ų | 126.6 | 51% | 0.506 | 67% | 0.665 | S | S | . | * | trans | -75.5 | -15.4 | -179.3 | 30.8 | -35.6 | 0 | 0 | 0 | 112.9 | G70 R71 V72 | P68-G70 PolarHBondContact O-N 3.48Å; P68-R71 PolarHBondContact O-N 3.04Å; P68-V72 HydrophobicContact CB-CB 3.99Å; P68-V72 HydrophobicContact CB-CG2 3.95Å; P68-V72 PolarHBondContact O-N 3.39Å | ||
| 69 | V | 98.2 | Very high | 96.2 | Very high | 120 Ų | 120 | 129.7 Ų | 129.7 | 73% | 0.727 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.2 | 121.4 | -177.2 | -179.3 | 0 | 0 | 0 | 0 | 110.2 | S67 R71 | S67-V69 VanDerWaalsContact C-N 3.25Å; S67-V69 PolarHBondContact O-N 3.47Å; S67-V69 PolarHBondContact OG-N 3.23Å; V69-R71 PolarHBondContact O-N 2.98Å |
| 70 | G | 97.3 | Very high | 94.8 | Very high | 88 Ų | 88 | 136.7 Ų | 136.7 | 91% | 0.907 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 72.3 | 7.6 | -178.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | P68 | P68-G70 PolarHBondContact O-N 3.48Š|
| 71 | R | 97.5 | Very high | 94.6 | Very high | 168 Ų | 168 | 138.7 Ų | 138.7 | 63% | 0.634 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.8 | -38.3 | 179.5 | -63.7 | -172.4 | -177.9 | 95 | 2.2 | 113.7 | S67 P68 V69 | S67-R71 PolarHBondContact O-NH1 3.04Å; P68-R71 PolarHBondContact O-N 3.04Å; V69-R71 PolarHBondContact O-N 2.98Å |
| 72 | V | 97.7 | Very high | 94.5 | Very high | 98 Ų | 98 | 142.3 Ų | 142.3 | 59% | 0.594 | 72% | 0.721 | S | S | * | * | trans | -111.8 | 128.6 | -175.6 | -179.6 | 0 | 0 | 0 | 0 | 109.5 | P68 P74 | P68-V72 HydrophobicContact CB-CB 3.99Å; P68-V72 HydrophobicContact CB-CG2 3.95Å; P68-V72 PolarHBondContact O-N 3.39Å; V72-P74 WeakPolarHBondContact O-CD 3.45Å | ||
| 73 | T | 97.5 | Very high | 94.3 | Very high | 129 Ų | 129 | 146.6 Ų | 146.6 | 79% | 0.791 | 74% | 0.743 | S | S | * | * | trans | -79.6 | 119.6 | 170.5 | -56.3 | 0 | 0 | 0 | 0 | 109.1 | K75 | T73-K75 PolarHBondContact O-N 3.08Š| ||
| 74 | P | 96.6 | Very high | 94 | Very high | 122 Ų | 122 | 145 Ų | 145 | 79% | 0.792 | 74% | 0.739 | S | S | * | * | trans | -58.8 | 138.8 | 176.7 | -23.8 | 34.8 | 0 | 0 | 0 | 111.4 | V72 | V72-P74 WeakPolarHBondContact O-CD 3.45Š| ||
| 75 | K | 95 | Very high | 93.8 | Very high | 187 Ų | 187 | 144.8 Ų | 144.8 | 81% | 0.813 | 75% | 0.75 | S | S | * | * | trans | -117.6 | 132.3 | 175.6 | -175.2 | 179.8 | 176.4 | -178 | 0 | 109 | T73 W77 | T73-K75 PolarHBondContact O-N 3.08Å; K75-W77 PolarHBondContact O-N 3.4Å | ||
| 76 | E | 96.1 | Very high | 93.5 | Very high | 166 Ų | 166 | 145.1 Ų | 145.1 | 78% | 0.776 | 75% | 0.75 | S | S | * | * | trans | -57.7 | 126.1 | 170.8 | -69.1 | -56.8 | 147.8 | 0 | 0 | 109.6 | ||||
| 77 | W | 94.5 | Very high | 93.3 | Very high | 225 Ų | 225 | 147.3 Ų | 147.3 | 85% | 0.852 | 76% | 0.761 | S | S | * | * | trans | -106.3 | -13.5 | -171.4 | 63.6 | -90 | 0 | 0 | 0 | 113 | K75 | K75-W77 PolarHBondContact O-N 3.4Š| ||
| 78 | R | 92.4 | Very high | 93 | Very high | 196 Ų | 196 | 153.6 Ų | 153.6 | 74% | 0.74 | 78% | 0.784 | S | S | * | * | trans | -106.7 | 123.1 | 177.7 | -171.7 | 174.7 | -178.8 | -178 | 1.3 | 109.8 | ||||
| 79 | N | 78.3 | Confident | 92.6 | Very high | 151 Ų | 151 | 159.9 Ų | 159.9 | 81% | 0.807 | 81% | 0.808 | S | S | * | * | trans | -74.4 | 137.5 | 167.1 | -62.6 | -27.9 | 0 | 0 | 0 | 108.7 | ||||
| 80 | Q | 69.8 | Low | 92.1 | Very high | 269 Ų | 269 | 163.5 Ų | 163.5 | 100% | 1.257 | 82% | 0.815 | S | S | * | * | trans | -64.4 | 0 | 174.2 | -73.3 | -175.4 | -6.7 | 0 | 0 | 111.3 |
Retrieved 80 of 80 residues in 29.2 ms
(Link to these results)