| 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 | 38.6 | Very low | 53.5 | Low | 248 Ų | 248 | 134.5 Ų | 134.5 | 100% | 1.222 | 70% | 0.699 | S | S | * | * | 0 | 80.3 | 0 | -79.9 | -168.3 | 158.9 | 0 | 0 | 109 | |||||
| 2 | S | 39.2 | Very low | 54.9 | Low | 85 Ų | 85 | 128 Ų | 128 | 59% | 0.594 | 68% | 0.68 | S | S | * | * | trans | -172.3 | 94.7 | 156.2 | 62.9 | 0 | 0 | 0 | 0 | 104.7 | Y4 | S2-Y4 VanDerWaalsContact C-N 3.35Å; S2-Y4 PolarHBondContact O-N 3.37Å | ||
| 3 | D | 44.2 | Very low | 56.1 | Low | 175 Ų | 175 | 124.2 Ų | 124.2 | 94% | 0.936 | 67% | 0.665 | S | S | * | * | trans | -66.5 | 97.2 | 174.1 | -77.9 | -34.4 | 0 | 0 | 0 | 107.8 | ||||
| 4 | Y | 46.2 | Very low | 57.2 | Low | 197 Ų | 197 | 119.7 Ų | 119.7 | 77% | 0.773 | 65% | 0.647 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 133.8 | 167.3 | -86.4 | -90.6 | 0 | 0 | 0 | 108.1 | S2 K6 | S2-Y4 VanDerWaalsContact C-N 3.35Å; S2-Y4 PolarHBondContact O-N 3.37Å; Y4-K6 PolarHBondContact O-N 3.03Å |
| 5 | P | 51.5 | Low | 58.3 | Low | 69 Ų | 69 | 116 Ų | 116 | 45% | 0.448 | 63% | 0.633 | S | S | . | * | P | Polyproline II helix | trans | -59 | 136.4 | 177.9 | -11.2 | 23.1 | 0 | 0 | 0 | 108.9 | E9 L10 | P5-E9 HydrophobicContact CB-CB 4.4Å; P5-L10 HydrophobicContact CB-CG 4.37Å |
| 6 | K | 56.5 | Low | 59.3 | Low | 160 Ų | 160 | 114.4 Ų | 114.4 | 70% | 0.696 | 63% | 0.632 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 142.9 | 178.5 | -71.7 | 174.1 | -178.7 | 171.2 | 0 | 108.3 | Y4 V8 E9 L10 | Y4-K6 PolarHBondContact O-N 3.03Å; K6-V8 PolarHBondContact O-N 3.27Å; K6-E9 PolarHBondContact N-OE2 3.41Å; K6-E9 WeakPolarHBondContact O-CB 3.47Å; K6-E9 PolarHBondContact O-N 3.33Å; K6-L10 PolarHBondContact O-N 2.99Å |
| 7 | L | 59.1 | Low | 60 | Low | 153 Ų | 153 | 114.2 Ų | 114.2 | 80% | 0.801 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -47.3 | -30 | -178.6 | -156.7 | 88.8 | 0 | 0 | 0 | 113.6 | S11 | L7-S11 PolarHBondContact O-N 3.44Å |
| 8 | V | 64.3 | Low | 60.9 | Low | 115 Ų | 115 | 115 Ų | 115 | 70% | 0.697 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -66.8 | -39.7 | 175.9 | -178.3 | 0 | 0 | 0 | 0 | 112.7 | K6 S11 A12 | K6-V8 PolarHBondContact O-N 3.27Å; V8-S11 PolarHBondContact O-N 3.44Å; V8-A12 PolarHBondContact O-N 3.05Å |
| 9 | E | 59.8 | Low | 62 | Low | 112 Ų | 112 | 114.1 Ų | 114.1 | 52% | 0.523 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -69.6 | -38.2 | 177.5 | -66.7 | 168.4 | 174.5 | 0 | 0 | 110.9 | P5 K6 A12 V13 | P5-E9 HydrophobicContact CB-CB 4.4Å; K6-E9 PolarHBondContact N-OE2 3.41Å; K6-E9 WeakPolarHBondContact O-CB 3.47Å; K6-E9 PolarHBondContact O-N 3.33Å; E9-A12 PolarHBondContact O-N 3.4Å; E9-V13 VanDerWaalsContact O-CG2 3.27Å; E9-V13 WeakPolarHBondContact O-CG2 3.48Å; E9-V13 PolarHBondContact O-N 3Å |
| 10 | L | 61.7 | Low | 62.9 | Low | 87 Ų | 87 | 113.5 Ų | 113.5 | 46% | 0.455 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -64.3 | -41.3 | 172.9 | -80.4 | 160.7 | 0 | 0 | 0 | 112 | P5 K6 V13 C14 | P5-L10 HydrophobicContact CB-CG 4.37Å; K6-L10 PolarHBondContact O-N 2.99Å; L10-V13 PolarHBondContact O-N 3.24Å; L10-C14 PolarHBondContact O-N 3.41Å; L10-C14 PolarHBondContact O-SG 2.93Å |
| 11 | S | 67.6 | Low | 63.6 | Low | 78 Ų | 78 | 112.4 Ų | 112.4 | 55% | 0.545 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -62.5 | -43.3 | 175.1 | -178 | 0 | 0 | 0 | 0 | 112.3 | L7 V8 V13 C14 S15 | L7-S11 PolarHBondContact O-N 3.44Å; V8-S11 PolarHBondContact O-N 3.44Å; S11-V13 PolarHBondContact O-N 3.01Å; S11-C14 PolarHBondContact O-N 2.85Å; S11-S15 PolarHBondContact O-N 3.46Å |
| 12 | A | 70.6 | Confident | 65.7 | Low | 57 Ų | 57 | 104.2 Ų | 104.2 | 47% | 0.471 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.7 | -40.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | V8 E9 S15 C16 | V8-A12 PolarHBondContact O-N 3.05Å; E9-A12 PolarHBondContact O-N 3.4Å; A12-S15 PolarHBondContact O-N 3.19Å; A12-C16 WeakPolarHBondContact O-CB 3.24Å; A12-C16 PolarHBondContact O-N 3.09Å; A12-C16 PolarHBondContact O-SG 3.38Å; A12-C16 VanDerWaalsContact O-SG 3.41Å |
| 13 | V | 70 | Confident | 67.8 | Low | 79 Ų | 79 | 106.5 Ų | 106.5 | 48% | 0.479 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.2 | -44.5 | 175.6 | 170.9 | 0 | 0 | 0 | 0 | 111.2 | E9 L10 S11 S15 C16 Q17 | E9-V13 VanDerWaalsContact O-CG2 3.27Å; E9-V13 WeakPolarHBondContact O-CG2 3.48Å; E9-V13 PolarHBondContact O-N 3Å; L10-V13 PolarHBondContact O-N 3.24Å; S11-V13 PolarHBondContact O-N 3.01Å; V13-S15 PolarHBondContact O-N 3.38Å; V13-C16 PolarHBondContact O-N 3.39Å; V13-Q17 HydrophobicContact CG1-CG 4.49Å; V13-Q17 WeakPolarHBondContact O-CB 3.48Å; V13-Q17 WeakPolarHBondContact O-CG 3.42Å; V13-Q17 PolarHBondContact O-N 3.47Å |
| 14 | C | 71.8 | Confident | 69.5 | Low | 61 Ų | 61 | 102.5 Ų | 102.5 | 41% | 0.412 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -60.7 | -43.9 | 175.4 | -69.3 | 0 | 0 | 0 | 0 | 111.8 | L10 S11 C16 Q17 E18 | L10-C14 PolarHBondContact O-N 3.41Å; L10-C14 PolarHBondContact O-SG 2.93Å; S11-C14 PolarHBondContact O-N 2.85Å; C14-C16 PolarHBondContact O-N 2.98Å; C14-Q17 WeakPolarHBondContact O-CB 3.48Å; C14-Q17 PolarHBondContact O-N 3.41Å; C14-Q17 VanDerWaalsContact O-N 3.17Å; C14-E18 WeakPolarHBondContact O-CG 3.43Å; C14-E18 PolarHBondContact O-N 2.79Å |
| 15 | S | 73.6 | Confident | 71.2 | Confident | 64 Ų | 64 | 98.5 Ų | 98.5 | 45% | 0.448 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64 | -41.4 | 177.3 | -177.1 | 0 | 0 | 0 | 0 | 112.1 | S11 A12 V13 Q17 E18 D19 | S11-S15 PolarHBondContact O-N 3.46Å; A12-S15 PolarHBondContact O-N 3.19Å; V13-S15 PolarHBondContact O-N 3.38Å; S15-Q17 VanDerWaalsContact C-N 3.29Å; S15-Q17 PolarHBondContact O-N 2.89Å; S15-E18 PolarHBondContact O-N 3.19Å; S15-D19 WeakPolarHBondContact O-CB 3.49Å; S15-D19 PolarHBondContact O-N 2.84Å |
| 16 | C | 73.6 | Confident | 72.7 | Confident | 90 Ų | 90 | 100.4 Ų | 100.4 | 61% | 0.608 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -64.2 | -34.7 | 174.1 | -74.9 | 0 | 0 | 0 | 0 | 112.5 | A12 V13 C14 L20 | A12-C16 WeakPolarHBondContact O-CB 3.24Å; A12-C16 PolarHBondContact O-N 3.09Å; A12-C16 PolarHBondContact O-SG 3.38Å; A12-C16 VanDerWaalsContact O-SG 3.41Å; V13-C16 PolarHBondContact O-N 3.39Å; C14-C16 PolarHBondContact O-N 2.98Å; C16-L20 WeakPolarHBondContact O-CB 3.42Å; C16-L20 PolarHBondContact O-N 2.88Å |
| 17 | Q | 71.8 | Confident | 73.7 | Confident | 112 Ų | 112 | 97.4 Ų | 97.4 | 52% | 0.523 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -69.2 | -42.8 | 175.3 | -76.6 | 177.8 | -23.4 | 0 | 0 | 111.8 | V13 C14 S15 L20 I21 | V13-Q17 HydrophobicContact CG1-CG 4.49Å; V13-Q17 WeakPolarHBondContact O-CB 3.48Å; V13-Q17 WeakPolarHBondContact O-CG 3.42Å; V13-Q17 PolarHBondContact O-N 3.47Å; C14-Q17 WeakPolarHBondContact O-CB 3.48Å; C14-Q17 PolarHBondContact O-N 3.41Å; C14-Q17 VanDerWaalsContact O-N 3.17Å; S15-Q17 VanDerWaalsContact C-N 3.29Å; S15-Q17 PolarHBondContact O-N 2.89Å; Q17-L20 PolarHBondContact O-N 3.48Å; Q17-I21 VanDerWaalsContact O-CG1 3.24Å; Q17-I21 WeakPolarHBondContact O-CG1 3.31Å; Q17-I21 PolarHBondContact O-N 3.33Å |
| 18 | E | 75.6 | Confident | 74.4 | Confident | 128 Ų | 128 | 93.6 Ų | 93.6 | 60% | 0.598 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.5 | -46.5 | 174.6 | -74 | 174.8 | 173.7 | 0 | 0 | 111.5 | C14 S15 L20 I21 V22 | C14-E18 WeakPolarHBondContact O-CG 3.43Å; C14-E18 PolarHBondContact O-N 2.79Å; S15-E18 PolarHBondContact O-N 3.19Å; E18-L20 VanDerWaalsContact C-N 3.29Å; E18-L20 PolarHBondContact O-N 3.02Å; E18-I21 PolarHBondContact O-N 3.47Å; E18-V22 WeakPolarHBondContact O-CG2 3.44Å; E18-V22 PolarHBondContact O-N 2.74Å |
| 19 | D | 82.7 | Confident | 75.1 | Confident | 98 Ų | 98 | 92.8 Ų | 92.8 | 52% | 0.524 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.9 | -38 | 176.3 | -113.3 | 26.5 | 0 | 0 | 0 | 112.4 | S15 K23 | S15-D19 WeakPolarHBondContact O-CB 3.49Å; S15-D19 PolarHBondContact O-N 2.84Å; D19-K23 WeakPolarHBondContact O-CG 3.31Å; D19-K23 PolarHBondContact O-N 3.44Å; D19-K23 VanDerWaalsContact O-N 3.12Å |
| 20 | L | 80.2 | Confident | 75.9 | Confident | 102 Ų | 102 | 91 Ų | 91 | 53% | 0.534 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -68.7 | -41.9 | 176.7 | -174.6 | 66.4 | 0 | 0 | 0 | 111.4 | C16 Q17 E18 K23 L24 | C16-L20 WeakPolarHBondContact O-CB 3.42Å; C16-L20 PolarHBondContact O-N 2.88Å; Q17-L20 PolarHBondContact O-N 3.48Å; E18-L20 VanDerWaalsContact C-N 3.29Å; E18-L20 PolarHBondContact O-N 3.02Å; L20-K23 PolarHBondContact O-N 3.29Å; L20-L24 HydrophobicContact CG-CD1 4.15Å; L20-L24 WeakPolarHBondContact O-CG 3.38Å; L20-L24 PolarHBondContact O-N 3.27Å |
| 21 | I | 77.3 | Confident | 76.6 | Confident | 91 Ų | 91 | 93.6 Ų | 93.6 | 47% | 0.467 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.9 | -48.8 | 176.3 | -71.5 | 164.4 | 0 | 0 | 0 | 109.9 | Q17 E18 K23 L24 E25 | Q17-I21 VanDerWaalsContact O-CG1 3.24Å; Q17-I21 WeakPolarHBondContact O-CG1 3.31Å; Q17-I21 PolarHBondContact O-N 3.33Å; E18-I21 PolarHBondContact O-N 3.47Å; I21-K23 VanDerWaalsContact C-N 3.32Å; I21-K23 PolarHBondContact O-N 2.89Å; I21-L24 PolarHBondContact O-N 2.83Å; I21-L24 VanDerWaalsContact O-N 3.14Å; I21-E25 HydrophobicContact CG2-CG 4.35Å; I21-E25 WeakPolarHBondContact O-CG 3.42Å; I21-E25 PolarHBondContact O-N 2.86Å |
| 22 | V | 82.8 | Confident | 77 | Confident | 76 Ų | 76 | 98.6 Ų | 98.6 | 46% | 0.461 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59.7 | -41.8 | 178.8 | 173.2 | 0 | 0 | 0 | 0 | 111.6 | E18 E25 L26 | E18-V22 WeakPolarHBondContact O-CG2 3.44Å; E18-V22 PolarHBondContact O-N 2.74Å; V22-E25 PolarHBondContact O-N 2.92Å; V22-L26 HydrophobicContact CG1-CD1 4.29Å; V22-L26 WeakPolarHBondContact O-CG 3.46Å; V22-L26 PolarHBondContact O-N 3.27Å |
| 23 | K | 83.7 | Confident | 77.4 | Confident | 133 Ų | 133 | 104.4 Ų | 104.4 | 58% | 0.578 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.8 | -42.1 | 175.9 | -77.2 | 174.5 | -176.1 | 165.9 | 0 | 112.4 | D19 L20 I21 L26 Q27 | D19-K23 WeakPolarHBondContact O-CG 3.31Å; D19-K23 PolarHBondContact O-N 3.44Å; D19-K23 VanDerWaalsContact O-N 3.12Å; L20-K23 PolarHBondContact O-N 3.29Å; I21-K23 VanDerWaalsContact C-N 3.32Å; I21-K23 PolarHBondContact O-N 2.89Å; K23-L26 PolarHBondContact O-N 3.49Å; K23-Q27 WeakPolarHBondContact O-CB 3.41Å; K23-Q27 PolarHBondContact O-N 3.22Å |
| 24 | L | 78.5 | Confident | 77.8 | Confident | 90 Ų | 90 | 106.8 Ų | 106.8 | 47% | 0.471 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.2 | -40.9 | 177.3 | -72.8 | 170.9 | 0 | 0 | 0 | 111.5 | L20 I21 Q27 V28 | L20-L24 HydrophobicContact CG-CD1 4.15Å; L20-L24 WeakPolarHBondContact O-CG 3.38Å; L20-L24 PolarHBondContact O-N 3.27Å; I21-L24 PolarHBondContact O-N 2.83Å; I21-L24 VanDerWaalsContact O-N 3.14Å; L24-Q27 PolarHBondContact O-N 3.36Å; L24-V28 WeakPolarHBondContact O-CG2 3.5Å; L24-V28 PolarHBondContact O-N 3.37Å |
| 25 | E | 81.6 | Confident | 77.9 | Confident | 114 Ų | 114 | 107.6 Ų | 107.6 | 53% | 0.533 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62 | -44.1 | 175.6 | -73.9 | -177 | 161 | 0 | 0 | 112.1 | I21 V22 Q27 V28 Q29 | I21-E25 HydrophobicContact CG2-CG 4.35Å; I21-E25 WeakPolarHBondContact O-CG 3.42Å; I21-E25 PolarHBondContact O-N 2.86Å; V22-E25 PolarHBondContact O-N 2.92Å; E25-Q27 VanDerWaalsContact C-N 3.31Å; E25-Q27 PolarHBondContact O-N 3.4Å; E25-V28 PolarHBondContact O-N 3.23Å; E25-Q29 WeakPolarHBondContact O-CG 3.26Å; E25-Q29 PolarHBondContact O-N 3.34Å |
| 26 | L | 83.5 | Confident | 78 | Confident | 109 Ų | 109 | 108.1 Ų | 108.1 | 57% | 0.571 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -60.9 | -40.5 | 174.1 | -76.4 | 171.7 | 0 | 0 | 0 | 111.8 | V22 K23 Q29 S30 | V22-L26 HydrophobicContact CG1-CD1 4.29Å; V22-L26 WeakPolarHBondContact O-CG 3.46Å; V22-L26 PolarHBondContact O-N 3.27Å; K23-L26 PolarHBondContact O-N 3.49Å; L26-Q29 PolarHBondContact O-N 3.48Å; L26-S30 PolarHBondContact O-N 3.3Å |
| 27 | Q | 77.5 | Confident | 78.5 | Confident | 97 Ų | 97 | 111.1 Ų | 111.1 | 45% | 0.453 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67 | -42.1 | 177.8 | -167.5 | 176 | -4.9 | 0 | 0 | 111.7 | K23 L24 E25 Q29 S30 Y31 | K23-Q27 WeakPolarHBondContact O-CB 3.41Å; K23-Q27 PolarHBondContact O-N 3.22Å; L24-Q27 PolarHBondContact O-N 3.36Å; E25-Q27 VanDerWaalsContact C-N 3.31Å; E25-Q27 PolarHBondContact O-N 3.4Å; Q27-Q29 PolarHBondContact O-N 2.88Å; Q27-S30 WeakPolarHBondContact O-CB 3.49Å; Q27-S30 PolarHBondContact O-N 2.83Å; Q27-Y31 HydrophobicContact CG-CD2 4.07Å; Q27-Y31 HydrophobicContact CG-CE2 3.66Å; Q27-Y31 WeakPolarHBondContact O-CD2 3.36Å; Q27-Y31 PolarHBondContact O-N 3.28Å |
| 28 | V | 73.8 | Confident | 78.5 | Confident | 73 Ų | 73 | 109.7 Ų | 109.7 | 44% | 0.442 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.6 | -42 | 174.4 | 170.4 | 0 | 0 | 0 | 0 | 111.2 | L24 E25 S30 Y31 R32 | L24-V28 WeakPolarHBondContact O-CG2 3.5Å; L24-V28 PolarHBondContact O-N 3.37Å; E25-V28 PolarHBondContact O-N 3.23Å; V28-S30 VanDerWaalsContact C-N 3.34Å; V28-S30 PolarHBondContact O-N 2.91Å; V28-Y31 PolarHBondContact O-N 2.86Å; V28-R32 WeakPolarHBondContact O-CG 3.39Å; V28-R32 PolarHBondContact O-N 2.92Å |
| 29 | Q | 79.2 | Confident | 78.4 | Confident | 97 Ų | 97 | 110 Ų | 110 | 45% | 0.453 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.8 | -39.1 | 175 | -74.7 | -174.7 | 14.3 | 0 | 0 | 112.3 | E25 L26 Q27 R32 R33 | E25-Q29 WeakPolarHBondContact O-CG 3.26Å; E25-Q29 PolarHBondContact O-N 3.34Å; L26-Q29 PolarHBondContact O-N 3.48Å; Q27-Q29 PolarHBondContact O-N 2.88Å; Q29-R32 PolarHBondContact O-N 2.91Å; Q29-R33 WeakPolarHBondContact O-CG 3.39Å; Q29-R33 PolarHBondContact O-N 2.84Å |
| 30 | S | 77.4 | Confident | 78.4 | Confident | 76 Ų | 76 | 108.5 Ų | 108.5 | 53% | 0.531 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.9 | -47.2 | 174.1 | -176.1 | 0 | 0 | 0 | 0 | 111.4 | L26 Q27 V28 R32 R33 F34 | L26-S30 PolarHBondContact O-N 3.3Å; Q27-S30 WeakPolarHBondContact O-CB 3.49Å; Q27-S30 PolarHBondContact O-N 2.83Å; V28-S30 VanDerWaalsContact C-N 3.34Å; V28-S30 PolarHBondContact O-N 2.91Å; S30-R32 PolarHBondContact O-N 3.34Å; S30-R33 PolarHBondContact O-N 3.16Å; S30-F34 PolarHBondContact O-N 3.39Å |
| 31 | Y | 75.5 | Confident | 78.3 | Confident | 140 Ų | 140 | 112.7 Ų | 112.7 | 55% | 0.549 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62 | -43.7 | 175.4 | -76 | -58.5 | 0 | 0 | 0 | 112.3 | Q27 V28 R33 F34 T35 | Q27-Y31 HydrophobicContact CG-CD2 4.07Å; Q27-Y31 HydrophobicContact CG-CE2 3.66Å; Q27-Y31 WeakPolarHBondContact O-CD2 3.36Å; Q27-Y31 PolarHBondContact O-N 3.28Å; V28-Y31 PolarHBondContact O-N 2.86Å; Y31-R33 VanDerWaalsContact C-N 3.32Å; Y31-R33 PolarHBondContact O-N 3.13Å; Y31-F34 WeakPolarHBondContact O-CB 3.32Å; Y31-F34 PolarHBondContact O-N 3.46Å; Y31-F34 VanDerWaalsContact O-N 3.15Å; Y31-T35 PolarHBondContact O-N 2.89Å; Y31-T35 PolarHBondContact O-OG1 2.95Å |
| 32 | R | 75.7 | Confident | 77.8 | Confident | 184 Ų | 184 | 113.2 Ų | 113.2 | 69% | 0.694 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -58 | -43.7 | 175.5 | -75.2 | -177.7 | -176 | 173.2 | 3 | 112.2 | V28 Q29 S30 T35 Q36 | V28-R32 WeakPolarHBondContact O-CG 3.39Å; V28-R32 PolarHBondContact O-N 2.92Å; Q29-R32 PolarHBondContact O-N 2.91Å; S30-R32 PolarHBondContact O-N 3.34Å; R32-T35 PolarHBondContact O-N 3.23Å; R32-Q36 WeakPolarHBondContact O-CB 3.35Å; R32-Q36 PolarHBondContact O-N 3.36Å |
| 33 | R | 80 | Confident | 77.4 | Confident | 179 Ų | 179 | 116 Ų | 116 | 68% | 0.675 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.9 | -39.5 | 176.2 | -73.2 | -179.2 | -175.6 | 172.6 | 3.8 | 112.1 | Q29 S30 Y31 Q36 K37 | Q29-R33 WeakPolarHBondContact O-CG 3.39Å; Q29-R33 PolarHBondContact O-N 2.84Å; S30-R33 PolarHBondContact O-N 3.16Å; Y31-R33 VanDerWaalsContact C-N 3.32Å; Y31-R33 PolarHBondContact O-N 3.13Å; R33-Q36 PolarHBondContact O-N 3.2Å; R33-K37 WeakPolarHBondContact O-CG 3.42Å; R33-K37 PolarHBondContact O-N 3.5Å |
| 34 | F | 78.6 | Confident | 77.2 | Confident | 129 Ų | 129 | 115.3 Ų | 115.3 | 57% | 0.566 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.7 | -49 | 176.1 | 177.9 | -103 | 0 | 0 | 0 | 111.5 | S30 Y31 Q36 K37 L38 | S30-F34 PolarHBondContact O-N 3.39Å; Y31-F34 WeakPolarHBondContact O-CB 3.32Å; Y31-F34 PolarHBondContact O-N 3.46Å; Y31-F34 VanDerWaalsContact O-N 3.15Å; F34-Q36 VanDerWaalsContact C-N 3.29Å; F34-Q36 PolarHBondContact O-N 2.79Å; F34-K37 PolarHBondContact O-N 3.44Å; F34-L38 HydrophobicContact CD1-CD1 4.07Å; F34-L38 HydrophobicContact CE1-CD1 3.35Å; F34-L38 HydrophobicContact CE2-CD1 4.24Å; F34-L38 HydrophobicContact CZ-CD1 3.45Å; F34-L38 VanDerWaalsContact CZ-CD1 3.45Å; F34-L38 PolarHBondContact O-N 3.32Å |
| 35 | T | 72.4 | Confident | 76.9 | Confident | 77 Ų | 77 | 117 Ų | 117 | 47% | 0.472 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.5 | -37 | 178.1 | -47.4 | 0 | 0 | 0 | 0 | 111.7 | Y31 R32 L38 R39 | Y31-T35 PolarHBondContact O-N 2.89Å; Y31-T35 PolarHBondContact O-OG1 2.95Å; R32-T35 PolarHBondContact O-N 3.23Å; T35-L38 PolarHBondContact O-N 2.9Å; T35-R39 WeakPolarHBondContact O-CB 3.46Å; T35-R39 PolarHBondContact O-N 3.12Å |
| 36 | Q | 76.7 | Confident | 76.3 | Confident | 76 Ų | 76 | 117.3 Ų | 117.3 | 36% | 0.355 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.8 | -47.4 | 174.4 | -172.4 | 60.9 | 36.1 | 0 | 0 | 111.6 | R32 R33 F34 L38 R39 D40 | R32-Q36 WeakPolarHBondContact O-CB 3.35Å; R32-Q36 PolarHBondContact O-N 3.36Å; R33-Q36 PolarHBondContact O-N 3.2Å; F34-Q36 VanDerWaalsContact C-N 3.29Å; F34-Q36 PolarHBondContact O-N 2.79Å; Q36-L38 VanDerWaalsContact C-N 3.28Å; Q36-L38 PolarHBondContact O-N 2.89Å; Q36-R39 WeakPolarHBondContact O-CB 3.38Å; Q36-R39 PolarHBondContact O-N 3.29Å; Q36-R39 VanDerWaalsContact O-N 3.16Å; Q36-D40 PolarHBondContact NE2-OD1 3.3Å; Q36-D40 PolarHBondContact NE2-OD2 2.93Å; Q36-D40 VanDerWaalsContact O-CG 3.24Å; Q36-D40 PolarHBondContact O-N 2.96Å |
| 37 | K | 83.1 | Confident | 76 | Confident | 153 Ų | 153 | 117.5 Ų | 117.5 | 67% | 0.665 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -59.2 | -38.6 | 175.1 | -77.1 | -177.3 | 177.1 | -176 | 0 | 112.8 | R33 F34 D40 R41 | R33-K37 WeakPolarHBondContact O-CG 3.42Å; R33-K37 PolarHBondContact O-N 3.5Å; F34-K37 PolarHBondContact O-N 3.44Å; K37-D40 PolarHBondContact O-N 2.93Å; K37-R41 WeakPolarHBondContact O-CB 3.42Å; K37-R41 PolarHBondContact O-N 2.9Å |
| 38 | L | 72.2 | Confident | 75.8 | Confident | 81 Ų | 81 | 117 Ų | 117 | 42% | 0.424 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.1 | -42.3 | 177 | -124.6 | 150 | 0 | 0 | 0 | 111.2 | F34 T35 Q36 R41 L42 | F34-L38 HydrophobicContact CD1-CD1 4.07Å; F34-L38 HydrophobicContact CE1-CD1 3.35Å; F34-L38 HydrophobicContact CE2-CD1 4.24Å; F34-L38 HydrophobicContact CZ-CD1 3.45Å; F34-L38 VanDerWaalsContact CZ-CD1 3.45Å; F34-L38 PolarHBondContact O-N 3.32Å; T35-L38 PolarHBondContact O-N 2.9Å; Q36-L38 VanDerWaalsContact C-N 3.28Å; Q36-L38 PolarHBondContact O-N 2.89Å; L38-R41 PolarHBondContact O-N 3Å; L38-L42 HydrophobicContact CD2-CD1 4.27Å; L38-L42 WeakPolarHBondContact O-CB 3.48Å; L38-L42 WeakPolarHBondContact O-CG 3.47Å; L38-L42 PolarHBondContact O-N 3.14Å |
| 39 | R | 74.4 | Confident | 75.7 | Confident | 135 Ų | 135 | 118.8 Ų | 118.8 | 51% | 0.509 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.8 | -43.7 | 174.8 | -170 | -170.3 | -58.3 | 172.9 | 1 | 111.9 | T35 Q36 L42 R43 | T35-R39 WeakPolarHBondContact O-CB 3.46Å; T35-R39 PolarHBondContact O-N 3.12Å; Q36-R39 WeakPolarHBondContact O-CB 3.38Å; Q36-R39 PolarHBondContact O-N 3.29Å; Q36-R39 VanDerWaalsContact O-N 3.16Å; R39-L42 PolarHBondContact O-N 3.41Å; R39-R43 PolarHBondContact O-N 3.48Å |
| 40 | D | 81.4 | Confident | 75.4 | Confident | 67 Ų | 67 | 115.4 Ų | 115.4 | 36% | 0.358 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.4 | -41.6 | 179.8 | -63.9 | -26.6 | 0 | 0 | 0 | 110.9 | Q36 K37 L42 R43 E44 | Q36-D40 PolarHBondContact NE2-OD1 3.3Å; Q36-D40 PolarHBondContact NE2-OD2 2.93Å; Q36-D40 VanDerWaalsContact O-CG 3.24Å; Q36-D40 PolarHBondContact O-N 2.96Å; K37-D40 PolarHBondContact O-N 2.93Å; D40-L42 PolarHBondContact O-N 2.95Å; D40-R43 PolarHBondContact O-N 3.38Å; D40-R43 IonicContact OD1-NH1 3.71Å; D40-E44 PolarHBondContact O-N 3.37Å |
| 41 | R | 77.9 | Confident | 75.2 | Confident | 190 Ų | 190 | 116.9 Ų | 116.9 | 72% | 0.717 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -62.2 | -40.7 | 172.5 | -85.9 | -177 | 163.6 | -174.3 | -5.9 | 113.6 | K37 L38 R43 E44 H45 | K37-R41 WeakPolarHBondContact O-CB 3.42Å; K37-R41 PolarHBondContact O-N 2.9Å; L38-R41 PolarHBondContact O-N 3Å; R41-R43 VanDerWaalsContact C-N 3.31Å; R41-E44 PolarHBondContact O-N 2.92Å; R41-H45 PolarHBondContact O-N 3.25Å |
| 42 | L | 68.5 | Low | 74.7 | Confident | 101 Ų | 101 | 115.6 Ų | 115.6 | 53% | 0.529 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.3 | -37.4 | 175.8 | -78.7 | 167.1 | 0 | 0 | 0 | 111.4 | L38 R39 D40 H45 L46 | L38-L42 HydrophobicContact CD2-CD1 4.27Å; L38-L42 WeakPolarHBondContact O-CB 3.48Å; L38-L42 WeakPolarHBondContact O-CG 3.47Å; L38-L42 PolarHBondContact O-N 3.14Å; R39-L42 PolarHBondContact O-N 3.41Å; D40-L42 PolarHBondContact O-N 2.95Å; L42-H45 PolarHBondContact O-N 3.38Å; L42-L46 WeakPolarHBondContact O-CB 3.27Å; L42-L46 VanDerWaalsContact O-CG 3.27Å; L42-L46 WeakPolarHBondContact O-CG 3.49Å; L42-L46 PolarHBondContact O-N 2.88Å |
| 43 | R | 74.5 | Confident | 74.2 | Confident | 134 Ų | 134 | 113.4 Ų | 113.4 | 51% | 0.506 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.3 | -45.2 | 175.2 | -171.4 | -176.3 | -62.5 | 149.2 | 1.7 | 111.7 | R39 D40 R41 H45 L46 E47 | R39-R43 PolarHBondContact O-N 3.48Å; D40-R43 PolarHBondContact O-N 3.38Å; D40-R43 IonicContact OD1-NH1 3.71Å; R41-R43 VanDerWaalsContact C-N 3.31Å; R43-H45 VanDerWaalsContact C-N 3.34Å; R43-H45 PolarHBondContact O-N 2.97Å; R43-L46 PolarHBondContact O-N 3.36Å; R43-E47 PolarHBondContact O-N 3.15Å |
| 44 | E | 78.4 | Confident | 73.9 | Confident | 120 Ų | 120 | 112.1 Ų | 112.1 | 56% | 0.561 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -59.5 | -45 | 176.2 | -166.9 | 173.7 | -161.1 | 0 | 0 | 110.9 | D40 R41 L46 E47 D48 | D40-E44 PolarHBondContact O-N 3.37Å; R41-E44 PolarHBondContact O-N 2.92Å; E44-L46 PolarHBondContact O-N 2.93Å; E44-E47 PolarHBondContact O-N 3.28Å; E44-D48 PolarHBondContact O-N 2.79Å |
| 45 | H | 71.4 | Confident | 73.5 | Confident | 124 Ų | 124 | 110.1 Ų | 110.1 | 57% | 0.574 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.6 | -40.2 | 174.7 | -109.3 | -50.4 | 0 | 0 | 0 | 113.6 | R41 L42 R43 E47 D48 E49 | R41-H45 PolarHBondContact O-N 3.25Å; L42-H45 PolarHBondContact O-N 3.38Å; R43-H45 VanDerWaalsContact C-N 3.34Å; R43-H45 PolarHBondContact O-N 2.97Å; H45-E47 VanDerWaalsContact C-N 3.35Å; H45-D48 PolarHBondContact O-N 2.94Å; H45-E49 PolarHBondContact O-N 3.38Å |
| 46 | L | 69.5 | Low | 73.1 | Confident | 122 Ų | 122 | 111 Ų | 111 | 64% | 0.639 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -69.5 | -32.7 | 176.5 | -72.8 | 169.9 | 0 | 0 | 0 | 112.1 | L42 R43 E44 G50 | L42-L46 WeakPolarHBondContact O-CB 3.27Å; L42-L46 VanDerWaalsContact O-CG 3.27Å; L42-L46 WeakPolarHBondContact O-CG 3.49Å; L42-L46 PolarHBondContact O-N 2.88Å; R43-L46 PolarHBondContact O-N 3.36Å; E44-L46 PolarHBondContact O-N 2.93Å; L46-G50 PolarHBondContact O-N 3.23Å |
| 47 | E | 77.4 | Confident | 72.8 | Confident | 112 Ų | 112 | 113.2 Ų | 113.2 | 52% | 0.523 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -69.6 | -40.5 | 173.1 | -78 | 178.1 | -169.5 | 0 | 0 | 111.7 | R43 E44 H45 G50 Q51 | R43-E47 PolarHBondContact O-N 3.15Å; E44-E47 PolarHBondContact O-N 3.28Å; H45-E47 VanDerWaalsContact C-N 3.35Å; E47-G50 CarbonylContact O-C 3.58Å; E47-G50 PolarHBondContact O-N 2.97Å; E47-Q51 WeakPolarHBondContact O-CG 3.31Å; E47-Q51 PolarHBondContact O-N 2.99Å |
| 48 | D | 74.6 | Confident | 72.2 | Confident | 86 Ų | 86 | 108.7 Ų | 108.7 | 46% | 0.46 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.7 | -45.8 | 174.1 | -76.4 | -15 | 0 | 0 | 0 | 111.6 | E44 H45 G50 Q51 L52 | E44-D48 PolarHBondContact O-N 2.79Å; H45-D48 PolarHBondContact O-N 2.94Å; D48-G50 VanDerWaalsContact C-N 3.35Å; D48-Q51 PolarHBondContact O-N 3.15Å; D48-L52 PolarHBondContact O-N 3.4Å |
| 49 | E | 71.2 | Confident | 71.8 | Confident | 112 Ų | 112 | 107.3 Ų | 107.3 | 52% | 0.523 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.4 | -40.1 | 173.2 | -75.1 | -158.9 | 167.7 | 0 | 0 | 111.5 | H45 Q51 L52 F53 | H45-E49 PolarHBondContact O-N 3.38Å; E49-Q51 VanDerWaalsContact C-N 3.31Å; E49-Q51 PolarHBondContact O-N 3.5Å; E49-L52 CarbonylContact O-C 3.6Å; E49-L52 WeakPolarHBondContact O-CA 3.45Å; E49-L52 WeakPolarHBondContact O-CB 3.37Å; E49-L52 PolarHBondContact O-N 2.84Å; E49-L52 VanDerWaalsContact O-N 3.1Å; E49-F53 WeakPolarHBondContact O-CD2 3.37Å; E49-F53 PolarHBondContact O-N 2.89Å |
| 50 | G | 73.1 | Confident | 71.2 | Confident | 26 Ų | 26 | 107.1 Ų | 107.1 | 27% | 0.268 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.2 | -33.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | L46 E47 D48 R54 | L46-G50 PolarHBondContact O-N 3.23Å; E47-G50 CarbonylContact O-C 3.58Å; E47-G50 PolarHBondContact O-N 2.97Å; D48-G50 VanDerWaalsContact C-N 3.35Å; G50-R54 WeakPolarHBondContact O-CG 3.48Å; G50-R54 PolarHBondContact O-N 3.42Å; G50-R54 PolarHBondContact O-NE 3.3Å |
| 51 | Q | 71.7 | Confident | 70.3 | Confident | 107 Ų | 107 | 109.2 Ų | 109.2 | 50% | 0.5 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -69.4 | -40.2 | 169.3 | -76.8 | -177.5 | 18.1 | 0 | 0 | 111.6 | E47 D48 E49 F53 R54 C55 | E47-Q51 WeakPolarHBondContact O-CG 3.31Å; E47-Q51 PolarHBondContact O-N 2.99Å; D48-Q51 PolarHBondContact O-N 3.15Å; E49-Q51 VanDerWaalsContact C-N 3.31Å; E49-Q51 PolarHBondContact O-N 3.5Å; Q51-F53 VanDerWaalsContact C-N 3.33Å; Q51-F53 PolarHBondContact O-N 2.99Å; Q51-R54 PolarHBondContact O-N 2.94Å; Q51-C55 WeakPolarHBondContact O-CB 3.3Å; Q51-C55 PolarHBondContact O-N 3.37Å; Q51-C55 PolarHBondContact O-SG 3.07Å |
| 52 | L | 65.8 | Low | 69.2 | Low | 113 Ų | 113 | 102 Ų | 102 | 59% | 0.592 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.4 | -41.5 | 175.9 | -153.3 | 113.1 | 0 | 0 | 0 | 111.4 | D48 E49 C55 L56 | D48-L52 PolarHBondContact O-N 3.4Å; E49-L52 CarbonylContact O-C 3.6Å; E49-L52 WeakPolarHBondContact O-CA 3.45Å; E49-L52 WeakPolarHBondContact O-CB 3.37Å; E49-L52 PolarHBondContact O-N 2.84Å; E49-L52 VanDerWaalsContact O-N 3.1Å; L52-C55 PolarHBondContact O-N 3.38Å; L52-L56 HydrophobicContact CD2-CD1 3.99Å; L52-L56 WeakPolarHBondContact O-CB 3.45Å; L52-L56 WeakPolarHBondContact O-CG 3.36Å; L52-L56 PolarHBondContact O-N 3.43Å |
| 53 | F | 65.4 | Low | 68.3 | Low | 138 Ų | 138 | 100.4 Ų | 100.4 | 61% | 0.605 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.2 | -42.5 | 173.1 | -83.5 | -67.7 | 0 | 0 | 0 | 112.1 | E49 Q51 C55 L56 E57 | E49-F53 WeakPolarHBondContact O-CD2 3.37Å; E49-F53 PolarHBondContact O-N 2.89Å; Q51-F53 VanDerWaalsContact C-N 3.33Å; Q51-F53 PolarHBondContact O-N 2.99Å; F53-C55 VanDerWaalsContact C-N 3.35Å; F53-C55 PolarHBondContact O-N 3.11Å; F53-L56 PolarHBondContact O-N 2.92Å; F53-E57 VanDerWaalsContact O-CB 3.27Å; F53-E57 WeakPolarHBondContact O-CB 3.37Å; F53-E57 PolarHBondContact O-N 2.76Å |
| 54 | R | 73.4 | Confident | 67.1 | Low | 151 Ų | 151 | 101.9 Ų | 101.9 | 57% | 0.57 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -65.4 | -35.8 | 173.7 | -77 | -177.9 | -71.6 | -134 | -1.6 | 112.9 | G50 Q51 A58 | G50-R54 WeakPolarHBondContact O-CG 3.48Å; G50-R54 PolarHBondContact O-N 3.42Å; G50-R54 PolarHBondContact O-NE 3.3Å; Q51-R54 PolarHBondContact O-N 2.94Å; R54-A58 WeakPolarHBondContact O-CB 3.39Å; R54-A58 PolarHBondContact O-N 2.92Å |
| 55 | C | 69.7 | Low | 65.4 | Low | 87 Ų | 87 | 100.5 Ų | 100.5 | 59% | 0.588 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -68.5 | -38.6 | 173.8 | -74.8 | 0 | 0 | 0 | 0 | 111.7 | Q51 L52 F53 A59 | Q51-C55 WeakPolarHBondContact O-CB 3.3Å; Q51-C55 PolarHBondContact O-N 3.37Å; Q51-C55 PolarHBondContact O-SG 3.07Å; L52-C55 PolarHBondContact O-N 3.38Å; F53-C55 VanDerWaalsContact C-N 3.35Å; F53-C55 PolarHBondContact O-N 3.11Å; C55-A59 WeakPolarHBondContact O-CB 3.37Å; C55-A59 PolarHBondContact O-N 3.39Å |
| 56 | L | 65.8 | Low | 63.9 | Low | 95 Ų | 95 | 101.4 Ų | 101.4 | 50% | 0.497 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -68.9 | -41.1 | 174.1 | -79.1 | 166.3 | 0 | 0 | 0 | 111.6 | L52 F53 A59 Q60 | L52-L56 HydrophobicContact CD2-CD1 3.99Å; L52-L56 WeakPolarHBondContact O-CB 3.45Å; L52-L56 WeakPolarHBondContact O-CG 3.36Å; L52-L56 PolarHBondContact O-N 3.43Å; F53-L56 PolarHBondContact O-N 2.92Å; L56-A59 CarbonylContact O-C 3.59Å; L56-A59 PolarHBondContact O-N 2.87Å; L56-Q60 VanDerWaalsContact O-CB 3.24Å; L56-Q60 WeakPolarHBondContact O-CB 3.24Å; L56-Q60 PolarHBondContact O-N 3.37Å |
| 57 | E | 69.9 | Low | 62.6 | Low | 123 Ų | 123 | 105 Ų | 105 | 58% | 0.575 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -66 | -41.1 | 175 | -168.5 | 176.1 | -154 | 0 | 0 | 111.1 | F53 Q60 L61 | F53-E57 VanDerWaalsContact O-CB 3.27Å; F53-E57 WeakPolarHBondContact O-CB 3.37Å; F53-E57 PolarHBondContact O-N 2.76Å; E57-Q60 PolarHBondContact O-N 2.94Å; E57-L61 HydrophobicContact CG-CD1 4.35Å; E57-L61 WeakPolarHBondContact O-CB 3.47Å; E57-L61 WeakPolarHBondContact O-CG 3.34Å; E57-L61 PolarHBondContact O-N 3.01Å |
| 58 | A | 69.5 | Low | 61 | Low | 59 Ų | 59 | 104.5 Ų | 104.5 | 49% | 0.488 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -66.1 | -36.6 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | R54 Q60 A62 | R54-A58 WeakPolarHBondContact O-CB 3.39Å; R54-A58 PolarHBondContact O-N 2.92Å; A58-Q60 VanDerWaalsContact C-N 3.32Å; A58-A62 WeakPolarHBondContact O-CB 3.47Å; A58-A62 PolarHBondContact O-N 3.44Å |
| 59 | A | 63.6 | Low | 59.8 | Low | 52 Ų | 52 | 104.8 Ų | 104.8 | 43% | 0.43 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -70 | -29.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112 | C55 L56 S63 | C55-A59 WeakPolarHBondContact O-CB 3.37Å; C55-A59 PolarHBondContact O-N 3.39Å; L56-A59 CarbonylContact O-C 3.59Å; L56-A59 PolarHBondContact O-N 2.87Å; A59-S63 VanDerWaalsContact O-CB 3.28Å; A59-S63 WeakPolarHBondContact O-CB 3.47Å; A59-S63 PolarHBondContact O-N 3.35Å; A59-S63 PolarHBondContact O-OG 3.38Å |
| 60 | Q | 62 | Low | 58.7 | Low | 131 Ų | 131 | 104.7 Ų | 104.7 | 61% | 0.612 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -75.8 | -42.9 | 176.8 | -162 | 160.2 | -8 | 0 | 0 | 111.4 | L56 E57 A58 A62 S63 E64 | L56-Q60 VanDerWaalsContact O-CB 3.24Å; L56-Q60 WeakPolarHBondContact O-CB 3.24Å; L56-Q60 PolarHBondContact O-N 3.37Å; E57-Q60 PolarHBondContact O-N 2.94Å; A58-Q60 VanDerWaalsContact C-N 3.32Å; Q60-A62 VanDerWaalsContact C-N 3.34Å; Q60-S63 WeakPolarHBondContact CA-OG 3.42Å; Q60-S63 CarbonylContact O-C 3.32Å; Q60-S63 PolarHBondContact O-N 2.88Å; Q60-S63 PolarHBondContact O-OG 2.93Å; Q60-S63 VanDerWaalsContact O-OG 3.06Å; Q60-E64 PolarHBondContact O-N 3.07Å |
| 61 | L | 63.2 | Low | 57.8 | Low | 110 Ų | 110 | 109.3 Ų | 109.3 | 58% | 0.576 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -66.1 | -35.4 | 170.1 | -73.8 | 164.9 | 0 | 0 | 0 | 112.1 | E57 | E57-L61 HydrophobicContact CG-CD1 4.35Å; E57-L61 WeakPolarHBondContact O-CB 3.47Å; E57-L61 WeakPolarHBondContact O-CG 3.34Å; E57-L61 PolarHBondContact O-N 3.01Å |
| 62 | A | 55.3 | Low | 57.2 | Low | 38 Ų | 38 | 105.4 Ų | 105.4 | 31% | 0.314 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -68.5 | -35.9 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | A58 Q60 S65 F66 | A58-A62 WeakPolarHBondContact O-CB 3.47Å; A58-A62 PolarHBondContact O-N 3.44Å; Q60-A62 VanDerWaalsContact C-N 3.34Å; A62-S65 CarbonylContact O-C 3.49Å; A62-S65 VanDerWaalsContact O-C 3.32Å; A62-S65 WeakPolarHBondContact O-CA 3.36Å; A62-S65 PolarHBondContact O-N 2.87Å; A62-S65 PolarHBondContact O-OG 2.87Å; A62-F66 VanDerWaalsContact O-CD2 3.27Å; A62-F66 WeakPolarHBondContact O-CD2 3.49Å; A62-F66 PolarHBondContact O-N 3.47Å |
| 63 | S | 50 | Low | 56.9 | Low | 68 Ų | 68 | 105.4 Ų | 105.4 | 48% | 0.476 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -77.8 | -19.9 | 178.3 | 47.3 | 0 | 0 | 0 | 0 | 114.5 | A59 Q60 S65 F66 | A59-S63 VanDerWaalsContact O-CB 3.28Å; A59-S63 WeakPolarHBondContact O-CB 3.47Å; A59-S63 PolarHBondContact O-N 3.35Å; A59-S63 PolarHBondContact O-OG 3.38Å; Q60-S63 WeakPolarHBondContact CA-OG 3.42Å; Q60-S63 CarbonylContact O-C 3.32Å; Q60-S63 PolarHBondContact O-N 2.88Å; Q60-S63 PolarHBondContact O-OG 2.93Å; Q60-S63 VanDerWaalsContact O-OG 3.06Å; S63-S65 PolarHBondContact O-N 2.97Å; S63-F66 PolarHBondContact O-N 3.49Å |
| 64 | E | 48 | Very low | 56.6 | Low | 165 Ų | 165 | 103.1 Ų | 103.1 | 77% | 0.771 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.7 | -15.1 | 161.2 | -76.6 | -176.2 | 163.2 | 0 | 0 | 112.9 | Q60 | Q60-E64 PolarHBondContact O-N 3.07Š|
| 65 | S | 42.9 | Very low | 56.3 | Low | 91 Ų | 91 | 102.1 Ų | 102.1 | 64% | 0.636 | 56% | 0.556 | S | S | * | * | S | Bend | trans | -103.4 | -2.8 | 169.5 | 74 | 0 | 0 | 0 | 0 | 114.5 | A62 S63 K67 | A62-S65 CarbonylContact O-C 3.49Å; A62-S65 VanDerWaalsContact O-C 3.32Å; A62-S65 WeakPolarHBondContact O-CA 3.36Å; A62-S65 PolarHBondContact O-N 2.87Å; A62-S65 PolarHBondContact O-OG 2.87Å; S63-S65 PolarHBondContact O-N 2.97Å; S65-K67 PolarHBondContact O-N 3.14Å |
| 66 | F | 39.8 | Very low | 56.3 | Low | 144 Ų | 144 | 105.4 Ų | 105.4 | 63% | 0.632 | 56% | 0.56 | S | S | * | * | trans | -79.1 | 78.9 | 164.8 | -89.1 | -88.7 | 0 | 0 | 0 | 108.7 | A62 S63 V68 | A62-F66 VanDerWaalsContact O-CD2 3.27Å; A62-F66 WeakPolarHBondContact O-CD2 3.49Å; A62-F66 PolarHBondContact O-N 3.47Å; S63-F66 PolarHBondContact O-N 3.49Å; F66-V68 PolarHBondContact O-N 3.37Å | ||
| 67 | K | 42.7 | Very low | 56.4 | Low | 196 Ų | 196 | 103.1 Ų | 103.1 | 85% | 0.852 | 56% | 0.555 | S | S | * | * | trans | -56.1 | 85.9 | 132.1 | -73.9 | -177.4 | 177.5 | -178.9 | 0 | 105.8 | S65 D69 | S65-K67 PolarHBondContact O-N 3.14Å; K67-D69 PolarHBondContact O-N 3.06Å; K67-D69 VanDerWaalsContact O-N 3.15Å | ||
| 68 | V | 43.9 | Very low | 56.5 | Low | 102 Ų | 102 | 102.7 Ų | 102.7 | 62% | 0.618 | 55% | 0.553 | S | S | * | * | trans | -41.8 | 126.3 | 153.4 | 172.4 | 0 | 0 | 0 | 0 | 104.7 | F66 D70 | F66-V68 PolarHBondContact O-N 3.37Å; V68-D70 PolarHBondContact O-N 3.46Å | ||
| 69 | D | 48.8 | Very low | 56.9 | Low | 93 Ų | 93 | 103.7 Ų | 103.7 | 50% | 0.497 | 55% | 0.553 | S | S | . | * | S | Bend | trans | -59.9 | 60.9 | -157.3 | -152.8 | -3.7 | 0 | 0 | 0 | 113.6 | K67 N71 A72 I73 | K67-D69 PolarHBondContact O-N 3.06Å; K67-D69 VanDerWaalsContact O-N 3.15Å; D69-N71 PolarHBondContact O-N 3.43Å; D69-A72 HydrophobicContact CB-CB 4.1Å; D69-A72 PolarHBondContact O-N 2.95Å; D69-A72 VanDerWaalsContact O-N 3.1Å; D69-A72 WeakPolarHBondContact OD1-CB 3.48Å; D69-A72 PolarHBondContact OD1-N 3.05Å; D69-A72 WeakPolarHBondContact OD2-CB 3.28Å; D69-I73 WeakPolarHBondContact O-CG1 3.44Å; D69-I73 PolarHBondContact O-N 2.89Å |
| 70 | D | 48.9 | Very low | 57.4 | Low | 109 Ų | 109 | 106.7 Ų | 106.7 | 58% | 0.583 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -58.7 | -26.4 | 169.1 | -82.3 | -17.9 | 0 | 0 | 0 | 108.3 | V68 L74 | V68-D70 PolarHBondContact O-N 3.46Å; D70-L74 WeakPolarHBondContact O-CA 3.45Å; D70-L74 WeakPolarHBondContact O-CB 3.47Å; D70-L74 WeakPolarHBondContact O-CD1 3.42Å; D70-L74 PolarHBondContact O-N 2.96Å |
| 71 | N | 54.4 | Low | 57.8 | Low | 123 Ų | 123 | 104 Ų | 104 | 66% | 0.658 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -72.2 | -40.6 | 171.9 | -98.6 | 20.6 | 0 | 0 | 0 | 113.6 | D69 E75 | D69-N71 PolarHBondContact O-N 3.43Å; N71-E75 WeakPolarHBondContact O-CA 3.47Å; N71-E75 WeakPolarHBondContact O-CB 3.37Å; N71-E75 WeakPolarHBondContact O-CG 3.47Å; N71-E75 PolarHBondContact O-N 2.83Å |
| 72 | A | 59 | Low | 58.5 | Low | 26 Ų | 26 | 102 Ų | 102 | 22% | 0.215 | 55% | 0.552 | C | S | . | * | H | α-helix | trans | -77 | -28.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | D69 K76 | D69-A72 HydrophobicContact CB-CB 4.1Å; D69-A72 PolarHBondContact O-N 2.95Å; D69-A72 VanDerWaalsContact O-N 3.1Å; D69-A72 WeakPolarHBondContact OD1-CB 3.48Å; D69-A72 PolarHBondContact OD1-N 3.05Å; D69-A72 WeakPolarHBondContact OD2-CB 3.28Å; A72-K76 VanDerWaalsContact O-CB 3.3Å; A72-K76 WeakPolarHBondContact O-CB 3.37Å; A72-K76 WeakPolarHBondContact O-CG 3.42Å; A72-K76 PolarHBondContact O-N 3.45Å |
| 73 | I | 58 | Low | 59.5 | Low | 112 Ų | 112 | 106.6 Ų | 106.6 | 57% | 0.574 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -73.3 | -42.1 | 171.4 | -63 | 176.7 | 0 | 0 | 0 | 110 | D69 K76 A77 | D69-I73 WeakPolarHBondContact O-CG1 3.44Å; D69-I73 PolarHBondContact O-N 2.89Å; I73-K76 PolarHBondContact O-N 3.43Å; I73-A77 VanDerWaalsContact O-CB 3.24Å; I73-A77 WeakPolarHBondContact O-CB 3.43Å; I73-A77 PolarHBondContact O-N 3.18Å |
| 74 | L | 59.1 | Low | 60.7 | Low | 90 Ų | 90 | 109.5 Ų | 109.5 | 47% | 0.471 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63 | -46 | 169.7 | -102.5 | 99.8 | 0 | 0 | 0 | 111.1 | D70 K76 A77 E78 | D70-L74 WeakPolarHBondContact O-CA 3.45Å; D70-L74 WeakPolarHBondContact O-CB 3.47Å; D70-L74 WeakPolarHBondContact O-CD1 3.42Å; D70-L74 PolarHBondContact O-N 2.96Å; L74-K76 VanDerWaalsContact C-N 3.32Å; L74-K76 PolarHBondContact O-N 3.43Å; L74-A77 CarbonylContact O-C 3.6Å; L74-A77 PolarHBondContact O-N 3.15Å; L74-A77 VanDerWaalsContact O-N 3.08Å; L74-E78 VanDerWaalsContact O-CB 3.28Å; L74-E78 WeakPolarHBondContact O-CB 3.44Å; L74-E78 WeakPolarHBondContact O-CG 3.3Å; L74-E78 PolarHBondContact O-N 3.25Å |
| 75 | E | 67.8 | Low | 62 | Low | 130 Ų | 130 | 107.3 Ų | 107.3 | 61% | 0.607 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -61.3 | -42.1 | 178.3 | -91.3 | -172.2 | 145.2 | 0 | 0 | 110.5 | N71 E78 V79 | N71-E75 WeakPolarHBondContact O-CA 3.47Å; N71-E75 WeakPolarHBondContact O-CB 3.37Å; N71-E75 WeakPolarHBondContact O-CG 3.47Å; N71-E75 PolarHBondContact O-N 2.83Å; E75-E78 PolarHBondContact O-N 3Å; E75-V79 WeakPolarHBondContact O-CB 3.4Å; E75-V79 WeakPolarHBondContact O-CG2 3.39Å; E75-V79 PolarHBondContact O-N 3.25Å |
| 76 | K | 69.7 | Low | 63.6 | Low | 156 Ų | 156 | 107.9 Ų | 107.9 | 68% | 0.678 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -65 | -39.2 | 173.5 | -85.3 | 178.4 | 176.6 | 170.2 | 0 | 112.1 | A72 I73 L74 L80 | A72-K76 VanDerWaalsContact O-CB 3.3Å; A72-K76 WeakPolarHBondContact O-CB 3.37Å; A72-K76 WeakPolarHBondContact O-CG 3.42Å; A72-K76 PolarHBondContact O-N 3.45Å; I73-K76 PolarHBondContact O-N 3.43Å; L74-K76 VanDerWaalsContact C-N 3.32Å; L74-K76 PolarHBondContact O-N 3.43Å; K76-L80 VanDerWaalsContact O-CB 3.28Å; K76-L80 WeakPolarHBondContact O-CB 3.39Å; K76-L80 VanDerWaalsContact O-CG 3.27Å; K76-L80 WeakPolarHBondContact O-CG 3.49Å; K76-L80 PolarHBondContact O-N 3.21Å |
| 77 | A | 67 | Low | 65.4 | Low | 48 Ų | 48 | 104.9 Ų | 104.9 | 40% | 0.397 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -69.1 | -37.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | I73 L74 L80 C81 | I73-A77 VanDerWaalsContact O-CB 3.24Å; I73-A77 WeakPolarHBondContact O-CB 3.43Å; I73-A77 PolarHBondContact O-N 3.18Å; L74-A77 CarbonylContact O-C 3.6Å; L74-A77 PolarHBondContact O-N 3.15Å; L74-A77 VanDerWaalsContact O-N 3.08Å; A77-L80 PolarHBondContact O-N 2.81Å; A77-C81 VanDerWaalsContact O-CB 3.3Å; A77-C81 WeakPolarHBondContact O-CB 3.5Å; A77-C81 PolarHBondContact O-N 3.48Å; A77-C81 PolarHBondContact O-SG 3.25Å |
| 78 | E | 72.9 | Confident | 66.8 | Low | 113 Ų | 113 | 97.8 Ų | 97.8 | 53% | 0.528 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -71.7 | -40.2 | 175.9 | -78.2 | -176.1 | 166.2 | 0 | 0 | 111.4 | L74 E75 C81 S82 | L74-E78 VanDerWaalsContact O-CB 3.28Å; L74-E78 WeakPolarHBondContact O-CB 3.44Å; L74-E78 WeakPolarHBondContact O-CG 3.3Å; L74-E78 PolarHBondContact O-N 3.25Å; E75-E78 PolarHBondContact O-N 3Å; E78-C81 PolarHBondContact O-N 3.04Å; E78-S82 WeakPolarHBondContact O-CB 3.36Å; E78-S82 PolarHBondContact O-N 2.99Å; E78-S82 PolarHBondContact O-OG 3.38Å |
| 79 | V | 77.4 | Confident | 68.1 | Low | 80 Ų | 80 | 95.5 Ų | 95.5 | 49% | 0.485 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.1 | -40.5 | 172.5 | 168.8 | 0 | 0 | 0 | 0 | 110.5 | E75 K83 | E75-V79 WeakPolarHBondContact O-CB 3.4Å; E75-V79 WeakPolarHBondContact O-CG2 3.39Å; E75-V79 PolarHBondContact O-N 3.25Å; V79-K83 WeakPolarHBondContact O-CB 3.4Å; V79-K83 WeakPolarHBondContact O-CG 3.44Å; V79-K83 PolarHBondContact O-N 3.41Å |
| 80 | L | 74.2 | Confident | 69.4 | Low | 116 Ų | 116 | 97.3 Ų | 97.3 | 61% | 0.607 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -68.1 | -42.8 | 174.5 | -78.8 | 169.4 | 0 | 0 | 0 | 111.8 | K76 A77 K83 L84 | K76-L80 VanDerWaalsContact O-CB 3.28Å; K76-L80 WeakPolarHBondContact O-CB 3.39Å; K76-L80 VanDerWaalsContact O-CG 3.27Å; K76-L80 WeakPolarHBondContact O-CG 3.49Å; K76-L80 PolarHBondContact O-N 3.21Å; A77-L80 PolarHBondContact O-N 2.81Å; L80-K83 PolarHBondContact O-N 3.2Å; L80-L84 WeakPolarHBondContact O-CB 3.5Å; L80-L84 PolarHBondContact O-N 3.47Å |
| 81 | C | 71.5 | Confident | 70.4 | Confident | 75 Ų | 75 | 97.4 Ų | 97.4 | 51% | 0.507 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.2 | -44.2 | 174.2 | -77.6 | 0 | 0 | 0 | 0 | 111.3 | A77 E78 K83 L84 I85 | A77-C81 VanDerWaalsContact O-CB 3.3Å; A77-C81 WeakPolarHBondContact O-CB 3.5Å; A77-C81 PolarHBondContact O-N 3.48Å; A77-C81 PolarHBondContact O-SG 3.25Å; E78-C81 PolarHBondContact O-N 3.04Å; C81-K83 PolarHBondContact O-N 3.46Å; C81-L84 WeakPolarHBondContact O-CB 3.1Å; C81-L84 PolarHBondContact O-N 3.29Å; C81-L84 VanDerWaalsContact O-N 3.13Å; C81-I85 VanDerWaalsContact O-CG1 3.29Å; C81-I85 WeakPolarHBondContact O-CG1 3.44Å; C81-I85 PolarHBondContact O-N 2.89Å |
| 82 | S | 76.4 | Confident | 71.1 | Confident | 68 Ų | 68 | 97.8 Ų | 97.8 | 48% | 0.476 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63 | -41.6 | 176.9 | -61.9 | 0 | 0 | 0 | 0 | 111.5 | E78 I85 L86 | E78-S82 WeakPolarHBondContact O-CB 3.36Å; E78-S82 PolarHBondContact O-N 2.99Å; E78-S82 PolarHBondContact O-OG 3.38Å; S82-I85 PolarHBondContact O-N 2.88Å; S82-L86 WeakPolarHBondContact O-CB 3.43Å; S82-L86 PolarHBondContact O-N 3.34Å |
| 83 | K | 77.3 | Confident | 71.6 | Confident | 133 Ų | 133 | 99.7 Ų | 99.7 | 58% | 0.578 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.2 | -42.8 | 171.5 | -84.5 | 179.7 | 178 | 175.8 | 0 | 111.5 | V79 L80 C81 L86 T87 | V79-K83 WeakPolarHBondContact O-CB 3.4Å; V79-K83 WeakPolarHBondContact O-CG 3.44Å; V79-K83 PolarHBondContact O-N 3.41Å; L80-K83 PolarHBondContact O-N 3.2Å; C81-K83 PolarHBondContact O-N 3.46Å; K83-L86 PolarHBondContact O-N 2.93Å; K83-T87 WeakPolarHBondContact O-CB 3.33Å; K83-T87 PolarHBondContact O-N 3.35Å; K83-T87 PolarHBondContact O-OG1 3.06Å |
| 84 | L | 76 | Confident | 72 | Confident | 130 Ų | 130 | 99.3 Ų | 99.3 | 68% | 0.681 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.9 | -43.6 | -179.9 | -154 | 113.4 | 0 | 0 | 0 | 111.2 | L80 C81 T87 A88 | L80-L84 WeakPolarHBondContact O-CB 3.5Å; L80-L84 PolarHBondContact O-N 3.47Å; C81-L84 WeakPolarHBondContact O-CB 3.1Å; C81-L84 PolarHBondContact O-N 3.29Å; C81-L84 VanDerWaalsContact O-N 3.13Å; L84-T87 PolarHBondContact O-N 2.87Å; L84-A88 WeakPolarHBondContact O-CB 3.39Å; L84-A88 PolarHBondContact O-N 3.4Å |
| 85 | I | 74.9 | Confident | 72.2 | Confident | 118 Ų | 118 | 98.5 Ų | 98.5 | 61% | 0.605 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.8 | -45.8 | 174.9 | -68 | 166 | 0 | 0 | 0 | 111 | C81 S82 T87 A88 S89 | C81-I85 VanDerWaalsContact O-CG1 3.29Å; C81-I85 WeakPolarHBondContact O-CG1 3.44Å; C81-I85 PolarHBondContact O-N 2.89Å; S82-I85 PolarHBondContact O-N 2.88Å; I85-T87 VanDerWaalsContact C-N 3.26Å; I85-T87 PolarHBondContact O-N 2.98Å; I85-A88 PolarHBondContact O-N 2.85Å; I85-S89 PolarHBondContact O-N 3.44Å |
| 86 | L | 76.9 | Confident | 71.9 | Confident | 103 Ų | 103 | 98 Ų | 98 | 54% | 0.539 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62 | -33.5 | 174.9 | -108.1 | 150 | 0 | 0 | 0 | 112.9 | S82 K83 S89 K90 | S82-L86 WeakPolarHBondContact O-CB 3.43Å; S82-L86 PolarHBondContact O-N 3.34Å; K83-L86 PolarHBondContact O-N 2.93Å; L86-S89 PolarHBondContact O-OG 2.86Å; L86-K90 WeakPolarHBondContact O-CB 3.31Å; L86-K90 WeakPolarHBondContact O-CG 3.42Å; L86-K90 PolarHBondContact O-N 3.31Å |
| 87 | T | 75.7 | Confident | 71.5 | Confident | 82 Ų | 82 | 97.1 Ų | 97.1 | 50% | 0.503 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -75.7 | -38.3 | 177.7 | -41.9 | 0 | 0 | 0 | 0 | 110.6 | K83 L84 I85 K90 L91 | K83-T87 WeakPolarHBondContact O-CB 3.33Å; K83-T87 PolarHBondContact O-N 3.35Å; K83-T87 PolarHBondContact O-OG1 3.06Å; L84-T87 PolarHBondContact O-N 2.87Å; I85-T87 VanDerWaalsContact C-N 3.26Å; I85-T87 PolarHBondContact O-N 2.98Å; T87-K90 PolarHBondContact O-N 3Å; T87-L91 PolarHBondContact O-N 3.25Å |
| 88 | A | 72.2 | Confident | 71 | Confident | 47 Ų | 47 | 101.5 Ų | 101.5 | 39% | 0.388 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.4 | -44.3 | 173 | 0 | 0 | 0 | 0 | 0 | 111.8 | L84 I85 K90 L91 E92 | L84-A88 WeakPolarHBondContact O-CB 3.39Å; L84-A88 PolarHBondContact O-N 3.4Å; I85-A88 PolarHBondContact O-N 2.85Å; A88-K90 VanDerWaalsContact C-N 3.34Å; A88-K90 PolarHBondContact O-N 3.16Å; A88-L91 WeakPolarHBondContact O-CB 3.36Å; A88-L91 PolarHBondContact O-N 3.41Å; A88-L91 VanDerWaalsContact O-N 3.11Å; A88-E92 PolarHBondContact O-N 2.82Å |
| 89 | S | 72.8 | Confident | 70.1 | Confident | 53 Ų | 53 | 103 Ų | 103 | 37% | 0.371 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67.6 | -32.8 | 178.2 | 96.8 | 0 | 0 | 0 | 0 | 112.7 | I85 L86 T93 | I85-S89 PolarHBondContact O-N 3.44Å; L86-S89 PolarHBondContact O-OG 2.86Å; S89-T93 WeakPolarHBondContact O-CG2 3.43Å; S89-T93 PolarHBondContact O-N 3.5Å; S89-T93 PolarHBondContact O-OG1 3.09Å |
| 90 | K | 75.8 | Confident | 69.1 | Low | 132 Ų | 132 | 107 Ų | 107 | 57% | 0.574 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -66.9 | -36.4 | 171 | -80.4 | 179.7 | -178.6 | 179.6 | 0 | 112.2 | L86 T87 A88 T93 L94 | L86-K90 WeakPolarHBondContact O-CB 3.31Å; L86-K90 WeakPolarHBondContact O-CG 3.42Å; L86-K90 PolarHBondContact O-N 3.31Å; T87-K90 PolarHBondContact O-N 3Å; A88-K90 VanDerWaalsContact C-N 3.34Å; A88-K90 PolarHBondContact O-N 3.16Å; K90-T93 WeakPolarHBondContact CA-OG1 3.46Å; K90-T93 PolarHBondContact O-OG1 3.44Å; K90-T93 VanDerWaalsContact O-OG1 3.1Å; K90-L94 WeakPolarHBondContact O-CB 3.49Å; K90-L94 WeakPolarHBondContact O-CD1 3.45Å; K90-L94 VanDerWaalsContact O-CG 3.23Å; K90-L94 WeakPolarHBondContact O-CG 3.35Å; K90-L94 PolarHBondContact O-N 2.94Å; K90-L94 VanDerWaalsContact O-N 3.1Å |
| 91 | L | 69.8 | Low | 68 | Low | 111 Ų | 111 | 110.6 Ų | 110.6 | 58% | 0.581 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -68.2 | -46.4 | 174 | -81.4 | 165 | 0 | 0 | 0 | 110.8 | T87 A88 T93 L94 T95 | T87-L91 PolarHBondContact O-N 3.25Å; A88-L91 WeakPolarHBondContact O-CB 3.36Å; A88-L91 PolarHBondContact O-N 3.41Å; A88-L91 VanDerWaalsContact O-N 3.11Å; L91-T93 PolarHBondContact O-N 3.1Å; L91-L94 WeakPolarHBondContact O-CA 3.37Å; L91-L94 WeakPolarHBondContact O-CB 3.4Å; L91-L94 PolarHBondContact O-N 3.27Å; L91-T95 PolarHBondContact O-N 2.94Å; L91-T95 PolarHBondContact O-OG1 3.42Å |
| 92 | E | 69.1 | Low | 67.1 | Low | 130 Ų | 130 | 110.5 Ų | 110.5 | 61% | 0.607 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -55.8 | -49 | 175.8 | -84.6 | 177.6 | 160.6 | 0 | 0 | 112 | A88 L94 T95 E96 | A88-E92 PolarHBondContact O-N 2.82Å; E92-L94 VanDerWaalsContact C-N 3.28Å; E92-L94 PolarHBondContact O-N 3.44Å; E92-T95 VanDerWaalsContact C-OG1 3.32Å; E92-T95 WeakPolarHBondContact CA-OG1 3.49Å; E92-T95 PolarHBondContact O-N 3.31Å; E92-T95 VanDerWaalsContact O-N 3.17Å; E92-T95 PolarHBondContact O-OG1 3.27Å; E92-E96 PolarHBondContact O-N 2.9Å |
| 93 | T | 69.5 | Low | 65.9 | Low | 66 Ų | 66 | 111.7 Ų | 111.7 | 41% | 0.405 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -66.3 | -25.9 | 176.7 | 49.6 | 0 | 0 | 0 | 0 | 113.9 | S89 K90 L91 K97 | S89-T93 WeakPolarHBondContact O-CG2 3.43Å; S89-T93 PolarHBondContact O-N 3.5Å; S89-T93 PolarHBondContact O-OG1 3.09Å; K90-T93 WeakPolarHBondContact CA-OG1 3.46Å; K90-T93 PolarHBondContact O-OG1 3.44Å; K90-T93 VanDerWaalsContact O-OG1 3.1Å; L91-T93 PolarHBondContact O-N 3.1Å; T93-K97 WeakPolarHBondContact O-CB 3.45Å; T93-K97 VanDerWaalsContact O-CG 3.24Å; T93-K97 WeakPolarHBondContact O-CG 3.19Å; T93-K97 PolarHBondContact O-N 2.86Å; T93-K97 VanDerWaalsContact O-N 3.16Å |
| 94 | L | 66.5 | Low | 64.4 | Low | 105 Ų | 105 | 112.4 Ų | 112.4 | 55% | 0.55 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -74.7 | -40 | 171.3 | -78.6 | 168.6 | 0 | 0 | 0 | 111.5 | K90 L91 E92 K97 Q98 | K90-L94 WeakPolarHBondContact O-CB 3.49Å; K90-L94 WeakPolarHBondContact O-CD1 3.45Å; K90-L94 VanDerWaalsContact O-CG 3.23Å; K90-L94 WeakPolarHBondContact O-CG 3.35Å; K90-L94 PolarHBondContact O-N 2.94Å; K90-L94 VanDerWaalsContact O-N 3.1Å; L91-L94 WeakPolarHBondContact O-CA 3.37Å; L91-L94 WeakPolarHBondContact O-CB 3.4Å; L91-L94 PolarHBondContact O-N 3.27Å; E92-L94 VanDerWaalsContact C-N 3.28Å; E92-L94 PolarHBondContact O-N 3.44Å; L94-K97 PolarHBondContact O-N 3.46Å; L94-Q98 WeakPolarHBondContact O-CB 3.36Å; L94-Q98 PolarHBondContact O-N 3.26Å |
| 95 | T | 62.9 | Low | 62.9 | Low | 73 Ų | 73 | 112.9 Ų | 112.9 | 45% | 0.448 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -65.2 | -43.2 | 173.3 | 26 | 0 | 0 | 0 | 0 | 112.3 | L91 E92 K97 Q98 E99 | L91-T95 PolarHBondContact O-N 2.94Å; L91-T95 PolarHBondContact O-OG1 3.42Å; E92-T95 VanDerWaalsContact C-OG1 3.32Å; E92-T95 WeakPolarHBondContact CA-OG1 3.49Å; E92-T95 PolarHBondContact O-N 3.31Å; E92-T95 VanDerWaalsContact O-N 3.17Å; E92-T95 PolarHBondContact O-OG1 3.27Å; T95-K97 VanDerWaalsContact C-N 3.32Å; T95-K97 PolarHBondContact O-N 2.94Å; T95-Q98 CarbonylContact O-C 3.57Å; T95-Q98 WeakPolarHBondContact O-CB 3.48Å; T95-Q98 PolarHBondContact O-N 3.34Å; T95-Q98 VanDerWaalsContact O-N 3.11Å; T95-E99 PolarHBondContact O-N 2.95Å |
| 96 | E | 60.9 | Low | 61.3 | Low | 120 Ų | 120 | 115.8 Ų | 115.8 | 56% | 0.561 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -64 | -35.8 | 174.8 | -75.3 | -177.3 | 162.7 | 0 | 0 | 112.3 | E92 K100 | E92-E96 PolarHBondContact O-N 2.9Å; E96-K100 PolarHBondContact O-N 3.27Å |
| 97 | K | 62.1 | Low | 59.8 | Low | 137 Ų | 137 | 116.1 Ų | 116.1 | 60% | 0.596 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -68.1 | -39.1 | 171.9 | -78.6 | 176.2 | -179.6 | 178.3 | 0 | 111.4 | T93 L94 T95 K100 Y101 | T93-K97 WeakPolarHBondContact O-CB 3.45Å; T93-K97 VanDerWaalsContact O-CG 3.24Å; T93-K97 WeakPolarHBondContact O-CG 3.19Å; T93-K97 PolarHBondContact O-N 2.86Å; T93-K97 VanDerWaalsContact O-N 3.16Å; L94-K97 PolarHBondContact O-N 3.46Å; T95-K97 VanDerWaalsContact C-N 3.32Å; T95-K97 PolarHBondContact O-N 2.94Å; K97-K100 PolarHBondContact O-N 3.36Å; K97-Y101 WeakPolarHBondContact O-CD2 3.38Å; K97-Y101 PolarHBondContact O-N 2.88Å |
| 98 | Q | 56.3 | Low | 58.8 | Low | 140 Ų | 140 | 116.3 Ų | 116.3 | 65% | 0.654 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -65.7 | -38.4 | 175.2 | -106.5 | -179.1 | -30 | 0 | 0 | 112.7 | L94 T95 K100 Y101 A102 | L94-Q98 WeakPolarHBondContact O-CB 3.36Å; L94-Q98 PolarHBondContact O-N 3.26Å; T95-Q98 CarbonylContact O-C 3.57Å; T95-Q98 WeakPolarHBondContact O-CB 3.48Å; T95-Q98 PolarHBondContact O-N 3.34Å; T95-Q98 VanDerWaalsContact O-N 3.11Å; Q98-K100 VanDerWaalsContact C-N 3.34Å; Q98-K100 PolarHBondContact O-N 3.44Å; Q98-Y101 PolarHBondContact O-N 3.41Å; Q98-A102 WeakPolarHBondContact O-CB 3.41Å; Q98-A102 PolarHBondContact O-N 3.15Å |
| 99 | E | 54.5 | Low | 58.1 | Low | 145 Ų | 145 | 118.7 Ų | 118.7 | 68% | 0.678 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -65.3 | -36 | 175.1 | -78.2 | -176.8 | 160.2 | 0 | 0 | 112.2 | T95 Y101 A102 | T95-E99 PolarHBondContact O-N 2.95Å; E99-Y101 VanDerWaalsContact C-N 3.33Å; E99-Y101 PolarHBondContact O-N 2.96Å; E99-A102 PolarHBondContact O-N 3Å |
| 100 | K | 55.3 | Low | 57.7 | Low | 163 Ų | 163 | 121 Ų | 121 | 71% | 0.709 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -70.7 | -22.6 | 172.9 | -75.9 | -178.7 | 179 | 174.8 | 0 | 114.5 | E96 K97 Q98 S103 | E96-K100 PolarHBondContact O-N 3.27Å; K97-K100 PolarHBondContact O-N 3.36Å; Q98-K100 VanDerWaalsContact C-N 3.34Å; Q98-K100 PolarHBondContact O-N 3.44Å; K100-S103 PolarHBondContact O-OG 3.38Å; K100-S103 VanDerWaalsContact O-OG 3.07Å |
| 101 | Y | 52 | Low | 57.4 | Low | 192 Ų | 192 | 120.5 Ų | 120.5 | 75% | 0.753 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -86.8 | -21.4 | 171.9 | -83.7 | -73.3 | 0 | 0 | 0 | 112.8 | K97 Q98 E99 | K97-Y101 WeakPolarHBondContact O-CD2 3.38Å; K97-Y101 PolarHBondContact O-N 2.88Å; Q98-Y101 PolarHBondContact O-N 3.41Å; E99-Y101 VanDerWaalsContact C-N 3.33Å; E99-Y101 PolarHBondContact O-N 2.96Å |
| 102 | A | 52.2 | Low | 57.3 | Low | 72 Ų | 72 | 124 Ų | 124 | 60% | 0.595 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -77.5 | -18.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q98 E99 D104 | Q98-A102 WeakPolarHBondContact O-CB 3.41Å; Q98-A102 PolarHBondContact O-N 3.15Å; E99-A102 PolarHBondContact O-N 3Å; A102-D104 VanDerWaalsContact C-N 3.3Å; A102-D104 PolarHBondContact O-N 2.95Å |
| 103 | S | 51.1 | Low | 57.3 | Low | 93 Ų | 93 | 122.6 Ų | 122.6 | 65% | 0.65 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | -9 | 177.2 | 41.2 | 0 | 0 | 0 | 0 | 115.2 | K100 | K100-S103 PolarHBondContact O-OG 3.38Å; K100-S103 VanDerWaalsContact O-OG 3.07Å |
| 104 | D | 45.3 | Very low | 57.5 | Low | 148 Ų | 148 | 122.2 Ų | 122.2 | 79% | 0.791 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.7 | 15 | -175.4 | -89.6 | -19.9 | 0 | 0 | 0 | 115.1 | A102 | A102-D104 VanDerWaalsContact C-N 3.3Å; A102-D104 PolarHBondContact O-N 2.95Å |
| 105 | Q | 45.6 | Very low | 58 | Low | 140 Ų | 140 | 121.9 Ų | 121.9 | 65% | 0.654 | 64% | 0.637 | S | S | * | * | trans | -132.6 | 95.2 | 174.9 | -71.7 | -168.8 | -12.7 | 0 | 0 | 113.2 | S107 | Q105-S107 PolarHBondContact O-N 3.28Š| ||
| 106 | N | 40.2 | Very low | 58.6 | Low | 180 Ų | 180 | 123.6 Ų | 123.6 | 96% | 0.963 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -67.2 | 73.8 | 160.6 | -87.9 | -26 | 0 | 0 | 0 | 110.7 | ||
| 107 | S | 45.7 | Very low | 59.3 | Low | 109 Ų | 109 | 120 Ų | 120 | 76% | 0.762 | 63% | 0.633 | S | S | * | * | trans | 177.5 | 75.4 | 149.5 | 64.7 | 0 | 0 | 0 | 0 | 110.3 | Q105 | Q105-S107 PolarHBondContact O-N 3.28Š| ||
| 108 | V | 54.9 | Low | 60.3 | Low | 87 Ų | 87 | 119 Ų | 119 | 53% | 0.527 | 63% | 0.631 | S | S | . | * | trans | -106.6 | 116.1 | 168.5 | -177.3 | 0 | 0 | 0 | 0 | 108.7 | P110 L113 | V108-P110 WeakPolarHBondContact O-CD 3.44Å; V108-L113 HydrophobicContact CG1-CD1 3.71Å; V108-L113 HydrophobicContact CG1-CG 4.03Å | ||
| 109 | D | 58.6 | Low | 61.6 | Low | 96 Ų | 96 | 119.6 Ų | 119.6 | 51% | 0.513 | 63% | 0.631 | S | S | . | * | trans | -64.9 | 116.9 | -179.5 | -176.9 | -4.2 | 0 | 0 | 0 | 110.9 | L111 R112 | D109-L111 PolarHBondContact O-N 3.48Å; D109-L111 VanDerWaalsContact O-N 3.09Å; D109-L111 PolarHBondContact OD1-N 3.23Å; D109-R112 HydrophobicContact CB-CB 4.47Å; D109-R112 WeakPolarHBondContact O-CB 3.44Å; D109-R112 PolarHBondContact O-N 2.92Å | ||
| 110 | P | 63.1 | Low | 62.9 | Low | 101 Ų | 101 | 119.4 Ų | 119.4 | 66% | 0.656 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -53.3 | -30 | -179.6 | -26 | 33.7 | 0 | 0 | 0 | 114 | V108 R112 L113 A114 | V108-P110 WeakPolarHBondContact O-CD 3.44Å; P110-R112 VanDerWaalsContact C-N 3.28Å; P110-R112 PolarHBondContact O-N 3.1Å; P110-L113 PolarHBondContact O-N 2.93Å; P110-A114 PolarHBondContact O-N 3.4Å |
| 111 | L | 70.3 | Confident | 64.3 | Low | 122 Ų | 122 | 119.2 Ų | 119.2 | 64% | 0.639 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -66.4 | -32.7 | 178.6 | -123.6 | 95.7 | 0 | 0 | 0 | 112.3 | D109 N115 | D109-L111 PolarHBondContact O-N 3.48Å; D109-L111 VanDerWaalsContact O-N 3.09Å; D109-L111 PolarHBondContact OD1-N 3.23Å; L111-N115 WeakPolarHBondContact O-CB 3.47Å; L111-N115 PolarHBondContact O-N 3.47Å |
| 112 | R | 68.3 | Low | 66 | Low | 185 Ų | 185 | 113.4 Ų | 113.4 | 70% | 0.698 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -73.6 | -39.2 | -179.1 | -134.7 | -177.4 | 177.7 | -162.9 | -1.2 | 111 | D109 P110 N115 I116 | D109-R112 HydrophobicContact CB-CB 4.47Å; D109-R112 WeakPolarHBondContact O-CB 3.44Å; D109-R112 PolarHBondContact O-N 2.92Å; P110-R112 VanDerWaalsContact C-N 3.28Å; P110-R112 PolarHBondContact O-N 3.1Å; R112-N115 PolarHBondContact O-N 2.9Å; R112-I116 VanDerWaalsContact O-CG1 3.29Å; R112-I116 WeakPolarHBondContact O-CG1 3.37Å; R112-I116 PolarHBondContact O-N 3.25Å |
| 113 | L | 67.4 | Low | 67.5 | Low | 101 Ų | 101 | 113 Ų | 113 | 53% | 0.529 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -65 | -43.1 | 173.2 | -81.5 | 162.5 | 0 | 0 | 0 | 111.7 | V108 P110 N115 I116 A117 | V108-L113 HydrophobicContact CG1-CD1 3.71Å; V108-L113 HydrophobicContact CG1-CG 4.03Å; P110-L113 PolarHBondContact O-N 2.93Å; L113-N115 PolarHBondContact O-N 3.43Å; L113-I116 PolarHBondContact O-N 3.36Å; L113-A117 WeakPolarHBondContact O-CB 3.44Å; L113-A117 PolarHBondContact O-N 3.48Å |
| 114 | A | 73.9 | Confident | 69.1 | Low | 58 Ų | 58 | 112.3 Ų | 112.3 | 48% | 0.479 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -61.1 | -42.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | P110 I116 A117 Q118 | P110-A114 PolarHBondContact O-N 3.4Å; A114-I116 PolarHBondContact O-N 3.26Å; A114-A117 PolarHBondContact O-N 2.9Å; A114-Q118 WeakPolarHBondContact O-CB 3.34Å; A114-Q118 PolarHBondContact O-N 2.9Å |
| 115 | N | 76.8 | Confident | 71.1 | Confident | 97 Ų | 97 | 112.3 Ų | 112.3 | 52% | 0.519 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -65.2 | -36 | 176 | -88.3 | -31.5 | 0 | 0 | 0 | 113.4 | L111 R112 L113 K119 | L111-N115 WeakPolarHBondContact O-CB 3.47Å; L111-N115 PolarHBondContact O-N 3.47Å; R112-N115 PolarHBondContact O-N 2.9Å; L113-N115 PolarHBondContact O-N 3.43Å; N115-K119 WeakPolarHBondContact O-CG 3.3Å; N115-K119 PolarHBondContact O-N 3.36Å; N115-K119 VanDerWaalsContact O-N 3.08Å |
| 116 | I | 76.3 | Confident | 73.1 | Confident | 110 Ų | 110 | 110.6 Ų | 110.6 | 56% | 0.564 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -68.7 | -44.2 | 175.5 | -69.2 | 166 | 0 | 0 | 0 | 110.2 | R112 L113 A114 Q118 K119 Y120 | R112-I116 VanDerWaalsContact O-CG1 3.29Å; R112-I116 WeakPolarHBondContact O-CG1 3.37Å; R112-I116 PolarHBondContact O-N 3.25Å; L113-I116 PolarHBondContact O-N 3.36Å; A114-I116 PolarHBondContact O-N 3.26Å; I116-Q118 VanDerWaalsContact C-N 3.34Å; I116-Q118 PolarHBondContact O-N 3Å; I116-K119 PolarHBondContact O-N 2.82Å; I116-Y120 PolarHBondContact O-N 2.91Å |
| 117 | A | 76.3 | Confident | 75.3 | Confident | 45 Ų | 45 | 107.1 Ų | 107.1 | 37% | 0.372 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.5 | -41.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L113 A114 Y120 W121 | L113-A117 WeakPolarHBondContact O-CB 3.44Å; L113-A117 PolarHBondContact O-N 3.48Å; A114-A117 PolarHBondContact O-N 2.9Å; A117-Y120 WeakPolarHBondContact O-CB 3.48Å; A117-Y120 PolarHBondContact O-N 3.19Å; A117-W121 PolarHBondContact O-N 3.43Å |
| 118 | Q | 81.9 | Confident | 77.2 | Confident | 115 Ų | 115 | 105.5 Ų | 105.5 | 54% | 0.537 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.9 | -47.9 | 176.6 | -170.9 | 119.9 | 4.7 | 0 | 0 | 111.7 | A114 I116 Y120 W121 D122 | A114-Q118 WeakPolarHBondContact O-CB 3.34Å; A114-Q118 PolarHBondContact O-N 2.9Å; I116-Q118 VanDerWaalsContact C-N 3.34Å; I116-Q118 PolarHBondContact O-N 3Å; Q118-Y120 VanDerWaalsContact C-N 3.29Å; Q118-Y120 PolarHBondContact O-N 3.25Å; Q118-W121 PolarHBondContact O-N 3.4Å; Q118-D122 WeakPolarHBondContact O-CB 3.43Å; Q118-D122 VanDerWaalsContact O-CG 3.31Å; Q118-D122 PolarHBondContact O-N 2.83Å |
| 119 | K | 83.3 | Confident | 78.8 | Confident | 152 Ų | 152 | 105.1 Ų | 105.1 | 66% | 0.661 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -58.9 | -40.3 | 175.2 | -76.1 | -178.9 | 178.7 | -175.7 | 0 | 112.2 | N115 I116 D122 S123 | N115-K119 WeakPolarHBondContact O-CG 3.3Å; N115-K119 PolarHBondContact O-N 3.36Å; N115-K119 VanDerWaalsContact O-N 3.08Å; I116-K119 PolarHBondContact O-N 2.82Å; K119-D122 PolarHBondContact O-N 2.95Å; K119-S123 WeakPolarHBondContact O-CB 3.5Å; K119-S123 PolarHBondContact O-N 2.89Å; K119-S123 PolarHBondContact O-OG 3.46Å; K119-S123 VanDerWaalsContact O-OG 3.13Å |
| 120 | Y | 81.7 | Confident | 80.3 | Confident | 142 Ų | 142 | 105.3 Ų | 105.3 | 56% | 0.557 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -60.5 | -49 | 175.3 | 174.1 | -92.4 | 0 | 0 | 0 | 111.7 | I116 A117 Q118 D122 S123 K124 | I116-Y120 PolarHBondContact O-N 2.91Å; A117-Y120 WeakPolarHBondContact O-CB 3.48Å; A117-Y120 PolarHBondContact O-N 3.19Å; Q118-Y120 VanDerWaalsContact C-N 3.29Å; Q118-Y120 PolarHBondContact O-N 3.25Å; Y120-D122 VanDerWaalsContact C-N 3.35Å; Y120-D122 PolarHBondContact O-N 3.41Å; Y120-S123 PolarHBondContact O-N 3.02Å; Y120-K124 VanDerWaalsContact O-CB 3.28Å; Y120-K124 WeakPolarHBondContact O-CB 3.38Å; Y120-K124 PolarHBondContact O-N 2.89Å |
| 121 | W | 85.8 | Confident | 81.4 | Confident | 159 Ų | 159 | 103.1 Ų | 103.1 | 60% | 0.602 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -67 | -34.2 | 179.7 | -74.5 | 116.9 | 0 | 0 | 0 | 113.1 | A117 Q118 K124 R125 | A117-W121 PolarHBondContact O-N 3.43Å; Q118-W121 PolarHBondContact O-N 3.4Å; W121-K124 HydrophobicContact CE3-CG 4.47Å; W121-K124 PolarHBondContact O-N 3.24Å; W121-R125 WeakPolarHBondContact O-CB 3.42Å; W121-R125 WeakPolarHBondContact O-CG 3.49Å; W121-R125 PolarHBondContact O-N 2.93Å |
| 122 | D | 86.7 | Confident | 82.3 | Confident | 69 Ų | 69 | 101.4 Ų | 101.4 | 37% | 0.369 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -68.1 | -46.4 | 174.1 | -69.6 | -19.9 | 0 | 0 | 0 | 111.3 | Q118 K119 Y120 K124 R125 E126 | Q118-D122 WeakPolarHBondContact O-CB 3.43Å; Q118-D122 VanDerWaalsContact O-CG 3.31Å; Q118-D122 PolarHBondContact O-N 2.83Å; K119-D122 PolarHBondContact O-N 2.95Å; Y120-D122 VanDerWaalsContact C-N 3.35Å; Y120-D122 PolarHBondContact O-N 3.41Å; D122-K124 VanDerWaalsContact C-N 3.31Å; D122-K124 PolarHBondContact O-N 2.93Å; D122-R125 PolarHBondContact O-N 2.98Å; D122-R125 IonicContact OD1-CZ 3.95Å; D122-R125 IonicContact OD1-NE 3.42Å; D122-R125 IonicContact OD1-NH2 3.5Å; D122-R125 PolarHBondContact OD1-NH2 3.32Å; D122-E126 PolarHBondContact O-N 3.41Å |
| 123 | S | 83.8 | Confident | 83.5 | Confident | 64 Ų | 64 | 98.3 Ų | 98.3 | 45% | 0.448 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.5 | -38.8 | 173 | -66.4 | 0 | 0 | 0 | 0 | 112.1 | K119 Y120 E126 I127 | K119-S123 WeakPolarHBondContact O-CB 3.5Å; K119-S123 PolarHBondContact O-N 2.89Å; K119-S123 PolarHBondContact O-OG 3.46Å; K119-S123 VanDerWaalsContact O-OG 3.13Å; Y120-S123 PolarHBondContact O-N 3.02Å; S123-E126 PolarHBondContact O-N 3.22Å; S123-I127 WeakPolarHBondContact O-CB 3.39Å; S123-I127 VanDerWaalsContact O-CG1 3.26Å; S123-I127 WeakPolarHBondContact O-CG1 3.45Å; S123-I127 PolarHBondContact O-N 3.4Å |
| 124 | K | 84.8 | Confident | 84.5 | Confident | 78 Ų | 78 | 101.2 Ų | 101.2 | 34% | 0.339 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.6 | -45.5 | 176.5 | -178.8 | 54.1 | 176.8 | 155.8 | 0 | 111.3 | Y120 W121 D122 E126 I127 D128 | Y120-K124 VanDerWaalsContact O-CB 3.28Å; Y120-K124 WeakPolarHBondContact O-CB 3.38Å; Y120-K124 PolarHBondContact O-N 2.89Å; W121-K124 HydrophobicContact CE3-CG 4.47Å; W121-K124 PolarHBondContact O-N 3.24Å; D122-K124 VanDerWaalsContact C-N 3.31Å; D122-K124 PolarHBondContact O-N 2.93Å; K124-E126 VanDerWaalsContact C-N 3.34Å; K124-E126 PolarHBondContact O-N 2.88Å; K124-I127 PolarHBondContact O-N 3.11Å; K124-D128 WeakPolarHBondContact CE-OD1 3.44Å; K124-D128 VanDerWaalsContact CE-OD2 3.27Å; K124-D128 WeakPolarHBondContact CE-OD2 3.29Å; K124-D128 IonicContact NZ-OD1 2.74Å; K124-D128 PolarHBondContact NZ-OD1 3.16Å; K124-D128 IonicContact NZ-OD2 3.94Å; K124-D128 WeakPolarHBondContact O-CB 3.47Å; K124-D128 VanDerWaalsContact O-CG 3.23Å; K124-D128 PolarHBondContact O-N 3Å |
| 125 | R | 86.8 | Confident | 85.3 | Confident | 148 Ų | 148 | 103.5 Ų | 103.5 | 56% | 0.558 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.2 | -39.8 | 174.2 | -83.1 | -172.6 | -74.9 | -157.1 | -1.6 | 112.9 | W121 D122 S129 | W121-R125 WeakPolarHBondContact O-CB 3.42Å; W121-R125 WeakPolarHBondContact O-CG 3.49Å; W121-R125 PolarHBondContact O-N 2.93Å; D122-R125 PolarHBondContact O-N 2.98Å; D122-R125 IonicContact OD1-CZ 3.95Å; D122-R125 IonicContact OD1-NE 3.42Å; D122-R125 IonicContact OD1-NH2 3.5Å; D122-R125 PolarHBondContact OD1-NH2 3.32Å; R125-S129 WeakPolarHBondContact O-CB 3.34Å; R125-S129 PolarHBondContact O-N 2.94Å; R125-S129 PolarHBondContact O-OG 2.95Å |
| 126 | E | 88.9 | Confident | 86 | Confident | 105 Ų | 105 | 105 Ų | 105 | 49% | 0.491 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.5 | -43.4 | 176.6 | -166.5 | -172.6 | 162.1 | 0 | 0 | 111.6 | D122 S123 K124 S129 K130 | D122-E126 PolarHBondContact O-N 3.41Å; S123-E126 PolarHBondContact O-N 3.22Å; K124-E126 VanDerWaalsContact C-N 3.34Å; K124-E126 PolarHBondContact O-N 2.88Å; E126-S129 PolarHBondContact O-N 2.88Å; E126-K130 WeakPolarHBondContact O-CG 3.34Å; E126-K130 PolarHBondContact O-N 3.49Å; E126-K130 WeakPolarHBondContact OE1-CE 3.28Å; E126-K130 IonicContact OE1-NZ 3.94Å; E126-K130 PolarHBondContact OE1-NZ 2.77Å |
| 127 | I | 86.1 | Confident | 86.8 | Confident | 106 Ų | 106 | 103.1 Ų | 103.1 | 54% | 0.544 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.9 | -47.6 | 175.9 | -70.9 | 167.3 | 0 | 0 | 0 | 110.7 | S123 K124 S129 K130 A131 | S123-I127 WeakPolarHBondContact O-CB 3.39Å; S123-I127 VanDerWaalsContact O-CG1 3.26Å; S123-I127 WeakPolarHBondContact O-CG1 3.45Å; S123-I127 PolarHBondContact O-N 3.4Å; K124-I127 PolarHBondContact O-N 3.11Å; I127-S129 VanDerWaalsContact C-N 3.3Å; I127-S129 PolarHBondContact O-N 3.33Å; I127-K130 PolarHBondContact O-N 3.47Å; I127-A131 WeakPolarHBondContact O-CB 3.47Å; I127-A131 PolarHBondContact O-N 3.29Å |
| 128 | D | 85.6 | Confident | 87.3 | Confident | 75 Ų | 75 | 106.9 Ų | 106.9 | 40% | 0.401 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.2 | -37.8 | -179.6 | -67.8 | -20.2 | 0 | 0 | 0 | 111.1 | K124 A131 E132 | K124-D128 WeakPolarHBondContact CE-OD1 3.44Å; K124-D128 VanDerWaalsContact CE-OD2 3.27Å; K124-D128 WeakPolarHBondContact CE-OD2 3.29Å; K124-D128 IonicContact NZ-OD1 2.74Å; K124-D128 PolarHBondContact NZ-OD1 3.16Å; K124-D128 IonicContact NZ-OD2 3.94Å; K124-D128 WeakPolarHBondContact O-CB 3.47Å; K124-D128 VanDerWaalsContact O-CG 3.23Å; K124-D128 PolarHBondContact O-N 3Å; D128-A131 PolarHBondContact O-N 2.9Å; D128-E132 PolarHBondContact O-N 2.74Å |
| 129 | S | 88.6 | Confident | 87.9 | Confident | 79 Ų | 79 | 106.2 Ų | 106.2 | 55% | 0.552 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.4 | -45.3 | 175 | -60.1 | 0 | 0 | 0 | 0 | 112.2 | R125 E126 I127 E132 E133 | R125-S129 WeakPolarHBondContact O-CB 3.34Å; R125-S129 PolarHBondContact O-N 2.94Å; R125-S129 PolarHBondContact O-OG 2.95Å; E126-S129 PolarHBondContact O-N 2.88Å; I127-S129 VanDerWaalsContact C-N 3.3Å; I127-S129 PolarHBondContact O-N 3.33Å; S129-E132 PolarHBondContact O-N 3.14Å; S129-E133 PolarHBondContact O-N 3.44Å |
| 130 | K | 90.8 | Very high | 88.4 | Confident | 100 Ų | 100 | 105.2 Ų | 105.2 | 44% | 0.435 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.3 | -40.5 | 175.5 | -75.2 | 177.8 | -174.4 | 165.3 | 0 | 111.5 | E126 I127 E132 E133 Y134 | E126-K130 WeakPolarHBondContact O-CG 3.34Å; E126-K130 PolarHBondContact O-N 3.49Å; E126-K130 WeakPolarHBondContact OE1-CE 3.28Å; E126-K130 IonicContact OE1-NZ 3.94Å; E126-K130 PolarHBondContact OE1-NZ 2.77Å; I127-K130 PolarHBondContact O-N 3.47Å; K130-E132 VanDerWaalsContact C-N 3.35Å; K130-E132 PolarHBondContact O-N 2.94Å; K130-E133 PolarHBondContact O-N 3.41Å; K130-Y134 HydrophobicContact CB-CD2 4.47Å; K130-Y134 HydrophobicContact CB-CE2 4.38Å; K130-Y134 WeakPolarHBondContact O-CD2 3.49Å; K130-Y134 PolarHBondContact O-N 3.35Å |
| 131 | A | 86 | Confident | 88.8 | Confident | 55 Ų | 55 | 105.5 Ų | 105.5 | 46% | 0.455 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61 | -43.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | I127 D128 Y134 K135 | I127-A131 WeakPolarHBondContact O-CB 3.47Å; I127-A131 PolarHBondContact O-N 3.29Å; D128-A131 PolarHBondContact O-N 2.9Å; A131-Y134 PolarHBondContact O-N 3.48Å; A131-K135 WeakPolarHBondContact O-CB 3.25Å; A131-K135 PolarHBondContact O-N 3.35Å |
| 132 | E | 89.3 | Confident | 89 | Confident | 86 Ų | 86 | 100.3 Ų | 100.3 | 40% | 0.402 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -67.8 | -36.8 | 176.8 | -166.4 | 60.2 | -154.2 | 0 | 0 | 112.1 | D128 S129 K130 K135 K136 | D128-E132 PolarHBondContact O-N 2.74Å; S129-E132 PolarHBondContact O-N 3.14Å; K130-E132 VanDerWaalsContact C-N 3.35Å; K130-E132 PolarHBondContact O-N 2.94Å; E132-K135 PolarHBondContact O-N 2.87Å; E132-K136 WeakPolarHBondContact O-CG 3.44Å; E132-K136 PolarHBondContact O-N 2.96Å |
| 133 | E | 91.9 | Very high | 89.4 | Confident | 121 Ų | 121 | 101.9 Ų | 101.9 | 57% | 0.565 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -64.2 | -44.2 | 172.6 | -169.1 | -177 | 174.7 | 0 | 0 | 111.9 | S129 K130 K135 K136 N137 | S129-E133 PolarHBondContact O-N 3.44Å; K130-E133 PolarHBondContact O-N 3.41Å; E133-K135 VanDerWaalsContact C-N 3.32Å; E133-K135 PolarHBondContact O-N 3.29Å; E133-K136 PolarHBondContact O-N 3.15Å; E133-N137 WeakPolarHBondContact O-CB 3.39Å; E133-N137 PolarHBondContact O-N 2.74Å; E133-N137 PolarHBondContact O-ND2 2.91Å |
| 134 | Y | 89.7 | Confident | 89.8 | Confident | 162 Ų | 162 | 103.3 Ų | 103.3 | 64% | 0.635 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -60.9 | -41.8 | 174.3 | -81.1 | -60.9 | 0 | 0 | 0 | 111.9 | K130 A131 N137 F138 | K130-Y134 HydrophobicContact CB-CD2 4.47Å; K130-Y134 HydrophobicContact CB-CE2 4.38Å; K130-Y134 WeakPolarHBondContact O-CD2 3.49Å; K130-Y134 PolarHBondContact O-N 3.35Å; A131-Y134 PolarHBondContact O-N 3.48Å; Y134-N137 PolarHBondContact O-N 3.28Å; Y134-F138 VanDerWaalsContact O-CB 3.29Å; Y134-F138 WeakPolarHBondContact O-CB 3.44Å; Y134-F138 PolarHBondContact O-N 3.46Å |
| 135 | K | 90.4 | Very high | 90.2 | Very high | 105 Ų | 105 | 102.1 Ų | 102.1 | 46% | 0.457 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.6 | -50.4 | 175.9 | -176.3 | -175.2 | 171.5 | -165.9 | 0 | 111.2 | A131 E132 E133 N137 F138 E139 | A131-K135 WeakPolarHBondContact O-CB 3.25Å; A131-K135 PolarHBondContact O-N 3.35Å; E132-K135 PolarHBondContact O-N 2.87Å; E133-K135 VanDerWaalsContact C-N 3.32Å; E133-K135 PolarHBondContact O-N 3.29Å; K135-N137 VanDerWaalsContact C-N 3.33Å; K135-N137 PolarHBondContact O-N 2.91Å; K135-F138 WeakPolarHBondContact O-CB 3.39Å; K135-F138 PolarHBondContact O-N 3.44Å; K135-F138 VanDerWaalsContact O-N 3.12Å; K135-E139 WeakPolarHBondContact CE-OE1 3.49Å; K135-E139 WeakPolarHBondContact O-CG 3.36Å; K135-E139 PolarHBondContact O-N 2.98Å |
| 136 | K | 92.2 | Very high | 90.5 | Very high | 130 Ų | 130 | 100 Ų | 100 | 57% | 0.565 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -59.3 | -41.8 | 175.5 | -74.2 | 179 | -178.1 | 176.6 | 0 | 112.5 | E132 E133 F138 K140 | E132-K136 WeakPolarHBondContact O-CG 3.44Å; E132-K136 PolarHBondContact O-N 2.96Å; E133-K136 PolarHBondContact O-N 3.15Å; K136-F138 VanDerWaalsContact C-N 3.33Å; K136-K140 WeakPolarHBondContact O-CB 3.33Å; K136-K140 PolarHBondContact O-N 2.99Å |
| 137 | N | 92.3 | Very high | 90.8 | Very high | 69 Ų | 69 | 100.7 Ų | 100.7 | 37% | 0.369 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -68.3 | -31.7 | 176.6 | -80.4 | -28.3 | 0 | 0 | 0 | 112.8 | E133 Y134 K135 R141 | E133-N137 WeakPolarHBondContact O-CB 3.39Å; E133-N137 PolarHBondContact O-N 2.74Å; E133-N137 PolarHBondContact O-ND2 2.91Å; Y134-N137 PolarHBondContact O-N 3.28Å; K135-N137 VanDerWaalsContact C-N 3.33Å; K135-N137 PolarHBondContact O-N 2.91Å; N137-R141 WeakPolarHBondContact O-CG 3.4Å; N137-R141 PolarHBondContact O-N 2.92Å; N137-R141 PolarHBondContact O-NE 3.31Å |
| 138 | F | 87.7 | Confident | 91.2 | Very high | 124 Ų | 124 | 101.6 Ų | 101.6 | 54% | 0.544 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -70.4 | -50.2 | 173.5 | -179.3 | -98.5 | 0 | 0 | 0 | 110.9 | Y134 K135 K136 K140 R141 C142 | Y134-F138 VanDerWaalsContact O-CB 3.29Å; Y134-F138 WeakPolarHBondContact O-CB 3.44Å; Y134-F138 PolarHBondContact O-N 3.46Å; K135-F138 WeakPolarHBondContact O-CB 3.39Å; K135-F138 PolarHBondContact O-N 3.44Å; K135-F138 VanDerWaalsContact O-N 3.12Å; K136-F138 VanDerWaalsContact C-N 3.33Å; F138-K140 VanDerWaalsContact C-N 3.29Å; F138-K140 PolarHBondContact O-N 3.36Å; F138-R141 WeakPolarHBondContact O-CA 3.32Å; F138-R141 WeakPolarHBondContact O-CB 3.46Å; F138-R141 PolarHBondContact O-N 3.14Å; F138-C142 WeakPolarHBondContact CE1-SG 3.47Å; F138-C142 PolarHBondContact O-N 3.39Å; F138-C142 PolarHBondContact O-SG 3.49Å; F138-C142 VanDerWaalsContact O-SG 3.42Å |
| 139 | E | 93.2 | Very high | 91.5 | Very high | 102 Ų | 102 | 106.4 Ų | 106.4 | 48% | 0.477 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -56.4 | -42.3 | 176 | -72.2 | 172.5 | 178.2 | 0 | 0 | 111.9 | K135 R141 C142 L143 | K135-E139 WeakPolarHBondContact CE-OE1 3.49Å; K135-E139 WeakPolarHBondContact O-CG 3.36Å; K135-E139 PolarHBondContact O-N 2.98Å; E139-R141 VanDerWaalsContact C-N 3.35Å; E139-R141 PolarHBondContact O-N 2.95Å; E139-C142 PolarHBondContact O-N 2.77Å; E139-L143 PolarHBondContact O-N 2.98Å |
| 140 | K | 93.8 | Very high | 91.8 | Very high | 131 Ų | 131 | 109.6 Ų | 109.6 | 57% | 0.57 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.4 | -41 | 174.8 | -173.4 | 178.7 | -180 | -178.4 | 0 | 112.4 | K136 F138 L143 Q144 | K136-K140 WeakPolarHBondContact O-CB 3.33Å; K136-K140 PolarHBondContact O-N 2.99Å; F138-K140 VanDerWaalsContact C-N 3.29Å; F138-K140 PolarHBondContact O-N 3.36Å; K140-L143 PolarHBondContact O-N 2.83Å; K140-Q144 WeakPolarHBondContact O-CG 3.49Å; K140-Q144 PolarHBondContact O-N 3.31Å |
| 141 | R | 90.7 | Very high | 92 | Very high | 148 Ų | 148 | 107.6 Ų | 107.6 | 56% | 0.558 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -68.5 | -39.1 | 176.6 | -79.6 | -176.9 | -76.1 | 171.2 | -3.5 | 111.9 | N137 F138 E139 Q144 A145 | N137-R141 WeakPolarHBondContact O-CG 3.4Å; N137-R141 PolarHBondContact O-N 2.92Å; N137-R141 PolarHBondContact O-NE 3.31Å; F138-R141 WeakPolarHBondContact O-CA 3.32Å; F138-R141 WeakPolarHBondContact O-CB 3.46Å; F138-R141 PolarHBondContact O-N 3.14Å; E139-R141 VanDerWaalsContact C-N 3.35Å; E139-R141 PolarHBondContact O-N 2.95Å; R141-Q144 PolarHBondContact O-N 3.49Å; R141-A145 WeakPolarHBondContact O-CB 3.47Å; R141-A145 PolarHBondContact O-N 3.49Å |
| 142 | C | 90.4 | Very high | 92.3 | Very high | 49 Ų | 49 | 109.5 Ų | 109.5 | 33% | 0.331 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.7 | -46.6 | 172.5 | -68 | 0 | 0 | 0 | 0 | 111.2 | F138 E139 Q144 A145 D146 | F138-C142 WeakPolarHBondContact CE1-SG 3.47Å; F138-C142 PolarHBondContact O-N 3.39Å; F138-C142 PolarHBondContact O-SG 3.49Å; F138-C142 VanDerWaalsContact O-SG 3.42Å; E139-C142 PolarHBondContact O-N 2.77Å; C142-Q144 VanDerWaalsContact C-N 3.32Å; C142-Q144 PolarHBondContact O-N 2.86Å; C142-A145 WeakPolarHBondContact O-CB 3.49Å; C142-A145 PolarHBondContact O-N 3.36Å; C142-A145 VanDerWaalsContact O-N 3.17Å; C142-D146 PolarHBondContact O-N 2.95Å |
| 143 | L | 94.1 | Very high | 92.6 | Very high | 102 Ų | 102 | 108.5 Ų | 108.5 | 53% | 0.534 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.2 | -40.7 | 177.1 | -164.1 | 95.7 | 0 | 0 | 0 | 112.3 | E139 K140 D146 Q147 | E139-L143 PolarHBondContact O-N 2.98Å; K140-L143 PolarHBondContact O-N 2.83Å; L143-D146 PolarHBondContact O-N 3.09Å; L143-Q147 VanDerWaalsContact O-CG 3.31Å; L143-Q147 WeakPolarHBondContact O-CG 3.33Å; L143-Q147 PolarHBondContact O-N 2.69Å |
| 144 | Q | 93.7 | Very high | 92.7 | Very high | 94 Ų | 94 | 106.2 Ų | 106.2 | 44% | 0.439 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66 | -41.1 | 175.7 | -74.1 | 175.9 | -22.1 | 0 | 0 | 112.2 | K140 R141 C142 D146 Q147 L148 | K140-Q144 WeakPolarHBondContact O-CG 3.49Å; K140-Q144 PolarHBondContact O-N 3.31Å; R141-Q144 PolarHBondContact O-N 3.49Å; C142-Q144 VanDerWaalsContact C-N 3.32Å; C142-Q144 PolarHBondContact O-N 2.86Å; Q144-D146 VanDerWaalsContact C-N 3.34Å; Q144-Q147 PolarHBondContact O-N 2.91Å; Q144-L148 WeakPolarHBondContact O-CG 3.32Å; Q144-L148 PolarHBondContact O-N 3.09Å |
| 145 | A | 91.4 | Very high | 93 | Very high | 54 Ų | 54 | 103.1 Ų | 103.1 | 45% | 0.446 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.5 | -41.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | R141 C142 L148 R149 | R141-A145 WeakPolarHBondContact O-CB 3.47Å; R141-A145 PolarHBondContact O-N 3.49Å; C142-A145 WeakPolarHBondContact O-CB 3.49Å; C142-A145 PolarHBondContact O-N 3.36Å; C142-A145 VanDerWaalsContact O-N 3.17Å; A145-L148 PolarHBondContact O-N 3.49Å; A145-R149 VanDerWaalsContact O-CB 3.31Å; A145-R149 WeakPolarHBondContact O-CB 3.41Å; A145-R149 PolarHBondContact O-N 2.96Å |
| 146 | D | 93.6 | Very high | 93.2 | Very high | 104 Ų | 104 | 104.2 Ų | 104.2 | 56% | 0.556 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65 | -38.9 | 175.3 | -74.3 | -24.4 | 0 | 0 | 0 | 112.3 | C142 L143 Q144 K150 | C142-D146 PolarHBondContact O-N 2.95Å; L143-D146 PolarHBondContact O-N 3.09Å; Q144-D146 VanDerWaalsContact C-N 3.34Å; D146-K150 WeakPolarHBondContact O-CB 3.45Å; D146-K150 PolarHBondContact O-N 3.35Å |
| 147 | Q | 94.9 | Very high | 93.3 | Very high | 118 Ų | 118 | 103.6 Ų | 103.6 | 55% | 0.551 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -64.5 | -44.8 | 174.7 | -74.6 | 174.5 | -1.3 | 0 | 0 | 112.1 | L143 Q144 K150 A151 | L143-Q147 VanDerWaalsContact O-CG 3.31Å; L143-Q147 WeakPolarHBondContact O-CG 3.33Å; L143-Q147 PolarHBondContact O-N 2.69Å; Q144-Q147 PolarHBondContact O-N 2.91Å; Q147-K150 PolarHBondContact O-N 2.93Å; Q147-A151 PolarHBondContact O-N 3.34Å |
| 148 | L | 94.5 | Very high | 93.5 | Very high | 125 Ų | 125 | 104.9 Ų | 104.9 | 65% | 0.654 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63 | -45.4 | 175.7 | -74.2 | 172.5 | 0 | 0 | 0 | 111.3 | Q144 A145 K150 A151 E152 | Q144-L148 WeakPolarHBondContact O-CG 3.32Å; Q144-L148 PolarHBondContact O-N 3.09Å; A145-L148 PolarHBondContact O-N 3.49Å; L148-K150 VanDerWaalsContact C-N 3.3Å; L148-K150 PolarHBondContact O-N 3.37Å; L148-A151 PolarHBondContact O-N 2.83Å; L148-A151 VanDerWaalsContact O-N 3.15Å; L148-E152 WeakPolarHBondContact O-CB 3.1Å; L148-E152 PolarHBondContact O-N 3.46Å |
| 149 | R | 91.7 | Very high | 93.8 | Very high | 176 Ų | 176 | 103.3 Ų | 103.3 | 66% | 0.664 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -58.6 | -42.3 | 175.6 | -175.1 | 178.6 | -179.6 | 167.8 | 3 | 111.5 | A145 E152 V153 | A145-R149 VanDerWaalsContact O-CB 3.31Å; A145-R149 WeakPolarHBondContact O-CB 3.41Å; A145-R149 PolarHBondContact O-N 2.96Å; R149-E152 PolarHBondContact O-N 3.21Å; R149-V153 WeakPolarHBondContact O-CB 3.44Å; R149-V153 VanDerWaalsContact O-CG2 3.27Å; R149-V153 WeakPolarHBondContact O-CG2 3.48Å; R149-V153 PolarHBondContact O-N 3.49Å |
| 150 | K | 95.1 | Very high | 93.9 | Very high | 146 Ų | 146 | 104.6 Ų | 104.6 | 64% | 0.635 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.6 | -40.4 | 176.7 | -170 | 176.8 | -177.5 | 179.6 | 0 | 112 | D146 Q147 L148 N154 | D146-K150 WeakPolarHBondContact O-CB 3.45Å; D146-K150 PolarHBondContact O-N 3.35Å; Q147-K150 PolarHBondContact O-N 2.93Å; L148-K150 VanDerWaalsContact C-N 3.3Å; L148-K150 PolarHBondContact O-N 3.37Å; K150-N154 VanDerWaalsContact O-CG 3.27Å; K150-N154 PolarHBondContact O-N 2.86Å; K150-N154 PolarHBondContact O-ND2 3.3Å |
| 151 | A | 95.1 | Very high | 94 | Very high | 59 Ų | 59 | 104.2 Ų | 104.2 | 49% | 0.488 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.9 | -42.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q147 L148 N154 L155 | Q147-A151 PolarHBondContact O-N 3.34Å; L148-A151 PolarHBondContact O-N 2.83Å; L148-A151 VanDerWaalsContact O-N 3.15Å; A151-N154 PolarHBondContact O-N 3.02Å; A151-L155 PolarHBondContact O-N 2.94Å |
| 152 | E | 92.8 | Very high | 94.3 | Very high | 95 Ų | 95 | 102.7 Ų | 102.7 | 44% | 0.444 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.1 | -44.7 | 176.7 | -170 | -178.5 | -176.5 | 0 | 0 | 111.7 | L148 R149 N154 L155 Y156 | L148-E152 WeakPolarHBondContact O-CB 3.1Å; L148-E152 PolarHBondContact O-N 3.46Å; R149-E152 PolarHBondContact O-N 3.21Å; E152-N154 VanDerWaalsContact C-N 3.28Å; E152-N154 PolarHBondContact O-N 2.9Å; E152-L155 WeakPolarHBondContact O-CB 3.46Å; E152-L155 PolarHBondContact O-N 3.29Å; E152-Y156 HydrophobicContact CG-CD2 4.03Å; E152-Y156 HydrophobicContact CG-CE2 3.42Å; E152-Y156 VanDerWaalsContact CG-CE2 3.42Å; E152-Y156 WeakPolarHBondContact O-CD2 3.37Å; E152-Y156 PolarHBondContact O-N 3.4Å; E152-Y156 WeakPolarHBondContact OE1-CE2 3.4Å; E152-Y156 PolarHBondContact OE1-OH 3.41Å |
| 153 | V | 95 | Very high | 94.5 | Very high | 64 Ų | 64 | 104.9 Ų | 104.9 | 39% | 0.388 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -59.9 | -38.8 | 173.9 | 168.7 | 0 | 0 | 0 | 0 | 111.7 | R149 K157 | R149-V153 WeakPolarHBondContact O-CB 3.44Å; R149-V153 VanDerWaalsContact O-CG2 3.27Å; R149-V153 WeakPolarHBondContact O-CG2 3.48Å; R149-V153 PolarHBondContact O-N 3.49Å; V153-K157 HydrophobicContact CG1-CD 4.32Å; V153-K157 VanDerWaalsContact O-CG 3.32Å; V153-K157 WeakPolarHBondContact O-CG 3.42Å; V153-K157 PolarHBondContact O-N 2.92Å |
| 154 | N | 95.4 | Very high | 94.6 | Very high | 73 Ų | 73 | 104.5 Ų | 104.5 | 39% | 0.39 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.2 | -40.9 | 176.5 | -72.7 | -18.5 | 0 | 0 | 0 | 111.8 | K150 A151 E152 Y156 K157 D158 | K150-N154 VanDerWaalsContact O-CG 3.27Å; K150-N154 PolarHBondContact O-N 2.86Å; K150-N154 PolarHBondContact O-ND2 3.3Å; A151-N154 PolarHBondContact O-N 3.02Å; E152-N154 VanDerWaalsContact C-N 3.28Å; E152-N154 PolarHBondContact O-N 2.9Å; N154-Y156 PolarHBondContact O-N 3.33Å; N154-K157 WeakPolarHBondContact O-CB 3.28Å; N154-K157 PolarHBondContact O-N 2.93Å; N154-D158 PolarHBondContact O-N 2.94Å |
| 155 | L | 95.2 | Very high | 94.7 | Very high | 97 Ų | 97 | 106.1 Ų | 106.1 | 51% | 0.508 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -58.8 | -47.9 | 174.9 | -177.9 | 69 | 0 | 0 | 0 | 111.3 | A151 E152 K157 D158 Q159 | A151-L155 PolarHBondContact O-N 2.94Å; E152-L155 WeakPolarHBondContact O-CB 3.46Å; E152-L155 PolarHBondContact O-N 3.29Å; L155-K157 VanDerWaalsContact C-N 3.3Å; L155-K157 PolarHBondContact O-N 3.33Å; L155-D158 PolarHBondContact O-N 3.46Å; L155-Q159 WeakPolarHBondContact O-CG 3.44Å; L155-Q159 PolarHBondContact O-N 2.89Å |
| 156 | Y | 93.8 | Very high | 95 | Very high | 129 Ų | 129 | 108.1 Ų | 108.1 | 51% | 0.506 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.6 | -35.7 | 176.6 | -67.6 | -44.3 | 0 | 0 | 0 | 112.4 | E152 N154 L160 | E152-Y156 HydrophobicContact CG-CD2 4.03Å; E152-Y156 HydrophobicContact CG-CE2 3.42Å; E152-Y156 VanDerWaalsContact CG-CE2 3.42Å; E152-Y156 WeakPolarHBondContact O-CD2 3.37Å; E152-Y156 PolarHBondContact O-N 3.4Å; E152-Y156 WeakPolarHBondContact OE1-CE2 3.4Å; E152-Y156 PolarHBondContact OE1-OH 3.41Å; N154-Y156 PolarHBondContact O-N 3.33Å; Y156-L160 VanDerWaalsContact O-CB 3.23Å; Y156-L160 WeakPolarHBondContact O-CB 3.49Å; Y156-L160 PolarHBondContact O-N 3.41Å |
| 157 | K | 95.2 | Very high | 95 | Very high | 117 Ų | 117 | 107.8 Ų | 107.8 | 51% | 0.509 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.5 | -41.8 | 174 | -79 | 175.9 | 179.5 | 179.5 | 0 | 112.3 | V153 N154 L155 L160 K161 | V153-K157 HydrophobicContact CG1-CD 4.32Å; V153-K157 VanDerWaalsContact O-CG 3.32Å; V153-K157 WeakPolarHBondContact O-CG 3.42Å; V153-K157 PolarHBondContact O-N 2.92Å; N154-K157 WeakPolarHBondContact O-CB 3.28Å; N154-K157 PolarHBondContact O-N 2.93Å; L155-K157 VanDerWaalsContact C-N 3.3Å; L155-K157 PolarHBondContact O-N 3.33Å; K157-L160 PolarHBondContact O-N 2.82Å; K157-K161 WeakPolarHBondContact O-CG 3.33Å; K157-K161 PolarHBondContact O-N 3.33Å |
| 158 | D | 95.5 | Very high | 95 | Very high | 95 Ų | 95 | 104.9 Ų | 104.9 | 51% | 0.508 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -71.4 | -39.7 | -179.9 | -69.7 | -20.5 | 0 | 0 | 0 | 111.4 | N154 L155 L160 K161 Q162 | N154-D158 PolarHBondContact O-N 2.94Å; L155-D158 PolarHBondContact O-N 3.46Å; D158-L160 VanDerWaalsContact C-N 3.35Å; D158-L160 PolarHBondContact O-N 3.29Å; D158-K161 PolarHBondContact O-N 2.98Å; D158-K161 IonicContact OD1-NZ 2.77Å; D158-Q162 WeakPolarHBondContact O-CB 3.49Å; D158-Q162 PolarHBondContact O-N 3.28Å |
| 159 | Q | 94.9 | Very high | 95.1 | Very high | 92 Ų | 92 | 104.7 Ų | 104.7 | 43% | 0.43 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.3 | -44.1 | 171 | -73.1 | 177.5 | -17.8 | 0 | 0 | 111.6 | L155 K161 Q162 V163 | L155-Q159 WeakPolarHBondContact O-CG 3.44Å; L155-Q159 PolarHBondContact O-N 2.89Å; Q159-K161 VanDerWaalsContact C-N 3.34Å; Q159-K161 PolarHBondContact O-N 2.98Å; Q159-Q162 PolarHBondContact O-N 2.96Å; Q159-V163 WeakPolarHBondContact O-CG2 3.36Å; Q159-V163 PolarHBondContact O-N 2.93Å |
| 160 | L | 95.9 | Very high | 95.3 | Very high | 128 Ų | 128 | 98.7 Ų | 98.7 | 67% | 0.67 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.5 | -37.6 | 179.1 | -168.8 | 131.4 | 0 | 0 | 0 | 112 | Y156 K157 D158 N164 | Y156-L160 VanDerWaalsContact O-CB 3.23Å; Y156-L160 WeakPolarHBondContact O-CB 3.49Å; Y156-L160 PolarHBondContact O-N 3.41Å; K157-L160 PolarHBondContact O-N 2.82Å; D158-L160 VanDerWaalsContact C-N 3.35Å; D158-L160 PolarHBondContact O-N 3.29Å; L160-N164 WeakPolarHBondContact O-CB 3.32Å; L160-N164 PolarHBondContact O-N 3.43Å |
| 161 | K | 95.9 | Very high | 95.4 | Very high | 123 Ų | 123 | 96.1 Ų | 96.1 | 54% | 0.535 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62 | -47.8 | 171 | -75.6 | 174.8 | -175.8 | 171.3 | 0 | 111.8 | K157 D158 Q159 V163 N164 E165 | K157-K161 WeakPolarHBondContact O-CG 3.33Å; K157-K161 PolarHBondContact O-N 3.33Å; D158-K161 PolarHBondContact O-N 2.98Å; D158-K161 IonicContact OD1-NZ 2.77Å; Q159-K161 VanDerWaalsContact C-N 3.34Å; Q159-K161 PolarHBondContact O-N 2.98Å; K161-V163 VanDerWaalsContact C-N 3.35Å; K161-V163 PolarHBondContact O-N 3.49Å; K161-N164 PolarHBondContact O-N 2.94Å; K161-N164 VanDerWaalsContact O-N 3.16Å; K161-E165 WeakPolarHBondContact O-CG 3.07Å; K161-E165 PolarHBondContact O-N 3.23Å |
| 162 | Q | 95.7 | Very high | 95.4 | Very high | 117 Ų | 117 | 100 Ų | 100 | 55% | 0.547 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.5 | -42.9 | 179.9 | -171.5 | -178.2 | 12.4 | 0 | 0 | 111.8 | D158 Q159 N164 E165 N166 | D158-Q162 WeakPolarHBondContact O-CB 3.49Å; D158-Q162 PolarHBondContact O-N 3.28Å; Q159-Q162 PolarHBondContact O-N 2.96Å; Q162-N164 VanDerWaalsContact C-N 3.34Å; Q162-E165 PolarHBondContact O-N 3.38Å; Q162-N166 WeakPolarHBondContact O-CB 3.06Å; Q162-N166 VanDerWaalsContact O-CG 3.27Å; Q162-N166 PolarHBondContact O-N 3.39Å; Q162-N166 PolarHBondContact O-ND2 3.26Å |
| 163 | V | 95.5 | Very high | 95.6 | Very high | 95 Ų | 95 | 99.3 Ų | 99.3 | 58% | 0.576 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.4 | -43.9 | 174.8 | 170.7 | 0 | 0 | 0 | 0 | 110.6 | Q159 K161 N166 L167 | Q159-V163 WeakPolarHBondContact O-CG2 3.36Å; Q159-V163 PolarHBondContact O-N 2.93Å; K161-V163 VanDerWaalsContact C-N 3.35Å; K161-V163 PolarHBondContact O-N 3.49Å; V163-N166 PolarHBondContact O-N 3.47Å; V163-L167 VanDerWaalsContact O-CB 3.32Å; V163-L167 WeakPolarHBondContact O-CB 3.43Å; V163-L167 PolarHBondContact O-N 3.42Å |
| 164 | N | 95.8 | Very high | 95.7 | Very high | 94 Ų | 94 | 100.6 Ų | 100.6 | 50% | 0.503 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.5 | -39.7 | 179.2 | -168.9 | 54 | 0 | 0 | 0 | 112.8 | L160 K161 Q162 L167 T168 | L160-N164 WeakPolarHBondContact O-CB 3.32Å; L160-N164 PolarHBondContact O-N 3.43Å; K161-N164 PolarHBondContact O-N 2.94Å; K161-N164 VanDerWaalsContact O-N 3.16Å; Q162-N164 VanDerWaalsContact C-N 3.34Å; N164-L167 PolarHBondContact O-N 2.9Å; N164-T168 WeakPolarHBondContact O-CB 3.45Å; N164-T168 PolarHBondContact O-N 3.04Å; N164-T168 PolarHBondContact O-OG1 3.31Å |
| 165 | E | 95.8 | Very high | 95.7 | Very high | 128 Ų | 128 | 103 Ų | 103 | 60% | 0.598 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64 | -44.3 | 174.7 | -73.8 | 173.1 | -174.7 | 0 | 0 | 111.6 | K161 Q162 T168 K169 | K161-E165 WeakPolarHBondContact O-CG 3.07Å; K161-E165 PolarHBondContact O-N 3.23Å; Q162-E165 PolarHBondContact O-N 3.38Å; E165-T168 PolarHBondContact O-N 3.45Å; E165-K169 PolarHBondContact O-N 2.93Å |
| 166 | N | 96.6 | Very high | 95.8 | Very high | 95 Ų | 95 | 102.2 Ų | 102.2 | 51% | 0.508 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.7 | -42.3 | 176.1 | -73.3 | -21 | 0 | 0 | 0 | 111.8 | Q162 V163 K169 A170 | Q162-N166 WeakPolarHBondContact O-CB 3.06Å; Q162-N166 VanDerWaalsContact O-CG 3.27Å; Q162-N166 PolarHBondContact O-N 3.39Å; Q162-N166 PolarHBondContact O-ND2 3.26Å; V163-N166 PolarHBondContact O-N 3.47Å; N166-K169 PolarHBondContact O-N 2.84Å; N166-A170 WeakPolarHBondContact O-CB 3.18Å; N166-A170 PolarHBondContact O-N 3.3Å |
| 167 | L | 95.1 | Very high | 95.9 | Very high | 97 Ų | 97 | 101.1 Ų | 101.1 | 51% | 0.508 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.6 | -43.4 | 176.7 | -172 | 123.4 | 0 | 0 | 0 | 111.1 | V163 N164 K169 A170 L171 | V163-L167 VanDerWaalsContact O-CB 3.32Å; V163-L167 WeakPolarHBondContact O-CB 3.43Å; V163-L167 PolarHBondContact O-N 3.42Å; N164-L167 PolarHBondContact O-N 2.9Å; L167-K169 VanDerWaalsContact C-N 3.28Å; L167-K169 PolarHBondContact O-N 3.48Å; L167-A170 PolarHBondContact O-N 3.46Å; L167-L171 HydrophobicContact CD2-CD1 3.77Å; L167-L171 HydrophobicContact CG-CD1 4.41Å; L167-L171 WeakPolarHBondContact O-CB 3.5Å; L167-L171 WeakPolarHBondContact O-CG 3.29Å; L167-L171 PolarHBondContact O-N 2.98Å |
| 168 | T | 95.2 | Very high | 95.9 | Very high | 57 Ų | 57 | 100 Ų | 100 | 35% | 0.35 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.6 | -32.9 | 176.3 | -54.1 | 0 | 0 | 0 | 0 | 112.2 | N164 E165 R172 | N164-T168 WeakPolarHBondContact O-CB 3.45Å; N164-T168 PolarHBondContact O-N 3.04Å; N164-T168 PolarHBondContact O-OG1 3.31Å; E165-T168 PolarHBondContact O-N 3.45Å; T168-R172 PolarHBondContact O-N 3.44Å; T168-R172 PolarHBondContact O-NE 3.02Å |
| 169 | K | 96.8 | Very high | 96 | Very high | 122 Ų | 122 | 101 Ų | 101 | 53% | 0.53 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -70.9 | -46.8 | 173.3 | -174.2 | -178.8 | 174.7 | -174.3 | 0 | 111.2 | E165 N166 L167 L171 R172 D173 | E165-K169 PolarHBondContact O-N 2.93Å; N166-K169 PolarHBondContact O-N 2.84Å; L167-K169 VanDerWaalsContact C-N 3.28Å; L167-K169 PolarHBondContact O-N 3.48Å; K169-L171 VanDerWaalsContact C-N 3.31Å; K169-L171 PolarHBondContact O-N 3.45Å; K169-R172 PolarHBondContact O-N 2.91Å; K169-D173 PolarHBondContact O-N 2.97Å |
| 170 | A | 95.5 | Very high | 96.1 | Very high | 50 Ų | 50 | 103.1 Ų | 103.1 | 41% | 0.413 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.3 | -39.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | N166 L167 D173 I174 | N166-A170 WeakPolarHBondContact O-CB 3.18Å; N166-A170 PolarHBondContact O-N 3.3Å; L167-A170 PolarHBondContact O-N 3.46Å; A170-D173 PolarHBondContact O-N 3.31Å; A170-I174 VanDerWaalsContact O-CG1 3.3Å; A170-I174 WeakPolarHBondContact O-CG1 3.47Å; A170-I174 PolarHBondContact O-N 3.49Å |
| 171 | L | 96.2 | Very high | 96.1 | Very high | 91 Ų | 91 | 100.9 Ų | 100.9 | 48% | 0.476 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.3 | -43.9 | 174.6 | -73.9 | 172 | 0 | 0 | 0 | 111.9 | L167 K169 I174 E175 | L167-L171 HydrophobicContact CD2-CD1 3.77Å; L167-L171 HydrophobicContact CG-CD1 4.41Å; L167-L171 WeakPolarHBondContact O-CB 3.5Å; L167-L171 WeakPolarHBondContact O-CG 3.29Å; L167-L171 PolarHBondContact O-N 2.98Å; K169-L171 VanDerWaalsContact C-N 3.31Å; K169-L171 PolarHBondContact O-N 3.45Å; L171-I174 PolarHBondContact O-N 3Å; L171-E175 WeakPolarHBondContact O-CG 3.35Å; L171-E175 PolarHBondContact O-N 3.25Å |
| 172 | R | 96.1 | Very high | 96.1 | Very high | 140 Ų | 140 | 99.4 Ų | 99.4 | 53% | 0.528 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.7 | -43.2 | 174.9 | -79.2 | -179.1 | -77.5 | 163.9 | -7.3 | 112.6 | T168 K169 I174 E175 D176 | T168-R172 PolarHBondContact O-N 3.44Å; T168-R172 PolarHBondContact O-NE 3.02Å; K169-R172 PolarHBondContact O-N 2.91Å; R172-I174 PolarHBondContact O-N 3.44Å; R172-E175 PolarHBondContact O-N 2.99Å; R172-D176 PolarHBondContact O-N 2.83Å |
| 173 | D | 96.8 | Very high | 96.2 | Very high | 81 Ų | 81 | 98.6 Ų | 98.6 | 43% | 0.433 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.3 | -34.1 | 177.3 | -67.7 | -20.5 | 0 | 0 | 0 | 111.3 | K169 A170 L177 | K169-D173 PolarHBondContact O-N 2.97Å; A170-D173 PolarHBondContact O-N 3.31Å; D173-L177 WeakPolarHBondContact O-CB 3.4Å; D173-L177 VanDerWaalsContact O-CG 3.24Å; D173-L177 WeakPolarHBondContact O-CG 3.33Å; D173-L177 PolarHBondContact O-N 2.88Å; D173-L177 VanDerWaalsContact O-N 3.09Å |
| 174 | I | 96.3 | Very high | 96.2 | Very high | 92 Ų | 92 | 100.7 Ų | 100.7 | 47% | 0.472 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -69.5 | -42.8 | 174 | -71.3 | 167.6 | 0 | 0 | 0 | 111.4 | A170 L171 R172 L177 N178 | A170-I174 VanDerWaalsContact O-CG1 3.3Å; A170-I174 WeakPolarHBondContact O-CG1 3.47Å; A170-I174 PolarHBondContact O-N 3.49Å; L171-I174 PolarHBondContact O-N 3Å; R172-I174 PolarHBondContact O-N 3.44Å; I174-L177 PolarHBondContact O-N 2.88Å; I174-N178 PolarHBondContact O-N 2.87Å; I174-N178 PolarHBondContact O-ND2 2.85Å |
| 175 | E | 96.2 | Very high | 96.3 | Very high | 124 Ų | 124 | 100.5 Ų | 100.5 | 58% | 0.579 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -59.4 | -47.9 | 175.7 | -73.1 | 170.8 | 171.5 | 0 | 0 | 111.2 | L171 R172 L177 N178 E179 | L171-E175 WeakPolarHBondContact O-CG 3.35Å; L171-E175 PolarHBondContact O-N 3.25Å; R172-E175 PolarHBondContact O-N 2.99Å; E175-L177 VanDerWaalsContact C-N 3.31Å; E175-L177 PolarHBondContact O-N 2.97Å; E175-N178 PolarHBondContact O-N 3.01Å; E175-E179 PolarHBondContact O-N 3.48Å |
| 176 | D | 96.2 | Very high | 96.3 | Very high | 80 Ų | 80 | 99 Ų | 99 | 43% | 0.428 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -60.3 | -38.8 | 176.2 | -78.9 | 2 | 0 | 0 | 0 | 112.4 | R172 R180 | R172-D176 PolarHBondContact O-N 2.83Å; D176-R180 WeakPolarHBondContact O-CG 3.05Å; D176-R180 PolarHBondContact O-N 3.4Å; D176-R180 VanDerWaalsContact O-N 3.08Å |
| 177 | L | 96.3 | Very high | 96.4 | Very high | 106 Ų | 106 | 99.7 Ų | 99.7 | 56% | 0.555 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -69.8 | -38.9 | 177.4 | -77.6 | 173.4 | 0 | 0 | 0 | 112.3 | D173 I174 E175 R180 N181 | D173-L177 WeakPolarHBondContact O-CB 3.4Å; D173-L177 VanDerWaalsContact O-CG 3.24Å; D173-L177 WeakPolarHBondContact O-CG 3.33Å; D173-L177 PolarHBondContact O-N 2.88Å; D173-L177 VanDerWaalsContact O-N 3.09Å; I174-L177 PolarHBondContact O-N 2.88Å; E175-L177 VanDerWaalsContact C-N 3.31Å; E175-L177 PolarHBondContact O-N 2.97Å; L177-R180 PolarHBondContact O-N 3.35Å; L177-N181 WeakPolarHBondContact O-CB 3.38Å; L177-N181 PolarHBondContact O-N 2.98Å |
| 178 | N | 96.6 | Very high | 96.4 | Very high | 93 Ų | 93 | 100.6 Ų | 100.6 | 50% | 0.497 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.5 | -44.9 | 175.1 | -74.9 | -24.7 | 0 | 0 | 0 | 110.9 | I174 E175 R180 N181 D182 | I174-N178 PolarHBondContact O-N 2.87Å; I174-N178 PolarHBondContact O-ND2 2.85Å; E175-N178 PolarHBondContact O-N 3.01Å; N178-R180 VanDerWaalsContact C-N 3.33Å; N178-R180 PolarHBondContact O-N 3.33Å; N178-N181 WeakPolarHBondContact O-CB 3.44Å; N178-N181 PolarHBondContact O-N 2.9Å; N178-N181 VanDerWaalsContact O-N 3.08Å; N178-D182 PolarHBondContact O-N 3.48Å |
| 179 | E | 96.5 | Very high | 96.5 | Very high | 117 Ų | 117 | 103.2 Ų | 103.2 | 55% | 0.547 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61 | -41.9 | 177.2 | -170.3 | -179 | 177.7 | 0 | 0 | 111.7 | E175 N181 D182 Q183 | E175-E179 PolarHBondContact O-N 3.48Å; E179-N181 VanDerWaalsContact C-N 3.34Å; E179-N181 PolarHBondContact O-N 3.37Å; E179-D182 PolarHBondContact O-N 3.13Å; E179-Q183 WeakPolarHBondContact O-CG 3.47Å; E179-Q183 PolarHBondContact O-N 2.86Å |
| 180 | R | 96.7 | Very high | 96.5 | Very high | 136 Ų | 136 | 99.9 Ų | 99.9 | 51% | 0.513 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.7 | -38.1 | 173.8 | -72.8 | 179.3 | -165.9 | 169.7 | 9.6 | 112.4 | D176 L177 N178 Q183 Y184 | D176-R180 WeakPolarHBondContact O-CG 3.05Å; D176-R180 PolarHBondContact O-N 3.4Å; D176-R180 VanDerWaalsContact O-N 3.08Å; L177-R180 PolarHBondContact O-N 3.35Å; N178-R180 VanDerWaalsContact C-N 3.33Å; N178-R180 PolarHBondContact O-N 3.33Å; R180-Q183 PolarHBondContact O-N 3.29Å; R180-Y184 HydrophobicContact CB-CE2 4.37Å; R180-Y184 WeakPolarHBondContact O-CD2 3.24Å; R180-Y184 PolarHBondContact O-N 3.38Å |
| 181 | N | 96.3 | Very high | 96.5 | Very high | 80 Ų | 80 | 101.8 Ų | 101.8 | 43% | 0.428 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.2 | -44.1 | 177.1 | -172.2 | 67.2 | 0 | 0 | 0 | 111.1 | L177 N178 E179 Q183 Y184 E185 | L177-N181 WeakPolarHBondContact O-CB 3.38Å; L177-N181 PolarHBondContact O-N 2.98Å; N178-N181 WeakPolarHBondContact O-CB 3.44Å; N178-N181 PolarHBondContact O-N 2.9Å; N178-N181 VanDerWaalsContact O-N 3.08Å; E179-N181 VanDerWaalsContact C-N 3.34Å; E179-N181 PolarHBondContact O-N 3.37Å; N181-Q183 VanDerWaalsContact C-N 3.34Å; N181-Q183 PolarHBondContact O-N 3.01Å; N181-Y184 PolarHBondContact O-N 3Å; N181-Y184 VanDerWaalsContact O-N 3.16Å; N181-E185 PolarHBondContact ND2-OE1 3.27Å; N181-E185 PolarHBondContact O-N 3.48Å |
| 182 | D | 96.4 | Very high | 96.5 | Very high | 92 Ų | 92 | 100 Ų | 100 | 49% | 0.492 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.7 | -43.3 | 176.1 | -67.4 | -14.4 | 0 | 0 | 0 | 111.3 | N178 E179 Y184 E185 D186 | N178-D182 PolarHBondContact O-N 3.48Å; E179-D182 PolarHBondContact O-N 3.13Å; D182-Y184 VanDerWaalsContact C-N 3.33Å; D182-Y184 PolarHBondContact O-N 2.95Å; D182-E185 PolarHBondContact O-N 3.49Å; D182-D186 PolarHBondContact O-N 3.4Å |
| 183 | Q | 96.8 | Very high | 96.5 | Very high | 100 Ų | 100 | 97.5 Ų | 97.5 | 47% | 0.467 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.5 | -41.8 | 174.3 | -71.3 | 174.2 | 13.9 | 0 | 0 | 112.5 | E179 R180 N181 D186 Q187 | E179-Q183 WeakPolarHBondContact O-CG 3.47Å; E179-Q183 PolarHBondContact O-N 2.86Å; R180-Q183 PolarHBondContact O-N 3.29Å; N181-Q183 VanDerWaalsContact C-N 3.34Å; N181-Q183 PolarHBondContact O-N 3.01Å; Q183-D186 PolarHBondContact O-N 3.33Å; Q183-Q187 VanDerWaalsContact O-CG 3.28Å; Q183-Q187 WeakPolarHBondContact O-CG 3.24Å; Q183-Q187 PolarHBondContact O-N 2.93Å |
| 184 | Y | 96.6 | Very high | 96.5 | Very high | 139 Ų | 139 | 98.3 Ų | 98.3 | 55% | 0.545 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -69.2 | -37.7 | 177.2 | -71.1 | -50.3 | 0 | 0 | 0 | 112.5 | R180 N181 D182 D186 Q187 L188 | R180-Y184 HydrophobicContact CB-CE2 4.37Å; R180-Y184 WeakPolarHBondContact O-CD2 3.24Å; R180-Y184 PolarHBondContact O-N 3.38Å; N181-Y184 PolarHBondContact O-N 3Å; N181-Y184 VanDerWaalsContact O-N 3.16Å; D182-Y184 VanDerWaalsContact C-N 3.33Å; D182-Y184 PolarHBondContact O-N 2.95Å; Y184-D186 VanDerWaalsContact C-N 3.33Å; Y184-Q187 PolarHBondContact O-N 2.86Å; Y184-L188 WeakPolarHBondContact O-CB 3.48Å; Y184-L188 WeakPolarHBondContact O-CG 3.44Å; Y184-L188 PolarHBondContact O-N 3.45Å |
| 185 | E | 97.1 | Very high | 96.5 | Very high | 90 Ų | 90 | 100.3 Ų | 100.3 | 42% | 0.421 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.9 | -42 | 174 | -76.4 | -168.2 | -172.4 | 0 | 0 | 111.8 | N181 D182 L188 K189 | N181-E185 PolarHBondContact ND2-OE1 3.27Å; N181-E185 PolarHBondContact O-N 3.48Å; D182-E185 PolarHBondContact O-N 3.49Å; E185-L188 PolarHBondContact O-N 2.9Å; E185-K189 VanDerWaalsContact O-CG 3.31Å; E185-K189 WeakPolarHBondContact O-CG 3.31Å; E185-K189 PolarHBondContact O-N 3.14Å |
| 186 | D | 97 | Very high | 96.5 | Very high | 97 Ų | 97 | 100.1 Ų | 100.1 | 52% | 0.519 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -68.5 | -39 | 177.7 | -75.7 | -11.9 | 0 | 0 | 0 | 112.1 | D182 Q183 Y184 K189 A190 | D182-D186 PolarHBondContact O-N 3.4Å; Q183-D186 PolarHBondContact O-N 3.33Å; Y184-D186 VanDerWaalsContact C-N 3.33Å; D186-K189 PolarHBondContact O-N 2.98Å; D186-K189 IonicContact OD1-NZ 3.07Å; D186-K189 PolarHBondContact OD1-NZ 3.3Å; D186-A190 WeakPolarHBondContact O-CB 3.33Å; D186-A190 PolarHBondContact O-N 2.98Å |
| 187 | Q | 96.9 | Very high | 96.5 | Very high | 109 Ų | 109 | 101.4 Ų | 101.4 | 51% | 0.509 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.1 | -42.2 | 171.7 | -73.8 | 175.6 | 9.3 | 0 | 0 | 112.1 | Q183 Y184 A190 L191 | Q183-Q187 VanDerWaalsContact O-CG 3.28Å; Q183-Q187 WeakPolarHBondContact O-CG 3.24Å; Q183-Q187 PolarHBondContact O-N 2.93Å; Y184-Q187 PolarHBondContact O-N 2.86Å; Q187-A190 PolarHBondContact O-N 3.42Å; Q187-L191 WeakPolarHBondContact O-CB 3.28Å; Q187-L191 WeakPolarHBondContact O-CG 3.48Å; Q187-L191 PolarHBondContact O-N 3.49Å |
| 188 | L | 96.7 | Very high | 96.5 | Very high | 117 Ų | 117 | 104.3 Ų | 104.3 | 61% | 0.613 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.3 | -41.8 | 176.2 | -81.1 | 166.6 | 0 | 0 | 0 | 111.8 | Y184 E185 L191 S192 | Y184-L188 WeakPolarHBondContact O-CB 3.48Å; Y184-L188 WeakPolarHBondContact O-CG 3.44Å; Y184-L188 PolarHBondContact O-N 3.45Å; E185-L188 PolarHBondContact O-N 2.9Å; L188-L191 PolarHBondContact O-N 2.89Å; L188-S192 WeakPolarHBondContact O-CB 3.44Å; L188-S192 PolarHBondContact O-N 3.37Å |
| 189 | K | 96.5 | Very high | 96.5 | Very high | 112 Ų | 112 | 105.4 Ų | 105.4 | 49% | 0.487 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.9 | -45.2 | 174 | -73.2 | 168.9 | -164.4 | 153.3 | 0 | 111.3 | E185 D186 S192 N193 | E185-K189 VanDerWaalsContact O-CG 3.31Å; E185-K189 WeakPolarHBondContact O-CG 3.31Å; E185-K189 PolarHBondContact O-N 3.14Å; D186-K189 PolarHBondContact O-N 2.98Å; D186-K189 IonicContact OD1-NZ 3.07Å; D186-K189 PolarHBondContact OD1-NZ 3.3Å; K189-S192 PolarHBondContact O-N 2.93Å; K189-N193 PolarHBondContact O-N 3.26Å |
| 190 | A | 96.3 | Very high | 96.5 | Very high | 51 Ų | 51 | 102.4 Ų | 102.4 | 42% | 0.421 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61 | -46.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | D186 Q187 S192 N193 I194 | D186-A190 WeakPolarHBondContact O-CB 3.33Å; D186-A190 PolarHBondContact O-N 2.98Å; Q187-A190 PolarHBondContact O-N 3.42Å; A190-S192 PolarHBondContact O-N 3.39Å; A190-N193 PolarHBondContact O-N 3Å; A190-I194 WeakPolarHBondContact O-CG1 3.34Å; A190-I194 PolarHBondContact O-N 3.43Å |
| 191 | L | 96.6 | Very high | 96.5 | Very high | 90 Ų | 90 | 101.2 Ų | 101.2 | 47% | 0.471 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.5 | -41.8 | 175.6 | -75.4 | 171.9 | 0 | 0 | 0 | 112 | Q187 L188 N193 I194 F195 | Q187-L191 WeakPolarHBondContact O-CB 3.28Å; Q187-L191 WeakPolarHBondContact O-CG 3.48Å; Q187-L191 PolarHBondContact O-N 3.49Å; L188-L191 PolarHBondContact O-N 2.89Å; L191-N193 VanDerWaalsContact C-N 3.31Å; L191-N193 PolarHBondContact O-N 3.2Å; L191-I194 PolarHBondContact O-N 2.98Å; L191-F195 WeakPolarHBondContact O-CD2 3.31Å; L191-F195 PolarHBondContact O-N 3.42Å |
| 192 | S | 96.3 | Very high | 96.5 | Very high | 53 Ų | 53 | 102.2 Ų | 102.2 | 37% | 0.371 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.9 | -42.1 | 176.5 | -174.6 | 0 | 0 | 0 | 0 | 111.8 | L188 K189 A190 F195 K196 | L188-S192 WeakPolarHBondContact O-CB 3.44Å; L188-S192 PolarHBondContact O-N 3.37Å; K189-S192 PolarHBondContact O-N 2.93Å; A190-S192 PolarHBondContact O-N 3.39Å; S192-F195 PolarHBondContact O-N 3.36Å; S192-K196 WeakPolarHBondContact O-CG 3.33Å; S192-K196 PolarHBondContact O-N 2.99Å |
| 193 | N | 96.3 | Very high | 96.5 | Very high | 88 Ų | 88 | 103.6 Ų | 103.6 | 47% | 0.471 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.8 | -43.3 | 176.2 | -69.5 | -17.8 | 0 | 0 | 0 | 111.8 | K189 A190 L191 F195 K196 D197 | K189-N193 PolarHBondContact O-N 3.26Å; A190-N193 PolarHBondContact O-N 3Å; L191-N193 VanDerWaalsContact C-N 3.31Å; L191-N193 PolarHBondContact O-N 3.2Å; N193-F195 VanDerWaalsContact C-N 3.3Å; N193-F195 PolarHBondContact O-N 2.9Å; N193-K196 PolarHBondContact O-N 3.33Å; N193-D197 PolarHBondContact O-N 3.47Å |
| 194 | I | 96.9 | Very high | 96.5 | Very high | 98 Ų | 98 | 102.1 Ų | 102.1 | 50% | 0.503 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -58.8 | -42.9 | 175.4 | -68.6 | 165.4 | 0 | 0 | 0 | 111.2 | A190 L191 D197 R198 | A190-I194 WeakPolarHBondContact O-CG1 3.34Å; A190-I194 PolarHBondContact O-N 3.43Å; L191-I194 PolarHBondContact O-N 2.98Å; I194-D197 PolarHBondContact O-N 2.92Å; I194-R198 VanDerWaalsContact O-CB 3.31Å; I194-R198 WeakPolarHBondContact O-CB 3.42Å; I194-R198 PolarHBondContact O-N 2.83Å |
| 195 | F | 95.5 | Very high | 96.5 | Very high | 135 Ų | 135 | 98.7 Ų | 98.7 | 59% | 0.592 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -66.1 | -41.3 | 177.5 | -77.4 | -58.5 | 0 | 0 | 0 | 112.2 | L191 S192 N193 R198 E199 | L191-F195 WeakPolarHBondContact O-CD2 3.31Å; L191-F195 PolarHBondContact O-N 3.42Å; S192-F195 PolarHBondContact O-N 3.36Å; N193-F195 VanDerWaalsContact C-N 3.3Å; N193-F195 PolarHBondContact O-N 2.9Å; F195-R198 PolarHBondContact O-N 2.91Å; F195-E199 VanDerWaalsContact O-CB 3.31Å; F195-E199 WeakPolarHBondContact O-CB 3.31Å; F195-E199 PolarHBondContact O-N 3.49Å |
| 196 | K | 96.5 | Very high | 96.4 | Very high | 120 Ų | 120 | 97.9 Ų | 97.9 | 52% | 0.522 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.2 | -45.3 | 174.5 | -74 | 173.2 | -178 | 174.6 | 0 | 112.3 | S192 N193 R198 E199 A200 | S192-K196 WeakPolarHBondContact O-CG 3.33Å; S192-K196 PolarHBondContact O-N 2.99Å; N193-K196 PolarHBondContact O-N 3.33Å; K196-R198 VanDerWaalsContact C-N 3.3Å; K196-R198 PolarHBondContact O-N 2.96Å; K196-E199 PolarHBondContact O-N 3.3Å; K196-A200 WeakPolarHBondContact O-CB 3.39Å; K196-A200 PolarHBondContact O-N 2.87Å |
| 197 | D | 96.3 | Very high | 96.3 | Very high | 107 Ų | 107 | 96.9 Ų | 96.9 | 57% | 0.572 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.3 | -39.9 | 178.3 | -69.2 | -16.7 | 0 | 0 | 0 | 111.1 | N193 I194 A200 L201 | N193-D197 PolarHBondContact O-N 3.47Å; I194-D197 PolarHBondContact O-N 2.92Å; D197-A200 PolarHBondContact O-N 3.36Å; D197-L201 WeakPolarHBondContact O-CG 3.48Å; D197-L201 PolarHBondContact O-N 2.98Å |
| 198 | R | 96.3 | Very high | 96.3 | Very high | 166 Ų | 166 | 97 Ų | 97 | 63% | 0.626 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -70.4 | -37.5 | 177.9 | -167.6 | 168.1 | -176.5 | 147.2 | 0.1 | 112.5 | I194 F195 K196 L201 L202 | I194-R198 VanDerWaalsContact O-CB 3.31Å; I194-R198 WeakPolarHBondContact O-CB 3.42Å; I194-R198 PolarHBondContact O-N 2.83Å; F195-R198 PolarHBondContact O-N 2.91Å; K196-R198 VanDerWaalsContact C-N 3.3Å; K196-R198 PolarHBondContact O-N 2.96Å; R198-L201 PolarHBondContact O-N 3.26Å; R198-L202 HydrophobicContact CG-CD1 4.41Å; R198-L202 WeakPolarHBondContact O-CB 3.13Å; R198-L202 VanDerWaalsContact O-CG 3.28Å; R198-L202 WeakPolarHBondContact O-CG 3.28Å; R198-L202 PolarHBondContact O-N 3.34Å |
| 199 | E | 96.9 | Very high | 96.2 | Very high | 116 Ų | 116 | 98.2 Ų | 98.2 | 54% | 0.542 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.8 | -47.4 | 172.8 | -175.1 | 171.5 | -155.9 | 0 | 0 | 110.5 | F195 K196 L201 L202 E203 | F195-E199 VanDerWaalsContact O-CB 3.31Å; F195-E199 WeakPolarHBondContact O-CB 3.31Å; F195-E199 PolarHBondContact O-N 3.49Å; K196-E199 PolarHBondContact O-N 3.3Å; E199-L201 VanDerWaalsContact C-N 3.34Å; E199-L201 PolarHBondContact O-N 3.39Å; E199-L202 PolarHBondContact O-N 2.91Å; E199-L202 VanDerWaalsContact O-N 3.14Å; E199-E203 WeakPolarHBondContact O-CG 3.37Å; E199-E203 PolarHBondContact O-N 2.88Å |
| 200 | A | 95.9 | Very high | 96.2 | Very high | 54 Ų | 54 | 98.5 Ų | 98.5 | 45% | 0.446 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.6 | -40.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | K196 D197 E203 S204 | K196-A200 WeakPolarHBondContact O-CB 3.39Å; K196-A200 PolarHBondContact O-N 2.87Å; D197-A200 PolarHBondContact O-N 3.36Å; A200-E203 PolarHBondContact O-N 3.4Å; A200-S204 WeakPolarHBondContact O-CB 3.4Å; A200-S204 PolarHBondContact O-N 3.49Å |
| 201 | L | 96.8 | Very high | 96.2 | Very high | 112 Ų | 112 | 100.7 Ų | 100.7 | 59% | 0.586 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.1 | -44.5 | 173.8 | -77.2 | 168.1 | 0 | 0 | 0 | 111.9 | D197 R198 E199 S204 D205 | D197-L201 WeakPolarHBondContact O-CG 3.48Å; D197-L201 PolarHBondContact O-N 2.98Å; R198-L201 PolarHBondContact O-N 3.26Å; E199-L201 VanDerWaalsContact C-N 3.34Å; E199-L201 PolarHBondContact O-N 3.39Å; L201-S204 WeakPolarHBondContact O-CB 3.42Å; L201-S204 PolarHBondContact O-N 2.99Å; L201-D205 PolarHBondContact O-N 3.46Å |
| 202 | L | 96.6 | Very high | 96.1 | Very high | 100 Ų | 100 | 101 Ų | 101 | 52% | 0.524 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65 | -39.9 | 178 | -73.2 | 170 | 0 | 0 | 0 | 111.8 | R198 E199 S204 D205 V206 | R198-L202 HydrophobicContact CG-CD1 4.41Å; R198-L202 WeakPolarHBondContact O-CB 3.13Å; R198-L202 VanDerWaalsContact O-CG 3.28Å; R198-L202 WeakPolarHBondContact O-CG 3.28Å; R198-L202 PolarHBondContact O-N 3.34Å; E199-L202 PolarHBondContact O-N 2.91Å; E199-L202 VanDerWaalsContact O-N 3.14Å; L202-S204 VanDerWaalsContact C-N 3.34Å; L202-D205 PolarHBondContact O-N 3.38Å; L202-V206 WeakPolarHBondContact O-CB 3.41Å; L202-V206 VanDerWaalsContact O-CG2 3.24Å; L202-V206 WeakPolarHBondContact O-CG2 3.34Å; L202-V206 PolarHBondContact O-N 3.37Å |
| 203 | E | 96.4 | Very high | 96 | Very high | 122 Ų | 122 | 101.1 Ų | 101.1 | 57% | 0.57 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.8 | -42.1 | 173.3 | -73.6 | -176.7 | 161.4 | 0 | 0 | 111.8 | E199 A200 V206 T207 | E199-E203 WeakPolarHBondContact O-CG 3.37Å; E199-E203 PolarHBondContact O-N 2.88Å; A200-E203 PolarHBondContact O-N 3.4Å; E203-V206 PolarHBondContact O-N 2.78Å; E203-T207 WeakPolarHBondContact O-CG2 3.43Å; E203-T207 PolarHBondContact O-N 2.87Å; E203-T207 PolarHBondContact O-OG1 3.05Å |
| 204 | S | 95.9 | Very high | 96 | Very high | 68 Ų | 68 | 101 Ų | 101 | 48% | 0.476 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.6 | -42.9 | 173.9 | 179.9 | 0 | 0 | 0 | 0 | 111.9 | A200 L201 L202 T207 K208 | A200-S204 WeakPolarHBondContact O-CB 3.4Å; A200-S204 PolarHBondContact O-N 3.49Å; L201-S204 WeakPolarHBondContact O-CB 3.42Å; L201-S204 PolarHBondContact O-N 2.99Å; L202-S204 VanDerWaalsContact C-N 3.34Å; S204-T207 WeakPolarHBondContact CA-OG1 3.04Å; S204-T207 PolarHBondContact O-OG1 3.41Å; S204-K208 VanDerWaalsContact O-CB 3.29Å; S204-K208 WeakPolarHBondContact O-CB 3.33Å; S204-K208 PolarHBondContact O-N 3.04Å |
| 205 | D | 96.2 | Very high | 95.9 | Very high | 67 Ų | 67 | 99.9 Ų | 99.9 | 36% | 0.358 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.5 | -41.6 | 177.7 | -77.9 | -18.3 | 0 | 0 | 0 | 111.7 | L201 L202 T207 K208 Y209 | L201-D205 PolarHBondContact O-N 3.46Å; L202-D205 PolarHBondContact O-N 3.38Å; D205-T207 PolarHBondContact O-N 3.29Å; D205-K208 WeakPolarHBondContact O-CB 3.48Å; D205-K208 PolarHBondContact O-N 3.45Å; D205-Y209 HydrophobicContact CB-CD2 4.37Å; D205-Y209 HydrophobicContact CB-CE2 4.12Å; D205-Y209 WeakPolarHBondContact O-CB 3.47Å; D205-Y209 WeakPolarHBondContact O-CD2 3.4Å; D205-Y209 PolarHBondContact O-N 2.92Å |
| 206 | V | 95.6 | Very high | 95.9 | Very high | 73 Ų | 73 | 96.4 Ų | 96.4 | 44% | 0.442 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.3 | -47.6 | 176.3 | 167.9 | 0 | 0 | 0 | 0 | 110.8 | L202 E203 K208 Y209 Q210 | L202-V206 WeakPolarHBondContact O-CB 3.41Å; L202-V206 VanDerWaalsContact O-CG2 3.24Å; L202-V206 WeakPolarHBondContact O-CG2 3.34Å; L202-V206 PolarHBondContact O-N 3.37Å; E203-V206 PolarHBondContact O-N 2.78Å; V206-K208 VanDerWaalsContact C-N 3.34Å; V206-K208 PolarHBondContact O-N 3.39Å; V206-Y209 PolarHBondContact O-N 3.16Å; V206-Q210 HydrophobicContact CG1-CG 4.44Å; V206-Q210 WeakPolarHBondContact O-CB 3.24Å; V206-Q210 VanDerWaalsContact O-CG 3.24Å; V206-Q210 WeakPolarHBondContact O-CG 3.41Å; V206-Q210 PolarHBondContact O-N 2.91Å |
| 207 | T | 95.3 | Very high | 95.8 | Very high | 77 Ų | 77 | 97.1 Ų | 97.1 | 47% | 0.472 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.6 | -39.1 | 178.5 | 51.7 | 0 | 0 | 0 | 0 | 112 | E203 S204 D205 Q210 T211 | E203-T207 WeakPolarHBondContact O-CG2 3.43Å; E203-T207 PolarHBondContact O-N 2.87Å; E203-T207 PolarHBondContact O-OG1 3.05Å; S204-T207 WeakPolarHBondContact CA-OG1 3.04Å; S204-T207 PolarHBondContact O-OG1 3.41Å; D205-T207 PolarHBondContact O-N 3.29Å; T207-Q210 PolarHBondContact O-N 3.28Å; T207-T211 WeakPolarHBondContact O-CB 3.46Å; T207-T211 PolarHBondContact O-N 2.91Å; T207-T211 PolarHBondContact O-OG1 3.34Å |
| 208 | K | 96.5 | Very high | 95.8 | Very high | 110 Ų | 110 | 97.5 Ų | 97.5 | 48% | 0.478 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.2 | -51.9 | 172.9 | -177.4 | -176.6 | 174.7 | -174.3 | 0 | 111.6 | S204 D205 V206 Q210 T211 E212 | S204-K208 VanDerWaalsContact O-CB 3.29Å; S204-K208 WeakPolarHBondContact O-CB 3.33Å; S204-K208 PolarHBondContact O-N 3.04Å; D205-K208 WeakPolarHBondContact O-CB 3.48Å; D205-K208 PolarHBondContact O-N 3.45Å; V206-K208 VanDerWaalsContact C-N 3.34Å; V206-K208 PolarHBondContact O-N 3.39Å; K208-Q210 VanDerWaalsContact C-N 3.33Å; K208-Q210 PolarHBondContact O-N 3.4Å; K208-T211 WeakPolarHBondContact O-CB 3.49Å; K208-T211 PolarHBondContact O-N 3.5Å; K208-T211 VanDerWaalsContact O-N 3.13Å; K208-E212 WeakPolarHBondContact CE-OE1 3.33Å; K208-E212 WeakPolarHBondContact O-CG 3.34Å; K208-E212 PolarHBondContact O-N 3.4Å |
| 209 | Y | 95.4 | Very high | 95.7 | Very high | 143 Ų | 143 | 93.8 Ų | 93.8 | 56% | 0.561 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -65.3 | -34.7 | -179.9 | -70.5 | -48 | 0 | 0 | 0 | 113 | D205 V206 S213 | D205-Y209 HydrophobicContact CB-CD2 4.37Å; D205-Y209 HydrophobicContact CB-CE2 4.12Å; D205-Y209 WeakPolarHBondContact O-CB 3.47Å; D205-Y209 WeakPolarHBondContact O-CD2 3.4Å; D205-Y209 PolarHBondContact O-N 2.92Å; V206-Y209 PolarHBondContact O-N 3.16Å; Y209-S213 WeakPolarHBondContact O-CB 3.27Å; Y209-S213 PolarHBondContact O-N 3.08Å |
| 210 | Q | 96 | Very high | 95.7 | Very high | 119 Ų | 119 | 92 Ų | 92 | 56% | 0.556 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.7 | -44.1 | 172.1 | -75.6 | 174.6 | -3 | 0 | 0 | 111.2 | V206 T207 K208 S213 V214 | V206-Q210 HydrophobicContact CG1-CG 4.44Å; V206-Q210 WeakPolarHBondContact O-CB 3.24Å; V206-Q210 VanDerWaalsContact O-CG 3.24Å; V206-Q210 WeakPolarHBondContact O-CG 3.41Å; V206-Q210 PolarHBondContact O-N 2.91Å; T207-Q210 PolarHBondContact O-N 3.28Å; K208-Q210 VanDerWaalsContact C-N 3.33Å; K208-Q210 PolarHBondContact O-N 3.4Å; Q210-S213 PolarHBondContact O-N 2.98Å; Q210-V214 WeakPolarHBondContact O-CG2 3.32Å; Q210-V214 PolarHBondContact O-N 3.02Å |
| 211 | T | 95.4 | Very high | 95.7 | Very high | 97 Ų | 97 | 93.5 Ų | 93.5 | 60% | 0.595 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -63.8 | -46.2 | 177.4 | -55.1 | 0 | 0 | 0 | 0 | 111.5 | T207 K208 S213 V214 S215 | T207-T211 WeakPolarHBondContact O-CB 3.46Å; T207-T211 PolarHBondContact O-N 2.91Å; T207-T211 PolarHBondContact O-OG1 3.34Å; K208-T211 WeakPolarHBondContact O-CB 3.49Å; K208-T211 PolarHBondContact O-N 3.5Å; K208-T211 VanDerWaalsContact O-N 3.13Å; T211-S213 VanDerWaalsContact C-N 3.34Å; T211-S213 PolarHBondContact O-N 3.32Å; T211-V214 PolarHBondContact O-N 3.48Å; T211-S215 WeakPolarHBondContact O-CB 3.42Å; T211-S215 PolarHBondContact O-N 2.91Å |
| 212 | E | 95.3 | Very high | 95.6 | Very high | 96 Ų | 96 | 96.8 Ų | 96.8 | 45% | 0.449 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.5 | -40.9 | 175.9 | -72.3 | 176.1 | -179.3 | 0 | 0 | 111.8 | K208 S215 A216 | K208-E212 WeakPolarHBondContact CE-OE1 3.33Å; K208-E212 WeakPolarHBondContact O-CG 3.34Å; K208-E212 PolarHBondContact O-N 3.4Å; E212-S215 PolarHBondContact O-N 2.97Å; E212-A216 WeakPolarHBondContact O-CB 3.45Å; E212-A216 PolarHBondContact O-N 2.9Å |
| 213 | S | 95 | Very high | 95.6 | Very high | 56 Ų | 56 | 96.9 Ų | 96.9 | 39% | 0.392 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.4 | -42.5 | 176.5 | -176.7 | 0 | 0 | 0 | 0 | 112.3 | Y209 Q210 T211 A216 K217 | Y209-S213 WeakPolarHBondContact O-CB 3.27Å; Y209-S213 PolarHBondContact O-N 3.08Å; Q210-S213 PolarHBondContact O-N 2.98Å; T211-S213 VanDerWaalsContact C-N 3.34Å; T211-S213 PolarHBondContact O-N 3.32Å; S213-A216 PolarHBondContact O-N 3.17Å; S213-K217 WeakPolarHBondContact O-CG 3.34Å; S213-K217 PolarHBondContact O-N 3.48Å |
| 214 | V | 95.5 | Very high | 95.6 | Very high | 85 Ų | 85 | 97.1 Ų | 97.1 | 52% | 0.515 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.9 | -45.9 | 174.5 | 171.3 | 0 | 0 | 0 | 0 | 110.6 | Q210 T211 A216 K217 L218 | Q210-V214 WeakPolarHBondContact O-CG2 3.32Å; Q210-V214 PolarHBondContact O-N 3.02Å; T211-V214 PolarHBondContact O-N 3.48Å; V214-A216 PolarHBondContact O-N 3.43Å; V214-K217 PolarHBondContact O-N 3.2Å; V214-L218 HydrophobicContact CG1-CD1 4.1Å; V214-L218 WeakPolarHBondContact O-CG 3.4Å; V214-L218 PolarHBondContact O-N 3.36Å |
| 215 | S | 95.4 | Very high | 95.6 | Very high | 75 Ų | 75 | 98.2 Ų | 98.2 | 52% | 0.524 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.5 | -45.3 | 177 | -171.2 | 0 | 0 | 0 | 0 | 111.9 | T211 E212 K217 L218 E219 | T211-S215 WeakPolarHBondContact O-CB 3.42Å; T211-S215 PolarHBondContact O-N 2.91Å; E212-S215 PolarHBondContact O-N 2.97Å; S215-K217 PolarHBondContact O-N 2.88Å; S215-L218 PolarHBondContact O-N 3.36Å; S215-E219 PolarHBondContact O-N 3.27Å |
| 216 | A | 94.5 | Very high | 95.6 | Very high | 61 Ų | 61 | 97.9 Ų | 97.9 | 50% | 0.504 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.7 | -38.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | E212 S213 V214 E219 N220 | E212-A216 WeakPolarHBondContact O-CB 3.45Å; E212-A216 PolarHBondContact O-N 2.9Å; S213-A216 PolarHBondContact O-N 3.17Å; V214-A216 PolarHBondContact O-N 3.43Å; A216-E219 PolarHBondContact O-N 3.49Å; A216-N220 WeakPolarHBondContact O-CB 3.42Å; A216-N220 PolarHBondContact O-N 3.41Å |
| 217 | K | 95 | Very high | 95.6 | Very high | 136 Ų | 136 | 98.8 Ų | 98.8 | 59% | 0.591 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.4 | -42.7 | 174.8 | -76.5 | 175.9 | -175.7 | 177.7 | 0 | 112.1 | S213 V214 S215 N220 N221 | S213-K217 WeakPolarHBondContact O-CG 3.34Å; S213-K217 PolarHBondContact O-N 3.48Å; V214-K217 PolarHBondContact O-N 3.2Å; S215-K217 PolarHBondContact O-N 2.88Å; K217-N220 PolarHBondContact O-N 2.96Å; K217-N221 VanDerWaalsContact O-CG 3.31Å; K217-N221 PolarHBondContact O-N 2.95Å; K217-N221 PolarHBondContact O-ND2 3.43Å |
| 218 | L | 95 | Very high | 95.6 | Very high | 114 Ų | 114 | 99.8 Ų | 99.8 | 60% | 0.597 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.3 | -44.8 | 177 | -71.8 | 168.8 | 0 | 0 | 0 | 111.3 | V214 S215 N221 R222 | V214-L218 HydrophobicContact CG1-CD1 4.1Å; V214-L218 WeakPolarHBondContact O-CG 3.4Å; V214-L218 PolarHBondContact O-N 3.36Å; S215-L218 PolarHBondContact O-N 3.36Å; L218-N221 PolarHBondContact O-N 2.93Å; L218-R222 PolarHBondContact O-N 3.36Å |
| 219 | E | 96 | Very high | 95.6 | Very high | 88 Ų | 88 | 97.6 Ų | 97.6 | 41% | 0.411 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.4 | -39.6 | 178 | -168.3 | 59.2 | -160.2 | 0 | 0 | 111.9 | S215 A216 N221 R222 L223 | S215-E219 PolarHBondContact O-N 3.27Å; A216-E219 PolarHBondContact O-N 3.49Å; E219-N221 VanDerWaalsContact C-N 3.32Å; E219-N221 PolarHBondContact O-N 3.22Å; E219-R222 WeakPolarHBondContact O-CB 3.33Å; E219-R222 PolarHBondContact O-N 3.37Å; E219-L223 HydrophobicContact CG-CD1 4.42Å; E219-L223 WeakPolarHBondContact O-CG 3.49Å; E219-L223 PolarHBondContact O-N 3.39Å |
| 220 | N | 96.1 | Very high | 95.6 | Very high | 78 Ų | 78 | 95.9 Ų | 95.9 | 42% | 0.417 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.1 | -43.2 | 173.7 | -170.2 | -84.4 | 0 | 0 | 0 | 112 | A216 K217 L223 K224 | A216-N220 WeakPolarHBondContact O-CB 3.42Å; A216-N220 PolarHBondContact O-N 3.41Å; K217-N220 PolarHBondContact O-N 2.96Å; N220-L223 PolarHBondContact O-N 3.42Å; N220-K224 WeakPolarHBondContact O-CG 3.41Å; N220-K224 PolarHBondContact O-N 3.29Å; N220-K224 WeakPolarHBondContact OD1-CE 3.49Å; N220-K224 PolarHBondContact OD1-NZ 3.02Å |
| 221 | N | 95.8 | Very high | 95.7 | Very high | 87 Ų | 87 | 95.8 Ų | 95.8 | 47% | 0.465 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.6 | -42.1 | 176.8 | -72.5 | -18.4 | 0 | 0 | 0 | 111.7 | K217 L218 E219 L223 K224 C225 | K217-N221 VanDerWaalsContact O-CG 3.31Å; K217-N221 PolarHBondContact O-N 2.95Å; K217-N221 PolarHBondContact O-ND2 3.43Å; L218-N221 PolarHBondContact O-N 2.93Å; E219-N221 VanDerWaalsContact C-N 3.32Å; E219-N221 PolarHBondContact O-N 3.22Å; N221-L223 VanDerWaalsContact C-N 3.35Å; N221-L223 PolarHBondContact O-N 2.91Å; N221-K224 PolarHBondContact O-N 3.09Å; N221-C225 PolarHBondContact O-N 2.91Å; N221-C225 PolarHBondContact O-SG 2.96Å; N221-C225 VanDerWaalsContact O-SG 3.38Å |
| 222 | R | 95 | Very high | 95.7 | Very high | 180 Ų | 180 | 94.6 Ų | 94.6 | 68% | 0.679 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -58.6 | -46.8 | 174.8 | -175.5 | -176.6 | 179.1 | 168 | 0.7 | 111.5 | L218 E219 C225 S226 | L218-R222 PolarHBondContact O-N 3.36Å; E219-R222 WeakPolarHBondContact O-CB 3.33Å; E219-R222 PolarHBondContact O-N 3.37Å; R222-C225 PolarHBondContact O-N 3.08Å; R222-S226 PolarHBondContact O-N 3.45Å |
| 223 | L | 96.2 | Very high | 95.8 | Very high | 103 Ų | 103 | 93.6 Ų | 93.6 | 54% | 0.539 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.7 | -40.3 | 177.3 | -71.4 | 172.9 | 0 | 0 | 0 | 112 | E219 N220 N221 S226 L227 | E219-L223 HydrophobicContact CG-CD1 4.42Å; E219-L223 WeakPolarHBondContact O-CG 3.49Å; E219-L223 PolarHBondContact O-N 3.39Å; N220-L223 PolarHBondContact O-N 3.42Å; N221-L223 VanDerWaalsContact C-N 3.35Å; N221-L223 PolarHBondContact O-N 2.91Å; L223-S226 PolarHBondContact O-N 3.49Å; L223-L227 VanDerWaalsContact O-CB 3.28Å; L223-L227 WeakPolarHBondContact O-CB 3.24Å; L223-L227 PolarHBondContact O-N 3.49Å |
| 224 | K | 96.8 | Very high | 95.8 | Very high | 126 Ų | 126 | 95.6 Ų | 95.6 | 55% | 0.548 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.8 | -47.2 | 173.6 | -79.3 | 173.8 | 176.9 | 162.4 | 0 | 112 | N220 N221 S226 L227 E228 | N220-K224 WeakPolarHBondContact O-CG 3.41Å; N220-K224 PolarHBondContact O-N 3.29Å; N220-K224 WeakPolarHBondContact OD1-CE 3.49Å; N220-K224 PolarHBondContact OD1-NZ 3.02Å; N221-K224 PolarHBondContact O-N 3.09Å; K224-S226 VanDerWaalsContact C-N 3.33Å; K224-S226 PolarHBondContact O-N 3.41Å; K224-L227 PolarHBondContact O-N 2.91Å; K224-E228 WeakPolarHBondContact O-CB 3.3Å; K224-E228 PolarHBondContact O-N 3.33Å |
| 225 | C | 94.9 | Very high | 95.8 | Very high | 91 Ų | 91 | 97.2 Ų | 97.2 | 62% | 0.615 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.3 | -41.9 | 176 | -68.4 | 0 | 0 | 0 | 0 | 111.9 | N221 R222 E228 S229 | N221-C225 PolarHBondContact O-N 2.91Å; N221-C225 PolarHBondContact O-SG 2.96Å; N221-C225 VanDerWaalsContact O-SG 3.38Å; R222-C225 PolarHBondContact O-N 3.08Å; C225-E228 PolarHBondContact O-N 3.44Å; C225-S229 WeakPolarHBondContact O-CB 3.43Å; C225-S229 PolarHBondContact O-N 3.01Å |
| 226 | S | 95.9 | Very high | 95.8 | Very high | 61 Ų | 61 | 100.7 Ų | 100.7 | 43% | 0.427 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.3 | -43.5 | 176.9 | -169.6 | 0 | 0 | 0 | 0 | 112.1 | R222 L223 K224 E228 S229 I230 | R222-S226 PolarHBondContact O-N 3.45Å; L223-S226 PolarHBondContact O-N 3.49Å; K224-S226 VanDerWaalsContact C-N 3.33Å; K224-S226 PolarHBondContact O-N 3.41Å; S226-E228 VanDerWaalsContact C-N 3.34Å; S226-S229 WeakPolarHBondContact O-CB 3.2Å; S226-S229 PolarHBondContact O-N 3.46Å; S226-I230 VanDerWaalsContact O-CG1 3.32Å; S226-I230 WeakPolarHBondContact O-CG1 3.41Å; S226-I230 PolarHBondContact O-N 3.34Å |
| 227 | L | 95.9 | Very high | 95.9 | Very high | 92 Ų | 92 | 100.9 Ų | 100.9 | 48% | 0.482 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64 | -40.5 | 177.7 | -179.7 | 141.1 | 0 | 0 | 0 | 111.3 | L223 K224 I230 K231 | L223-L227 VanDerWaalsContact O-CB 3.28Å; L223-L227 WeakPolarHBondContact O-CB 3.24Å; L223-L227 PolarHBondContact O-N 3.49Å; K224-L227 PolarHBondContact O-N 2.91Å; L227-I230 PolarHBondContact O-N 2.86Å; L227-K231 HydrophobicContact CD2-CD 3.86Å; L227-K231 VanDerWaalsContact CD2-CE 3.49Å; L227-K231 HydrophobicContact CD2-CG 4.43Å; L227-K231 WeakPolarHBondContact O-CG 3.49Å; L227-K231 PolarHBondContact O-N 2.88Å |
| 228 | E | 96.1 | Very high | 95.9 | Very high | 97 Ų | 97 | 99.5 Ų | 99.5 | 45% | 0.453 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -66.9 | -38.3 | 175.9 | -162.6 | 57.1 | -146.3 | 0 | 0 | 111.8 | K224 C225 S226 K231 N232 | K224-E228 WeakPolarHBondContact O-CB 3.3Å; K224-E228 PolarHBondContact O-N 3.33Å; C225-E228 PolarHBondContact O-N 3.44Å; S226-E228 VanDerWaalsContact C-N 3.34Å; E228-K231 PolarHBondContact O-N 3.14Å; E228-N232 WeakPolarHBondContact O-CB 3.49Å; E228-N232 PolarHBondContact O-N 2.95Å; E228-N232 PolarHBondContact O-ND2 3.34Å |
| 229 | S | 95.9 | Very high | 96 | Very high | 64 Ų | 64 | 98.8 Ų | 98.8 | 45% | 0.448 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.2 | -45.1 | 172.4 | -176.2 | 0 | 0 | 0 | 0 | 111.8 | C225 S226 N232 N233 | C225-S229 WeakPolarHBondContact O-CB 3.43Å; C225-S229 PolarHBondContact O-N 3.01Å; S226-S229 WeakPolarHBondContact O-CB 3.2Å; S226-S229 PolarHBondContact O-N 3.46Å; S229-N232 PolarHBondContact O-N 3.42Å; S229-N233 PolarHBondContact O-N 3.32Å; S229-N233 PolarHBondContact O-ND2 3.38Å |
| 230 | I | 96.4 | Very high | 96 | Very high | 107 Ų | 107 | 99.9 Ų | 99.9 | 55% | 0.549 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.2 | -44.8 | 177.1 | -69 | 166.3 | 0 | 0 | 0 | 110.9 | S226 L227 N232 N233 L234 | S226-I230 VanDerWaalsContact O-CG1 3.32Å; S226-I230 WeakPolarHBondContact O-CG1 3.41Å; S226-I230 PolarHBondContact O-N 3.34Å; L227-I230 PolarHBondContact O-N 2.86Å; I230-N232 VanDerWaalsContact C-N 3.34Å; I230-N232 PolarHBondContact O-N 3.22Å; I230-N233 PolarHBondContact O-N 3.12Å; I230-L234 WeakPolarHBondContact O-CB 3.42Å; I230-L234 PolarHBondContact O-N 2.94Å |
| 231 | K | 96.8 | Very high | 96 | Very high | 117 Ų | 117 | 103.4 Ų | 103.4 | 51% | 0.509 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.2 | -45 | 175.9 | -79.2 | 179.5 | 173.2 | 175.9 | 0 | 112.2 | L227 E228 N233 L234 K235 | L227-K231 HydrophobicContact CD2-CD 3.86Å; L227-K231 VanDerWaalsContact CD2-CE 3.49Å; L227-K231 HydrophobicContact CD2-CG 4.43Å; L227-K231 WeakPolarHBondContact O-CG 3.49Å; L227-K231 PolarHBondContact O-N 2.88Å; E228-K231 PolarHBondContact O-N 3.14Å; K231-N233 VanDerWaalsContact C-N 3.34Å; K231-N233 PolarHBondContact O-N 3.05Å; K231-L234 PolarHBondContact O-N 3.36Å; K231-K235 WeakPolarHBondContact O-CB 3.39Å; K231-K235 PolarHBondContact O-N 2.99Å |
| 232 | N | 96.2 | Very high | 95.9 | Very high | 73 Ų | 73 | 104.4 Ų | 104.4 | 39% | 0.39 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.3 | -39.5 | 177.3 | -75.4 | -44.5 | 0 | 0 | 0 | 112.1 | E228 S229 I230 R236 | E228-N232 WeakPolarHBondContact O-CB 3.49Å; E228-N232 PolarHBondContact O-N 2.95Å; E228-N232 PolarHBondContact O-ND2 3.34Å; S229-N232 PolarHBondContact O-N 3.42Å; I230-N232 VanDerWaalsContact C-N 3.34Å; I230-N232 PolarHBondContact O-N 3.22Å; N232-R236 WeakPolarHBondContact O-CG 3.46Å; N232-R236 PolarHBondContact O-N 3.28Å |
| 233 | N | 96.2 | Very high | 95.9 | Very high | 74 Ų | 74 | 100.8 Ų | 100.8 | 40% | 0.396 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -68.1 | -38.9 | 175.7 | -73 | -18.9 | 0 | 0 | 0 | 112.4 | S229 I230 K231 R236 T237 | S229-N233 PolarHBondContact O-N 3.32Å; S229-N233 PolarHBondContact O-ND2 3.38Å; I230-N233 PolarHBondContact O-N 3.12Å; K231-N233 VanDerWaalsContact C-N 3.34Å; K231-N233 PolarHBondContact O-N 3.05Å; N233-R236 PolarHBondContact O-N 2.99Å; N233-R236 PolarHBondContact OD1-NH1 3.18Å; N233-R236 VanDerWaalsContact OD1-NH1 3.09Å; N233-T237 WeakPolarHBondContact O-CB 3.32Å; N233-T237 PolarHBondContact O-N 2.99Å; N233-T237 PolarHBondContact O-OG1 3.41Å |
| 234 | L | 95.5 | Very high | 95.9 | Very high | 99 Ų | 99 | 100.3 Ų | 100.3 | 52% | 0.518 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.3 | -49.8 | 174.3 | -178.4 | 65 | 0 | 0 | 0 | 110.4 | I230 K231 R236 T237 E238 | I230-L234 WeakPolarHBondContact O-CB 3.42Å; I230-L234 PolarHBondContact O-N 2.94Å; K231-L234 PolarHBondContact O-N 3.36Å; L234-R236 PolarHBondContact O-N 3.19Å; L234-T237 CarbonylContact O-C 3.52Å; L234-T237 WeakPolarHBondContact O-CA 3.38Å; L234-T237 WeakPolarHBondContact O-CB 3.45Å; L234-T237 PolarHBondContact O-N 2.93Å; L234-E238 WeakPolarHBondContact O-CG 3.45Å; L234-E238 PolarHBondContact O-N 3.34Å |
| 235 | K | 96.5 | Very high | 95.8 | Very high | 118 Ų | 118 | 97.5 Ų | 97.5 | 51% | 0.513 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -56.6 | -45.8 | 177.2 | -176.5 | 177.1 | 175.8 | -177.7 | 0 | 112.4 | K231 T237 E238 E239 | K231-K235 WeakPolarHBondContact O-CB 3.39Å; K231-K235 PolarHBondContact O-N 2.99Å; K235-T237 VanDerWaalsContact C-N 3.27Å; K235-T237 PolarHBondContact O-N 2.97Å; K235-E238 PolarHBondContact O-N 3.02Å; K235-E239 WeakPolarHBondContact CE-OE1 3.39Å; K235-E239 WeakPolarHBondContact O-CG 3.49Å; K235-E239 PolarHBondContact O-N 3.16Å |
| 236 | R | 95.2 | Very high | 95.9 | Very high | 148 Ų | 148 | 96.6 Ų | 96.6 | 56% | 0.558 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -60.2 | -38.1 | 174.4 | -74 | 178.9 | -168.3 | 142.3 | -1.9 | 112.4 | N232 N233 L234 M240 | N232-R236 WeakPolarHBondContact O-CG 3.46Å; N232-R236 PolarHBondContact O-N 3.28Å; N233-R236 PolarHBondContact O-N 2.99Å; N233-R236 PolarHBondContact OD1-NH1 3.18Å; N233-R236 VanDerWaalsContact OD1-NH1 3.09Å; L234-R236 PolarHBondContact O-N 3.19Å; R236-M240 WeakPolarHBondContact O-CB 3.4Å; R236-M240 WeakPolarHBondContact O-CG 3.4Å; R236-M240 PolarHBondContact O-N 3.34Å |
| 237 | T | 95.8 | Very high | 95.9 | Very high | 66 Ų | 66 | 96.2 Ų | 96.2 | 41% | 0.405 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -68.5 | -42.5 | 179.1 | -54.1 | 0 | 0 | 0 | 0 | 110.7 | N233 L234 K235 M240 R241 | N233-T237 WeakPolarHBondContact O-CB 3.32Å; N233-T237 PolarHBondContact O-N 2.99Å; N233-T237 PolarHBondContact O-OG1 3.41Å; L234-T237 CarbonylContact O-C 3.52Å; L234-T237 WeakPolarHBondContact O-CA 3.38Å; L234-T237 WeakPolarHBondContact O-CB 3.45Å; L234-T237 PolarHBondContact O-N 2.93Å; K235-T237 VanDerWaalsContact C-N 3.27Å; K235-T237 PolarHBondContact O-N 2.97Å; T237-M240 PolarHBondContact O-N 3.36Å; T237-R241 WeakPolarHBondContact O-CB 3.27Å; T237-R241 VanDerWaalsContact O-CG 3.28Å; T237-R241 WeakPolarHBondContact O-CG 3.48Å; T237-R241 PolarHBondContact O-N 2.97Å |
| 238 | E | 96.2 | Very high | 95.9 | Very high | 106 Ų | 106 | 97.3 Ų | 97.3 | 50% | 0.495 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.4 | -47.6 | 173.4 | -70.1 | 173.9 | 161 | 0 | 0 | 111.1 | L234 K235 M240 R241 D242 | L234-E238 WeakPolarHBondContact O-CG 3.45Å; L234-E238 PolarHBondContact O-N 3.34Å; K235-E238 PolarHBondContact O-N 3.02Å; E238-M240 PolarHBondContact O-N 2.88Å; E238-R241 WeakPolarHBondContact O-CB 3.43Å; E238-R241 PolarHBondContact O-N 3.37Å; E238-R241 VanDerWaalsContact O-N 3.14Å; E238-D242 PolarHBondContact O-N 3.49Å |
| 239 | E | 96.4 | Very high | 95.9 | Very high | 99 Ų | 99 | 99.1 Ų | 99.1 | 46% | 0.463 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.9 | -43.9 | 176.1 | -72.8 | 170.1 | 177.2 | 0 | 0 | 112.2 | K235 D242 V243 | K235-E239 WeakPolarHBondContact CE-OE1 3.39Å; K235-E239 WeakPolarHBondContact O-CG 3.49Å; K235-E239 PolarHBondContact O-N 3.16Å; E239-D242 PolarHBondContact O-N 2.87Å; E239-V243 WeakPolarHBondContact O-CG2 3.42Å; E239-V243 PolarHBondContact O-N 3.03Å; E239-V243 VanDerWaalsContact O-N 3.09Å |
| 240 | M | 95.9 | Very high | 95.9 | Very high | 112 Ų | 112 | 102.1 Ų | 102.1 | 55% | 0.552 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.2 | -41.8 | 174.9 | -75.8 | -171.2 | -59.9 | 0 | 0 | 112 | R236 T237 E238 D242 V243 E244 | R236-M240 WeakPolarHBondContact O-CB 3.4Å; R236-M240 WeakPolarHBondContact O-CG 3.4Å; R236-M240 PolarHBondContact O-N 3.34Å; T237-M240 PolarHBondContact O-N 3.36Å; E238-M240 PolarHBondContact O-N 2.88Å; M240-D242 VanDerWaalsContact C-N 3.34Å; M240-V243 PolarHBondContact O-N 3.49Å; M240-E244 WeakPolarHBondContact O-CG 3.38Å; M240-E244 PolarHBondContact O-N 3.37Å |
| 241 | R | 95.4 | Very high | 95.9 | Very high | 151 Ų | 151 | 100.9 Ų | 100.9 | 57% | 0.57 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.9 | -39.6 | 176.7 | -74.1 | -60.4 | -166.5 | -172.5 | 3.4 | 111.9 | T237 E238 V243 E244 V245 | T237-R241 WeakPolarHBondContact O-CB 3.27Å; T237-R241 VanDerWaalsContact O-CG 3.28Å; T237-R241 WeakPolarHBondContact O-CG 3.48Å; T237-R241 PolarHBondContact O-N 2.97Å; E238-R241 WeakPolarHBondContact O-CB 3.43Å; E238-R241 PolarHBondContact O-N 3.37Å; E238-R241 VanDerWaalsContact O-N 3.14Å; R241-V243 VanDerWaalsContact C-N 3.33Å; R241-V243 PolarHBondContact O-N 3.39Å; R241-E244 WeakPolarHBondContact CD-OE2 3.24Å; R241-E244 IonicContact CZ-OE2 3.77Å; R241-E244 IonicContact NE-OE2 3.61Å; R241-E244 IonicContact NH1-OE2 2.68Å; R241-E244 PolarHBondContact NH1-OE2 3.35Å; R241-E244 PolarHBondContact O-N 3.28Å; R241-V245 WeakPolarHBondContact O-CB 3.49Å; R241-V245 VanDerWaalsContact O-CG2 3.25Å; R241-V245 WeakPolarHBondContact O-CG2 3.34Å; R241-V245 PolarHBondContact O-N 2.93Å |
| 242 | D | 95.3 | Very high | 95.8 | Very high | 108 Ų | 108 | 99.8 Ų | 99.8 | 58% | 0.578 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.6 | -40.5 | 176.4 | -77.2 | -19 | 0 | 0 | 0 | 111.5 | E238 E239 M240 V245 T246 | E238-D242 PolarHBondContact O-N 3.49Å; E239-D242 PolarHBondContact O-N 2.87Å; M240-D242 VanDerWaalsContact C-N 3.34Å; D242-V245 PolarHBondContact O-N 2.98Å; D242-T246 VanDerWaalsContact O-CB 3.32Å; D242-T246 WeakPolarHBondContact O-CB 3.27Å; D242-T246 PolarHBondContact O-N 2.94Å; D242-T246 PolarHBondContact O-OG1 2.73Å |
| 243 | V | 94.9 | Very high | 95.8 | Very high | 104 Ų | 104 | 101.4 Ų | 101.4 | 63% | 0.63 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.7 | -47.3 | 173 | 173.4 | 0 | 0 | 0 | 0 | 111.2 | E239 M240 R241 V245 T246 S247 | E239-V243 WeakPolarHBondContact O-CG2 3.42Å; E239-V243 PolarHBondContact O-N 3.03Å; E239-V243 VanDerWaalsContact O-N 3.09Å; M240-V243 PolarHBondContact O-N 3.49Å; R241-V243 VanDerWaalsContact C-N 3.33Å; R241-V243 PolarHBondContact O-N 3.39Å; V243-V245 PolarHBondContact O-N 3.24Å; V243-T246 PolarHBondContact O-N 3.15Å; V243-S247 WeakPolarHBondContact O-CB 3.43Å; V243-S247 PolarHBondContact O-N 2.93Å |
| 244 | E | 95.5 | Very high | 95.8 | Very high | 94 Ų | 94 | 102.3 Ų | 102.3 | 44% | 0.439 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.1 | -47 | 176.6 | -75 | 178.5 | 174.6 | 0 | 0 | 111.9 | M240 R241 T246 S247 L248 | M240-E244 WeakPolarHBondContact O-CG 3.38Å; M240-E244 PolarHBondContact O-N 3.37Å; R241-E244 WeakPolarHBondContact CD-OE2 3.24Å; R241-E244 IonicContact CZ-OE2 3.77Å; R241-E244 IonicContact NE-OE2 3.61Å; R241-E244 IonicContact NH1-OE2 2.68Å; R241-E244 PolarHBondContact NH1-OE2 3.35Å; R241-E244 PolarHBondContact O-N 3.28Å; E244-T246 VanDerWaalsContact C-N 3.32Å; E244-T246 PolarHBondContact O-N 2.99Å; E244-S247 PolarHBondContact O-N 3.49Å; E244-L248 WeakPolarHBondContact O-CB 3.4Å; E244-L248 VanDerWaalsContact O-CG 3.29Å; E244-L248 WeakPolarHBondContact O-CG 3.38Å; E244-L248 PolarHBondContact O-N 3.17Å |
| 245 | V | 95.6 | Very high | 95.8 | Very high | 66 Ų | 66 | 102.6 Ų | 102.6 | 40% | 0.4 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.6 | -40.4 | 179.1 | 168.5 | 0 | 0 | 0 | 0 | 110.8 | R241 D242 V243 L248 K249 | R241-V245 WeakPolarHBondContact O-CB 3.49Å; R241-V245 VanDerWaalsContact O-CG2 3.25Å; R241-V245 WeakPolarHBondContact O-CG2 3.34Å; R241-V245 PolarHBondContact O-N 2.93Å; D242-V245 PolarHBondContact O-N 2.98Å; V243-V245 PolarHBondContact O-N 3.24Å; V245-L248 PolarHBondContact O-N 2.95Å; V245-K249 HydrophobicContact CG1-CD 4.28Å; V245-K249 WeakPolarHBondContact O-CG 3.4Å; V245-K249 PolarHBondContact O-N 3.38Å |
| 246 | T | 95.6 | Very high | 95.8 | Very high | 72 Ų | 72 | 101.3 Ų | 101.3 | 44% | 0.442 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.1 | -46.5 | 177.4 | -55.5 | 0 | 0 | 0 | 0 | 110.7 | D242 V243 E244 L248 K249 E250 | D242-T246 VanDerWaalsContact O-CB 3.32Å; D242-T246 WeakPolarHBondContact O-CB 3.27Å; D242-T246 PolarHBondContact O-N 2.94Å; D242-T246 PolarHBondContact O-OG1 2.73Å; V243-T246 PolarHBondContact O-N 3.15Å; E244-T246 VanDerWaalsContact C-N 3.32Å; E244-T246 PolarHBondContact O-N 2.99Å; T246-L248 VanDerWaalsContact C-N 3.34Å; T246-L248 PolarHBondContact O-N 3.25Å; T246-K249 WeakPolarHBondContact O-CB 3.49Å; T246-K249 PolarHBondContact O-N 3.4Å; T246-K249 VanDerWaalsContact O-N 3.15Å; T246-E250 WeakPolarHBondContact O-CG 3.39Å; T246-E250 PolarHBondContact O-N 3.01Å |
| 247 | S | 95.7 | Very high | 95.8 | Very high | 53 Ų | 53 | 100.2 Ų | 100.2 | 37% | 0.371 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.1 | -41.2 | 175.9 | -179 | 0 | 0 | 0 | 0 | 112.4 | V243 E244 K249 E250 N251 | V243-S247 WeakPolarHBondContact O-CB 3.43Å; V243-S247 PolarHBondContact O-N 2.93Å; E244-S247 PolarHBondContact O-N 3.49Å; S247-K249 VanDerWaalsContact C-N 3.34Å; S247-K249 PolarHBondContact O-N 2.92Å; S247-E250 PolarHBondContact O-N 3.37Å; S247-N251 WeakPolarHBondContact O-CB 3.39Å; S247-N251 VanDerWaalsContact O-CG 3.32Å; S247-N251 PolarHBondContact O-N 2.88Å; S247-N251 PolarHBondContact O-ND2 2.87Å; S247-N251 VanDerWaalsContact O-ND2 3.16Å |
| 248 | L | 95.8 | Very high | 95.8 | Very high | 116 Ų | 116 | 101.7 Ų | 101.7 | 61% | 0.607 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.2 | -38.4 | 175.4 | -74.4 | 171.9 | 0 | 0 | 0 | 112.2 | E244 V245 T246 L252 | E244-L248 WeakPolarHBondContact O-CB 3.4Å; E244-L248 VanDerWaalsContact O-CG 3.29Å; E244-L248 WeakPolarHBondContact O-CG 3.38Å; E244-L248 PolarHBondContact O-N 3.17Å; V245-L248 PolarHBondContact O-N 2.95Å; T246-L248 VanDerWaalsContact C-N 3.34Å; T246-L248 PolarHBondContact O-N 3.25Å; L248-L252 WeakPolarHBondContact O-CB 3.19Å; L248-L252 PolarHBondContact O-N 3.41Å |
| 249 | K | 96.5 | Very high | 95.8 | Very high | 135 Ų | 135 | 102.3 Ų | 102.3 | 59% | 0.587 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.2 | -44.4 | 174.3 | -76.7 | 173.7 | 178.9 | 175.9 | 0 | 111.7 | V245 T246 S247 L252 E253 | V245-K249 HydrophobicContact CG1-CD 4.28Å; V245-K249 WeakPolarHBondContact O-CG 3.4Å; V245-K249 PolarHBondContact O-N 3.38Å; T246-K249 WeakPolarHBondContact O-CB 3.49Å; T246-K249 PolarHBondContact O-N 3.4Å; T246-K249 VanDerWaalsContact O-N 3.15Å; S247-K249 VanDerWaalsContact C-N 3.34Å; S247-K249 PolarHBondContact O-N 2.92Å; K249-L252 WeakPolarHBondContact O-CB 3.19Å; K249-L252 PolarHBondContact O-N 3.22Å; K249-E253 PolarHBondContact O-N 2.9Å |
| 250 | E | 95.8 | Very high | 95.7 | Very high | 127 Ų | 127 | 103.7 Ų | 103.7 | 59% | 0.593 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61 | -46.1 | 176.1 | -71.5 | 174.5 | 172.9 | 0 | 0 | 111.5 | T246 S247 L252 E253 L254 | T246-E250 WeakPolarHBondContact O-CG 3.39Å; T246-E250 PolarHBondContact O-N 3.01Å; S247-E250 PolarHBondContact O-N 3.37Å; E250-L252 VanDerWaalsContact C-N 3.34Å; E250-L252 PolarHBondContact O-N 2.99Å; E250-E253 PolarHBondContact O-N 3.49Å; E250-L254 PolarHBondContact O-N 3.27Å |
| 251 | N | 96.3 | Very high | 95.7 | Very high | 81 Ų | 81 | 103.5 Ų | 103.5 | 43% | 0.433 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.3 | -39.6 | 176.1 | -74.2 | -34.6 | 0 | 0 | 0 | 112.3 | S247 L254 I255 | S247-N251 WeakPolarHBondContact O-CB 3.39Å; S247-N251 VanDerWaalsContact O-CG 3.32Å; S247-N251 PolarHBondContact O-N 2.88Å; S247-N251 PolarHBondContact O-ND2 2.87Å; S247-N251 VanDerWaalsContact O-ND2 3.16Å; N251-L254 PolarHBondContact O-N 3.32Å; N251-I255 VanDerWaalsContact O-CG1 3.3Å; N251-I255 WeakPolarHBondContact O-CG1 3.23Å; N251-I255 PolarHBondContact O-N 3.05Å |
| 252 | L | 95.4 | Very high | 95.7 | Very high | 94 Ų | 94 | 100.3 Ų | 100.3 | 49% | 0.492 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.8 | -44.9 | 175.7 | -173.4 | 98.5 | 0 | 0 | 0 | 111.4 | L248 K249 E250 L254 I255 K256 | L248-L252 WeakPolarHBondContact O-CB 3.19Å; L248-L252 PolarHBondContact O-N 3.41Å; K249-L252 WeakPolarHBondContact O-CB 3.19Å; K249-L252 PolarHBondContact O-N 3.22Å; E250-L252 VanDerWaalsContact C-N 3.34Å; E250-L252 PolarHBondContact O-N 2.99Å; L252-L254 VanDerWaalsContact C-N 3.35Å; L252-I255 PolarHBondContact O-N 2.8Å; L252-K256 WeakPolarHBondContact O-CG 3.37Å; L252-K256 PolarHBondContact O-N 2.9Å |
| 253 | E | 96 | Very high | 95.7 | Very high | 106 Ų | 106 | 99.9 Ų | 99.9 | 50% | 0.495 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.4 | -38.3 | 177.5 | -72.9 | -54 | 138.1 | 0 | 0 | 112 | K249 E250 K256 H257 | K249-E253 PolarHBondContact O-N 2.9Å; E250-E253 PolarHBondContact O-N 3.49Å; E253-K256 PolarHBondContact O-N 3.2Å; E253-K256 IonicContact OE1-NZ 2.7Å; E253-K256 PolarHBondContact OE1-NZ 3.47Å; E253-H257 WeakPolarHBondContact O-CB 3.5Å; E253-H257 PolarHBondContact O-N 2.97Å |
| 254 | L | 95.7 | Very high | 95.8 | Very high | 93 Ų | 93 | 98 Ų | 98 | 49% | 0.487 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.1 | -47.2 | 172.7 | -176.7 | 66.6 | 0 | 0 | 0 | 111.6 | E250 N251 L252 K256 H257 Q258 | E250-L254 PolarHBondContact O-N 3.27Å; N251-L254 PolarHBondContact O-N 3.32Å; L252-L254 VanDerWaalsContact C-N 3.35Å; L254-K256 PolarHBondContact O-N 2.97Å; L254-H257 PolarHBondContact O-N 3.33Å; L254-Q258 WeakPolarHBondContact O-CG 3.21Å; L254-Q258 PolarHBondContact O-N 3.5Å |
| 255 | I | 95.6 | Very high | 95.8 | Very high | 106 Ų | 106 | 97.8 Ų | 97.8 | 54% | 0.544 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.4 | -41.7 | 177.9 | -69.7 | 167.7 | 0 | 0 | 0 | 110.9 | N251 L252 H257 Q258 H259 | N251-I255 VanDerWaalsContact O-CG1 3.3Å; N251-I255 WeakPolarHBondContact O-CG1 3.23Å; N251-I255 PolarHBondContact O-N 3.05Å; L252-I255 PolarHBondContact O-N 2.8Å; I255-H257 VanDerWaalsContact C-N 3.33Å; I255-H257 PolarHBondContact O-N 3.24Å; I255-Q258 PolarHBondContact O-N 2.99Å; I255-H259 WeakPolarHBondContact O-CB 3.35Å; I255-H259 PolarHBondContact O-N 3.2Å |
| 256 | K | 96 | Very high | 95.8 | Very high | 90 Ų | 90 | 98.8 Ų | 98.8 | 39% | 0.391 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.3 | -45.4 | 174.2 | -76.8 | 177.4 | -174.2 | 169.9 | 0 | 110.9 | L252 E253 L254 H259 H260 | L252-K256 WeakPolarHBondContact O-CG 3.37Å; L252-K256 PolarHBondContact O-N 2.9Å; E253-K256 PolarHBondContact O-N 3.2Å; E253-K256 IonicContact OE1-NZ 2.7Å; E253-K256 PolarHBondContact OE1-NZ 3.47Å; L254-K256 PolarHBondContact O-N 2.97Å; K256-H259 WeakPolarHBondContact O-CB 3.27Å; K256-H259 PolarHBondContact O-N 2.89Å; K256-H260 PolarHBondContact O-N 3.48Å; K256-H260 PolarHBondContact O-ND1 3.45Å |
| 257 | H | 95.3 | Very high | 95.8 | Very high | 125 Ų | 125 | 99.8 Ų | 99.8 | 58% | 0.579 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61 | -48.3 | 178.9 | -170.8 | 68.8 | 0 | 0 | 0 | 111.6 | E253 L254 I255 H259 H260 E261 | E253-H257 WeakPolarHBondContact O-CB 3.5Å; E253-H257 PolarHBondContact O-N 2.97Å; L254-H257 PolarHBondContact O-N 3.33Å; I255-H257 VanDerWaalsContact C-N 3.33Å; I255-H257 PolarHBondContact O-N 3.24Å; H257-H259 VanDerWaalsContact C-N 3.29Å; H257-H259 PolarHBondContact O-N 3.42Å; H257-H260 PolarHBondContact O-N 3.45Å; H257-H260 VanDerWaalsContact O-N 3.14Å; H257-E261 PolarHBondContact O-N 2.85Å |
| 258 | Q | 96.1 | Very high | 95.8 | Very high | 97 Ų | 97 | 100.7 Ų | 100.7 | 45% | 0.453 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.2 | -39.3 | 174.8 | -70.8 | 174.7 | -11.4 | 0 | 0 | 112.3 | L254 I255 E261 T262 | L254-Q258 WeakPolarHBondContact O-CG 3.21Å; L254-Q258 PolarHBondContact O-N 3.5Å; I255-Q258 PolarHBondContact O-N 2.99Å; Q258-E261 PolarHBondContact O-N 3Å; Q258-T262 WeakPolarHBondContact O-CB 3.32Å; Q258-T262 WeakPolarHBondContact O-CG2 3.32Å; Q258-T262 PolarHBondContact O-N 3.49Å; Q258-T262 PolarHBondContact O-OG1 2.96Å |
| 259 | H | 96 | Very high | 95.8 | Very high | 120 Ų | 120 | 98.9 Ų | 98.9 | 56% | 0.556 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.4 | -43.7 | 175.3 | -176.8 | 67.8 | 0 | 0 | 0 | 111.9 | I255 K256 H257 T262 H263 | I255-H259 WeakPolarHBondContact O-CB 3.35Å; I255-H259 PolarHBondContact O-N 3.2Å; K256-H259 WeakPolarHBondContact O-CB 3.27Å; K256-H259 PolarHBondContact O-N 2.89Å; H257-H259 VanDerWaalsContact C-N 3.29Å; H257-H259 PolarHBondContact O-N 3.42Å; H259-T262 WeakPolarHBondContact CA-OG1 3.28Å; H259-T262 PolarHBondContact O-OG1 3.22Å; H259-H263 WeakPolarHBondContact O-CB 3.45Å; H259-H263 PolarHBondContact O-N 2.78Å |
| 260 | H | 95.9 | Very high | 95.7 | Very high | 127 Ų | 127 | 98.7 Ų | 98.7 | 59% | 0.588 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.5 | -42 | 176.5 | -75.3 | 81.1 | 0 | 0 | 0 | 111.8 | K256 H257 H263 S264 | K256-H260 PolarHBondContact O-N 3.48Å; K256-H260 PolarHBondContact O-ND1 3.45Å; H257-H260 PolarHBondContact O-N 3.45Å; H257-H260 VanDerWaalsContact O-N 3.14Å; H260-H263 PolarHBondContact O-N 3.25Å; H260-S264 WeakPolarHBondContact O-CB 3.12Å; H260-S264 PolarHBondContact O-N 2.99Å |
| 261 | E | 95.2 | Very high | 95.7 | Very high | 109 Ų | 109 | 97.5 Ų | 97.5 | 51% | 0.509 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.9 | -50.1 | 177.6 | -173.1 | -178.1 | -173.3 | 0 | 0 | 111.5 | H257 Q258 H263 S264 N265 | H257-E261 PolarHBondContact O-N 2.85Å; Q258-E261 PolarHBondContact O-N 3Å; E261-H263 VanDerWaalsContact C-N 3.32Å; E261-H263 PolarHBondContact O-N 2.75Å; E261-S264 WeakPolarHBondContact O-CB 3.2Å; E261-S264 PolarHBondContact O-N 3.36Å; E261-N265 WeakPolarHBondContact O-CB 3.5Å; E261-N265 VanDerWaalsContact O-CG 3.29Å; E261-N265 PolarHBondContact O-N 2.98Å; E261-N265 PolarHBondContact O-ND2 3.48Å |
| 262 | T | 95.2 | Very high | 95.6 | Very high | 84 Ų | 84 | 98.3 Ų | 98.3 | 52% | 0.515 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.2 | -37.3 | 177 | 51.5 | 0 | 0 | 0 | 0 | 112.4 | Q258 H259 N265 L266 | Q258-T262 WeakPolarHBondContact O-CB 3.32Å; Q258-T262 WeakPolarHBondContact O-CG2 3.32Å; Q258-T262 PolarHBondContact O-N 3.49Å; Q258-T262 PolarHBondContact O-OG1 2.96Å; H259-T262 WeakPolarHBondContact CA-OG1 3.28Å; H259-T262 PolarHBondContact O-OG1 3.22Å; T262-N265 PolarHBondContact O-N 2.82Å; T262-L266 WeakPolarHBondContact O-CB 3.45Å; T262-L266 PolarHBondContact O-N 2.81Å |
| 263 | H | 96.5 | Very high | 95.6 | Very high | 98 Ų | 98 | 97.9 Ų | 97.9 | 45% | 0.454 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.8 | -43.8 | 174.4 | -171.5 | 73 | 0 | 0 | 0 | 112 | H259 H260 E261 L266 I267 | H259-H263 WeakPolarHBondContact O-CB 3.45Å; H259-H263 PolarHBondContact O-N 2.78Å; H260-H263 PolarHBondContact O-N 3.25Å; E261-H263 VanDerWaalsContact C-N 3.32Å; E261-H263 PolarHBondContact O-N 2.75Å; H263-L266 WeakPolarHBondContact O-CB 3.4Å; H263-L266 PolarHBondContact O-N 3.33Å; H263-I267 WeakPolarHBondContact O-CG1 3.31Å; H263-I267 PolarHBondContact O-N 2.92Å |
| 264 | S | 96.4 | Very high | 95.5 | Very high | 66 Ų | 66 | 96.8 Ų | 96.8 | 46% | 0.462 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60 | -47.5 | 174.6 | -174.8 | 0 | 0 | 0 | 0 | 111.4 | H260 E261 L266 I267 T268 | H260-S264 WeakPolarHBondContact O-CB 3.12Å; H260-S264 PolarHBondContact O-N 2.99Å; E261-S264 WeakPolarHBondContact O-CB 3.2Å; E261-S264 PolarHBondContact O-N 3.36Å; S264-L266 VanDerWaalsContact C-N 3.3Å; S264-L266 PolarHBondContact O-N 3.1Å; S264-I267 WeakPolarHBondContact O-CB 3.27Å; S264-I267 PolarHBondContact O-N 2.84Å; S264-I267 VanDerWaalsContact O-N 3.11Å; S264-T268 PolarHBondContact O-N 2.81Å; S264-T268 PolarHBondContact O-OG1 3.32Å |
| 265 | N | 95.9 | Very high | 95.5 | Very high | 88 Ų | 88 | 95.6 Ų | 95.6 | 47% | 0.471 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.6 | -41 | 175.9 | -70.5 | -20.5 | 0 | 0 | 0 | 111.9 | E261 T262 I267 T268 V269 | E261-N265 WeakPolarHBondContact O-CB 3.5Å; E261-N265 VanDerWaalsContact O-CG 3.29Å; E261-N265 PolarHBondContact O-N 2.98Å; E261-N265 PolarHBondContact O-ND2 3.48Å; T262-N265 PolarHBondContact O-N 2.82Å; N265-I267 VanDerWaalsContact C-N 3.34Å; N265-I267 PolarHBondContact O-N 3.3Å; N265-T268 WeakPolarHBondContact O-CB 3.34Å; N265-T268 PolarHBondContact O-N 2.83Å; N265-V269 WeakPolarHBondContact O-CG2 3.08Å; N265-V269 PolarHBondContact O-N 3.49Å |
| 266 | L | 95.6 | Very high | 95.5 | Very high | 87 Ų | 87 | 97.7 Ų | 97.7 | 46% | 0.455 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.7 | -39.5 | 175.6 | -179.3 | 65.7 | 0 | 0 | 0 | 112.1 | T262 H263 S264 V269 K270 | T262-L266 WeakPolarHBondContact O-CB 3.45Å; T262-L266 PolarHBondContact O-N 2.81Å; H263-L266 WeakPolarHBondContact O-CB 3.4Å; H263-L266 PolarHBondContact O-N 3.33Å; S264-L266 VanDerWaalsContact C-N 3.3Å; S264-L266 PolarHBondContact O-N 3.1Å; L266-V269 PolarHBondContact O-N 3.41Å; L266-K270 WeakPolarHBondContact O-CB 3.36Å; L266-K270 WeakPolarHBondContact O-CG 3.34Å; L266-K270 PolarHBondContact O-N 3.44Å |
| 267 | I | 95.8 | Very high | 95.4 | Very high | 94 Ų | 94 | 99.5 Ų | 99.5 | 48% | 0.482 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.9 | -46.4 | 174.3 | -68.6 | 168.3 | 0 | 0 | 0 | 110.1 | H263 S264 N265 V269 K270 Q271 | H263-I267 WeakPolarHBondContact O-CG1 3.31Å; H263-I267 PolarHBondContact O-N 2.92Å; S264-I267 WeakPolarHBondContact O-CB 3.27Å; S264-I267 PolarHBondContact O-N 2.84Å; S264-I267 VanDerWaalsContact O-N 3.11Å; N265-I267 VanDerWaalsContact C-N 3.34Å; N265-I267 PolarHBondContact O-N 3.3Å; I267-V269 PolarHBondContact O-N 2.86Å; I267-K270 WeakPolarHBondContact O-CB 3.41Å; I267-K270 PolarHBondContact O-N 3.46Å; I267-Q271 PolarHBondContact O-N 3.43Å |
| 268 | T | 94.7 | Very high | 95.4 | Very high | 72 Ų | 72 | 100 Ų | 100 | 44% | 0.442 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -58.4 | -48.9 | 177 | -55.8 | 0 | 0 | 0 | 0 | 111.4 | S264 N265 K270 Q271 E272 | S264-T268 PolarHBondContact O-N 2.81Å; S264-T268 PolarHBondContact O-OG1 3.32Å; N265-T268 WeakPolarHBondContact O-CB 3.34Å; N265-T268 PolarHBondContact O-N 2.83Å; T268-K270 VanDerWaalsContact C-N 3.33Å; T268-K270 PolarHBondContact O-N 3.34Å; T268-Q271 WeakPolarHBondContact O-CB 3.17Å; T268-Q271 PolarHBondContact O-N 2.95Å; T268-Q271 VanDerWaalsContact O-N 3.1Å; T268-E272 PolarHBondContact O-N 3.24Å |
| 269 | V | 95.2 | Very high | 95.3 | Very high | 77 Ų | 77 | 102.1 Ų | 102.1 | 47% | 0.467 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.6 | -42.1 | 177.1 | 171.3 | 0 | 0 | 0 | 0 | 111.3 | N265 L266 I267 Q271 E272 V273 | N265-V269 WeakPolarHBondContact O-CG2 3.08Å; N265-V269 PolarHBondContact O-N 3.49Å; L266-V269 PolarHBondContact O-N 3.41Å; I267-V269 PolarHBondContact O-N 2.86Å; V269-Q271 VanDerWaalsContact C-N 3.31Å; V269-Q271 PolarHBondContact O-N 3.25Å; V269-E272 PolarHBondContact O-N 2.9Å; V269-V273 HydrophobicContact CG1-CG2 4.44Å; V269-V273 VanDerWaalsContact O-CG2 3.31Å; V269-V273 WeakPolarHBondContact O-CG2 3.19Å; V269-V273 PolarHBondContact O-N 2.97Å |
| 270 | K | 95.2 | Very high | 95.2 | Very high | 131 Ų | 131 | 101.2 Ų | 101.2 | 57% | 0.57 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.1 | -41.4 | 174.7 | -79 | 179.8 | 176.9 | -178.1 | 0 | 111.8 | L266 I267 T268 V273 L274 | L266-K270 WeakPolarHBondContact O-CB 3.36Å; L266-K270 WeakPolarHBondContact O-CG 3.34Å; L266-K270 PolarHBondContact O-N 3.44Å; I267-K270 WeakPolarHBondContact O-CB 3.41Å; I267-K270 PolarHBondContact O-N 3.46Å; T268-K270 VanDerWaalsContact C-N 3.33Å; T268-K270 PolarHBondContact O-N 3.34Å; K270-V273 PolarHBondContact O-N 3.23Å; K270-L274 WeakPolarHBondContact O-CG 3.49Å; K270-L274 PolarHBondContact O-N 3.16Å |
| 271 | Q | 95.7 | Very high | 95.1 | Very high | 102 Ų | 102 | 96.3 Ų | 96.3 | 48% | 0.477 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.6 | -39.8 | 177.3 | -170.5 | 61.6 | 32.2 | 0 | 0 | 111.9 | I267 T268 V269 L274 N275 | I267-Q271 PolarHBondContact O-N 3.43Å; T268-Q271 WeakPolarHBondContact O-CB 3.17Å; T268-Q271 PolarHBondContact O-N 2.95Å; T268-Q271 VanDerWaalsContact O-N 3.1Å; V269-Q271 VanDerWaalsContact C-N 3.31Å; V269-Q271 PolarHBondContact O-N 3.25Å; Q271-L274 PolarHBondContact O-N 3.48Å; Q271-N275 VanDerWaalsContact O-CG 3.29Å; Q271-N275 PolarHBondContact O-N 2.88Å |
| 272 | E | 95.2 | Very high | 95 | Very high | 99 Ų | 99 | 93.2 Ų | 93.2 | 46% | 0.463 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.4 | -44.8 | 173.8 | -72.8 | -177.9 | 175 | 0 | 0 | 111.8 | T268 V269 L274 N275 Y276 | T268-E272 PolarHBondContact O-N 3.24Å; V269-E272 PolarHBondContact O-N 2.9Å; E272-L274 VanDerWaalsContact C-N 3.33Å; E272-L274 PolarHBondContact O-N 2.89Å; E272-N275 WeakPolarHBondContact O-CB 3.4Å; E272-N275 PolarHBondContact O-N 3.37Å; E272-N275 VanDerWaalsContact O-N 3.15Å; E272-Y276 HydrophobicContact CB-CE2 4.42Å; E272-Y276 WeakPolarHBondContact O-CD2 3.17Å; E272-Y276 PolarHBondContact O-N 2.95Å |
| 273 | V | 93.6 | Very high | 94.9 | Very high | 84 Ų | 84 | 91.7 Ų | 91.7 | 51% | 0.509 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -58.9 | -44.6 | 175.3 | 170.7 | 0 | 0 | 0 | 0 | 111 | V269 K270 N275 Y276 Q277 | V269-V273 HydrophobicContact CG1-CG2 4.44Å; V269-V273 VanDerWaalsContact O-CG2 3.31Å; V269-V273 WeakPolarHBondContact O-CG2 3.19Å; V269-V273 PolarHBondContact O-N 2.97Å; K270-V273 PolarHBondContact O-N 3.23Å; V273-N275 VanDerWaalsContact C-N 3.34Å; V273-N275 PolarHBondContact O-N 3.3Å; V273-Y276 PolarHBondContact O-N 3.43Å; V273-Q277 WeakPolarHBondContact O-CB 3.5Å; V273-Q277 PolarHBondContact O-N 3.45Å |
| 274 | L | 95.6 | Very high | 94.7 | Very high | 83 Ų | 83 | 92.4 Ų | 92.4 | 44% | 0.435 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -60.4 | -42.8 | 174.6 | -73.4 | 172.1 | 0 | 0 | 0 | 111.9 | K270 Q271 E272 Q277 Q278 | K270-L274 WeakPolarHBondContact O-CG 3.49Å; K270-L274 PolarHBondContact O-N 3.16Å; Q271-L274 PolarHBondContact O-N 3.48Å; E272-L274 VanDerWaalsContact C-N 3.33Å; E272-L274 PolarHBondContact O-N 2.89Å; L274-Q277 PolarHBondContact O-N 3.06Å; L274-Q278 WeakPolarHBondContact O-CG 3.43Å; L274-Q278 PolarHBondContact O-N 2.68Å |
| 275 | N | 95.3 | Very high | 94.6 | Very high | 68 Ų | 68 | 97.7 Ų | 97.7 | 36% | 0.364 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.8 | -42.3 | 176.2 | -73.5 | -18.1 | 0 | 0 | 0 | 111.8 | Q271 E272 V273 Q277 Q278 K279 | Q271-N275 VanDerWaalsContact O-CG 3.29Å; Q271-N275 PolarHBondContact O-N 2.88Å; E272-N275 WeakPolarHBondContact O-CB 3.4Å; E272-N275 PolarHBondContact O-N 3.37Å; E272-N275 VanDerWaalsContact O-N 3.15Å; V273-N275 VanDerWaalsContact C-N 3.34Å; V273-N275 PolarHBondContact O-N 3.3Å; N275-Q277 VanDerWaalsContact C-N 3.35Å; N275-Q278 PolarHBondContact O-N 3.17Å; N275-K279 WeakPolarHBondContact O-CG 2.97Å; N275-K279 PolarHBondContact O-N 2.83Å |
| 276 | Y | 94.8 | Very high | 94.4 | Very high | 151 Ų | 151 | 99.2 Ų | 99.2 | 59% | 0.592 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.6 | -39.3 | 174.9 | -77 | -61.5 | 0 | 0 | 0 | 112 | E272 V273 Q278 K279 L280 | E272-Y276 HydrophobicContact CB-CE2 4.42Å; E272-Y276 WeakPolarHBondContact O-CD2 3.17Å; E272-Y276 PolarHBondContact O-N 2.95Å; V273-Y276 PolarHBondContact O-N 3.43Å; Y276-Q278 PolarHBondContact O-N 3.01Å; Y276-K279 PolarHBondContact O-N 2.93Å; Y276-L280 WeakPolarHBondContact O-CB 3.45Å; Y276-L280 PolarHBondContact O-N 2.69Å |
| 277 | Q | 95.3 | Very high | 94.3 | Very high | 128 Ų | 128 | 99.7 Ų | 99.7 | 60% | 0.598 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -63.8 | -40.5 | 176 | -167.3 | 176.8 | 2 | 0 | 0 | 111.7 | V273 L274 N275 L280 G281 | V273-Q277 WeakPolarHBondContact O-CB 3.5Å; V273-Q277 PolarHBondContact O-N 3.45Å; L274-Q277 PolarHBondContact O-N 3.06Å; N275-Q277 VanDerWaalsContact C-N 3.35Å; Q277-L280 PolarHBondContact O-N 2.82Å; Q277-G281 PolarHBondContact O-N 2.81Å |
| 278 | Q | 94.6 | Very high | 94.1 | Very high | 134 Ų | 134 | 102 Ų | 102 | 63% | 0.626 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.5 | -44.3 | 173.5 | -72.3 | 178.8 | 1.5 | 0 | 0 | 112.3 | L274 N275 Y276 L280 G281 A282 | L274-Q278 WeakPolarHBondContact O-CG 3.43Å; L274-Q278 PolarHBondContact O-N 2.68Å; N275-Q278 PolarHBondContact O-N 3.17Å; Y276-Q278 PolarHBondContact O-N 3.01Å; Q278-L280 VanDerWaalsContact C-N 3.34Å; Q278-G281 PolarHBondContact O-N 2.95Å; Q278-A282 PolarHBondContact O-N 3.19Å |
| 279 | K | 94.6 | Very high | 94.1 | Very high | 143 Ų | 143 | 102.1 Ų | 102.1 | 62% | 0.622 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.2 | -42.7 | 175.5 | -75.2 | 178.8 | -179.4 | 179.3 | 0 | 111.6 | N275 Y276 A282 A283 | N275-K279 WeakPolarHBondContact O-CG 2.97Å; N275-K279 PolarHBondContact O-N 2.83Å; Y276-K279 PolarHBondContact O-N 2.93Å; K279-A282 WeakPolarHBondContact O-CB 3.24Å; K279-A282 PolarHBondContact O-N 3.03Å; K279-A283 PolarHBondContact O-N 3.34Å |
| 280 | L | 93 | Very high | 94 | Very high | 101 Ų | 101 | 104.2 Ų | 104.2 | 53% | 0.529 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.6 | -49.5 | 175.4 | -177.9 | 63.7 | 0 | 0 | 0 | 110.9 | Y276 Q277 Q278 A282 A283 E284 | Y276-L280 WeakPolarHBondContact O-CB 3.45Å; Y276-L280 PolarHBondContact O-N 2.69Å; Q277-L280 PolarHBondContact O-N 2.82Å; Q278-L280 VanDerWaalsContact C-N 3.34Å; L280-A282 PolarHBondContact O-N 3.41Å; L280-A283 PolarHBondContact O-N 3.25Å; L280-A283 VanDerWaalsContact O-N 3.1Å; L280-E284 WeakPolarHBondContact O-CG 3.48Å; L280-E284 PolarHBondContact O-N 2.94Å |
| 281 | G | 93.6 | Very high | 93.8 | Very high | 23 Ų | 23 | 105 Ų | 105 | 24% | 0.237 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -64.8 | -24.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q277 Q278 R285 | Q277-G281 PolarHBondContact O-N 2.81Å; Q278-G281 PolarHBondContact O-N 2.95Å; G281-R285 WeakPolarHBondContact O-CG 3.47Å; G281-R285 PolarHBondContact O-N 3.22Å; G281-R285 PolarHBondContact O-NE 3.49Å; G281-R285 VanDerWaalsContact O-NE 3.16Å |
| 282 | A | 93.2 | Very high | 93.7 | Very high | 44 Ų | 44 | 108.2 Ų | 108.2 | 36% | 0.364 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -72.3 | -47 | 169.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q278 K279 L280 E284 R285 E286 | Q278-A282 PolarHBondContact O-N 3.19Å; K279-A282 WeakPolarHBondContact O-CB 3.24Å; K279-A282 PolarHBondContact O-N 3.03Å; L280-A282 PolarHBondContact O-N 3.41Å; A282-E284 VanDerWaalsContact C-N 3.34Å; A282-E284 PolarHBondContact O-N 2.81Å; A282-R285 PolarHBondContact O-N 2.96Å; A282-E286 PolarHBondContact O-N 3.36Å |
| 283 | A | 92.2 | Very high | 93.6 | Very high | 52 Ų | 52 | 109.5 Ų | 109.5 | 43% | 0.43 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.3 | -38.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | K279 L280 E286 L287 | K279-A283 PolarHBondContact O-N 3.34Å; L280-A283 PolarHBondContact O-N 3.25Å; L280-A283 VanDerWaalsContact O-N 3.1Å; A283-E286 PolarHBondContact O-N 3.18Å; A283-L287 WeakPolarHBondContact O-CB 3.28Å; A283-L287 PolarHBondContact O-N 2.96Å |
| 284 | E | 94 | Very high | 93.5 | Very high | 114 Ų | 114 | 110.7 Ų | 110.7 | 53% | 0.533 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 175.2 | -74.3 | 176.8 | 162.6 | 0 | 0 | 112.2 | L280 A282 L287 Q288 | L280-E284 WeakPolarHBondContact O-CG 3.48Å; L280-E284 PolarHBondContact O-N 2.94Å; A282-E284 VanDerWaalsContact C-N 3.34Å; A282-E284 PolarHBondContact O-N 2.81Å; E284-L287 PolarHBondContact O-N 2.81Å; E284-Q288 WeakPolarHBondContact O-CB 3.11Å; E284-Q288 PolarHBondContact O-N 3.44Å |
| 285 | R | 92.9 | Very high | 93.3 | Very high | 177 Ų | 177 | 114.4 Ų | 114.4 | 67% | 0.668 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -65.2 | -39.5 | 174.9 | -76.7 | -176.4 | -73.6 | 157.8 | -4.8 | 112.1 | G281 A282 Q288 T289 | G281-R285 WeakPolarHBondContact O-CG 3.47Å; G281-R285 PolarHBondContact O-N 3.22Å; G281-R285 PolarHBondContact O-NE 3.49Å; G281-R285 VanDerWaalsContact O-NE 3.16Å; A282-R285 PolarHBondContact O-N 2.96Å; R285-Q288 PolarHBondContact O-N 2.92Å; R285-T289 PolarHBondContact O-N 3.41Å; R285-T289 PolarHBondContact O-OG1 3.05Å |
| 286 | E | 92.9 | Very high | 93.1 | Very high | 119 Ų | 119 | 113.3 Ų | 113.3 | 56% | 0.556 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.2 | -46.4 | 176 | -163.4 | 179.4 | 179.7 | 0 | 0 | 110.9 | A282 A283 Q288 T289 F290 | A282-E286 PolarHBondContact O-N 3.36Å; A283-E286 PolarHBondContact O-N 3.18Å; E286-Q288 VanDerWaalsContact C-N 3.29Å; E286-Q288 PolarHBondContact O-N 2.86Å; E286-T289 WeakPolarHBondContact O-CA 3.21Å; E286-T289 WeakPolarHBondContact O-CB 3.35Å; E286-T289 PolarHBondContact O-N 3.15Å; E286-T289 VanDerWaalsContact O-N 3.09Å; E286-F290 HydrophobicContact CG-CD2 4.02Å; E286-F290 HydrophobicContact CG-CE2 3.75Å; E286-F290 VanDerWaalsContact O-CD2 3.3Å; E286-F290 WeakPolarHBondContact O-CD2 3.45Å; E286-F290 PolarHBondContact O-N 2.95Å |
| 287 | L | 92.1 | Very high | 93 | Very high | 97 Ų | 97 | 110 Ų | 110 | 51% | 0.508 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -56.8 | -42.7 | 173.5 | -171.4 | 103.6 | 0 | 0 | 0 | 111.7 | A283 E284 T289 F290 R291 | A283-L287 WeakPolarHBondContact O-CB 3.28Å; A283-L287 PolarHBondContact O-N 2.96Å; E284-L287 PolarHBondContact O-N 2.81Å; L287-T289 VanDerWaalsContact C-N 3.31Å; L287-T289 PolarHBondContact O-N 3.33Å; L287-F290 PolarHBondContact O-N 2.91Å; L287-R291 WeakPolarHBondContact O-CG 3.3Å; L287-R291 PolarHBondContact O-N 2.95Å |
| 288 | Q | 93.4 | Very high | 92.8 | Very high | 142 Ų | 142 | 107.9 Ų | 107.9 | 66% | 0.664 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -65.1 | -36.8 | 177.7 | -169.7 | 149.1 | -11.2 | 0 | 0 | 112.2 | E284 R285 E286 R291 Y292 | E284-Q288 WeakPolarHBondContact O-CB 3.11Å; E284-Q288 PolarHBondContact O-N 3.44Å; R285-Q288 PolarHBondContact O-N 2.92Å; E286-Q288 VanDerWaalsContact C-N 3.29Å; E286-Q288 PolarHBondContact O-N 2.86Å; Q288-R291 PolarHBondContact O-N 2.74Å; Q288-Y292 PolarHBondContact O-N 3.15Å |
| 289 | T | 93.3 | Very high | 92.7 | Very high | 75 Ų | 75 | 106.4 Ų | 106.4 | 46% | 0.46 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.9 | -43.9 | 173.5 | -53.2 | 0 | 0 | 0 | 0 | 111.2 | R285 E286 L287 R291 Y292 K293 | R285-T289 PolarHBondContact O-N 3.41Å; R285-T289 PolarHBondContact O-OG1 3.05Å; E286-T289 WeakPolarHBondContact O-CA 3.21Å; E286-T289 WeakPolarHBondContact O-CB 3.35Å; E286-T289 PolarHBondContact O-N 3.15Å; E286-T289 VanDerWaalsContact O-N 3.09Å; L287-T289 VanDerWaalsContact C-N 3.31Å; L287-T289 PolarHBondContact O-N 3.33Å; T289-R291 VanDerWaalsContact C-N 3.35Å; T289-R291 PolarHBondContact O-N 2.62Å; T289-Y292 PolarHBondContact O-N 2.81Å; T289-K293 PolarHBondContact O-N 2.72Å |
| 290 | F | 92.4 | Very high | 92.6 | Very high | 122 Ų | 122 | 104.7 Ų | 104.7 | 54% | 0.535 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60 | -42.9 | 173.9 | -83.6 | -64.8 | 0 | 0 | 0 | 112.1 | E286 L287 Y292 K293 Q294 | E286-F290 HydrophobicContact CG-CD2 4.02Å; E286-F290 HydrophobicContact CG-CE2 3.75Å; E286-F290 VanDerWaalsContact O-CD2 3.3Å; E286-F290 WeakPolarHBondContact O-CD2 3.45Å; E286-F290 PolarHBondContact O-N 2.95Å; L287-F290 PolarHBondContact O-N 2.91Å; F290-Y292 VanDerWaalsContact C-N 3.3Å; F290-Y292 PolarHBondContact O-N 3.1Å; F290-K293 PolarHBondContact O-N 3.22Å; F290-Q294 WeakPolarHBondContact O-CB 3.5Å; F290-Q294 PolarHBondContact O-N 2.91Å |
| 291 | R | 92.4 | Very high | 92.5 | Very high | 148 Ų | 148 | 104.8 Ų | 104.8 | 56% | 0.558 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.7 | -35.3 | 175.1 | -76.4 | -179.4 | 173.6 | 178.9 | -0.2 | 113.1 | L287 Q288 T289 R295 | L287-R291 WeakPolarHBondContact O-CG 3.3Å; L287-R291 PolarHBondContact O-N 2.95Å; Q288-R291 PolarHBondContact O-N 2.74Å; T289-R291 VanDerWaalsContact C-N 3.35Å; T289-R291 PolarHBondContact O-N 2.62Å; R291-R295 PolarHBondContact O-N 3.44Å; R291-R295 VanDerWaalsContact O-N 3.15Å |
| 292 | Y | 93 | Very high | 92.4 | Very high | 169 Ų | 169 | 111 Ų | 111 | 66% | 0.663 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -68.1 | -46.6 | 174.7 | -174.6 | -92.7 | 0 | 0 | 0 | 111.3 | Q288 T289 F290 Q294 R295 A296 | Q288-Y292 PolarHBondContact O-N 3.15Å; T289-Y292 PolarHBondContact O-N 2.81Å; F290-Y292 VanDerWaalsContact C-N 3.3Å; F290-Y292 PolarHBondContact O-N 3.1Å; Y292-Q294 PolarHBondContact O-N 2.92Å; Y292-R295 PolarHBondContact O-N 3.17Å; Y292-A296 PolarHBondContact O-N 3.37Å |
| 293 | K | 92.8 | Very high | 92.3 | Very high | 125 Ų | 125 | 113.6 Ų | 113.6 | 54% | 0.543 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.6 | -43.5 | 175.7 | -71.2 | -179.5 | 179.8 | 178.9 | 0 | 112.1 | T289 F290 R295 A296 V297 | T289-K293 PolarHBondContact O-N 2.72Å; F290-K293 PolarHBondContact O-N 3.22Å; K293-R295 VanDerWaalsContact C-N 3.33Å; K293-R295 PolarHBondContact O-N 3.36Å; K293-A296 WeakPolarHBondContact O-CB 3.31Å; K293-A296 PolarHBondContact O-N 2.93Å; K293-V297 WeakPolarHBondContact O-CG2 3.37Å; K293-V297 PolarHBondContact O-N 3.01Å |
| 294 | Q | 91.2 | Very high | 92.3 | Very high | 109 Ų | 109 | 114 Ų | 114 | 51% | 0.509 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -56.6 | -48.1 | 175.4 | -179.2 | -174.6 | -6.5 | 0 | 0 | 110.9 | F290 Y292 A296 V297 E298 | F290-Q294 WeakPolarHBondContact O-CB 3.5Å; F290-Q294 PolarHBondContact O-N 2.91Å; Y292-Q294 PolarHBondContact O-N 2.92Å; Q294-A296 VanDerWaalsContact C-N 3.32Å; Q294-A296 PolarHBondContact O-N 3.3Å; Q294-V297 PolarHBondContact O-N 3.47Å; Q294-E298 HydrophobicContact CG-CG 4.47Å; Q294-E298 PolarHBondContact NE2-OE1 3.39Å; Q294-E298 WeakPolarHBondContact O-CG 3.47Å; Q294-E298 PolarHBondContact O-N 2.68Å |
| 295 | R | 91.6 | Very high | 92.1 | Very high | 162 Ų | 162 | 111.9 Ų | 111.9 | 61% | 0.611 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -59.4 | -41.2 | 176.9 | -97.6 | -175.1 | -87.2 | 172.1 | -11.1 | 112.8 | R291 Y292 K293 E298 E299 | R291-R295 PolarHBondContact O-N 3.44Å; R291-R295 VanDerWaalsContact O-N 3.15Å; Y292-R295 PolarHBondContact O-N 3.17Å; K293-R295 VanDerWaalsContact C-N 3.33Å; K293-R295 PolarHBondContact O-N 3.36Å; R295-E298 PolarHBondContact O-N 2.86Å; R295-E299 PolarHBondContact O-N 2.93Å |
| 296 | A | 91.3 | Very high | 92.1 | Very high | 45 Ų | 45 | 106.6 Ų | 106.6 | 37% | 0.372 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.6 | -46.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y292 K293 Q294 E298 E299 D300 | Y292-A296 PolarHBondContact O-N 3.37Å; K293-A296 WeakPolarHBondContact O-CB 3.31Å; K293-A296 PolarHBondContact O-N 2.93Å; Q294-A296 VanDerWaalsContact C-N 3.32Å; Q294-A296 PolarHBondContact O-N 3.3Å; A296-E298 PolarHBondContact O-N 2.79Å; A296-E299 PolarHBondContact O-N 3.45Å; A296-D300 PolarHBondContact O-N 2.91Å |
| 297 | V | 93.7 | Very high | 92 | Very high | 82 Ų | 82 | 105.2 Ų | 105.2 | 50% | 0.497 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.2 | -40.8 | 177.5 | 173.3 | 0 | 0 | 0 | 0 | 112 | K293 Q294 E299 D300 L301 | K293-V297 WeakPolarHBondContact O-CG2 3.37Å; K293-V297 PolarHBondContact O-N 3.01Å; Q294-V297 PolarHBondContact O-N 3.47Å; V297-E299 VanDerWaalsContact C-N 3.28Å; V297-E299 PolarHBondContact O-N 2.93Å; V297-D300 PolarHBondContact O-N 2.85Å; V297-L301 HydrophobicContact CG1-CD1 4.06Å; V297-L301 WeakPolarHBondContact O-CB 3.29Å; V297-L301 PolarHBondContact O-N 3.45Å |
| 298 | E | 91.5 | Very high | 91.9 | Very high | 83 Ų | 83 | 105.7 Ų | 105.7 | 39% | 0.388 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.4 | -37.3 | 175.3 | -76.7 | 174.4 | -174.3 | 0 | 0 | 112 | Q294 R295 A296 R302 | Q294-E298 HydrophobicContact CG-CG 4.47Å; Q294-E298 PolarHBondContact NE2-OE1 3.39Å; Q294-E298 WeakPolarHBondContact O-CG 3.47Å; Q294-E298 PolarHBondContact O-N 2.68Å; R295-E298 PolarHBondContact O-N 2.86Å; A296-E298 PolarHBondContact O-N 2.79Å; E298-R302 WeakPolarHBondContact O-CG 3.28Å; E298-R302 PolarHBondContact O-N 3.08Å |
| 299 | E | 91.8 | Very high | 91.8 | Very high | 102 Ų | 102 | 105.5 Ų | 105.5 | 48% | 0.477 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -73.1 | -41.5 | 177.7 | -162.4 | 59.9 | -156.1 | 0 | 0 | 112 | R295 A296 V297 L301 R302 Q303 | R295-E299 PolarHBondContact O-N 2.93Å; A296-E299 PolarHBondContact O-N 3.45Å; V297-E299 VanDerWaalsContact C-N 3.28Å; V297-E299 PolarHBondContact O-N 2.93Å; E299-L301 VanDerWaalsContact C-N 3.28Å; E299-L301 PolarHBondContact O-N 3.3Å; E299-R302 WeakPolarHBondContact O-CB 3.3Å; E299-R302 PolarHBondContact O-N 3.45Å; E299-R302 VanDerWaalsContact O-N 3.14Å; E299-R302 IonicContact OE2-NH1 3Å; E299-R302 PolarHBondContact OE2-NH1 3.47Å; E299-R302 VanDerWaalsContact OE2-NH1 3.07Å; E299-Q303 WeakPolarHBondContact O-CB 3.49Å; E299-Q303 PolarHBondContact O-N 2.78Å |
| 300 | D | 91.8 | Very high | 91.6 | Very high | 107 Ų | 107 | 107.8 Ų | 107.8 | 57% | 0.572 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -59.3 | -40.3 | 172.7 | -70.6 | -19.2 | 0 | 0 | 0 | 111.5 | A296 V297 Q303 S304 | A296-D300 PolarHBondContact O-N 2.91Å; V297-D300 PolarHBondContact O-N 2.85Å; D300-Q303 PolarHBondContact O-N 2.74Å; D300-S304 WeakPolarHBondContact O-CB 3.38Å; D300-S304 PolarHBondContact O-N 2.86Å; D300-S304 PolarHBondContact O-OG 3.06Å |
| 301 | L | 91.2 | Very high | 91.4 | Very high | 104 Ų | 104 | 107 Ų | 107 | 55% | 0.545 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.6 | -44.3 | 173.7 | -87.2 | 162 | 0 | 0 | 0 | 111.9 | V297 E299 Q303 S304 V305 | V297-L301 HydrophobicContact CG1-CD1 4.06Å; V297-L301 WeakPolarHBondContact O-CB 3.29Å; V297-L301 PolarHBondContact O-N 3.45Å; E299-L301 VanDerWaalsContact C-N 3.28Å; E299-L301 PolarHBondContact O-N 3.3Å; L301-Q303 VanDerWaalsContact C-N 3.34Å; L301-Q303 PolarHBondContact O-N 2.76Å; L301-S304 PolarHBondContact O-N 3.31Å; L301-V305 WeakPolarHBondContact O-CB 3.44Å; L301-V305 VanDerWaalsContact O-CG2 3.28Å; L301-V305 WeakPolarHBondContact O-CG2 3.27Å; L301-V305 PolarHBondContact O-N 3.42Å |
| 302 | R | 92.3 | Very high | 91.1 | Very high | 152 Ų | 152 | 104.7 Ų | 104.7 | 57% | 0.574 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.3 | -44.1 | 175.4 | -82 | 177.1 | -179.7 | 163.4 | 0.9 | 111.9 | E298 E299 V305 T306 | E298-R302 WeakPolarHBondContact O-CG 3.28Å; E298-R302 PolarHBondContact O-N 3.08Å; E299-R302 WeakPolarHBondContact O-CB 3.3Å; E299-R302 PolarHBondContact O-N 3.45Å; E299-R302 VanDerWaalsContact O-N 3.14Å; E299-R302 IonicContact OE2-NH1 3Å; E299-R302 PolarHBondContact OE2-NH1 3.47Å; E299-R302 VanDerWaalsContact OE2-NH1 3.07Å; R302-V305 PolarHBondContact O-N 2.88Å; R302-T306 WeakPolarHBondContact O-CB 3.19Å; R302-T306 PolarHBondContact O-N 3.42Å; R302-T306 PolarHBondContact O-OG1 3.25Å |
| 303 | Q | 91.4 | Very high | 90.9 | Very high | 100 Ų | 100 | 101.2 Ų | 101.2 | 47% | 0.467 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.1 | -49.5 | 177.3 | -177.3 | 58.9 | 24.4 | 0 | 0 | 110.5 | E299 D300 L301 V305 T306 E307 | E299-Q303 WeakPolarHBondContact O-CB 3.49Å; E299-Q303 PolarHBondContact O-N 2.78Å; D300-Q303 PolarHBondContact O-N 2.74Å; L301-Q303 VanDerWaalsContact C-N 3.34Å; L301-Q303 PolarHBondContact O-N 2.76Å; Q303-V305 VanDerWaalsContact C-N 3.34Å; Q303-V305 PolarHBondContact O-N 3.13Å; Q303-T306 WeakPolarHBondContact O-CA 3.18Å; Q303-T306 WeakPolarHBondContact O-CB 3.4Å; Q303-T306 PolarHBondContact O-N 2.93Å; Q303-E307 PolarHBondContact NE2-OE1 3.47Å; Q303-E307 PolarHBondContact O-N 2.95Å |
| 304 | S | 91.1 | Very high | 90.7 | Very high | 59 Ų | 59 | 100.7 Ų | 100.7 | 41% | 0.413 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -57.5 | -43.3 | 176.1 | -61.2 | 0 | 0 | 0 | 0 | 112.6 | D300 L301 T306 E307 L308 | D300-S304 WeakPolarHBondContact O-CB 3.38Å; D300-S304 PolarHBondContact O-N 2.86Å; D300-S304 PolarHBondContact O-OG 3.06Å; L301-S304 PolarHBondContact O-N 3.31Å; S304-T306 VanDerWaalsContact C-N 3.3Å; S304-T306 PolarHBondContact O-N 2.91Å; S304-E307 PolarHBondContact O-N 3.36Å; S304-L308 WeakPolarHBondContact O-CB 3.43Å; S304-L308 WeakPolarHBondContact O-CG 3.35Å; S304-L308 PolarHBondContact O-N 3.38Å |
| 305 | V | 90.8 | Very high | 90.3 | Very high | 70 Ų | 70 | 99.5 Ų | 99.5 | 42% | 0.424 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.8 | -37.1 | 175.5 | 167 | 0 | 0 | 0 | 0 | 111.4 | L301 R302 Q303 K309 | L301-V305 WeakPolarHBondContact O-CB 3.44Å; L301-V305 VanDerWaalsContact O-CG2 3.28Å; L301-V305 WeakPolarHBondContact O-CG2 3.27Å; L301-V305 PolarHBondContact O-N 3.42Å; R302-V305 PolarHBondContact O-N 2.88Å; Q303-V305 VanDerWaalsContact C-N 3.34Å; Q303-V305 PolarHBondContact O-N 3.13Å; V305-K309 HydrophobicContact CG1-CD 4.38Å; V305-K309 WeakPolarHBondContact O-CB 3.29Å; V305-K309 WeakPolarHBondContact O-CG 3.4Å; V305-K309 PolarHBondContact O-N 2.86Å |
| 306 | T | 91.5 | Very high | 90.1 | Very high | 67 Ų | 67 | 98.3 Ų | 98.3 | 41% | 0.411 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.7 | -42.7 | 178.2 | -54.9 | 0 | 0 | 0 | 0 | 111 | R302 Q303 S304 K309 Q310 | R302-T306 WeakPolarHBondContact O-CB 3.19Å; R302-T306 PolarHBondContact O-N 3.42Å; R302-T306 PolarHBondContact O-OG1 3.25Å; Q303-T306 WeakPolarHBondContact O-CA 3.18Å; Q303-T306 WeakPolarHBondContact O-CB 3.4Å; Q303-T306 PolarHBondContact O-N 2.93Å; S304-T306 VanDerWaalsContact C-N 3.3Å; S304-T306 PolarHBondContact O-N 2.91Å; T306-K309 WeakPolarHBondContact O-CB 3.39Å; T306-K309 PolarHBondContact O-N 2.95Å; T306-Q310 PolarHBondContact O-N 3.23Å |
| 307 | E | 90.7 | Very high | 89.8 | Confident | 90 Ų | 90 | 99.1 Ų | 99.1 | 42% | 0.421 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.6 | -46.9 | 173.4 | -72.6 | 172.2 | -165.8 | 0 | 0 | 111.7 | Q303 S304 K309 Q310 Q311 | Q303-E307 PolarHBondContact NE2-OE1 3.47Å; Q303-E307 PolarHBondContact O-N 2.95Å; S304-E307 PolarHBondContact O-N 3.36Å; E307-K309 VanDerWaalsContact C-N 3.3Å; E307-K309 PolarHBondContact O-N 3.32Å; E307-Q310 WeakPolarHBondContact O-CB 3.47Å; E307-Q310 PolarHBondContact O-N 3.02Å; E307-Q310 VanDerWaalsContact O-N 3.11Å; E307-Q311 WeakPolarHBondContact O-CG 3.45Å; E307-Q311 PolarHBondContact O-N 2.9Å |
| 308 | L | 91.5 | Very high | 89.4 | Confident | 106 Ų | 106 | 101.4 Ų | 101.4 | 56% | 0.555 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -60.4 | -38.9 | 175.5 | -75.3 | 171.3 | 0 | 0 | 0 | 112.2 | S304 Q311 L312 | S304-L308 WeakPolarHBondContact O-CB 3.43Å; S304-L308 WeakPolarHBondContact O-CG 3.35Å; S304-L308 PolarHBondContact O-N 3.38Å; L308-Q311 PolarHBondContact O-N 3.12Å; L308-L312 WeakPolarHBondContact O-CB 3.46Å; L308-L312 PolarHBondContact O-N 3.46Å |
| 309 | K | 90.6 | Very high | 89.1 | Confident | 139 Ų | 139 | 104.6 Ų | 104.6 | 60% | 0.604 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.1 | -42.3 | 173.7 | -79.5 | 177 | 178.7 | 178.8 | 0 | 111.7 | V305 T306 E307 L312 V313 | V305-K309 HydrophobicContact CG1-CD 4.38Å; V305-K309 WeakPolarHBondContact O-CB 3.29Å; V305-K309 WeakPolarHBondContact O-CG 3.4Å; V305-K309 PolarHBondContact O-N 2.86Å; T306-K309 WeakPolarHBondContact O-CB 3.39Å; T306-K309 PolarHBondContact O-N 2.95Å; E307-K309 VanDerWaalsContact C-N 3.3Å; E307-K309 PolarHBondContact O-N 3.32Å; K309-L312 PolarHBondContact O-N 2.8Å; K309-V313 WeakPolarHBondContact O-CG2 3.41Å; K309-V313 PolarHBondContact O-N 3.49Å; K309-V313 VanDerWaalsContact O-N 3.07Å |
| 310 | Q | 88.8 | Confident | 88.8 | Confident | 122 Ų | 122 | 103.7 Ų | 103.7 | 57% | 0.57 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.7 | -45.6 | 175.4 | -78.8 | -178.1 | -9.7 | 0 | 0 | 111.8 | T306 E307 L312 V313 Q314 | T306-Q310 PolarHBondContact O-N 3.23Å; E307-Q310 WeakPolarHBondContact O-CB 3.47Å; E307-Q310 PolarHBondContact O-N 3.02Å; E307-Q310 VanDerWaalsContact O-N 3.11Å; Q310-L312 VanDerWaalsContact C-N 3.3Å; Q310-L312 PolarHBondContact O-N 3.22Å; Q310-V313 PolarHBondContact O-N 3.35Å; Q310-V313 VanDerWaalsContact O-N 3.15Å; Q310-Q314 PolarHBondContact O-N 2.97Å |
| 311 | Q | 87.7 | Confident | 88.5 | Confident | 107 Ų | 107 | 104.4 Ų | 104.4 | 50% | 0.5 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -58.6 | -42.2 | 175.1 | -71.7 | 178.4 | 0.7 | 0 | 0 | 111.5 | E307 L308 V313 Q314 C315 | E307-Q311 WeakPolarHBondContact O-CG 3.45Å; E307-Q311 PolarHBondContact O-N 2.9Å; L308-Q311 PolarHBondContact O-N 3.12Å; Q311-V313 VanDerWaalsContact C-N 3.33Å; Q311-V313 PolarHBondContact O-N 3.19Å; Q311-Q314 PolarHBondContact O-N 2.87Å; Q311-C315 PolarHBondContact O-N 3.25Å |
| 312 | L | 87.5 | Confident | 88 | Confident | 98 Ų | 98 | 105.5 Ų | 105.5 | 51% | 0.513 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.1 | -41.1 | 176 | -177.9 | 66.4 | 0 | 0 | 0 | 112.1 | L308 K309 Q310 C315 K316 | L308-L312 WeakPolarHBondContact O-CB 3.46Å; L308-L312 PolarHBondContact O-N 3.46Å; K309-L312 PolarHBondContact O-N 2.8Å; Q310-L312 VanDerWaalsContact C-N 3.3Å; Q310-L312 PolarHBondContact O-N 3.22Å; L312-C315 PolarHBondContact O-N 3.5Å; L312-K316 WeakPolarHBondContact O-CB 3.44Å; L312-K316 WeakPolarHBondContact O-CG 3.37Å; L312-K316 PolarHBondContact O-N 2.83Å |
| 313 | V | 89 | Confident | 87.6 | Confident | 97 Ų | 97 | 103 Ų | 103 | 59% | 0.588 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.2 | -43.6 | 175.9 | 171.9 | 0 | 0 | 0 | 0 | 110.8 | K309 Q310 Q311 K316 S317 | K309-V313 WeakPolarHBondContact O-CG2 3.41Å; K309-V313 PolarHBondContact O-N 3.49Å; K309-V313 VanDerWaalsContact O-N 3.07Å; Q310-V313 PolarHBondContact O-N 3.35Å; Q310-V313 VanDerWaalsContact O-N 3.15Å; Q311-V313 VanDerWaalsContact C-N 3.33Å; Q311-V313 PolarHBondContact O-N 3.19Å; V313-K316 PolarHBondContact O-N 2.9Å; V313-S317 PolarHBondContact O-N 3.35Å |
| 314 | Q | 87.3 | Confident | 87.4 | Confident | 113 Ų | 113 | 101.7 Ų | 101.7 | 53% | 0.528 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.1 | -46.7 | 175.7 | -71 | 177.6 | -0.8 | 0 | 0 | 112 | Q310 Q311 K316 S317 F318 | Q310-Q314 PolarHBondContact O-N 2.97Å; Q311-Q314 PolarHBondContact O-N 2.87Å; Q314-K316 VanDerWaalsContact C-N 3.3Å; Q314-K316 PolarHBondContact O-N 2.85Å; Q314-S317 PolarHBondContact O-N 2.6Å; Q314-S317 VanDerWaalsContact O-N 3.15Å; Q314-S317 PolarHBondContact O-OG 3.35Å; Q314-F318 VanDerWaalsContact O-CD2 3.24Å; Q314-F318 WeakPolarHBondContact O-CD2 3.05Å; Q314-F318 PolarHBondContact O-N 3.04Å |
| 315 | C | 83.8 | Confident | 87.2 | Confident | 84 Ų | 84 | 104.7 Ų | 104.7 | 57% | 0.568 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -59.4 | -40.7 | 174.9 | -81.5 | 0 | 0 | 0 | 0 | 112 | Q311 L312 F318 Y319 | Q311-C315 PolarHBondContact O-N 3.25Å; L312-C315 PolarHBondContact O-N 3.5Å; C315-F318 PolarHBondContact O-N 3.29Å; C315-Y319 WeakPolarHBondContact O-CB 3.35Å; C315-Y319 PolarHBondContact O-N 3.39Å |
| 316 | K | 85.8 | Confident | 86.9 | Confident | 138 Ų | 138 | 105.6 Ų | 105.6 | 60% | 0.6 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.8 | -41.9 | 174.6 | -79.4 | -179 | 178.5 | -177.7 | 0 | 112.1 | L312 V313 Q314 Q320 | L312-K316 WeakPolarHBondContact O-CB 3.44Å; L312-K316 WeakPolarHBondContact O-CG 3.37Å; L312-K316 PolarHBondContact O-N 2.83Å; V313-K316 PolarHBondContact O-N 2.9Å; Q314-K316 VanDerWaalsContact C-N 3.3Å; Q314-K316 PolarHBondContact O-N 2.85Å; K316-Q320 WeakPolarHBondContact O-CB 3.43Å; K316-Q320 PolarHBondContact O-N 3.35Å |
| 317 | S | 85.3 | Confident | 86.6 | Confident | 61 Ų | 61 | 105.4 Ų | 105.4 | 43% | 0.427 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.9 | -39.7 | 176.6 | 61.3 | 0 | 0 | 0 | 0 | 112.5 | V313 Q314 Q320 Q321 | V313-S317 PolarHBondContact O-N 3.35Å; Q314-S317 PolarHBondContact O-N 2.6Å; Q314-S317 VanDerWaalsContact O-N 3.15Å; Q314-S317 PolarHBondContact O-OG 3.35Å; S317-Q320 PolarHBondContact O-N 2.73Å; S317-Q321 PolarHBondContact O-N 3Å |
| 318 | F | 86 | Confident | 86.4 | Confident | 131 Ų | 131 | 103.9 Ų | 103.9 | 58% | 0.575 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.2 | -47.6 | 175 | -84.5 | -64.1 | 0 | 0 | 0 | 111.8 | Q314 C315 Q320 Q321 E322 | Q314-F318 VanDerWaalsContact O-CD2 3.24Å; Q314-F318 WeakPolarHBondContact O-CD2 3.05Å; Q314-F318 PolarHBondContact O-N 3.04Å; C315-F318 PolarHBondContact O-N 3.29Å; F318-Q320 VanDerWaalsContact C-N 3.3Å; F318-Q320 PolarHBondContact O-N 3.48Å; F318-Q321 PolarHBondContact O-N 3.43Å; F318-E322 WeakPolarHBondContact O-CB 3.45Å; F318-E322 PolarHBondContact O-N 2.86Å |
| 319 | Y | 85.7 | Confident | 86.1 | Confident | 150 Ų | 150 | 103.8 Ų | 103.8 | 59% | 0.588 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -58.5 | -42.7 | 176 | 177.1 | -98 | 0 | 0 | 0 | 111.8 | C315 E322 K323 | C315-Y319 WeakPolarHBondContact O-CB 3.35Å; C315-Y319 PolarHBondContact O-N 3.39Å; Y319-E322 PolarHBondContact O-N 2.89Å; Y319-K323 HydrophobicContact CE1-CD 4.35Å; Y319-K323 VanDerWaalsContact O-CB 3.3Å; Y319-K323 WeakPolarHBondContact O-CB 3.36Å; Y319-K323 PolarHBondContact O-N 3.42Å |
| 320 | Q | 85.1 | Confident | 85.8 | Confident | 82 Ų | 82 | 102.2 Ų | 102.2 | 38% | 0.383 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.2 | -43.4 | 178.2 | -173.2 | 57.4 | 38.8 | 0 | 0 | 111.7 | K316 S317 F318 E322 K323 D324 | K316-Q320 WeakPolarHBondContact O-CB 3.43Å; K316-Q320 PolarHBondContact O-N 3.35Å; S317-Q320 PolarHBondContact O-N 2.73Å; F318-Q320 VanDerWaalsContact C-N 3.3Å; F318-Q320 PolarHBondContact O-N 3.48Å; Q320-E322 PolarHBondContact O-N 2.85Å; Q320-K323 PolarHBondContact O-N 3.36Å; Q320-D324 PolarHBondContact NE2-OD1 3.11Å; Q320-D324 VanDerWaalsContact NE2-OD1 3.12Å; Q320-D324 PolarHBondContact NE2-OD2 3.43Å; Q320-D324 VanDerWaalsContact NE2-OD2 3.14Å; Q320-D324 WeakPolarHBondContact O-CB 3.43Å; Q320-D324 VanDerWaalsContact O-CG 3.24Å; Q320-D324 PolarHBondContact O-N 2.86Å |
| 321 | Q | 85.4 | Confident | 85.6 | Confident | 123 Ų | 123 | 103.2 Ų | 103.2 | 58% | 0.575 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -59.3 | -44.4 | 173.5 | -82 | -177.3 | -12.2 | 0 | 0 | 112.4 | S317 F318 D324 M325 | S317-Q321 PolarHBondContact O-N 3Å; F318-Q321 PolarHBondContact O-N 3.43Å; Q321-D324 PolarHBondContact O-N 3.44Å; Q321-M325 PolarHBondContact O-N 3.03Å |
| 322 | E | 81.6 | Confident | 85.3 | Confident | 127 Ų | 127 | 106.5 Ų | 106.5 | 59% | 0.593 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.6 | -43.4 | -179.9 | -160.5 | -179.3 | -159.2 | 0 | 0 | 111.2 | F318 Y319 Q320 D324 M325 E326 | F318-E322 WeakPolarHBondContact O-CB 3.45Å; F318-E322 PolarHBondContact O-N 2.86Å; Y319-E322 PolarHBondContact O-N 2.89Å; Q320-E322 PolarHBondContact O-N 2.85Å; E322-D324 VanDerWaalsContact C-N 3.35Å; E322-D324 PolarHBondContact O-N 3.17Å; E322-M325 PolarHBondContact O-N 2.78Å; E322-E326 PolarHBondContact O-N 3.02Å |
| 323 | K | 83.9 | Confident | 85.2 | Confident | 99 Ų | 99 | 106.7 Ų | 106.7 | 43% | 0.43 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -58.1 | -44.7 | 172.7 | -176.4 | -177.5 | 176.5 | -176.7 | 0 | 111.9 | Y319 Q320 E326 I327 | Y319-K323 HydrophobicContact CE1-CD 4.35Å; Y319-K323 VanDerWaalsContact O-CB 3.3Å; Y319-K323 WeakPolarHBondContact O-CB 3.36Å; Y319-K323 PolarHBondContact O-N 3.42Å; Q320-K323 PolarHBondContact O-N 3.36Å; K323-E326 PolarHBondContact O-N 3.38Å; K323-I327 HydrophobicContact CG-CD1 4.01Å; K323-I327 WeakPolarHBondContact O-CB 3.27Å; K323-I327 VanDerWaalsContact O-CG1 3.27Å; K323-I327 WeakPolarHBondContact O-CG1 3.46Å; K323-I327 PolarHBondContact O-N 3.3Å |
| 324 | D | 86.8 | Confident | 85 | Confident | 73 Ų | 73 | 106.7 Ų | 106.7 | 39% | 0.39 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -68.8 | -35.2 | 180 | -70.4 | -26.7 | 0 | 0 | 0 | 112.3 | Q320 Q321 E322 S328 | Q320-D324 PolarHBondContact NE2-OD1 3.11Å; Q320-D324 VanDerWaalsContact NE2-OD1 3.12Å; Q320-D324 PolarHBondContact NE2-OD2 3.43Å; Q320-D324 VanDerWaalsContact NE2-OD2 3.14Å; Q320-D324 WeakPolarHBondContact O-CB 3.43Å; Q320-D324 VanDerWaalsContact O-CG 3.24Å; Q320-D324 PolarHBondContact O-N 2.86Å; Q321-D324 PolarHBondContact O-N 3.44Å; E322-D324 VanDerWaalsContact C-N 3.35Å; E322-D324 PolarHBondContact O-N 3.17Å; D324-S328 VanDerWaalsContact O-CB 3.31Å; D324-S328 WeakPolarHBondContact O-CB 3.49Å; D324-S328 PolarHBondContact O-N 2.94Å; D324-S328 PolarHBondContact O-OG 2.87Å |
| 325 | M | 86.7 | Confident | 84.8 | Confident | 121 Ų | 121 | 107 Ų | 107 | 60% | 0.596 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.5 | -44.2 | 170.3 | -81.2 | -149.7 | -61.4 | 0 | 0 | 112 | Q321 E322 S328 K329 | Q321-M325 PolarHBondContact O-N 3.03Å; E322-M325 PolarHBondContact O-N 2.78Å; M325-S328 WeakPolarHBondContact O-CB 3.28Å; M325-S328 PolarHBondContact O-N 3.29Å; M325-K329 PolarHBondContact O-N 2.84Å |
| 326 | E | 83.9 | Confident | 84.7 | Confident | 90 Ų | 90 | 105.3 Ų | 105.3 | 42% | 0.421 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -70.2 | -39.9 | -178.7 | -153.9 | 57.1 | -145 | 0 | 0 | 111.4 | E322 K323 S328 K329 L330 | E322-E326 PolarHBondContact O-N 3.02Å; K323-E326 PolarHBondContact O-N 3.38Å; E326-S328 VanDerWaalsContact C-N 3.27Å; E326-S328 PolarHBondContact O-N 2.93Å; E326-K329 WeakPolarHBondContact O-CB 3.4Å; E326-K329 PolarHBondContact O-N 3.41Å; E326-K329 WeakPolarHBondContact OE2-CD 3.35Å; E326-K329 IonicContact OE2-NZ 2.73Å; E326-K329 PolarHBondContact OE2-NZ 2.89Å; E326-L330 WeakPolarHBondContact O-CG 3.49Å; E326-L330 PolarHBondContact O-N 3.45Å |
| 327 | I | 85.1 | Confident | 84.4 | Confident | 62 Ų | 62 | 103.6 Ų | 103.6 | 32% | 0.318 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -57.5 | -42.5 | 169.1 | -70.6 | 168.1 | 0 | 0 | 0 | 110.6 | K323 L330 K331 | K323-I327 HydrophobicContact CG-CD1 4.01Å; K323-I327 WeakPolarHBondContact O-CB 3.27Å; K323-I327 VanDerWaalsContact O-CG1 3.27Å; K323-I327 WeakPolarHBondContact O-CG1 3.46Å; K323-I327 PolarHBondContact O-N 3.3Å; I327-L330 PolarHBondContact O-N 3.42Å; I327-K331 HydrophobicContact CG2-CD 4.1Å; I327-K331 HydrophobicContact CG2-CG 4.37Å; I327-K331 WeakPolarHBondContact O-CB 3.43Å; I327-K331 WeakPolarHBondContact O-CG 3.49Å; I327-K331 PolarHBondContact O-N 3.4Å |
| 328 | S | 87 | Confident | 84.2 | Confident | 59 Ų | 59 | 104.6 Ų | 104.6 | 41% | 0.413 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.8 | -35.4 | 179.4 | -63.5 | 0 | 0 | 0 | 0 | 112.8 | D324 M325 E326 R332 | D324-S328 VanDerWaalsContact O-CB 3.31Å; D324-S328 WeakPolarHBondContact O-CB 3.49Å; D324-S328 PolarHBondContact O-N 2.94Å; D324-S328 PolarHBondContact O-OG 2.87Å; M325-S328 WeakPolarHBondContact O-CB 3.28Å; M325-S328 PolarHBondContact O-N 3.29Å; E326-S328 VanDerWaalsContact C-N 3.27Å; E326-S328 PolarHBondContact O-N 2.93Å; S328-R332 WeakPolarHBondContact O-CG 3.49Å; S328-R332 PolarHBondContact O-N 3.41Å; S328-R332 VanDerWaalsContact O-N 3.16Å; S328-R332 PolarHBondContact O-NE 2.98Å |
| 329 | K | 85.9 | Confident | 83.9 | Confident | 103 Ų | 103 | 102.8 Ų | 102.8 | 45% | 0.448 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.8 | -50.1 | 169.7 | -81.9 | 171.8 | 178.9 | 168.4 | 0 | 111.1 | M325 E326 K331 R332 L333 | M325-K329 PolarHBondContact O-N 2.84Å; E326-K329 WeakPolarHBondContact O-CB 3.4Å; E326-K329 PolarHBondContact O-N 3.41Å; E326-K329 WeakPolarHBondContact OE2-CD 3.35Å; E326-K329 IonicContact OE2-NZ 2.73Å; E326-K329 PolarHBondContact OE2-NZ 2.89Å; K329-K331 VanDerWaalsContact C-N 3.33Å; K329-K331 PolarHBondContact O-N 2.78Å; K329-R332 WeakPolarHBondContact O-CB 3.26Å; K329-R332 PolarHBondContact O-N 3.4Å; K329-R332 VanDerWaalsContact O-N 3.13Å; K329-L333 PolarHBondContact O-N 2.85Å |
| 330 | L | 82.8 | Confident | 83.7 | Confident | 107 Ų | 107 | 100 Ų | 100 | 56% | 0.56 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -60.1 | -41.1 | 179.5 | -72.2 | 171.8 | 0 | 0 | 0 | 112 | E326 I327 R332 L333 L334 | E326-L330 WeakPolarHBondContact O-CG 3.49Å; E326-L330 PolarHBondContact O-N 3.45Å; I327-L330 PolarHBondContact O-N 3.42Å; L330-R332 PolarHBondContact O-N 3.16Å; L330-L333 PolarHBondContact O-N 2.85Å; L330-L334 WeakPolarHBondContact O-CB 3.48Å; L330-L334 PolarHBondContact O-N 3.11Å |
| 331 | K | 85.2 | Confident | 83.4 | Confident | 143 Ų | 143 | 100.1 Ų | 100.1 | 62% | 0.622 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61.1 | -42.7 | 174 | -78.3 | 178.7 | 178.4 | 177.6 | 0 | 112.4 | I327 K329 L334 H335 | I327-K331 HydrophobicContact CG2-CD 4.1Å; I327-K331 HydrophobicContact CG2-CG 4.37Å; I327-K331 WeakPolarHBondContact O-CB 3.43Å; I327-K331 WeakPolarHBondContact O-CG 3.49Å; I327-K331 PolarHBondContact O-N 3.4Å; K329-K331 VanDerWaalsContact C-N 3.33Å; K329-K331 PolarHBondContact O-N 2.78Å; K331-L334 PolarHBondContact O-N 3.18Å; K331-H335 WeakPolarHBondContact O-CB 3.21Å; K331-H335 PolarHBondContact O-N 3.34Å |
| 332 | R | 82.6 | Confident | 83 | Confident | 175 Ų | 175 | 96.3 Ų | 96.3 | 66% | 0.66 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -63.7 | -42 | 175 | -79.5 | -174.7 | -79.5 | 171.4 | -7.9 | 111.7 | S328 K329 L330 H335 A336 | S328-R332 WeakPolarHBondContact O-CG 3.49Å; S328-R332 PolarHBondContact O-N 3.41Å; S328-R332 VanDerWaalsContact O-N 3.16Å; S328-R332 PolarHBondContact O-NE 2.98Å; K329-R332 WeakPolarHBondContact O-CB 3.26Å; K329-R332 PolarHBondContact O-N 3.4Å; K329-R332 VanDerWaalsContact O-N 3.13Å; L330-R332 PolarHBondContact O-N 3.16Å; R332-H335 PolarHBondContact O-N 2.87Å; R332-A336 WeakPolarHBondContact O-CB 3.44Å; R332-A336 PolarHBondContact O-N 3.06Å |
| 333 | L | 83.6 | Confident | 82.7 | Confident | 103 Ų | 103 | 96.5 Ų | 96.5 | 54% | 0.539 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.2 | -44.1 | 177.6 | -125.5 | 150.8 | 0 | 0 | 0 | 111.6 | K329 L330 A336 Q337 | K329-L333 PolarHBondContact O-N 2.85Å; L330-L333 PolarHBondContact O-N 2.85Å; L333-A336 PolarHBondContact O-N 3.1Å; L333-Q337 WeakPolarHBondContact O-CB 3.41Å; L333-Q337 WeakPolarHBondContact O-CG 3.5Å; L333-Q337 PolarHBondContact O-N 3.1Å |
| 334 | L | 85.5 | Confident | 82.3 | Confident | 97 Ų | 97 | 97.1 Ų | 97.1 | 51% | 0.508 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.9 | -42 | 174.5 | -175.9 | 67.7 | 0 | 0 | 0 | 111.6 | L330 K331 Q337 N338 | L330-L334 WeakPolarHBondContact O-CB 3.48Å; L330-L334 PolarHBondContact O-N 3.11Å; K331-L334 PolarHBondContact O-N 3.18Å; L334-Q337 PolarHBondContact O-N 2.88Å; L334-N338 WeakPolarHBondContact O-CB 3.46Å; L334-N338 VanDerWaalsContact O-CG 3.29Å; L334-N338 PolarHBondContact O-N 3.17Å; L334-N338 PolarHBondContact O-ND2 3.3Å |
| 335 | H | 83.9 | Confident | 81.7 | Confident | 120 Ų | 120 | 100.2 Ų | 100.2 | 56% | 0.556 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.1 | -43.6 | 175.3 | -174 | 71.2 | 0 | 0 | 0 | 111.8 | K331 R332 N338 M339 | K331-H335 WeakPolarHBondContact O-CB 3.21Å; K331-H335 PolarHBondContact O-N 3.34Å; R332-H335 PolarHBondContact O-N 2.87Å; H335-N338 PolarHBondContact O-N 3.2Å; H335-M339 WeakPolarHBondContact O-CG 3.24Å; H335-M339 PolarHBondContact O-N 2.93Å |
| 336 | A | 81.3 | Confident | 81.2 | Confident | 48 Ų | 48 | 98.1 Ų | 98.1 | 40% | 0.397 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.5 | -43.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | R332 L333 N338 M339 I340 | R332-A336 WeakPolarHBondContact O-CB 3.44Å; R332-A336 PolarHBondContact O-N 3.06Å; L333-A336 PolarHBondContact O-N 3.1Å; A336-N338 PolarHBondContact O-N 2.97Å; A336-M339 WeakPolarHBondContact O-CB 3.23Å; A336-M339 PolarHBondContact O-N 3.42Å; A336-I340 WeakPolarHBondContact O-CG1 3.38Å; A336-I340 PolarHBondContact O-N 2.8Å |
| 337 | Q | 79.1 | Confident | 80.4 | Confident | 102 Ų | 102 | 98.5 Ų | 98.5 | 48% | 0.477 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.7 | -44.1 | 173.9 | -77 | 178.5 | -19.7 | 0 | 0 | 111.9 | L333 L334 M339 I340 I341 | L333-Q337 WeakPolarHBondContact O-CB 3.41Å; L333-Q337 WeakPolarHBondContact O-CG 3.5Å; L333-Q337 PolarHBondContact O-N 3.1Å; L334-Q337 PolarHBondContact O-N 2.88Å; Q337-M339 VanDerWaalsContact C-N 3.3Å; Q337-M339 PolarHBondContact O-N 3.48Å; Q337-I340 PolarHBondContact O-N 2.91Å; Q337-I341 WeakPolarHBondContact O-CB 3.5Å; Q337-I341 VanDerWaalsContact O-CG1 3.26Å; Q337-I341 WeakPolarHBondContact O-CG1 3.47Å; Q337-I341 PolarHBondContact O-N 3.37Å |
| 338 | N | 81.9 | Confident | 79.4 | Confident | 81 Ų | 81 | 98.9 Ų | 98.9 | 43% | 0.433 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.8 | -37.7 | 176 | -76.2 | -26 | 0 | 0 | 0 | 112.2 | L334 H335 A336 A342 | L334-N338 WeakPolarHBondContact O-CB 3.46Å; L334-N338 VanDerWaalsContact O-CG 3.29Å; L334-N338 PolarHBondContact O-N 3.17Å; L334-N338 PolarHBondContact O-ND2 3.3Å; H335-N338 PolarHBondContact O-N 3.2Å; A336-N338 PolarHBondContact O-N 2.97Å; N338-A342 VanDerWaalsContact O-CB 3.31Å; N338-A342 WeakPolarHBondContact O-CB 3.39Å; N338-A342 PolarHBondContact O-N 3.34Å |
| 339 | M | 80.1 | Confident | 78.3 | Confident | 94 Ų | 94 | 101.4 Ų | 101.4 | 46% | 0.463 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.1 | -43 | 173.6 | -73.6 | -66.3 | 99.6 | 0 | 0 | 112.4 | H335 A336 Q337 A342 Q343 | H335-M339 WeakPolarHBondContact O-CG 3.24Å; H335-M339 PolarHBondContact O-N 2.93Å; A336-M339 WeakPolarHBondContact O-CB 3.23Å; A336-M339 PolarHBondContact O-N 3.42Å; Q337-M339 VanDerWaalsContact C-N 3.3Å; Q337-M339 PolarHBondContact O-N 3.48Å; M339-A342 PolarHBondContact O-N 3.13Å; M339-Q343 WeakPolarHBondContact O-CG 3.35Å; M339-Q343 PolarHBondContact O-N 3.47Å |
| 340 | I | 80.3 | Confident | 77.4 | Confident | 91 Ų | 91 | 102.1 Ų | 102.1 | 47% | 0.467 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.7 | -45.1 | 175.1 | -67.7 | 165.1 | 0 | 0 | 0 | 110.4 | A336 Q337 A342 Q343 L344 | A336-I340 WeakPolarHBondContact O-CG1 3.38Å; A336-I340 PolarHBondContact O-N 2.8Å; Q337-I340 PolarHBondContact O-N 2.91Å; I340-A342 VanDerWaalsContact C-N 3.32Å; I340-A342 PolarHBondContact O-N 2.68Å; I340-Q343 PolarHBondContact O-N 3.18Å; I340-L344 HydrophobicContact CG2-CD1 3.9Å; I340-L344 HydrophobicContact CG2-CG 4.36Å; I340-L344 WeakPolarHBondContact O-CB 3.5Å; I340-L344 VanDerWaalsContact O-CG 3.31Å; I340-L344 WeakPolarHBondContact O-CG 3.21Å; I340-L344 PolarHBondContact O-N 3.21Å |
| 341 | I | 79 | Confident | 76.6 | Confident | 85 Ų | 85 | 101.8 Ų | 101.8 | 44% | 0.436 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.6 | -42.1 | 176.4 | -69.2 | 166.2 | 0 | 0 | 0 | 110.6 | Q337 L344 K345 | Q337-I341 WeakPolarHBondContact O-CB 3.5Å; Q337-I341 VanDerWaalsContact O-CG1 3.26Å; Q337-I341 WeakPolarHBondContact O-CG1 3.47Å; Q337-I341 PolarHBondContact O-N 3.37Å; I341-L344 PolarHBondContact O-N 2.95Å; I341-K345 WeakPolarHBondContact O-CG 3.48Å; I341-K345 PolarHBondContact O-N 3.38Å |
| 342 | A | 77 | Confident | 75.2 | Confident | 43 Ų | 43 | 100.3 Ų | 100.3 | 36% | 0.355 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.8 | -47.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | N338 M339 I340 L344 K345 T346 | N338-A342 VanDerWaalsContact O-CB 3.31Å; N338-A342 WeakPolarHBondContact O-CB 3.39Å; N338-A342 PolarHBondContact O-N 3.34Å; M339-A342 PolarHBondContact O-N 3.13Å; I340-A342 VanDerWaalsContact C-N 3.32Å; I340-A342 PolarHBondContact O-N 2.68Å; A342-L344 PolarHBondContact O-N 3.07Å; A342-K345 WeakPolarHBondContact O-CB 3.47Å; A342-K345 PolarHBondContact O-N 3.49Å; A342-T346 PolarHBondContact O-N 2.99Å; A342-T346 PolarHBondContact O-OG1 3.36Å |
| 343 | Q | 74.4 | Confident | 74 | Confident | 130 Ų | 130 | 97.4 Ų | 97.4 | 61% | 0.607 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -60.1 | -43.2 | 176 | -75.1 | 177 | -12.7 | 0 | 0 | 112.7 | M339 I340 K345 T346 E347 | M339-Q343 WeakPolarHBondContact O-CG 3.35Å; M339-Q343 PolarHBondContact O-N 3.47Å; I340-Q343 PolarHBondContact O-N 3.18Å; Q343-K345 VanDerWaalsContact C-N 3.32Å; Q343-K345 PolarHBondContact O-N 3.31Å; Q343-T346 WeakPolarHBondContact CA-OG1 3.45Å; Q343-T346 PolarHBondContact O-N 2.7Å; Q343-T346 PolarHBondContact O-OG1 2.89Å; Q343-E347 PolarHBondContact O-N 3.47Å |
| 344 | L | 75.5 | Confident | 72.6 | Confident | 113 Ų | 113 | 101 Ų | 101 | 59% | 0.592 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.1 | -37.6 | 175.8 | -74.5 | 170.4 | 0 | 0 | 0 | 111.7 | I340 I341 A342 E347 S348 | I340-L344 HydrophobicContact CG2-CD1 3.9Å; I340-L344 HydrophobicContact CG2-CG 4.36Å; I340-L344 WeakPolarHBondContact O-CB 3.5Å; I340-L344 VanDerWaalsContact O-CG 3.31Å; I340-L344 WeakPolarHBondContact O-CG 3.21Å; I340-L344 PolarHBondContact O-N 3.21Å; I341-L344 PolarHBondContact O-N 2.95Å; A342-L344 PolarHBondContact O-N 3.07Å; L344-E347 PolarHBondContact O-N 2.88Å; L344-S348 VanDerWaalsContact O-CB 3.24Å; L344-S348 WeakPolarHBondContact O-CB 3.41Å; L344-S348 PolarHBondContact O-N 3.28Å |
| 345 | K | 75.4 | Confident | 71.1 | Confident | 137 Ų | 137 | 100.1 Ų | 100.1 | 60% | 0.596 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.8 | -41.8 | 172.4 | -77.5 | -179.8 | 177.9 | -179.4 | 0 | 111.8 | I341 A342 Q343 S348 M349 | I341-K345 WeakPolarHBondContact O-CG 3.48Å; I341-K345 PolarHBondContact O-N 3.38Å; A342-K345 WeakPolarHBondContact O-CB 3.47Å; A342-K345 PolarHBondContact O-N 3.49Å; Q343-K345 VanDerWaalsContact C-N 3.32Å; Q343-K345 PolarHBondContact O-N 3.31Å; K345-S348 PolarHBondContact O-N 3.46Å; K345-M349 PolarHBondContact O-N 2.92Å |
| 346 | T | 75.3 | Confident | 69.6 | Low | 77 Ų | 77 | 102.9 Ų | 102.9 | 47% | 0.472 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.8 | -42.1 | 177 | -9.3 | 0 | 0 | 0 | 0 | 111.9 | A342 Q343 M349 K350 | A342-T346 PolarHBondContact O-N 2.99Å; A342-T346 PolarHBondContact O-OG1 3.36Å; Q343-T346 WeakPolarHBondContact CA-OG1 3.45Å; Q343-T346 PolarHBondContact O-N 2.7Å; Q343-T346 PolarHBondContact O-OG1 2.89Å; T346-M349 PolarHBondContact O-N 3.25Å; T346-K350 WeakPolarHBondContact O-CG 3.42Å; T346-K350 PolarHBondContact O-N 3.36Å |
| 347 | E | 68.3 | Low | 68 | Low | 98 Ų | 98 | 112 Ų | 112 | 46% | 0.458 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -67.8 | -39.9 | 175.9 | -79.2 | -55.3 | 142.9 | 0 | 0 | 112.3 | Q343 L344 M349 K350 V351 | Q343-E347 PolarHBondContact O-N 3.47Å; L344-E347 PolarHBondContact O-N 2.88Å; E347-M349 VanDerWaalsContact C-N 3.3Å; E347-M349 PolarHBondContact O-N 3.46Å; E347-K350 WeakPolarHBondContact O-CB 3.42Å; E347-K350 PolarHBondContact O-N 3.08Å; E347-K350 VanDerWaalsContact O-N 3.09Å; E347-K350 WeakPolarHBondContact OE1-CD 3.29Å; E347-K350 IonicContact OE1-NZ 2.74Å; E347-K350 PolarHBondContact OE1-NZ 3.42Å; E347-V351 WeakPolarHBondContact O-CG2 3.49Å; E347-V351 PolarHBondContact O-N 3.47Å |
| 348 | S | 62.5 | Low | 66.5 | Low | 70 Ų | 70 | 113.1 Ų | 113.1 | 49% | 0.49 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -61.3 | -38.6 | 174 | -166.2 | 0 | 0 | 0 | 0 | 112 | L344 K345 V351 M352 | L344-S348 VanDerWaalsContact O-CB 3.24Å; L344-S348 WeakPolarHBondContact O-CB 3.41Å; L344-S348 PolarHBondContact O-N 3.28Å; K345-S348 PolarHBondContact O-N 3.46Å; S348-V351 PolarHBondContact O-N 3.47Å; S348-M352 PolarHBondContact O-N 3.36Å |
| 349 | M | 65.6 | Low | 64.8 | Low | 112 Ų | 112 | 112.5 Ų | 112.5 | 55% | 0.552 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -65.4 | -37.5 | 171.6 | -82.1 | -162.7 | -126.7 | 0 | 0 | 113.4 | K345 T346 E347 V351 M352 N353 | K345-M349 PolarHBondContact O-N 2.92Å; T346-M349 PolarHBondContact O-N 3.25Å; E347-M349 VanDerWaalsContact C-N 3.3Å; E347-M349 PolarHBondContact O-N 3.46Å; M349-V351 VanDerWaalsContact C-N 3.34Å; M349-M352 HydrophobicContact CG-CE 4.41Å; M349-M352 PolarHBondContact O-N 3.06Å; M349-N353 WeakPolarHBondContact O-CB 3.4Å; M349-N353 PolarHBondContact O-N 2.95Å |
| 350 | K | 66.3 | Low | 63 | Low | 118 Ų | 118 | 117.6 Ų | 117.6 | 51% | 0.513 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -64.6 | -39 | 175.2 | -73.3 | 177.9 | -170.3 | 169 | 0 | 111.9 | T346 E347 N353 K354 | T346-K350 WeakPolarHBondContact O-CG 3.42Å; T346-K350 PolarHBondContact O-N 3.36Å; E347-K350 WeakPolarHBondContact O-CB 3.42Å; E347-K350 PolarHBondContact O-N 3.08Å; E347-K350 VanDerWaalsContact O-N 3.09Å; E347-K350 WeakPolarHBondContact OE1-CD 3.29Å; E347-K350 IonicContact OE1-NZ 2.74Å; E347-K350 PolarHBondContact OE1-NZ 3.42Å; K350-N353 PolarHBondContact O-N 3.44Å; K350-K354 PolarHBondContact O-N 3.09Å |
| 351 | V | 65.2 | Low | 61.4 | Low | 101 Ų | 101 | 123 Ų | 123 | 61% | 0.612 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -67 | -42 | 175.9 | 175.9 | 0 | 0 | 0 | 0 | 111.1 | E347 S348 M349 N353 K354 S355 | E347-V351 WeakPolarHBondContact O-CG2 3.49Å; E347-V351 PolarHBondContact O-N 3.47Å; S348-V351 PolarHBondContact O-N 3.47Å; M349-V351 VanDerWaalsContact C-N 3.34Å; V351-N353 PolarHBondContact O-N 3.41Å; V351-K354 PolarHBondContact O-N 2.96Å; V351-S355 PolarHBondContact O-N 3.07Å |
| 352 | M | 57.5 | Low | 59.5 | Low | 111 Ų | 111 | 128 Ų | 128 | 55% | 0.547 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -65.8 | -31.9 | 174.8 | -82.9 | -161.6 | -62.9 | 0 | 0 | 114.2 | S348 M349 S355 | S348-M352 PolarHBondContact O-N 3.36Å; M349-M352 HydrophobicContact CG-CE 4.41Å; M349-M352 PolarHBondContact O-N 3.06Å; M352-S355 PolarHBondContact O-OG 3.06Å |
| 353 | N | 57.1 | Low | 57.4 | Low | 114 Ų | 114 | 134 Ų | 134 | 61% | 0.61 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -79.7 | -22.3 | 179.7 | -76.9 | -20.9 | 0 | 0 | 0 | 113.3 | M349 K350 V351 | M349-N353 WeakPolarHBondContact O-CB 3.4Å; M349-N353 PolarHBondContact O-N 2.95Å; K350-N353 PolarHBondContact O-N 3.44Å; V351-N353 PolarHBondContact O-N 3.41Å |
| 354 | K | 53.8 | Low | 56.6 | Low | 178 Ų | 178 | 134.3 Ų | 134.3 | 77% | 0.774 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -75.6 | -32.8 | 170 | -83.9 | -177.4 | 174.8 | 178.3 | 0 | 112.6 | K350 V351 K356 | K350-K354 PolarHBondContact O-N 3.09Å; V351-K354 PolarHBondContact O-N 2.96Å; K354-K356 VanDerWaalsContact C-N 3.33Å; K354-K356 PolarHBondContact O-N 2.88Å |
| 355 | S | 53 | Low | 55.6 | Low | 79 Ų | 79 | 135.4 Ų | 135.4 | 55% | 0.552 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -74.5 | -16.1 | -179.4 | 66.1 | 0 | 0 | 0 | 0 | 114.7 | V351 M352 T358 | V351-S355 PolarHBondContact O-N 3.07Å; M352-S355 PolarHBondContact O-OG 3.06Å; S355-T358 PolarHBondContact O-OG1 3.46Å |
| 356 | K | 52.3 | Low | 54.5 | Low | 179 Ų | 179 | 135.3 Ų | 135.3 | 78% | 0.778 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.5 | -10.8 | 177.2 | -81.9 | -177 | 176.9 | 176.4 | 0 | 115.7 | K354 | K354-K356 VanDerWaalsContact C-N 3.33Å; K354-K356 PolarHBondContact O-N 2.88Å |
| 357 | R | 47.7 | Very low | 53.2 | Low | 238 Ų | 238 | 138.7 Ų | 138.7 | 90% | 0.898 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -93.4 | -7 | 179.8 | -88.5 | -177.1 | 172.7 | 175 | -1.7 | 115 | G359 | R357-G359 PolarHBondContact O-N 3.17Š|
| 358 | T | 49.3 | Very low | 52.3 | Low | 127 Ų | 127 | 141.3 Ų | 141.3 | 78% | 0.779 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -91.3 | 36.7 | 176.9 | 43 | 0 | 0 | 0 | 0 | 114.2 | S355 | S355-T358 PolarHBondContact O-OG1 3.46Š|
| 359 | G | 45.8 | Very low | 51.6 | Low | 68 Ų | 68 | 146 Ų | 146 | 70% | 0.701 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -132.7 | 2.4 | -171.8 | 0 | 0 | 0 | 0 | 0 | 118.9 | R357 | R357-G359 PolarHBondContact O-N 3.17Š|
| 360 | K | 41.8 | Very low | 50.6 | Low | 201 Ų | 201 | 148.4 Ų | 148.4 | 87% | 0.874 | 77% | 0.773 | S | S | * | * | trans | -138.8 | 75.7 | 175 | -93.6 | -176.5 | 175 | 178.6 | 0 | 111.3 | ||||
| 361 | K | 45.9 | Very low | 49.4 | Very low | 204 Ų | 204 | 150.8 Ų | 150.8 | 89% | 0.887 | 79% | 0.793 | S | S | * | * | trans | -159.1 | 60.5 | 150.5 | -104.4 | -173.8 | -179 | -175.6 | 0 | 107.6 | ||||
| 362 | Q | 40.7 | Very low | 48.1 | Very low | 189 Ų | 189 | 154.9 Ų | 154.9 | 88% | 0.883 | 81% | 0.808 | S | S | * | * | trans | -120.3 | 135.5 | 133 | -83.4 | 179.8 | -17.9 | 0 | 0 | 103.8 | ||||
| 363 | A | 32.1 | Very low | 47.2 | Very low | 171 Ų | 171 | 158.9 Ų | 158.9 | 100% | 1.413 | 83% | 0.832 | S | S | * | * | trans | 77 | 0 | -156.1 | 0 | 0 | 0 | 0 | 0 | 115.3 |
Retrieved 363 of 363 residues in 878.2 ms
(Link to these results)