| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.6 | Very low | 43.9 | Very low | 240 Ų | 240 | 143.1 Ų | 143.1 | 100% | 1.182 | 74% | 0.744 | S | S | * | * | 0 | 98.1 | 0 | -64.8 | 167.9 | 99.5 | 0 | 0 | 109.2 | |||||
| 2 | K | 37.8 | Very low | 44 | Very low | 204 Ų | 204 | 144.9 Ų | 144.9 | 89% | 0.887 | 74% | 0.743 | S | S | * | * | trans | 169 | 99.5 | 170 | -99.3 | 161.1 | -173.7 | -177 | 0 | 107.5 | ||||
| 3 | K | 35.4 | Very low | 44.2 | Very low | 205 Ų | 205 | 142.5 Ų | 142.5 | 89% | 0.891 | 73% | 0.731 | S | S | * | * | trans | -176.5 | 145.1 | 161.1 | -103.9 | 159.7 | -171.2 | -173.4 | 0 | 110.7 | ||||
| 4 | H | 37.2 | Very low | 44.3 | Very low | 187 Ų | 187 | 141.8 Ų | 141.8 | 87% | 0.866 | 72% | 0.72 | S | S | * | * | trans | 87.6 | 77 | 172.3 | -78.8 | -86.9 | 0 | 0 | 0 | 119.6 | ||||
| 5 | S | 48.2 | Very low | 44.5 | Very low | 109 Ų | 109 | 138.8 Ų | 138.8 | 76% | 0.762 | 71% | 0.711 | S | S | * | * | trans | -143.5 | 7.8 | 155.9 | 59.3 | 0 | 0 | 0 | 0 | 116 | ||||
| 6 | N | 43.5 | Very low | 44.3 | Very low | 120 Ų | 120 | 136.5 Ų | 136.5 | 64% | 0.642 | 70% | 0.701 | S | S | * | * | trans | -116.3 | 27.2 | -163.1 | -65.6 | -0.2 | 0 | 0 | 0 | 116.3 | E10 | N6-E10 WeakPolarHBondContact O-CG 3.37Š| ||
| 7 | S | 54.7 | Low | 44.5 | Very low | 89 Ų | 89 | 139.5 Ų | 139.5 | 62% | 0.622 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -95.7 | -17.9 | -172.8 | -167.6 | 0 | 0 | 0 | 0 | 116.3 | V11 | S7-V11 WeakPolarHBondContact O-CG2 3.17Š|
| 8 | L | 42.4 | Very low | 44.6 | Very low | 140 Ų | 140 | 137.2 Ų | 137.2 | 73% | 0.733 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -103.3 | -30.3 | -172.3 | -75.9 | 171.7 | 0 | 0 | 0 | 114 | ||
| 9 | S | 47 | Very low | 44.8 | Very low | 76 Ų | 76 | 134.3 Ų | 134.3 | 53% | 0.531 | 68% | 0.682 | S | S | . | * | H | α-helix | trans | -73.6 | -32.2 | 174.5 | 47.6 | 0 | 0 | 0 | 0 | 112.8 | L13 | S9-L13 PolarHBondContact O-N 3.44Å |
| 10 | E | 47.1 | Very low | 44.8 | Very low | 119 Ų | 119 | 133.4 Ų | 133.4 | 56% | 0.556 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -66.3 | -33.8 | 176.8 | -80.7 | -89 | 148.6 | 0 | 0 | 112.8 | N6 K14 | N6-E10 WeakPolarHBondContact O-CG 3.37Å; E10-K14 WeakPolarHBondContact O-CB 3.44Å; E10-K14 PolarHBondContact O-N 3.46Å |
| 11 | V | 50.9 | Low | 44.8 | Very low | 85 Ų | 85 | 132.8 Ų | 132.8 | 52% | 0.515 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -76.8 | -38.9 | -175.8 | 178.2 | 0 | 0 | 0 | 0 | 111.6 | S7 K14 V15 | S7-V11 WeakPolarHBondContact O-CG2 3.17Å; V11-K14 PolarHBondContact O-N 3.4Å; V11-V15 WeakPolarHBondContact O-CG2 3.47Å; V11-V15 PolarHBondContact O-N 3.11Å |
| 12 | F | 45.1 | Very low | 45.1 | Very low | 165 Ų | 165 | 127.4 Ų | 127.4 | 72% | 0.724 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -72.3 | -32.7 | 177.7 | -88.4 | -83.8 | 0 | 0 | 0 | 113 | N16 | F12-N16 PolarHBondContact O-N 3.05Å |
| 13 | L | 46.9 | Very low | 45.3 | Very low | 113 Ų | 113 | 122.3 Ų | 122.3 | 59% | 0.592 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -74.8 | -26.4 | 175.7 | -72.5 | 172.9 | 0 | 0 | 0 | 113.1 | S9 R17 | S9-L13 PolarHBondContact O-N 3.44Å; L13-R17 PolarHBondContact O-N 3.17Å |
| 14 | K | 45.8 | Very low | 45.5 | Very low | 133 Ų | 133 | 119 Ų | 119 | 58% | 0.578 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -75.2 | -35.6 | 176.7 | -123.9 | 161.3 | -179.9 | 165.2 | 0 | 113.2 | E10 V11 N18 | E10-K14 WeakPolarHBondContact O-CB 3.44Å; E10-K14 PolarHBondContact O-N 3.46Å; V11-K14 PolarHBondContact O-N 3.4Å; K14-N18 PolarHBondContact O-N 2.94Å; K14-N18 PolarHBondContact O-ND2 3.46Å; K14-N18 PolarHBondContact O-OD1 3.47Å |
| 15 | V | 46.6 | Very low | 45.6 | Very low | 97 Ų | 97 | 116.9 Ų | 116.9 | 59% | 0.588 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -70.5 | -35.1 | 178 | 174.6 | 0 | 0 | 0 | 0 | 111.6 | V11 T19 | V11-V15 WeakPolarHBondContact O-CG2 3.47Å; V11-V15 PolarHBondContact O-N 3.11Å; V15-T19 PolarHBondContact O-N 3.2Å; V15-T19 PolarHBondContact O-OG1 2.72Å; V15-T19 VanDerWaalsContact O-OG1 3.04Å |
| 16 | N | 41.8 | Very low | 45.2 | Very low | 102 Ų | 102 | 118.4 Ų | 118.4 | 55% | 0.545 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -79.7 | -25 | 179.3 | -155 | 25.7 | 0 | 0 | 0 | 113.4 | F12 T19 | F12-N16 PolarHBondContact O-N 3.05Å; N16-T19 PolarHBondContact O-OG1 3.13Å |
| 17 | R | 47.2 | Very low | 44.9 | Very low | 187 Ų | 187 | 119.6 Ų | 119.6 | 71% | 0.706 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -77.3 | -30.7 | 172.8 | -88.4 | -177.2 | 173.6 | 155 | -1.2 | 113.3 | L13 N21 | L13-R17 PolarHBondContact O-N 3.17Å; R17-N21 PolarHBondContact O-N 3.03Å |
| 18 | N | 46.2 | Very low | 44 | Very low | 99 Ų | 99 | 122.7 Ų | 122.7 | 53% | 0.529 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -73.8 | -31.1 | 178.8 | -67.4 | -3 | 0 | 0 | 0 | 112.1 | K14 | K14-N18 PolarHBondContact O-N 2.94Å; K14-N18 PolarHBondContact O-ND2 3.46Å; K14-N18 PolarHBondContact O-OD1 3.47Å |
| 19 | T | 48.8 | Very low | 43.8 | Very low | 82 Ų | 82 | 124.8 Ų | 124.8 | 50% | 0.503 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -77.9 | -22.6 | 177.4 | 41.8 | 0 | 0 | 0 | 0 | 113.7 | V15 N16 | V15-T19 PolarHBondContact O-N 3.2Å; V15-T19 PolarHBondContact O-OG1 2.72Å; V15-T19 VanDerWaalsContact O-OG1 3.04Å; N16-T19 PolarHBondContact O-OG1 3.13Å |
| 20 | L | 44.1 | Very low | 43.2 | Very low | 115 Ų | 115 | 129.1 Ų | 129.1 | 60% | 0.602 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -90.4 | -23.6 | 177.1 | -118.5 | 131.9 | 0 | 0 | 0 | 113.6 | ||
| 21 | N | 44.4 | Very low | 42.6 | Very low | 122 Ų | 122 | 132 Ų | 132 | 65% | 0.652 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -80.7 | -24.4 | 174.9 | -92.5 | 4.3 | 0 | 0 | 0 | 113.7 | R17 | R17-N21 PolarHBondContact O-N 3.03Å |
| 22 | D | 45 | Very low | 42 | Very low | 126 Ų | 126 | 135.9 Ų | 135.9 | 67% | 0.674 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | -17.5 | 177.1 | -74.7 | -20.6 | 0 | 0 | 0 | 113.3 | ||
| 23 | S | 43.3 | Very low | 41.4 | Very low | 97 Ų | 97 | 135 Ų | 135 | 68% | 0.678 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92 | -6.4 | 178.7 | -71.4 | 0 | 0 | 0 | 0 | 114.5 | ||
| 24 | N | 39.1 | Very low | 40.9 | Very low | 135 Ų | 135 | 138.8 Ų | 138.8 | 72% | 0.722 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -112.4 | 13.7 | -171.6 | -129.9 | 5.3 | 0 | 0 | 0 | 114.6 | ||
| 25 | N | 39.6 | Very low | 40.4 | Very low | 144 Ų | 144 | 141.4 Ų | 141.4 | 77% | 0.77 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -126.7 | 13.3 | -175.6 | -131.1 | 3 | 0 | 0 | 0 | 115.4 | ||
| 26 | N | 39.4 | Very low | 40 | Very low | 141 Ų | 141 | 141 Ų | 141 | 75% | 0.754 | 72% | 0.723 | S | S | * | * | trans | -118.2 | 16.5 | -174.7 | -80.5 | -19.7 | 0 | 0 | 0 | 115.8 | ||||
| 27 | N | 37.8 | Very low | 39.9 | Very low | 145 Ų | 145 | 142.8 Ų | 142.8 | 78% | 0.775 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -99.3 | 18.3 | -177 | -74.8 | -17.3 | 0 | 0 | 0 | 115.8 | ||
| 28 | N | 35.4 | Very low | 39.8 | Very low | 154 Ų | 154 | 138.1 Ų | 138.1 | 82% | 0.824 | 73% | 0.725 | S | S | * | * | trans | -142.3 | 93.8 | 178.2 | -80.4 | -35.3 | 0 | 0 | 0 | 111.5 | ||||
| 29 | K | 38.2 | Very low | 39.6 | Very low | 183 Ų | 183 | 137 Ų | 137 | 80% | 0.796 | 73% | 0.725 | S | S | * | * | trans | 165.2 | 117.9 | 137 | -94 | 168 | 177.6 | -175.1 | 0 | 112.9 | ||||
| 30 | Q | 35.5 | Very low | 39.4 | Very low | 167 Ų | 167 | 140.3 Ų | 140.3 | 78% | 0.78 | 74% | 0.735 | S | S | * | * | trans | 59.3 | 101.9 | 131.9 | -66.9 | 167.8 | -23 | 0 | 0 | 117.1 | ||||
| 31 | M | 32.7 | Very low | 39.4 | Very low | 179 Ų | 179 | 142.2 Ų | 142.2 | 88% | 0.882 | 74% | 0.741 | S | S | * | * | 31.7 | 104.6 | 87.8 | -90.3 | -165.5 | 142.7 | 0 | 0 | 113.7 | |||||
| 32 | I | 39.4 | Very low | 39.5 | Very low | 168 Ų | 168 | 142.7 Ų | 142.7 | 86% | 0.862 | 74% | 0.739 | S | S | * | * | trans | 162.7 | 134.7 | 134.4 | -82.8 | 154.9 | 0 | 0 | 0 | 109.8 | ||||
| 33 | N | 32.9 | Very low | 39.8 | Very low | 145 Ų | 145 | 143.9 Ų | 143.9 | 78% | 0.775 | 74% | 0.74 | S | S | * | * | trans | -36.1 | 134.6 | 170.4 | -73.6 | -34.9 | 0 | 0 | 0 | 114.9 | ||||
| 34 | Q | 36 | Very low | 40.1 | Very low | 194 Ų | 194 | 145.5 Ų | 145.5 | 91% | 0.907 | 74% | 0.737 | S | S | * | * | trans | 161.5 | 130.6 | 131.4 | -87.2 | 157.1 | 6.5 | 0 | 0 | 111.4 | ||||
| 35 | Q | 34.5 | Very low | 41.1 | Very low | 187 Ų | 187 | 144.7 Ų | 144.7 | 87% | 0.874 | 73% | 0.729 | S | S | * | * | trans | -29.8 | 166.3 | 162.3 | -133.5 | 142.2 | -55.3 | 0 | 0 | 115.9 | ||||
| 36 | P | 39.4 | Very low | 42.3 | Very low | 89 Ų | 89 | 141.9 Ų | 141.9 | 58% | 0.578 | 71% | 0.714 | S | S | * | * | cis | -134.5 | 124.2 | -34.2 | 30.5 | -9.8 | 0 | 0 | 0 | 113.1 | T38 | P36-T38 PolarHBondContact O-N 3.5Š| ||
| 37 | D | 38.1 | Very low | 43.6 | Very low | 139 Ų | 139 | 140.7 Ų | 140.7 | 74% | 0.743 | 71% | 0.707 | S | S | * | * | trans | -90.7 | 70.1 | 176.7 | -83 | -27.3 | 0 | 0 | 0 | 113.7 | S39 | D37-S39 PolarHBondContact O-N 2.69Å; D37-S39 VanDerWaalsContact O-N 3.1Å | ||
| 38 | T | 45.8 | Very low | 45.1 | Very low | 90 Ų | 90 | 140.6 Ų | 140.6 | 55% | 0.552 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -66.3 | -1 | 172.3 | -24.4 | 0 | 0 | 0 | 0 | 113.1 | P36 Q42 | P36-T38 PolarHBondContact O-N 3.5Å; T38-Q42 WeakPolarHBondContact O-CB 3.28Å |
| 39 | S | 43 | Very low | 46.9 | Very low | 75 Ų | 75 | 136.6 Ų | 136.6 | 52% | 0.524 | 68% | 0.678 | S | S | . | * | H | α-helix | trans | -91.3 | -34 | -167.8 | -38.5 | 0 | 0 | 0 | 0 | 114.2 | D37 Q43 | D37-S39 PolarHBondContact O-N 2.69Å; D37-S39 VanDerWaalsContact O-N 3.1Å; S39-Q43 PolarHBondContact O-N 3.42Å |
| 40 | Q | 44.6 | Very low | 48.4 | Very low | 152 Ų | 152 | 134.2 Ų | 134.2 | 71% | 0.71 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -85.4 | -33.8 | -177.2 | -66.4 | -168.1 | 7.8 | 0 | 0 | 112.8 | Q42 Q43 Q44 | Q40-Q42 VanDerWaalsContact C-N 3.27Å; Q40-Q42 PolarHBondContact O-N 3.2Å; Q40-Q43 PolarHBondContact O-N 3Å; Q40-Q44 PolarHBondContact O-N 3.45Å |
| 41 | Q | 43.4 | Very low | 49.5 | Very low | 155 Ų | 155 | 131 Ų | 131 | 72% | 0.724 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -66.2 | -32.8 | 170.7 | -72.4 | -175.7 | -1.1 | 0 | 0 | 111.4 | Q44 H45 | Q41-Q44 PolarHBondContact O-N 3.16Å; Q41-H45 WeakPolarHBondContact O-CB 3.19Å; Q41-H45 PolarHBondContact O-N 3.49Å |
| 42 | Q | 47.4 | Very low | 51.2 | Low | 132 Ų | 132 | 124.2 Ų | 124.2 | 62% | 0.617 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -72.4 | -33.7 | 179.3 | -152.2 | 162.9 | 26.9 | 0 | 0 | 112.5 | T38 Q40 N46 | T38-Q42 WeakPolarHBondContact O-CB 3.28Å; Q40-Q42 VanDerWaalsContact C-N 3.27Å; Q40-Q42 PolarHBondContact O-N 3.2Å; Q42-N46 VanDerWaalsContact O-CB 3.23Å; Q42-N46 WeakPolarHBondContact O-CB 3.34Å; Q42-N46 PolarHBondContact O-N 3.13Å |
| 43 | Q | 49.5 | Very low | 52.5 | Low | 150 Ų | 150 | 119.8 Ų | 119.8 | 70% | 0.701 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -69.5 | -39.7 | 171.8 | -86.7 | 179.7 | -5.8 | 0 | 0 | 112.8 | S39 Q40 N46 L47 | S39-Q43 PolarHBondContact O-N 3.42Å; Q40-Q43 PolarHBondContact O-N 3Å; Q43-N46 PolarHBondContact O-N 2.95Å; Q43-L47 WeakPolarHBondContact O-CB 3.46Å; Q43-L47 PolarHBondContact O-N 3.14Å |
| 44 | Q | 49.6 | Very low | 53.8 | Low | 131 Ų | 131 | 117.3 Ų | 117.3 | 61% | 0.612 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -69.8 | -36.5 | 176.7 | -133.6 | -178.6 | 26.1 | 0 | 0 | 111.9 | Q40 Q41 K48 | Q40-Q44 PolarHBondContact O-N 3.45Å; Q41-Q44 PolarHBondContact O-N 3.16Å; Q44-K48 WeakPolarHBondContact O-CB 3.38Å; Q44-K48 WeakPolarHBondContact O-CG 3.3Å; Q44-K48 PolarHBondContact O-N 2.95Å |
| 45 | H | 60.4 | Low | 54.7 | Low | 118 Ų | 118 | 113.4 Ų | 113.4 | 55% | 0.546 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -66.3 | -44 | 173.1 | -162.3 | -74.5 | 0 | 0 | 0 | 111.2 | Q41 L47 K48 D49 | Q41-H45 WeakPolarHBondContact O-CB 3.19Å; Q41-H45 PolarHBondContact O-N 3.49Å; H45-L47 VanDerWaalsContact C-N 3.32Å; H45-L47 PolarHBondContact O-N 3.02Å; H45-K48 PolarHBondContact O-N 2.97Å; H45-D49 IonicContact CE1-OD1 3.64Å; H45-D49 IonicContact CE1-OD2 3.16Å; H45-D49 PolarHBondContact CE1-OD2 3.13Å; H45-D49 IonicContact CG-OD2 3.9Å; H45-D49 IonicContact ND1-OD1 3.77Å; H45-D49 IonicContact ND1-OD2 2.7Å; H45-D49 PolarHBondContact ND1-OD2 3.4Å; H45-D49 WeakPolarHBondContact O-CB 3.48Å; H45-D49 PolarHBondContact O-N 2.8Å |
| 46 | N | 65.9 | Low | 55.7 | Low | 85 Ų | 85 | 110.6 Ų | 110.6 | 46% | 0.455 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.4 | -33.4 | 178.2 | -149.4 | -60.9 | 0 | 0 | 0 | 112.4 | Q42 Q43 K50 | Q42-N46 VanDerWaalsContact O-CB 3.23Å; Q42-N46 WeakPolarHBondContact O-CB 3.34Å; Q42-N46 PolarHBondContact O-N 3.13Å; Q43-N46 PolarHBondContact O-N 2.95Å; N46-K50 VanDerWaalsContact O-CB 3.28Å; N46-K50 WeakPolarHBondContact O-CB 3.15Å; N46-K50 VanDerWaalsContact O-CG 3.28Å; N46-K50 WeakPolarHBondContact O-CG 3.5Å; N46-K50 PolarHBondContact O-N 3Å; N46-K50 WeakPolarHBondContact OD1-CE 3.11Å |
| 47 | L | 66.4 | Low | 56.5 | Low | 117 Ų | 117 | 114.2 Ų | 114.2 | 61% | 0.613 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -73 | -41.1 | 174.8 | -151.2 | 160.8 | 0 | 0 | 0 | 111.2 | Q43 H45 K50 L51 | Q43-L47 WeakPolarHBondContact O-CB 3.46Å; Q43-L47 PolarHBondContact O-N 3.14Å; H45-L47 VanDerWaalsContact C-N 3.32Å; H45-L47 PolarHBondContact O-N 3.02Å; L47-K50 PolarHBondContact O-N 3.07Å; L47-L51 VanDerWaalsContact O-CB 3.3Å; L47-L51 WeakPolarHBondContact O-CB 3.38Å; L47-L51 PolarHBondContact O-N 3.05Å |
| 48 | K | 68.3 | Low | 57 | Low | 142 Ų | 142 | 115.4 Ų | 115.4 | 62% | 0.617 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -61.7 | -41.9 | 171.9 | -77.1 | 179.2 | 176.2 | -178.1 | 0 | 111.8 | Q44 H45 L51 A52 | Q44-K48 WeakPolarHBondContact O-CB 3.38Å; Q44-K48 WeakPolarHBondContact O-CG 3.3Å; Q44-K48 PolarHBondContact O-N 2.95Å; H45-K48 PolarHBondContact O-N 2.97Å; K48-L51 PolarHBondContact O-N 3.21Å; K48-A52 WeakPolarHBondContact O-CB 3.39Å; K48-A52 PolarHBondContact O-N 3.2Å |
| 49 | D | 73.1 | Confident | 56.8 | Low | 70 Ų | 70 | 114.5 Ų | 114.5 | 37% | 0.374 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -68.5 | -38.7 | 176.4 | -68.9 | -30.5 | 0 | 0 | 0 | 112.2 | H45 N53 | H45-D49 IonicContact CE1-OD1 3.64Å; H45-D49 IonicContact CE1-OD2 3.16Å; H45-D49 PolarHBondContact CE1-OD2 3.13Å; H45-D49 IonicContact CG-OD2 3.9Å; H45-D49 IonicContact ND1-OD1 3.77Å; H45-D49 IonicContact ND1-OD2 2.7Å; H45-D49 PolarHBondContact ND1-OD2 3.4Å; H45-D49 WeakPolarHBondContact O-CB 3.48Å; H45-D49 PolarHBondContact O-N 2.8Å; D49-N53 VanDerWaalsContact O-CB 3.24Å; D49-N53 WeakPolarHBondContact O-CB 3.34Å; D49-N53 PolarHBondContact O-N 3.34Å |
| 50 | K | 69.9 | Low | 56.5 | Low | 133 Ų | 133 | 115.2 Ų | 115.2 | 58% | 0.578 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -65.3 | -44.1 | 172.8 | -82.5 | 178 | 179.4 | -177.5 | 0 | 111.4 | N46 L47 N53 I54 | N46-K50 VanDerWaalsContact O-CB 3.28Å; N46-K50 WeakPolarHBondContact O-CB 3.15Å; N46-K50 VanDerWaalsContact O-CG 3.28Å; N46-K50 WeakPolarHBondContact O-CG 3.5Å; N46-K50 PolarHBondContact O-N 3Å; N46-K50 WeakPolarHBondContact OD1-CE 3.11Å; L47-K50 PolarHBondContact O-N 3.07Å; K50-N53 PolarHBondContact O-N 3.07Å; K50-I54 WeakPolarHBondContact O-CB 3.27Å; K50-I54 WeakPolarHBondContact O-CD1 3.4Å; K50-I54 WeakPolarHBondContact O-CG1 3.39Å; K50-I54 PolarHBondContact O-N 2.89Å |
| 51 | L | 59.5 | Low | 56.3 | Low | 99 Ų | 99 | 117.1 Ų | 117.1 | 52% | 0.518 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -65.3 | -42.5 | 177 | -160.6 | 88.2 | 0 | 0 | 0 | 110.8 | L47 K48 I54 L55 | L47-L51 VanDerWaalsContact O-CB 3.3Å; L47-L51 WeakPolarHBondContact O-CB 3.38Å; L47-L51 PolarHBondContact O-N 3.05Å; K48-L51 PolarHBondContact O-N 3.21Å; L51-I54 PolarHBondContact O-N 3.39Å; L51-L55 HydrophobicContact CD2-CD1 4.22Å; L51-L55 HydrophobicContact CG-CD1 4.2Å; L51-L55 WeakPolarHBondContact O-CB 3.39Å; L51-L55 VanDerWaalsContact O-CG 3.25Å; L51-L55 WeakPolarHBondContact O-CG 3.27Å; L51-L55 PolarHBondContact O-N 2.99Å |
| 52 | A | 68.4 | Low | 56 | Low | 37 Ų | 37 | 116 Ų | 116 | 31% | 0.306 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.5 | -39.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | K48 R56 | K48-A52 WeakPolarHBondContact O-CB 3.39Å; K48-A52 PolarHBondContact O-N 3.2Å; A52-R56 WeakPolarHBondContact O-CB 3.33Å; A52-R56 PolarHBondContact O-N 3.08Å |
| 53 | N | 67.2 | Low | 55.4 | Low | 76 Ų | 76 | 115 Ų | 115 | 41% | 0.406 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -70.6 | -30.4 | 174.2 | -89.2 | -30.9 | 0 | 0 | 0 | 113.3 | D49 K50 R56 K57 | D49-N53 VanDerWaalsContact O-CB 3.24Å; D49-N53 WeakPolarHBondContact O-CB 3.34Å; D49-N53 PolarHBondContact O-N 3.34Å; K50-N53 PolarHBondContact O-N 3.07Å; N53-R56 PolarHBondContact OD1-NH1 3.39Å; N53-K57 VanDerWaalsContact O-CB 3.24Å; N53-K57 WeakPolarHBondContact O-CB 3.36Å; N53-K57 VanDerWaalsContact O-CG 3.26Å; N53-K57 WeakPolarHBondContact O-CG 3.29Å; N53-K57 PolarHBondContact O-N 3.01Å |
| 54 | I | 60.4 | Low | 54.6 | Low | 93 Ų | 93 | 112.3 Ų | 112.3 | 48% | 0.477 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -72.4 | -45.5 | 173.6 | -70.3 | 161.8 | 0 | 0 | 0 | 109.8 | K50 L51 R56 K57 H58 | K50-I54 WeakPolarHBondContact O-CB 3.27Å; K50-I54 WeakPolarHBondContact O-CD1 3.4Å; K50-I54 WeakPolarHBondContact O-CG1 3.39Å; K50-I54 PolarHBondContact O-N 2.89Å; L51-I54 PolarHBondContact O-N 3.39Å; I54-R56 VanDerWaalsContact C-N 3.32Å; I54-R56 PolarHBondContact O-N 3.33Å; I54-K57 PolarHBondContact O-N 3.01Å; I54-H58 WeakPolarHBondContact O-CB 3.43Å; I54-H58 PolarHBondContact O-CD2 2.66Å; I54-H58 VanDerWaalsContact O-CD2 3.32Å; I54-H58 PolarHBondContact O-N 2.96Å |
| 55 | L | 55 | Low | 53.9 | Low | 111 Ų | 111 | 111 Ų | 111 | 58% | 0.581 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -63 | -39.7 | 175.1 | -71.3 | 166.9 | 0 | 0 | 0 | 111.2 | L51 S59 | L51-L55 HydrophobicContact CD2-CD1 4.22Å; L51-L55 HydrophobicContact CG-CD1 4.2Å; L51-L55 WeakPolarHBondContact O-CB 3.39Å; L51-L55 VanDerWaalsContact O-CG 3.25Å; L51-L55 WeakPolarHBondContact O-CG 3.27Å; L51-L55 PolarHBondContact O-N 2.99Å; L55-S59 VanDerWaalsContact O-CB 3.26Å; L55-S59 WeakPolarHBondContact O-CB 3.45Å; L55-S59 PolarHBondContact O-N 3.36Å |
| 56 | R | 55.2 | Low | 52.6 | Low | 128 Ų | 128 | 115.8 Ų | 115.8 | 48% | 0.483 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -65.9 | -47.8 | 172.2 | -162.1 | -177.4 | -70.4 | 128.4 | -4.5 | 110.8 | A52 N53 I54 H58 S59 F60 | A52-R56 WeakPolarHBondContact O-CB 3.33Å; A52-R56 PolarHBondContact O-N 3.08Å; N53-R56 PolarHBondContact OD1-NH1 3.39Å; I54-R56 VanDerWaalsContact C-N 3.32Å; I54-R56 PolarHBondContact O-N 3.33Å; R56-H58 VanDerWaalsContact C-N 3.29Å; R56-H58 PolarHBondContact O-N 3.08Å; R56-S59 PolarHBondContact O-N 2.73Å; R56-F60 HydrophobicContact CB-CD2 4.45Å; R56-F60 HydrophobicContact CB-CE2 4.14Å; R56-F60 HydrophobicContact CG-CD1 4.37Å; R56-F60 HydrophobicContact CG-CD2 3.79Å; R56-F60 HydrophobicContact CG-CE1 3.96Å; R56-F60 HydrophobicContact CG-CE2 3.22Å; R56-F60 HydrophobicContact CG-CG 4.36Å; R56-F60 HydrophobicContact CG-CZ 3.36Å; R56-F60 VanDerWaalsContact O-CB 3.24Å; R56-F60 WeakPolarHBondContact O-CB 3.2Å; R56-F60 WeakPolarHBondContact O-CD2 3.26Å; R56-F60 WeakPolarHBondContact O-CG 3.39Å; R56-F60 PolarHBondContact O-N 2.98Å |
| 57 | K | 55.8 | Low | 51.3 | Low | 166 Ų | 166 | 117.4 Ų | 117.4 | 72% | 0.722 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -64.6 | -30.4 | 177.3 | -78.8 | 178.6 | 177 | -171.7 | 0 | 113.6 | N53 I54 | N53-K57 VanDerWaalsContact O-CB 3.24Å; N53-K57 WeakPolarHBondContact O-CB 3.36Å; N53-K57 VanDerWaalsContact O-CG 3.26Å; N53-K57 WeakPolarHBondContact O-CG 3.29Å; N53-K57 PolarHBondContact O-N 3.01Å; I54-K57 PolarHBondContact O-N 3.01Å |
| 58 | H | 47.4 | Very low | 49.6 | Very low | 164 Ų | 164 | 122.7 Ų | 122.7 | 76% | 0.759 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -87.2 | -14.1 | 176.2 | -81.5 | -87.1 | 0 | 0 | 0 | 114.4 | I54 R56 | I54-H58 WeakPolarHBondContact O-CB 3.43Å; I54-H58 PolarHBondContact O-CD2 2.66Å; I54-H58 VanDerWaalsContact O-CD2 3.32Å; I54-H58 PolarHBondContact O-N 2.96Å; R56-H58 VanDerWaalsContact C-N 3.29Å; R56-H58 PolarHBondContact O-N 3.08Å |
| 59 | S | 42.5 | Very low | 48.2 | Very low | 71 Ų | 71 | 122.9 Ų | 122.9 | 50% | 0.497 | 62% | 0.616 | S | S | . | * | S | Bend | trans | -97.5 | 4.4 | 173.8 | 96 | 0 | 0 | 0 | 0 | 113.9 | L55 R56 | L55-S59 VanDerWaalsContact O-CB 3.26Å; L55-S59 WeakPolarHBondContact O-CB 3.45Å; L55-S59 PolarHBondContact O-N 3.36Å; R56-S59 PolarHBondContact O-N 2.73Å |
| 60 | F | 36.9 | Very low | 46.3 | Very low | 90 Ų | 90 | 128.6 Ų | 128.6 | 40% | 0.395 | 64% | 0.637 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -110.3 | 23.7 | -166.9 | -82.8 | -129.3 | 0 | 0 | 0 | 114 | R56 L63 | R56-F60 HydrophobicContact CB-CD2 4.45Å; R56-F60 HydrophobicContact CB-CE2 4.14Å; R56-F60 HydrophobicContact CG-CD1 4.37Å; R56-F60 HydrophobicContact CG-CD2 3.79Å; R56-F60 HydrophobicContact CG-CE1 3.96Å; R56-F60 HydrophobicContact CG-CE2 3.22Å; R56-F60 HydrophobicContact CG-CG 4.36Å; R56-F60 HydrophobicContact CG-CZ 3.36Å; R56-F60 VanDerWaalsContact O-CB 3.24Å; R56-F60 WeakPolarHBondContact O-CB 3.2Å; R56-F60 WeakPolarHBondContact O-CD2 3.26Å; R56-F60 WeakPolarHBondContact O-CG 3.39Å; R56-F60 PolarHBondContact O-N 2.98Å; F60-L63 HydrophobicContact CB-CD1 3.83Å; F60-L63 HydrophobicContact CB-CG 4.05Å; F60-L63 HydrophobicContact CD1-CD1 3.59Å; F60-L63 HydrophobicContact CD1-CD2 3.44Å; F60-L63 VanDerWaalsContact CD1-CD2 3.44Å; F60-L63 HydrophobicContact CD1-CG 3.57Å; F60-L63 HydrophobicContact CE1-CD2 3.58Å; F60-L63 HydrophobicContact CE1-CG 4.22Å; F60-L63 HydrophobicContact CG-CD1 4.06Å; F60-L63 HydrophobicContact CG-CD2 4.24Å; F60-L63 HydrophobicContact CG-CG 3.96Å; F60-L63 WeakPolarHBondContact O-CD1 3.37Å |
| 61 | H | 41.1 | Very low | 44.4 | Very low | 191 Ų | 191 | 128.2 Ų | 128.2 | 88% | 0.884 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.1 | 15.4 | 159.5 | -94.3 | -77.9 | 0 | 0 | 0 | 114.2 | ||
| 62 | T | 36.1 | Very low | 43.4 | Very low | 131 Ų | 131 | 128.8 Ų | 128.8 | 80% | 0.804 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -134.1 | 58.6 | 159.5 | 64.4 | 0 | 0 | 0 | 0 | 109.8 | ||
| 63 | L | 35.7 | Very low | 41.7 | Very low | 112 Ų | 112 | 134.9 Ų | 134.9 | 59% | 0.586 | 68% | 0.683 | S | S | * | * | trans | -83.1 | 120.2 | 171.1 | -89.4 | 157.6 | 0 | 0 | 0 | 109.9 | F60 | F60-L63 HydrophobicContact CB-CD1 3.83Å; F60-L63 HydrophobicContact CB-CG 4.05Å; F60-L63 HydrophobicContact CD1-CD1 3.59Å; F60-L63 HydrophobicContact CD1-CD2 3.44Å; F60-L63 VanDerWaalsContact CD1-CD2 3.44Å; F60-L63 HydrophobicContact CD1-CG 3.57Å; F60-L63 HydrophobicContact CE1-CD2 3.58Å; F60-L63 HydrophobicContact CE1-CG 4.22Å; F60-L63 HydrophobicContact CG-CD1 4.06Å; F60-L63 HydrophobicContact CG-CD2 4.24Å; F60-L63 HydrophobicContact CG-CG 3.96Å; F60-L63 WeakPolarHBondContact O-CD1 3.37Å | ||
| 64 | S | 32.7 | Very low | 40 | Very low | 94 Ų | 94 | 139.3 Ų | 139.3 | 66% | 0.657 | 71% | 0.705 | S | S | * | * | 169.7 | 100.7 | 116 | -171.3 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 65 | P | 34.7 | Very low | 38.7 | Very low | 102 Ų | 102 | 139.8 Ų | 139.8 | 66% | 0.662 | 71% | 0.713 | S | S | * | * | trans | -84.7 | 141.4 | 159.2 | 33.3 | -24.7 | 0 | 0 | 0 | 108.3 | ||||
| 66 | Y | 32.3 | Very low | 37.8 | Very low | 219 Ų | 219 | 143.3 Ų | 143.3 | 86% | 0.859 | 73% | 0.726 | S | S | * | * | trans | 82.1 | 78.5 | -177.9 | -57.4 | -83.7 | 0 | 0 | 0 | 116.9 | ||||
| 67 | T | 38.4 | Very low | 36.9 | Very low | 120 Ų | 120 | 142 Ų | 142 | 74% | 0.736 | 74% | 0.737 | S | S | * | * | trans | -147.7 | 104.2 | 135.5 | -52.6 | 0 | 0 | 0 | 0 | 108.3 | I69 | T67-I69 HydrophobicContact CG2-CD1 4.41Š| ||
| 68 | Y | 30.4 | Very low | 35.6 | Very low | 227 Ų | 227 | 146.1 Ų | 146.1 | 89% | 0.89 | 75% | 0.748 | S | S | * | * | trans | -56.3 | 130.4 | 161.9 | -146.6 | -100.2 | 0 | 0 | 0 | 107.3 | ||||
| 69 | I | 39.7 | Very low | 35 | Very low | 147 Ų | 147 | 148.8 Ų | 148.8 | 75% | 0.754 | 75% | 0.751 | S | S | * | * | trans | 175.8 | 107 | 152.3 | -85.6 | 145.6 | 0 | 0 | 0 | 109.6 | T67 | T67-I69 HydrophobicContact CG2-CD1 4.41Š| ||
| 70 | K | 33 | Very low | 34.3 | Very low | 190 Ų | 190 | 151 Ų | 151 | 83% | 0.826 | 77% | 0.767 | S | S | * | * | trans | 67.8 | 128.5 | 143.3 | -132.6 | 169.5 | -172.3 | -179.8 | 0 | 121.8 | ||||
| 71 | P | 30.4 | Very low | 34.8 | Very low | 124 Ų | 124 | 151.4 Ų | 151.4 | 81% | 0.805 | 78% | 0.777 | S | S | * | * | trans | -78.7 | 123.6 | 168.2 | 32.8 | -28.8 | 0 | 0 | 0 | 109.3 | ||||
| 72 | S | 37.5 | Very low | 34.5 | Very low | 112 Ų | 112 | 146.5 Ų | 146.5 | 78% | 0.783 | 78% | 0.778 | S | S | * | * | trans | -101.3 | 102.2 | 161.9 | 39 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 73 | E | 33.8 | Very low | 34.8 | Very low | 165 Ų | 165 | 149.7 Ų | 149.7 | 77% | 0.771 | 78% | 0.775 | S | S | * | * | 70.2 | 93.7 | 98.1 | -78.6 | -79.5 | 143.9 | 0 | 0 | 111.5 | T75 | E73-T75 PolarHBondContact O-N 3.3Š| |||
| 74 | L | 32.1 | Very low | 35.4 | Very low | 168 Ų | 168 | 148.9 Ų | 148.9 | 88% | 0.88 | 78% | 0.775 | S | S | * | * | trans | -46.6 | 107.3 | 155.1 | -176.7 | 86 | 0 | 0 | 0 | 109.8 | ||||
| 75 | T | 31.4 | Very low | 36.2 | Very low | 103 Ų | 103 | 149.5 Ų | 149.5 | 63% | 0.632 | 77% | 0.771 | S | S | * | * | trans | -167.2 | 134.6 | 153.4 | 10.5 | 0 | 0 | 0 | 0 | 111.8 | E73 | E73-T75 PolarHBondContact O-N 3.3Š| ||
| 76 | Q | 38 | Very low | 37 | Very low | 185 Ų | 185 | 152.5 Ų | 152.5 | 86% | 0.864 | 77% | 0.774 | S | S | * | * | trans | 74.1 | 126.3 | 158.9 | -60.7 | 167.4 | 7.3 | 0 | 0 | 114.9 | ||||
| 77 | S | 34.7 | Very low | 38 | Very low | 102 Ų | 102 | 145.9 Ų | 145.9 | 71% | 0.713 | 75% | 0.753 | S | S | * | * | cis | -164.9 | 131.3 | 24.1 | -179.5 | 0 | 0 | 0 | 0 | 108.7 | R79 | S77-R79 PolarHBondContact O-N 2.8Š| ||
| 78 | R | 29 | Very low | 39.1 | Very low | 252 Ų | 252 | 144 Ų | 144 | 95% | 0.951 | 74% | 0.741 | S | S | * | * | trans | -54.4 | 108.4 | 156.6 | -82.3 | -179.8 | -178.2 | -173.9 | 0.5 | 107.7 | ||||
| 79 | R | 34.2 | Very low | 40.6 | Very low | 220 Ų | 220 | 138.5 Ų | 138.5 | 83% | 0.83 | 72% | 0.722 | S | S | * | * | trans | -133.1 | 94 | 155.5 | -137.7 | 175.1 | -155.9 | -175.8 | 5.8 | 109.5 | S77 T81 | S77-R79 PolarHBondContact O-N 2.8Å; R79-T81 PolarHBondContact O-N 3.36Å; R79-T81 VanDerWaalsContact O-N 3.17Å | ||
| 80 | S | 29.5 | Very low | 41.6 | Very low | 118 Ų | 118 | 137.3 Ų | 137.3 | 83% | 0.825 | 71% | 0.712 | S | S | * | * | trans | -55.4 | 113.3 | 160.6 | 58.8 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 81 | T | 45.4 | Very low | 43.2 | Very low | 97 Ų | 97 | 132.7 Ų | 132.7 | 60% | 0.595 | 70% | 0.696 | S | S | * | * | trans | -133.9 | 117.9 | 154.8 | 56.7 | 0 | 0 | 0 | 0 | 106.6 | R79 R83 | R79-T81 PolarHBondContact O-N 3.36Å; R79-T81 VanDerWaalsContact O-N 3.17Å; T81-R83 PolarHBondContact O-N 2.84Å | ||
| 82 | G | 36.1 | Very low | 45.2 | Very low | 89 Ų | 89 | 131 Ų | 131 | 92% | 0.918 | 68% | 0.68 | S | S | * | * | trans | -63.6 | 96 | -176.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 83 | R | 42 | Very low | 46.7 | Very low | 197 Ų | 197 | 129.8 Ų | 129.8 | 74% | 0.743 | 66% | 0.664 | S | S | * | * | trans | -126.1 | 98.9 | 172.7 | -89.3 | -180 | 156.8 | 119.6 | -4.6 | 109.2 | T81 | T81-R83 PolarHBondContact O-N 2.84Š| ||
| 84 | T | 49.1 | Very low | 48.3 | Very low | 96 Ų | 96 | 124.2 Ų | 124.2 | 59% | 0.589 | 64% | 0.639 | S | S | * | * | trans | 33.1 | 119.5 | 148.9 | 57.5 | 0 | 0 | 0 | 0 | 118.8 | K86 D87 | T84-K86 PolarHBondContact O-N 3.15Å; T84-D87 PolarHBondContact O-N 3.04Å | ||
| 85 | D | 49.6 | Very low | 50.2 | Low | 106 Ų | 106 | 119.6 Ų | 119.6 | 57% | 0.567 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -38.2 | -7.9 | 166.6 | 177.4 | 50.3 | 0 | 0 | 0 | 117.6 | T88 K89 | D85-T88 PolarHBondContact O-OG1 3.4Å; D85-T88 VanDerWaalsContact O-OG1 3.13Å; D85-K89 WeakPolarHBondContact O-CD 3.3Å; D85-K89 IonicContact OD1-NZ 2.8Å; D85-K89 IonicContact OD2-NZ 3.52Å; D85-K89 PolarHBondContact OD2-NZ 3.4Å |
| 86 | K | 51.3 | Low | 51.8 | Low | 166 Ų | 166 | 118.1 Ų | 118.1 | 72% | 0.722 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -77.2 | -33.5 | 173.5 | -64.5 | -178.9 | -179.5 | 174.5 | 0 | 112.4 | T84 F90 | T84-K86 PolarHBondContact O-N 3.15Å; K86-F90 PolarHBondContact O-N 3.33Å; K86-F90 VanDerWaalsContact O-N 3.13Å |
| 87 | D | 53 | Low | 52.8 | Low | 80 Ų | 80 | 114.9 Ų | 114.9 | 43% | 0.428 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -79.2 | -32.5 | -173.9 | -63.4 | -33 | 0 | 0 | 0 | 112.2 | T84 F90 N91 | T84-D87 PolarHBondContact O-N 3.04Å; D87-F90 PolarHBondContact O-N 2.87Å; D87-N91 PolarHBondContact O-N 3.32Å; D87-N91 PolarHBondContact O-ND2 3.38Å |
| 88 | T | 62 | Low | 53.9 | Low | 79 Ų | 79 | 118.3 Ų | 118.3 | 49% | 0.485 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -62.9 | -51.5 | 171.1 | 42.4 | 0 | 0 | 0 | 0 | 110.7 | D85 F90 N91 D92 | D85-T88 PolarHBondContact O-OG1 3.4Å; D85-T88 VanDerWaalsContact O-OG1 3.13Å; T88-F90 PolarHBondContact O-N 3.48Å; T88-N91 PolarHBondContact O-N 3.41Å; T88-N91 VanDerWaalsContact O-N 3.14Å; T88-D92 VanDerWaalsContact O-CG 3.24Å; T88-D92 PolarHBondContact O-N 3.02Å |
| 89 | K | 62 | Low | 55.3 | Low | 112 Ų | 112 | 109 Ų | 109 | 49% | 0.487 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -57.7 | -35.2 | 175.6 | -73 | 171.7 | -179.7 | 157 | 0 | 112.8 | D85 I93 | D85-K89 WeakPolarHBondContact O-CD 3.3Å; D85-K89 IonicContact OD1-NZ 2.8Å; D85-K89 IonicContact OD2-NZ 3.52Å; D85-K89 PolarHBondContact OD2-NZ 3.4Å; K89-I93 WeakPolarHBondContact O-CD1 3.4Å; K89-I93 WeakPolarHBondContact O-CG1 3.46Å; K89-I93 PolarHBondContact O-N 3.03Å; K89-I93 VanDerWaalsContact O-N 3.13Å |
| 90 | F | 59.1 | Low | 56.4 | Low | 122 Ų | 122 | 102.4 Ų | 102.4 | 54% | 0.535 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -72 | -40.5 | 178.3 | -167.1 | -103.1 | 0 | 0 | 0 | 112.4 | K86 D87 T88 I93 I94 | K86-F90 PolarHBondContact O-N 3.33Å; K86-F90 VanDerWaalsContact O-N 3.13Å; D87-F90 PolarHBondContact O-N 2.87Å; T88-F90 PolarHBondContact O-N 3.48Å; F90-I93 PolarHBondContact O-N 3.42Å; F90-I94 HydrophobicContact CD1-CD1 3.61Å; F90-I94 HydrophobicContact CD1-CG1 4.35Å; F90-I94 HydrophobicContact CE1-CD1 3.38Å; F90-I94 HydrophobicContact CE1-CG1 4.18Å; F90-I94 HydrophobicContact CZ-CD1 4.2Å; F90-I94 WeakPolarHBondContact O-CG1 2.86Å; F90-I94 PolarHBondContact O-N 2.85Å |
| 91 | N | 67.5 | Low | 57.4 | Low | 94 Ų | 94 | 103.7 Ų | 103.7 | 50% | 0.503 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.8 | -40.4 | 173.3 | -78.6 | -54.5 | 0 | 0 | 0 | 111.6 | D87 T88 I93 I94 T95 | D87-N91 PolarHBondContact O-N 3.32Å; D87-N91 PolarHBondContact O-ND2 3.38Å; T88-N91 PolarHBondContact O-N 3.41Å; T88-N91 VanDerWaalsContact O-N 3.14Å; N91-I93 VanDerWaalsContact C-N 3.32Å; N91-I93 PolarHBondContact O-N 2.97Å; N91-I94 PolarHBondContact O-N 2.79Å; N91-I94 VanDerWaalsContact O-N 3.15Å; N91-T95 WeakPolarHBondContact O-CB 3.24Å; N91-T95 PolarHBondContact O-N 2.95Å; N91-T95 PolarHBondContact O-OG1 2.97Å |
| 92 | D | 71.6 | Confident | 57.8 | Low | 87 Ų | 87 | 105.7 Ų | 105.7 | 47% | 0.465 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -60.7 | -41.3 | 175.6 | -62.8 | -17.4 | 0 | 0 | 0 | 111.5 | T88 T95 L96 | T88-D92 VanDerWaalsContact O-CG 3.24Å; T88-D92 PolarHBondContact O-N 3.02Å; D92-T95 PolarHBondContact O-N 3.26Å; D92-L96 VanDerWaalsContact O-CB 3.27Å; D92-L96 WeakPolarHBondContact O-CB 3.02Å; D92-L96 WeakPolarHBondContact O-CG 3.23Å; D92-L96 PolarHBondContact O-N 3.31Å |
| 93 | I | 69.8 | Low | 58.4 | Low | 88 Ų | 88 | 107.2 Ų | 107.2 | 45% | 0.451 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.7 | -38.7 | 176.3 | -68.1 | 162.8 | 0 | 0 | 0 | 111.3 | K89 F90 N91 R97 | K89-I93 WeakPolarHBondContact O-CD1 3.4Å; K89-I93 WeakPolarHBondContact O-CG1 3.46Å; K89-I93 PolarHBondContact O-N 3.03Å; K89-I93 VanDerWaalsContact O-N 3.13Å; F90-I93 PolarHBondContact O-N 3.42Å; N91-I93 VanDerWaalsContact C-N 3.32Å; N91-I93 PolarHBondContact O-N 2.97Å; I93-R97 WeakPolarHBondContact O-CB 3.46Å; I93-R97 WeakPolarHBondContact O-CG 3.37Å; I93-R97 PolarHBondContact O-N 2.8Å |
| 94 | I | 66.9 | Low | 58.5 | Low | 48 Ų | 48 | 103.9 Ų | 103.9 | 25% | 0.246 | 54% | 0.54 | C | S | . | . | H | α-helix | trans | -66.6 | -43.8 | 175.8 | -69.1 | 170.9 | 0 | 0 | 0 | 110.3 | F90 N91 R97 R98 | F90-I94 HydrophobicContact CD1-CD1 3.61Å; F90-I94 HydrophobicContact CD1-CG1 4.35Å; F90-I94 HydrophobicContact CE1-CD1 3.38Å; F90-I94 HydrophobicContact CE1-CG1 4.18Å; F90-I94 HydrophobicContact CZ-CD1 4.2Å; F90-I94 WeakPolarHBondContact O-CG1 2.86Å; F90-I94 PolarHBondContact O-N 2.85Å; N91-I94 PolarHBondContact O-N 2.79Å; N91-I94 VanDerWaalsContact O-N 3.15Å; I94-R97 PolarHBondContact O-N 3.44Å; I94-R98 VanDerWaalsContact CG2-CZ 3.42Å; I94-R98 VanDerWaalsContact CG2-NH1 3.28Å; I94-R98 WeakPolarHBondContact O-CG 3.16Å; I94-R98 PolarHBondContact O-N 3.08Å |
| 95 | T | 71.4 | Confident | 58.4 | Low | 70 Ų | 70 | 104.5 Ų | 104.5 | 43% | 0.429 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.8 | -45.5 | 178.4 | -57.3 | 0 | 0 | 0 | 0 | 110.9 | N91 D92 R97 R98 C99 | N91-T95 WeakPolarHBondContact O-CB 3.24Å; N91-T95 PolarHBondContact O-N 2.95Å; N91-T95 PolarHBondContact O-OG1 2.97Å; D92-T95 PolarHBondContact O-N 3.26Å; T95-R97 VanDerWaalsContact C-N 3.3Å; T95-R97 PolarHBondContact O-N 3Å; T95-R98 PolarHBondContact O-N 3.14Å; T95-R98 VanDerWaalsContact O-N 3.08Å; T95-C99 PolarHBondContact O-N 3.27Å; T95-C99 PolarHBondContact O-SG 3.22Å; T95-C99 VanDerWaalsContact O-SG 3.33Å |
| 96 | L | 66.5 | Low | 58.3 | Low | 73 Ų | 73 | 106.7 Ų | 106.7 | 38% | 0.382 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -58.6 | -40.1 | 173.3 | -84 | 164.4 | 0 | 0 | 0 | 112.2 | D92 C99 A100 I113 | D92-L96 VanDerWaalsContact O-CB 3.27Å; D92-L96 WeakPolarHBondContact O-CB 3.02Å; D92-L96 WeakPolarHBondContact O-CG 3.23Å; D92-L96 PolarHBondContact O-N 3.31Å; L96-C99 PolarHBondContact O-N 3.07Å; L96-A100 WeakPolarHBondContact O-CB 3.06Å; L96-A100 PolarHBondContact O-N 3.37Å; L96-I113 HydrophobicContact CD2-CD1 4.1Å; L96-I113 HydrophobicContact CD2-CG1 4.13Å |
| 97 | R | 58.3 | Low | 58.1 | Low | 117 Ų | 117 | 105.8 Ų | 105.8 | 44% | 0.442 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -64.9 | -38.2 | 174.3 | -86.5 | -177.9 | 171.2 | -173.3 | -2.6 | 112.8 | I93 I94 T95 A100 L101 G276 | I93-R97 WeakPolarHBondContact O-CB 3.46Å; I93-R97 WeakPolarHBondContact O-CG 3.37Å; I93-R97 PolarHBondContact O-N 2.8Å; I94-R97 PolarHBondContact O-N 3.44Å; T95-R97 VanDerWaalsContact C-N 3.3Å; T95-R97 PolarHBondContact O-N 3Å; R97-A100 PolarHBondContact O-N 3.42Å; R97-L101 VanDerWaalsContact O-CG 3.3Å; R97-L101 WeakPolarHBondContact O-CG 3.35Å; R97-L101 PolarHBondContact O-N 2.98Å; R97-G276 PolarHBondContact NH2-O 3.2Å |
| 98 | R | 57.7 | Low | 57.8 | Low | 173 Ų | 173 | 107.2 Ų | 107.2 | 65% | 0.653 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -66.6 | -38.3 | 176.4 | -73.5 | -179.3 | -177.1 | 129.5 | -0.4 | 111.6 | I94 T95 | I94-R98 VanDerWaalsContact CG2-CZ 3.42Å; I94-R98 VanDerWaalsContact CG2-NH1 3.28Å; I94-R98 WeakPolarHBondContact O-CG 3.16Å; I94-R98 PolarHBondContact O-N 3.08Å; T95-R98 PolarHBondContact O-N 3.14Å; T95-R98 VanDerWaalsContact O-N 3.08Å |
| 99 | C | 58.9 | Low | 56.6 | Low | 58 Ų | 58 | 106.1 Ų | 106.1 | 39% | 0.392 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -70.8 | -33.9 | 175.8 | -61.3 | 0 | 0 | 0 | 0 | 112.7 | T95 L96 I113 | T95-C99 PolarHBondContact O-N 3.27Å; T95-C99 PolarHBondContact O-SG 3.22Å; T95-C99 VanDerWaalsContact O-SG 3.33Å; L96-C99 PolarHBondContact O-N 3.07Å; C99-I113 HydrophobicContact CB-CD1 3.97Å |
| 100 | A | 56.3 | Low | 55.4 | Low | 81 Ų | 81 | 106.5 Ų | 106.5 | 67% | 0.669 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -76.3 | -19.8 | -180 | 0 | 0 | 0 | 0 | 0 | 114.3 | L96 R97 | L96-A100 WeakPolarHBondContact O-CB 3.06Å; L96-A100 PolarHBondContact O-N 3.37Å; R97-A100 PolarHBondContact O-N 3.42Å |
| 101 | L | 51.6 | Low | 54.6 | Low | 145 Ų | 145 | 105.5 Ų | 105.5 | 76% | 0.759 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.1 | -2.4 | -179.9 | -68.3 | 173.4 | 0 | 0 | 0 | 113.5 | R97 | R97-L101 VanDerWaalsContact O-CG 3.3Å; R97-L101 WeakPolarHBondContact O-CG 3.35Å; R97-L101 PolarHBondContact O-N 2.98Å |
| 102 | M | 54.4 | Low | 53.5 | Low | 138 Ų | 138 | 105.6 Ų | 105.6 | 68% | 0.68 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -69.9 | 127.4 | 172.2 | -88.2 | -178.8 | 106.9 | 0 | 0 | 109.4 | L104 | M102-L104 PolarHBondContact O-N 3.04Š|
| 103 | P | 46.8 | Very low | 52.2 | Low | 121 Ų | 121 | 105.9 Ų | 105.9 | 79% | 0.786 | 60% | 0.597 | S | S | * | * | trans | -61.6 | 112 | 169.6 | 24 | -29.2 | 0 | 0 | 0 | 107.8 | N105 | P103-N105 PolarHBondContact O-N 3.14Š| ||
| 104 | L | 45.1 | Very low | 51.1 | Low | 128 Ų | 128 | 104.9 Ų | 104.9 | 67% | 0.67 | 60% | 0.598 | S | S | * | * | trans | -65.5 | 100.4 | 174.7 | -74.7 | 148.1 | 0 | 0 | 0 | 107.5 | M102 A109 | M102-L104 PolarHBondContact O-N 3.04Å; L104-A109 HydrophobicContact CD2-CB 3.45Å; L104-A109 VanDerWaalsContact CD2-CB 3.45Å | ||
| 105 | N | 46.5 | Very low | 50 | Low | 109 Ų | 109 | 108.5 Ų | 108.5 | 58% | 0.583 | 62% | 0.618 | S | S | * | * | trans | -61.5 | 131.9 | 159.5 | -173.1 | 10.3 | 0 | 0 | 0 | 107.2 | P103 N107 T108 | P103-N105 PolarHBondContact O-N 3.14Å; N105-N107 PolarHBondContact O-N 2.97Å; N105-T108 PolarHBondContact O-N 3.35Å | ||
| 106 | N | 47.7 | Very low | 48.7 | Very low | 152 Ų | 152 | 112 Ų | 112 | 81% | 0.813 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.9 | -7.7 | -171.4 | -79.4 | 7 | 0 | 0 | 0 | 114.5 | ||
| 107 | N | 46.4 | Very low | 47.4 | Very low | 146 Ų | 146 | 118 Ų | 118 | 78% | 0.781 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.2 | 10.3 | -177 | -62.6 | -0.7 | 0 | 0 | 0 | 113.9 | N105 | N105-N107 PolarHBondContact O-N 2.97Š|
| 108 | T | 47.5 | Very low | 46.6 | Very low | 110 Ų | 110 | 119.7 Ų | 119.7 | 68% | 0.675 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -139.4 | 15.3 | -173 | -19.7 | 0 | 0 | 0 | 0 | 115.3 | N105 | N105-T108 PolarHBondContact O-N 3.35Š|
| 109 | A | 36.7 | Very low | 45.9 | Very low | 56 Ų | 56 | 117.1 Ų | 117.1 | 46% | 0.463 | 66% | 0.662 | S | S | . | * | trans | -88.1 | 133.2 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | L104 | L104-A109 HydrophobicContact CD2-CB 3.45Å; L104-A109 VanDerWaalsContact CD2-CB 3.45Å | ||
| 110 | C | 36.3 | Very low | 45 | Very low | 120 Ų | 120 | 119.9 Ų | 119.9 | 81% | 0.811 | 68% | 0.682 | S | S | * | * | S | Bend | trans | 83.2 | 74.5 | 168.9 | -68.9 | 0 | 0 | 0 | 0 | 118.2 | ||
| 111 | S | 43 | Very low | 44.2 | Very low | 102 Ų | 102 | 119.4 Ų | 119.4 | 71% | 0.713 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -143.7 | -13.9 | 154.2 | 60 | 0 | 0 | 0 | 0 | 115.4 | ||
| 112 | S | 45.2 | Very low | 43.6 | Very low | 95 Ų | 95 | 122.5 Ų | 122.5 | 66% | 0.664 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -100.8 | -15.8 | -172.9 | 56.9 | 0 | 0 | 0 | 0 | 116.3 | ||
| 113 | I | 44.6 | Very low | 42.9 | Very low | 93 Ų | 93 | 122.7 Ų | 122.7 | 48% | 0.477 | 69% | 0.691 | S | S | . | * | S | Bend | trans | -101 | -4.7 | -170 | -128.8 | 155.2 | 0 | 0 | 0 | 114.8 | L96 C99 | L96-I113 HydrophobicContact CD2-CD1 4.1Å; L96-I113 HydrophobicContact CD2-CG1 4.13Å; C99-I113 HydrophobicContact CB-CD1 3.97Å |
| 114 | S | 46 | Very low | 42.6 | Very low | 68 Ų | 68 | 122 Ų | 122 | 48% | 0.476 | 69% | 0.689 | S | S | . | * | S | Bend | trans | -99.8 | -12.5 | -171.8 | -52.4 | 0 | 0 | 0 | 0 | 114.6 | ||
| 115 | N | 43.9 | Very low | 42.5 | Very low | 123 Ų | 123 | 124 Ų | 124 | 66% | 0.658 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -94.2 | -17.8 | -175 | -73.9 | -18.9 | 0 | 0 | 0 | 114.6 | ||
| 116 | E | 42.8 | Very low | 42.2 | Very low | 143 Ų | 143 | 126.2 Ų | 126.2 | 67% | 0.668 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | -15.9 | -176.4 | -81.3 | -168.5 | 144.8 | 0 | 0 | 114.8 | ||
| 117 | Y | 40.5 | Very low | 41.6 | Very low | 201 Ų | 201 | 127.5 Ų | 127.5 | 79% | 0.788 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.9 | -7.7 | 179.2 | -97.1 | -93.2 | 0 | 0 | 0 | 115 | ||
| 118 | M | 41.7 | Very low | 41.2 | Very low | 152 Ų | 152 | 125 Ų | 125 | 75% | 0.749 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.4 | -10.9 | -176.3 | -87.4 | -81.3 | 169.4 | 0 | 0 | 114.9 | ||
| 119 | N | 42.1 | Very low | 41 | Very low | 118 Ų | 118 | 126.5 Ų | 126.5 | 63% | 0.631 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -102 | -13.4 | 179.2 | -95.7 | -6.7 | 0 | 0 | 0 | 115.4 | G121 | N119-G121 VanDerWaalsContact C-N 3.32Å; N119-G121 PolarHBondContact O-N 2.83Å |
| 120 | S | 39.8 | Very low | 41 | Very low | 117 Ų | 117 | 132.4 Ų | 132.4 | 82% | 0.818 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.9 | -7.4 | 178.1 | -75.8 | 0 | 0 | 0 | 0 | 114.5 | ||
| 121 | G | 40.3 | Very low | 40.9 | Very low | 71 Ų | 71 | 131.8 Ų | 131.8 | 73% | 0.732 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.6 | 2.9 | -178.1 | 0 | 0 | 0 | 0 | 0 | 116 | N119 | N119-G121 VanDerWaalsContact C-N 3.32Å; N119-G121 PolarHBondContact O-N 2.83Å |
| 122 | R | 39.1 | Very low | 40.7 | Very low | 210 Ų | 210 | 132 Ų | 132 | 79% | 0.792 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -128.5 | -0.2 | -169.5 | -88.9 | -176.4 | 144.6 | 122.6 | -2.7 | 116.9 | ||
| 123 | N | 38.7 | Very low | 40.3 | Very low | 141 Ų | 141 | 134.3 Ų | 134.3 | 75% | 0.754 | 74% | 0.738 | S | S | * | * | trans | -106.4 | 20 | -171.9 | -70 | -15.1 | 0 | 0 | 0 | 115.3 | ||||
| 124 | S | 40.5 | Very low | 40.2 | Very low | 108 Ų | 108 | 138.6 Ų | 138.6 | 76% | 0.755 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -93.6 | 5.5 | -177.8 | 61.9 | 0 | 0 | 0 | 0 | 116.3 | ||
| 125 | E | 42.8 | Very low | 39.8 | Very low | 168 Ų | 168 | 142.7 Ų | 142.7 | 79% | 0.785 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -130.2 | 11.8 | -169.5 | -66.6 | -170.1 | 155.8 | 0 | 0 | 117.3 | ||
| 126 | N | 41.1 | Very low | 39.8 | Very low | 157 Ų | 157 | 143.5 Ų | 143.5 | 84% | 0.84 | 78% | 0.778 | S | S | * | * | trans | -130.9 | 34 | 179.2 | -79.3 | -49.7 | 0 | 0 | 0 | 115.1 | S128 | N126-S128 PolarHBondContact O-N 3.3Š| ||
| 127 | L | 33.9 | Very low | 39.4 | Very low | 179 Ų | 179 | 142.2 Ų | 142.2 | 94% | 0.937 | 78% | 0.782 | S | S | * | * | trans | -94.6 | 75.7 | 171.7 | -160.5 | 84.2 | 0 | 0 | 0 | 110.5 | ||||
| 128 | S | 39.5 | Very low | 39 | Very low | 94 Ų | 94 | 143.6 Ų | 143.6 | 66% | 0.657 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -155.4 | -7.6 | 168.1 | 53.1 | 0 | 0 | 0 | 0 | 116.6 | N126 | N126-S128 PolarHBondContact O-N 3.3Š|
| 129 | N | 42.1 | Very low | 38.8 | Very low | 141 Ų | 141 | 143.2 Ų | 143.2 | 75% | 0.754 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -131.8 | 64.2 | -170.4 | -63.2 | -27.2 | 0 | 0 | 0 | 113.8 | ||
| 130 | L | 36.1 | Very low | 38.8 | Very low | 180 Ų | 180 | 141.6 Ų | 141.6 | 94% | 0.942 | 79% | 0.785 | S | S | * | * | trans | -170.1 | 84.3 | 145.9 | -132.7 | 65.6 | 0 | 0 | 0 | 111.6 | ||||
| 131 | S | 35.4 | Very low | 38.9 | Very low | 106 Ų | 106 | 143 Ų | 143 | 74% | 0.741 | 78% | 0.783 | S | S | * | * | trans | -76.4 | 165.6 | 161 | -66.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 132 | T | 39.4 | Very low | 39 | Very low | 108 Ų | 108 | 148.2 Ų | 148.2 | 66% | 0.663 | 79% | 0.788 | S | S | * | * | trans | 90.7 | 82.3 | 157.6 | 3.4 | 0 | 0 | 0 | 0 | 118.3 | F134 | T132-F134 HydrophobicContact CG2-CD2 3.82Å; T132-F134 HydrophobicContact CG2-CE2 3.29Å; T132-F134 HydrophobicContact CG2-CZ 3.82Å | ||
| 133 | T | 35 | Very low | 38.9 | Very low | 143 Ų | 143 | 145.7 Ų | 145.7 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | trans | -91.8 | 112.9 | 152.4 | -47.3 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 134 | F | 42.6 | Very low | 39 | Very low | 182 Ų | 182 | 146.5 Ų | 146.5 | 80% | 0.798 | 79% | 0.794 | S | S | * | * | trans | -88.7 | 144.2 | 168 | -78.4 | -82.8 | 0 | 0 | 0 | 110.9 | T132 | T132-F134 HydrophobicContact CG2-CD2 3.82Å; T132-F134 HydrophobicContact CG2-CE2 3.29Å; T132-F134 HydrophobicContact CG2-CZ 3.82Å | ||
| 135 | I | 38.2 | Very low | 39.1 | Very low | 154 Ų | 154 | 151.9 Ų | 151.9 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | trans | -85.1 | 138.2 | -178.5 | -65.1 | 163.3 | 0 | 0 | 0 | 109.8 | ||||
| 136 | T | 43.3 | Very low | 38.9 | Very low | 140 Ų | 140 | 151.3 Ų | 151.3 | 86% | 0.859 | 80% | 0.799 | S | S | * | * | trans | -174.8 | 139.8 | 144.8 | 18.2 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 137 | P | 36 | Very low | 39 | Very low | 117 Ų | 117 | 149.4 Ų | 149.4 | 76% | 0.76 | 79% | 0.793 | S | S | * | * | trans | -107.7 | 168.4 | -178.4 | 38.9 | -30.5 | 0 | 0 | 0 | 114.5 | ||||
| 138 | R | 32.4 | Very low | 39.4 | Very low | 229 Ų | 229 | 148.1 Ų | 148.1 | 86% | 0.864 | 79% | 0.788 | S | S | * | * | trans | 86.9 | 104.4 | 152.6 | -159.2 | -178.9 | -169.6 | 138.4 | 1.4 | 118.1 | ||||
| 139 | N | 37.6 | Very low | 39.7 | Very low | 145 Ų | 145 | 151.8 Ų | 151.8 | 78% | 0.775 | 80% | 0.798 | S | S | * | * | -176.9 | 157.7 | 107.7 | -116.2 | -16.2 | 0 | 0 | 0 | 113.2 | |||||
| 140 | S | 40.4 | Very low | 39.9 | Very low | 83 Ų | 83 | 149.7 Ų | 149.7 | 58% | 0.58 | 79% | 0.791 | S | S | * | * | trans | -51.8 | 159.6 | -175.7 | 50.1 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 141 | N | 42.4 | Very low | 40.4 | Very low | 148 Ų | 148 | 148.6 Ų | 148.6 | 79% | 0.791 | 78% | 0.781 | S | S | * | * | trans | 84.5 | 98.3 | 163.4 | -46.3 | -27.9 | 0 | 0 | 0 | 114.4 | ||||
| 142 | Q | 43.2 | Very low | 40.8 | Very low | 180 Ų | 180 | 151 Ų | 151 | 84% | 0.841 | 79% | 0.785 | S | S | * | * | trans | -177.7 | 63.2 | 142.7 | -77 | -119.9 | 18.6 | 0 | 0 | 108.5 | ||||
| 143 | L | 36.3 | Very low | 41.3 | Very low | 156 Ų | 156 | 155.4 Ų | 155.4 | 82% | 0.817 | 80% | 0.798 | S | S | * | * | trans | -104.1 | 72.3 | 167.2 | -174.6 | 77.4 | 0 | 0 | 0 | 107 | ||||
| 144 | D | 42 | Very low | 41.5 | Very low | 159 Ų | 159 | 156.1 Ų | 156.1 | 85% | 0.85 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -160.4 | 16.5 | 175.8 | -100.3 | -25 | 0 | 0 | 0 | 115.5 | ||
| 145 | R | 40.9 | Very low | 41.3 | Very low | 220 Ų | 220 | 157.2 Ų | 157.2 | 83% | 0.83 | 80% | 0.796 | S | S | * | * | trans | -131.7 | 16.6 | 176.8 | -96 | -167.9 | -163.2 | -174.1 | 6.6 | 116.2 | T147 | R145-T147 VanDerWaalsContact C-N 3.25Å; R145-T147 PolarHBondContact O-N 3.42Å; R145-T147 VanDerWaalsContact O-N 3.11Å | ||
| 146 | L | 40.1 | Very low | 41.5 | Very low | 156 Ų | 156 | 155.2 Ų | 155.2 | 82% | 0.817 | 80% | 0.796 | S | S | * | * | trans | -83.5 | 65.1 | 170.7 | -81 | 167 | 0 | 0 | 0 | 110.9 | ||||
| 147 | T | 43.3 | Very low | 41.7 | Very low | 117 Ų | 117 | 154 Ų | 154 | 72% | 0.718 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -167.8 | 127.9 | 167.4 | 21 | 0 | 0 | 0 | 0 | 106.9 | R145 | R145-T147 VanDerWaalsContact C-N 3.25Å; R145-T147 PolarHBondContact O-N 3.42Å; R145-T147 VanDerWaalsContact O-N 3.11Å |
| 148 | N | 42 | Very low | 42.4 | Very low | 152 Ų | 152 | 154.7 Ų | 154.7 | 81% | 0.813 | 80% | 0.795 | S | S | * | * | trans | 111.7 | 6.4 | -178.3 | -55.6 | -10.4 | 0 | 0 | 0 | 116.5 | T150 | N148-T150 PolarHBondContact O-N 3.38Š| ||
| 149 | I | 45.7 | Very low | 43.1 | Very low | 172 Ų | 172 | 148.8 Ų | 148.8 | 88% | 0.882 | 79% | 0.789 | S | S | * | * | trans | -92.2 | 78 | 157.9 | -55 | 175.4 | 0 | 0 | 0 | 107.2 | ||||
| 150 | T | 46.5 | Very low | 43.8 | Very low | 97 Ų | 97 | 148.1 Ų | 148.1 | 60% | 0.595 | 79% | 0.791 | S | S | * | * | trans | -137.4 | 109.7 | 176.5 | 28.2 | 0 | 0 | 0 | 0 | 110.4 | N148 | N148-T150 PolarHBondContact O-N 3.38Š| ||
| 151 | Q | 46.8 | Very low | 44.5 | Very low | 157 Ų | 157 | 149.9 Ų | 149.9 | 73% | 0.734 | 79% | 0.794 | S | S | * | * | S | Bend | trans | 92.8 | -18.9 | 134.8 | -66.4 | 177.8 | -52 | 0 | 0 | 122.1 | ||
| 152 | D | 43.8 | Very low | 44.9 | Very low | 156 Ų | 156 | 151.4 Ų | 151.4 | 83% | 0.834 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -98.9 | 0.2 | -168.8 | -74.1 | -17.8 | 0 | 0 | 0 | 118.5 | ||
| 153 | Q | 48 | Very low | 45.5 | Very low | 200 Ų | 200 | 148.5 Ų | 148.5 | 94% | 0.935 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -120.8 | 12.2 | -178.3 | -71.9 | -139.2 | -18.9 | 0 | 0 | 117.1 | ||
| 154 | L | 39.7 | Very low | 46.7 | Very low | 159 Ų | 159 | 142.8 Ų | 142.8 | 83% | 0.832 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -108.4 | 13.7 | -179.4 | -149.4 | 90 | 0 | 0 | 0 | 115.1 | ||
| 155 | Y | 39.3 | Very low | 47.8 | Very low | 204 Ų | 204 | 139.7 Ų | 139.7 | 80% | 0.8 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -111.9 | 8.4 | -169.8 | -81.6 | -74.8 | 0 | 0 | 0 | 117.2 | ||
| 156 | S | 42.5 | Very low | 49.2 | Very low | 112 Ų | 112 | 133.8 Ų | 133.8 | 78% | 0.783 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -122.6 | 11.8 | -172.9 | -60.2 | 0 | 0 | 0 | 0 | 117.7 | ||
| 157 | S | 46.9 | Very low | 50.7 | Low | 115 Ų | 115 | 133.8 Ų | 133.8 | 80% | 0.804 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -120.7 | 15.6 | -171.5 | -54.8 | 0 | 0 | 0 | 0 | 117.3 | ||
| 158 | T | 49.9 | Very low | 52 | Low | 131 Ų | 131 | 133.2 Ų | 133.2 | 80% | 0.804 | 71% | 0.713 | S | S | * | * | trans | -124.7 | 32.3 | -171.3 | -30.5 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 159 | S | 47.9 | Very low | 53.5 | Low | 106 Ų | 106 | 132.2 Ų | 132.2 | 74% | 0.741 | 70% | 0.701 | S | S | * | * | trans | -107.3 | 6.2 | -173.6 | 37.9 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 160 | T | 52.6 | Low | 54.9 | Low | 131 Ų | 131 | 131.4 Ų | 131.4 | 80% | 0.804 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -103 | -4.1 | -176.1 | 54.6 | 0 | 0 | 0 | 0 | 116.4 | ||
| 161 | N | 54.3 | Low | 56.3 | Low | 120 Ų | 120 | 129.6 Ų | 129.6 | 64% | 0.642 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -105 | 4.2 | -174 | -131.3 | -38 | 0 | 0 | 0 | 115.7 | ||
| 162 | Y | 51.2 | Low | 57.7 | Low | 179 Ų | 179 | 127 Ų | 127 | 70% | 0.702 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -73.4 | -30.1 | 176.1 | -107.6 | -95.4 | 0 | 0 | 0 | 113 | G164 | Y162-G164 PolarHBondContact O-N 2.97Å |
| 163 | N | 56.8 | Low | 59.5 | Low | 119 Ų | 119 | 124.2 Ų | 124.2 | 64% | 0.636 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -73.4 | -25.1 | -178 | -79.8 | -24.7 | 0 | 0 | 0 | 113.7 | K167 | N163-K167 WeakPolarHBondContact O-CG 3.42Å; N163-K167 PolarHBondContact O-N 2.76Å |
| 164 | G | 61.2 | Low | 61.1 | Low | 37 Ų | 37 | 119.9 Ų | 119.9 | 38% | 0.381 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -71.9 | -43.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y162 N166 K167 L168 | Y162-G164 PolarHBondContact O-N 2.97Å; G164-N166 VanDerWaalsContact C-N 3.34Å; G164-N166 PolarHBondContact O-N 3.02Å; G164-K167 PolarHBondContact O-N 2.75Å; G164-L168 PolarHBondContact O-N 3.4Å; G164-L168 VanDerWaalsContact O-N 3.16Å |
| 165 | N | 64.7 | Low | 62.8 | Low | 93 Ų | 93 | 116.2 Ų | 116.2 | 50% | 0.497 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -64.7 | -38.3 | -178.8 | -67.9 | -18.2 | 0 | 0 | 0 | 112 | K167 L168 K169 | N165-K167 PolarHBondContact O-N 2.82Å; N165-L168 PolarHBondContact O-N 2.7Å; N165-K169 WeakPolarHBondContact O-CB 3.44Å; N165-K169 PolarHBondContact O-N 3.23Å |
| 166 | N | 70.6 | Confident | 64.8 | Low | 97 Ų | 97 | 109.3 Ų | 109.3 | 52% | 0.519 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -66.3 | -36.9 | 176.5 | -68.9 | -13.6 | 0 | 0 | 0 | 112.2 | G164 R170 | G164-N166 VanDerWaalsContact C-N 3.34Å; G164-N166 PolarHBondContact O-N 3.02Å; N166-R170 WeakPolarHBondContact O-CB 3.34Å; N166-R170 PolarHBondContact O-N 3.11Å |
| 167 | K | 71.2 | Confident | 66.9 | Low | 156 Ų | 156 | 108 Ų | 108 | 68% | 0.678 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -66.6 | -42.9 | 177 | -72.5 | 176.4 | -177.7 | -176.5 | 0 | 112 | N163 G164 N165 R170 S171 | N163-K167 WeakPolarHBondContact O-CG 3.42Å; N163-K167 PolarHBondContact O-N 2.76Å; G164-K167 PolarHBondContact O-N 2.75Å; N165-K167 PolarHBondContact O-N 2.82Å; K167-R170 PolarHBondContact O-N 3.13Å; K167-S171 PolarHBondContact O-N 2.83Å |
| 168 | L | 71 | Confident | 68.6 | Low | 105 Ų | 105 | 105.7 Ų | 105.7 | 55% | 0.55 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -67.6 | -46.4 | 178.5 | -178.7 | 61.6 | 0 | 0 | 0 | 111.5 | G164 N165 R170 S171 I172 | G164-L168 PolarHBondContact O-N 3.4Å; G164-L168 VanDerWaalsContact O-N 3.16Å; N165-L168 PolarHBondContact O-N 2.7Å; L168-R170 VanDerWaalsContact C-N 3.3Å; L168-R170 PolarHBondContact O-N 3.43Å; L168-S171 PolarHBondContact O-N 2.99Å; L168-S171 VanDerWaalsContact O-N 3.07Å; L168-S171 PolarHBondContact O-OG 3.1Å; L168-I172 HydrophobicContact CD1-CD1 4.48Å; L168-I172 HydrophobicContact CG-CD1 4.31Å; L168-I172 PolarHBondContact O-N 3.49Å; L168-I172 VanDerWaalsContact O-N 3.08Å |
| 169 | K | 73 | Confident | 70 | Confident | 131 Ų | 131 | 101.6 Ų | 101.6 | 57% | 0.57 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -55.7 | -47.9 | 175.2 | -174.7 | 179.5 | 176.4 | -172 | 0 | 110.9 | N165 S171 I172 E173 | N165-K169 WeakPolarHBondContact O-CB 3.44Å; N165-K169 PolarHBondContact O-N 3.23Å; K169-S171 VanDerWaalsContact C-N 3.3Å; K169-S171 PolarHBondContact O-N 3.4Å; K169-I172 PolarHBondContact O-N 3.14Å; K169-E173 WeakPolarHBondContact CE-OE1 3.45Å; K169-E173 WeakPolarHBondContact CG-OE1 3.49Å; K169-E173 WeakPolarHBondContact O-CG 3.47Å; K169-E173 PolarHBondContact O-N 3.42Å |
| 170 | R | 74.4 | Confident | 71.9 | Confident | 155 Ų | 155 | 102.2 Ų | 102.2 | 59% | 0.585 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -60.8 | -36.5 | 176.7 | -171.1 | 173.8 | -173 | -166.7 | -2.5 | 112.5 | N166 K167 L168 F174 | N166-R170 WeakPolarHBondContact O-CB 3.34Å; N166-R170 PolarHBondContact O-N 3.11Å; K167-R170 PolarHBondContact O-N 3.13Å; L168-R170 VanDerWaalsContact C-N 3.3Å; L168-R170 PolarHBondContact O-N 3.43Å; R170-F174 HydrophobicContact CG-CD2 3.59Å; R170-F174 HydrophobicContact CG-CE2 3.35Å; R170-F174 HydrophobicContact CG-CZ 4.31Å; R170-F174 WeakPolarHBondContact O-CB 3.37Å; R170-F174 WeakPolarHBondContact O-CD2 3.42Å; R170-F174 WeakPolarHBondContact O-CG 3.46Å; R170-F174 PolarHBondContact O-N 3.48Å |
| 171 | S | 76.1 | Confident | 73.5 | Confident | 58 Ų | 58 | 100.7 Ų | 100.7 | 41% | 0.406 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.3 | -36 | 177.1 | 75.6 | 0 | 0 | 0 | 0 | 113.5 | K167 L168 K169 K175 | K167-S171 PolarHBondContact O-N 2.83Å; L168-S171 PolarHBondContact O-N 2.99Å; L168-S171 VanDerWaalsContact O-N 3.07Å; L168-S171 PolarHBondContact O-OG 3.1Å; K169-S171 VanDerWaalsContact C-N 3.3Å; K169-S171 PolarHBondContact O-N 3.4Å; S171-K175 VanDerWaalsContact O-CB 3.3Å; S171-K175 WeakPolarHBondContact O-CB 3.46Å; S171-K175 PolarHBondContact O-N 2.83Å |
| 172 | I | 77.6 | Confident | 74.9 | Confident | 104 Ų | 104 | 99.2 Ų | 99.2 | 53% | 0.533 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -70.8 | -42.2 | 176.1 | -63.5 | 167.3 | 0 | 0 | 0 | 110 | L168 K169 K175 A176 | L168-I172 HydrophobicContact CD1-CD1 4.48Å; L168-I172 HydrophobicContact CG-CD1 4.31Å; L168-I172 PolarHBondContact O-N 3.49Å; L168-I172 VanDerWaalsContact O-N 3.08Å; K169-I172 PolarHBondContact O-N 3.14Å; I172-K175 WeakPolarHBondContact O-CB 3.47Å; I172-K175 PolarHBondContact O-N 3.25Å; I172-A176 PolarHBondContact O-N 2.88Å |
| 173 | E | 80.2 | Confident | 76.4 | Confident | 97 Ų | 97 | 93.2 Ų | 93.2 | 45% | 0.453 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61.1 | -48.6 | 174.6 | -71 | 170.7 | -179.3 | 0 | 0 | 111.2 | K169 K175 A176 I177 | K169-E173 WeakPolarHBondContact CE-OE1 3.45Å; K169-E173 WeakPolarHBondContact CG-OE1 3.49Å; K169-E173 WeakPolarHBondContact O-CG 3.47Å; K169-E173 PolarHBondContact O-N 3.42Å; E173-K175 VanDerWaalsContact C-N 3.25Å; E173-K175 PolarHBondContact O-N 3.15Å; E173-A176 PolarHBondContact O-N 2.96Å; E173-A176 VanDerWaalsContact O-N 3.14Å; E173-I177 WeakPolarHBondContact O-CG1 3.41Å; E173-I177 PolarHBondContact O-N 3.44Å |
| 174 | F | 82.3 | Confident | 77.9 | Confident | 108 Ų | 108 | 90.8 Ų | 90.8 | 47% | 0.474 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -61.3 | -33.8 | 175.8 | -82.8 | -54.2 | 0 | 0 | 0 | 113 | R170 I177 S178 | R170-F174 HydrophobicContact CG-CD2 3.59Å; R170-F174 HydrophobicContact CG-CE2 3.35Å; R170-F174 HydrophobicContact CG-CZ 4.31Å; R170-F174 WeakPolarHBondContact O-CB 3.37Å; R170-F174 WeakPolarHBondContact O-CD2 3.42Å; R170-F174 WeakPolarHBondContact O-CG 3.46Å; R170-F174 PolarHBondContact O-N 3.48Å; F174-I177 HydrophobicContact CD1-CD1 4.45Å; F174-I177 PolarHBondContact O-N 3.19Å; F174-S178 VanDerWaalsContact O-CB 3.26Å; F174-S178 WeakPolarHBondContact O-CB 3.33Å; F174-S178 PolarHBondContact O-N 3.32Å |
| 175 | K | 76.3 | Confident | 79 | Confident | 83 Ų | 83 | 92.2 Ų | 92.2 | 36% | 0.361 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64.9 | -41.9 | 175 | 178.4 | 178.8 | 178.9 | 132.1 | 0 | 111.8 | S171 I172 E173 S178 M179 A235 | S171-K175 VanDerWaalsContact O-CB 3.3Å; S171-K175 WeakPolarHBondContact O-CB 3.46Å; S171-K175 PolarHBondContact O-N 2.83Å; I172-K175 WeakPolarHBondContact O-CB 3.47Å; I172-K175 PolarHBondContact O-N 3.25Å; E173-K175 VanDerWaalsContact C-N 3.25Å; E173-K175 PolarHBondContact O-N 3.15Å; K175-S178 PolarHBondContact O-N 2.8Å; K175-M179 HydrophobicContact CG-CE 4.43Å; K175-M179 WeakPolarHBondContact O-CG 3.42Å; K175-M179 PolarHBondContact O-N 3.38Å; K175-M179 VanDerWaalsContact O-N 3.08Å; K175-A235 WeakPolarHBondContact CE-O 3.48Å; K175-A235 PolarHBondContact NZ-O 3.44Å |
| 176 | A | 80.9 | Confident | 79.9 | Confident | 58 Ų | 58 | 88.2 Ų | 88.2 | 48% | 0.479 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -65.2 | -43.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | I172 E173 S178 M179 F180 | I172-A176 PolarHBondContact O-N 2.88Å; E173-A176 PolarHBondContact O-N 2.96Å; E173-A176 VanDerWaalsContact O-N 3.14Å; A176-S178 VanDerWaalsContact C-N 3.31Å; A176-S178 PolarHBondContact O-N 3.29Å; A176-M179 WeakPolarHBondContact O-CB 3.31Å; A176-M179 PolarHBondContact O-N 2.97Å; A176-F180 PolarHBondContact O-N 2.94Å; A176-F180 VanDerWaalsContact O-N 3.15Å |
| 177 | I | 86.4 | Confident | 80.5 | Confident | 85 Ų | 85 | 87.2 Ų | 87.2 | 44% | 0.436 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -61.8 | -40.7 | 174.8 | -65.4 | 166.4 | 0 | 0 | 0 | 110.7 | E173 F174 M179 F180 L181 | E173-I177 WeakPolarHBondContact O-CG1 3.41Å; E173-I177 PolarHBondContact O-N 3.44Å; F174-I177 HydrophobicContact CD1-CD1 4.45Å; F174-I177 PolarHBondContact O-N 3.19Å; I177-M179 VanDerWaalsContact C-N 3.34Å; I177-M179 PolarHBondContact O-N 3.3Å; I177-F180 WeakPolarHBondContact O-CB 3.45Å; I177-F180 PolarHBondContact O-N 3.07Å; I177-F180 VanDerWaalsContact O-N 3.14Å; I177-L181 HydrophobicContact CG2-CD1 3.93Å; I177-L181 HydrophobicContact CG2-CG 4.24Å; I177-L181 WeakPolarHBondContact O-CG 3.45Å; I177-L181 PolarHBondContact O-N 3.32Å |
| 178 | S | 81.6 | Confident | 81.2 | Confident | 67 Ų | 67 | 85.2 Ų | 85.2 | 47% | 0.469 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -61.9 | -39.8 | 177.1 | 178.5 | 0 | 0 | 0 | 0 | 112.3 | F174 K175 A176 F180 L181 F182 | F174-S178 VanDerWaalsContact O-CB 3.26Å; F174-S178 WeakPolarHBondContact O-CB 3.33Å; F174-S178 PolarHBondContact O-N 3.32Å; K175-S178 PolarHBondContact O-N 2.8Å; A176-S178 VanDerWaalsContact C-N 3.31Å; A176-S178 PolarHBondContact O-N 3.29Å; S178-F180 VanDerWaalsContact C-N 3.31Å; S178-F180 PolarHBondContact O-N 3.02Å; S178-L181 PolarHBondContact O-N 2.72Å; S178-F182 PolarHBondContact O-N 2.86Å |
| 179 | M | 80.8 | Confident | 81.9 | Confident | 45 Ų | 45 | 86.8 Ų | 86.8 | 22% | 0.222 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -60.8 | -43.1 | 173.3 | -70 | 175.3 | 179.9 | 0 | 0 | 111.1 | K175 A176 I177 F182 N183 I231 A235 | K175-M179 HydrophobicContact CG-CE 4.43Å; K175-M179 WeakPolarHBondContact O-CG 3.42Å; K175-M179 PolarHBondContact O-N 3.38Å; K175-M179 VanDerWaalsContact O-N 3.08Å; A176-M179 WeakPolarHBondContact O-CB 3.31Å; A176-M179 PolarHBondContact O-N 2.97Å; I177-M179 VanDerWaalsContact C-N 3.34Å; I177-M179 PolarHBondContact O-N 3.3Å; M179-F182 PolarHBondContact O-N 3.25Å; M179-N183 WeakPolarHBondContact O-CB 3.41Å; M179-N183 PolarHBondContact O-N 3.32Å; M179-I231 HydrophobicContact CB-CG2 4.13Å; M179-I231 HydrophobicContact CG-CG2 4.34Å; M179-A235 HydrophobicContact CE-CB 3.34Å; M179-A235 HydrophobicContact CG-CB 3.39Å; M179-A235 HydrophobicContact SD-CB 4.18Å |
| 180 | F | 86.7 | Confident | 82.2 | Confident | 119 Ų | 119 | 80.7 Ų | 80.7 | 52% | 0.522 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -64.6 | -45.1 | 177.2 | 180 | -107.3 | 0 | 0 | 0 | 112.2 | A176 I177 S178 F182 N183 L184 | A176-F180 PolarHBondContact O-N 2.94Å; A176-F180 VanDerWaalsContact O-N 3.15Å; I177-F180 WeakPolarHBondContact O-CB 3.45Å; I177-F180 PolarHBondContact O-N 3.07Å; I177-F180 VanDerWaalsContact O-N 3.14Å; S178-F180 VanDerWaalsContact C-N 3.31Å; S178-F180 PolarHBondContact O-N 3.02Å; F180-F182 VanDerWaalsContact C-N 3.34Å; F180-F182 PolarHBondContact O-N 3.22Å; F180-N183 WeakPolarHBondContact O-CB 3.36Å; F180-N183 PolarHBondContact O-N 2.9Å; F180-L184 HydrophobicContact CD1-CD1 3.73Å; F180-L184 HydrophobicContact CD1-CG 4.17Å; F180-L184 HydrophobicContact CD2-CG 4.42Å; F180-L184 HydrophobicContact CE1-CD1 3.15Å; F180-L184 HydrophobicContact CE1-CD2 4.42Å; F180-L184 HydrophobicContact CE1-CG 3.81Å; F180-L184 HydrophobicContact CE2-CD1 4.26Å; F180-L184 HydrophobicContact CE2-CD2 4.1Å; F180-L184 HydrophobicContact CE2-CG 4.05Å; F180-L184 HydrophobicContact CG-CG 4.48Å; F180-L184 HydrophobicContact CZ-CD1 3.46Å; F180-L184 VanDerWaalsContact CZ-CD1 3.46Å; F180-L184 HydrophobicContact CZ-CD2 3.87Å; F180-L184 HydrophobicContact CZ-CG 3.74Å; F180-L184 WeakPolarHBondContact O-CG 3.31Å; F180-L184 PolarHBondContact O-N 2.88Å |
| 181 | L | 87.5 | Confident | 82.5 | Confident | 99 Ų | 99 | 77.7 Ų | 77.7 | 52% | 0.518 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -59.9 | -42.9 | 177 | -75.5 | 169.1 | 0 | 0 | 0 | 112 | I177 S178 L184 S185 | I177-L181 HydrophobicContact CG2-CD1 3.93Å; I177-L181 HydrophobicContact CG2-CG 4.24Å; I177-L181 WeakPolarHBondContact O-CG 3.45Å; I177-L181 PolarHBondContact O-N 3.32Å; S178-L181 PolarHBondContact O-N 2.72Å; L181-L184 PolarHBondContact O-N 3.48Å; L181-S185 VanDerWaalsContact O-CB 3.31Å; L181-S185 WeakPolarHBondContact O-CB 3.49Å; L181-S185 PolarHBondContact O-N 3.33Å; L181-S185 PolarHBondContact O-OG 3.21Å |
| 182 | F | 83.2 | Confident | 82.9 | Confident | 89 Ų | 89 | 79.7 Ų | 79.7 | 39% | 0.39 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -65.7 | -43.7 | 175.4 | -167.7 | -71 | 0 | 0 | 0 | 110.9 | S178 M179 F180 L184 S185 S186 F227 I231 | S178-F182 PolarHBondContact O-N 2.86Å; M179-F182 PolarHBondContact O-N 3.25Å; F180-F182 VanDerWaalsContact C-N 3.34Å; F180-F182 PolarHBondContact O-N 3.22Å; F182-L184 VanDerWaalsContact C-N 3.35Å; F182-L184 PolarHBondContact O-N 3.45Å; F182-S185 PolarHBondContact O-N 2.81Å; F182-S186 WeakPolarHBondContact O-CB 3.49Å; F182-S186 PolarHBondContact O-N 3.06Å; F182-F227 AromaticContact CE1-CD1 3.94Å; F182-F227 HydrophobicContact CE1-CD1 3.94Å; F182-F227 HydrophobicContact CZ-CD1 4.29Å; F182-I231 HydrophobicContact CB-CG1 4.41Å; F182-I231 HydrophobicContact CD1-CB 4.39Å; F182-I231 HydrophobicContact CD1-CD1 3.57Å; F182-I231 HydrophobicContact CD1-CG1 3.11Å; F182-I231 HydrophobicContact CE1-CD1 4.02Å; F182-I231 HydrophobicContact CE1-CG1 3.43Å; F182-I231 VanDerWaalsContact CE1-CG1 3.43Å; F182-I231 HydrophobicContact CG-CG1 3.97Å |
| 183 | N | 82.2 | Confident | 83 | Confident | 52 Ų | 52 | 75.5 Ų | 75.5 | 28% | 0.278 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -58.5 | -46.8 | 177.1 | -172.1 | 48.2 | 0 | 0 | 0 | 111.6 | M179 F180 S186 I187 I231 | M179-N183 WeakPolarHBondContact O-CB 3.41Å; M179-N183 PolarHBondContact O-N 3.32Å; F180-N183 WeakPolarHBondContact O-CB 3.36Å; F180-N183 PolarHBondContact O-N 2.9Å; N183-S186 WeakPolarHBondContact O-CB 3.37Å; N183-S186 PolarHBondContact O-N 3.44Å; N183-I187 WeakPolarHBondContact O-CD1 3.47Å; N183-I187 VanDerWaalsContact O-CG1 3.25Å; N183-I187 WeakPolarHBondContact O-CG1 3.25Å; N183-I187 PolarHBondContact O-N 3.43Å; N183-I231 HydrophobicContact CB-CD1 4.07Å |
| 184 | L | 87.4 | Confident | 82.8 | Confident | 68 Ų | 68 | 74.9 Ų | 74.9 | 36% | 0.356 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -61.7 | -44.8 | 175.1 | -73 | -175.9 | 0 | 0 | 0 | 112.3 | F180 L181 F182 S186 I187 L188 | F180-L184 HydrophobicContact CD1-CD1 3.73Å; F180-L184 HydrophobicContact CD1-CG 4.17Å; F180-L184 HydrophobicContact CD2-CG 4.42Å; F180-L184 HydrophobicContact CE1-CD1 3.15Å; F180-L184 HydrophobicContact CE1-CD2 4.42Å; F180-L184 HydrophobicContact CE1-CG 3.81Å; F180-L184 HydrophobicContact CE2-CD1 4.26Å; F180-L184 HydrophobicContact CE2-CD2 4.1Å; F180-L184 HydrophobicContact CE2-CG 4.05Å; F180-L184 HydrophobicContact CG-CG 4.48Å; F180-L184 HydrophobicContact CZ-CD1 3.46Å; F180-L184 VanDerWaalsContact CZ-CD1 3.46Å; F180-L184 HydrophobicContact CZ-CD2 3.87Å; F180-L184 HydrophobicContact CZ-CG 3.74Å; F180-L184 WeakPolarHBondContact O-CG 3.31Å; F180-L184 PolarHBondContact O-N 2.88Å; L181-L184 PolarHBondContact O-N 3.48Å; F182-L184 VanDerWaalsContact C-N 3.35Å; F182-L184 PolarHBondContact O-N 3.45Å; L184-S186 VanDerWaalsContact C-N 3.29Å; L184-S186 PolarHBondContact O-N 2.83Å; L184-I187 PolarHBondContact O-N 3.17Å; L184-L188 WeakPolarHBondContact O-CG 2.98Å; L184-L188 PolarHBondContact O-N 2.8Å |
| 185 | S | 85.8 | Confident | 82.7 | Confident | 68 Ų | 68 | 76.2 Ų | 76.2 | 48% | 0.476 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -62 | -40.8 | 178.2 | -58.6 | 0 | 0 | 0 | 0 | 111.1 | L181 F182 L188 L189 | L181-S185 VanDerWaalsContact O-CB 3.31Å; L181-S185 WeakPolarHBondContact O-CB 3.49Å; L181-S185 PolarHBondContact O-N 3.33Å; L181-S185 PolarHBondContact O-OG 3.21Å; F182-S185 PolarHBondContact O-N 2.81Å; S185-L188 PolarHBondContact O-N 3.5Å; S185-L189 VanDerWaalsContact O-CB 3.25Å; S185-L189 WeakPolarHBondContact O-CB 3.41Å; S185-L189 PolarHBondContact O-N 2.92Å |
| 186 | S | 82.6 | Confident | 83 | Confident | 9 Ų | 9 | 74.5 Ų | 74.5 | 6% | 0.063 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -63.3 | -45.1 | 175 | 178.9 | 0 | 0 | 0 | 0 | 111.2 | F182 N183 L184 L188 L189 C190 F227 | F182-S186 WeakPolarHBondContact O-CB 3.49Å; F182-S186 PolarHBondContact O-N 3.06Å; N183-S186 WeakPolarHBondContact O-CB 3.37Å; N183-S186 PolarHBondContact O-N 3.44Å; L184-S186 VanDerWaalsContact C-N 3.29Å; L184-S186 PolarHBondContact O-N 2.83Å; S186-L188 VanDerWaalsContact C-N 3.33Å; S186-L188 PolarHBondContact O-N 2.92Å; S186-L189 PolarHBondContact O-N 3.37Å; S186-C190 WeakPolarHBondContact O-CB 3.39Å; S186-C190 PolarHBondContact O-N 3.16Å; S186-F227 WeakPolarHBondContact OG-CB 3.25Å; S186-F227 WeakPolarHBondContact OG-CD2 3.07Å; S186-F227 VanDerWaalsContact OG-CG 3.31Å; S186-F227 WeakPolarHBondContact OG-CG 3.22Å |
| 187 | I | 83.3 | Confident | 83.1 | Confident | 76 Ų | 76 | 72.5 Ų | 72.5 | 39% | 0.39 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -59.1 | -48.4 | 176.8 | -70.1 | 162.6 | 0 | 0 | 0 | 109.5 | N183 L184 W191 | N183-I187 WeakPolarHBondContact O-CD1 3.47Å; N183-I187 VanDerWaalsContact O-CG1 3.25Å; N183-I187 WeakPolarHBondContact O-CG1 3.25Å; N183-I187 PolarHBondContact O-N 3.43Å; L184-I187 PolarHBondContact O-N 3.17Å; I187-W191 WeakPolarHBondContact O-CB 2.93Å; I187-W191 PolarHBondContact O-N 3.05Å |
| 188 | L | 86.6 | Confident | 82.7 | Confident | 114 Ų | 114 | 73.8 Ų | 73.8 | 60% | 0.597 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -63.2 | -48.1 | 178.4 | -69.3 | 173 | 0 | 0 | 0 | 111.9 | L184 S185 S186 C190 W191 L192 | L184-L188 WeakPolarHBondContact O-CG 2.98Å; L184-L188 PolarHBondContact O-N 2.8Å; S185-L188 PolarHBondContact O-N 3.5Å; S186-L188 VanDerWaalsContact C-N 3.33Å; S186-L188 PolarHBondContact O-N 2.92Å; L188-C190 PolarHBondContact O-N 3.29Å; L188-W191 PolarHBondContact O-N 2.85Å; L188-L192 WeakPolarHBondContact O-CA 3.35Å; L188-L192 WeakPolarHBondContact O-CB 3.43Å; L188-L192 PolarHBondContact O-N 3.21Å |
| 189 | L | 84.1 | Confident | 82.8 | Confident | 137 Ų | 137 | 75 Ų | 75 | 72% | 0.717 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -70.7 | -32.2 | -174.7 | -160 | 68.9 | 0 | 0 | 0 | 113.3 | S185 S186 P193 | S185-L189 VanDerWaalsContact O-CB 3.25Å; S185-L189 WeakPolarHBondContact O-CB 3.41Å; S185-L189 PolarHBondContact O-N 2.92Å; S186-L189 PolarHBondContact O-N 3.37Å; L189-P193 WeakPolarHBondContact O-CD 3.26Å; L189-P193 VanDerWaalsContact O-CG 3.32Å; L189-P193 WeakPolarHBondContact O-CG 3.49Å |
| 190 | C | 80.3 | Confident | 82.9 | Confident | 4 Ų | 4 | 77.7 Ų | 77.7 | 3% | 0.027 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -75.7 | -33.6 | 176.1 | 174.9 | 0 | 0 | 0 | 0 | 111.2 | S186 L188 L220 R221 C224 | S186-C190 WeakPolarHBondContact O-CB 3.39Å; S186-C190 PolarHBondContact O-N 3.16Å; L188-C190 PolarHBondContact O-N 3.29Å; C190-L220 PolarHBondContact SG-O 3.44Å; C190-R221 WeakPolarHBondContact SG-CA 3.41Å; C190-R221 PolarHBondContact SG-O 3.2Å; C190-R221 VanDerWaalsContact SG-O 3.38Å; C190-C224 HydrophobicContact CB-CB 4.44Å; C190-C224 WeakPolarHBondContact CB-SG 3.18Å; C190-C224 WeakPolarHBondContact SG-CB 3.31Å; C190-C224 PolarHBondContact SG-N 3.11Å; C190-C224 CovalentContact SG-SG 2.07Å; C190-C224 PolarHBondContact SG-SG 3.02Å |
| 191 | W | 81.6 | Confident | 82.5 | Confident | 91 Ų | 91 | 76.1 Ų | 76.1 | 35% | 0.345 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -95.4 | -42.8 | -173.9 | -164.7 | -63.7 | 0 | 0 | 0 | 113.6 | I187 L188 P193 Y194 Y195 | I187-W191 WeakPolarHBondContact O-CB 2.93Å; I187-W191 PolarHBondContact O-N 3.05Å; L188-W191 PolarHBondContact O-N 2.85Å; W191-P193 VanDerWaalsContact C-CD 3.43Å; W191-P193 VanDerWaalsContact C-N 3.33Å; W191-Y194 WeakPolarHBondContact O-CA 2.72Å; W191-Y194 WeakPolarHBondContact O-CB 3.28Å; W191-Y194 PolarHBondContact O-N 3.06Å; W191-Y195 AromaticContact CD1-CD1 3.98Å; W191-Y195 AromaticContact CD1-CD2 2.97Å; W191-Y195 AromaticContact CD1-CE1 3.96Å; W191-Y195 AromaticContact CD1-CE2 2.94Å; W191-Y195 AromaticContact CD1-CG 3.49Å; W191-Y195 VanDerWaalsContact CD1-CG 3.49Å; W191-Y195 AromaticContact CD1-CZ 3.46Å; W191-Y195 VanDerWaalsContact CD1-CZ 3.46Å; W191-Y195 HydrophobicContact CD2-CE2 4.47Å; W191-Y195 AromaticContact CE2-CE1 3.82Å; W191-Y195 AromaticContact CE2-CE2 3.79Å; W191-Y195 AromaticContact CE2-CZ 3.44Å; W191-Y195 VanDerWaalsContact CE2-CZ 3.44Å; W191-Y195 HydrophobicContact CG-CD2 4.23Å; W191-Y195 HydrophobicContact CG-CE2 4.02Å; W191-Y195 HydrophobicContact CZ2-CE1 4.05Å; W191-Y195 AromaticContact CZ2-CZ 3.84Å; W191-Y195 WeakPolarHBondContact CZ2-OH 3.24Å; W191-Y195 AromaticContact NE1-CD1 3.32Å; W191-Y195 VanDerWaalsContact NE1-CD1 3.32Å; W191-Y195 AromaticContact NE1-CD2 3.15Å; W191-Y195 AromaticContact NE1-CE1 3.03Å; W191-Y195 AromaticContact NE1-CE2 2.84Å; W191-Y195 AromaticContact NE1-CG 3.34Å; W191-Y195 VanDerWaalsContact NE1-CG 3.34Å; W191-Y195 AromaticContact NE1-CZ 2.76Å; W191-Y195 PolarHBondContact NE1-OH 2.84Å; W191-Y195 PolarHBondContact O-N 3.08Å |
| 192 | L | 83.2 | Confident | 82.1 | Confident | 100 Ų | 100 | 76.1 Ų | 76.1 | 52% | 0.524 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -47.3 | -47.1 | 180 | -172.5 | 153.3 | 0 | 0 | 0 | 113 | L188 Y194 Y195 T196 | L188-L192 WeakPolarHBondContact O-CA 3.35Å; L188-L192 WeakPolarHBondContact O-CB 3.43Å; L188-L192 PolarHBondContact O-N 3.21Å; L192-Y194 VanDerWaalsContact C-N 3.3Å; L192-Y194 PolarHBondContact O-N 2.9Å; L192-Y195 PolarHBondContact O-N 3.09Å; L192-T196 HydrophobicContact CD2-CG2 3.73Å; L192-T196 HydrophobicContact CG-CG2 4.4Å; L192-T196 WeakPolarHBondContact O-CG2 2.93Å; L192-T196 PolarHBondContact O-N 3.28Å; L192-T196 PolarHBondContact O-OG1 3.43Å |
| 193 | P | 79.9 | Confident | 81.9 | Confident | 17 Ų | 17 | 78.6 Ų | 78.6 | 11% | 0.11 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -61.3 | -39.1 | 178.9 | 19.5 | -30.8 | 0 | 0 | 0 | 113 | L189 W191 T196 L197 F217 L220 | L189-P193 WeakPolarHBondContact O-CD 3.26Å; L189-P193 VanDerWaalsContact O-CG 3.32Å; L189-P193 WeakPolarHBondContact O-CG 3.49Å; W191-P193 VanDerWaalsContact C-CD 3.43Å; W191-P193 VanDerWaalsContact C-N 3.33Å; P193-T196 VanDerWaalsContact CA-OG1 3.28Å; P193-T196 WeakPolarHBondContact CA-OG1 3.49Å; P193-T196 PolarHBondContact O-N 3.5Å; P193-T196 PolarHBondContact O-OG1 2.96Å; P193-L197 WeakPolarHBondContact O-CG 3.08Å; P193-L197 PolarHBondContact O-N 3.08Å; P193-F217 HydrophobicContact CB-CD1 3.27Å; P193-F217 HydrophobicContact CB-CE1 3.14Å; P193-F217 HydrophobicContact CB-CG 4.11Å; P193-F217 HydrophobicContact CB-CZ 3.87Å; P193-F217 HydrophobicContact CG-CD1 3.79Å; P193-F217 HydrophobicContact CG-CE1 3.88Å; P193-L220 HydrophobicContact CG-CD2 3.58Å |
| 194 | Y | 75.9 | Confident | 81.7 | Confident | 83 Ų | 83 | 80.1 Ų | 80.1 | 33% | 0.325 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -63.7 | -44.4 | 175.4 | 178.4 | -103.3 | 0 | 0 | 0 | 111.6 | W191 L192 T196 L197 F198 | W191-Y194 WeakPolarHBondContact O-CA 2.72Å; W191-Y194 WeakPolarHBondContact O-CB 3.28Å; W191-Y194 PolarHBondContact O-N 3.06Å; L192-Y194 VanDerWaalsContact C-N 3.3Å; L192-Y194 PolarHBondContact O-N 2.9Å; Y194-T196 VanDerWaalsContact C-N 3.33Å; Y194-T196 PolarHBondContact O-N 3.39Å; Y194-L197 PolarHBondContact O-N 3.44Å; Y194-F198 PolarHBondContact O-N 2.96Å; Y194-F198 VanDerWaalsContact O-N 3.1Å |
| 195 | Y | 80.5 | Confident | 80.9 | Confident | 136 Ų | 136 | 82.2 Ų | 82.2 | 53% | 0.533 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.6 | -40.1 | 173.4 | -81.3 | -35.4 | 0 | 0 | 0 | 112.2 | W191 L192 F198 L199 | W191-Y195 AromaticContact CD1-CD1 3.98Å; W191-Y195 AromaticContact CD1-CD2 2.97Å; W191-Y195 AromaticContact CD1-CE1 3.96Å; W191-Y195 AromaticContact CD1-CE2 2.94Å; W191-Y195 AromaticContact CD1-CG 3.49Å; W191-Y195 VanDerWaalsContact CD1-CG 3.49Å; W191-Y195 AromaticContact CD1-CZ 3.46Å; W191-Y195 VanDerWaalsContact CD1-CZ 3.46Å; W191-Y195 HydrophobicContact CD2-CE2 4.47Å; W191-Y195 AromaticContact CE2-CE1 3.82Å; W191-Y195 AromaticContact CE2-CE2 3.79Å; W191-Y195 AromaticContact CE2-CZ 3.44Å; W191-Y195 VanDerWaalsContact CE2-CZ 3.44Å; W191-Y195 HydrophobicContact CG-CD2 4.23Å; W191-Y195 HydrophobicContact CG-CE2 4.02Å; W191-Y195 HydrophobicContact CZ2-CE1 4.05Å; W191-Y195 AromaticContact CZ2-CZ 3.84Å; W191-Y195 WeakPolarHBondContact CZ2-OH 3.24Å; W191-Y195 AromaticContact NE1-CD1 3.32Å; W191-Y195 VanDerWaalsContact NE1-CD1 3.32Å; W191-Y195 AromaticContact NE1-CD2 3.15Å; W191-Y195 AromaticContact NE1-CE1 3.03Å; W191-Y195 AromaticContact NE1-CE2 2.84Å; W191-Y195 AromaticContact NE1-CG 3.34Å; W191-Y195 VanDerWaalsContact NE1-CG 3.34Å; W191-Y195 AromaticContact NE1-CZ 2.76Å; W191-Y195 PolarHBondContact NE1-OH 2.84Å; W191-Y195 PolarHBondContact O-N 3.08Å; L192-Y195 PolarHBondContact O-N 3.09Å; Y195-F198 WeakPolarHBondContact O-CB 3.13Å; Y195-F198 PolarHBondContact O-N 3.21Å; Y195-L199 WeakPolarHBondContact O-CG 2.94Å; Y195-L199 PolarHBondContact O-N 3.08Å |
| 196 | T | 83.1 | Confident | 80.2 | Confident | 48 Ų | 48 | 86.2 Ų | 86.2 | 29% | 0.294 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -65.2 | -42.1 | 178.2 | 56.7 | 0 | 0 | 0 | 0 | 111.9 | L192 P193 Y194 F198 L199 F200 | L192-T196 HydrophobicContact CD2-CG2 3.73Å; L192-T196 HydrophobicContact CG-CG2 4.4Å; L192-T196 WeakPolarHBondContact O-CG2 2.93Å; L192-T196 PolarHBondContact O-N 3.28Å; L192-T196 PolarHBondContact O-OG1 3.43Å; P193-T196 VanDerWaalsContact CA-OG1 3.28Å; P193-T196 WeakPolarHBondContact CA-OG1 3.49Å; P193-T196 PolarHBondContact O-N 3.5Å; P193-T196 PolarHBondContact O-OG1 2.96Å; Y194-T196 VanDerWaalsContact C-N 3.33Å; Y194-T196 PolarHBondContact O-N 3.39Å; T196-F198 VanDerWaalsContact C-N 3.28Å; T196-F198 PolarHBondContact O-N 2.89Å; T196-L199 PolarHBondContact O-N 3.18Å; T196-F200 WeakPolarHBondContact O-CD2 2.95Å; T196-F200 PolarHBondContact O-N 2.07Å |
| 197 | L | 81.5 | Confident | 79.5 | Confident | 16 Ų | 16 | 89.7 Ų | 89.7 | 8% | 0.084 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -60.7 | -40.4 | 175.9 | -71.3 | 176 | 0 | 0 | 0 | 112.1 | P193 Y194 F200 T201 L209 V213 F217 | P193-L197 WeakPolarHBondContact O-CG 3.08Å; P193-L197 PolarHBondContact O-N 3.08Å; Y194-L197 PolarHBondContact O-N 3.44Å; L197-F200 PolarHBondContact O-N 3.49Å; L197-T201 WeakPolarHBondContact O-CB 2.99Å; L197-T201 PolarHBondContact O-N 2.72Å; L197-T201 PolarHBondContact O-OG1 3.31Å; L197-L209 HydrophobicContact CD2-CD1 3.91Å; L197-L209 HydrophobicContact CD2-CD2 4.03Å; L197-V213 HydrophobicContact CD2-CG1 4.11Å; L197-F217 HydrophobicContact CD1-CB 3.59Å; L197-F217 HydrophobicContact CD1-CD2 3.22Å; L197-F217 HydrophobicContact CD1-CE2 4.06Å; L197-F217 HydrophobicContact CD1-CG 3.69Å; L197-F217 HydrophobicContact CD2-CD2 4.11Å; L197-F217 HydrophobicContact CD2-CE2 4.16Å; L197-F217 HydrophobicContact CG-CD2 3.9Å; L197-F217 HydrophobicContact CG-CE2 4.27Å |
| 198 | F | 79.5 | Confident | 78.9 | Confident | 112 Ų | 112 | 92 Ų | 92 | 49% | 0.491 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -61.3 | -49.3 | 176.2 | -171.1 | -97.4 | 0 | 0 | 0 | 110.7 | Y194 Y195 T196 F200 T201 D202 | Y194-F198 PolarHBondContact O-N 2.96Å; Y194-F198 VanDerWaalsContact O-N 3.1Å; Y195-F198 WeakPolarHBondContact O-CB 3.13Å; Y195-F198 PolarHBondContact O-N 3.21Å; T196-F198 VanDerWaalsContact C-N 3.28Å; T196-F198 PolarHBondContact O-N 2.89Å; F198-F200 VanDerWaalsContact C-N 3.34Å; F198-F200 PolarHBondContact O-N 3.22Å; F198-T201 PolarHBondContact O-N 2.9Å; F198-D202 WeakPolarHBondContact CE1-OD2 3.41Å; F198-D202 PolarHBondContact O-N 3.13Å; F198-D202 VanDerWaalsContact O-N 3.07Å |
| 199 | L | 83.8 | Confident | 78.4 | Confident | 92 Ų | 92 | 89.8 Ų | 89.8 | 48% | 0.482 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -59.8 | -41.2 | 175.7 | -68.5 | 173.5 | 0 | 0 | 0 | 112.6 | Y195 T196 D202 H203 | Y195-L199 WeakPolarHBondContact O-CG 2.94Å; Y195-L199 PolarHBondContact O-N 3.08Å; T196-L199 PolarHBondContact O-N 3.18Å; L199-D202 PolarHBondContact O-N 2.9Å; L199-H203 WeakPolarHBondContact O-CB 3.32Å; L199-H203 PolarHBondContact O-CD2 2.97Å; L199-H203 PolarHBondContact O-N 3.38Å |
| 200 | F | 82.7 | Confident | 78.2 | Confident | 102 Ų | 102 | 86.7 Ų | 86.7 | 45% | 0.447 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -66.4 | -37.6 | 177.4 | -79.7 | -63.9 | 0 | 0 | 0 | 112.6 | T196 L197 F198 D202 L204 L207 | T196-F200 WeakPolarHBondContact O-CD2 2.95Å; T196-F200 PolarHBondContact O-N 2.07Å; L197-F200 PolarHBondContact O-N 3.49Å; F198-F200 VanDerWaalsContact C-N 3.34Å; F198-F200 PolarHBondContact O-N 3.22Å; F200-D202 VanDerWaalsContact C-N 3.34Å; F200-L204 PolarHBondContact O-N 2.97Å; F200-L207 HydrophobicContact CB-CD2 4.31Å; F200-L207 HydrophobicContact CD1-CD2 4.47Å |
| 201 | T | 77.9 | Confident | 78.2 | Confident | 85 Ų | 85 | 93.8 Ų | 93.8 | 52% | 0.521 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -67.5 | -37.5 | 178.9 | -53.3 | 0 | 0 | 0 | 0 | 111.1 | L197 F198 | L197-T201 WeakPolarHBondContact O-CB 2.99Å; L197-T201 PolarHBondContact O-N 2.72Å; L197-T201 PolarHBondContact O-OG1 3.31Å; F198-T201 PolarHBondContact O-N 2.9Å |
| 202 | D | 77.9 | Confident | 78.4 | Confident | 100 Ų | 100 | 94 Ų | 94 | 54% | 0.535 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -74.1 | -37.7 | 178.1 | -71.2 | -13.8 | 0 | 0 | 0 | 112.8 | F198 L199 F200 | F198-D202 WeakPolarHBondContact CE1-OD2 3.41Å; F198-D202 PolarHBondContact O-N 3.13Å; F198-D202 VanDerWaalsContact O-N 3.07Å; L199-D202 PolarHBondContact O-N 2.9Å; F200-D202 VanDerWaalsContact C-N 3.34Å |
| 203 | H | 80.2 | Confident | 78.4 | Confident | 141 Ų | 141 | 91.7 Ų | 91.7 | 65% | 0.653 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -90.7 | -27.6 | -175.4 | -70.8 | -59.4 | 0 | 0 | 0 | 114.6 | L199 | L199-H203 WeakPolarHBondContact O-CB 3.32Å; L199-H203 PolarHBondContact O-CD2 2.97Å; L199-H203 PolarHBondContact O-N 3.38Å |
| 204 | L | 77.8 | Confident | 78.5 | Confident | 84 Ų | 84 | 96.8 Ų | 96.8 | 44% | 0.44 | 50% | 0.501 | S | S | . | . | trans | -122.6 | 84.2 | 179.6 | -83.3 | 73.8 | 0 | 0 | 0 | 110.2 | F200 N206 L207 | F200-L204 PolarHBondContact O-N 2.97Å; L204-N206 PolarHBondContact O-N 3.48Å; L204-L207 HydrophobicContact CB-CB 3.9Å; L204-L207 HydrophobicContact CD2-CB 4.41Å; L204-L207 HydrophobicContact CD2-CD1 4.43Å; L204-L207 HydrophobicContact CD2-CD2 4.45Å; L204-L207 PolarHBondContact O-N 3.48Å; L204-L207 VanDerWaalsContact O-N 3.07Å | ||
| 205 | P | 71.2 | Confident | 78.8 | Confident | 111 Ų | 111 | 97 Ų | 97 | 72% | 0.721 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.8 | -16.9 | 179 | 24.6 | -34.1 | 0 | 0 | 0 | 113.7 | ||
| 206 | N | 69.7 | Low | 79 | Confident | 153 Ų | 153 | 96.4 Ų | 96.4 | 82% | 0.818 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93 | -0.2 | 179.4 | -62 | -33.6 | 0 | 0 | 0 | 113.7 | L204 C208 | L204-N206 PolarHBondContact O-N 3.48Å; N206-C208 PolarHBondContact O-N 3.08Å |
| 207 | L | 69 | Low | 79 | Confident | 81 Ų | 81 | 96.3 Ų | 96.3 | 42% | 0.424 | 50% | 0.501 | S | S | . | . | trans | -83.9 | 98.8 | -179.6 | -162.4 | 70.7 | 0 | 0 | 0 | 109.7 | F200 L204 L209 | F200-L207 HydrophobicContact CB-CD2 4.31Å; F200-L207 HydrophobicContact CD1-CD2 4.47Å; L204-L207 HydrophobicContact CB-CB 3.9Å; L204-L207 HydrophobicContact CD2-CB 4.41Å; L204-L207 HydrophobicContact CD2-CD1 4.43Å; L204-L207 HydrophobicContact CD2-CD2 4.45Å; L204-L207 PolarHBondContact O-N 3.48Å; L204-L207 VanDerWaalsContact O-N 3.07Å; L207-L209 VanDerWaalsContact C-N 3.29Å; L207-L209 HydrophobicContact CD2-CD2 4.3Å; L207-L209 HydrophobicContact CD2-CG 4.35Å; L207-L209 PolarHBondContact O-N 3.48Å | ||
| 208 | C | 70.4 | Confident | 78.8 | Confident | 126 Ų | 126 | 100.3 Ų | 100.3 | 85% | 0.851 | 52% | 0.516 | S | S | * | . | trans | -71.2 | 85.1 | 172 | -64.3 | 0 | 0 | 0 | 0 | 110.3 | N206 S210 | N206-C208 PolarHBondContact O-N 3.08Å; C208-S210 PolarHBondContact O-N 3.23Å | ||
| 209 | L | 75.3 | Confident | 79.1 | Confident | 67 Ų | 67 | 102.1 Ų | 102.1 | 35% | 0.351 | 52% | 0.52 | S | S | . | . | trans | -65.9 | 124.3 | 168.2 | -72.5 | 164.8 | 0 | 0 | 0 | 108.9 | L197 L207 F211 | L197-L209 HydrophobicContact CD2-CD1 3.91Å; L197-L209 HydrophobicContact CD2-CD2 4.03Å; L207-L209 VanDerWaalsContact C-N 3.29Å; L207-L209 HydrophobicContact CD2-CD2 4.3Å; L207-L209 HydrophobicContact CD2-CG 4.35Å; L207-L209 PolarHBondContact O-N 3.48Å; L209-F211 PolarHBondContact O-N 2.86Å | ||
| 210 | S | 80.3 | Confident | 79 | Confident | 71 Ų | 71 | 99.4 Ų | 99.4 | 50% | 0.497 | 51% | 0.506 | S | S | . | . | trans | -61.4 | 138.7 | 175.7 | 179 | 0 | 0 | 0 | 0 | 110.1 | C208 T212 V213 Y214 | C208-S210 PolarHBondContact O-N 3.23Å; S210-T212 PolarHBondContact O-N 2.9Å; S210-T212 VanDerWaalsContact O-N 3.08Å; S210-V213 WeakPolarHBondContact O-CB 3.39Å; S210-V213 PolarHBondContact O-N 2.96Å; S210-Y214 PolarHBondContact O-N 3.47Å | ||
| 211 | F | 81 | Confident | 78.6 | Confident | 153 Ų | 153 | 99.5 Ų | 99.5 | 67% | 0.671 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -51.1 | -35.8 | 178.6 | 180 | -98.9 | 0 | 0 | 0 | 112.5 | L209 V213 Y214 E215 | L209-F211 PolarHBondContact O-N 2.86Å; F211-V213 VanDerWaalsContact C-N 3.27Å; F211-V213 PolarHBondContact O-N 2.81Å; F211-Y214 PolarHBondContact O-N 2.82Å; F211-E215 PolarHBondContact O-N 3.45Å |
| 212 | T | 84.5 | Confident | 78.6 | Confident | 95 Ų | 95 | 98.9 Ų | 98.9 | 58% | 0.583 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -58.9 | -36.3 | 176.3 | -49.2 | 0 | 0 | 0 | 0 | 112.9 | S210 F216 | S210-T212 PolarHBondContact O-N 2.9Å; S210-T212 VanDerWaalsContact O-N 3.08Å; T212-F216 VanDerWaalsContact O-CB 3.32Å; T212-F216 WeakPolarHBondContact O-CB 2.97Å; T212-F216 PolarHBondContact O-N 3.27Å |
| 213 | V | 83.8 | Confident | 78.7 | Confident | 53 Ų | 53 | 97.8 Ų | 97.8 | 32% | 0.321 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -69.9 | -44.9 | 179.8 | 179.2 | 0 | 0 | 0 | 0 | 109.8 | L197 S210 F211 E215 F216 F217 | L197-V213 HydrophobicContact CD2-CG1 4.11Å; S210-V213 WeakPolarHBondContact O-CB 3.39Å; S210-V213 PolarHBondContact O-N 2.96Å; F211-V213 VanDerWaalsContact C-N 3.27Å; F211-V213 PolarHBondContact O-N 2.81Å; V213-E215 PolarHBondContact O-N 3.31Å; V213-F216 PolarHBondContact O-N 2.8Å; V213-F217 HydrophobicContact CG1-CD2 3.67Å; V213-F217 HydrophobicContact CG1-CE2 3.5Å; V213-F217 WeakPolarHBondContact O-CD2 3.5Å; V213-F217 PolarHBondContact O-N 2.79Å; V213-F217 VanDerWaalsContact O-N 3.14Å |
| 214 | Y | 81.8 | Confident | 78.5 | Confident | 123 Ų | 123 | 92.5 Ų | 92.5 | 48% | 0.482 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -60.3 | -46.4 | 175.8 | -177.5 | -95.4 | 0 | 0 | 0 | 111.5 | S210 F211 F217 Y218 | S210-Y214 PolarHBondContact O-N 3.47Å; F211-Y214 PolarHBondContact O-N 2.82Å; Y214-F217 PolarHBondContact O-N 3.25Å; Y214-Y218 VanDerWaalsContact O-CB 3.25Å; Y214-Y218 WeakPolarHBondContact O-CB 3.05Å; Y214-Y218 PolarHBondContact O-N 3.34Å |
| 215 | E | 83.7 | Confident | 78.6 | Confident | 87 Ų | 87 | 92.6 Ų | 92.6 | 41% | 0.407 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -61.5 | -45.2 | 177.7 | -177.9 | 172 | -168.7 | 0 | 0 | 112 | F211 V213 F217 Y218 W219 | F211-E215 PolarHBondContact O-N 3.45Å; V213-E215 PolarHBondContact O-N 3.31Å; E215-F217 PolarHBondContact O-N 2.82Å; E215-Y218 WeakPolarHBondContact O-CB 3.47Å; E215-Y218 PolarHBondContact O-N 3.25Å; E215-W219 PolarHBondContact O-N 2.81Å |
| 216 | F | 84.7 | Confident | 78.9 | Confident | 124 Ų | 124 | 89.7 Ų | 89.7 | 54% | 0.544 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -57 | -49.6 | 178.4 | 176.8 | -98.8 | 0 | 0 | 0 | 112.1 | T212 V213 W219 L220 | T212-F216 VanDerWaalsContact O-CB 3.32Å; T212-F216 WeakPolarHBondContact O-CB 2.97Å; T212-F216 PolarHBondContact O-N 3.27Å; V213-F216 PolarHBondContact O-N 2.8Å; F216-W219 PolarHBondContact O-N 3.32Å; F216-L220 PolarHBondContact O-N 3.27Å |
| 217 | F | 81.8 | Confident | 79.2 | Confident | 47 Ų | 47 | 84.8 Ų | 84.8 | 21% | 0.206 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -72.9 | -30.9 | -179.1 | -71.2 | -57.7 | 0 | 0 | 0 | 113.2 | P193 L197 V213 Y214 E215 W219 L220 R221 | P193-F217 HydrophobicContact CB-CD1 3.27Å; P193-F217 HydrophobicContact CB-CE1 3.14Å; P193-F217 HydrophobicContact CB-CG 4.11Å; P193-F217 HydrophobicContact CB-CZ 3.87Å; P193-F217 HydrophobicContact CG-CD1 3.79Å; P193-F217 HydrophobicContact CG-CE1 3.88Å; L197-F217 HydrophobicContact CD1-CB 3.59Å; L197-F217 HydrophobicContact CD1-CD2 3.22Å; L197-F217 HydrophobicContact CD1-CE2 4.06Å; L197-F217 HydrophobicContact CD1-CG 3.69Å; L197-F217 HydrophobicContact CD2-CD2 4.11Å; L197-F217 HydrophobicContact CD2-CE2 4.16Å; L197-F217 HydrophobicContact CG-CD2 3.9Å; L197-F217 HydrophobicContact CG-CE2 4.27Å; V213-F217 HydrophobicContact CG1-CD2 3.67Å; V213-F217 HydrophobicContact CG1-CE2 3.5Å; V213-F217 WeakPolarHBondContact O-CD2 3.5Å; V213-F217 PolarHBondContact O-N 2.79Å; V213-F217 VanDerWaalsContact O-N 3.14Å; Y214-F217 PolarHBondContact O-N 3.25Å; E215-F217 PolarHBondContact O-N 2.82Å; F217-W219 VanDerWaalsContact C-N 3.31Å; F217-W219 PolarHBondContact O-N 2.8Å; F217-L220 HydrophobicContact CD1-CD2 3.9Å; F217-L220 HydrophobicContact CE1-CD2 4.29Å; F217-L220 WeakPolarHBondContact O-CB 3.31Å; F217-L220 PolarHBondContact O-N 2.74Å; F217-R221 PolarHBondContact O-N 2.94Å |
| 218 | Y | 78.6 | Confident | 79.3 | Confident | 100 Ų | 100 | 82.8 Ų | 82.8 | 39% | 0.392 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -58.2 | -45.4 | 170.3 | 177.4 | -93.6 | 0 | 0 | 0 | 111.5 | Y214 E215 R221 F222 | Y214-Y218 VanDerWaalsContact O-CB 3.25Å; Y214-Y218 WeakPolarHBondContact O-CB 3.05Å; Y214-Y218 PolarHBondContact O-N 3.34Å; E215-Y218 WeakPolarHBondContact O-CB 3.47Å; E215-Y218 PolarHBondContact O-N 3.25Å; Y218-R221 WeakPolarHBondContact O-CB 3.4Å; Y218-F222 HydrophobicContact CD1-CE2 4.29Å; Y218-F222 AromaticContact CE1-CE2 3.76Å; Y218-F222 HydrophobicContact CE1-CE2 3.76Å; Y218-F222 HydrophobicContact CE1-CZ 4.47Å |
| 219 | W | 84.3 | Confident | 79.4 | Confident | 149 Ų | 149 | 78.2 Ų | 78.2 | 56% | 0.564 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -70.9 | -33.4 | 176.6 | -73.8 | 114.2 | 0 | 0 | 0 | 113.1 | E215 F216 F217 R221 F222 | E215-W219 PolarHBondContact O-N 2.81Å; F216-W219 PolarHBondContact O-N 3.32Å; F217-W219 VanDerWaalsContact C-N 3.31Å; F217-W219 PolarHBondContact O-N 2.8Å; W219-R221 PolarHBondContact O-N 3.17Å; W219-F222 AromaticContact CE3-CD2 3.78Å; W219-F222 HydrophobicContact CE3-CD2 3.78Å; W219-F222 HydrophobicContact CE3-CE2 4.1Å; W219-F222 HydrophobicContact CZ3-CD2 4.22Å; W219-F222 HydrophobicContact CZ3-CE2 4.24Å; W219-F222 WeakPolarHBondContact O-CB 3.28Å; W219-F222 PolarHBondContact O-N 3.04Å |
| 220 | L | 82.9 | Confident | 79.2 | Confident | 36 Ų | 36 | 79.7 Ų | 79.7 | 19% | 0.188 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -57 | -34.9 | 179.1 | -165.9 | 70.4 | 0 | 0 | 0 | 112.2 | C190 P193 F216 F217 F222 L223 | C190-L220 PolarHBondContact SG-O 3.44Å; P193-L220 HydrophobicContact CG-CD2 3.58Å; F216-L220 PolarHBondContact O-N 3.27Å; F217-L220 HydrophobicContact CD1-CD2 3.9Å; F217-L220 HydrophobicContact CE1-CD2 4.29Å; F217-L220 WeakPolarHBondContact O-CB 3.31Å; F217-L220 PolarHBondContact O-N 2.74Å; L220-F222 PolarHBondContact O-N 3.33Å; L220-L223 HydrophobicContact CD1-CB 4.44Å; L220-L223 HydrophobicContact CD1-CD2 3.85Å; L220-L223 WeakPolarHBondContact O-CA 3.37Å; L220-L223 WeakPolarHBondContact O-CB 3.44Å; L220-L223 PolarHBondContact O-N 2.97Å |
| 221 | R | 74 | Confident | 79 | Confident | 103 Ų | 103 | 76.6 Ų | 76.6 | 39% | 0.389 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -53.7 | -35.7 | 173.6 | -170.6 | -175.4 | 68.2 | 92.6 | 0.3 | 113.2 | C190 F217 Y218 W219 L223 C224 | C190-R221 WeakPolarHBondContact SG-CA 3.41Å; C190-R221 PolarHBondContact SG-O 3.2Å; C190-R221 VanDerWaalsContact SG-O 3.38Å; F217-R221 PolarHBondContact O-N 2.94Å; Y218-R221 WeakPolarHBondContact O-CB 3.4Å; W219-R221 PolarHBondContact O-N 3.17Å; R221-L223 VanDerWaalsContact C-N 3.3Å; R221-C224 VanDerWaalsContact O-CB 3.31Å; R221-C224 WeakPolarHBondContact O-CB 3.35Å |
| 222 | F | 77.6 | Confident | 78.4 | Confident | 73 Ų | 73 | 74.6 Ų | 74.6 | 32% | 0.32 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -76.4 | -19.9 | 178.5 | -64.8 | -81.4 | 0 | 0 | 0 | 112.6 | Y218 W219 L220 C224 I225 | Y218-F222 HydrophobicContact CD1-CE2 4.29Å; Y218-F222 AromaticContact CE1-CE2 3.76Å; Y218-F222 HydrophobicContact CE1-CE2 3.76Å; Y218-F222 HydrophobicContact CE1-CZ 4.47Å; W219-F222 AromaticContact CE3-CD2 3.78Å; W219-F222 HydrophobicContact CE3-CD2 3.78Å; W219-F222 HydrophobicContact CE3-CE2 4.1Å; W219-F222 HydrophobicContact CZ3-CD2 4.22Å; W219-F222 HydrophobicContact CZ3-CE2 4.24Å; W219-F222 WeakPolarHBondContact O-CB 3.28Å; W219-F222 PolarHBondContact O-N 3.04Å; L220-F222 PolarHBondContact O-N 3.33Å; F222-C224 PolarHBondContact O-N 3.28Å; F222-I225 HydrophobicContact CD1-CD1 4.35Å; F222-I225 WeakPolarHBondContact O-CB 3.29Å; F222-I225 PolarHBondContact O-N 3.48Å |
| 223 | L | 79.5 | Confident | 77.7 | Confident | 77 Ų | 77 | 70.3 Ų | 70.3 | 40% | 0.403 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -61.5 | -27.9 | 176.1 | -154.8 | 73.3 | 0 | 0 | 0 | 111.6 | L220 R221 I225 A226 F227 | L220-L223 HydrophobicContact CD1-CB 4.44Å; L220-L223 HydrophobicContact CD1-CD2 3.85Å; L220-L223 WeakPolarHBondContact O-CA 3.37Å; L220-L223 WeakPolarHBondContact O-CB 3.44Å; L220-L223 PolarHBondContact O-N 2.97Å; R221-L223 VanDerWaalsContact C-N 3.3Å; L223-I225 PolarHBondContact O-N 3.41Å; L223-I225 VanDerWaalsContact O-N 3.13Å; L223-A226 HydrophobicContact CD1-CB 4.4Å; L223-A226 WeakPolarHBondContact O-CA 3.22Å; L223-A226 WeakPolarHBondContact O-CB 3.25Å; L223-A226 PolarHBondContact O-N 3.19Å; L223-F227 HydrophobicContact CB-CE2 4.09Å; L223-F227 HydrophobicContact CD2-CE2 3.49Å; L223-F227 VanDerWaalsContact CD2-CE2 3.49Å; L223-F227 HydrophobicContact CD2-CZ 3.66Å; L223-F227 HydrophobicContact CG-CD2 4.2Å; L223-F227 HydrophobicContact CG-CE2 3.59Å; L223-F227 HydrophobicContact CG-CZ 4.09Å; L223-F227 WeakPolarHBondContact O-CD2 3.37Å; L223-F227 PolarHBondContact O-N 2.94Å |
| 224 | C | 76.4 | Confident | 77 | Confident | 30 Ų | 30 | 71.4 Ų | 71.4 | 20% | 0.203 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -49.2 | -35.5 | 169.6 | -74.6 | 0 | 0 | 0 | 0 | 113 | C190 R221 F222 | C190-C224 HydrophobicContact CB-CB 4.44Å; C190-C224 WeakPolarHBondContact CB-SG 3.18Å; C190-C224 WeakPolarHBondContact SG-CB 3.31Å; C190-C224 PolarHBondContact SG-N 3.11Å; C190-C224 CovalentContact SG-SG 2.07Å; C190-C224 PolarHBondContact SG-SG 3.02Å; R221-C224 VanDerWaalsContact O-CB 3.31Å; R221-C224 WeakPolarHBondContact O-CB 3.35Å; F222-C224 PolarHBondContact O-N 3.28Å |
| 225 | I | 80.2 | Confident | 76.2 | Confident | 86 Ų | 86 | 66.6 Ų | 66.6 | 44% | 0.441 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -73.7 | -34.2 | 177.6 | -56.8 | 169.7 | 0 | 0 | 0 | 111 | F222 L223 L268 | F222-I225 HydrophobicContact CD1-CD1 4.35Å; F222-I225 WeakPolarHBondContact O-CB 3.29Å; F222-I225 PolarHBondContact O-N 3.48Å; L223-I225 PolarHBondContact O-N 3.41Å; L223-I225 VanDerWaalsContact O-N 3.13Å; I225-L268 HydrophobicContact CG2-CD2 4.27Å |
| 226 | A | 77.2 | Confident | 75.3 | Confident | 50 Ų | 50 | 63.4 Ų | 63.4 | 41% | 0.413 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -73 | -27.8 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L223 N228 P229 | L223-A226 HydrophobicContact CD1-CB 4.4Å; L223-A226 WeakPolarHBondContact O-CA 3.22Å; L223-A226 WeakPolarHBondContact O-CB 3.25Å; L223-A226 PolarHBondContact O-N 3.19Å; A226-N228 VanDerWaalsContact C-N 3.31Å; A226-N228 PolarHBondContact O-N 3.25Å; A226-P229 WeakPolarHBondContact O-CD 3.26Å |
| 227 | F | 77.1 | Confident | 74.5 | Confident | 50 Ų | 50 | 62.3 Ų | 62.3 | 22% | 0.219 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -69 | -27.2 | 178.5 | -75.6 | -67.1 | 0 | 0 | 0 | 113.4 | F182 S186 L223 L230 I231 | F182-F227 AromaticContact CE1-CD1 3.94Å; F182-F227 HydrophobicContact CE1-CD1 3.94Å; F182-F227 HydrophobicContact CZ-CD1 4.29Å; S186-F227 WeakPolarHBondContact OG-CB 3.25Å; S186-F227 WeakPolarHBondContact OG-CD2 3.07Å; S186-F227 VanDerWaalsContact OG-CG 3.31Å; S186-F227 WeakPolarHBondContact OG-CG 3.22Å; L223-F227 HydrophobicContact CB-CE2 4.09Å; L223-F227 HydrophobicContact CD2-CE2 3.49Å; L223-F227 VanDerWaalsContact CD2-CE2 3.49Å; L223-F227 HydrophobicContact CD2-CZ 3.66Å; L223-F227 HydrophobicContact CG-CD2 4.2Å; L223-F227 HydrophobicContact CG-CE2 3.59Å; L223-F227 HydrophobicContact CG-CZ 4.09Å; L223-F227 WeakPolarHBondContact O-CD2 3.37Å; L223-F227 PolarHBondContact O-N 2.94Å; F227-L230 HydrophobicContact CD1-CD1 3.94Å; F227-L230 HydrophobicContact CE1-CD1 4.33Å; F227-L230 CarbonylContact O-C 3.55Å; F227-L230 WeakPolarHBondContact O-CA 3.24Å; F227-L230 WeakPolarHBondContact O-CB 3.38Å; F227-L230 PolarHBondContact O-N 3.14Å; F227-I231 HydrophobicContact CB-CD1 4.19Å; F227-I231 VanDerWaalsContact O-CG1 3.22Å; F227-I231 WeakPolarHBondContact O-CG1 3.28Å; F227-I231 PolarHBondContact O-N 2.94Å |
| 228 | N | 70.5 | Confident | 73.8 | Confident | 39 Ų | 39 | 66 Ų | 66 | 21% | 0.209 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -54.1 | -55.9 | -179.3 | -72.3 | -17.4 | 0 | 0 | 0 | 112 | A226 L230 I231 Y232 G267 | A226-N228 VanDerWaalsContact C-N 3.31Å; A226-N228 PolarHBondContact O-N 3.25Å; N228-L230 VanDerWaalsContact C-N 3.28Å; N228-L230 PolarHBondContact O-N 3.38Å; N228-I231 PolarHBondContact O-N 3.42Å; N228-Y232 HydrophobicContact CB-CE2 4.43Å; N228-Y232 WeakPolarHBondContact O-CD2 3.42Å; N228-Y232 PolarHBondContact O-N 3.45Å; N228-G267 PolarHBondContact ND2-O 3.5Å |
| 229 | P | 71.5 | Confident | 73.2 | Confident | 30 Ų | 30 | 63.9 Ų | 63.9 | 20% | 0.195 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -57.3 | -34.2 | 172.2 | -27.1 | 33.6 | 0 | 0 | 0 | 115.1 | A226 G233 F243 L263 | A226-P229 WeakPolarHBondContact O-CD 3.26Å; P229-G233 WeakPolarHBondContact O-CA 3.39Å; P229-G233 PolarHBondContact O-N 2.96Å; P229-F243 HydrophobicContact CB-CZ 4.49Å; P229-L263 HydrophobicContact CB-CD2 4.32Å |
| 230 | L | 72.7 | Confident | 72.5 | Confident | 98 Ų | 98 | 63.9 Ų | 63.9 | 51% | 0.513 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -71.7 | -37.6 | -179.8 | -66.7 | 173.7 | 0 | 0 | 0 | 112.2 | F227 N228 G233 S234 | F227-L230 HydrophobicContact CD1-CD1 3.94Å; F227-L230 HydrophobicContact CE1-CD1 4.33Å; F227-L230 CarbonylContact O-C 3.55Å; F227-L230 WeakPolarHBondContact O-CA 3.24Å; F227-L230 WeakPolarHBondContact O-CB 3.38Å; F227-L230 PolarHBondContact O-N 3.14Å; N228-L230 VanDerWaalsContact C-N 3.28Å; N228-L230 PolarHBondContact O-N 3.38Å; L230-G233 PolarHBondContact O-N 3.31Å; L230-S234 VanDerWaalsContact O-CB 3.24Å; L230-S234 WeakPolarHBondContact O-CB 3.4Å; L230-S234 PolarHBondContact O-N 2.7Å; L230-S234 PolarHBondContact O-OG 3.36Å |
| 231 | I | 74.5 | Confident | 71.9 | Confident | 6 Ų | 6 | 67 Ų | 67 | 3% | 0.031 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -64.6 | -52.3 | 176.4 | -67.8 | 162.3 | 0 | 0 | 0 | 109.8 | M179 F182 N183 F227 N228 G233 S234 A235 | M179-I231 HydrophobicContact CB-CG2 4.13Å; M179-I231 HydrophobicContact CG-CG2 4.34Å; F182-I231 HydrophobicContact CB-CG1 4.41Å; F182-I231 HydrophobicContact CD1-CB 4.39Å; F182-I231 HydrophobicContact CD1-CD1 3.57Å; F182-I231 HydrophobicContact CD1-CG1 3.11Å; F182-I231 HydrophobicContact CE1-CD1 4.02Å; F182-I231 HydrophobicContact CE1-CG1 3.43Å; F182-I231 VanDerWaalsContact CE1-CG1 3.43Å; F182-I231 HydrophobicContact CG-CG1 3.97Å; N183-I231 HydrophobicContact CB-CD1 4.07Å; F227-I231 HydrophobicContact CB-CD1 4.19Å; F227-I231 VanDerWaalsContact O-CG1 3.22Å; F227-I231 WeakPolarHBondContact O-CG1 3.28Å; F227-I231 PolarHBondContact O-N 2.94Å; N228-I231 PolarHBondContact O-N 3.42Å; I231-G233 VanDerWaalsContact C-N 3.25Å; I231-G233 PolarHBondContact O-N 3.02Å; I231-S234 PolarHBondContact O-N 2.8Å; I231-S234 PolarHBondContact O-OG 2.88Å; I231-A235 WeakPolarHBondContact O-CB 3.14Å; I231-A235 PolarHBondContact O-N 3.4Å |
| 232 | Y | 68.5 | Low | 71.7 | Confident | 110 Ų | 110 | 63.7 Ų | 63.7 | 43% | 0.431 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -64.2 | -37 | 179.1 | -64.6 | -60.3 | 0 | 0 | 0 | 110.9 | N228 S236 L239 | N228-Y232 HydrophobicContact CB-CE2 4.43Å; N228-Y232 WeakPolarHBondContact O-CD2 3.42Å; N228-Y232 PolarHBondContact O-N 3.45Å; Y232-S236 PolarHBondContact O-N 2.81Å; Y232-S236 PolarHBondContact O-OG 3.45Å; Y232-L239 WeakPolarHBondContact O-CD1 3.5Å |
| 233 | G | 71 | Confident | 71.4 | Confident | 6 Ų | 6 | 62.6 Ų | 62.6 | 6% | 0.062 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -66.5 | -37.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | P229 L230 I231 R240 | P229-G233 WeakPolarHBondContact O-CA 3.39Å; P229-G233 PolarHBondContact O-N 2.96Å; L230-G233 PolarHBondContact O-N 3.31Å; I231-G233 VanDerWaalsContact C-N 3.25Å; I231-G233 PolarHBondContact O-N 3.02Å; G233-R240 PolarHBondContact O-N 3.16Å |
| 234 | S | 67.8 | Low | 71 | Confident | 75 Ų | 75 | 65.6 Ų | 65.6 | 52% | 0.524 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -81.8 | -38.7 | -177.9 | 63.2 | 0 | 0 | 0 | 0 | 112.1 | L230 I231 | L230-S234 VanDerWaalsContact O-CB 3.24Å; L230-S234 WeakPolarHBondContact O-CB 3.4Å; L230-S234 PolarHBondContact O-N 2.7Å; L230-S234 PolarHBondContact O-OG 3.36Å; I231-S234 PolarHBondContact O-N 2.8Å; I231-S234 PolarHBondContact O-OG 2.88Å |
| 235 | A | 65.2 | Low | 70.7 | Confident | 23 Ų | 23 | 71.5 Ų | 71.5 | 19% | 0.19 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -80.4 | -33.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | K175 M179 I231 | K175-A235 WeakPolarHBondContact CE-O 3.48Å; K175-A235 PolarHBondContact NZ-O 3.44Å; M179-A235 HydrophobicContact CE-CB 3.34Å; M179-A235 HydrophobicContact CG-CB 3.39Å; M179-A235 HydrophobicContact SD-CB 4.18Å; I231-A235 WeakPolarHBondContact O-CB 3.14Å; I231-A235 PolarHBondContact O-N 3.4Å |
| 236 | S | 65.3 | Low | 70.3 | Confident | 20 Ų | 20 | 72.4 Ų | 72.4 | 14% | 0.14 | 36% | 0.357 | C | S | . | . | trans | -92.6 | 128.9 | 177.7 | 69.4 | 0 | 0 | 0 | 0 | 112.2 | Y232 D238 L239 R240 | Y232-S236 PolarHBondContact O-N 2.81Å; Y232-S236 PolarHBondContact O-OG 3.45Å; S236-D238 PolarHBondContact O-N 2.99Å; S236-L239 PolarHBondContact O-N 3.32Å; S236-L239 WeakPolarHBondContact OG-CB 3.44Å; S236-L239 VanDerWaalsContact OG-CD1 3.23Å; S236-L239 WeakPolarHBondContact OG-CD1 3.46Å; S236-L239 WeakPolarHBondContact OG-CG 3.46Å; S236-L239 PolarHBondContact OG-N 3.24Å; S236-R240 PolarHBondContact O-N 3.11Å | ||
| 237 | E | 67.3 | Low | 70 | Confident | 100 Ų | 100 | 75.9 Ų | 75.9 | 47% | 0.467 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -67.3 | -32.2 | -179.3 | -164.6 | -174 | 146.9 | 0 | 0 | 111.3 | R240 K241 | E237-R240 PolarHBondContact O-N 3.02Å; E237-K241 WeakPolarHBondContact O-CG 3.36Å; E237-K241 PolarHBondContact O-N 3.25Å; E237-K241 VanDerWaalsContact OE1-CE 3.28Å; E237-K241 WeakPolarHBondContact OE1-CE 3.32Å; E237-K241 IonicContact OE1-NZ 2.72Å; E237-K241 PolarHBondContact OE1-NZ 2.75Å |
| 238 | D | 67.3 | Low | 69.7 | Low | 126 Ų | 126 | 79.1 Ų | 79.1 | 67% | 0.674 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -66.1 | -43.8 | 177.3 | -58.9 | -43.5 | 0 | 0 | 0 | 111.7 | S236 K241 A242 | S236-D238 PolarHBondContact O-N 2.99Å; D238-K241 PolarHBondContact O-N 3.39Å; D238-A242 PolarHBondContact O-N 2.94Å; D238-A242 VanDerWaalsContact O-N 3.11Å |
| 239 | L | 65.8 | Low | 69.4 | Low | 55 Ų | 55 | 82.9 Ų | 82.9 | 29% | 0.288 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -72.4 | -35.3 | 175.6 | -60.7 | 177.9 | 0 | 0 | 0 | 111.1 | Y232 S236 K241 A242 F243 L263 | Y232-L239 WeakPolarHBondContact O-CD1 3.5Å; S236-L239 PolarHBondContact O-N 3.32Å; S236-L239 WeakPolarHBondContact OG-CB 3.44Å; S236-L239 VanDerWaalsContact OG-CD1 3.23Å; S236-L239 WeakPolarHBondContact OG-CD1 3.46Å; S236-L239 WeakPolarHBondContact OG-CG 3.46Å; S236-L239 PolarHBondContact OG-N 3.24Å; L239-K241 VanDerWaalsContact C-N 3.26Å; L239-K241 PolarHBondContact O-N 3.1Å; L239-A242 CarbonylContact O-C 3.52Å; L239-A242 WeakPolarHBondContact O-CA 3.35Å; L239-A242 WeakPolarHBondContact O-CB 3.3Å; L239-A242 PolarHBondContact O-N 3.36Å; L239-F243 HydrophobicContact CB-CD2 4.14Å; L239-F243 HydrophobicContact CB-CE2 4.12Å; L239-F243 WeakPolarHBondContact O-CD2 3.15Å; L239-F243 PolarHBondContact O-N 3.38Å; L239-L263 HydrophobicContact CD1-CD1 4.38Å |
| 240 | R | 69.6 | Low | 68.9 | Low | 148 Ų | 148 | 87.2 Ų | 87.2 | 56% | 0.558 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -57.6 | -41 | 173.5 | -171.7 | 177.4 | 68.6 | 160.2 | -1.4 | 111.8 | G233 S236 E237 F243 K244 | G233-R240 PolarHBondContact O-N 3.16Å; S236-R240 PolarHBondContact O-N 3.11Å; E237-R240 PolarHBondContact O-N 3.02Å; R240-F243 PolarHBondContact O-N 2.85Å; R240-K244 VanDerWaalsContact O-CB 3.27Å; R240-K244 WeakPolarHBondContact O-CB 3.24Å; R240-K244 PolarHBondContact O-N 3.38Å |
| 241 | K | 70.4 | Confident | 68.3 | Low | 102 Ų | 102 | 85.9 Ų | 85.9 | 44% | 0.443 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.6 | -41.8 | 173.9 | -72.7 | 169.1 | -174.5 | 161.7 | 0 | 111.1 | E237 D238 L239 R245 | E237-K241 WeakPolarHBondContact O-CG 3.36Å; E237-K241 PolarHBondContact O-N 3.25Å; E237-K241 VanDerWaalsContact OE1-CE 3.28Å; E237-K241 WeakPolarHBondContact OE1-CE 3.32Å; E237-K241 IonicContact OE1-NZ 2.72Å; E237-K241 PolarHBondContact OE1-NZ 2.75Å; D238-K241 PolarHBondContact O-N 3.39Å; L239-K241 VanDerWaalsContact C-N 3.26Å; L239-K241 PolarHBondContact O-N 3.1Å; K241-R245 VanDerWaalsContact O-CG 3.29Å; K241-R245 WeakPolarHBondContact O-CG 3.5Å; K241-R245 PolarHBondContact O-N 3.46Å |
| 242 | A | 70.8 | Confident | 67.5 | Low | 34 Ų | 34 | 94.8 Ų | 94.8 | 28% | 0.281 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65.1 | -44.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | D238 L239 R245 F246 | D238-A242 PolarHBondContact O-N 2.94Å; D238-A242 VanDerWaalsContact O-N 3.11Å; L239-A242 CarbonylContact O-C 3.52Å; L239-A242 WeakPolarHBondContact O-CA 3.35Å; L239-A242 WeakPolarHBondContact O-CB 3.3Å; L239-A242 PolarHBondContact O-N 3.36Å; A242-R245 WeakPolarHBondContact O-CB 3.4Å; A242-R245 PolarHBondContact O-N 3.31Å; A242-F246 WeakPolarHBondContact O-CB 3.44Å; A242-F246 PolarHBondContact O-N 2.95Å |
| 243 | F | 70.5 | Confident | 67 | Low | 50 Ų | 50 | 92 Ų | 92 | 22% | 0.219 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -66 | -40.7 | 176.3 | -80.2 | -68.2 | 0 | 0 | 0 | 112.1 | P229 L239 R240 R245 F246 I247 L263 | P229-F243 HydrophobicContact CB-CZ 4.49Å; L239-F243 HydrophobicContact CB-CD2 4.14Å; L239-F243 HydrophobicContact CB-CE2 4.12Å; L239-F243 WeakPolarHBondContact O-CD2 3.15Å; L239-F243 PolarHBondContact O-N 3.38Å; R240-F243 PolarHBondContact O-N 2.85Å; F243-R245 VanDerWaalsContact C-N 3.29Å; F243-R245 PolarHBondContact O-N 2.87Å; F243-F246 WeakPolarHBondContact O-CB 3.39Å; F243-F246 PolarHBondContact O-N 2.88Å; F243-F246 VanDerWaalsContact O-N 3.13Å; F243-I247 WeakPolarHBondContact O-CB 3.02Å; F243-I247 WeakPolarHBondContact O-CG1 3.45Å; F243-I247 PolarHBondContact O-N 3.38Å; F243-L263 HydrophobicContact CE2-CD2 4.36Å; F243-L263 HydrophobicContact CZ-CD2 3.77Å |
| 244 | K | 71.6 | Confident | 66.5 | Low | 139 Ų | 139 | 101.4 Ų | 101.4 | 60% | 0.604 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.6 | -41.3 | 173.8 | -171.1 | 176.5 | -178.4 | 178.1 | 0 | 111 | R240 L248 | R240-K244 VanDerWaalsContact O-CB 3.27Å; R240-K244 WeakPolarHBondContact O-CB 3.24Å; R240-K244 PolarHBondContact O-N 3.38Å; K244-L248 HydrophobicContact CG-CD1 3.75Å; K244-L248 WeakPolarHBondContact O-CB 3.35Å; K244-L248 WeakPolarHBondContact O-CD1 3.44Å; K244-L248 PolarHBondContact O-N 3.23Å |
| 245 | R | 70.2 | Confident | 66.1 | Low | 154 Ų | 154 | 105.4 Ų | 105.4 | 58% | 0.581 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.1 | -43.4 | 172.7 | -72.7 | 174.1 | -176.7 | -167.3 | 0.8 | 111.3 | K241 A242 F243 H249 | K241-R245 VanDerWaalsContact O-CG 3.29Å; K241-R245 WeakPolarHBondContact O-CG 3.5Å; K241-R245 PolarHBondContact O-N 3.46Å; A242-R245 WeakPolarHBondContact O-CB 3.4Å; A242-R245 PolarHBondContact O-N 3.31Å; F243-R245 VanDerWaalsContact C-N 3.29Å; F243-R245 PolarHBondContact O-N 2.87Å; R245-H249 WeakPolarHBondContact O-CA 3.25Å; R245-H249 WeakPolarHBondContact O-CB 3.42Å; R245-H249 PolarHBondContact O-N 3.5Å |
| 246 | F | 70.8 | Confident | 66 | Low | 105 Ų | 105 | 108.4 Ų | 108.4 | 46% | 0.461 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.4 | -46.1 | 179 | -175.3 | -100.1 | 0 | 0 | 0 | 112.5 | A242 F243 L260 | A242-F246 WeakPolarHBondContact O-CB 3.44Å; A242-F246 PolarHBondContact O-N 2.95Å; F243-F246 WeakPolarHBondContact O-CB 3.39Å; F243-F246 PolarHBondContact O-N 2.88Å; F243-F246 VanDerWaalsContact O-N 3.13Å; F246-L260 HydrophobicContact CE2-CD2 4.01Å; F246-L260 HydrophobicContact CZ-CD2 4.29Å |
| 247 | I | 71.7 | Confident | 66.1 | Low | 124 Ų | 124 | 114.6 Ų | 114.6 | 64% | 0.636 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -72.8 | -44.5 | -178.2 | -65 | 167.8 | 0 | 0 | 0 | 111.4 | F243 | F243-I247 WeakPolarHBondContact O-CB 3.02Å; F243-I247 WeakPolarHBondContact O-CG1 3.45Å; F243-I247 PolarHBondContact O-N 3.38Å |
| 248 | L | 70.6 | Confident | 66.1 | Low | 117 Ų | 117 | 116.6 Ų | 116.6 | 61% | 0.613 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -82.3 | -25.3 | -178.4 | -83 | 87.3 | 0 | 0 | 0 | 114.1 | K244 | K244-L248 HydrophobicContact CG-CD1 3.75Å; K244-L248 WeakPolarHBondContact O-CB 3.35Å; K244-L248 WeakPolarHBondContact O-CD1 3.44Å; K244-L248 PolarHBondContact O-N 3.23Å |
| 249 | H | 64.9 | Low | 66 | Low | 118 Ų | 118 | 113.5 Ų | 113.5 | 55% | 0.546 | 56% | 0.558 | S | S | . | * | trans | -116.3 | 55.3 | -176.1 | -62.6 | 64.9 | 0 | 0 | 0 | 111.5 | R245 G251 | R245-H249 WeakPolarHBondContact O-CA 3.25Å; R245-H249 WeakPolarHBondContact O-CB 3.42Å; R245-H249 PolarHBondContact O-N 3.5Å; H249-G251 PolarHBondContact O-N 3.08Å | ||
| 250 | C | 60.6 | Low | 66.1 | Low | 121 Ų | 121 | 114.3 Ų | 114.3 | 82% | 0.818 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.7 | 27.9 | -176.8 | -137.8 | 0 | 0 | 0 | 0 | 115.8 | ||
| 251 | G | 60.5 | Low | 66.2 | Low | 71 Ų | 71 | 114.9 Ų | 114.9 | 73% | 0.732 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -157 | -4.3 | -172.7 | 0 | 0 | 0 | 0 | 0 | 119.4 | H249 | H249-G251 PolarHBondContact O-N 3.08Š|
| 252 | K | 56.2 | Low | 65.8 | Low | 193 Ų | 193 | 118 Ų | 118 | 84% | 0.839 | 58% | 0.578 | S | S | * | * | trans | -126.4 | 8.2 | -174.7 | -68.5 | -171.8 | 179.7 | 173.1 | 0 | 116.9 | K254 | K252-K254 PolarHBondContact O-N 3.3Å; K252-K254 VanDerWaalsContact O-N 3.1Å | ||
| 253 | V | 59.4 | Low | 65.7 | Low | 50 Ų | 50 | 118 Ų | 118 | 30% | 0.303 | 57% | 0.573 | S | S | . | * | trans | -91.5 | 75.6 | -173.4 | -165.3 | 0 | 0 | 0 | 0 | 111.7 | H255 E256 | V253-H255 VanDerWaalsContact C-N 3.27Å; V253-H255 PolarHBondContact O-N 2.91Å; V253-E256 HydrophobicContact CG1-CB 3.42Å; V253-E256 VanDerWaalsContact CG1-CB 3.42Å; V253-E256 HydrophobicContact CG1-CG 3.44Å; V253-E256 VanDerWaalsContact CG1-CG 3.44Å; V253-E256 WeakPolarHBondContact CG1-OE2 3.21Å | ||
| 254 | K | 59.7 | Low | 65.6 | Low | 204 Ų | 204 | 118.9 Ų | 118.9 | 89% | 0.887 | 58% | 0.582 | S | S | * | * | S | Bend | trans | -69.9 | -18.5 | 176.8 | -100.2 | -178 | 177.7 | 179.9 | 0 | 113.7 | K252 | K252-K254 PolarHBondContact O-N 3.3Å; K252-K254 VanDerWaalsContact O-N 3.1Å |
| 255 | H | 58.8 | Low | 65.4 | Low | 160 Ų | 160 | 116.4 Ų | 116.4 | 74% | 0.741 | 58% | 0.575 | S | S | * | * | S | Bend | trans | -112.1 | -12.5 | -168.9 | -143.4 | -99.3 | 0 | 0 | 0 | 116.2 | V253 | V253-H255 VanDerWaalsContact C-N 3.27Å; V253-H255 PolarHBondContact O-N 2.91Å |
| 256 | E | 64.3 | Low | 65.1 | Low | 86 Ų | 86 | 110.8 Ų | 110.8 | 40% | 0.402 | 56% | 0.562 | S | S | . | * | trans | -97.8 | -0.4 | -175.8 | -55 | -173.9 | 151.7 | 0 | 0 | 114.9 | V253 K258 A259 L260 | V253-E256 HydrophobicContact CG1-CB 3.42Å; V253-E256 VanDerWaalsContact CG1-CB 3.42Å; V253-E256 HydrophobicContact CG1-CG 3.44Å; V253-E256 VanDerWaalsContact CG1-CG 3.44Å; V253-E256 WeakPolarHBondContact CG1-OE2 3.21Å; E256-K258 PolarHBondContact O-N 3.01Å; E256-A259 PolarHBondContact O-N 2.92Å; E256-L260 PolarHBondContact O-N 3.45Å | ||
| 257 | K | 67.1 | Low | 64.7 | Low | 150 Ų | 150 | 106.2 Ų | 106.2 | 65% | 0.652 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -54 | -29.2 | 174.4 | -64.5 | -172.4 | 179.8 | -173.9 | 0 | 112.3 | K261 | K257-K261 WeakPolarHBondContact O-CB 3.28Å; K257-K261 VanDerWaalsContact O-CG 3.28Å; K257-K261 WeakPolarHBondContact O-CG 3.28Å; K257-K261 PolarHBondContact O-N 3.24Å; K257-K261 VanDerWaalsContact O-N 3.09Å |
| 258 | K | 67.3 | Low | 64.4 | Low | 142 Ų | 142 | 105.5 Ų | 105.5 | 62% | 0.617 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -70.8 | -38 | 176.1 | -65.7 | 179.1 | -179.5 | 175.1 | 0 | 112.5 | E256 R262 | E256-K258 PolarHBondContact O-N 3.01Å; K258-R262 WeakPolarHBondContact O-CD 3.16Å; K258-R262 WeakPolarHBondContact O-CG 3.46Å; K258-R262 PolarHBondContact O-N 3.37Å |
| 259 | A | 64.9 | Low | 63.8 | Low | 60 Ų | 60 | 103.4 Ų | 103.4 | 50% | 0.496 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -71.7 | -42.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | E256 R262 L263 | E256-A259 PolarHBondContact O-N 2.92Å; A259-R262 WeakPolarHBondContact O-CB 3.47Å; A259-R262 PolarHBondContact O-N 2.81Å; A259-R262 VanDerWaalsContact O-N 3.16Å; A259-L263 PolarHBondContact O-N 2.89Å |
| 260 | L | 69 | Low | 63.1 | Low | 73 Ų | 73 | 101.4 Ų | 101.4 | 38% | 0.382 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63 | -45.4 | 176.7 | -172.8 | 63 | 0 | 0 | 0 | 111.9 | F246 E256 R262 L263 V264 | F246-L260 HydrophobicContact CE2-CD2 4.01Å; F246-L260 HydrophobicContact CZ-CD2 4.29Å; E256-L260 PolarHBondContact O-N 3.45Å; L260-R262 PolarHBondContact O-N 2.87Å; L260-L263 PolarHBondContact O-N 3.07Å; L260-V264 VanDerWaalsContact O-CG2 3.31Å; L260-V264 WeakPolarHBondContact O-CG2 3.23Å; L260-V264 PolarHBondContact O-N 3.07Å |
| 261 | K | 69.7 | Low | 62.3 | Low | 160 Ų | 160 | 97.2 Ų | 97.2 | 70% | 0.696 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -56.7 | -39.3 | 173.6 | -78.4 | -177.9 | 177.6 | -166.9 | 0 | 112.2 | K257 L265 | K257-K261 WeakPolarHBondContact O-CB 3.28Å; K257-K261 VanDerWaalsContact O-CG 3.28Å; K257-K261 WeakPolarHBondContact O-CG 3.28Å; K257-K261 PolarHBondContact O-N 3.24Å; K257-K261 VanDerWaalsContact O-N 3.09Å; K261-L265 VanDerWaalsContact O-CB 3.29Å; K261-L265 WeakPolarHBondContact O-CB 3.49Å; K261-L265 PolarHBondContact O-N 3.19Å |
| 262 | R | 63.7 | Low | 61.4 | Low | 168 Ų | 168 | 98 Ų | 98 | 63% | 0.634 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -71.9 | -38.1 | 178.6 | -72.3 | 170.2 | -179.5 | -168.1 | -2.2 | 112.5 | K258 A259 L260 L265 A266 | K258-R262 WeakPolarHBondContact O-CD 3.16Å; K258-R262 WeakPolarHBondContact O-CG 3.46Å; K258-R262 PolarHBondContact O-N 3.37Å; A259-R262 WeakPolarHBondContact O-CB 3.47Å; A259-R262 PolarHBondContact O-N 2.81Å; A259-R262 VanDerWaalsContact O-N 3.16Å; L260-R262 PolarHBondContact O-N 2.87Å; R262-L265 PolarHBondContact O-N 3.03Å; R262-A266 WeakPolarHBondContact O-CB 3.33Å; R262-A266 PolarHBondContact O-N 3.22Å |
| 263 | L | 67.1 | Low | 61 | Low | 34 Ų | 34 | 94.6 Ų | 94.6 | 18% | 0.178 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -64.1 | -45 | 174.5 | -175 | 74.8 | 0 | 0 | 0 | 111 | P229 L239 F243 A259 L260 L265 A266 G267 | P229-L263 HydrophobicContact CB-CD2 4.32Å; L239-L263 HydrophobicContact CD1-CD1 4.38Å; F243-L263 HydrophobicContact CE2-CD2 4.36Å; F243-L263 HydrophobicContact CZ-CD2 3.77Å; A259-L263 PolarHBondContact O-N 2.89Å; L260-L263 PolarHBondContact O-N 3.07Å; L263-L265 VanDerWaalsContact C-N 3.33Å; L263-L265 PolarHBondContact O-N 3.05Å; L263-A266 PolarHBondContact O-N 3.23Å; L263-G267 PolarHBondContact O-N 3.47Å |
| 264 | V | 69.8 | Low | 60.3 | Low | 68 Ų | 68 | 97.6 Ų | 97.6 | 41% | 0.412 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.2 | -44.1 | 175.3 | 171.2 | 0 | 0 | 0 | 0 | 110.5 | L260 A266 G267 L268 | L260-V264 VanDerWaalsContact O-CG2 3.31Å; L260-V264 WeakPolarHBondContact O-CG2 3.23Å; L260-V264 PolarHBondContact O-N 3.07Å; V264-A266 VanDerWaalsContact C-N 3.34Å; V264-A266 PolarHBondContact O-N 3.45Å; V264-G267 PolarHBondContact O-N 3.46Å; V264-L268 HydrophobicContact CG1-CD1 3.79Å; V264-L268 PolarHBondContact O-N 3.39Å; V264-L268 VanDerWaalsContact O-N 3.08Å |
| 265 | L | 66 | Low | 59.3 | Low | 86 Ų | 86 | 96.7 Ų | 96.7 | 45% | 0.45 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.2 | -37 | 176.7 | -169.5 | 67.3 | 0 | 0 | 0 | 112.8 | K261 R262 L263 A270 A271 | K261-L265 VanDerWaalsContact O-CB 3.29Å; K261-L265 WeakPolarHBondContact O-CB 3.49Å; K261-L265 PolarHBondContact O-N 3.19Å; R262-L265 PolarHBondContact O-N 3.03Å; L263-L265 VanDerWaalsContact C-N 3.33Å; L263-L265 PolarHBondContact O-N 3.05Å; L265-A270 HydrophobicContact CD1-CB 4.41Å; L265-A271 HydrophobicContact CD2-CB 4.44Å; L265-A271 HydrophobicContact CG-CB 4.4Å |
| 266 | A | 63.9 | Low | 58.8 | Low | 36 Ų | 36 | 92 Ų | 92 | 30% | 0.298 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -67.7 | -38.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112 | R262 L263 V264 L268 G269 Y275 | R262-A266 WeakPolarHBondContact O-CB 3.33Å; R262-A266 PolarHBondContact O-N 3.22Å; L263-A266 PolarHBondContact O-N 3.23Å; V264-A266 VanDerWaalsContact C-N 3.34Å; V264-A266 PolarHBondContact O-N 3.45Å; A266-L268 VanDerWaalsContact C-N 3.33Å; A266-L268 PolarHBondContact O-N 3.35Å; A266-G269 PolarHBondContact O-N 3.47Å; A266-Y275 WeakPolarHBondContact CB-OH 3.49Å |
| 267 | G | 62.8 | Low | 57.7 | Low | 10 Ų | 10 | 96 Ų | 96 | 10% | 0.103 | 55% | 0.55 | C | S | . | . | H | α-helix | trans | -70.1 | -24.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | N228 L263 V264 G269 | N228-G267 PolarHBondContact ND2-O 3.5Å; L263-G267 PolarHBondContact O-N 3.47Å; V264-G267 PolarHBondContact O-N 3.46Å; G267-G269 VanDerWaalsContact C-N 3.3Å; G267-G269 PolarHBondContact O-N 3.1Å |
| 268 | L | 66.3 | Low | 56.7 | Low | 108 Ų | 108 | 98.1 Ų | 98.1 | 57% | 0.565 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.9 | 7.3 | 178.3 | -86.6 | 151.7 | 0 | 0 | 0 | 114.1 | I225 V264 A266 A270 | I225-L268 HydrophobicContact CG2-CD2 4.27Å; V264-L268 HydrophobicContact CG1-CD1 3.79Å; V264-L268 PolarHBondContact O-N 3.39Å; V264-L268 VanDerWaalsContact O-N 3.08Å; A266-L268 VanDerWaalsContact C-N 3.33Å; A266-L268 PolarHBondContact O-N 3.35Å; L268-A270 VanDerWaalsContact C-N 3.27Å; L268-A270 PolarHBondContact O-N 3.36Å |
| 269 | G | 57.3 | Low | 55.6 | Low | 73 Ų | 73 | 98.2 Ų | 98.2 | 75% | 0.753 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 73.5 | 7.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | A266 G267 | A266-G269 PolarHBondContact O-N 3.47Å; G267-G269 VanDerWaalsContact C-N 3.3Å; G267-G269 PolarHBondContact O-N 3.1Å |
| 270 | A | 50.3 | Low | 54.8 | Low | 76 Ų | 76 | 101.4 Ų | 101.4 | 63% | 0.628 | 57% | 0.567 | S | S | * | * | trans | -99.8 | 6 | -169.1 | 0 | 0 | 0 | 0 | 0 | 116 | L265 L268 | L265-A270 HydrophobicContact CD1-CB 4.41Å; L268-A270 VanDerWaalsContact C-N 3.27Å; L268-A270 PolarHBondContact O-N 3.36Å | ||
| 271 | A | 44.2 | Very low | 53.9 | Low | 33 Ų | 33 | 104.3 Ų | 104.3 | 27% | 0.273 | 58% | 0.582 | S | S | . | * | trans | -147 | 89.2 | -176.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | L265 I273 | L265-A271 HydrophobicContact CD2-CB 4.44Å; L265-A271 HydrophobicContact CG-CB 4.4Å; A271-I273 HydrophobicContact CB-CB 4.29Å; A271-I273 HydrophobicContact CB-CD1 3.75Å; A271-I273 HydrophobicContact CB-CG1 3.78Å; A271-I273 PolarHBondContact O-N 3.04Å | ||
| 272 | G | 41.7 | Very low | 52.7 | Low | 89 Ų | 89 | 101.8 Ų | 101.8 | 92% | 0.918 | 58% | 0.581 | S | S | * | * | trans | -67.6 | 42 | 153 | 0 | 0 | 0 | 0 | 0 | 112.2 | P274 | G272-P274 WeakPolarHBondContact O-CD 3.36Š| ||
| 273 | I | 46.8 | Very low | 51.8 | Low | 120 Ų | 120 | 102.7 Ų | 102.7 | 62% | 0.615 | 59% | 0.593 | S | S | * | * | trans | -90.9 | 113.5 | -178.1 | -57.4 | 172.9 | 0 | 0 | 0 | 107.3 | A271 Y275 | A271-I273 HydrophobicContact CB-CB 4.29Å; A271-I273 HydrophobicContact CB-CD1 3.75Å; A271-I273 HydrophobicContact CB-CG1 3.78Å; A271-I273 PolarHBondContact O-N 3.04Å; I273-Y275 PolarHBondContact O-N 3.04Å | ||
| 274 | P | 45.7 | Very low | 50.4 | Low | 114 Ų | 114 | 110 Ų | 110 | 74% | 0.74 | 63% | 0.626 | S | S | * | * | trans | -60.8 | 124 | 179.1 | 24.2 | -32.1 | 0 | 0 | 0 | 110.1 | G272 | G272-P274 WeakPolarHBondContact O-CD 3.36Š| ||
| 275 | Y | 39.2 | Very low | 49 | Very low | 185 Ų | 185 | 115.8 Ų | 115.8 | 73% | 0.725 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.7 | 135.3 | 171.5 | -62.8 | -93.1 | 0 | 0 | 0 | 109.7 | A266 I273 | A266-Y275 WeakPolarHBondContact CB-OH 3.49Å; I273-Y275 PolarHBondContact O-N 3.04Å |
| 276 | G | 46.8 | Very low | 47.4 | Very low | 61 Ų | 61 | 121.4 Ų | 121.4 | 63% | 0.629 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 119.9 | -6.4 | 155.1 | 0 | 0 | 0 | 0 | 0 | 119.2 | R97 R278 | R97-G276 PolarHBondContact NH2-O 3.2Å; G276-R278 PolarHBondContact O-N 3.25Å |
| 277 | H | 41.7 | Very low | 46.1 | Very low | 169 Ų | 169 | 124.3 Ų | 124.3 | 78% | 0.782 | 69% | 0.69 | S | S | * | * | trans | -84.5 | 105.5 | 171.8 | -110.2 | -43.1 | 0 | 0 | 0 | 111.7 | I279 | H277-I279 VanDerWaalsContact C-N 3.35Å; H277-I279 PolarHBondContact O-N 3.49Å | ||
| 278 | R | 46.9 | Very low | 44.7 | Very low | 195 Ų | 195 | 129 Ų | 129 | 74% | 0.736 | 72% | 0.721 | S | S | * | * | trans | -65.6 | 99.7 | 156.5 | -154.4 | -177.9 | -164.9 | -142.1 | 4.9 | 105.8 | G276 I280 | G276-R278 PolarHBondContact O-N 3.25Å; R278-I280 VanDerWaalsContact C-N 3.28Å; R278-I280 PolarHBondContact O-N 3.25Å | ||
| 279 | I | 43.9 | Very low | 43.4 | Very low | 144 Ų | 144 | 131.1 Ų | 131.1 | 74% | 0.738 | 73% | 0.733 | S | S | * | * | trans | -65.6 | 96.9 | 168 | -58.2 | 171.7 | 0 | 0 | 0 | 105.2 | H277 I281 | H277-I279 VanDerWaalsContact C-N 3.35Å; H277-I279 PolarHBondContact O-N 3.49Å; I279-I281 VanDerWaalsContact C-N 3.29Å; I279-I281 HydrophobicContact CG2-CG1 4.07Å; I279-I281 PolarHBondContact O-N 3.49Å; I279-I281 VanDerWaalsContact O-N 3.11Å | ||
| 280 | I | 48.1 | Very low | 42.3 | Very low | 128 Ų | 128 | 138.2 Ų | 138.2 | 66% | 0.656 | 74% | 0.739 | S | S | * | * | trans | -75.6 | 94.8 | 167.1 | -59.5 | 168.2 | 0 | 0 | 0 | 104.1 | R278 P282 | R278-I280 VanDerWaalsContact C-N 3.28Å; R278-I280 PolarHBondContact O-N 3.25Å; I280-P282 WeakPolarHBondContact O-CD 3.47Å | ||
| 281 | I | 49.5 | Very low | 41.4 | Very low | 133 Ų | 133 | 141.6 Ų | 141.6 | 68% | 0.682 | 75% | 0.746 | S | S | * | * | trans | -62.9 | 119.6 | 162.9 | -56.7 | 169.6 | 0 | 0 | 0 | 104.6 | I279 Q283 | I279-I281 VanDerWaalsContact C-N 3.29Å; I279-I281 HydrophobicContact CG2-CG1 4.07Å; I279-I281 PolarHBondContact O-N 3.49Å; I279-I281 VanDerWaalsContact O-N 3.11Å; I281-Q283 PolarHBondContact O-N 3.47Å | ||
| 282 | P | 44.8 | Very low | 40.8 | Very low | 107 Ų | 107 | 148 Ų | 148 | 70% | 0.695 | 77% | 0.77 | S | S | * | * | trans | -59.8 | 116.7 | 174.3 | 23.9 | -30.4 | 0 | 0 | 0 | 107.3 | I280 Q284 | I280-P282 WeakPolarHBondContact O-CD 3.47Å; P282-Q284 PolarHBondContact O-N 3.24Å; P282-Q284 VanDerWaalsContact O-N 3.08Å | ||
| 283 | Q | 44.1 | Very low | 40.4 | Very low | 187 Ų | 187 | 151.6 Ų | 151.6 | 87% | 0.874 | 76% | 0.764 | S | S | * | * | trans | -62.9 | 114.2 | 169.5 | -69.7 | -157.7 | -62.2 | 0 | 0 | 106.6 | I281 M285 | I281-Q283 PolarHBondContact O-N 3.47Å; Q283-M285 PolarHBondContact O-N 3.21Å | ||
| 284 | Q | 39.7 | Very low | 39.8 | Very low | 189 Ų | 189 | 154.2 Ų | 154.2 | 88% | 0.883 | 77% | 0.773 | S | S | * | * | trans | -58.2 | 114.7 | 168 | -68.9 | -136.3 | -47.8 | 0 | 0 | 107.7 | P282 K286 | P282-Q284 PolarHBondContact O-N 3.24Å; P282-Q284 VanDerWaalsContact O-N 3.08Å; Q284-K286 PolarHBondContact O-N 3.33Å; Q284-K286 VanDerWaalsContact O-N 3.08Å | ||
| 285 | M | 39.8 | Very low | 39.1 | Very low | 189 Ų | 189 | 157.8 Ų | 157.8 | 93% | 0.931 | 78% | 0.78 | S | S | * | * | trans | -59.6 | 111.7 | 171.9 | -82.9 | 175.5 | 157.8 | 0 | 0 | 108.3 | Q283 | Q283-M285 PolarHBondContact O-N 3.21Š| ||
| 286 | K | 31.5 | Very low | 38.9 | Very low | 204 Ų | 204 | 157.7 Ų | 157.7 | 89% | 0.887 | 79% | 0.786 | S | S | * | * | trans | -107.3 | 97.6 | 167.8 | -175.3 | -179.9 | -176.8 | -179.3 | 0 | 107.6 | Q284 | Q284-K286 PolarHBondContact O-N 3.33Å; Q284-K286 VanDerWaalsContact O-N 3.08Å | ||
| 287 | S | 37.4 | Very low | 38.4 | Very low | 96 Ų | 96 | 162.8 Ų | 162.8 | 67% | 0.671 | 80% | 0.799 | S | S | * | * | trans | -175.7 | 93.3 | 160.5 | 48.3 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 288 | S | 33.9 | Very low | 37.9 | Very low | 108 Ų | 108 | 166.2 Ų | 166.2 | 76% | 0.755 | 81% | 0.805 | S | S | * | * | 57.4 | 91.7 | 101.6 | -59.8 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 289 | D | 37.2 | Very low | 37.4 | Very low | 154 Ų | 154 | 162.3 Ų | 162.3 | 82% | 0.824 | 81% | 0.807 | S | S | * | * | trans | 179.4 | 147.1 | 138.1 | -84.6 | -25.6 | 0 | 0 | 0 | 110.3 | ||||
| 290 | Y | 34.6 | Very low | 37.4 | Very low | 221 Ų | 221 | 162 Ų | 162 | 87% | 0.867 | 81% | 0.812 | S | S | * | * | trans | 81.8 | 83.7 | 172.9 | -78.2 | -89.3 | 0 | 0 | 0 | 119.7 | ||||
| 291 | N | 31.4 | Very low | 36.8 | Very low | 147 Ų | 147 | 162.2 Ų | 162.2 | 79% | 0.786 | 81% | 0.813 | S | S | * | * | -0.1 | 141.2 | 126.7 | -74.7 | -46.8 | 0 | 0 | 0 | 118.2 | |||||
| 292 | Q | 32.5 | Very low | 36.3 | Very low | 168 Ų | 168 | 164.5 Ų | 164.5 | 79% | 0.785 | 82% | 0.819 | S | S | * | * | trans | 75.6 | 96.3 | 155.2 | -69.8 | 175 | 14.7 | 0 | 0 | 117.4 | ||||
| 293 | Q | 33.9 | Very low | 36.2 | Very low | 165 Ų | 165 | 164.4 Ų | 164.4 | 77% | 0.771 | 81% | 0.812 | S | S | * | * | 163.5 | 127.9 | 109 | -88.4 | 163.8 | 13 | 0 | 0 | 111.3 | |||||
| 294 | Q | 33.9 | Very low | 36 | Very low | 175 Ų | 175 | 164 Ų | 164 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | trans | 62.8 | 98.8 | 153.7 | -63.3 | 170.2 | 11.1 | 0 | 0 | 116.1 | ||||
| 295 | Q | 30.4 | Very low | 36.1 | Very low | 188 Ų | 188 | 160.8 Ų | 160.8 | 88% | 0.879 | 80% | 0.803 | S | S | * | * | 50.6 | 67.9 | 50.6 | -149.5 | 172.2 | 26.7 | 0 | 0 | 113.8 | |||||
| 296 | Q | 34.2 | Very low | 36.1 | Very low | 184 Ų | 184 | 159.2 Ų | 159.2 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | trans | 173.1 | 91.4 | 142.5 | -100 | 170.1 | 5.8 | 0 | 0 | 111.7 | ||||
| 297 | N | 36.3 | Very low | 36.5 | Very low | 168 Ų | 168 | 157 Ų | 157 | 90% | 0.898 | 79% | 0.792 | S | S | * | * | 176.1 | 102.5 | 127.1 | -104.6 | -42.5 | 0 | 0 | 0 | 110.3 | |||||
| 298 | R | 31.2 | Very low | 36.5 | Very low | 240 Ų | 240 | 159.7 Ų | 159.7 | 91% | 0.906 | 80% | 0.798 | S | S | * | * | trans | -79.4 | 163.4 | 168.6 | -107.8 | -176.2 | 174.5 | 175.3 | -1 | 109.6 | ||||
| 299 | S | 37 | Very low | 36.9 | Very low | 113 Ų | 113 | 162.6 Ų | 162.6 | 79% | 0.79 | 80% | 0.803 | S | S | * | * | trans | 94.2 | 121.2 | 175 | 81 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 300 | V | 44 | Very low | 37.3 | Very low | 138 Ų | 138 | 158.8 Ų | 158.8 | 84% | 0.836 | 79% | 0.793 | S | S | * | * | cis | -145.8 | 131.1 | 37.2 | 174 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 301 | I | 36.5 | Very low | 37.6 | Very low | 133 Ų | 133 | 154.8 Ų | 154.8 | 68% | 0.682 | 79% | 0.786 | S | S | * | * | trans | -78.5 | 148.3 | 172.1 | -68.6 | 160.1 | 0 | 0 | 0 | 108.9 | ||||
| 302 | F | 38.1 | Very low | 38.6 | Very low | 181 Ų | 181 | 155.9 Ų | 155.9 | 79% | 0.794 | 79% | 0.789 | S | S | * | * | trans | 166.1 | 98 | 133 | -105.7 | -112.3 | 0 | 0 | 0 | 108.1 | ||||
| 303 | N | 42.8 | Very low | 39.2 | Very low | 104 Ų | 104 | 155 Ų | 155 | 56% | 0.556 | 79% | 0.79 | S | S | * | * | 89.8 | 132.3 | 95.9 | -76.9 | -9.9 | 0 | 0 | 0 | 112.3 | |||||
| 304 | K | 40.4 | Very low | 40.1 | Very low | 180 Ų | 180 | 154.4 Ų | 154.4 | 78% | 0.783 | 79% | 0.792 | S | S | * | * | cis | -173 | 146.9 | -11.1 | -119 | 174.2 | -176.8 | 177.5 | 0 | 103.7 | ||||
| 305 | P | 40.5 | Very low | 40.4 | Very low | 121 Ų | 121 | 155.3 Ų | 155.3 | 79% | 0.786 | 79% | 0.793 | S | S | * | * | trans | -88 | 137.3 | 176.1 | 34.4 | -28.6 | 0 | 0 | 0 | 110.2 | ||||
| 306 | L | 40.1 | Very low | 41.2 | Very low | 156 Ų | 156 | 156.8 Ų | 156.8 | 82% | 0.817 | 82% | 0.815 | S | S | * | * | trans | -117.4 | 108.5 | 168.7 | -90.5 | 162 | 0 | 0 | 0 | 107 | ||||
| 307 | M | 40.9 | Very low | 41.6 | Very low | 158 Ų | 158 | 155.4 Ų | 155.4 | 78% | 0.778 | 81% | 0.813 | S | S | * | * | 100.7 | 120.6 | 57.6 | -172.1 | -170.7 | -66.2 | 0 | 0 | 109.8 | |||||
| 308 | I | 36 | Very low | 41.9 | Very low | 152 Ų | 152 | 154.7 Ų | 154.7 | 78% | 0.779 | 81% | 0.808 | S | S | * | * | trans | -57.4 | 133.3 | 173 | -62.9 | 157.9 | 0 | 0 | 0 | 109.3 | ||||
| 309 | I | 43.4 | Very low | 42.5 | Very low | 168 Ų | 168 | 150 Ų | 150 | 86% | 0.862 | 80% | 0.803 | S | S | * | * | trans | -110.3 | 112.3 | 160.5 | -67.8 | 175 | 0 | 0 | 0 | 106.8 | ||||
| 310 | A | 46.1 | Very low | 42.8 | Very low | 75 Ų | 75 | 152.2 Ų | 152.2 | 62% | 0.62 | 80% | 0.803 | S | S | * | * | trans | -73.3 | 146.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 311 | D | 40.2 | Very low | 42.7 | Very low | 136 Ų | 136 | 153.1 Ų | 153.1 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | trans | -23.3 | 121 | 150.9 | -159.1 | 28 | 0 | 0 | 0 | 114.7 | ||||
| 312 | M | 52.3 | Low | 43.1 | Very low | 170 Ų | 170 | 154.4 Ų | 154.4 | 84% | 0.837 | 81% | 0.809 | S | S | * | * | trans | -148.2 | 91.8 | 158.6 | -79.2 | -84.3 | 69.1 | 0 | 0 | 107 | ||||
| 313 | D | 45 | Very low | 43.5 | Very low | 150 Ų | 150 | 152.5 Ų | 152.5 | 80% | 0.802 | 81% | 0.81 | S | S | * | * | trans | -64.2 | 123.6 | 154.4 | -79.9 | -36.8 | 0 | 0 | 0 | 108.1 | ||||
| 314 | D | 53.4 | Low | 43.5 | Very low | 152 Ų | 152 | 156.2 Ų | 156.2 | 81% | 0.813 | 83% | 0.83 | S | S | * | * | trans | -120.8 | 141.6 | 173.7 | -143.8 | -9.2 | 0 | 0 | 0 | 110.6 | ||||
| 315 | K | 40.1 | Very low | 43.8 | Very low | 195 Ų | 195 | 154.3 Ų | 154.3 | 85% | 0.848 | 83% | 0.834 | S | S | * | * | trans | -50.5 | 139.2 | -167.9 | -70.8 | 161.9 | 168.9 | 173.4 | 0 | 115 | ||||
| 316 | T | 47.8 | Very low | 44.1 | Very low | 218 Ų | 218 | 157.3 Ų | 157.3 | 100% | 1.337 | 84% | 0.838 | S | S | * | * | trans | -149.6 | 0 | 130.5 | 12.7 | 0 | 0 | 0 | 0 | 110.4 |
Retrieved 316 of 316 residues in 400.9 ms
(Link to these results)