| 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 | 36.3 | Very low | 51.8 | Low | 236 Ų | 236 | 124.9 Ų | 124.9 | 100% | 1.163 | 75% | 0.75 | S | S | * | * | 0 | 146.2 | 0 | -81.6 | -68.2 | 135.2 | 0 | 0 | 108 | |||||
| 2 | P | 48.5 | Very low | 52.9 | Low | 120 Ų | 120 | 125.2 Ų | 125.2 | 78% | 0.779 | 74% | 0.742 | S | S | * | * | -96.6 | 173.9 | -108.9 | 34.9 | -36.6 | 0 | 0 | 0 | 114.8 | |||||
| 3 | G | 52.3 | Low | 53.8 | Low | 72 Ų | 72 | 124.6 Ų | 124.6 | 74% | 0.742 | 73% | 0.733 | S | S | * | * | trans | -58 | 152 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 4 | S | 42.8 | Very low | 54.5 | Low | 112 Ų | 112 | 118.9 Ų | 118.9 | 78% | 0.783 | 71% | 0.708 | S | S | * | * | trans | -110.7 | 86.2 | 159.1 | -67.7 | 0 | 0 | 0 | 0 | 107.5 | S6 | S4-S6 PolarHBondContact O-N 3.25Š| ||
| 5 | N | 49.8 | Very low | 54.8 | Low | 172 Ų | 172 | 113.3 Ų | 113.3 | 92% | 0.92 | 67% | 0.672 | S | S | * | * | trans | -69.3 | 61.1 | 154.2 | -77.7 | -11.9 | 0 | 0 | 0 | 108.1 | A7 | N5-A7 PolarHBondContact O-N 2.99Å; N5-A7 VanDerWaalsContact O-N 3.07Å | ||
| 6 | S | 46.4 | Very low | 55.2 | Low | 98 Ų | 98 | 110.6 Ų | 110.6 | 69% | 0.685 | 66% | 0.657 | S | S | * | * | trans | -66.3 | 105.3 | 170 | 161.1 | 0 | 0 | 0 | 0 | 105.7 | S4 F8 | S4-S6 PolarHBondContact O-N 3.25Å; S6-F8 PolarHBondContact O-N 3.34Å; S6-F8 VanDerWaalsContact O-N 3.08Å | ||
| 7 | A | 51.1 | Low | 56 | Low | 72 Ų | 72 | 110.9 Ų | 110.9 | 60% | 0.595 | 66% | 0.66 | S | S | * | * | trans | -39.9 | 121.9 | 168 | 0 | 0 | 0 | 0 | 0 | 108.6 | N5 I9 | N5-A7 PolarHBondContact O-N 2.99Å; N5-A7 VanDerWaalsContact O-N 3.07Å; A7-I9 PolarHBondContact O-N 3.44Å | ||
| 8 | F | 55.5 | Low | 56.6 | Low | 187 Ų | 187 | 107.1 Ų | 107.1 | 82% | 0.82 | 64% | 0.64 | S | S | * | * | trans | -68.4 | 87.6 | 179.7 | -162.2 | -93.4 | 0 | 0 | 0 | 107.1 | S6 P10 | S6-F8 PolarHBondContact O-N 3.34Å; S6-F8 VanDerWaalsContact O-N 3.08Å; F8-P10 WeakPolarHBondContact O-CD 3.39Å | ||
| 9 | I | 57.7 | Low | 57.3 | Low | 138 Ų | 138 | 109.7 Ų | 109.7 | 71% | 0.708 | 65% | 0.645 | S | S | * | * | trans | -80.9 | 107.1 | 171.5 | -60 | 171.1 | 0 | 0 | 0 | 104.3 | A7 T11 | A7-I9 PolarHBondContact O-N 3.44Å; I9-T11 PolarHBondContact O-N 2.88Å | ||
| 10 | P | 58 | Low | 58.2 | Low | 73 Ų | 73 | 110.7 Ų | 110.7 | 47% | 0.474 | 65% | 0.647 | S | S | . | * | trans | -65.9 | 102.6 | 178.9 | 26.3 | -32 | 0 | 0 | 0 | 108.3 | F8 I15 | F8-P10 WeakPolarHBondContact O-CD 3.39Å; P10-I15 HydrophobicContact CB-CD1 4.13Å; P10-I15 HydrophobicContact CB-CG1 4.11Å | ||
| 11 | T | 71.6 | Confident | 58.8 | Low | 94 Ų | 94 | 108.2 Ų | 108.2 | 58% | 0.577 | 63% | 0.631 | S | S | * | * | trans | -60.5 | 139.8 | 171.8 | -44.7 | 0 | 0 | 0 | 0 | 108.1 | I9 N13 A14 I15 | I9-T11 PolarHBondContact O-N 2.88Å; T11-N13 PolarHBondContact O-N 3.44Å; T11-A14 WeakPolarHBondContact O-CB 3.43Å; T11-A14 PolarHBondContact O-N 2.95Å; T11-I15 PolarHBondContact O-N 3.47Å | ||
| 12 | I | 64.3 | Low | 60.2 | Low | 128 Ų | 128 | 102.5 Ų | 102.5 | 66% | 0.656 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -49.6 | -36.8 | -178.7 | -67.4 | 176.2 | 0 | 0 | 0 | 111.6 | A14 I15 T16 | I12-A14 VanDerWaalsContact C-N 3.32Å; I12-A14 PolarHBondContact O-N 3.25Å; I12-I15 PolarHBondContact O-N 3.05Å; I12-T16 HydrophobicContact CG2-CG2 4.4Å; I12-T16 WeakPolarHBondContact O-CG2 3.43Å; I12-T16 PolarHBondContact O-N 3.44Å; I12-T16 VanDerWaalsContact O-N 3.15Å |
| 13 | N | 65.1 | Low | 61.3 | Low | 118 Ų | 118 | 106 Ų | 106 | 63% | 0.631 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -63.2 | -31.8 | 177.1 | -65.8 | -2.7 | 0 | 0 | 0 | 113.8 | T11 T16 T17 | T11-N13 PolarHBondContact O-N 3.44Å; N13-T16 PolarHBondContact O-OG1 3.35Å; N13-T16 VanDerWaalsContact O-OG1 3.13Å; N13-T17 VanDerWaalsContact O-CG2 3.3Å; N13-T17 WeakPolarHBondContact O-CG2 3.28Å; N13-T17 PolarHBondContact O-N 3.45Å; N13-T17 PolarHBondContact O-OG1 3.04Å; N13-T17 VanDerWaalsContact O-OG1 3.08Å |
| 14 | A | 63.2 | Low | 62.3 | Low | 45 Ų | 45 | 107.1 Ų | 107.1 | 37% | 0.372 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -74.4 | -28.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | T11 I12 | T11-A14 WeakPolarHBondContact O-CB 3.43Å; T11-A14 PolarHBondContact O-N 2.95Å; I12-A14 VanDerWaalsContact C-N 3.32Å; I12-A14 PolarHBondContact O-N 3.25Å |
| 15 | I | 59.5 | Low | 63.6 | Low | 34 Ų | 34 | 104.7 Ų | 104.7 | 17% | 0.174 | 57% | 0.567 | C | S | . | * | H | α-helix | trans | -76.8 | -37.1 | 177.7 | -49.2 | 177.1 | 0 | 0 | 0 | 110.2 | P10 T11 I12 L21 M24 V25 | P10-I15 HydrophobicContact CB-CD1 4.13Å; P10-I15 HydrophobicContact CB-CG1 4.11Å; T11-I15 PolarHBondContact O-N 3.47Å; I12-I15 PolarHBondContact O-N 3.05Å; I15-L21 HydrophobicContact CG2-CB 3.94Å; I15-M24 HydrophobicContact CG2-CB 4.37Å; I15-M24 HydrophobicContact CG2-CE 4.45Å; I15-V25 HydrophobicContact CB-CG2 4.26Å; I15-V25 HydrophobicContact CG2-CG2 3.5Å |
| 16 | T | 61.1 | Low | 64 | Low | 70 Ų | 70 | 104.2 Ų | 104.2 | 43% | 0.429 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -75.6 | -26.6 | -178.5 | 60 | 0 | 0 | 0 | 0 | 114 | I12 N13 V25 | I12-T16 HydrophobicContact CG2-CG2 4.4Å; I12-T16 WeakPolarHBondContact O-CG2 3.43Å; I12-T16 PolarHBondContact O-N 3.44Å; I12-T16 VanDerWaalsContact O-N 3.15Å; N13-T16 PolarHBondContact O-OG1 3.35Å; N13-T16 VanDerWaalsContact O-OG1 3.13Å; T16-V25 HydrophobicContact CG2-CG2 4.36Å |
| 17 | T | 68.1 | Low | 64.6 | Low | 116 Ų | 116 | 104.7 Ų | 104.7 | 71% | 0.712 | 56% | 0.559 | S | S | * | * | S | Bend | trans | -88 | -9.8 | -178.1 | 55.5 | 0 | 0 | 0 | 0 | 113.8 | N13 | N13-T17 VanDerWaalsContact O-CG2 3.3Å; N13-T17 WeakPolarHBondContact O-CG2 3.28Å; N13-T17 PolarHBondContact O-N 3.45Å; N13-T17 PolarHBondContact O-OG1 3.04Å; N13-T17 VanDerWaalsContact O-OG1 3.08Å |
| 18 | S | 66.8 | Low | 64.9 | Low | 42 Ų | 42 | 107.3 Ų | 107.3 | 29% | 0.294 | 57% | 0.568 | S | S | . | * | trans | -96.4 | 118.9 | 177.1 | -177.7 | 0 | 0 | 0 | 0 | 110.6 | D20 L21 Q22 | S18-D20 PolarHBondContact O-N 3.19Å; S18-L21 PolarHBondContact O-N 3.23Å; S18-Q22 PolarHBondContact O-N 3.42Å | ||
| 19 | Q | 70.8 | Confident | 64.7 | Low | 157 Ų | 157 | 103.7 Ų | 103.7 | 73% | 0.734 | 56% | 0.561 | S | S | * | * | G | 310 helix | trans | -54.4 | -35.6 | 178.1 | -171.5 | 68.8 | 39.1 | 0 | 0 | 111.9 | ||
| 20 | D | 75 | Confident | 64.3 | Low | 130 Ų | 130 | 104.9 Ų | 104.9 | 70% | 0.695 | 57% | 0.567 | S | S | * | * | G | 310 helix | trans | -80.2 | -14.2 | -178.5 | -80.2 | -7.5 | 0 | 0 | 0 | 113.9 | S18 W23 | S18-D20 PolarHBondContact O-N 3.19Å; D20-W23 PolarHBondContact O-NE1 3.44Å |
| 21 | L | 71.9 | Confident | 63.4 | Low | 59 Ų | 59 | 105.9 Ų | 105.9 | 31% | 0.309 | 57% | 0.572 | S | S | . | * | G | 310 helix | trans | -105.6 | -0.7 | -179.1 | -52.8 | 179.1 | 0 | 0 | 0 | 112.5 | I15 S18 W23 M24 | I15-L21 HydrophobicContact CG2-CB 3.94Å; S18-L21 PolarHBondContact O-N 3.23Å; L21-W23 PolarHBondContact O-N 3.47Å; L21-M24 HydrophobicContact CB-CE 3.87Å; L21-M24 HydrophobicContact CD1-CE 4.43Å; L21-M24 HydrophobicContact CD2-CE 3.49Å; L21-M24 VanDerWaalsContact CD2-CE 3.49Å; L21-M24 HydrophobicContact CG-CE 4.1Å; L21-M24 WeakPolarHBondContact O-CB 3.45Å; L21-M24 PolarHBondContact O-N 2.88Å |
| 22 | Q | 65.1 | Low | 62.2 | Low | 116 Ų | 116 | 106.4 Ų | 106.4 | 54% | 0.542 | 58% | 0.58 | S | S | . | * | G | 310 helix | trans | -60.3 | -28.8 | -179.1 | -159.5 | 175.2 | 42.8 | 0 | 0 | 112.6 | S18 M24 V25 | S18-Q22 PolarHBondContact O-N 3.42Å; Q22-M24 VanDerWaalsContact C-N 3.26Å; Q22-M24 PolarHBondContact O-N 3.22Å; Q22-V25 PolarHBondContact O-N 3.25Å |
| 23 | W | 71.4 | Confident | 61.1 | Low | 194 Ų | 194 | 107.5 Ų | 107.5 | 74% | 0.735 | 58% | 0.584 | S | S | * | * | G | 310 helix | trans | -67.8 | -21.9 | 175.8 | 65.8 | -94.8 | 0 | 0 | 0 | 113.8 | D20 L21 V25 | D20-W23 PolarHBondContact O-NE1 3.44Å; L21-W23 PolarHBondContact O-N 3.47Å; W23-V25 VanDerWaalsContact C-N 3.34Å |
| 24 | M | 72.7 | Confident | 60.2 | Low | 95 Ų | 95 | 107.2 Ų | 107.2 | 47% | 0.468 | 59% | 0.591 | S | S | . | * | G | 310 helix | trans | -80.2 | -17.2 | 175 | -77.9 | -168.8 | -66.9 | 0 | 0 | 112.9 | I15 L21 Q22 Q26 | I15-M24 HydrophobicContact CG2-CB 4.37Å; I15-M24 HydrophobicContact CG2-CE 4.45Å; L21-M24 HydrophobicContact CB-CE 3.87Å; L21-M24 HydrophobicContact CD1-CE 4.43Å; L21-M24 HydrophobicContact CD2-CE 3.49Å; L21-M24 VanDerWaalsContact CD2-CE 3.49Å; L21-M24 HydrophobicContact CG-CE 4.1Å; L21-M24 WeakPolarHBondContact O-CB 3.45Å; L21-M24 PolarHBondContact O-N 2.88Å; Q22-M24 VanDerWaalsContact C-N 3.26Å; Q22-M24 PolarHBondContact O-N 3.22Å; M24-Q26 PolarHBondContact O-N 3.44Å |
| 25 | V | 69.9 | Low | 59.1 | Low | 61 Ų | 61 | 111 Ų | 111 | 37% | 0.37 | 61% | 0.605 | S | S | . | * | trans | -91.3 | 90 | 177.3 | -171.8 | 0 | 0 | 0 | 0 | 107.8 | I15 T16 Q22 W23 P27 | I15-V25 HydrophobicContact CB-CG2 4.26Å; I15-V25 HydrophobicContact CG2-CG2 3.5Å; T16-V25 HydrophobicContact CG2-CG2 4.36Å; Q22-V25 PolarHBondContact O-N 3.25Å; W23-V25 VanDerWaalsContact C-N 3.34Å; V25-P27 WeakPolarHBondContact O-CD 3.29Å | ||
| 26 | Q | 59.5 | Low | 58.8 | Low | 162 Ų | 162 | 114.8 Ų | 114.8 | 76% | 0.757 | 63% | 0.632 | S | S | * | * | trans | -76.2 | 114.1 | 167.2 | -73.8 | -132.4 | 26 | 0 | 0 | 109 | M24 T28 | M24-Q26 PolarHBondContact O-N 3.44Å; Q26-T28 PolarHBondContact O-N 3.01Å | ||
| 27 | P | 58.3 | Low | 58.1 | Low | 107 Ų | 107 | 120.7 Ų | 120.7 | 70% | 0.695 | 65% | 0.648 | S | S | * | * | trans | -63.5 | 108.6 | 173.8 | 24.3 | -30.2 | 0 | 0 | 0 | 108.3 | V25 V29 | V25-P27 WeakPolarHBondContact O-CD 3.29Å; P27-V29 PolarHBondContact O-N 2.94Å | ||
| 28 | T | 57.3 | Low | 57.1 | Low | 128 Ų | 128 | 120.5 Ų | 120.5 | 79% | 0.785 | 65% | 0.651 | S | S | * | * | trans | -78.5 | 74.2 | 174.5 | -50.2 | 0 | 0 | 0 | 0 | 108.3 | Q26 I30 | Q26-T28 PolarHBondContact O-N 3.01Å; T28-I30 PolarHBondContact O-N 2.85Å | ||
| 29 | V | 52.4 | Low | 56.3 | Low | 110 Ų | 110 | 130.1 Ų | 130.1 | 67% | 0.667 | 68% | 0.681 | S | S | * | * | trans | -77.5 | 115.2 | 157.3 | -97 | 0 | 0 | 0 | 0 | 106.7 | P27 T31 | P27-V29 PolarHBondContact O-N 2.94Å; V29-T31 PolarHBondContact O-N 3.5Å | ||
| 30 | I | 48.9 | Very low | 55.3 | Low | 164 Ų | 164 | 127.9 Ų | 127.9 | 84% | 0.841 | 68% | 0.682 | S | S | * | * | trans | -67 | 77.5 | 169.4 | -56.2 | 173.2 | 0 | 0 | 0 | 106.7 | T28 | T28-I30 PolarHBondContact O-N 2.85Š| ||
| 31 | T | 39.3 | Very low | 54 | Low | 93 Ų | 93 | 129.5 Ų | 129.5 | 57% | 0.571 | 69% | 0.686 | S | S | * | * | trans | -102.1 | 95.4 | 175.4 | -60.8 | 0 | 0 | 0 | 0 | 107.4 | V29 M33 | V29-T31 PolarHBondContact O-N 3.5Å; T31-M33 HydrophobicContact CG2-CB 3.79Å; T31-M33 HydrophobicContact CG2-CG 3.66Å; T31-M33 PolarHBondContact O-N 3.49Å | ||
| 32 | S | 46.4 | Very low | 53 | Low | 105 Ų | 105 | 131.9 Ų | 131.9 | 73% | 0.734 | 71% | 0.705 | S | S | * | * | trans | -63.6 | 79.9 | 156.9 | 51.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 33 | M | 40.9 | Very low | 52.2 | Low | 151 Ų | 151 | 136.7 Ų | 136.7 | 74% | 0.744 | 72% | 0.719 | S | S | * | * | trans | -137.7 | 116.3 | 163.2 | -71 | -77.2 | 101.4 | 0 | 0 | 107.5 | T31 N35 | T31-M33 HydrophobicContact CG2-CB 3.79Å; T31-M33 HydrophobicContact CG2-CG 3.66Å; T31-M33 PolarHBondContact O-N 3.49Å; M33-N35 PolarHBondContact O-N 3.21Å | ||
| 34 | S | 46 | Very low | 50.8 | Low | 112 Ų | 112 | 130.6 Ų | 130.6 | 78% | 0.783 | 72% | 0.717 | S | S | * | * | trans | -51.7 | 125.1 | 167.1 | 45 | 0 | 0 | 0 | 0 | 110.1 | P36 | S34-P36 WeakPolarHBondContact O-CD 3.5Š| ||
| 35 | N | 40.7 | Very low | 49.4 | Very low | 125 Ų | 125 | 135.2 Ų | 135.2 | 67% | 0.668 | 74% | 0.737 | S | S | * | * | trans | -58.1 | 118.9 | 176.3 | -158.3 | 54.2 | 0 | 0 | 0 | 110.1 | M33 Y37 | M33-N35 PolarHBondContact O-N 3.21Å; N35-Y37 PolarHBondContact ND2-O 2.91Å; N35-Y37 PolarHBondContact O-N 3.46Å | ||
| 36 | P | 51.6 | Low | 48.2 | Very low | 114 Ų | 114 | 139.8 Ų | 139.8 | 74% | 0.74 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -77.1 | -1.8 | -178.8 | 29.2 | -32 | 0 | 0 | 0 | 113.6 | S34 | S34-P36 WeakPolarHBondContact O-CD 3.5Š|
| 37 | Y | 47 | Very low | 47.3 | Very low | 194 Ų | 194 | 140.3 Ų | 140.3 | 76% | 0.761 | 76% | 0.761 | S | S | * | * | trans | -105.5 | 75.9 | 173 | -69 | -81.5 | 0 | 0 | 0 | 110.4 | N35 R39 | N35-Y37 PolarHBondContact ND2-O 2.91Å; N35-Y37 PolarHBondContact O-N 3.46Å; Y37-R39 PolarHBondContact O-N 3.31Å; Y37-R39 VanDerWaalsContact O-N 3.17Å | ||
| 38 | S | 46.3 | Very low | 46.7 | Very low | 111 Ų | 111 | 139.6 Ų | 139.6 | 78% | 0.776 | 76% | 0.755 | S | S | * | * | trans | -67.6 | 103.5 | 156 | -69 | 0 | 0 | 0 | 0 | 107.4 | S40 | S38-S40 VanDerWaalsContact C-N 3.33Å; S38-S40 PolarHBondContact O-N 3.36Å | ||
| 39 | R | 51.6 | Low | 45.9 | Very low | 245 Ų | 245 | 140.8 Ų | 140.8 | 93% | 0.925 | 76% | 0.756 | S | S | * | * | trans | -70.5 | 93.2 | 172.5 | -154.5 | 177.5 | -150.7 | -106.8 | 3.8 | 107.4 | Y37 H41 | Y37-R39 PolarHBondContact O-N 3.31Å; Y37-R39 VanDerWaalsContact O-N 3.17Å; R39-H41 PolarHBondContact O-N 3.13Å | ||
| 40 | S | 48.5 | Very low | 45.2 | Very low | 109 Ų | 109 | 139 Ų | 139 | 76% | 0.762 | 76% | 0.761 | S | S | * | * | trans | -60.7 | 116.1 | 174.6 | 52.1 | 0 | 0 | 0 | 0 | 109.4 | S38 | S38-S40 VanDerWaalsContact C-N 3.33Å; S38-S40 PolarHBondContact O-N 3.36Å | ||
| 41 | H | 49.2 | Very low | 45.5 | Very low | 165 Ų | 165 | 137.2 Ų | 137.2 | 76% | 0.764 | 76% | 0.759 | S | S | * | * | trans | -64.7 | 136.2 | 167.9 | -119.3 | -69.4 | 0 | 0 | 0 | 108.7 | R39 Y43 G44 | R39-H41 PolarHBondContact O-N 3.13Å; H41-Y43 PolarHBondContact O-N 3.36Å; H41-G44 PolarHBondContact O-N 3.08Å | ||
| 42 | P | 50.7 | Low | 46 | Very low | 109 Ų | 109 | 138 Ų | 138 | 71% | 0.708 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.6 | 16.4 | -172 | 26.3 | -33.9 | 0 | 0 | 0 | 115.8 | ||
| 43 | Y | 47.7 | Very low | 45.9 | Very low | 216 Ų | 216 | 141.3 Ų | 141.3 | 85% | 0.847 | 78% | 0.777 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -137.6 | 31.9 | 177 | -69 | -76.7 | 0 | 0 | 0 | 113.5 | H41 | H41-Y43 PolarHBondContact O-N 3.36Š|
| 44 | G | 41.5 | Very low | 46.1 | Very low | 67 Ų | 67 | 142 Ų | 142 | 69% | 0.691 | 78% | 0.783 | S | S | * | * | trans | -92 | 97.6 | 171 | 0 | 0 | 0 | 0 | 0 | 111.7 | H41 H46 | H41-G44 PolarHBondContact O-N 3.08Å; G44-H46 PolarHBondContact O-N 3.26Å | ||
| 45 | H | 43.5 | Very low | 46.5 | Very low | 191 Ų | 191 | 142.2 Ų | 142.2 | 88% | 0.884 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 117.8 | 170.7 | -94.5 | -80.8 | 0 | 0 | 0 | 110.8 | ||
| 46 | H | 44.5 | Very low | 46.7 | Very low | 158 Ų | 158 | 143.4 Ų | 143.4 | 73% | 0.731 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -85.6 | 116.3 | 168.5 | -172.8 | -94.4 | 0 | 0 | 0 | 108.9 | G44 | G44-H46 PolarHBondContact O-N 3.26Š|
| 47 | L | 40.6 | Very low | 46.2 | Very low | 172 Ų | 172 | 144.7 Ų | 144.7 | 90% | 0.901 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -93.6 | 122.2 | 166.9 | -77.6 | 159.6 | 0 | 0 | 0 | 108.2 | ||
| 48 | T | 45.4 | Very low | 46.2 | Very low | 92 Ų | 92 | 140.6 Ų | 140.6 | 56% | 0.564 | 78% | 0.779 | S | S | * | * | trans | -104.9 | 137.5 | -175.7 | -143.7 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 49 | N | 41.3 | Very low | 46.6 | Very low | 153 Ų | 153 | 143.9 Ų | 143.9 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | 79.1 | 124.1 | 146.2 | -58 | -4 | 0 | 0 | 0 | 122.7 | ||||
| 50 | G | 37.3 | Very low | 46.4 | Very low | 74 Ų | 74 | 136.8 Ų | 136.8 | 76% | 0.763 | 78% | 0.781 | S | S | * | * | trans | -164.5 | 134 | 149.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 51 | P | 55.8 | Low | 46.6 | Very low | 125 Ų | 125 | 141.6 Ų | 141.6 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | trans | -100.5 | 153.7 | -164.7 | 37.3 | -32.6 | 0 | 0 | 0 | 116.1 | ||||
| 52 | S | 48.7 | Very low | 46.4 | Very low | 111 Ų | 111 | 140 Ų | 140 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | 50.6 | 129.2 | 157.7 | -71.5 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 53 | L | 44.2 | Very low | 46.5 | Very low | 173 Ų | 173 | 138.4 Ų | 138.4 | 91% | 0.906 | 79% | 0.79 | S | S | * | * | -162.4 | 143.5 | 68.2 | -72.5 | 163.2 | 0 | 0 | 0 | 111.1 | |||||
| 54 | L | 45.4 | Very low | 46.5 | Very low | 166 Ų | 166 | 133.2 Ų | 133.2 | 87% | 0.869 | 78% | 0.78 | S | S | * | * | trans | -77.1 | 173.5 | 173.2 | -73.5 | 166.5 | 0 | 0 | 0 | 111.5 | ||||
| 55 | P | 54.3 | Low | 47.3 | Very low | 116 Ų | 116 | 137.7 Ų | 137.7 | 75% | 0.753 | 79% | 0.787 | S | S | * | * | cis | -147.3 | 168.9 | 21.4 | 38.9 | -16.3 | 0 | 0 | 0 | 119.2 | ||||
| 56 | H | 45.8 | Very low | 47.7 | Very low | 151 Ų | 151 | 138.7 Ų | 138.7 | 70% | 0.699 | 78% | 0.783 | S | S | * | * | trans | 82.7 | 102.4 | 148.9 | -139.1 | -88.4 | 0 | 0 | 0 | 120.3 | ||||
| 57 | N | 40.8 | Very low | 47.9 | Very low | 140 Ų | 140 | 136.8 Ų | 136.8 | 75% | 0.749 | 79% | 0.788 | S | S | * | * | -168.4 | 114.3 | 117.6 | -95.1 | -27 | 0 | 0 | 0 | 112.4 | |||||
| 58 | T | 47.6 | Very low | 48.6 | Very low | 108 Ų | 108 | 135 Ų | 135 | 66% | 0.663 | 78% | 0.784 | S | S | * | * | trans | 20.8 | 108 | 150.4 | 64.7 | 0 | 0 | 0 | 0 | 119.2 | A60 | T58-A60 PolarHBondContact O-N 3.02Š| ||
| 59 | L | 53.2 | Low | 49 | Very low | 180 Ų | 180 | 132.5 Ų | 132.5 | 94% | 0.942 | 78% | 0.777 | S | S | * | * | trans | 48.4 | 65.6 | 144.7 | -62 | 166.9 | 0 | 0 | 0 | 117 | R61 | L59-R61 PolarHBondContact O-N 3.05Š| ||
| 60 | A | 49.3 | Very low | 49.6 | Very low | 96 Ų | 96 | 132.1 Ų | 132.1 | 79% | 0.793 | 77% | 0.774 | S | S | * | * | trans | -85.4 | 102.4 | 157.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | T58 P62 | T58-A60 PolarHBondContact O-N 3.02Å; A60-P62 WeakPolarHBondContact O-CD 3.33Å | ||
| 61 | R | 52 | Low | 50.5 | Low | 210 Ų | 210 | 136 Ų | 136 | 79% | 0.792 | 78% | 0.777 | S | S | * | * | trans | -67.5 | 120 | 168.4 | -168.2 | 176.6 | -174.7 | -171.4 | 1.7 | 108.3 | L59 G63 | L59-R61 PolarHBondContact O-N 3.05Å; R61-G63 PolarHBondContact O-N 3.3Å; R61-G63 VanDerWaalsContact O-N 3.12Å | ||
| 62 | P | 44.8 | Very low | 50.3 | Low | 131 Ų | 131 | 140.2 Ų | 140.2 | 85% | 0.851 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.9 | 116.8 | 175.7 | -18.7 | 31.1 | 0 | 0 | 0 | 109.2 | A60 | A60-P62 WeakPolarHBondContact O-CD 3.33Š|
| 63 | G | 52.9 | Low | 50.7 | Low | 76 Ų | 76 | 145.2 Ų | 145.2 | 78% | 0.784 | 78% | 0.778 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 127.4 | -6.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 117 | R61 | R61-G63 PolarHBondContact O-N 3.3Å; R61-G63 VanDerWaalsContact O-N 3.12Å |
| 64 | V | 46.7 | Very low | 51.1 | Low | 107 Ų | 107 | 147.3 Ų | 147.3 | 65% | 0.648 | 77% | 0.774 | S | S | * | * | trans | -100.4 | 95.2 | 174 | -177.3 | 0 | 0 | 0 | 0 | 109.7 | R66 | V64-R66 PolarHBondContact O-N 3.29Å; V64-R66 VanDerWaalsContact O-N 3.09Å | ||
| 65 | I | 58.9 | Low | 51.3 | Low | 161 Ų | 161 | 146.6 Ų | 146.6 | 83% | 0.826 | 76% | 0.764 | S | S | * | * | trans | -68.2 | 105.2 | 166.5 | -62.7 | 174.4 | 0 | 0 | 0 | 107 | S67 | I65-S67 PolarHBondContact O-N 2.94Š| ||
| 66 | R | 52.3 | Low | 51 | Low | 213 Ų | 213 | 150.9 Ų | 150.9 | 80% | 0.804 | 77% | 0.765 | S | S | * | * | trans | -59.6 | 127.7 | 162.6 | -74.1 | 179.8 | 161.9 | -166.1 | -5 | 107.8 | V64 T68 | V64-R66 PolarHBondContact O-N 3.29Å; V64-R66 VanDerWaalsContact O-N 3.09Å; R66-T68 PolarHBondContact O-N 3.09Å | ||
| 67 | S | 49.5 | Very low | 51.4 | Low | 118 Ų | 118 | 149 Ų | 149 | 83% | 0.825 | 76% | 0.757 | S | S | * | * | trans | -64.3 | 74 | 174.9 | 35 | 0 | 0 | 0 | 0 | 111.7 | I65 G69 | I65-S67 PolarHBondContact O-N 2.94Å; S67-G69 PolarHBondContact O-N 3.45Å | ||
| 68 | T | 54.1 | Low | 51.9 | Low | 134 Ų | 134 | 150.6 Ų | 150.6 | 82% | 0.822 | 76% | 0.76 | S | S | * | * | trans | -86 | 55.7 | 155.2 | 45.7 | 0 | 0 | 0 | 0 | 108.6 | R66 | R66-T68 PolarHBondContact O-N 3.09Š| ||
| 69 | G | 53.9 | Low | 52.4 | Low | 40 Ų | 40 | 153.4 Ų | 153.4 | 41% | 0.412 | 77% | 0.765 | S | S | . | * | trans | -106.6 | -16.1 | -159.7 | 0 | 0 | 0 | 0 | 0 | 117.6 | S67 | S67-G69 PolarHBondContact O-N 3.45Š| ||
| 70 | D | 54.7 | Low | 52.7 | Low | 144 Ų | 144 | 146.8 Ų | 146.8 | 77% | 0.77 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -100 | -15.6 | -163.9 | -83.6 | -38.9 | 0 | 0 | 0 | 116.5 | ||
| 71 | L | 56.6 | Low | 54 | Low | 155 Ų | 155 | 145.8 Ų | 145.8 | 81% | 0.812 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -105.9 | -13 | -175.3 | -60.7 | -179.8 | 0 | 0 | 0 | 115 | ||
| 72 | R | 51.4 | Low | 55.3 | Low | 214 Ų | 214 | 141 Ų | 141 | 81% | 0.808 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -95.2 | -19.6 | 179.9 | -69.8 | -67.2 | -174.7 | 169.8 | -0.1 | 114.5 | ||
| 73 | R | 55.3 | Low | 57 | Low | 216 Ų | 216 | 142.3 Ų | 142.3 | 82% | 0.815 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -79.4 | -28.7 | 177.4 | -70.4 | -167.3 | 106.7 | 120.9 | 0.7 | 113.7 | ||
| 74 | R | 53.8 | Low | 58.6 | Low | 218 Ų | 218 | 143.5 Ų | 143.5 | 82% | 0.823 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -79.6 | -19.4 | -179.8 | -71.5 | -162.3 | 177 | 158.5 | 3.2 | 115 | ||
| 75 | K | 49.8 | Very low | 60.6 | Low | 151 Ų | 151 | 143.9 Ų | 143.9 | 66% | 0.657 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.1 | -9.3 | -176.2 | -166.7 | 165.4 | 179.7 | 173.7 | 0 | 114.5 | ||
| 76 | R | 48 | Very low | 62.2 | Low | 205 Ų | 205 | 142.3 Ų | 142.3 | 77% | 0.774 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.9 | 19.8 | 179.4 | -156.3 | -166.9 | 175.4 | 172.6 | -0.1 | 113 | ||
| 77 | E | 53.8 | Low | 64.1 | Low | 111 Ų | 111 | 138.2 Ų | 138.2 | 52% | 0.519 | 66% | 0.663 | S | S | . | * | S | Bend | trans | -95.9 | -20.6 | 171.4 | -75.4 | -176.2 | 150.8 | 0 | 0 | 111.7 | R92 | E77-R92 IonicContact OE1-NH2 3.89Š|
| 78 | E | 51.9 | Low | 66.3 | Low | 175 Ų | 175 | 136.8 Ų | 136.8 | 82% | 0.818 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.5 | -0.1 | -172.5 | -158.8 | 169.5 | -163.3 | 0 | 0 | 114.9 | ||
| 79 | Q | 57.8 | Low | 68.2 | Low | 166 Ų | 166 | 137.1 Ų | 137.1 | 78% | 0.776 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.8 | 16.4 | -178.7 | -67.8 | 173.5 | 27.1 | 0 | 0 | 113.3 | ||
| 80 | L | 60.2 | Low | 70.2 | Confident | 41 Ų | 41 | 137.3 Ų | 137.3 | 22% | 0.215 | 62% | 0.619 | C | S | . | * | S | Bend | trans | -91 | 131.1 | 170.8 | -70.5 | 147.3 | 0 | 0 | 0 | 106.7 | E84 R88 | L80-E84 HydrophobicContact CB-CB 4.4Å; L80-E84 HydrophobicContact CD2-CB 4.32Å; L80-E84 WeakPolarHBondContact CD2-OE2 3.46Å; L80-R88 VanDerWaalsContact CD2-NH2 3.28Å |
| 81 | T | 76.3 | Confident | 72.3 | Confident | 76 Ų | 76 | 137.7 Ų | 137.7 | 47% | 0.466 | 61% | 0.609 | S | S | . | * | trans | -56.8 | 146.7 | 174.6 | 45.3 | 0 | 0 | 0 | 0 | 109.2 | E83 E84 E85 | T81-E83 PolarHBondContact O-N 2.84Å; T81-E84 WeakPolarHBondContact O-CA 3.42Å; T81-E84 WeakPolarHBondContact O-CB 3.3Å; T81-E84 PolarHBondContact O-N 3.07Å; T81-E84 VanDerWaalsContact OG1-CG 3.29Å; T81-E84 WeakPolarHBondContact OG1-CG 3.27Å; T81-E85 PolarHBondContact O-N 2.77Å | ||
| 82 | P | 78.9 | Confident | 74.3 | Confident | 110 Ų | 110 | 137.5 Ų | 137.5 | 71% | 0.714 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -53.4 | -32.1 | -177.4 | 18.5 | -31.5 | 0 | 0 | 0 | 112.5 | E85 E86 | P82-E85 PolarHBondContact O-N 2.89Å; P82-E86 PolarHBondContact O-N 3.08Å |
| 83 | E | 79.8 | Confident | 76.5 | Confident | 158 Ų | 158 | 131 Ų | 131 | 74% | 0.738 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -66.3 | -39.1 | 173.9 | -167.3 | -177.2 | 170.5 | 0 | 0 | 113.6 | T81 K87 | T81-E83 PolarHBondContact O-N 2.84Å; E83-K87 PolarHBondContact O-N 3.24Å; E83-K87 VanDerWaalsContact O-N 3.07Å |
| 84 | E | 86.8 | Confident | 78.5 | Confident | 100 Ų | 100 | 128.9 Ų | 128.9 | 47% | 0.467 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -71.9 | -31.6 | 175.5 | -74.2 | -176.3 | 168.4 | 0 | 0 | 112.6 | L80 T81 R88 | L80-E84 HydrophobicContact CB-CB 4.4Å; L80-E84 HydrophobicContact CD2-CB 4.32Å; L80-E84 WeakPolarHBondContact CD2-OE2 3.46Å; T81-E84 WeakPolarHBondContact O-CA 3.42Å; T81-E84 WeakPolarHBondContact O-CB 3.3Å; T81-E84 PolarHBondContact O-N 3.07Å; T81-E84 VanDerWaalsContact OG1-CG 3.29Å; T81-E84 WeakPolarHBondContact OG1-CG 3.27Å; E84-R88 WeakPolarHBondContact O-CB 3.34Å; E84-R88 PolarHBondContact O-N 3.48Å; E84-R88 VanDerWaalsContact O-N 3.09Å; E84-R88 PolarHBondContact O-NH1 3.01Å |
| 85 | E | 89.6 | Confident | 80.6 | Confident | 115 Ų | 115 | 123.9 Ų | 123.9 | 54% | 0.537 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -66.1 | -45.3 | 173.2 | -174.7 | 169 | -156.3 | 0 | 0 | 111.3 | T81 P82 K87 R88 R89 | T81-E85 PolarHBondContact O-N 2.77Å; P82-E85 PolarHBondContact O-N 2.89Å; E85-K87 PolarHBondContact O-N 3.34Å; E85-R88 WeakPolarHBondContact O-CB 3.36Å; E85-R88 PolarHBondContact O-N 2.83Å; E85-R88 VanDerWaalsContact O-N 3.12Å; E85-R89 PolarHBondContact O-N 2.77Å |
| 86 | E | 90.8 | Very high | 83 | Confident | 128 Ų | 128 | 124.3 Ų | 124.3 | 60% | 0.598 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -61.5 | -45.5 | 176.2 | -175.1 | 171.1 | -159 | 0 | 0 | 111.7 | P82 R88 R89 V90 | P82-E86 PolarHBondContact O-N 3.08Å; E86-R88 PolarHBondContact O-N 2.86Å; E86-R89 WeakPolarHBondContact O-CA 3.32Å; E86-R89 WeakPolarHBondContact O-CB 3.48Å; E86-R89 PolarHBondContact O-N 2.68Å; E86-V90 WeakPolarHBondContact O-CG2 3.39Å; E86-V90 PolarHBondContact O-N 3.21Å |
| 87 | K | 94.1 | Very high | 85.4 | Confident | 127 Ų | 127 | 120.5 Ų | 120.5 | 55% | 0.552 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -57.8 | -36.7 | 174.5 | -172.2 | 176.5 | -172.3 | 171.8 | 0 | 112.2 | E83 E85 R91 | E83-K87 PolarHBondContact O-N 3.24Å; E83-K87 VanDerWaalsContact O-N 3.07Å; E85-K87 PolarHBondContact O-N 3.34Å; K87-R91 WeakPolarHBondContact O-CG 3.47Å; K87-R91 PolarHBondContact O-N 3.04Å |
| 88 | R | 94.3 | Very high | 87.5 | Confident | 88 Ų | 88 | 118 Ų | 118 | 33% | 0.332 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -70.2 | -40.7 | 175.1 | -177.6 | -178.8 | -72 | 95.9 | -5.1 | 111.5 | L80 E84 E85 E86 R91 R92 | L80-R88 VanDerWaalsContact CD2-NH2 3.28Å; E84-R88 WeakPolarHBondContact O-CB 3.34Å; E84-R88 PolarHBondContact O-N 3.48Å; E84-R88 VanDerWaalsContact O-N 3.09Å; E84-R88 PolarHBondContact O-NH1 3.01Å; E85-R88 WeakPolarHBondContact O-CB 3.36Å; E85-R88 PolarHBondContact O-N 2.83Å; E85-R88 VanDerWaalsContact O-N 3.12Å; E86-R88 PolarHBondContact O-N 2.86Å; R88-R91 PolarHBondContact O-N 3.46Å; R88-R92 WeakPolarHBondContact O-CG 3.42Å; R88-R92 PolarHBondContact O-N 2.8Å |
| 89 | R | 94.8 | Very high | 89.7 | Confident | 142 Ų | 142 | 111.4 Ų | 111.4 | 54% | 0.536 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -58.8 | -50.3 | 175.3 | -173.8 | -177.5 | 178.3 | -68.6 | -13.6 | 110.9 | E85 E86 R91 R92 E93 | E85-R89 PolarHBondContact O-N 2.77Å; E86-R89 WeakPolarHBondContact O-CA 3.32Å; E86-R89 WeakPolarHBondContact O-CB 3.48Å; E86-R89 PolarHBondContact O-N 2.68Å; R89-R91 VanDerWaalsContact C-N 3.31Å; R89-R91 PolarHBondContact O-N 3.17Å; R89-R92 PolarHBondContact O-N 3.09Å; R89-R92 VanDerWaalsContact O-N 3.1Å; R89-E93 IonicContact CZ-OE1 3.02Å; R89-E93 IonicContact CZ-OE2 3.92Å; R89-E93 IonicContact NH1-OE1 2.88Å; R89-E93 PolarHBondContact NH1-OE1 2.95Å; R89-E93 IonicContact NH1-OE2 3.03Å; R89-E93 PolarHBondContact NH1-OE2 3.19Å; R89-E93 IonicContact NH2-OE1 2.75Å; R89-E93 PolarHBondContact NH2-OE1 3.04Å; R89-E93 PolarHBondContact O-N 3.49Å |
| 90 | V | 96.4 | Very high | 91.7 | Very high | 44 Ų | 44 | 105.5 Ų | 105.5 | 27% | 0.267 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58.8 | -41 | 177.7 | 173.7 | 0 | 0 | 0 | 0 | 111.6 | E86 E93 R94 | E86-V90 WeakPolarHBondContact O-CG2 3.39Å; E86-V90 PolarHBondContact O-N 3.21Å; V90-E93 PolarHBondContact O-N 2.9Å; V90-R94 VanDerWaalsContact CG1-CZ 3.47Å; V90-R94 WeakPolarHBondContact O-CB 3.48Å; V90-R94 WeakPolarHBondContact O-CG 3.39Å; V90-R94 PolarHBondContact O-N 3.46Å |
| 91 | R | 97.6 | Very high | 93.5 | Very high | 151 Ų | 151 | 111.2 Ų | 111.2 | 57% | 0.57 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -65.4 | -41.8 | 175.4 | -76.1 | -161.6 | -178.8 | 108.7 | -9.5 | 112.8 | K87 R88 R89 E93 R94 N95 | K87-R91 WeakPolarHBondContact O-CG 3.47Å; K87-R91 PolarHBondContact O-N 3.04Å; R88-R91 PolarHBondContact O-N 3.46Å; R89-R91 VanDerWaalsContact C-N 3.31Å; R89-R91 PolarHBondContact O-N 3.17Å; R91-E93 VanDerWaalsContact C-N 3.35Å; R91-R94 PolarHBondContact O-N 3.36Å; R91-N95 WeakPolarHBondContact O-CB 2.77Å; R91-N95 PolarHBondContact O-N 2.77Å |
| 92 | R | 97.9 | Very high | 94.6 | Very high | 151 Ų | 151 | 111.8 Ų | 111.8 | 57% | 0.57 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.7 | -41.2 | 175.6 | -72.9 | 178.5 | -179.3 | 166.9 | -1.4 | 111.1 | E77 R88 R89 N95 K96 | E77-R92 IonicContact OE1-NH2 3.89Å; R88-R92 WeakPolarHBondContact O-CG 3.42Å; R88-R92 PolarHBondContact O-N 2.8Å; R89-R92 PolarHBondContact O-N 3.09Å; R89-R92 VanDerWaalsContact O-N 3.1Å; R92-N95 PolarHBondContact O-N 3.15Å; R92-K96 VanDerWaalsContact O-CB 3.27Å; R92-K96 WeakPolarHBondContact O-CB 3.16Å; R92-K96 PolarHBondContact O-N 3.2Å |
| 93 | E | 97.8 | Very high | 95.5 | Very high | 79 Ų | 79 | 115.3 Ų | 115.3 | 37% | 0.369 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65 | -46.4 | 176.4 | -73.8 | -176.2 | 154 | 0 | 0 | 111.9 | R89 V90 R91 N95 K96 L97 | R89-E93 IonicContact CZ-OE1 3.02Å; R89-E93 IonicContact CZ-OE2 3.92Å; R89-E93 IonicContact NH1-OE1 2.88Å; R89-E93 PolarHBondContact NH1-OE1 2.95Å; R89-E93 IonicContact NH1-OE2 3.03Å; R89-E93 PolarHBondContact NH1-OE2 3.19Å; R89-E93 IonicContact NH2-OE1 2.75Å; R89-E93 PolarHBondContact NH2-OE1 3.04Å; R89-E93 PolarHBondContact O-N 3.49Å; V90-E93 PolarHBondContact O-N 2.9Å; R91-E93 VanDerWaalsContact C-N 3.35Å; E93-N95 VanDerWaalsContact C-N 3.33Å; E93-N95 PolarHBondContact O-N 3.43Å; E93-K96 WeakPolarHBondContact O-CB 3.41Å; E93-K96 PolarHBondContact O-N 2.99Å; E93-L97 WeakPolarHBondContact O-CG 3.38Å; E93-L97 PolarHBondContact O-N 3.47Å |
| 94 | R | 98.6 | Very high | 96.4 | Very high | 171 Ų | 171 | 111.5 Ų | 111.5 | 65% | 0.645 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59 | -43.7 | 173.8 | -73.5 | 178.2 | -175.2 | 151.7 | 3.9 | 112 | V90 R91 L97 A98 | V90-R94 VanDerWaalsContact CG1-CZ 3.47Å; V90-R94 WeakPolarHBondContact O-CB 3.48Å; V90-R94 WeakPolarHBondContact O-CG 3.39Å; V90-R94 PolarHBondContact O-N 3.46Å; R91-R94 PolarHBondContact O-N 3.36Å; R94-L97 PolarHBondContact O-N 3.01Å; R94-A98 WeakPolarHBondContact O-CB 3.38Å; R94-A98 PolarHBondContact O-N 3.13Å |
| 95 | N | 98.3 | Very high | 97 | Very high | 113 Ų | 113 | 116 Ų | 116 | 60% | 0.604 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -66.4 | -38.6 | 176.8 | -176.7 | -99.8 | 0 | 0 | 0 | 112.2 | R91 R92 E93 A98 A99 | R91-N95 WeakPolarHBondContact O-CB 2.77Å; R91-N95 PolarHBondContact O-N 2.77Å; R92-N95 PolarHBondContact O-N 3.15Å; E93-N95 VanDerWaalsContact C-N 3.33Å; E93-N95 PolarHBondContact O-N 3.43Å; N95-A98 PolarHBondContact O-N 3.42Å; N95-A99 WeakPolarHBondContact O-CB 3.49Å; N95-A99 PolarHBondContact O-N 3.29Å |
| 96 | K | 98.6 | Very high | 97.4 | Very high | 160 Ų | 160 | 119.9 Ų | 119.9 | 70% | 0.696 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -59.7 | -46.7 | 174.7 | -176.7 | -178.7 | 179.7 | -175.7 | 0 | 111 | R92 E93 A99 A100 | R92-K96 VanDerWaalsContact O-CB 3.27Å; R92-K96 WeakPolarHBondContact O-CB 3.16Å; R92-K96 PolarHBondContact O-N 3.2Å; E93-K96 WeakPolarHBondContact O-CB 3.41Å; E93-K96 PolarHBondContact O-N 2.99Å; K96-A99 PolarHBondContact O-N 3.45Å; K96-A100 WeakPolarHBondContact O-CB 3.44Å; K96-A100 PolarHBondContact O-N 3.39Å |
| 97 | L | 98.4 | Very high | 97.8 | Very high | 125 Ų | 125 | 121.1 Ų | 121.1 | 65% | 0.654 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -65.4 | -42.6 | 176.2 | -67.2 | 174.9 | 0 | 0 | 0 | 111.8 | E93 R94 A99 A100 K101 | E93-L97 WeakPolarHBondContact O-CG 3.38Å; E93-L97 PolarHBondContact O-N 3.47Å; R94-L97 PolarHBondContact O-N 3.01Å; L97-A99 PolarHBondContact O-N 2.99Å; L97-A100 PolarHBondContact O-N 3.37Å; L97-K101 WeakPolarHBondContact O-CB 3.22Å; L97-K101 PolarHBondContact O-N 2.95Å |
| 98 | A | 98.6 | Very high | 98 | Very high | 58 Ų | 58 | 120.3 Ų | 120.3 | 48% | 0.479 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -62.7 | -41.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | R94 N95 K101 C102 | R94-A98 WeakPolarHBondContact O-CB 3.38Å; R94-A98 PolarHBondContact O-N 3.13Å; N95-A98 PolarHBondContact O-N 3.42Å; A98-K101 PolarHBondContact O-N 3.49Å; A98-C102 WeakPolarHBondContact O-CB 3.45Å; A98-C102 PolarHBondContact O-N 3.17Å |
| 99 | A | 98.6 | Very high | 98.2 | Very high | 36 Ų | 36 | 120.5 Ų | 120.5 | 30% | 0.298 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -66.2 | -42 | 176 | 0 | 0 | 0 | 0 | 0 | 111.9 | N95 K96 L97 C102 R103 | N95-A99 WeakPolarHBondContact O-CB 3.49Å; N95-A99 PolarHBondContact O-N 3.29Å; K96-A99 PolarHBondContact O-N 3.45Å; L97-A99 PolarHBondContact O-N 2.99Å; A99-C102 PolarHBondContact O-N 2.98Å; A99-R103 WeakPolarHBondContact O-CG 3.43Å; A99-R103 PolarHBondContact O-N 2.89Å |
| 100 | A | 98.6 | Very high | 98.4 | Very high | 43 Ų | 43 | 117.8 Ų | 117.8 | 36% | 0.355 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.7 | -47.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | K96 L97 C102 R103 N104 | K96-A100 WeakPolarHBondContact O-CB 3.44Å; K96-A100 PolarHBondContact O-N 3.39Å; L97-A100 PolarHBondContact O-N 3.37Å; A100-C102 VanDerWaalsContact C-N 3.34Å; A100-C102 PolarHBondContact O-N 2.88Å; A100-R103 PolarHBondContact O-N 2.86Å; A100-N104 PolarHBondContact O-N 3.49Å; A100-N104 PolarHBondContact O-OD1 3.4Å |
| 101 | K | 98.8 | Very high | 98.5 | Very high | 160 Ų | 160 | 121.2 Ų | 121.2 | 70% | 0.696 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -61.5 | -39.6 | 176.7 | -172.8 | 173.4 | -176.8 | 174.7 | 0 | 112.6 | L97 A98 N104 R105 | L97-K101 WeakPolarHBondContact O-CB 3.22Å; L97-K101 PolarHBondContact O-N 2.95Å; A98-K101 PolarHBondContact O-N 3.49Å; K101-N104 PolarHBondContact O-N 2.93Å; K101-R105 WeakPolarHBondContact O-CB 3.2Å; K101-R105 PolarHBondContact O-N 3.18Å |
| 102 | C | 98.8 | Very high | 98.6 | Very high | 89 Ų | 89 | 120 Ų | 120 | 60% | 0.601 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -62.5 | -45 | 175.5 | -176.2 | 0 | 0 | 0 | 0 | 111.6 | A98 A99 A100 R106 | A98-C102 WeakPolarHBondContact O-CB 3.45Å; A98-C102 PolarHBondContact O-N 3.17Å; A99-C102 PolarHBondContact O-N 2.98Å; A100-C102 VanDerWaalsContact C-N 3.34Å; A100-C102 PolarHBondContact O-N 2.88Å; C102-R106 WeakPolarHBondContact O-CB 3.38Å; C102-R106 PolarHBondContact O-N 3.38Å; C102-R106 VanDerWaalsContact O-N 3.08Å |
| 103 | R | 98.8 | Very high | 98.6 | Very high | 184 Ų | 184 | 117 Ų | 117 | 69% | 0.694 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -63.5 | -44 | 175.6 | -70.4 | 171.9 | -179.2 | 170.2 | -0.4 | 111.9 | A99 A100 R106 R107 | A99-R103 WeakPolarHBondContact O-CG 3.43Å; A99-R103 PolarHBondContact O-N 2.89Å; A100-R103 PolarHBondContact O-N 2.86Å; R103-R106 PolarHBondContact O-N 3.44Å; R103-R107 PolarHBondContact O-N 3.49Å |
| 104 | N | 98.6 | Very high | 98.7 | Very high | 77 Ų | 77 | 118.2 Ų | 118.2 | 41% | 0.412 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -63.2 | -49.6 | 177.8 | -76.2 | 12.3 | 0 | 0 | 0 | 111.2 | A100 K101 R106 R107 E108 | A100-N104 PolarHBondContact O-N 3.49Å; A100-N104 PolarHBondContact O-OD1 3.4Å; K101-N104 PolarHBondContact O-N 2.93Å; N104-R106 PolarHBondContact O-N 3.19Å; N104-R107 CarbonylContact O-C 3.58Å; N104-R107 WeakPolarHBondContact O-CA 3.43Å; N104-R107 WeakPolarHBondContact O-CB 3.44Å; N104-R107 PolarHBondContact O-N 3.23Å; N104-E108 WeakPolarHBondContact O-CB 3.46Å; N104-E108 WeakPolarHBondContact O-CG 3.18Å; N104-E108 PolarHBondContact O-N 2.83Å |
| 105 | R | 98.8 | Very high | 98.7 | Very high | 194 Ų | 194 | 111.7 Ų | 111.7 | 73% | 0.732 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -58.7 | -37.8 | 178.7 | -171.6 | 178 | -175.7 | -162 | 0.7 | 112.4 | K101 L109 | K101-R105 WeakPolarHBondContact O-CB 3.2Å; K101-R105 PolarHBondContact O-N 3.18Å; R105-L109 WeakPolarHBondContact O-CB 3.47Å; R105-L109 PolarHBondContact O-N 3.37Å |
| 106 | R | 98.8 | Very high | 98.7 | Very high | 197 Ų | 197 | 111.4 Ų | 111.4 | 74% | 0.743 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -66.2 | -43.3 | 175 | -174 | 176.1 | 179 | -172.8 | -0.7 | 111.4 | C102 R103 N104 L109 T110 | C102-R106 WeakPolarHBondContact O-CB 3.38Å; C102-R106 PolarHBondContact O-N 3.38Å; C102-R106 VanDerWaalsContact O-N 3.08Å; R103-R106 PolarHBondContact O-N 3.44Å; N104-R106 PolarHBondContact O-N 3.19Å; R106-L109 PolarHBondContact O-N 3.38Å; R106-T110 PolarHBondContact O-N 3.35Å; R106-T110 VanDerWaalsContact O-N 3.09Å; R106-T110 PolarHBondContact O-OG1 2.9Å; R106-T110 VanDerWaalsContact O-OG1 3.12Å |
| 107 | R | 98.8 | Very high | 98.7 | Very high | 154 Ų | 154 | 107 Ų | 107 | 58% | 0.581 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.4 | -50.7 | 177.2 | -173.3 | -170.8 | -60 | -177.4 | -1.7 | 111.4 | R103 N104 L109 T110 E111 | R103-R107 PolarHBondContact O-N 3.49Å; N104-R107 CarbonylContact O-C 3.58Å; N104-R107 WeakPolarHBondContact O-CA 3.43Å; N104-R107 WeakPolarHBondContact O-CB 3.44Å; N104-R107 PolarHBondContact O-N 3.23Å; R107-L109 VanDerWaalsContact C-N 3.28Å; R107-L109 PolarHBondContact O-N 3.44Å; R107-T110 CarbonylContact O-C 3.58Å; R107-T110 WeakPolarHBondContact O-CA 3.46Å; R107-T110 WeakPolarHBondContact O-CB 3.38Å; R107-T110 PolarHBondContact O-N 3.42Å; R107-E111 VanDerWaalsContact CD-OE1 3.22Å; R107-E111 WeakPolarHBondContact CD-OE1 3.46Å; R107-E111 HydrophobicContact CG-CG 4.33Å; R107-E111 VanDerWaalsContact CG-OE1 3.23Å; R107-E111 WeakPolarHBondContact CG-OE1 3.25Å; R107-E111 WeakPolarHBondContact O-CG 3.4Å; R107-E111 PolarHBondContact O-N 2.99Å |
| 108 | E | 98.6 | Very high | 98.7 | Very high | 111 Ų | 111 | 106 Ų | 106 | 52% | 0.519 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -57 | -40.9 | 177.6 | -71.5 | 164.3 | -161.5 | 0 | 0 | 111.5 | N104 E111 M112 | N104-E108 WeakPolarHBondContact O-CB 3.46Å; N104-E108 WeakPolarHBondContact O-CG 3.18Å; N104-E108 PolarHBondContact O-N 2.83Å; E108-E111 PolarHBondContact O-N 3.39Å; E108-M112 VanDerWaalsContact O-CB 3.3Å; E108-M112 WeakPolarHBondContact O-CB 3.4Å; E108-M112 PolarHBondContact O-N 3.4Å |
| 109 | L | 98.8 | Very high | 98.7 | Very high | 91 Ų | 91 | 109.9 Ų | 109.9 | 48% | 0.476 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.6 | -43.8 | 174.3 | 177.1 | 62.2 | 0 | 0 | 0 | 111.6 | R105 R106 R107 M112 L113 | R105-L109 WeakPolarHBondContact O-CB 3.47Å; R105-L109 PolarHBondContact O-N 3.37Å; R106-L109 PolarHBondContact O-N 3.38Å; R107-L109 VanDerWaalsContact C-N 3.28Å; R107-L109 PolarHBondContact O-N 3.44Å; L109-M112 PolarHBondContact O-N 3.31Å; L109-L113 HydrophobicContact CD1-CD1 4.08Å; L109-L113 HydrophobicContact CD1-CG 4.18Å; L109-L113 HydrophobicContact CG-CD1 4.13Å; L109-L113 VanDerWaalsContact O-CG 3.29Å; L109-L113 WeakPolarHBondContact O-CG 3.38Å; L109-L113 PolarHBondContact O-N 3.2Å |
| 110 | T | 98.6 | Very high | 98.7 | Very high | 86 Ų | 86 | 112.6 Ų | 112.6 | 53% | 0.528 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.3 | -44.4 | 176.6 | -60 | 0 | 0 | 0 | 0 | 111.6 | R106 R107 M112 L113 Q114 | R106-T110 PolarHBondContact O-N 3.35Å; R106-T110 VanDerWaalsContact O-N 3.09Å; R106-T110 PolarHBondContact O-OG1 2.9Å; R106-T110 VanDerWaalsContact O-OG1 3.12Å; R107-T110 CarbonylContact O-C 3.58Å; R107-T110 WeakPolarHBondContact O-CA 3.46Å; R107-T110 WeakPolarHBondContact O-CB 3.38Å; R107-T110 PolarHBondContact O-N 3.42Å; T110-M112 VanDerWaalsContact C-N 3.34Å; T110-M112 PolarHBondContact O-N 2.99Å; T110-L113 PolarHBondContact O-N 3.18Å; T110-Q114 VanDerWaalsContact O-CB 3.23Å; T110-Q114 WeakPolarHBondContact O-CB 3.46Å; T110-Q114 PolarHBondContact O-N 2.76Å |
| 111 | E | 98.8 | Very high | 98.7 | Very high | 116 Ų | 116 | 116.5 Ų | 116.5 | 54% | 0.542 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -61.7 | -41.7 | 177 | -72.5 | 169.1 | -176.5 | 0 | 0 | 111.5 | R107 E108 Q114 G115 | R107-E111 VanDerWaalsContact CD-OE1 3.22Å; R107-E111 WeakPolarHBondContact CD-OE1 3.46Å; R107-E111 HydrophobicContact CG-CG 4.33Å; R107-E111 VanDerWaalsContact CG-OE1 3.23Å; R107-E111 WeakPolarHBondContact CG-OE1 3.25Å; R107-E111 WeakPolarHBondContact O-CG 3.4Å; R107-E111 PolarHBondContact O-N 2.99Å; E108-E111 PolarHBondContact O-N 3.39Å; E111-Q114 PolarHBondContact O-N 2.96Å; E111-G115 PolarHBondContact O-N 3.32Å |
| 112 | M | 98.7 | Very high | 98.7 | Very high | 124 Ų | 124 | 115 Ų | 115 | 61% | 0.611 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.5 | -50.6 | 175.9 | -178.9 | -167.2 | -53.4 | 0 | 0 | 112.2 | E108 L109 T110 Q114 G115 E116 | E108-M112 VanDerWaalsContact O-CB 3.3Å; E108-M112 WeakPolarHBondContact O-CB 3.4Å; E108-M112 PolarHBondContact O-N 3.4Å; L109-M112 PolarHBondContact O-N 3.31Å; T110-M112 VanDerWaalsContact C-N 3.34Å; T110-M112 PolarHBondContact O-N 2.99Å; M112-Q114 VanDerWaalsContact C-N 3.29Å; M112-Q114 PolarHBondContact O-N 2.92Å; M112-G115 PolarHBondContact O-N 2.92Å; M112-E116 WeakPolarHBondContact O-CB 3.4Å; M112-E116 PolarHBondContact O-N 2.97Å |
| 113 | L | 98.8 | Very high | 98.7 | Very high | 90 Ų | 90 | 115.6 Ų | 115.6 | 47% | 0.471 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.2 | -37.4 | -179.6 | -69.4 | 173.5 | 0 | 0 | 0 | 111.7 | L109 T110 T117 | L109-L113 HydrophobicContact CD1-CD1 4.08Å; L109-L113 HydrophobicContact CD1-CG 4.18Å; L109-L113 HydrophobicContact CG-CD1 4.13Å; L109-L113 VanDerWaalsContact O-CG 3.29Å; L109-L113 WeakPolarHBondContact O-CG 3.38Å; L109-L113 PolarHBondContact O-N 3.2Å; T110-L113 PolarHBondContact O-N 3.18Å; L113-T117 PolarHBondContact O-N 3.42Å; L113-T117 PolarHBondContact O-OG1 2.71Å |
| 114 | Q | 98.8 | Very high | 98.7 | Very high | 104 Ų | 104 | 112.8 Ų | 112.8 | 49% | 0.486 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.6 | -48.8 | 174.6 | -176.3 | 61.4 | 33.8 | 0 | 0 | 110.7 | T110 E111 M112 E116 T117 E118 | T110-Q114 VanDerWaalsContact O-CB 3.23Å; T110-Q114 WeakPolarHBondContact O-CB 3.46Å; T110-Q114 PolarHBondContact O-N 2.76Å; E111-Q114 PolarHBondContact O-N 2.96Å; M112-Q114 VanDerWaalsContact C-N 3.29Å; M112-Q114 PolarHBondContact O-N 2.92Å; Q114-E116 VanDerWaalsContact C-N 3.34Å; Q114-E116 PolarHBondContact O-N 3Å; Q114-T117 WeakPolarHBondContact O-CB 3.41Å; Q114-T117 PolarHBondContact O-N 3.29Å; Q114-T117 VanDerWaalsContact O-N 3.16Å; Q114-E118 WeakPolarHBondContact CG-OE1 3.32Å; Q114-E118 PolarHBondContact NE2-OE1 3.32Å; Q114-E118 WeakPolarHBondContact O-CG 3.3Å; Q114-E118 PolarHBondContact O-N 2.96Å |
| 115 | G | 98.7 | Very high | 98.7 | Very high | 33 Ų | 33 | 111.5 Ų | 111.5 | 34% | 0.34 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.1 | -35.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | E111 M112 T117 K119 | E111-G115 PolarHBondContact O-N 3.32Å; M112-G115 PolarHBondContact O-N 2.92Å; G115-T117 VanDerWaalsContact C-N 3.35Å; G115-K119 WeakPolarHBondContact O-CB 3.23Å; G115-K119 PolarHBondContact O-N 2.93Å |
| 116 | E | 98.8 | Very high | 98.7 | Very high | 108 Ų | 108 | 106.7 Ų | 106.7 | 51% | 0.505 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.7 | -40 | 173 | -175.3 | 174.2 | -172.3 | 0 | 0 | 111.5 | M112 Q114 K119 L120 | M112-E116 WeakPolarHBondContact O-CB 3.4Å; M112-E116 PolarHBondContact O-N 2.97Å; Q114-E116 VanDerWaalsContact C-N 3.34Å; Q114-E116 PolarHBondContact O-N 3Å; E116-K119 PolarHBondContact O-N 3.43Å; E116-L120 HydrophobicContact CG-CD1 4.31Å; E116-L120 VanDerWaalsContact O-CG 3.32Å; E116-L120 WeakPolarHBondContact O-CG 3.49Å; E116-L120 PolarHBondContact O-N 2.96Å |
| 117 | T | 98.8 | Very high | 98.7 | Very high | 66 Ų | 66 | 101.5 Ų | 101.5 | 41% | 0.405 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.7 | -49.1 | 176 | -56.1 | 0 | 0 | 0 | 0 | 110.9 | L113 Q114 G115 K119 L120 E121 | L113-T117 PolarHBondContact O-N 3.42Å; L113-T117 PolarHBondContact O-OG1 2.71Å; Q114-T117 WeakPolarHBondContact O-CB 3.41Å; Q114-T117 PolarHBondContact O-N 3.29Å; Q114-T117 VanDerWaalsContact O-N 3.16Å; G115-T117 VanDerWaalsContact C-N 3.35Å; T117-K119 VanDerWaalsContact C-N 3.32Å; T117-K119 PolarHBondContact O-N 3.16Å; T117-L120 PolarHBondContact O-N 3.25Å; T117-E121 WeakPolarHBondContact O-CG 3.44Å; T117-E121 PolarHBondContact O-N 2.81Å |
| 118 | E | 98.7 | Very high | 98.7 | Very high | 105 Ų | 105 | 99 Ų | 99 | 49% | 0.491 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.4 | -43.9 | 178 | -72.6 | 168.4 | -164.9 | 0 | 0 | 111.6 | Q114 L120 E121 E122 | Q114-E118 WeakPolarHBondContact CG-OE1 3.32Å; Q114-E118 PolarHBondContact NE2-OE1 3.32Å; Q114-E118 WeakPolarHBondContact O-CG 3.3Å; Q114-E118 PolarHBondContact O-N 2.96Å; E118-L120 PolarHBondContact O-N 3.05Å; E118-E121 PolarHBondContact O-N 3.49Å; E118-E122 PolarHBondContact O-N 3.46Å |
| 119 | K | 98.7 | Very high | 98.7 | Very high | 139 Ų | 139 | 100.9 Ų | 100.9 | 60% | 0.604 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.9 | -45.1 | 176.4 | -176.1 | -174.6 | 175.2 | -169.4 | 0 | 112.3 | G115 E116 T117 E121 E122 E123 | G115-K119 WeakPolarHBondContact O-CB 3.23Å; G115-K119 PolarHBondContact O-N 2.93Å; E116-K119 PolarHBondContact O-N 3.43Å; T117-K119 VanDerWaalsContact C-N 3.32Å; T117-K119 PolarHBondContact O-N 3.16Å; K119-E121 VanDerWaalsContact C-N 3.3Å; K119-E121 PolarHBondContact O-N 3.4Å; K119-E122 PolarHBondContact O-N 3.48Å; K119-E123 WeakPolarHBondContact O-CB 3.37Å; K119-E123 PolarHBondContact O-N 2.95Å |
| 120 | L | 98.8 | Very high | 98.7 | Very high | 93 Ų | 93 | 101.9 Ų | 101.9 | 49% | 0.487 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -67.5 | -33.3 | 178.8 | -71.9 | 173.4 | 0 | 0 | 0 | 111.9 | E116 T117 E118 K124 | E116-L120 HydrophobicContact CG-CD1 4.31Å; E116-L120 VanDerWaalsContact O-CG 3.32Å; E116-L120 WeakPolarHBondContact O-CG 3.49Å; E116-L120 PolarHBondContact O-N 2.96Å; T117-L120 PolarHBondContact O-N 3.25Å; E118-L120 PolarHBondContact O-N 3.05Å; L120-K124 WeakPolarHBondContact O-CB 3.29Å; L120-K124 PolarHBondContact O-N 3.26Å |
| 121 | E | 98.7 | Very high | 98.7 | Very high | 125 Ų | 125 | 103.1 Ų | 103.1 | 58% | 0.584 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -67.6 | -40.6 | 174.2 | -73.8 | 179.9 | 176.1 | 0 | 0 | 112.1 | T117 E118 K119 A125 | T117-E121 WeakPolarHBondContact O-CG 3.44Å; T117-E121 PolarHBondContact O-N 2.81Å; E118-E121 PolarHBondContact O-N 3.49Å; K119-E121 VanDerWaalsContact C-N 3.3Å; K119-E121 PolarHBondContact O-N 3.4Å; E121-A125 WeakPolarHBondContact O-CB 3.45Å; E121-A125 PolarHBondContact O-N 2.98Å |
| 122 | E | 98.8 | Very high | 98.7 | Very high | 129 Ų | 129 | 103 Ų | 103 | 60% | 0.603 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.8 | -51.8 | 173.3 | -175.8 | 176.2 | -157 | 0 | 0 | 111.3 | E118 K119 K124 A125 D126 | E118-E122 PolarHBondContact O-N 3.46Å; K119-E122 PolarHBondContact O-N 3.48Å; E122-K124 VanDerWaalsContact C-N 3.27Å; E122-K124 PolarHBondContact O-N 3.48Å; E122-A125 WeakPolarHBondContact O-CB 3.22Å; E122-A125 PolarHBondContact O-N 2.93Å; E122-D126 PolarHBondContact O-N 3.2Å |
| 123 | E | 98.8 | Very high | 98.7 | Very high | 101 Ų | 101 | 100.5 Ų | 100.5 | 47% | 0.472 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.7 | -39.3 | 178.6 | -175.5 | 175.4 | 176.2 | 0 | 0 | 111.7 | K119 D126 L127 | K119-E123 WeakPolarHBondContact O-CB 3.37Å; K119-E123 PolarHBondContact O-N 2.95Å; E123-D126 PolarHBondContact O-N 2.95Å; E123-L127 HydrophobicContact CG-CD1 4.25Å; E123-L127 WeakPolarHBondContact O-CB 3.23Å; E123-L127 VanDerWaalsContact O-CG 3.3Å; E123-L127 WeakPolarHBondContact O-CG 3.36Å; E123-L127 PolarHBondContact O-N 3.37Å |
| 124 | K | 98.7 | Very high | 98.7 | Very high | 125 Ų | 125 | 100.9 Ų | 100.9 | 54% | 0.543 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.7 | -44.5 | 173.4 | 178.2 | -174.3 | 173.3 | -172.1 | 0 | 111.7 | L120 E122 D126 Q128 | L120-K124 WeakPolarHBondContact O-CB 3.29Å; L120-K124 PolarHBondContact O-N 3.26Å; E122-K124 VanDerWaalsContact C-N 3.27Å; E122-K124 PolarHBondContact O-N 3.48Å; K124-D126 VanDerWaalsContact C-N 3.33Å; K124-Q128 WeakPolarHBondContact O-CB 3.42Å; K124-Q128 VanDerWaalsContact O-CG 3.22Å; K124-Q128 WeakPolarHBondContact O-CG 3.47Å; K124-Q128 PolarHBondContact O-N 3.5Å |
| 125 | A | 98.8 | Very high | 98.7 | Very high | 50 Ų | 50 | 99.9 Ų | 99.9 | 41% | 0.413 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.3 | -40.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | E121 E122 Q128 K129 | E121-A125 WeakPolarHBondContact O-CB 3.45Å; E121-A125 PolarHBondContact O-N 2.98Å; E122-A125 WeakPolarHBondContact O-CB 3.22Å; E122-A125 PolarHBondContact O-N 2.93Å; A125-Q128 PolarHBondContact O-N 3.03Å; A125-K129 WeakPolarHBondContact O-CB 3.34Å; A125-K129 PolarHBondContact O-N 3.02Å |
| 126 | D | 98.8 | Very high | 98.7 | Very high | 93 Ų | 93 | 104.9 Ų | 104.9 | 50% | 0.497 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.3 | -48.1 | 176.8 | -75.7 | -21.5 | 0 | 0 | 0 | 112 | E122 E123 K124 Q128 K129 E130 | E122-D126 PolarHBondContact O-N 3.2Å; E123-D126 PolarHBondContact O-N 2.95Å; K124-D126 VanDerWaalsContact C-N 3.33Å; D126-Q128 VanDerWaalsContact C-N 3.31Å; D126-Q128 PolarHBondContact O-N 2.82Å; D126-K129 WeakPolarHBondContact O-CB 3.5Å; D126-K129 PolarHBondContact O-N 3.09Å; D126-K129 VanDerWaalsContact O-N 3.17Å; D126-E130 PolarHBondContact O-N 3.34Å |
| 127 | L | 98.8 | Very high | 98.7 | Very high | 89 Ų | 89 | 105 Ų | 105 | 47% | 0.466 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.5 | -39.6 | 176 | -71 | 173.6 | 0 | 0 | 0 | 111.9 | E123 K129 E130 I131 | E123-L127 HydrophobicContact CG-CD1 4.25Å; E123-L127 WeakPolarHBondContact O-CB 3.23Å; E123-L127 VanDerWaalsContact O-CG 3.3Å; E123-L127 WeakPolarHBondContact O-CG 3.36Å; E123-L127 PolarHBondContact O-N 3.37Å; L127-K129 VanDerWaalsContact C-N 3.34Å; L127-K129 PolarHBondContact O-N 3.11Å; L127-E130 PolarHBondContact O-N 3.26Å; L127-I131 VanDerWaalsContact O-CG1 3.25Å; L127-I131 WeakPolarHBondContact O-CG1 3.44Å; L127-I131 PolarHBondContact O-N 2.82Å |
| 128 | Q | 98.7 | Very high | 98.7 | Very high | 100 Ų | 100 | 106.5 Ų | 106.5 | 47% | 0.467 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.7 | -42.9 | 175.1 | -77.6 | 178.6 | -18.1 | 0 | 0 | 111.8 | K124 A125 D126 I131 E132 | K124-Q128 WeakPolarHBondContact O-CB 3.42Å; K124-Q128 VanDerWaalsContact O-CG 3.22Å; K124-Q128 WeakPolarHBondContact O-CG 3.47Å; K124-Q128 PolarHBondContact O-N 3.5Å; A125-Q128 PolarHBondContact O-N 3.03Å; D126-Q128 VanDerWaalsContact C-N 3.31Å; D126-Q128 PolarHBondContact O-N 2.82Å; Q128-I131 PolarHBondContact O-N 3.42Å; Q128-E132 WeakPolarHBondContact O-CG 3.33Å; Q128-E132 PolarHBondContact O-N 2.9Å |
| 129 | K | 98.8 | Very high | 98.7 | Very high | 151 Ų | 151 | 105.2 Ų | 105.2 | 66% | 0.657 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.2 | -39.5 | 176.4 | -176.2 | -177.3 | 176.7 | -173.4 | 0 | 112.2 | A125 D126 L127 E132 S133 | A125-K129 WeakPolarHBondContact O-CB 3.34Å; A125-K129 PolarHBondContact O-N 3.02Å; D126-K129 WeakPolarHBondContact O-CB 3.5Å; D126-K129 PolarHBondContact O-N 3.09Å; D126-K129 VanDerWaalsContact O-N 3.17Å; L127-K129 VanDerWaalsContact C-N 3.34Å; L127-K129 PolarHBondContact O-N 3.11Å; K129-E132 PolarHBondContact O-N 3.12Å; K129-S133 WeakPolarHBondContact O-CB 3.47Å; K129-S133 PolarHBondContact O-N 3.17Å |
| 130 | E | 98.8 | Very high | 98.6 | Very high | 113 Ų | 113 | 105.2 Ų | 105.2 | 53% | 0.528 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.7 | -46 | 175.3 | -173.3 | 176.5 | -178.8 | 0 | 0 | 111.3 | D126 L127 E132 S133 L134 | D126-E130 PolarHBondContact O-N 3.34Å; L127-E130 PolarHBondContact O-N 3.26Å; E130-E132 VanDerWaalsContact C-N 3.32Å; E130-E132 PolarHBondContact O-N 3.28Å; E130-S133 WeakPolarHBondContact O-CB 3.48Å; E130-S133 PolarHBondContact O-N 3.49Å; E130-S133 VanDerWaalsContact O-N 3.13Å; E130-L134 HydrophobicContact CG-CD1 4.08Å; E130-L134 HydrophobicContact CG-CG 4.45Å; E130-L134 WeakPolarHBondContact O-CG 3.3Å; E130-L134 PolarHBondContact O-N 3.48Å |
| 131 | I | 98.7 | Very high | 98.6 | Very high | 112 Ų | 112 | 104.9 Ų | 104.9 | 57% | 0.574 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -56.4 | -47.4 | 175 | -70.1 | 164.7 | 0 | 0 | 0 | 110.7 | L127 Q128 S133 L134 Q135 | L127-I131 VanDerWaalsContact O-CG1 3.25Å; L127-I131 WeakPolarHBondContact O-CG1 3.44Å; L127-I131 PolarHBondContact O-N 2.82Å; Q128-I131 PolarHBondContact O-N 3.42Å; I131-S133 VanDerWaalsContact C-N 3.31Å; I131-S133 PolarHBondContact O-N 3.12Å; I131-L134 PolarHBondContact O-N 3.09Å; I131-Q135 VanDerWaalsContact O-CB 3.32Å; I131-Q135 WeakPolarHBondContact O-CB 3.41Å; I131-Q135 PolarHBondContact O-N 3.02Å |
| 132 | E | 98.7 | Very high | 98.5 | Very high | 113 Ų | 113 | 103.2 Ų | 103.2 | 53% | 0.528 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.1 | -38.7 | 177.8 | -74.2 | -179 | -167.2 | 0 | 0 | 112.6 | Q128 K129 E130 K136 | Q128-E132 WeakPolarHBondContact O-CG 3.33Å; Q128-E132 PolarHBondContact O-N 2.9Å; K129-E132 PolarHBondContact O-N 3.12Å; E130-E132 VanDerWaalsContact C-N 3.32Å; E130-E132 PolarHBondContact O-N 3.28Å; E132-K136 VanDerWaalsContact O-CG 3.27Å; E132-K136 WeakPolarHBondContact O-CG 3.33Å; E132-K136 PolarHBondContact O-N 3.43Å |
| 133 | S | 98.7 | Very high | 98.4 | Very high | 72 Ų | 72 | 104.2 Ų | 104.2 | 50% | 0.503 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.9 | -48.4 | 177.1 | -172.8 | 0 | 0 | 0 | 0 | 111.3 | K129 E130 I131 Q135 K136 E137 | K129-S133 WeakPolarHBondContact O-CB 3.47Å; K129-S133 PolarHBondContact O-N 3.17Å; E130-S133 WeakPolarHBondContact O-CB 3.48Å; E130-S133 PolarHBondContact O-N 3.49Å; E130-S133 VanDerWaalsContact O-N 3.13Å; I131-S133 VanDerWaalsContact C-N 3.31Å; I131-S133 PolarHBondContact O-N 3.12Å; S133-Q135 VanDerWaalsContact C-N 3.34Å; S133-Q135 PolarHBondContact O-N 2.93Å; S133-K136 PolarHBondContact O-N 2.85Å; S133-E137 PolarHBondContact O-N 3.42Å |
| 134 | L | 98.8 | Very high | 98.3 | Very high | 97 Ų | 97 | 104 Ų | 104 | 51% | 0.508 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.9 | -39.5 | 178.6 | -70.3 | 173 | 0 | 0 | 0 | 111.6 | E130 I131 E137 K138 | E130-L134 HydrophobicContact CG-CD1 4.08Å; E130-L134 HydrophobicContact CG-CG 4.45Å; E130-L134 WeakPolarHBondContact O-CG 3.3Å; E130-L134 PolarHBondContact O-N 3.48Å; I131-L134 PolarHBondContact O-N 3.09Å; L134-E137 PolarHBondContact O-N 2.87Å; L134-K138 WeakPolarHBondContact O-CB 3.36Å; L134-K138 PolarHBondContact O-N 2.79Å |
| 135 | Q | 98.5 | Very high | 98.1 | Very high | 84 Ų | 84 | 102.6 Ų | 102.6 | 39% | 0.393 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.5 | -42.4 | 175.8 | -172.7 | 59.8 | 46.9 | 0 | 0 | 111.4 | I131 S133 E137 K138 D139 | I131-Q135 VanDerWaalsContact O-CB 3.32Å; I131-Q135 WeakPolarHBondContact O-CB 3.41Å; I131-Q135 PolarHBondContact O-N 3.02Å; S133-Q135 VanDerWaalsContact C-N 3.34Å; S133-Q135 PolarHBondContact O-N 2.93Å; Q135-E137 VanDerWaalsContact C-N 3.33Å; Q135-E137 PolarHBondContact O-N 3.27Å; Q135-K138 WeakPolarHBondContact O-CB 3.43Å; Q135-K138 PolarHBondContact O-N 3.47Å; Q135-D139 PolarHBondContact NE2-OD1 2.95Å; Q135-D139 WeakPolarHBondContact O-CB 3.43Å; Q135-D139 PolarHBondContact O-N 3.39Å |
| 136 | K | 98.7 | Very high | 97.9 | Very high | 137 Ų | 137 | 104.9 Ų | 104.9 | 60% | 0.596 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.1 | -39.9 | 174.7 | -74.5 | 166.7 | -175.3 | 161.9 | 0 | 112.4 | E132 S133 K140 | E132-K136 VanDerWaalsContact O-CG 3.27Å; E132-K136 WeakPolarHBondContact O-CG 3.33Å; E132-K136 PolarHBondContact O-N 3.43Å; S133-K136 PolarHBondContact O-N 2.85Å; K136-K140 WeakPolarHBondContact O-CB 3.36Å; K136-K140 PolarHBondContact O-N 3.33Å |
| 137 | E | 98.5 | Very high | 97.7 | Very high | 110 Ų | 110 | 103.3 Ų | 103.3 | 51% | 0.514 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67 | -44.3 | 176.8 | -175.6 | 173.1 | -174.6 | 0 | 0 | 111.6 | S133 L134 Q135 K140 L141 | S133-E137 PolarHBondContact O-N 3.42Å; L134-E137 PolarHBondContact O-N 2.87Å; Q135-E137 VanDerWaalsContact C-N 3.33Å; Q135-E137 PolarHBondContact O-N 3.27Å; E137-K140 WeakPolarHBondContact O-CB 3.41Å; E137-K140 PolarHBondContact O-N 3.01Å; E137-L141 HydrophobicContact CG-CD1 4.07Å; E137-L141 WeakPolarHBondContact O-CG 3.36Å; E137-L141 PolarHBondContact O-N 3.08Å |
| 138 | K | 98.3 | Very high | 97.5 | Very high | 99 Ų | 99 | 103.6 Ų | 103.6 | 43% | 0.43 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -55 | -53.5 | 172.7 | 178.5 | -166.1 | 161.4 | -174.7 | 0 | 110.7 | L134 Q135 K140 L141 E142 | L134-K138 WeakPolarHBondContact O-CB 3.36Å; L134-K138 PolarHBondContact O-N 2.79Å; Q135-K138 WeakPolarHBondContact O-CB 3.43Å; Q135-K138 PolarHBondContact O-N 3.47Å; K138-K140 VanDerWaalsContact C-N 3.26Å; K138-K140 PolarHBondContact O-N 3.21Å; K138-L141 PolarHBondContact O-N 2.99Å; K138-L141 VanDerWaalsContact O-N 3.09Å; K138-E142 VanDerWaalsContact CE-CD 3.4Å; K138-E142 WeakPolarHBondContact CE-OE1 3.27Å; K138-E142 HydrophobicContact CG-CG 4.35Å; K138-E142 IonicContact NZ-OE1 3.6Å; K138-E142 WeakPolarHBondContact O-CB 3.4Å; K138-E142 WeakPolarHBondContact O-CG 3.4Å; K138-E142 PolarHBondContact O-N 2.98Å |
| 139 | D | 98.2 | Very high | 97 | Very high | 78 Ų | 78 | 102.4 Ų | 102.4 | 42% | 0.417 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.8 | -37.8 | -177.9 | -64.9 | -16.1 | 0 | 0 | 0 | 111.4 | Q135 F143 | Q135-D139 PolarHBondContact NE2-OD1 2.95Å; Q135-D139 WeakPolarHBondContact O-CB 3.43Å; Q135-D139 PolarHBondContact O-N 3.39Å; D139-F143 VanDerWaalsContact O-CB 3.28Å; D139-F143 WeakPolarHBondContact O-CB 3.35Å; D139-F143 PolarHBondContact O-N 3.37Å |
| 140 | K | 98.2 | Very high | 96.5 | Very high | 138 Ų | 138 | 100.5 Ų | 100.5 | 60% | 0.6 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.1 | -45.5 | 174.3 | -179.6 | -174.4 | 176.2 | -172.9 | 0 | 111.8 | K136 E137 K138 F143 M144 | K136-K140 WeakPolarHBondContact O-CB 3.36Å; K136-K140 PolarHBondContact O-N 3.33Å; E137-K140 WeakPolarHBondContact O-CB 3.41Å; E137-K140 PolarHBondContact O-N 3.01Å; K138-K140 VanDerWaalsContact C-N 3.26Å; K138-K140 PolarHBondContact O-N 3.21Å; K140-F143 PolarHBondContact O-N 3.01Å; K140-M144 WeakPolarHBondContact O-CG 3.36Å; K140-M144 PolarHBondContact O-N 3.2Å |
| 141 | L | 97.9 | Very high | 95.9 | Very high | 86 Ų | 86 | 100.6 Ų | 100.6 | 45% | 0.45 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.5 | -43.5 | 178.5 | -69.9 | 166.2 | 0 | 0 | 0 | 111.2 | E137 K138 F143 M144 L145 | E137-L141 HydrophobicContact CG-CD1 4.07Å; E137-L141 WeakPolarHBondContact O-CG 3.36Å; E137-L141 PolarHBondContact O-N 3.08Å; K138-L141 PolarHBondContact O-N 2.99Å; K138-L141 VanDerWaalsContact O-N 3.09Å; L141-F143 VanDerWaalsContact C-N 3.34Å; L141-F143 PolarHBondContact O-N 3.4Å; L141-M144 HydrophobicContact CD2-CE 3.52Å; L141-M144 HydrophobicContact CG-CE 4.34Å; L141-M144 PolarHBondContact O-N 3.42Å; L141-L145 WeakPolarHBondContact O-CG 3.36Å; L141-L145 PolarHBondContact O-N 3.47Å |
| 142 | E | 96.3 | Very high | 95.3 | Very high | 90 Ų | 90 | 96.7 Ų | 96.7 | 42% | 0.421 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59 | -45.3 | 174.5 | -74.2 | -175.9 | 165.9 | 0 | 0 | 111.2 | K138 M144 L145 V146 | K138-E142 VanDerWaalsContact CE-CD 3.4Å; K138-E142 WeakPolarHBondContact CE-OE1 3.27Å; K138-E142 HydrophobicContact CG-CG 4.35Å; K138-E142 IonicContact NZ-OE1 3.6Å; K138-E142 WeakPolarHBondContact O-CB 3.4Å; K138-E142 WeakPolarHBondContact O-CG 3.4Å; K138-E142 PolarHBondContact O-N 2.98Å; E142-M144 PolarHBondContact O-N 2.96Å; E142-L145 PolarHBondContact O-N 3.5Å; E142-V146 VanDerWaalsContact O-CG2 3.29Å; E142-V146 WeakPolarHBondContact O-CG2 3.34Å; E142-V146 PolarHBondContact O-N 3.22Å |
| 143 | F | 97.6 | Very high | 94.6 | Very high | 150 Ų | 150 | 101.1 Ų | 101.1 | 66% | 0.658 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -58.5 | -46.1 | 175.5 | 178.7 | -97.4 | 0 | 0 | 0 | 112.2 | D139 K140 L141 L145 V146 A147 | D139-F143 VanDerWaalsContact O-CB 3.28Å; D139-F143 WeakPolarHBondContact O-CB 3.35Å; D139-F143 PolarHBondContact O-N 3.37Å; K140-F143 PolarHBondContact O-N 3.01Å; L141-F143 VanDerWaalsContact C-N 3.34Å; L141-F143 PolarHBondContact O-N 3.4Å; F143-L145 VanDerWaalsContact C-N 3.34Å; F143-L145 PolarHBondContact O-N 3.04Å; F143-V146 PolarHBondContact O-N 2.79Å; F143-A147 WeakPolarHBondContact O-CB 3.17Å; F143-A147 PolarHBondContact O-N 3.43Å |
| 144 | M | 96.8 | Very high | 93.6 | Very high | 97 Ų | 97 | 103.4 Ų | 103.4 | 48% | 0.478 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.6 | -40.2 | 177.2 | -71.5 | -170.9 | -58.6 | 0 | 0 | 112.2 | K140 L141 E142 A147 H148 | K140-M144 WeakPolarHBondContact O-CG 3.36Å; K140-M144 PolarHBondContact O-N 3.2Å; L141-M144 HydrophobicContact CD2-CE 3.52Å; L141-M144 HydrophobicContact CG-CE 4.34Å; L141-M144 PolarHBondContact O-N 3.42Å; E142-M144 PolarHBondContact O-N 2.96Å; M144-A147 PolarHBondContact O-N 3.4Å; M144-H148 WeakPolarHBondContact O-CB 3.49Å; M144-H148 PolarHBondContact O-N 3.33Å |
| 145 | L | 94.4 | Very high | 92.1 | Very high | 96 Ų | 96 | 102.5 Ų | 102.5 | 50% | 0.503 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.1 | -44.5 | 176.7 | -73.2 | 173.3 | 0 | 0 | 0 | 111.7 | L141 E142 F143 A147 H148 N149 | L141-L145 WeakPolarHBondContact O-CG 3.36Å; L141-L145 PolarHBondContact O-N 3.47Å; E142-L145 PolarHBondContact O-N 3.5Å; F143-L145 VanDerWaalsContact C-N 3.34Å; F143-L145 PolarHBondContact O-N 3.04Å; L145-A147 VanDerWaalsContact C-N 3.33Å; L145-A147 PolarHBondContact O-N 3.38Å; L145-H148 PolarHBondContact O-N 2.9Å; L145-N149 PolarHBondContact O-N 2.84Å; L145-N149 PolarHBondContact O-ND2 3.29Å; L145-N149 PolarHBondContact O-OD1 3.48Å |
| 146 | V | 94.3 | Very high | 90.5 | Very high | 97 Ų | 97 | 103.1 Ų | 103.1 | 59% | 0.588 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -60.4 | -44 | 176.5 | 170.6 | 0 | 0 | 0 | 0 | 110.8 | E142 F143 H148 N149 P150 | E142-V146 VanDerWaalsContact O-CG2 3.29Å; E142-V146 WeakPolarHBondContact O-CG2 3.34Å; E142-V146 PolarHBondContact O-N 3.22Å; F143-V146 PolarHBondContact O-N 2.79Å; V146-H148 VanDerWaalsContact C-N 3.31Å; V146-H148 PolarHBondContact O-N 3.43Å; V146-N149 PolarHBondContact O-N 2.85Å; V146-P150 WeakPolarHBondContact O-CD 3.48Å |
| 147 | A | 94.3 | Very high | 88.7 | Confident | 60 Ų | 60 | 102.7 Ų | 102.7 | 50% | 0.496 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64.6 | -33.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | F143 M144 L145 P150 | F143-A147 WeakPolarHBondContact O-CB 3.17Å; F143-A147 PolarHBondContact O-N 3.43Å; M144-A147 PolarHBondContact O-N 3.4Å; L145-A147 VanDerWaalsContact C-N 3.33Å; L145-A147 PolarHBondContact O-N 3.38Å; A147-P150 WeakPolarHBondContact O-CD 3.46Å |
| 148 | H | 93.7 | Very high | 86.8 | Confident | 96 Ų | 96 | 104.5 Ų | 104.5 | 44% | 0.444 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -78.7 | -31.2 | 178.8 | 175.3 | -101.6 | 0 | 0 | 0 | 113.7 | M144 L145 V146 P150 V151 C152 | M144-H148 WeakPolarHBondContact O-CB 3.49Å; M144-H148 PolarHBondContact O-N 3.33Å; L145-H148 PolarHBondContact O-N 2.9Å; V146-H148 VanDerWaalsContact C-N 3.31Å; V146-H148 PolarHBondContact O-N 3.43Å; H148-P150 VanDerWaalsContact C-CD 3.43Å; H148-V151 PolarHBondContact O-N 2.84Å; H148-C152 PolarHBondContact CE1-SG 3.13Å; H148-C152 PolarHBondContact O-N 2.86Å |
| 149 | N | 88.4 | Confident | 84.9 | Confident | 74 Ų | 74 | 104.6 Ų | 104.6 | 40% | 0.396 | 55% | 0.545 | S | S | . | . | G | 310 helix | trans | -46.1 | -45.3 | -177.1 | -76.1 | -22.5 | 0 | 0 | 0 | 115.9 | L145 V146 V151 C152 R159 | L145-N149 PolarHBondContact O-N 2.84Å; L145-N149 PolarHBondContact O-ND2 3.29Å; L145-N149 PolarHBondContact O-OD1 3.48Å; V146-N149 PolarHBondContact O-N 2.85Å; N149-V151 PolarHBondContact O-N 3.29Å; N149-C152 PolarHBondContact O-N 2.87Å; N149-R159 PolarHBondContact OD1-NH2 3.4Å |
| 150 | P | 87.9 | Confident | 82.9 | Confident | 112 Ų | 112 | 106.3 Ų | 106.3 | 73% | 0.727 | 55% | 0.551 | S | S | * | * | G | 310 helix | trans | -67.9 | -18.6 | -179.1 | 25.8 | -35.6 | 0 | 0 | 0 | 114.6 | V146 A147 H148 | V146-P150 WeakPolarHBondContact O-CD 3.48Å; A147-P150 WeakPolarHBondContact O-CD 3.46Å; H148-P150 VanDerWaalsContact C-CD 3.43Å |
| 151 | V | 87.1 | Confident | 80.7 | Confident | 114 Ų | 114 | 106.4 Ų | 106.4 | 69% | 0.691 | 55% | 0.553 | S | S | * | * | G | 310 helix | trans | -101.6 | -12.3 | -178.5 | -172.1 | 0 | 0 | 0 | 0 | 111.6 | H148 N149 K153 | H148-V151 PolarHBondContact O-N 2.84Å; N149-V151 PolarHBondContact O-N 3.29Å; V151-K153 PolarHBondContact O-N 3.15Å |
| 152 | C | 86.7 | Confident | 78.6 | Confident | 30 Ų | 30 | 109.8 Ų | 109.8 | 20% | 0.203 | 57% | 0.567 | C | S | . | * | trans | -73.4 | 123.9 | -176.4 | -167.8 | 0 | 0 | 0 | 0 | 111.6 | H148 N149 | H148-C152 PolarHBondContact CE1-SG 3.13Å; H148-C152 PolarHBondContact O-N 2.86Å; N149-C152 PolarHBondContact O-N 2.87Å | ||
| 153 | K | 82.8 | Confident | 76.6 | Confident | 206 Ų | 206 | 108.5 Ų | 108.5 | 90% | 0.896 | 57% | 0.568 | S | S | * | * | trans | -93.2 | 8.1 | 178.7 | -58.5 | -151.6 | 179.8 | -161.9 | 0 | 114.7 | V151 | V151-K153 PolarHBondContact O-N 3.15Š| ||
| 154 | L | 79 | Confident | 74.3 | Confident | 120 Ų | 120 | 105 Ų | 105 | 63% | 0.628 | 56% | 0.561 | S | S | * | * | S | Bend | trans | -82.5 | 138.7 | 178.4 | -69.5 | 169.1 | 0 | 0 | 0 | 110.4 | V156 | L154-V156 PolarHBondContact O-N 2.8Š|
| 155 | P | 67.6 | Low | 72.2 | Confident | 79 Ų | 79 | 107.5 Ų | 107.5 | 51% | 0.513 | 57% | 0.572 | S | S | . | * | trans | -58.2 | 134.9 | 177.8 | -19.6 | 30.3 | 0 | 0 | 0 | 111.7 | D157 E158 | P155-D157 PolarHBondContact O-N 3.39Å; P155-E158 PolarHBondContact O-N 3.3Å | ||
| 156 | V | 64.7 | Low | 70.3 | Confident | 96 Ų | 96 | 108.4 Ų | 108.4 | 58% | 0.582 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -64.2 | -23.5 | -176.6 | 178.4 | 0 | 0 | 0 | 0 | 112.4 | L154 R159 H160 | L154-V156 PolarHBondContact O-N 2.8Å; V156-R159 PolarHBondContact O-N 2.89Å; V156-H160 WeakPolarHBondContact CG1-CE1 3.47Å; V156-H160 WeakPolarHBondContact CG1-ND1 3.5Å; V156-H160 PolarHBondContact O-ND1 2.93Å |
| 157 | D | 60 | Low | 68.2 | Low | 129 Ų | 129 | 110.6 Ų | 110.6 | 69% | 0.69 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -69.3 | -33.3 | -176.8 | -68.3 | -51.2 | 0 | 0 | 0 | 113.8 | P155 R159 | P155-D157 PolarHBondContact O-N 3.39Å; D157-R159 VanDerWaalsContact C-N 3.33Å; D157-R159 PolarHBondContact O-N 3.42Å |
| 158 | E | 58.5 | Low | 66.2 | Low | 148 Ų | 148 | 115.1 Ų | 115.1 | 69% | 0.692 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -76.1 | -21.6 | 175.9 | -67.1 | -156.2 | 139.2 | 0 | 0 | 113 | P155 | P155-E158 PolarHBondContact O-N 3.3Å |
| 159 | R | 58.4 | Low | 64.1 | Low | 101 Ų | 101 | 117 Ų | 117 | 38% | 0.381 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -76.4 | -28.9 | 179.6 | -70.6 | -90.2 | -62.3 | -98.7 | -6.6 | 113.2 | N149 V156 D157 S163 | N149-R159 PolarHBondContact OD1-NH2 3.4Å; V156-R159 PolarHBondContact O-N 2.89Å; D157-R159 VanDerWaalsContact C-N 3.33Å; D157-R159 PolarHBondContact O-N 3.42Å; R159-S163 PolarHBondContact O-OG 3.03Å; R159-S163 VanDerWaalsContact O-OG 3.04Å |
| 160 | H | 56.5 | Low | 62.3 | Low | 114 Ų | 114 | 119.6 Ų | 119.6 | 53% | 0.528 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -88 | -24.4 | -176.7 | -73.2 | 86.6 | 0 | 0 | 0 | 113.4 | V156 Q162 S163 S164 | V156-H160 WeakPolarHBondContact CG1-CE1 3.47Å; V156-H160 WeakPolarHBondContact CG1-ND1 3.5Å; V156-H160 PolarHBondContact O-ND1 2.93Å; H160-Q162 PolarHBondContact O-N 3.19Å; H160-S163 WeakPolarHBondContact CA-OG 3.47Å; H160-S163 PolarHBondContact O-OG 2.75Å; H160-S164 WeakPolarHBondContact O-CB 3.46Å; H160-S164 PolarHBondContact O-N 2.88Å; H160-S164 PolarHBondContact O-OG 3.49Å |
| 161 | Q | 52.7 | Low | 60.4 | Low | 139 Ų | 139 | 121.5 Ų | 121.5 | 65% | 0.65 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -66.7 | -36.5 | 178.3 | -131.1 | 102.7 | 65.6 | 0 | 0 | 112.2 | H165 | Q161-H165 PolarHBondContact O-CD2 3.12Å |
| 162 | Q | 52.4 | Low | 58.5 | Low | 158 Ų | 158 | 124.3 Ų | 124.3 | 74% | 0.738 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -76 | -34.7 | 179.7 | -69.5 | -178.2 | 0.5 | 0 | 0 | 113.6 | H160 | H160-Q162 PolarHBondContact O-N 3.19Å |
| 163 | S | 54 | Low | 56.4 | Low | 63 Ų | 63 | 128.1 Ų | 128.1 | 44% | 0.441 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -74.5 | -31.4 | 178.5 | 35.2 | 0 | 0 | 0 | 0 | 112.6 | R159 H160 H165 H166 Q167 | R159-S163 PolarHBondContact O-OG 3.03Å; R159-S163 VanDerWaalsContact O-OG 3.04Å; H160-S163 WeakPolarHBondContact CA-OG 3.47Å; H160-S163 PolarHBondContact O-OG 2.75Å; S163-H165 VanDerWaalsContact C-N 3.35Å; S163-H165 PolarHBondContact O-N 3.41Å; S163-H166 PolarHBondContact O-N 2.92Å; S163-Q167 PolarHBondContact O-N 3.28Å; S163-Q167 VanDerWaalsContact O-N 3.09Å |
| 164 | S | 50.6 | Low | 54.4 | Low | 75 Ų | 75 | 124.2 Ų | 124.2 | 52% | 0.524 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -63.5 | -36.3 | 175 | -56.4 | 0 | 0 | 0 | 0 | 113 | H160 | H160-S164 WeakPolarHBondContact O-CB 3.46Å; H160-S164 PolarHBondContact O-N 2.88Å; H160-S164 PolarHBondContact O-OG 3.49Å |
| 165 | H | 52.3 | Low | 52.9 | Low | 151 Ų | 151 | 124.1 Ų | 124.1 | 70% | 0.699 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -71.1 | -28.3 | 175.2 | -84.9 | -71.2 | 0 | 0 | 0 | 113.2 | Q161 S163 | Q161-H165 PolarHBondContact O-CD2 3.12Å; S163-H165 VanDerWaalsContact C-N 3.35Å; S163-H165 PolarHBondContact O-N 3.41Å |
| 166 | H | 54.4 | Low | 51.9 | Low | 115 Ų | 115 | 128 Ų | 128 | 53% | 0.532 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -83.2 | -29 | -179.9 | -141 | 65.1 | 0 | 0 | 0 | 112.8 | S163 Q168 Q169 Q170 | S163-H166 PolarHBondContact O-N 2.92Å; H166-Q168 VanDerWaalsContact C-N 3.31Å; H166-Q168 PolarHBondContact O-N 2.86Å; H166-Q169 PolarHBondContact O-N 3.04Å; H166-Q170 PolarHBondContact O-N 2.97Å |
| 167 | Q | 51.3 | Low | 50.7 | Low | 143 Ų | 143 | 131.7 Ų | 131.7 | 67% | 0.668 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -70.6 | -25.6 | 178.1 | -159.2 | 173.3 | 58.7 | 0 | 0 | 112.9 | S163 Q169 | S163-Q167 PolarHBondContact O-N 3.28Å; S163-Q167 VanDerWaalsContact O-N 3.09Å; Q167-Q169 VanDerWaalsContact C-N 3.3Å; Q167-Q169 PolarHBondContact O-N 3.32Å |
| 168 | Q | 50.7 | Low | 50 | Low | 154 Ų | 154 | 133.2 Ų | 133.2 | 72% | 0.72 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -72.8 | -22.2 | 173.7 | -163.9 | 168.5 | 54 | 0 | 0 | 112.8 | H166 | H166-Q168 VanDerWaalsContact C-N 3.31Å; H166-Q168 PolarHBondContact O-N 2.86Å |
| 169 | Q | 50.9 | Low | 49.4 | Very low | 135 Ų | 135 | 130.8 Ų | 130.8 | 63% | 0.631 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -89 | -26.6 | 179.2 | -159.9 | 164.9 | 58.8 | 0 | 0 | 113.1 | H166 Q167 Q171 Q172 | H166-Q169 PolarHBondContact O-N 3.04Å; Q167-Q169 VanDerWaalsContact C-N 3.3Å; Q167-Q169 PolarHBondContact O-N 3.32Å; Q169-Q171 VanDerWaalsContact C-N 3.33Å; Q169-Q171 PolarHBondContact O-N 2.86Å; Q169-Q172 PolarHBondContact O-N 3.1Å |
| 170 | Q | 49.8 | Very low | 48.5 | Very low | 130 Ų | 130 | 133.2 Ų | 133.2 | 61% | 0.607 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -73.9 | -16.6 | 176.4 | -75.3 | -176.9 | 16.2 | 0 | 0 | 114.4 | H166 Q172 C173 | H166-Q170 PolarHBondContact O-N 2.97Å; Q170-Q172 PolarHBondContact O-N 2.92Å; Q170-C173 PolarHBondContact O-N 3.42Å |
| 171 | Q | 49.2 | Very low | 48.3 | Very low | 152 Ų | 152 | 138 Ų | 138 | 71% | 0.71 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.7 | -6.4 | 172 | -74.6 | 178.7 | 30.9 | 0 | 0 | 113.7 | Q169 | Q169-Q171 VanDerWaalsContact C-N 3.33Å; Q169-Q171 PolarHBondContact O-N 2.86Å |
| 172 | Q | 46.3 | Very low | 47.9 | Very low | 172 Ų | 172 | 137.2 Ų | 137.2 | 80% | 0.804 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.2 | -9.4 | 172.3 | -68.3 | -169.7 | 6 | 0 | 0 | 114.2 | Q169 Q170 N174 | Q169-Q172 PolarHBondContact O-N 3.1Å; Q170-Q172 PolarHBondContact O-N 2.92Å; Q172-N174 PolarHBondContact O-N 2.9Å |
| 173 | C | 41.9 | Very low | 47.3 | Very low | 110 Ų | 110 | 134.2 Ų | 134.2 | 74% | 0.743 | 70% | 0.696 | S | S | * | * | trans | -98.9 | 65.6 | 171.8 | -64.4 | 0 | 0 | 0 | 0 | 109.6 | Q170 | Q170-C173 PolarHBondContact O-N 3.42Š| ||
| 174 | N | 41.9 | Very low | 47 | Very low | 124 Ų | 124 | 139 Ų | 139 | 66% | 0.663 | 72% | 0.716 | S | S | * | * | trans | -57.1 | 141 | 160.1 | -80.7 | -40.8 | 0 | 0 | 0 | 108.3 | Q172 L176 | Q172-N174 PolarHBondContact O-N 2.9Å; N174-L176 VanDerWaalsContact C-N 3.32Å; N174-L176 PolarHBondContact O-N 3.32Å | ||
| 175 | P | 47.5 | Very low | 46.6 | Very low | 119 Ų | 119 | 142.2 Ų | 142.2 | 77% | 0.773 | 73% | 0.728 | S | S | * | * | trans | -61.9 | 104.1 | 165.8 | 26.3 | -29.4 | 0 | 0 | 0 | 106 | Q177 | P175-Q177 PolarHBondContact O-N 3.49Š| ||
| 176 | L | 44.9 | Very low | 46.3 | Very low | 161 Ų | 161 | 140.8 Ų | 140.8 | 84% | 0.843 | 73% | 0.732 | S | S | * | * | trans | -56.1 | 112.4 | 170.5 | -73.7 | 169 | 0 | 0 | 0 | 105.3 | N174 L178 | N174-L176 VanDerWaalsContact C-N 3.32Å; N174-L176 PolarHBondContact O-N 3.32Å; L176-L178 PolarHBondContact O-N 3.38Å | ||
| 177 | Q | 40.7 | Very low | 45.8 | Very low | 172 Ų | 172 | 146.7 Ų | 146.7 | 80% | 0.804 | 75% | 0.749 | S | S | * | * | trans | -54.6 | 121.5 | 169.1 | -64.2 | -158.1 | 1.6 | 0 | 0 | 106.2 | P175 T179 | P175-Q177 PolarHBondContact O-N 3.49Å; Q177-T179 WeakPolarHBondContact O-CG2 3.29Å; Q177-T179 PolarHBondContact O-N 3.09Å | ||
| 178 | L | 44.7 | Very low | 45 | Very low | 162 Ų | 162 | 144.1 Ų | 144.1 | 85% | 0.848 | 75% | 0.753 | S | S | * | * | trans | -66.8 | 68.7 | 170 | -84.5 | 136.6 | 0 | 0 | 0 | 108.4 | L176 M180 | L176-L178 PolarHBondContact O-N 3.38Å; L178-M180 HydrophobicContact CD2-CE 4.47Å; L178-M180 PolarHBondContact O-N 3.25Å | ||
| 179 | T | 45.8 | Very low | 44.2 | Very low | 96 Ų | 96 | 145 Ų | 145 | 59% | 0.589 | 76% | 0.756 | S | S | * | * | trans | -72.7 | 107.4 | 161.3 | 157.7 | 0 | 0 | 0 | 0 | 105.7 | Q177 R181 | Q177-T179 WeakPolarHBondContact O-CG2 3.29Å; Q177-T179 PolarHBondContact O-N 3.09Å; T179-R181 PolarHBondContact O-N 3.21Å | ||
| 180 | M | 40.1 | Very low | 43.5 | Very low | 153 Ų | 153 | 146.5 Ų | 146.5 | 75% | 0.754 | 77% | 0.766 | S | S | * | * | trans | -59.2 | 91.1 | 167.3 | -66.8 | -81.3 | 80.5 | 0 | 0 | 108.3 | L178 | L178-M180 HydrophobicContact CD2-CE 4.47Å; L178-M180 PolarHBondContact O-N 3.25Å | ||
| 181 | R | 51.3 | Low | 42.7 | Very low | 213 Ų | 213 | 147.2 Ų | 147.2 | 80% | 0.804 | 77% | 0.774 | S | S | * | * | trans | -79 | 127 | 168.8 | -78.4 | -175.2 | 166.9 | -169.9 | -3.2 | 108.1 | T179 S183 | T179-R181 PolarHBondContact O-N 3.21Å; R181-S183 PolarHBondContact O-N 3.27Å; R181-S183 VanDerWaalsContact O-N 3.11Å | ||
| 182 | P | 45.2 | Very low | 41.8 | Very low | 123 Ų | 123 | 148.5 Ų | 148.5 | 80% | 0.799 | 78% | 0.78 | S | S | * | * | trans | -66.7 | 113.9 | 171.6 | 25.8 | -29.7 | 0 | 0 | 0 | 108.8 | L184 | P182-L184 PolarHBondContact O-N 3.21Š| ||
| 183 | S | 38.9 | Very low | 41.2 | Very low | 95 Ų | 95 | 146.9 Ų | 146.9 | 66% | 0.664 | 78% | 0.781 | S | S | * | * | trans | -75.1 | 114.2 | 177.7 | -173.2 | 0 | 0 | 0 | 0 | 110.2 | R181 | R181-S183 PolarHBondContact O-N 3.27Å; R181-S183 VanDerWaalsContact O-N 3.11Å | ||
| 184 | L | 49.1 | Very low | 40.8 | Very low | 165 Ų | 165 | 147 Ų | 147 | 86% | 0.864 | 78% | 0.779 | S | S | * | * | trans | -103.6 | 95.6 | 157.9 | -69.3 | 175.5 | 0 | 0 | 0 | 107 | P182 | P182-L184 PolarHBondContact O-N 3.21Š| ||
| 185 | N | 41.4 | Very low | 40.7 | Very low | 142 Ų | 142 | 147.9 Ų | 147.9 | 76% | 0.759 | 79% | 0.788 | S | S | * | * | trans | -112.1 | 123.1 | 170.3 | -88.5 | 13.5 | 0 | 0 | 0 | 111.4 | ||||
| 186 | P | 47 | Very low | 40.1 | Very low | 121 Ų | 121 | 151 Ų | 151 | 79% | 0.786 | 79% | 0.789 | S | S | * | * | trans | -85.3 | 115 | 153.1 | 17 | -1.4 | 0 | 0 | 0 | 110.3 | ||||
| 187 | R | 42.4 | Very low | 39.4 | Very low | 238 Ų | 238 | 152.5 Ų | 152.5 | 90% | 0.898 | 79% | 0.792 | S | S | * | * | trans | 9.6 | 110.8 | 146.1 | -166.3 | 172.6 | -177.7 | 162.5 | 0.1 | 118 | ||||
| 188 | A | 34.9 | Very low | 39.2 | Very low | 90 Ų | 90 | 152.9 Ų | 152.9 | 74% | 0.744 | 79% | 0.794 | S | S | * | * | trans | -148.3 | 108.3 | 153.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 189 | Q | 34.1 | Very low | 39.5 | Very low | 171 Ų | 171 | 149.5 Ų | 149.5 | 80% | 0.799 | 78% | 0.782 | S | S | * | * | 99.2 | 88.7 | 100.4 | -162 | 170.5 | 11.9 | 0 | 0 | 110.8 | |||||
| 190 | M | 35.3 | Very low | 38.8 | Very low | 167 Ų | 167 | 152.8 Ų | 152.8 | 82% | 0.823 | 79% | 0.79 | S | S | * | * | trans | -78.1 | 124.7 | 171.5 | 56.5 | -153.2 | 135.2 | 0 | 0 | 109.9 | ||||
| 191 | N | 34.5 | Very low | 38.5 | Very low | 146 Ų | 146 | 151.8 Ų | 151.8 | 78% | 0.781 | 79% | 0.788 | S | S | * | * | trans | -108.3 | 121 | 161.9 | -77.7 | -33.1 | 0 | 0 | 0 | 108 | ||||
| 192 | Q | 30.4 | Very low | 37.9 | Very low | 178 Ų | 178 | 150 Ų | 150 | 83% | 0.832 | 79% | 0.792 | S | S | * | * | trans | -70.6 | 136.2 | 170.3 | -78.5 | 178.1 | -2.6 | 0 | 0 | 110.1 | ||||
| 193 | V | 32.9 | Very low | 37.8 | Very low | 139 Ų | 139 | 152.9 Ų | 152.9 | 84% | 0.842 | 80% | 0.795 | S | S | * | * | trans | -112.6 | 115.8 | 151.5 | 176 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 194 | V | 34.1 | Very low | 37.8 | Very low | 113 Ų | 113 | 158.1 Ų | 158.1 | 69% | 0.685 | 81% | 0.809 | S | S | * | * | trans | -71.5 | 122.7 | 175.8 | 169.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 195 | V | 38.5 | Very low | 37.1 | Very low | 142 Ų | 142 | 158.8 Ų | 158.8 | 86% | 0.861 | 81% | 0.808 | S | S | * | * | trans | -127.2 | 119.6 | 149 | 179 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 196 | K | 34.8 | Very low | 36.7 | Very low | 183 Ų | 183 | 158.1 Ų | 158.1 | 80% | 0.796 | 81% | 0.809 | S | S | * | * | trans | -80.3 | 127.4 | -174.8 | 175.3 | -177.4 | -179.6 | -179.7 | 0 | 110 | ||||
| 197 | Q | 30.7 | Very low | 36.1 | Very low | 194 Ų | 194 | 155.8 Ų | 155.8 | 91% | 0.907 | 81% | 0.807 | S | S | * | * | trans | -163.6 | 120.9 | 143.4 | -109.7 | 168.4 | 23.7 | 0 | 0 | 110.5 | ||||
| 198 | E | 36.5 | Very low | 35.8 | Very low | 179 Ų | 179 | 154.2 Ų | 154.2 | 84% | 0.836 | 81% | 0.807 | S | S | * | * | trans | -116 | 170.2 | 160.8 | -93.4 | -128 | 154.3 | 0 | 0 | 106.4 | ||||
| 199 | P | 50.7 | Low | 36.1 | Very low | 92 Ų | 92 | 155.3 Ų | 155.3 | 60% | 0.597 | 81% | 0.806 | S | S | * | * | cis | -136.8 | 179.7 | 10.7 | 28.5 | -4.1 | 0 | 0 | 0 | 114.7 | ||||
| 200 | E | 32.1 | Very low | 36.2 | Very low | 164 Ų | 164 | 156.2 Ų | 156.2 | 77% | 0.766 | 81% | 0.81 | S | S | * | * | 176.2 | 112.8 | 113.8 | -74.6 | -114.7 | 146.1 | 0 | 0 | 111.4 | |||||
| 201 | D | 34.2 | Very low | 36.3 | Very low | 132 Ų | 132 | 159.1 Ų | 159.1 | 71% | 0.706 | 81% | 0.812 | S | S | * | * | trans | 43.8 | 117.2 | 137.2 | -52.2 | -25.6 | 0 | 0 | 0 | 122.5 | ||||
| 202 | I | 38.9 | Very low | 36.5 | Very low | 175 Ų | 175 | 157.1 Ų | 157.1 | 90% | 0.897 | 81% | 0.809 | S | S | * | * | -151.4 | 126.8 | 120.2 | -42 | 178.9 | 0 | 0 | 0 | 109.2 | |||||
| 203 | E | 43.2 | Very low | 36.8 | Very low | 184 Ų | 184 | 153.2 Ų | 153.2 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | trans | -75.6 | 142.1 | 176.5 | -56.8 | -171.2 | 149.5 | 0 | 0 | 112.9 | ||||
| 204 | E | 37.2 | Very low | 37.6 | Very low | 205 Ų | 205 | 153.8 Ų | 153.8 | 96% | 0.958 | 79% | 0.794 | S | S | * | * | -163 | 149.5 | 128 | -124.4 | -175 | 174.1 | 0 | 0 | 112.1 | |||||
| 205 | E | 34.8 | Very low | 38.3 | Very low | 179 Ų | 179 | 156.6 Ų | 156.6 | 84% | 0.836 | 80% | 0.797 | S | S | * | * | trans | -101.8 | 166.3 | -152.6 | -160.8 | -152 | 163.6 | 0 | 0 | 113.2 | ||||
| 206 | V | 34.1 | Very low | 38.5 | Very low | 128 Ų | 128 | 155.6 Ų | 155.6 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | trans | 105 | 112 | 152.6 | -171.6 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 207 | G | 33.8 | Very low | 38.8 | Very low | 72 Ų | 72 | 153.9 Ų | 153.9 | 74% | 0.742 | 79% | 0.792 | S | S | * | * | trans | 135 | 83.3 | 142.4 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 208 | K | 36.2 | Very low | 39.1 | Very low | 206 Ų | 206 | 150.4 Ų | 150.4 | 90% | 0.896 | 79% | 0.787 | S | S | * | * | trans | -125.4 | 152.9 | 155 | -83.5 | 179.5 | -174.6 | 169.5 | 0 | 107 | ||||
| 209 | P | 40.3 | Very low | 39.4 | Very low | 112 Ų | 112 | 149.7 Ų | 149.7 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | cis | -141.9 | 166 | 47.9 | 33.5 | -9.9 | 0 | 0 | 0 | 113.9 | ||||
| 210 | Q | 36.7 | Very low | 38.5 | Very low | 191 Ų | 191 | 148.6 Ų | 148.6 | 89% | 0.893 | 79% | 0.794 | S | S | * | * | -166.7 | 147.7 | 81 | -72.6 | -141.8 | -26.4 | 0 | 0 | 113 | |||||
| 211 | R | 37.8 | Very low | 38.6 | Very low | 228 Ų | 228 | 144.9 Ų | 144.9 | 86% | 0.86 | 80% | 0.8 | S | S | * | * | trans | -90.2 | 119.4 | -173.9 | -179.2 | -172.5 | -173.4 | -157.6 | 4.6 | 110.1 | V213 | R211-V213 HydrophobicContact CG-CG2 4.2Š| ||
| 212 | S | 38.1 | Very low | 38.6 | Very low | 103 Ų | 103 | 142.3 Ų | 142.3 | 72% | 0.72 | 80% | 0.804 | S | S | * | * | trans | -98.9 | 118.4 | 167.4 | 166.5 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 213 | V | 38.1 | Very low | 38.3 | Very low | 96 Ų | 96 | 137.6 Ų | 137.6 | 58% | 0.582 | 80% | 0.799 | S | S | * | * | trans | -97.7 | 106.5 | 176.2 | 176.7 | 0 | 0 | 0 | 0 | 107.7 | R211 K215 | R211-V213 HydrophobicContact CG-CG2 4.2Å; V213-K215 HydrophobicContact CG1-CG 4.49Å | ||
| 214 | I | 49.8 | Very low | 38.1 | Very low | 151 Ų | 151 | 136.8 Ų | 136.8 | 77% | 0.774 | 80% | 0.799 | S | S | * | * | trans | -117.5 | 113.7 | 163.5 | -61.5 | 175.8 | 0 | 0 | 0 | 106.8 | ||||
| 215 | K | 48.2 | Very low | 38 | Very low | 173 Ų | 173 | 132.8 Ų | 132.8 | 75% | 0.752 | 79% | 0.793 | S | S | * | * | trans | -78.3 | 137.1 | 173.1 | -67.7 | 170.1 | 177.8 | 173.4 | 0 | 108.9 | V213 | V213-K215 HydrophobicContact CG1-CG 4.49Š| ||
| 216 | P | 41.8 | Very low | 38 | Very low | 120 Ų | 120 | 128 Ų | 128 | 78% | 0.779 | 79% | 0.792 | S | S | * | * | trans | -71.8 | 132 | 166.7 | 28.8 | -30 | 0 | 0 | 0 | 109.5 | C218 | P216-C218 PolarHBondContact O-N 3.03Š| ||
| 217 | I | 42.5 | Very low | 37.9 | Very low | 148 Ų | 148 | 125.3 Ų | 125.3 | 76% | 0.759 | 79% | 0.79 | S | S | * | * | trans | -75 | 113.2 | 173.7 | -62.3 | 171.2 | 0 | 0 | 0 | 107.5 | L219 | I217-L219 HydrophobicContact CG2-CD1 3.99Å; I217-L219 PolarHBondContact O-N 3.07Å | ||
| 218 | C | 35.4 | Very low | 38.3 | Very low | 121 Ų | 121 | 129.3 Ų | 129.3 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | -71.6 | 109.2 | 161.1 | -63.4 | 0 | 0 | 0 | 0 | 108 | P216 G220 | P216-C218 PolarHBondContact O-N 3.03Å; C218-G220 VanDerWaalsContact C-N 3.3Å; C218-G220 PolarHBondContact O-N 2.84Å | ||
| 219 | L | 42.8 | Very low | 38.3 | Very low | 164 Ų | 164 | 128.2 Ų | 128.2 | 86% | 0.859 | 78% | 0.783 | S | S | * | * | trans | -73.2 | 94.6 | 158.8 | -90.6 | 87.4 | 0 | 0 | 0 | 107.2 | I217 | I217-L219 HydrophobicContact CG2-CD1 3.99Å; I217-L219 PolarHBondContact O-N 3.07Å | ||
| 220 | G | 33.1 | Very low | 38.1 | Very low | 69 Ų | 69 | 128.3 Ų | 128.3 | 71% | 0.711 | 79% | 0.785 | S | S | * | * | trans | -62.3 | 141.4 | 168.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | C218 | C218-G220 VanDerWaalsContact C-N 3.3Å; C218-G220 PolarHBondContact O-N 2.84Å | ||
| 221 | G | 34.3 | Very low | 39.1 | Very low | 86 Ų | 86 | 124.2 Ų | 124.2 | 89% | 0.887 | 78% | 0.775 | S | S | * | * | trans | -59.7 | 134.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 222 | G | 33.6 | Very low | 39.1 | Very low | 78 Ų | 78 | 121.3 Ų | 121.3 | 80% | 0.804 | 78% | 0.776 | S | S | * | * | trans | -102.9 | 111.1 | 156.6 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 223 | G | 32.7 | Very low | 39.2 | Very low | 76 Ų | 76 | 119.7 Ų | 119.7 | 78% | 0.784 | 78% | 0.776 | S | S | * | * | trans | -69.3 | 142.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 224 | I | 38.6 | Very low | 39.1 | Very low | 167 Ų | 167 | 122.9 Ų | 122.9 | 86% | 0.856 | 79% | 0.79 | S | S | * | * | trans | -138.6 | 128.4 | 147.3 | 45.9 | 168.4 | 0 | 0 | 0 | 108.9 | ||||
| 225 | S | 35.7 | Very low | 39.2 | Very low | 121 Ų | 121 | 120.7 Ų | 120.7 | 85% | 0.846 | 79% | 0.788 | S | S | * | * | trans | -35 | 145.9 | 169.6 | 50.6 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 226 | G | 33.6 | Very low | 39 | Very low | 79 Ų | 79 | 119.9 Ų | 119.9 | 81% | 0.814 | 79% | 0.791 | S | S | * | * | trans | 143.9 | 89.4 | 150.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 227 | G | 33.7 | Very low | 39.5 | Very low | 71 Ų | 71 | 122.2 Ų | 122.2 | 73% | 0.732 | 80% | 0.797 | S | S | * | * | trans | -74.1 | 158.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 228 | M | 40.6 | Very low | 39.5 | Very low | 155 Ų | 155 | 120.3 Ų | 120.3 | 76% | 0.764 | 79% | 0.793 | S | S | * | * | trans | -169.9 | 139.4 | 133.7 | -145.6 | 60.7 | 84.5 | 0 | 0 | 109.5 | ||||
| 229 | Y | 36.4 | Very low | 40.1 | Very low | 183 Ų | 183 | 120.4 Ų | 120.4 | 72% | 0.718 | 79% | 0.792 | S | S | * | * | trans | -57.6 | 151.3 | 170.7 | 52.9 | -90.4 | 0 | 0 | 0 | 112.3 | ||||
| 230 | C | 36.8 | Very low | 40.4 | Very low | 114 Ų | 114 | 118.7 Ų | 118.7 | 77% | 0.77 | 79% | 0.787 | S | S | * | * | -173.5 | 144.7 | 125.7 | -101.9 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 231 | P | 58 | Low | 41.1 | Very low | 106 Ų | 106 | 121.6 Ų | 121.6 | 69% | 0.688 | 79% | 0.791 | S | S | * | * | trans | -99.7 | 169.2 | -169.6 | 39.7 | -33.1 | 0 | 0 | 0 | 114 | ||||
| 232 | D | 37.8 | Very low | 41.7 | Very low | 166 Ų | 166 | 123 Ų | 123 | 89% | 0.888 | 78% | 0.782 | S | S | * | * | trans | 56 | 129.8 | 157.3 | -63.8 | -37.2 | 0 | 0 | 0 | 121 | ||||
| 233 | G | 40.5 | Very low | 42.2 | Very low | 69 Ų | 69 | 123.3 Ų | 123.3 | 71% | 0.711 | 78% | 0.778 | S | S | * | * | trans | 135 | 106.4 | 152.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 234 | D | 36 | Very low | 42.6 | Very low | 164 Ų | 164 | 124.7 Ų | 124.7 | 88% | 0.877 | 78% | 0.775 | S | S | * | * | trans | 65.7 | 118.1 | 142.9 | -66.3 | -41.2 | 0 | 0 | 0 | 122.5 | ||||
| 235 | S | 50.9 | Low | 43.1 | Very low | 105 Ų | 105 | 123 Ų | 123 | 73% | 0.734 | 77% | 0.772 | S | S | * | * | 39.8 | 116 | 126.1 | -152.5 | 0 | 0 | 0 | 0 | 118.7 | |||||
| 236 | L | 44.5 | Very low | 43.6 | Very low | 156 Ų | 156 | 123.1 Ų | 123.1 | 82% | 0.817 | 77% | 0.771 | S | S | * | * | -177.6 | 114.6 | 124 | -92.6 | 163.9 | 0 | 0 | 0 | 110.4 | T238 | L236-T238 PolarHBondContact O-N 3.07Å; L236-T238 VanDerWaalsContact O-N 3.13Å | |||
| 237 | N | 51.5 | Low | 43.9 | Very low | 169 Ų | 169 | 124 Ų | 124 | 90% | 0.904 | 77% | 0.77 | S | S | * | * | trans | -72 | 94.4 | 168 | -80.2 | -55.3 | 0 | 0 | 0 | 110.3 | ||||
| 238 | T | 43.4 | Very low | 44.4 | Very low | 108 Ų | 108 | 125.4 Ų | 125.4 | 66% | 0.663 | 78% | 0.775 | S | S | * | * | trans | -143.3 | 113 | 158 | 35.3 | 0 | 0 | 0 | 0 | 109.2 | L236 V240 | L236-T238 PolarHBondContact O-N 3.07Å; L236-T238 VanDerWaalsContact O-N 3.13Å; T238-V240 PolarHBondContact O-N 3.42Å; T238-V240 VanDerWaalsContact O-N 3.15Å | ||
| 239 | P | 47.3 | Very low | 44.9 | Very low | 123 Ų | 123 | 124.3 Ų | 124.3 | 80% | 0.799 | 78% | 0.777 | S | S | * | * | trans | -70.3 | 111.4 | 172.1 | 27 | -30.9 | 0 | 0 | 0 | 109.7 | V241 | P239-V241 PolarHBondContact O-N 3.07Š| ||
| 240 | V | 48.7 | Very low | 45.5 | Very low | 127 Ų | 127 | 121.4 Ų | 121.4 | 77% | 0.77 | 78% | 0.78 | S | S | * | * | trans | -67.5 | 113.1 | 166.7 | 171.2 | 0 | 0 | 0 | 0 | 108.1 | T238 V242 | T238-V240 PolarHBondContact O-N 3.42Å; T238-V240 VanDerWaalsContact O-N 3.15Å; V240-V242 HydrophobicContact CG1-CG2 4.44Å; V240-V242 PolarHBondContact O-N 3.23Å | ||
| 241 | V | 48 | Very low | 45.8 | Very low | 130 Ų | 130 | 122.1 Ų | 122.1 | 79% | 0.788 | 78% | 0.777 | S | S | * | * | trans | -79.1 | 103.9 | 173.7 | -175.4 | 0 | 0 | 0 | 0 | 108.3 | P239 A243 | P239-V241 PolarHBondContact O-N 3.07Å; V241-A243 PolarHBondContact O-N 3.49Å | ||
| 242 | V | 47 | Very low | 44.9 | Very low | 115 Ų | 115 | 122 Ų | 122 | 70% | 0.697 | 79% | 0.785 | S | S | * | * | trans | -75.4 | 102.8 | 168.4 | 179.3 | 0 | 0 | 0 | 0 | 108 | V240 S244 | V240-V242 HydrophobicContact CG1-CG2 4.44Å; V240-V242 PolarHBondContact O-N 3.23Å; V242-S244 PolarHBondContact O-N 3.34Å | ||
| 243 | A | 44.7 | Very low | 45.4 | Very low | 86 Ų | 86 | 121.4 Ų | 121.4 | 71% | 0.711 | 78% | 0.777 | S | S | * | * | trans | -77.3 | 98.8 | 169.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | V241 T245 | V241-A243 PolarHBondContact O-N 3.49Å; A243-T245 PolarHBondContact O-N 3.35Å | ||
| 244 | S | 41.9 | Very low | 45.8 | Very low | 105 Ų | 105 | 124.8 Ų | 124.8 | 73% | 0.734 | 78% | 0.778 | S | S | * | * | trans | -82.7 | 95.3 | 171 | -62 | 0 | 0 | 0 | 0 | 110.3 | V242 P246 | V242-S244 PolarHBondContact O-N 3.34Å; S244-P246 WeakPolarHBondContact O-CD 3.48Å | ||
| 245 | T | 47.9 | Very low | 46.4 | Very low | 130 Ų | 130 | 125.5 Ų | 125.5 | 80% | 0.798 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 121.5 | 160.4 | 1.1 | 0 | 0 | 0 | 0 | 109.1 | A243 A247 | A243-T245 PolarHBondContact O-N 3.35Å; T245-A247 PolarHBondContact O-N 3.06Å |
| 246 | P | 47.1 | Very low | 46.4 | Very low | 125 Ų | 125 | 127.7 Ų | 127.7 | 81% | 0.812 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 128.8 | 167.5 | 27.8 | -30.3 | 0 | 0 | 0 | 110 | S244 | S244-P246 WeakPolarHBondContact O-CD 3.48Š|
| 247 | A | 40 | Very low | 46.1 | Very low | 96 Ų | 96 | 127.9 Ų | 127.9 | 79% | 0.793 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 143.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | T245 | T245-A247 PolarHBondContact O-N 3.06Š|
| 248 | A | 43.5 | Very low | 46.1 | Very low | 101 Ų | 101 | 125.5 Ų | 125.5 | 84% | 0.835 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 135.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 249 | T | 50.5 | Low | 46.1 | Very low | 133 Ų | 133 | 129.3 Ų | 129.3 | 82% | 0.816 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -103.6 | 142.4 | 168.1 | 47.5 | 0 | 0 | 0 | 0 | 110.6 | ||
| 250 | P | 49.4 | Very low | 46.2 | Very low | 121 Ų | 121 | 128.7 Ų | 128.7 | 79% | 0.786 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -87.6 | 141.1 | -177.7 | 34.3 | -31.2 | 0 | 0 | 0 | 112.2 | ||
| 251 | N | 43.8 | Very low | 45.7 | Very low | 130 Ų | 130 | 129.3 Ų | 129.3 | 70% | 0.695 | 77% | 0.768 | S | S | * | * | trans | 30.3 | 115.1 | 143 | -162.7 | -4.3 | 0 | 0 | 0 | 119.2 | ||||
| 252 | A | 38.8 | Very low | 45.4 | Very low | 104 Ų | 104 | 131.3 Ų | 131.3 | 86% | 0.86 | 77% | 0.771 | S | S | * | * | trans | -135.7 | 115.8 | 148.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 253 | Q | 48.7 | Very low | 45.2 | Very low | 153 Ų | 153 | 133.8 Ų | 133.8 | 72% | 0.715 | 78% | 0.777 | S | S | * | * | trans | -80.4 | 151.9 | 173.9 | -71.4 | 171.3 | -22 | 0 | 0 | 111 | ||||
| 254 | N | 49 | Very low | 45.4 | Very low | 139 Ų | 139 | 137.8 Ų | 137.8 | 74% | 0.743 | 78% | 0.781 | S | S | * | * | trans | 81.8 | 94 | 164.7 | -55.5 | -33.3 | 0 | 0 | 0 | 117.6 | ||||
| 255 | L | 48.6 | Very low | 45.7 | Very low | 179 Ų | 179 | 138.4 Ų | 138.4 | 94% | 0.937 | 78% | 0.782 | S | S | * | * | trans | -128.7 | 107.1 | 144.6 | -69.3 | 175.9 | 0 | 0 | 0 | 108.8 | ||||
| 256 | I | 49.7 | Very low | 45 | Very low | 151 Ų | 151 | 140.4 Ų | 140.4 | 77% | 0.774 | 78% | 0.783 | S | S | * | * | trans | -71 | 125.6 | 171 | -72.3 | 156.4 | 0 | 0 | 0 | 107.7 | ||||
| 257 | F | 38.5 | Very low | 44.7 | Very low | 160 Ų | 160 | 139.6 Ų | 139.6 | 70% | 0.702 | 78% | 0.78 | S | S | * | * | trans | -97.7 | 101.9 | 176.3 | -163.7 | -91.1 | 0 | 0 | 0 | 109.5 | Y259 | F257-Y259 AromaticContact CD1-CD2 3.58Å; F257-Y259 HydrophobicContact CD1-CD2 3.58Å; F257-Y259 AromaticContact CD1-CE2 3.58Å; F257-Y259 HydrophobicContact CD1-CE2 3.58Å; F257-Y259 HydrophobicContact CD1-CG 4.47Å; F257-Y259 AromaticContact CE1-CD2 3.65Å; F257-Y259 HydrophobicContact CE1-CD2 3.65Å; F257-Y259 HydrophobicContact CE1-CE1 4.46Å; F257-Y259 AromaticContact CE1-CE2 3.44Å; F257-Y259 HydrophobicContact CE1-CE2 3.44Å; F257-Y259 VanDerWaalsContact CE1-CE2 3.44Å; F257-Y259 HydrophobicContact CE1-CG 4.26Å; F257-Y259 AromaticContact CE1-CZ 3.88Å | ||
| 258 | T | 51.5 | Low | 45.1 | Very low | 120 Ų | 120 | 141 Ų | 141 | 74% | 0.736 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 117.2 | 173.1 | -58.1 | 0 | 0 | 0 | 0 | 109.3 | ||
| 259 | Y | 42.9 | Very low | 44.9 | Very low | 188 Ų | 188 | 141.2 Ų | 141.2 | 74% | 0.737 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -80.4 | 137.6 | 174.2 | -102.7 | -91.1 | 0 | 0 | 0 | 111.5 | F257 | F257-Y259 AromaticContact CD1-CD2 3.58Å; F257-Y259 HydrophobicContact CD1-CD2 3.58Å; F257-Y259 AromaticContact CD1-CE2 3.58Å; F257-Y259 HydrophobicContact CD1-CE2 3.58Å; F257-Y259 HydrophobicContact CD1-CG 4.47Å; F257-Y259 AromaticContact CE1-CD2 3.65Å; F257-Y259 HydrophobicContact CE1-CD2 3.65Å; F257-Y259 HydrophobicContact CE1-CE1 4.46Å; F257-Y259 AromaticContact CE1-CE2 3.44Å; F257-Y259 HydrophobicContact CE1-CE2 3.44Å; F257-Y259 VanDerWaalsContact CE1-CE2 3.44Å; F257-Y259 HydrophobicContact CE1-CG 4.26Å; F257-Y259 AromaticContact CE1-CZ 3.88Å |
| 260 | P | 50.4 | Low | 44.9 | Very low | 109 Ų | 109 | 140.5 Ų | 140.5 | 71% | 0.708 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 127.1 | 166.8 | -7.1 | 24.3 | 0 | 0 | 0 | 110.5 | ||
| 261 | N | 38.7 | Very low | 44.2 | Very low | 141 Ų | 141 | 140.5 Ų | 140.5 | 75% | 0.754 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 126.7 | 169.9 | -165.1 | 9.2 | 0 | 0 | 0 | 110.8 | ||
| 262 | M | 40.8 | Very low | 44.5 | Very low | 172 Ų | 172 | 139.5 Ų | 139.5 | 85% | 0.847 | 78% | 0.78 | S | S | * | * | trans | -117.7 | 115.6 | 168.3 | -73.7 | -88 | 72.7 | 0 | 0 | 108.8 | ||||
| 263 | M | 42.7 | Very low | 44.6 | Very low | 166 Ų | 166 | 143.5 Ų | 143.5 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | trans | -67.2 | 144 | 178.3 | -68 | 175.1 | 59.8 | 0 | 0 | 111.6 | ||||
| 264 | E | 48.8 | Very low | 44 | Very low | 171 Ų | 171 | 141.2 Ų | 141.2 | 80% | 0.799 | 78% | 0.782 | S | S | * | * | trans | -52 | 154.7 | 159 | -113.7 | -158 | 138.5 | 0 | 0 | 112.2 | ||||
| 265 | P | 47.6 | Very low | 43.7 | Very low | 117 Ų | 117 | 140.2 Ų | 140.2 | 76% | 0.76 | 78% | 0.784 | S | S | * | * | -146.9 | 145.9 | 100.9 | 33 | -14.4 | 0 | 0 | 0 | 116.5 | |||||
| 266 | E | 34.5 | Very low | 43.5 | Very low | 173 Ų | 173 | 137.5 Ų | 137.5 | 81% | 0.808 | 78% | 0.78 | S | S | * | * | trans | 32.4 | 127.8 | 144.4 | -78 | -167.1 | 106.8 | 0 | 0 | 122 | ||||
| 267 | S | 41.3 | Very low | 43.3 | Very low | 107 Ų | 107 | 139.3 Ų | 139.3 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | trans | -67.5 | 159.5 | 157.4 | -56.8 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 268 | P | 47.8 | Very low | 43.7 | Very low | 125 Ų | 125 | 136 Ų | 136 | 81% | 0.812 | 79% | 0.785 | S | S | * | * | -141.3 | 144 | 93.8 | 32.6 | -15.8 | 0 | 0 | 0 | 114.8 | |||||
| 269 | S | 38.9 | Very low | 43 | Very low | 107 Ų | 107 | 139.1 Ų | 139.1 | 75% | 0.748 | 79% | 0.79 | S | S | * | * | trans | -52.9 | 164.3 | 156.8 | 47.6 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 270 | P | 51.4 | Low | 43.4 | Very low | 117 Ų | 117 | 140.7 Ų | 140.7 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | cis | -149.8 | 165.6 | 37.7 | 39.7 | -18.1 | 0 | 0 | 0 | 117.6 | ||||
| 271 | S | 34.7 | Very low | 43.4 | Very low | 121 Ų | 121 | 145.6 Ų | 145.6 | 85% | 0.846 | 80% | 0.8 | S | S | * | * | 171.9 | 129.7 | 125.9 | 43.2 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 272 | S | 49.7 | Very low | 43.3 | Very low | 110 Ų | 110 | 143.9 Ų | 143.9 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | -70.4 | 137.8 | 169.8 | 46.8 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 273 | E | 39.7 | Very low | 43.4 | Very low | 188 Ų | 188 | 141.1 Ų | 141.1 | 88% | 0.879 | 80% | 0.796 | S | S | * | * | trans | -178.6 | 109.5 | 140 | -101.5 | 169 | 171.6 | 0 | 0 | 107.9 | ||||
| 274 | S | 37.1 | Very low | 43.4 | Very low | 104 Ų | 104 | 138.6 Ų | 138.6 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | 64.7 | 100.6 | 86 | -163.8 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 275 | C | 43.1 | Very low | 43.2 | Very low | 118 Ų | 118 | 135.8 Ų | 135.8 | 80% | 0.797 | 79% | 0.794 | S | S | * | * | 172.7 | 116 | 112.2 | -87.7 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 276 | S | 44 | Very low | 42.9 | Very low | 122 Ų | 122 | 133.4 Ų | 133.4 | 85% | 0.853 | 79% | 0.79 | S | S | * | * | trans | -58.7 | 128.6 | 157.4 | -33 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 277 | K | 46 | Very low | 43.4 | Very low | 190 Ų | 190 | 133 Ų | 133 | 83% | 0.826 | 79% | 0.794 | S | S | * | * | trans | -162.2 | 109.9 | 142.3 | -144.6 | 156.7 | -178.4 | 169.5 | 0 | 113.4 | ||||
| 278 | A | 45.7 | Very low | 43.6 | Very low | 90 Ų | 90 | 137 Ų | 137 | 74% | 0.744 | 80% | 0.801 | S | S | * | * | trans | -69.3 | 139.5 | 158.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 279 | H | 37.9 | Very low | 43.6 | Very low | 185 Ų | 185 | 136.7 Ų | 136.7 | 86% | 0.856 | 80% | 0.802 | S | S | * | * | trans | -119.2 | 99.2 | 163.1 | -131.3 | 48.3 | 0 | 0 | 0 | 109.5 | ||||
| 280 | R | 50.5 | Low | 44.3 | Very low | 221 Ų | 221 | 136.7 Ų | 136.7 | 83% | 0.834 | 80% | 0.801 | S | S | * | * | trans | -98.1 | 120.5 | 163.6 | -80.6 | -170.7 | 174 | -113.3 | -0.9 | 108.5 | ||||
| 281 | R | 49.9 | Very low | 44.1 | Very low | 213 Ų | 213 | 138.6 Ų | 138.6 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | 56.2 | 136.8 | 139.3 | -51.4 | -174.4 | 88.2 | -120.9 | 5.2 | 120.5 | ||||
| 282 | S | 37.3 | Very low | 45 | Very low | 104 Ų | 104 | 137.5 Ų | 137.5 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | 119.3 | 136.7 | 141.9 | -49.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 283 | S | 41.9 | Very low | 45.3 | Very low | 114 Ų | 114 | 140.5 Ų | 140.5 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | cis | -176.1 | 170.5 | -2.6 | -84.6 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 284 | S | 43.4 | Very low | 45.5 | Very low | 113 Ų | 113 | 138.9 Ų | 138.9 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | 109 | 147.6 | 142.3 | -157.9 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 285 | S | 45 | Very low | 46 | Very low | 113 Ų | 113 | 139.4 Ų | 139.4 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | trans | 64.5 | 116.8 | 173.4 | 59.9 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 286 | G | 41.5 | Very low | 46.8 | Very low | 66 Ų | 66 | 139 Ų | 139 | 68% | 0.68 | 80% | 0.801 | S | S | * | * | cis | 111.8 | 110.2 | 24.4 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 287 | D | 43.7 | Very low | 47 | Very low | 164 Ų | 164 | 139.1 Ų | 139.1 | 88% | 0.877 | 80% | 0.797 | S | S | * | * | trans | -161.5 | 112.4 | 145.7 | -95.6 | -24.3 | 0 | 0 | 0 | 109.1 | ||||
| 288 | Q | 47 | Very low | 47.3 | Very low | 192 Ų | 192 | 137.5 Ų | 137.5 | 90% | 0.897 | 80% | 0.796 | S | S | * | * | trans | -88.3 | 125.9 | 161.7 | -67.4 | -162.4 | 16.8 | 0 | 0 | 107 | ||||
| 289 | S | 46.2 | Very low | 47.4 | Very low | 119 Ų | 119 | 140.7 Ų | 140.7 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | trans | -115.3 | 109.2 | 162.1 | -50.9 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 290 | S | 53.8 | Low | 47.8 | Very low | 106 Ų | 106 | 136.2 Ų | 136.2 | 74% | 0.741 | 80% | 0.795 | S | S | * | * | trans | -73.2 | 126.3 | 171.5 | 40.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 291 | D | 48.2 | Very low | 47.7 | Very low | 157 Ų | 157 | 137.6 Ų | 137.6 | 84% | 0.84 | 82% | 0.818 | S | S | * | * | trans | -172.3 | 145.9 | 154.7 | -97.7 | -39.3 | 0 | 0 | 0 | 108.5 | ||||
| 292 | S | 53.5 | Low | 47.6 | Very low | 98 Ų | 98 | 133.9 Ų | 133.9 | 69% | 0.685 | 82% | 0.818 | S | S | * | * | cis | -165.3 | 126 | -27.8 | -100.9 | 0 | 0 | 0 | 0 | 103.2 | ||||
| 293 | L | 55.4 | Low | 48.1 | Very low | 173 Ų | 173 | 135.4 Ų | 135.4 | 91% | 0.906 | 82% | 0.823 | S | S | * | * | trans | 4 | 112.6 | 159.4 | -56.1 | 171.2 | 0 | 0 | 0 | 117.9 | ||||
| 294 | N | 45.1 | Very low | 48.5 | Very low | 155 Ų | 155 | 136.6 Ų | 136.6 | 83% | 0.829 | 83% | 0.825 | S | S | * | * | trans | -163.6 | 101.5 | 134.2 | -141.2 | 24.4 | 0 | 0 | 0 | 112 | ||||
| 295 | S | 46.6 | Very low | 48.8 | Very low | 114 Ų | 114 | 138 Ų | 138 | 80% | 0.797 | 83% | 0.827 | S | S | * | * | trans | -107.9 | 121.2 | 160 | -59 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 296 | P | 59.6 | Low | 49 | Very low | 111 Ų | 111 | 139.6 Ų | 139.6 | 72% | 0.721 | 83% | 0.829 | S | S | * | * | trans | -91.7 | 113.7 | 164.1 | 30.2 | -22.5 | 0 | 0 | 0 | 109.5 | ||||
| 297 | T | 48.7 | Very low | 49.5 | Very low | 123 Ų | 123 | 144.5 Ų | 144.5 | 76% | 0.755 | 84% | 0.839 | S | S | * | * | trans | -65.5 | 128.5 | 156.7 | -56.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 298 | L | 52.1 | Low | 49.9 | Very low | 156 Ų | 156 | 143.1 Ų | 143.1 | 82% | 0.817 | 84% | 0.836 | S | S | * | * | trans | -142.7 | 100.2 | 155.2 | -70 | -180 | 0 | 0 | 0 | 106.6 | ||||
| 299 | L | 47.4 | Very low | 50.1 | Low | 158 Ų | 158 | 139.3 Ų | 139.3 | 83% | 0.827 | 83% | 0.832 | S | S | * | * | 57.1 | 122.8 | 90.5 | -84.7 | 168.9 | 0 | 0 | 0 | 114.4 | |||||
| 300 | A | 46.6 | Very low | 50.5 | Low | 91 Ų | 91 | 141 Ų | 141 | 75% | 0.752 | 83% | 0.832 | S | S | * | * | trans | -61.6 | 146.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 301 | L | 48.6 | Very low | 50.2 | Low | 250 Ų | 250 | 144.2 Ų | 144.2 | 100% | 1.309 | 84% | 0.84 | S | S | * | * | trans | -150.6 | 0 | 134.1 | -92.1 | 173 | 0 | 0 | 0 | 107.9 |
Retrieved 301 of 301 residues in 236.3 ms
(Link to these results)