| 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 | 38.7 | Very low | 46.5 | Very low | 247 Ų | 247 | 160.2 Ų | 160.2 | 100% | 1.217 | 80% | 0.797 | S | S | * | * | 0 | 112 | 0 | -85.6 | 164.4 | 123.5 | 0 | 0 | 108.3 | |||||
| 2 | V | 41 | Very low | 47 | Very low | 136 Ų | 136 | 159.8 Ų | 159.8 | 82% | 0.824 | 79% | 0.787 | S | S | * | * | trans | -92.5 | 127.6 | -179.2 | 171.7 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 3 | L | 38.8 | Very low | 47.4 | Very low | 176 Ų | 176 | 157.6 Ų | 157.6 | 92% | 0.921 | 78% | 0.779 | S | S | * | * | trans | -129.9 | 105.6 | 163.2 | -108.1 | 144.7 | 0 | 0 | 0 | 108.9 | ||||
| 4 | K | 45.7 | Very low | 47.6 | Very low | 173 Ų | 173 | 157.4 Ų | 157.4 | 75% | 0.752 | 77% | 0.772 | S | S | * | * | trans | -88.2 | 112.2 | -177.1 | -168.5 | 176 | -175.6 | 177.8 | 0 | 107.2 | ||||
| 5 | Q | 44.4 | Very low | 47.6 | Very low | 199 Ų | 199 | 159.7 Ų | 159.7 | 93% | 0.93 | 77% | 0.769 | S | S | * | * | trans | -97.3 | 122.4 | 178.1 | -152.5 | 153.8 | 38.6 | 0 | 0 | 110.2 | ||||
| 6 | Q | 49.5 | Very low | 47.3 | Very low | 128 Ų | 128 | 158.5 Ų | 158.5 | 60% | 0.598 | 77% | 0.767 | S | S | * | * | trans | -86 | 135.4 | -169 | -73.8 | -89.8 | -7.8 | 0 | 0 | 112.3 | W8 | Q6-W8 VanDerWaalsContact C-N 3.29Å; Q6-W8 PolarHBondContact O-N 3.43Å | ||
| 7 | P | 49.8 | Very low | 47 | Very low | 102 Ų | 102 | 155.5 Ų | 155.5 | 66% | 0.662 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | 10.6 | -176.8 | 31.6 | -34.2 | 0 | 0 | 0 | 115.4 | ||
| 8 | W | 44.6 | Very low | 46.5 | Very low | 197 Ų | 197 | 154.8 Ų | 154.8 | 75% | 0.746 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -12.7 | -171.7 | -96.3 | 78 | 0 | 0 | 0 | 116 | Q6 | Q6-W8 VanDerWaalsContact C-N 3.29Å; Q6-W8 PolarHBondContact O-N 3.43Å |
| 9 | L | 50 | Low | 46 | Very low | 136 Ų | 136 | 151.7 Ų | 151.7 | 71% | 0.712 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.8 | -24.8 | -176.4 | -69.2 | 172.9 | 0 | 0 | 0 | 113.8 | ||
| 10 | L | 56.4 | Low | 45.6 | Very low | 142 Ų | 142 | 152.8 Ų | 152.8 | 74% | 0.743 | 75% | 0.749 | S | S | * | * | H | α-helix | trans | -72.3 | -30.2 | 177.6 | -88.6 | 159.4 | 0 | 0 | 0 | 112.8 | K12 F14 | L10-K12 PolarHBondContact O-N 2.96Å; L10-F14 PolarHBondContact O-N 3.09Å |
| 11 | L | 53 | Low | 45.5 | Very low | 126 Ų | 126 | 154.6 Ų | 154.6 | 66% | 0.66 | 75% | 0.748 | S | S | * | * | H | α-helix | trans | -74.3 | -25.4 | -179.9 | -128.7 | 89.4 | 0 | 0 | 0 | 113.3 | R15 | L11-R15 PolarHBondContact O-N 2.87Å |
| 12 | K | 52.3 | Low | 45.4 | Very low | 156 Ų | 156 | 153.3 Ų | 153.3 | 68% | 0.678 | 73% | 0.73 | S | S | * | * | H | α-helix | trans | -78.1 | -36.5 | 176 | -92.6 | -177.1 | 174.8 | -179.7 | 0 | 112.4 | L10 R15 L16 | L10-K12 PolarHBondContact O-N 2.96Å; K12-R15 PolarHBondContact O-N 2.86Å; K12-L16 PolarHBondContact O-N 3.2Å |
| 13 | L | 52.2 | Low | 45.6 | Very low | 131 Ų | 131 | 155.8 Ų | 155.8 | 69% | 0.686 | 73% | 0.73 | S | S | * | * | H | α-helix | trans | -68.7 | -33.5 | 175.1 | -95.6 | 145.7 | 0 | 0 | 0 | 112.4 | N17 | L13-N17 PolarHBondContact O-N 3.04Å |
| 14 | F | 50.4 | Low | 45.8 | Very low | 154 Ų | 154 | 153.4 Ų | 153.4 | 68% | 0.675 | 72% | 0.718 | S | S | * | * | H | α-helix | trans | -70.7 | -33 | 175.3 | -151.6 | -97.6 | 0 | 0 | 0 | 112.6 | L10 | L10-F14 PolarHBondContact O-N 3.09Å |
| 15 | R | 46.6 | Very low | 45.9 | Very low | 193 Ų | 193 | 150.3 Ų | 150.3 | 73% | 0.728 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -76.6 | -27.9 | 178.8 | -120.3 | -156 | -79.2 | -149.4 | 0.1 | 114.1 | L11 K12 | L11-R15 PolarHBondContact O-N 2.87Å; K12-R15 PolarHBondContact O-N 2.86Å |
| 16 | L | 44.2 | Very low | 46 | Very low | 140 Ų | 140 | 144.4 Ų | 144.4 | 73% | 0.733 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -76.7 | -34.1 | 177.5 | -123.2 | 92.6 | 0 | 0 | 0 | 112.8 | K12 Q18 S19 | K12-L16 PolarHBondContact O-N 3.2Å; L16-Q18 PolarHBondContact O-N 2.75Å; L16-S19 PolarHBondContact O-N 3.41Å |
| 17 | N | 40.7 | Very low | 46 | Very low | 108 Ų | 108 | 141.7 Ų | 141.7 | 58% | 0.578 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -72.4 | -15.3 | -179.8 | -162 | 8.5 | 0 | 0 | 0 | 113.4 | L13 | L13-N17 PolarHBondContact O-N 3.04Å |
| 18 | Q | 39.4 | Very low | 45.9 | Very low | 142 Ų | 142 | 143.4 Ų | 143.4 | 66% | 0.664 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | -20.5 | 178 | -127.3 | 175.3 | 6.4 | 0 | 0 | 113 | L16 | L16-Q18 PolarHBondContact O-N 2.75Š|
| 19 | S | 37.2 | Very low | 45.9 | Very low | 96 Ų | 96 | 140.1 Ų | 140.1 | 67% | 0.671 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -83.7 | -9.7 | -176.8 | -166.4 | 0 | 0 | 0 | 0 | 114.1 | L16 | L16-S19 PolarHBondContact O-N 3.41Š|
| 20 | Q | 37.8 | Very low | 45.8 | Very low | 173 Ų | 173 | 141 Ų | 141 | 81% | 0.808 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -101.9 | -5.6 | -175.6 | -135.7 | 163.9 | -3.9 | 0 | 0 | 113.8 | ||
| 21 | R | 42.6 | Very low | 45.1 | Very low | 192 Ų | 192 | 138 Ų | 138 | 73% | 0.725 | 68% | 0.684 | S | S | * | * | trans | -100.8 | 66.9 | 171.2 | -82.1 | -163.2 | -99.6 | -170.7 | -7.5 | 110.9 | ||||
| 22 | R | 37.3 | Very low | 44.6 | Very low | 220 Ų | 220 | 139.9 Ų | 139.9 | 83% | 0.83 | 68% | 0.682 | S | S | * | * | trans | -80.2 | 117.2 | 161.8 | -130.7 | -174.5 | -86.3 | -178.9 | -5.3 | 107.2 | D24 | R22-D24 PolarHBondContact O-N 3.14Š| ||
| 23 | F | 43.8 | Very low | 44.1 | Very low | 187 Ų | 187 | 135.5 Ų | 135.5 | 82% | 0.82 | 68% | 0.675 | S | S | * | * | trans | -72.9 | 118 | 177 | -92.4 | -101.7 | 0 | 0 | 0 | 109.4 | P25 | F23-P25 WeakPolarHBondContact O-CD 3.5Š| ||
| 24 | D | 43.4 | Very low | 43.8 | Very low | 127 Ų | 127 | 132.2 Ų | 132.2 | 68% | 0.679 | 66% | 0.663 | S | S | * | * | trans | -93.6 | 111.2 | 170 | -73.7 | -33.2 | 0 | 0 | 0 | 110 | R22 A26 | R22-D24 PolarHBondContact O-N 3.14Å; D24-A26 PolarHBondContact O-N 3.07Å | ||
| 25 | P | 48.2 | Very low | 43.5 | Very low | 108 Ų | 108 | 132.4 Ų | 132.4 | 70% | 0.701 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.9 | -8.5 | -178 | 27.1 | -33 | 0 | 0 | 0 | 114.1 | F23 | F23-P25 WeakPolarHBondContact O-CD 3.5Š|
| 26 | A | 45.7 | Very low | 43 | Very low | 75 Ų | 75 | 131.2 Ų | 131.2 | 62% | 0.62 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.6 | -26.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | D24 L28 | D24-A26 PolarHBondContact O-N 3.07Å; A26-L28 PolarHBondContact O-N 3.13Å |
| 27 | A | 50.6 | Low | 42.8 | Very low | 71 Ų | 71 | 127.6 Ų | 127.6 | 59% | 0.587 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -74.2 | -26.3 | -176 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 28 | L | 46.7 | Very low | 42.8 | Very low | 138 Ų | 138 | 125.8 Ų | 125.8 | 72% | 0.723 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -80.9 | -19.7 | -176.4 | -153.9 | 95.3 | 0 | 0 | 0 | 113.4 | A26 | A26-L28 PolarHBondContact O-N 3.13Å |
| 29 | I | 46.2 | Very low | 42.8 | Very low | 128 Ų | 128 | 122.4 Ų | 122.4 | 66% | 0.656 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -84.2 | -37.5 | -178.6 | -60.3 | 175.8 | 0 | 0 | 0 | 110.2 | R32 A33 | I29-R32 PolarHBondContact O-N 2.92Å; I29-A33 PolarHBondContact O-N 2.61Å; I29-A33 VanDerWaalsContact O-N 3.11Å |
| 30 | Q | 46.5 | Very low | 42.7 | Very low | 155 Ų | 155 | 124.6 Ų | 124.6 | 72% | 0.724 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -66.1 | -40.1 | 177.7 | -157.5 | 100.3 | -27.2 | 0 | 0 | 112.2 | R32 A33 S34 | Q30-R32 VanDerWaalsContact C-N 3.29Å; Q30-R32 PolarHBondContact O-N 3.15Å; Q30-A33 PolarHBondContact O-N 2.81Å; Q30-S34 PolarHBondContact O-N 3.41Å; Q30-S34 VanDerWaalsContact O-N 3.16Å; Q30-S34 PolarHBondContact O-OG 2.93Å; Q30-S34 VanDerWaalsContact O-OG 3.12Å |
| 31 | D | 42.4 | Very low | 42.6 | Very low | 78 Ų | 78 | 127.4 Ų | 127.4 | 42% | 0.417 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -78.4 | -12.6 | -177.5 | -166.6 | 39 | 0 | 0 | 0 | 113.6 | S34 R35 | D31-S34 WeakPolarHBondContact CA-OG 3.3Å; D31-S34 PolarHBondContact O-OG 2.92Å; D31-R35 WeakPolarHBondContact O-CG 3.31Å; D31-R35 PolarHBondContact O-NE 2.98Å; D31-R35 IonicContact OD1-NE 3.98Å; D31-R35 IonicContact OD1-NH2 3.24Å; D31-R35 IonicContact OD2-CZ 3.43Å; D31-R35 VanDerWaalsContact OD2-CZ 3.24Å; D31-R35 IonicContact OD2-NE 3Å; D31-R35 IonicContact OD2-NH1 2.58Å; D31-R35 IonicContact OD2-NH2 2.75Å; D31-R35 PolarHBondContact OD2-NH2 2.97Å |
| 32 | R | 42.9 | Very low | 42.4 | Very low | 165 Ų | 165 | 123.4 Ų | 123.4 | 62% | 0.623 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -92 | -37.6 | 171.4 | -152 | 172.8 | 177.8 | 179.8 | -1.2 | 110.6 | I29 Q30 S34 R35 W36 | I29-R32 PolarHBondContact O-N 2.92Å; Q30-R32 VanDerWaalsContact C-N 3.29Å; Q30-R32 PolarHBondContact O-N 3.15Å; R32-S34 PolarHBondContact O-N 3.41Å; R32-R35 PolarHBondContact O-N 3.17Å; R32-W36 PolarHBondContact O-N 3.33Å |
| 33 | A | 41.9 | Very low | 42.7 | Very low | 64 Ų | 64 | 117.6 Ų | 117.6 | 53% | 0.529 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -63.9 | -39.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | I29 Q30 W36 A37 | I29-A33 PolarHBondContact O-N 2.61Å; I29-A33 VanDerWaalsContact O-N 3.11Å; Q30-A33 PolarHBondContact O-N 2.81Å; A33-W36 PolarHBondContact O-N 2.94Å; A33-A37 WeakPolarHBondContact O-CB 3.3Å; A33-A37 PolarHBondContact O-N 3.14Å |
| 34 | S | 46.5 | Very low | 42.3 | Very low | 62 Ų | 62 | 116.1 Ų | 116.1 | 43% | 0.434 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -66.9 | -38.4 | 177.7 | 54.4 | 0 | 0 | 0 | 0 | 113.2 | Q30 D31 R32 W36 A37 A38 | Q30-S34 PolarHBondContact O-N 3.41Å; Q30-S34 VanDerWaalsContact O-N 3.16Å; Q30-S34 PolarHBondContact O-OG 2.93Å; Q30-S34 VanDerWaalsContact O-OG 3.12Å; D31-S34 WeakPolarHBondContact CA-OG 3.3Å; D31-S34 PolarHBondContact O-OG 2.92Å; R32-S34 PolarHBondContact O-N 3.41Å; S34-W36 VanDerWaalsContact C-N 3.35Å; S34-W36 PolarHBondContact O-N 3.13Å; S34-A37 PolarHBondContact O-N 3.16Å; S34-A38 PolarHBondContact O-N 3.37Å; S34-A38 VanDerWaalsContact O-N 3.15Å |
| 35 | R | 43.6 | Very low | 41.8 | Very low | 159 Ų | 159 | 114.3 Ų | 114.3 | 60% | 0.6 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -71.3 | -27.2 | 177.9 | -77.9 | -171.7 | -83.2 | -156.8 | -0.6 | 113.6 | D31 R32 | D31-R35 WeakPolarHBondContact O-CG 3.31Å; D31-R35 PolarHBondContact O-NE 2.98Å; D31-R35 IonicContact OD1-NE 3.98Å; D31-R35 IonicContact OD1-NH2 3.24Å; D31-R35 IonicContact OD2-CZ 3.43Å; D31-R35 VanDerWaalsContact OD2-CZ 3.24Å; D31-R35 IonicContact OD2-NE 3Å; D31-R35 IonicContact OD2-NH1 2.58Å; D31-R35 IonicContact OD2-NH2 2.75Å; D31-R35 PolarHBondContact OD2-NH2 2.97Å; R32-R35 PolarHBondContact O-N 3.17Å |
| 36 | W | 36.6 | Very low | 41.3 | Very low | 167 Ų | 167 | 115 Ų | 115 | 63% | 0.633 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -83.2 | -32.9 | 174.7 | -71.6 | 59.3 | 0 | 0 | 0 | 111.9 | R32 A33 S34 A38 A39 L40 | R32-W36 PolarHBondContact O-N 3.33Å; A33-W36 PolarHBondContact O-N 2.94Å; S34-W36 VanDerWaalsContact C-N 3.35Å; S34-W36 PolarHBondContact O-N 3.13Å; W36-A38 VanDerWaalsContact C-N 3.33Å; W36-A38 PolarHBondContact O-N 3.3Å; W36-A39 PolarHBondContact O-N 3.44Å; W36-L40 PolarHBondContact O-N 3.41Å |
| 37 | A | 38.3 | Very low | 40.9 | Very low | 64 Ų | 64 | 117.9 Ų | 117.9 | 53% | 0.529 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -66.7 | -31.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | A33 S34 | A33-A37 WeakPolarHBondContact O-CB 3.3Å; A33-A37 PolarHBondContact O-N 3.14Å; S34-A37 PolarHBondContact O-N 3.16Å |
| 38 | A | 40.8 | Very low | 40.1 | Very low | 70 Ų | 70 | 121.9 Ų | 121.9 | 58% | 0.579 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -72.2 | -31.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | S34 W36 | S34-A38 PolarHBondContact O-N 3.37Å; S34-A38 VanDerWaalsContact O-N 3.15Å; W36-A38 VanDerWaalsContact C-N 3.33Å; W36-A38 PolarHBondContact O-N 3.3Å |
| 39 | A | 39.6 | Very low | 39.2 | Very low | 71 Ų | 71 | 127.3 Ų | 127.3 | 59% | 0.587 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -79.3 | -21.2 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | W36 | W36-A39 PolarHBondContact O-N 3.44Å |
| 40 | L | 36.3 | Very low | 38.3 | Very low | 142 Ų | 142 | 126.5 Ų | 126.5 | 74% | 0.743 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.2 | -6.4 | 174.4 | -101.3 | 121.5 | 0 | 0 | 0 | 114 | W36 | W36-L40 PolarHBondContact O-N 3.41Š|
| 41 | R | 35.4 | Very low | 37.4 | Very low | 233 Ų | 233 | 127.4 Ų | 127.4 | 88% | 0.879 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -96 | 5.1 | -177.1 | -133.9 | 178 | -169.1 | -155.7 | 2.1 | 114.9 | ||
| 42 | S | 38.8 | Very low | 36.8 | Very low | 107 Ų | 107 | 130.3 Ų | 130.3 | 75% | 0.748 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -118.5 | 15.9 | 178.2 | 72.8 | 0 | 0 | 0 | 0 | 114.7 | ||
| 43 | S | 41.9 | Very low | 36.1 | Very low | 98 Ų | 98 | 127.6 Ų | 127.6 | 69% | 0.685 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -137.8 | 44.8 | -179.7 | -170.4 | 0 | 0 | 0 | 0 | 113.4 | ||
| 44 | I | 36.4 | Very low | 35.4 | Very low | 156 Ų | 156 | 128.4 Ų | 128.4 | 80% | 0.8 | 74% | 0.743 | S | S | * | * | trans | -145 | 97.4 | 157.4 | -53.7 | 179.4 | 0 | 0 | 0 | 106.9 | ||||
| 45 | A | 31.7 | Very low | 34.4 | Very low | 90 Ų | 90 | 131 Ų | 131 | 74% | 0.744 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 135.1 | 162.1 | 0 | 0 | 0 | 0 | 0 | 108 | V47 | A45-V47 PolarHBondContact O-N 3.28Š|
| 46 | P | 39.7 | Very low | 33.7 | Very low | 123 Ų | 123 | 129.7 Ų | 129.7 | 80% | 0.799 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -79 | 119.2 | 176.2 | 31.1 | -28.9 | 0 | 0 | 0 | 109.1 | ||
| 47 | V | 37.1 | Very low | 33.2 | Very low | 135 Ų | 135 | 126.4 Ų | 126.4 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 142.3 | 149.2 | 173.3 | 0 | 0 | 0 | 0 | 106.4 | A45 | A45-V47 PolarHBondContact O-N 3.28Š|
| 48 | L | 32.1 | Very low | 32.6 | Very low | 154 Ų | 154 | 129.4 Ų | 129.4 | 81% | 0.806 | 79% | 0.785 | S | S | * | * | trans | 105.6 | 85.6 | 163.3 | -145.8 | 80.7 | 0 | 0 | 0 | 117 | ||||
| 49 | W | 28.6 | Very low | 32 | Very low | 253 Ų | 253 | 133.2 Ų | 133.2 | 96% | 0.958 | 80% | 0.795 | S | S | * | * | trans | -141.5 | 124.4 | 134.2 | -80.5 | -18.3 | 0 | 0 | 0 | 105 | ||||
| 50 | S | 27.3 | Very low | 31.3 | Very low | 111 Ų | 111 | 135.4 Ų | 135.4 | 78% | 0.776 | 80% | 0.801 | S | S | * | * | -176.4 | 134.9 | 77.1 | -47.8 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 51 | L | 27.6 | Very low | 30.7 | Very low | 174 Ų | 174 | 132.9 Ų | 132.9 | 91% | 0.911 | 80% | 0.801 | S | S | * | * | trans | -151.1 | 93 | 154.8 | -94 | 174.2 | 0 | 0 | 0 | 108.5 | ||||
| 52 | T | 29.8 | Very low | 30.2 | Very low | 138 Ų | 138 | 128 Ų | 128 | 85% | 0.847 | 80% | 0.798 | S | S | * | * | trans | -150.9 | 111.5 | 152 | 50.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 53 | A | 28.1 | Very low | 29.6 | Very low | 109 Ų | 109 | 128.3 Ų | 128.3 | 90% | 0.901 | 80% | 0.799 | S | S | * | * | trans | 36.5 | 134 | 146.5 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 54 | G | 26.5 | Very low | 28.9 | Very low | 81 Ų | 81 | 135 Ų | 135 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | trans | 141.9 | 95.6 | 144.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 55 | S | 27.5 | Very low | 28.6 | Very low | 115 Ų | 115 | 133.1 Ų | 133.1 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | trans | -54.7 | 145.1 | 175.5 | -49.6 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 56 | T | 27.6 | Very low | 28.3 | Very low | 132 Ų | 132 | 136.5 Ų | 136.5 | 81% | 0.81 | 81% | 0.813 | S | S | * | * | 179.1 | 116.6 | 119.1 | 25.7 | 0 | 0 | 0 | 0 | 113 | |||||
| 57 | S | 26.8 | Very low | 27.5 | Very low | 99 Ų | 99 | 140.2 Ų | 140.2 | 69% | 0.692 | 82% | 0.817 | S | S | * | * | trans | 48.8 | 119.2 | 137.3 | 60.9 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 58 | V | 25.2 | Very low | 27.1 | Very low | 126 Ų | 126 | 141.8 Ų | 141.8 | 76% | 0.764 | 82% | 0.815 | S | S | * | * | 77.2 | 103.5 | 116.8 | -180 | 0 | 0 | 0 | 0 | 119.3 | |||||
| 59 | L | 27.9 | Very low | 27.1 | Very low | 150 Ų | 150 | 140.1 Ų | 140.1 | 79% | 0.785 | 81% | 0.814 | S | S | * | * | 164.8 | 130.2 | 113 | -90 | 179.4 | 0 | 0 | 0 | 115 | |||||
| 60 | T | 24.9 | Very low | 26.9 | Very low | 117 Ų | 117 | 136.3 Ų | 136.3 | 72% | 0.718 | 81% | 0.807 | S | S | * | * | trans | 45.9 | 113.8 | 143.9 | 46 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 61 | A | 23.9 | Very low | 26.8 | Very low | 90 Ų | 90 | 136.4 Ų | 136.4 | 74% | 0.744 | 81% | 0.807 | S | S | * | * | 57.3 | 133.9 | 117.9 | 0 | 0 | 0 | 0 | 0 | 122.6 | |||||
| 62 | T | 24.9 | Very low | 26.8 | Very low | 131 Ų | 131 | 135.6 Ų | 135.6 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | 106.2 | 127.4 | 138.6 | -12.7 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 63 | S | 26.5 | Very low | 26.6 | Very low | 112 Ų | 112 | 140 Ų | 140 | 78% | 0.783 | 80% | 0.804 | S | S | * | * | trans | 89.1 | 112 | 151.2 | 75.4 | 0 | 0 | 0 | 0 | 120 | ||||
| 64 | R | 26.8 | Very low | 26.4 | Very low | 238 Ų | 238 | 146.4 Ų | 146.4 | 90% | 0.898 | 81% | 0.805 | S | S | * | * | trans | -64.9 | 160.9 | 156.7 | -75 | 175.4 | 167.5 | 173.3 | -4.1 | 110.2 | ||||
| 65 | P | 29.6 | Very low | 26.5 | Very low | 118 Ų | 118 | 153.7 Ų | 153.7 | 77% | 0.766 | 81% | 0.808 | S | S | * | * | -134 | 132 | 114.2 | 27.1 | -11.1 | 0 | 0 | 0 | 114.3 | |||||
| 66 | N | 25.5 | Very low | 26.7 | Very low | 161 Ų | 161 | 159.5 Ų | 159.5 | 86% | 0.861 | 81% | 0.812 | S | S | * | * | trans | 22.8 | 109.2 | 136.3 | -118 | 10 | 0 | 0 | 0 | 118.8 | ||||
| 67 | F | 24.1 | Very low | 26.8 | Very low | 201 Ų | 201 | 157.6 Ų | 157.6 | 88% | 0.882 | 81% | 0.809 | S | S | * | * | trans | -114.3 | 110.5 | 159.2 | -112.7 | -93.5 | 0 | 0 | 0 | 108.5 | ||||
| 68 | E | 28.8 | Very low | 27.2 | Very low | 167 Ų | 167 | 158.9 Ų | 158.9 | 78% | 0.78 | 82% | 0.815 | S | S | * | * | trans | -71 | 133.5 | 159.4 | -112.6 | -133.2 | 132.9 | 0 | 0 | 108.9 | ||||
| 69 | P | 31.5 | Very low | 27.7 | Very low | 120 Ų | 120 | 156.3 Ų | 156.3 | 78% | 0.779 | 81% | 0.814 | S | S | * | * | trans | -97.6 | 106.6 | 161.3 | 17 | -0.5 | 0 | 0 | 0 | 110.3 | S71 | P69-S71 PolarHBondContact O-N 3.19Š| ||
| 70 | Q | 25 | Very low | 27.8 | Very low | 173 Ų | 173 | 157.1 Ų | 157.1 | 81% | 0.808 | 82% | 0.819 | S | S | * | * | trans | -51.5 | 129 | 162.8 | -99.4 | 174.8 | 2.4 | 0 | 0 | 110.9 | L72 | Q70-L72 PolarHBondContact O-N 3.1Š| ||
| 71 | S | 24.7 | Very low | 28.2 | Very low | 112 Ų | 112 | 160 Ų | 160 | 78% | 0.783 | 82% | 0.822 | S | S | * | * | trans | -60.1 | 113.5 | 175.2 | 59.7 | 0 | 0 | 0 | 0 | 111.6 | P69 R73 | P69-S71 PolarHBondContact O-N 3.19Å; S71-R73 PolarHBondContact O-N 2.94Å | ||
| 72 | L | 28.3 | Very low | 28.5 | Very low | 158 Ų | 158 | 162.3 Ų | 162.3 | 83% | 0.827 | 83% | 0.826 | S | S | * | * | trans | -72.3 | 96.1 | 167.5 | -75.2 | 169.8 | 0 | 0 | 0 | 109.5 | Q70 W74 | Q70-L72 PolarHBondContact O-N 3.1Å; L72-W74 PolarHBondContact O-N 3.24Å | ||
| 73 | R | 24 | Very low | 28.9 | Very low | 229 Ų | 229 | 162 Ų | 162 | 86% | 0.864 | 82% | 0.824 | S | S | * | * | trans | -58.9 | 100.1 | 167.8 | 180 | -173.1 | -80.4 | -146.2 | -2 | 109.1 | S71 R75 | S71-R73 PolarHBondContact O-N 2.94Å; R73-R75 PolarHBondContact O-N 2.98Å | ||
| 74 | W | 25.5 | Very low | 29.1 | Very low | 244 Ų | 244 | 160 Ų | 160 | 92% | 0.924 | 82% | 0.821 | S | S | * | * | trans | -62.1 | 102.7 | 166.6 | -72.7 | 98.1 | 0 | 0 | 0 | 109.3 | L72 R76 | L72-W74 PolarHBondContact O-N 3.24Å; W74-R76 PolarHBondContact O-N 3.19Å; W74-R76 VanDerWaalsContact O-N 3.15Å | ||
| 75 | R | 27.6 | Very low | 29.6 | Very low | 234 Ų | 234 | 157.5 Ų | 157.5 | 88% | 0.883 | 82% | 0.817 | S | S | * | * | trans | -70.7 | 108 | 172.6 | -151.9 | -160.3 | -64.6 | -106.3 | 7.6 | 107.5 | R73 A77 | R73-R75 PolarHBondContact O-N 2.98Å; R75-A77 PolarHBondContact O-N 3.48Å | ||
| 76 | R | 31.5 | Very low | 30 | Very low | 238 Ų | 238 | 157 Ų | 157 | 90% | 0.898 | 82% | 0.816 | S | S | * | * | trans | -52.5 | 114.2 | 172.7 | -168.9 | -177.9 | -68.9 | 177.3 | -2.7 | 109.8 | W74 | W74-R76 PolarHBondContact O-N 3.19Å; W74-R76 VanDerWaalsContact O-N 3.15Å | ||
| 77 | A | 29.7 | Very low | 30.4 | Very low | 91 Ų | 91 | 155.7 Ų | 155.7 | 75% | 0.752 | 81% | 0.814 | S | S | * | * | trans | -85 | 132 | 167.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | R75 | R75-A77 PolarHBondContact O-N 3.48Š| ||
| 78 | P | 35.8 | Very low | 30.9 | Very low | 126 Ų | 126 | 153.6 Ų | 153.6 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | trans | -80.5 | 138.9 | 178.2 | 29.7 | -28.8 | 0 | 0 | 0 | 111.7 | ||||
| 79 | G | 35.8 | Very low | 31.1 | Very low | 72 Ų | 72 | 156.2 Ų | 156.2 | 74% | 0.742 | 81% | 0.814 | S | S | * | * | trans | 4.5 | 106.6 | 166.7 | 0 | 0 | 0 | 0 | 0 | 118.9 | K81 | G79-K81 PolarHBondContact O-N 3.1Å; G79-K81 VanDerWaalsContact O-N 3.11Å | ||
| 80 | L | 28.8 | Very low | 31.4 | Very low | 168 Ų | 168 | 157.7 Ų | 157.7 | 88% | 0.88 | 82% | 0.815 | S | S | * | * | trans | -76.1 | 92.1 | 154.9 | -162.5 | 71.8 | 0 | 0 | 0 | 108 | V82 | L80-V82 PolarHBondContact O-N 2.87Š| ||
| 81 | K | 33.2 | Very low | 32.2 | Very low | 178 Ų | 178 | 157 Ų | 157 | 77% | 0.774 | 82% | 0.815 | S | S | * | * | trans | -63.9 | 112 | 164.8 | -78 | -171.5 | 174 | -177.3 | 0 | 107.7 | G79 T83 | G79-K81 PolarHBondContact O-N 3.1Å; G79-K81 VanDerWaalsContact O-N 3.11Å; K81-T83 PolarHBondContact O-N 2.85Å | ||
| 82 | V | 30.2 | Very low | 32.6 | Very low | 138 Ų | 138 | 155.9 Ų | 155.9 | 84% | 0.836 | 81% | 0.808 | S | S | * | * | trans | -72.1 | 82 | 165.7 | 179.4 | 0 | 0 | 0 | 0 | 107.3 | L80 | L80-V82 PolarHBondContact O-N 2.87Š| ||
| 83 | T | 35.1 | Very low | 33.3 | Very low | 125 Ų | 125 | 154.2 Ų | 154.2 | 77% | 0.767 | 80% | 0.804 | S | S | * | * | trans | -93.8 | 113.6 | 164.5 | 39.9 | 0 | 0 | 0 | 0 | 108 | K81 | K81-T83 PolarHBondContact O-N 2.85Š| ||
| 84 | G | 30.3 | Very low | 34 | Very low | 69 Ų | 69 | 153.6 Ų | 153.6 | 71% | 0.711 | 80% | 0.801 | S | S | * | * | trans | 164.8 | 44.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 85 | F | 36.4 | Very low | 34.4 | Very low | 185 Ų | 185 | 148.9 Ų | 148.9 | 81% | 0.811 | 79% | 0.79 | S | S | * | * | trans | -115.2 | 85.5 | 168.5 | -122.5 | -83.1 | 0 | 0 | 0 | 108.7 | ||||
| 86 | S | 37.8 | Very low | 35 | Very low | 109 Ų | 109 | 144.2 Ų | 144.2 | 76% | 0.762 | 78% | 0.781 | S | S | * | * | trans | -167.1 | 69.9 | 167 | 48.9 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 87 | V | 35.3 | Very low | 35.2 | Very low | 133 Ų | 133 | 139 Ų | 139 | 81% | 0.806 | 77% | 0.772 | S | S | * | * | trans | -137.7 | 67.2 | 150 | -171.5 | 0 | 0 | 0 | 0 | 107.4 | R89 | V87-R89 HydrophobicContact CG1-CB 4.25Å; V87-R89 PolarHBondContact O-N 2.9Å | ||
| 88 | L | 34.4 | Very low | 35.7 | Very low | 157 Ų | 157 | 139 Ų | 139 | 82% | 0.822 | 76% | 0.762 | S | S | * | * | trans | -80.4 | 86.9 | 153.7 | -86.2 | 165.3 | 0 | 0 | 0 | 105.8 | N90 | L88-N90 PolarHBondContact O-N 2.91Š| ||
| 89 | R | 32.9 | Very low | 35.8 | Very low | 221 Ų | 221 | 137.6 Ų | 137.6 | 83% | 0.834 | 76% | 0.755 | S | S | * | * | trans | -70.3 | 113.1 | 171.4 | -168.8 | 176.9 | 169.8 | -167.7 | -3.8 | 106.9 | V87 I91 | V87-R89 HydrophobicContact CG1-CB 4.25Å; V87-R89 PolarHBondContact O-N 2.9Å; R89-I91 PolarHBondContact O-N 2.96Å | ||
| 90 | N | 36.8 | Very low | 36.1 | Very low | 152 Ų | 152 | 138.2 Ų | 138.2 | 81% | 0.813 | 75% | 0.748 | S | S | * | * | trans | -41.7 | 109.6 | 172.8 | -70.8 | -16.9 | 0 | 0 | 0 | 110.7 | L88 S92 | L88-N90 PolarHBondContact O-N 2.91Å; N90-S92 PolarHBondContact O-N 2.75Å; N90-S92 VanDerWaalsContact O-N 3.14Å | ||
| 91 | I | 41.3 | Very low | 36.6 | Very low | 157 Ų | 157 | 139.8 Ų | 139.8 | 81% | 0.805 | 74% | 0.743 | S | S | * | * | trans | -78.5 | 93.2 | 156.6 | -65.1 | 171.1 | 0 | 0 | 0 | 103.8 | R89 V93 | R89-I91 PolarHBondContact O-N 2.96Å; I91-V93 PolarHBondContact O-N 3.13Å | ||
| 92 | S | 34.6 | Very low | 37 | Very low | 90 Ų | 90 | 136.2 Ų | 136.2 | 63% | 0.629 | 74% | 0.736 | S | S | * | * | trans | -55.7 | 108.7 | 162.5 | 170.1 | 0 | 0 | 0 | 0 | 106 | N90 R94 | N90-S92 PolarHBondContact O-N 2.75Å; N90-S92 VanDerWaalsContact O-N 3.14Å; S92-R94 PolarHBondContact O-N 2.94Å | ||
| 93 | V | 42.3 | Very low | 37.6 | Very low | 123 Ų | 123 | 136.9 Ų | 136.9 | 75% | 0.745 | 73% | 0.727 | S | S | * | * | trans | -60.5 | 91.7 | 160.5 | -179.8 | 0 | 0 | 0 | 0 | 104.4 | I91 E95 | I91-V93 PolarHBondContact O-N 3.13Å; V93-E95 PolarHBondContact O-N 3.19Å | ||
| 94 | R | 38.9 | Very low | 37.8 | Very low | 215 Ų | 215 | 138.9 Ų | 138.9 | 81% | 0.811 | 73% | 0.728 | S | S | * | * | trans | -66 | 99.7 | 161 | -79.2 | -176.2 | -178.8 | 176.9 | -0.2 | 104.3 | S92 L96 | S92-R94 PolarHBondContact O-N 2.94Å; R94-L96 PolarHBondContact O-N 3.42Å | ||
| 95 | E | 34.1 | Very low | 38.5 | Very low | 146 Ų | 146 | 143.6 Ų | 143.6 | 68% | 0.682 | 73% | 0.726 | S | S | * | * | trans | -47.1 | 109 | 161.1 | -70.3 | -175.2 | 165.2 | 0 | 0 | 107.1 | V93 N97 | V93-E95 PolarHBondContact O-N 3.19Å; E95-N97 PolarHBondContact O-N 2.86Å; E95-N97 PolarHBondContact OE2-ND2 2.92Å; E95-N97 VanDerWaalsContact OE2-ND2 3.1Å | ||
| 96 | L | 39.3 | Very low | 38.6 | Very low | 135 Ų | 135 | 141.7 Ų | 141.7 | 71% | 0.707 | 72% | 0.724 | S | S | * | * | trans | -74.1 | 72.1 | 165.9 | -69.5 | 172.1 | 0 | 0 | 0 | 106.3 | R94 T98 | R94-L96 PolarHBondContact O-N 3.42Å; L96-T98 PolarHBondContact O-N 3.35Å | ||
| 97 | N | 36.2 | Very low | 39.2 | Very low | 130 Ų | 130 | 140.9 Ų | 140.9 | 70% | 0.695 | 71% | 0.71 | S | S | * | * | trans | -70.9 | 75.5 | 162.2 | -75.3 | -31.4 | 0 | 0 | 0 | 106.7 | E95 S99 | E95-N97 PolarHBondContact O-N 2.86Å; E95-N97 PolarHBondContact OE2-ND2 2.92Å; E95-N97 VanDerWaalsContact OE2-ND2 3.1Å; N97-S99 PolarHBondContact O-N 3.34Å | ||
| 98 | T | 39.2 | Very low | 39.4 | Very low | 90 Ų | 90 | 142.6 Ų | 142.6 | 55% | 0.552 | 71% | 0.707 | S | S | * | * | trans | -69.4 | 82.8 | 161.4 | 41.2 | 0 | 0 | 0 | 0 | 106.4 | L96 S100 | L96-T98 PolarHBondContact O-N 3.35Å; T98-S100 VanDerWaalsContact C-N 3.25Å; T98-S100 PolarHBondContact O-N 2.68Å | ||
| 99 | S | 38 | Very low | 40.2 | Very low | 96 Ų | 96 | 138.4 Ų | 138.4 | 67% | 0.671 | 69% | 0.689 | S | S | * | * | trans | -52.2 | 94.6 | 166.3 | 160.8 | 0 | 0 | 0 | 0 | 107.9 | N97 R101 | N97-S99 PolarHBondContact O-N 3.34Å; S99-R101 PolarHBondContact O-N 3.48Å | ||
| 100 | S | 43.1 | Very low | 40.5 | Very low | 86 Ų | 86 | 135 Ų | 135 | 60% | 0.601 | 69% | 0.688 | S | S | * | * | trans | -70.5 | 82.1 | 173.7 | 65.2 | 0 | 0 | 0 | 0 | 107.9 | T98 V102 | T98-S100 VanDerWaalsContact C-N 3.25Å; T98-S100 PolarHBondContact O-N 2.68Å; S100-V102 VanDerWaalsContact C-N 3.26Å; S100-V102 PolarHBondContact O-N 2.87Å | ||
| 101 | R | 39.3 | Very low | 41.2 | Very low | 201 Ų | 201 | 134 Ų | 134 | 76% | 0.758 | 68% | 0.681 | S | S | * | * | trans | -65.3 | 100.6 | 158.1 | -78.3 | -170.7 | 177 | -178.8 | -0.7 | 105.9 | S99 F103 | S99-R101 PolarHBondContact O-N 3.48Å; R101-F103 VanDerWaalsContact C-N 3.26Å; R101-F103 HydrophobicContact CB-CE2 4.36Å; R101-F103 PolarHBondContact O-N 3.29Å | ||
| 102 | V | 42 | Very low | 41.3 | Very low | 103 Ų | 103 | 131.7 Ų | 131.7 | 62% | 0.624 | 68% | 0.676 | S | S | * | * | trans | -59.3 | 95.9 | 167.5 | 178.8 | 0 | 0 | 0 | 0 | 105.6 | S100 Q104 | S100-V102 VanDerWaalsContact C-N 3.26Å; S100-V102 PolarHBondContact O-N 2.87Å; V102-Q104 HydrophobicContact CG1-CB 4.1Å; V102-Q104 PolarHBondContact O-N 3.44Å | ||
| 103 | F | 42.7 | Very low | 41.7 | Very low | 151 Ų | 151 | 135.7 Ų | 135.7 | 66% | 0.662 | 68% | 0.682 | S | S | * | * | trans | -72.6 | 84.4 | 160.8 | -79 | -79.7 | 0 | 0 | 0 | 106 | R101 Y105 | R101-F103 VanDerWaalsContact C-N 3.26Å; R101-F103 HydrophobicContact CB-CE2 4.36Å; R101-F103 PolarHBondContact O-N 3.29Å; F103-Y105 HydrophobicContact CB-CD2 4.08Å; F103-Y105 HydrophobicContact CB-CE2 3.64Å; F103-Y105 HydrophobicContact CG-CE2 4.5Å; F103-Y105 WeakPolarHBondContact O-CD2 3.41Å; F103-Y105 PolarHBondContact O-N 3.32Å | ||
| 104 | Q | 38.4 | Very low | 42.3 | Very low | 167 Ų | 167 | 135 Ų | 135 | 78% | 0.78 | 68% | 0.678 | S | S | * | * | trans | -69.4 | 89.1 | 167 | -166.1 | 170.8 | -1.9 | 0 | 0 | 105.3 | V102 D106 | V102-Q104 HydrophobicContact CG1-CB 4.1Å; V102-Q104 PolarHBondContact O-N 3.44Å; Q104-D106 VanDerWaalsContact C-N 3.29Å; Q104-D106 PolarHBondContact O-N 2.89Å | ||
| 105 | Y | 45.6 | Very low | 42.5 | Very low | 169 Ų | 169 | 132.9 Ų | 132.9 | 66% | 0.663 | 68% | 0.677 | S | S | * | * | trans | -68.3 | 97.8 | 168.3 | -71.5 | -81.7 | 0 | 0 | 0 | 106.5 | F103 L107 | F103-Y105 HydrophobicContact CB-CD2 4.08Å; F103-Y105 HydrophobicContact CB-CE2 3.64Å; F103-Y105 HydrophobicContact CG-CE2 4.5Å; F103-Y105 WeakPolarHBondContact O-CD2 3.41Å; F103-Y105 PolarHBondContact O-N 3.32Å; Y105-L107 VanDerWaalsContact C-N 3.26Å; Y105-L107 PolarHBondContact O-N 3.24Å | ||
| 106 | D | 37.8 | Very low | 43.5 | Very low | 144 Ų | 144 | 129.2 Ų | 129.2 | 77% | 0.77 | 68% | 0.679 | S | S | * | * | trans | -67 | 88.6 | 169.8 | -158.1 | 12.4 | 0 | 0 | 0 | 107 | Q104 K108 | Q104-D106 VanDerWaalsContact C-N 3.29Å; Q104-D106 PolarHBondContact O-N 2.89Å; D106-K108 PolarHBondContact O-N 2.91Å | ||
| 107 | L | 50.5 | Low | 44.4 | Very low | 92 Ų | 92 | 129.7 Ų | 129.7 | 48% | 0.482 | 67% | 0.671 | S | S | . | * | trans | -73.2 | 84.9 | 169.8 | -92.4 | 83.9 | 0 | 0 | 0 | 107.4 | Y105 P109 L173 | Y105-L107 VanDerWaalsContact C-N 3.26Å; Y105-L107 PolarHBondContact O-N 3.24Å; L107-P109 VanDerWaalsContact O-CD 3.31Å; L107-P109 WeakPolarHBondContact O-CD 3.31Å; L107-L173 HydrophobicContact CD2-CD2 4.13Å | ||
| 108 | K | 40.6 | Very low | 45.3 | Very low | 169 Ų | 169 | 131.9 Ų | 131.9 | 74% | 0.735 | 68% | 0.675 | S | S | * | * | trans | -96.3 | 96.9 | 153 | -139.3 | -177.3 | -173.5 | -177.1 | 0 | 106.3 | D106 D110 | D106-K108 PolarHBondContact O-N 2.91Å; K108-D110 PolarHBondContact O-N 3.46Å | ||
| 109 | P | 50.6 | Low | 46.3 | Very low | 70 Ų | 70 | 132.8 Ų | 132.8 | 46% | 0.455 | 68% | 0.676 | S | S | . | * | trans | -73.7 | 102.2 | 173.2 | 28.6 | -26.4 | 0 | 0 | 0 | 106.3 | L107 I111 | L107-P109 VanDerWaalsContact O-CD 3.31Å; L107-P109 WeakPolarHBondContact O-CD 3.31Å; P109-I111 PolarHBondContact O-N 3.48Å | ||
| 110 | D | 38.7 | Very low | 47.4 | Very low | 149 Ų | 149 | 137.4 Ų | 137.4 | 80% | 0.797 | 68% | 0.684 | S | S | * | * | trans | -65.5 | 93.5 | 165.1 | -87.4 | -25.8 | 0 | 0 | 0 | 107.4 | K108 P112 | K108-D110 PolarHBondContact O-N 3.46Å; D110-P112 VanDerWaalsContact O-CD 3.3Å; D110-P112 WeakPolarHBondContact O-CD 3.07Å | ||
| 111 | I | 51 | Low | 48.9 | Very low | 132 Ų | 132 | 137.1 Ų | 137.1 | 68% | 0.677 | 67% | 0.672 | S | S | * | * | trans | -59.6 | 118.9 | 168.2 | -59.5 | 158.7 | 0 | 0 | 0 | 106.1 | P109 K113 | P109-I111 PolarHBondContact O-N 3.48Å; I111-K113 VanDerWaalsContact C-N 3.3Å; I111-K113 PolarHBondContact O-N 3.45Å | ||
| 112 | P | 44.9 | Very low | 50.8 | Low | 107 Ų | 107 | 132.3 Ų | 132.3 | 70% | 0.695 | 66% | 0.661 | S | S | * | * | trans | -65.4 | 102.4 | 163.1 | 26.4 | -28.6 | 0 | 0 | 0 | 106 | D110 T114 | D110-P112 VanDerWaalsContact O-CD 3.3Å; D110-P112 WeakPolarHBondContact O-CD 3.07Å; P112-T114 PolarHBondContact O-N 2.98Å | ||
| 113 | K | 42.4 | Very low | 52.8 | Low | 174 Ų | 174 | 130.4 Ų | 130.4 | 76% | 0.757 | 65% | 0.65 | S | S | * | * | trans | -47.3 | 126.5 | 174.4 | -74.1 | -179.8 | 176.6 | 177.8 | 0 | 108.3 | I111 E115 | I111-K113 VanDerWaalsContact C-N 3.3Å; I111-K113 PolarHBondContact O-N 3.45Å; K113-E115 HydrophobicContact CB-CG 4.11Å; K113-E115 PolarHBondContact O-N 3.02Å | ||
| 114 | T | 53.8 | Low | 54.8 | Low | 108 Ų | 108 | 128.7 Ų | 128.7 | 66% | 0.663 | 64% | 0.644 | S | S | * | * | trans | -67.8 | 66.9 | 176.8 | -50.4 | 0 | 0 | 0 | 0 | 110 | P112 | P112-T114 PolarHBondContact O-N 2.98Š| ||
| 115 | E | 45 | Very low | 56.9 | Low | 171 Ų | 171 | 123.2 Ų | 123.2 | 80% | 0.799 | 63% | 0.627 | S | S | * | * | trans | -105.2 | 93.8 | 176.3 | -69.5 | -73.4 | 158.4 | 0 | 0 | 107 | K113 | K113-E115 HydrophobicContact CB-CG 4.11Å; K113-E115 PolarHBondContact O-N 3.02Å | ||
| 116 | G | 55.1 | Low | 58.7 | Low | 69 Ų | 69 | 117.2 Ų | 117.2 | 71% | 0.711 | 61% | 0.608 | S | S | * | * | trans | 106.8 | 81.5 | 166 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 117 | R | 56.7 | Low | 61 | Low | 145 Ų | 145 | 111 Ų | 111 | 55% | 0.547 | 58% | 0.575 | S | S | . | * | trans | -134.2 | 68 | 162.1 | -63.1 | -174.5 | -153.3 | 168.8 | 4.6 | 110.6 | Y159 | R117-Y159 WeakPolarHBondContact CD-OH 3.4Š| ||
| 118 | K | 55.8 | Low | 62.6 | Low | 177 Ų | 177 | 113.6 Ų | 113.6 | 77% | 0.77 | 58% | 0.579 | S | S | * | * | trans | -92.6 | 113.5 | 158.9 | -76.1 | -178.4 | 178.5 | -179.8 | 0 | 106.8 | F120 | K118-F120 HydrophobicContact CB-CZ 4.4Å; K118-F120 PolarHBondContact O-N 3.46Å | ||
| 119 | L | 59.2 | Low | 64.7 | Low | 109 Ų | 109 | 110.2 Ų | 110.2 | 57% | 0.571 | 57% | 0.568 | S | S | * | * | trans | -74.7 | 117 | 165.8 | -72.2 | 169.2 | 0 | 0 | 0 | 107.3 | F121 M155 | L119-F121 PolarHBondContact O-N 3.42Å; L119-F121 VanDerWaalsContact O-N 3.15Å; L119-M155 HydrophobicContact CD1-CE 3.57Å; L119-M155 HydrophobicContact CD1-CG 3.77Å; L119-M155 HydrophobicContact CD1-SD 4.01Å; L119-M155 HydrophobicContact CG-CE 4.46Å | ||
| 120 | F | 62.3 | Low | 66.3 | Low | 193 Ų | 193 | 108.1 Ų | 108.1 | 85% | 0.846 | 55% | 0.553 | S | S | * | * | trans | -80.7 | 93.7 | 174 | -64.2 | -80.3 | 0 | 0 | 0 | 108 | K118 | K118-F120 HydrophobicContact CB-CZ 4.4Å; K118-F120 PolarHBondContact O-N 3.46Å | ||
| 121 | F | 74 | Confident | 68.6 | Low | 79 Ų | 79 | 104.4 Ų | 104.4 | 35% | 0.346 | 53% | 0.531 | S | S | . | . | trans | -86.1 | 109.1 | 170.9 | -165.7 | -87.5 | 0 | 0 | 0 | 108.5 | L119 T123 V126 V144 L147 I148 | L119-F121 PolarHBondContact O-N 3.42Å; L119-F121 VanDerWaalsContact O-N 3.15Å; F121-T123 VanDerWaalsContact C-N 3.33Å; F121-T123 PolarHBondContact O-N 3.22Å; F121-T123 PolarHBondContact O-OG1 3Å; F121-V126 HydrophobicContact CE1-CB 4.48Å; F121-V126 HydrophobicContact CE1-CG2 4Å; F121-V126 HydrophobicContact CZ-CG2 3.98Å; F121-V144 HydrophobicContact CE1-CG1 3.94Å; F121-L147 HydrophobicContact CE2-CD2 4.27Å; F121-L147 HydrophobicContact CZ-CD2 3.68Å; F121-L147 HydrophobicContact CZ-CG 4.34Å; F121-I148 HydrophobicContact CD1-CD1 3.7Å; F121-I148 HydrophobicContact CD1-CG1 3.5Å; F121-I148 VanDerWaalsContact CD1-CG1 3.5Å; F121-I148 HydrophobicContact CE1-CD1 4.13Å; F121-I148 HydrophobicContact CE1-CG1 3.83Å; F121-I148 HydrophobicContact CG-CG1 4.04Å | ||
| 122 | D | 79.9 | Confident | 70.3 | Confident | 101 Ų | 101 | 105.5 Ų | 105.5 | 54% | 0.54 | 53% | 0.533 | S | S | . | . | trans | -72.3 | 92 | 175.9 | -171.5 | -13.2 | 0 | 0 | 0 | 109.7 | H124 A125 V126 | D122-H124 VanDerWaalsContact C-N 3.25Å; D122-H124 PolarHBondContact O-N 3.48Å; D122-H124 PolarHBondContact OD1-N 3.39Å; D122-H124 VanDerWaalsContact OD1-N 3.09Å; D122-A125 HydrophobicContact CB-CB 4.27Å; D122-A125 PolarHBondContact OD1-N 2.89Å; D122-A125 VanDerWaalsContact OD1-N 3.14Å; D122-A125 WeakPolarHBondContact OD2-CB 2.95Å; D122-V126 WeakPolarHBondContact O-CG2 3.48Å | ||
| 123 | T | 84 | Confident | 72.1 | Confident | 62 Ų | 62 | 105.9 Ų | 105.9 | 38% | 0.38 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.3 | -34.4 | -178.3 | -54 | 0 | 0 | 0 | 0 | 110.7 | F121 V127 V144 I148 | F121-T123 VanDerWaalsContact C-N 3.33Å; F121-T123 PolarHBondContact O-N 3.22Å; F121-T123 PolarHBondContact O-OG1 3Å; T123-V127 VanDerWaalsContact O-CG2 3.3Å; T123-V127 WeakPolarHBondContact O-CG2 3.39Å; T123-V127 PolarHBondContact O-N 3.39Å; T123-V144 HydrophobicContact CG2-CG1 3.59Å; T123-I148 HydrophobicContact CG2-CD1 3.97Å; T123-I148 VanDerWaalsContact OG1-CD1 3.31Å; T123-I148 WeakPolarHBondContact OG1-CD1 3.31Å |
| 124 | H | 83.6 | Confident | 74.1 | Confident | 116 Ų | 116 | 101 Ų | 101 | 54% | 0.537 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -76.5 | -41.3 | -171.8 | -173.1 | 14.6 | 0 | 0 | 0 | 112 | D122 V126 V127 R128 | D122-H124 VanDerWaalsContact C-N 3.25Å; D122-H124 PolarHBondContact O-N 3.48Å; D122-H124 PolarHBondContact OD1-N 3.39Å; D122-H124 VanDerWaalsContact OD1-N 3.09Å; H124-V126 VanDerWaalsContact C-N 3.29Å; H124-V126 PolarHBondContact O-N 3.19Å; H124-V127 PolarHBondContact O-N 3.45Å; H124-R128 PolarHBondContact O-N 2.92Å |
| 125 | A | 82.6 | Confident | 75.5 | Confident | 52 Ų | 52 | 100.9 Ų | 100.9 | 43% | 0.43 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.8 | -39.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | D122 L129 | D122-A125 HydrophobicContact CB-CB 4.27Å; D122-A125 PolarHBondContact OD1-N 2.89Å; D122-A125 VanDerWaalsContact OD1-N 3.14Å; D122-A125 WeakPolarHBondContact OD2-CB 2.95Å; A125-L129 PolarHBondContact O-N 3.34Å; A125-L129 VanDerWaalsContact O-N 3.13Å |
| 126 | V | 83.8 | Confident | 77.4 | Confident | 42 Ų | 42 | 95.4 Ų | 95.4 | 26% | 0.255 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -71.7 | -37.5 | 179.9 | -176.4 | 0 | 0 | 0 | 0 | 111.6 | F121 D122 H124 L129 L130 V144 | F121-V126 HydrophobicContact CE1-CB 4.48Å; F121-V126 HydrophobicContact CE1-CG2 4Å; F121-V126 HydrophobicContact CZ-CG2 3.98Å; D122-V126 WeakPolarHBondContact O-CG2 3.48Å; H124-V126 VanDerWaalsContact C-N 3.29Å; H124-V126 PolarHBondContact O-N 3.19Å; V126-L129 PolarHBondContact O-N 3.26Å; V126-L130 HydrophobicContact CG1-CD1 4.16Å; V126-L130 WeakPolarHBondContact O-CD1 3.38Å; V126-L130 WeakPolarHBondContact O-CG 3.31Å; V126-L130 PolarHBondContact O-N 3.06Å; V126-L130 VanDerWaalsContact O-N 3.14Å; V126-V144 HydrophobicContact CB-CG2 4.06Å; V126-V144 HydrophobicContact CG1-CG2 3.57Å |
| 127 | V | 86.3 | Confident | 78.8 | Confident | 15 Ų | 15 | 95 Ų | 95 | 9% | 0.091 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -63.1 | -45.7 | 174.7 | 170.6 | 0 | 0 | 0 | 0 | 111.1 | T123 H124 L129 L130 E131 A140 E141 V144 | T123-V127 VanDerWaalsContact O-CG2 3.3Å; T123-V127 WeakPolarHBondContact O-CG2 3.39Å; T123-V127 PolarHBondContact O-N 3.39Å; H124-V127 PolarHBondContact O-N 3.45Å; V127-L129 VanDerWaalsContact C-N 3.34Å; V127-L129 PolarHBondContact O-N 3.04Å; V127-L130 PolarHBondContact O-N 3.46Å; V127-L130 VanDerWaalsContact O-N 3.16Å; V127-E131 HydrophobicContact CG1-CG 4.4Å; V127-E131 WeakPolarHBondContact O-CG 3.47Å; V127-E131 PolarHBondContact O-N 2.97Å; V127-A140 HydrophobicContact CG1-CB 4.1Å; V127-E141 HydrophobicContact CG2-CG 4.45Å; V127-V144 HydrophobicContact CG2-CB 4.17Å; V127-V144 HydrophobicContact CG2-CG1 4.49Å; V127-V144 HydrophobicContact CG2-CG2 3.85Å |
| 128 | R | 84.3 | Confident | 80.1 | Confident | 146 Ų | 146 | 95.6 Ų | 95.6 | 55% | 0.551 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -59.6 | -43.1 | 176.9 | -84.7 | -171 | 167.6 | -176.1 | -0.5 | 112.8 | H124 L130 E131 E132 | H124-R128 PolarHBondContact O-N 2.92Å; R128-L130 VanDerWaalsContact C-N 3.27Å; R128-L130 PolarHBondContact O-N 3.48Å; R128-E131 PolarHBondContact O-N 3.1Å; R128-E132 WeakPolarHBondContact O-CG 3.38Å; R128-E132 PolarHBondContact O-N 3.37Å |
| 129 | L | 85.1 | Confident | 81.5 | Confident | 97 Ų | 97 | 92.7 Ų | 92.7 | 51% | 0.508 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.6 | -39 | 177.4 | -177 | 67.6 | 0 | 0 | 0 | 111.7 | A125 V126 V127 N133 | A125-L129 PolarHBondContact O-N 3.34Å; A125-L129 VanDerWaalsContact O-N 3.13Å; V126-L129 PolarHBondContact O-N 3.26Å; V127-L129 VanDerWaalsContact C-N 3.34Å; V127-L129 PolarHBondContact O-N 3.04Å; L129-N133 PolarHBondContact O-N 3.49Å; L129-N133 PolarHBondContact O-ND2 2.98Å |
| 130 | L | 84.3 | Confident | 82.8 | Confident | 27 Ų | 27 | 87.5 Ų | 87.5 | 14% | 0.141 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -70.3 | -39.3 | 177.7 | -72.3 | 161.4 | 0 | 0 | 0 | 111.6 | V126 V127 R128 N133 G134 F135 A140 L143 V144 | V126-L130 HydrophobicContact CG1-CD1 4.16Å; V126-L130 WeakPolarHBondContact O-CD1 3.38Å; V126-L130 WeakPolarHBondContact O-CG 3.31Å; V126-L130 PolarHBondContact O-N 3.06Å; V126-L130 VanDerWaalsContact O-N 3.14Å; V127-L130 PolarHBondContact O-N 3.46Å; V127-L130 VanDerWaalsContact O-N 3.16Å; R128-L130 VanDerWaalsContact C-N 3.27Å; R128-L130 PolarHBondContact O-N 3.48Å; L130-N133 PolarHBondContact O-N 2.83Å; L130-G134 PolarHBondContact O-N 3.38Å; L130-F135 HydrophobicContact CB-CB 4.44Å; L130-F135 HydrophobicContact CB-CD2 4.39Å; L130-F135 HydrophobicContact CD2-CD2 4.1Å; L130-F135 HydrophobicContact CD2-CE2 4.22Å; L130-F135 WeakPolarHBondContact O-CB 3.39Å; L130-F135 WeakPolarHBondContact O-CD2 3.33Å; L130-F135 PolarHBondContact O-N 3.48Å; L130-A140 HydrophobicContact CB-CB 3.64Å; L130-A140 HydrophobicContact CD1-CB 4.15Å; L130-L143 HydrophobicContact CD1-CD2 3.86Å; L130-L143 HydrophobicContact CD2-CD2 3.81Å; L130-V144 HydrophobicContact CD1-CG2 3.66Å |
| 131 | E | 87.3 | Confident | 84 | Confident | 71 Ų | 71 | 82.5 Ų | 82.5 | 33% | 0.332 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -62.5 | -42 | 175.2 | -70.2 | 173.7 | 165.3 | 0 | 0 | 112 | V127 R128 N133 G134 S137 A140 | V127-E131 HydrophobicContact CG1-CG 4.4Å; V127-E131 WeakPolarHBondContact O-CG 3.47Å; V127-E131 PolarHBondContact O-N 2.97Å; R128-E131 PolarHBondContact O-N 3.1Å; E131-N133 PolarHBondContact O-N 3.42Å; E131-G134 PolarHBondContact O-N 2.94Å; E131-G134 VanDerWaalsContact O-N 3.1Å; E131-S137 VanDerWaalsContact OE1-CA 3.31Å; E131-S137 WeakPolarHBondContact OE1-CA 3.4Å; E131-S137 WeakPolarHBondContact OE1-CB 3.3Å; E131-S137 PolarHBondContact OE1-OG 3.49Å; E131-A140 HydrophobicContact CG-CB 4.32Å |
| 132 | E | 86.4 | Confident | 84.7 | Confident | 155 Ų | 155 | 83 Ų | 83 | 72% | 0.724 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -62.5 | -27.1 | 175.3 | -73.7 | 173.2 | -170 | 0 | 0 | 113 | R128 G134 | R128-E132 WeakPolarHBondContact O-CG 3.38Å; R128-E132 PolarHBondContact O-N 3.37Å; E132-G134 VanDerWaalsContact C-N 3.32Å |
| 133 | N | 82.5 | Confident | 84.9 | Confident | 115 Ų | 115 | 82.9 Ų | 82.9 | 62% | 0.615 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.2 | 13.6 | 177.4 | -75 | -74.4 | 0 | 0 | 0 | 113.5 | L129 L130 E131 F135 | L129-N133 PolarHBondContact O-N 3.49Å; L129-N133 PolarHBondContact O-ND2 2.98Å; L130-N133 PolarHBondContact O-N 2.83Å; E131-N133 PolarHBondContact O-N 3.42Å; N133-F135 HydrophobicContact CB-CD2 4.49Å |
| 134 | G | 83.2 | Confident | 85.2 | Confident | 71 Ų | 71 | 80 Ų | 80 | 73% | 0.732 | 43% | 0.426 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 91.6 | 11.8 | 170.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | L130 E131 E132 | L130-G134 PolarHBondContact O-N 3.38Å; E131-G134 PolarHBondContact O-N 2.94Å; E131-G134 VanDerWaalsContact O-N 3.1Å; E132-G134 VanDerWaalsContact C-N 3.32Å |
| 135 | F | 84.3 | Confident | 85.4 | Confident | 105 Ų | 105 | 80.5 Ų | 80.5 | 46% | 0.461 | 43% | 0.427 | S | S | . | . | trans | -83.1 | 143.8 | 172.2 | -68.7 | -89.8 | 0 | 0 | 0 | 111 | L130 N133 | L130-F135 HydrophobicContact CB-CB 4.44Å; L130-F135 HydrophobicContact CB-CD2 4.39Å; L130-F135 HydrophobicContact CD2-CD2 4.1Å; L130-F135 HydrophobicContact CD2-CE2 4.22Å; L130-F135 WeakPolarHBondContact O-CB 3.39Å; L130-F135 WeakPolarHBondContact O-CD2 3.33Å; L130-F135 PolarHBondContact O-N 3.48Å; N133-F135 HydrophobicContact CB-CD2 4.49Å | ||
| 136 | S | 85.6 | Confident | 85.7 | Confident | 57 Ų | 57 | 82.3 Ų | 82.3 | 40% | 0.399 | 43% | 0.432 | S | S | . | . | trans | -68.7 | 147.8 | 171 | 68.5 | 0 | 0 | 0 | 0 | 110.3 | Q138 Q139 A140 | S136-Q138 PolarHBondContact O-N 3.49Å; S136-Q138 VanDerWaalsContact O-N 3.13Å; S136-Q139 WeakPolarHBondContact O-CA 3.47Å; S136-Q139 WeakPolarHBondContact O-CB 3.49Å; S136-Q139 PolarHBondContact O-N 3.43Å; S136-Q139 WeakPolarHBondContact OG-CG 3.35Å; S136-Q139 PolarHBondContact OG-OE1 2.82Å; S136-A140 PolarHBondContact O-N 3.4Å | ||
| 137 | S | 84 | Confident | 85.9 | Confident | 59 Ų | 59 | 84.2 Ų | 84.2 | 41% | 0.413 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -51.5 | -40.4 | -178.1 | -167.4 | 0 | 0 | 0 | 0 | 113.1 | E131 Q139 A140 E141 | E131-S137 VanDerWaalsContact OE1-CA 3.31Å; E131-S137 WeakPolarHBondContact OE1-CA 3.4Å; E131-S137 WeakPolarHBondContact OE1-CB 3.3Å; E131-S137 PolarHBondContact OE1-OG 3.49Å; S137-Q139 PolarHBondContact O-N 2.85Å; S137-A140 PolarHBondContact O-N 3.43Å; S137-E141 PolarHBondContact O-N 3.22Å |
| 138 | Q | 84.4 | Confident | 85.9 | Confident | 158 Ų | 158 | 85.2 Ų | 85.2 | 74% | 0.738 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -65.9 | -38.7 | 176.8 | -63.6 | -173.4 | 3.3 | 0 | 0 | 112.9 | S136 V142 | S136-Q138 PolarHBondContact O-N 3.49Å; S136-Q138 VanDerWaalsContact O-N 3.13Å; Q138-V142 VanDerWaalsContact O-CG2 3.31Å; Q138-V142 WeakPolarHBondContact O-CG2 3.32Å; Q138-V142 PolarHBondContact O-N 2.98Å |
| 139 | Q | 85.5 | Confident | 86.1 | Confident | 116 Ų | 116 | 79.9 Ų | 79.9 | 54% | 0.542 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -70.3 | -40 | 177.3 | -71.3 | 167.1 | -36 | 0 | 0 | 111.5 | S136 S137 V142 L143 | S136-Q139 WeakPolarHBondContact O-CA 3.47Å; S136-Q139 WeakPolarHBondContact O-CB 3.49Å; S136-Q139 PolarHBondContact O-N 3.43Å; S136-Q139 WeakPolarHBondContact OG-CG 3.35Å; S136-Q139 PolarHBondContact OG-OE1 2.82Å; S137-Q139 PolarHBondContact O-N 2.85Å; Q139-V142 PolarHBondContact O-N 3.44Å; Q139-L143 WeakPolarHBondContact O-CB 3.3Å; Q139-L143 PolarHBondContact O-N 2.76Å |
| 140 | A | 85.9 | Confident | 86.2 | Confident | 1 Ų | 1 | 78.7 Ų | 78.7 | 1% | 0.008 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -62 | -45.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | V127 L130 E131 S136 S137 V142 L143 V144 | V127-A140 HydrophobicContact CG1-CB 4.1Å; L130-A140 HydrophobicContact CB-CB 3.64Å; L130-A140 HydrophobicContact CD1-CB 4.15Å; E131-A140 HydrophobicContact CG-CB 4.32Å; S136-A140 PolarHBondContact O-N 3.4Å; S137-A140 PolarHBondContact O-N 3.43Å; A140-V142 PolarHBondContact O-N 3.12Å; A140-L143 PolarHBondContact O-N 2.94Å; A140-V144 VanDerWaalsContact O-CG2 3.3Å; A140-V144 WeakPolarHBondContact O-CG2 3.33Å; A140-V144 PolarHBondContact O-N 2.86Å |
| 141 | E | 86.4 | Confident | 86.3 | Confident | 87 Ų | 87 | 79.6 Ų | 79.6 | 41% | 0.407 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -60.9 | -43.2 | 176.2 | -79.3 | -168.2 | -162.5 | 0 | 0 | 113.4 | V127 S137 V144 K145 | V127-E141 HydrophobicContact CG2-CG 4.45Å; S137-E141 PolarHBondContact O-N 3.22Å; E141-V144 PolarHBondContact O-N 2.94Å; E141-K145 WeakPolarHBondContact O-CB 3.22Å; E141-K145 VanDerWaalsContact O-CG 3.25Å; E141-K145 WeakPolarHBondContact O-CG 3.47Å; E141-K145 PolarHBondContact O-N 3.47Å; E141-K145 IonicContact OE2-NZ 3.98Å; E141-K145 PolarHBondContact OE2-NZ 3.39Å; E141-K145 VanDerWaalsContact OE2-NZ 3.13Å |
| 142 | V | 88.6 | Confident | 86.3 | Confident | 89 Ų | 89 | 80.2 Ų | 80.2 | 54% | 0.539 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -65.4 | -43 | -179.9 | 171.6 | 0 | 0 | 0 | 0 | 110.5 | Q138 Q139 A140 V144 K145 V146 | Q138-V142 VanDerWaalsContact O-CG2 3.31Å; Q138-V142 WeakPolarHBondContact O-CG2 3.32Å; Q138-V142 PolarHBondContact O-N 2.98Å; Q139-V142 PolarHBondContact O-N 3.44Å; A140-V142 PolarHBondContact O-N 3.12Å; V142-V144 PolarHBondContact O-N 2.65Å; V142-K145 PolarHBondContact O-N 2.88Å; V142-V146 WeakPolarHBondContact O-CG2 3.23Å; V142-V146 PolarHBondContact O-N 2.92Å |
| 143 | L | 85.8 | Confident | 86.3 | Confident | 99 Ų | 99 | 76 Ų | 76 | 52% | 0.518 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -61.5 | -44.7 | 177.6 | -164.4 | 83.8 | 0 | 0 | 0 | 111.5 | L130 Q139 A140 V146 L147 | L130-L143 HydrophobicContact CD1-CD2 3.86Å; L130-L143 HydrophobicContact CD2-CD2 3.81Å; Q139-L143 WeakPolarHBondContact O-CB 3.3Å; Q139-L143 PolarHBondContact O-N 2.76Å; A140-L143 PolarHBondContact O-N 2.94Å; L143-V146 PolarHBondContact O-N 2.99Å; L143-L147 WeakPolarHBondContact O-CB 3.48Å; L143-L147 PolarHBondContact O-N 3.19Å |
| 144 | V | 89.3 | Confident | 86.5 | Confident | 1 Ų | 1 | 74.8 Ų | 74.8 | 1% | 0.006 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -67.4 | -38.8 | 178.6 | 176.6 | 0 | 0 | 0 | 0 | 111.4 | F121 T123 V126 V127 L130 A140 E141 V142 V146 L147 I148 | F121-V144 HydrophobicContact CE1-CG1 3.94Å; T123-V144 HydrophobicContact CG2-CG1 3.59Å; V126-V144 HydrophobicContact CB-CG2 4.06Å; V126-V144 HydrophobicContact CG1-CG2 3.57Å; V127-V144 HydrophobicContact CG2-CB 4.17Å; V127-V144 HydrophobicContact CG2-CG1 4.49Å; V127-V144 HydrophobicContact CG2-CG2 3.85Å; L130-V144 HydrophobicContact CD1-CG2 3.66Å; A140-V144 VanDerWaalsContact O-CG2 3.3Å; A140-V144 WeakPolarHBondContact O-CG2 3.33Å; A140-V144 PolarHBondContact O-N 2.86Å; E141-V144 PolarHBondContact O-N 2.94Å; V142-V144 PolarHBondContact O-N 2.65Å; V144-V146 VanDerWaalsContact C-N 3.34Å; V144-V146 PolarHBondContact O-N 2.96Å; V144-L147 PolarHBondContact O-N 3.43Å; V144-I148 HydrophobicContact CG1-CD1 3.8Å; V144-I148 HydrophobicContact CG1-CG1 4.33Å; V144-I148 VanDerWaalsContact O-CG1 3.3Å; V144-I148 WeakPolarHBondContact O-CG1 3.25Å; V144-I148 PolarHBondContact O-N 2.93Å |
| 145 | K | 87.2 | Confident | 86.4 | Confident | 127 Ų | 127 | 73.7 Ų | 73.7 | 55% | 0.552 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -60.6 | -42.2 | 173.5 | -77.7 | 168.4 | -176.6 | 158.2 | 0 | 112 | E141 V142 G149 | E141-K145 WeakPolarHBondContact O-CB 3.22Å; E141-K145 VanDerWaalsContact O-CG 3.25Å; E141-K145 WeakPolarHBondContact O-CG 3.47Å; E141-K145 PolarHBondContact O-N 3.47Å; E141-K145 IonicContact OE2-NZ 3.98Å; E141-K145 PolarHBondContact OE2-NZ 3.39Å; E141-K145 VanDerWaalsContact OE2-NZ 3.13Å; V142-K145 PolarHBondContact O-N 2.88Å; K145-G149 PolarHBondContact O-N 2.76Å |
| 146 | V | 89.2 | Confident | 86.3 | Confident | 90 Ų | 90 | 73.6 Ų | 73.6 | 55% | 0.545 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -64 | -44.7 | 174.6 | 172.7 | 0 | 0 | 0 | 0 | 110.6 | V142 L143 V144 I148 G149 T150 | V142-V146 WeakPolarHBondContact O-CG2 3.23Å; V142-V146 PolarHBondContact O-N 2.92Å; L143-V146 PolarHBondContact O-N 2.99Å; V144-V146 VanDerWaalsContact C-N 3.34Å; V144-V146 PolarHBondContact O-N 2.96Å; V146-I148 PolarHBondContact O-N 3.32Å; V146-G149 PolarHBondContact O-N 3.48Å; V146-T150 PolarHBondContact O-N 3.1Å; V146-T150 PolarHBondContact O-OG1 2.83Å; V146-T150 VanDerWaalsContact O-OG1 3.1Å |
| 147 | L | 87.7 | Confident | 86.2 | Confident | 82 Ų | 82 | 76.3 Ų | 76.3 | 43% | 0.429 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -61.6 | -43.1 | 179.2 | -174 | 65.1 | 0 | 0 | 0 | 112.2 | F121 L143 V144 T151 | F121-L147 HydrophobicContact CE2-CD2 4.27Å; F121-L147 HydrophobicContact CZ-CD2 3.68Å; F121-L147 HydrophobicContact CZ-CG 4.34Å; L143-L147 WeakPolarHBondContact O-CB 3.48Å; L143-L147 PolarHBondContact O-N 3.19Å; V144-L147 PolarHBondContact O-N 3.43Å; L147-T151 VanDerWaalsContact O-CB 3.23Å; L147-T151 WeakPolarHBondContact O-CB 3.43Å; L147-T151 PolarHBondContact O-N 3.04Å; L147-T151 PolarHBondContact O-OG1 3.06Å |
| 148 | I | 87.6 | Confident | 86.1 | Confident | 37 Ų | 37 | 76.8 Ų | 76.8 | 19% | 0.19 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -64.8 | -44.3 | 174.9 | -68.1 | 167 | 0 | 0 | 0 | 110.2 | F121 T123 V144 V146 T151 N152 | F121-I148 HydrophobicContact CD1-CD1 3.7Å; F121-I148 HydrophobicContact CD1-CG1 3.5Å; F121-I148 VanDerWaalsContact CD1-CG1 3.5Å; F121-I148 HydrophobicContact CE1-CD1 4.13Å; F121-I148 HydrophobicContact CE1-CG1 3.83Å; F121-I148 HydrophobicContact CG-CG1 4.04Å; T123-I148 HydrophobicContact CG2-CD1 3.97Å; T123-I148 VanDerWaalsContact OG1-CD1 3.31Å; T123-I148 WeakPolarHBondContact OG1-CD1 3.31Å; V144-I148 HydrophobicContact CG1-CD1 3.8Å; V144-I148 HydrophobicContact CG1-CG1 4.33Å; V144-I148 VanDerWaalsContact O-CG1 3.3Å; V144-I148 WeakPolarHBondContact O-CG1 3.25Å; V144-I148 PolarHBondContact O-N 2.93Å; V146-I148 PolarHBondContact O-N 3.32Å; I148-T151 PolarHBondContact O-N 3.48Å; I148-N152 WeakPolarHBondContact CG2-ND2 3.38Å; I148-N152 WeakPolarHBondContact O-CB 3.37Å; I148-N152 PolarHBondContact O-N 3.03Å; I148-N152 PolarHBondContact O-ND2 3.06Å |
| 149 | G | 87.5 | Confident | 85.8 | Confident | 34 Ų | 34 | 72.1 Ų | 72.1 | 35% | 0.351 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -56.9 | -52.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | K145 V146 T151 N152 S153 | K145-G149 PolarHBondContact O-N 2.76Å; V146-G149 PolarHBondContact O-N 3.48Å; G149-T151 PolarHBondContact O-N 3.25Å; G149-N152 PolarHBondContact O-N 2.93Å; G149-S153 PolarHBondContact O-N 3.44Å; G149-S153 PolarHBondContact O-OG 2.94Å; G149-S153 VanDerWaalsContact O-OG 3.12Å |
| 150 | T | 88.4 | Confident | 85.4 | Confident | 72 Ų | 72 | 70.7 Ų | 70.7 | 44% | 0.442 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -63.4 | -40.5 | 177.6 | -56.2 | 0 | 0 | 0 | 0 | 112.2 | V146 S153 N154 | V146-T150 PolarHBondContact O-N 3.1Å; V146-T150 PolarHBondContact O-OG1 2.83Å; V146-T150 VanDerWaalsContact O-OG1 3.1Å; T150-S153 PolarHBondContact O-N 3.43Å; T150-N154 VanDerWaalsContact O-CB 3.31Å; T150-N154 WeakPolarHBondContact O-CB 3.49Å; T150-N154 PolarHBondContact O-N 3.39Å; T150-N154 PolarHBondContact O-ND2 3.46Å |
| 151 | T | 86.2 | Confident | 84.9 | Confident | 46 Ų | 46 | 74.1 Ų | 74.1 | 28% | 0.282 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -65.5 | -45 | 178.7 | -58.4 | 0 | 0 | 0 | 0 | 111 | L147 I148 G149 N154 M155 | L147-T151 VanDerWaalsContact O-CB 3.23Å; L147-T151 WeakPolarHBondContact O-CB 3.43Å; L147-T151 PolarHBondContact O-N 3.04Å; L147-T151 PolarHBondContact O-OG1 3.06Å; I148-T151 PolarHBondContact O-N 3.48Å; G149-T151 PolarHBondContact O-N 3.25Å; T151-N154 PolarHBondContact O-N 3.46Å; T151-M155 HydrophobicContact CG2-CG 4.47Å; T151-M155 WeakPolarHBondContact O-CB 3.27Å; T151-M155 VanDerWaalsContact O-CG 3.22Å; T151-M155 WeakPolarHBondContact O-CG 3.46Å; T151-M155 PolarHBondContact O-N 3.28Å |
| 152 | N | 85.9 | Confident | 84.2 | Confident | 83 Ų | 83 | 74.3 Ų | 74.3 | 44% | 0.444 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -62.8 | -46 | 176.9 | -71.6 | -22.8 | 0 | 0 | 0 | 111.3 | I148 G149 N154 M155 D156 | I148-N152 WeakPolarHBondContact CG2-ND2 3.38Å; I148-N152 WeakPolarHBondContact O-CB 3.37Å; I148-N152 PolarHBondContact O-N 3.03Å; I148-N152 PolarHBondContact O-ND2 3.06Å; G149-N152 PolarHBondContact O-N 2.93Å; N152-N154 PolarHBondContact O-N 3.27Å; N152-M155 PolarHBondContact O-N 3.33Å; N152-D156 PolarHBondContact O-N 2.9Å |
| 153 | S | 87.2 | Confident | 83.2 | Confident | 67 Ų | 67 | 74 Ų | 74 | 47% | 0.469 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -62.4 | -40.2 | 176.2 | -61.2 | 0 | 0 | 0 | 0 | 112.9 | G149 T150 M155 D156 L157 | G149-S153 PolarHBondContact O-N 3.44Å; G149-S153 PolarHBondContact O-OG 2.94Å; G149-S153 VanDerWaalsContact O-OG 3.12Å; T150-S153 PolarHBondContact O-N 3.43Å; S153-M155 VanDerWaalsContact C-N 3.33Å; S153-D156 PolarHBondContact O-N 2.88Å; S153-L157 WeakPolarHBondContact O-CG 3.21Å; S153-L157 PolarHBondContact O-N 3.3Å; S153-L157 VanDerWaalsContact O-N 3.14Å |
| 154 | N | 86 | Confident | 82.4 | Confident | 89 Ų | 89 | 72.6 Ų | 72.6 | 48% | 0.476 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -65.3 | -38.1 | 175.5 | -76.3 | -13.5 | 0 | 0 | 0 | 111.6 | T150 T151 N152 L157 V158 | T150-N154 VanDerWaalsContact O-CB 3.31Å; T150-N154 WeakPolarHBondContact O-CB 3.49Å; T150-N154 PolarHBondContact O-N 3.39Å; T150-N154 PolarHBondContact O-ND2 3.46Å; T151-N154 PolarHBondContact O-N 3.46Å; N152-N154 PolarHBondContact O-N 3.27Å; N154-L157 PolarHBondContact O-N 3.45Å; N154-V158 WeakPolarHBondContact O-CB 3.35Å; N154-V158 VanDerWaalsContact O-CG2 3.24Å; N154-V158 WeakPolarHBondContact O-CG2 3.26Å; N154-V158 PolarHBondContact O-N 2.89Å |
| 155 | M | 82.4 | Confident | 81.6 | Confident | 48 Ų | 48 | 78 Ų | 78 | 24% | 0.236 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -67.9 | -41 | 176.9 | -70.3 | -62.4 | -69.3 | 0 | 0 | 111.8 | L119 T151 N152 S153 L157 V158 Y159 | L119-M155 HydrophobicContact CD1-CE 3.57Å; L119-M155 HydrophobicContact CD1-CG 3.77Å; L119-M155 HydrophobicContact CD1-SD 4.01Å; L119-M155 HydrophobicContact CG-CE 4.46Å; T151-M155 HydrophobicContact CG2-CG 4.47Å; T151-M155 WeakPolarHBondContact O-CB 3.27Å; T151-M155 VanDerWaalsContact O-CG 3.22Å; T151-M155 WeakPolarHBondContact O-CG 3.46Å; T151-M155 PolarHBondContact O-N 3.28Å; N152-M155 PolarHBondContact O-N 3.33Å; S153-M155 VanDerWaalsContact C-N 3.33Å; M155-L157 VanDerWaalsContact C-N 3.3Å; M155-L157 PolarHBondContact O-N 2.94Å; M155-V158 PolarHBondContact O-N 3.48Å; M155-Y159 HydrophobicContact CB-CD2 4.26Å; M155-Y159 HydrophobicContact CB-CE2 3.92Å; M155-Y159 HydrophobicContact CE-CE1 4.14Å; M155-Y159 HydrophobicContact CE-CE2 3.61Å; M155-Y159 WeakPolarHBondContact CE-OH 2.95Å; M155-Y159 WeakPolarHBondContact O-CB 3.46Å; M155-Y159 WeakPolarHBondContact O-CD2 3.47Å; M155-Y159 VanDerWaalsContact O-CG 3.31Å; M155-Y159 PolarHBondContact O-N 2.89Å |
| 156 | D | 81.6 | Confident | 80.9 | Confident | 104 Ų | 104 | 76.4 Ų | 76.4 | 56% | 0.556 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -59.7 | -41 | 175 | -71.2 | -22.4 | 0 | 0 | 0 | 111.9 | N152 S153 Y159 T160 | N152-D156 PolarHBondContact O-N 2.9Å; S153-D156 PolarHBondContact O-N 2.88Å; D156-Y159 PolarHBondContact O-N 3.43Å; D156-T160 WeakPolarHBondContact O-CB 3.48Å; D156-T160 VanDerWaalsContact O-CG2 3.32Å; D156-T160 WeakPolarHBondContact O-CG2 3.25Å; D156-T160 PolarHBondContact O-N 2.91Å; D156-T160 PolarHBondContact O-OG1 3.33Å |
| 157 | L | 84.3 | Confident | 80.2 | Confident | 114 Ų | 114 | 77.6 Ų | 77.6 | 60% | 0.597 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -64.8 | -46.2 | 174 | -71 | 173.9 | 0 | 0 | 0 | 112.2 | S153 N154 M155 Y159 T160 D161 | S153-L157 WeakPolarHBondContact O-CG 3.21Å; S153-L157 PolarHBondContact O-N 3.3Å; S153-L157 VanDerWaalsContact O-N 3.14Å; N154-L157 PolarHBondContact O-N 3.45Å; M155-L157 VanDerWaalsContact C-N 3.3Å; M155-L157 PolarHBondContact O-N 2.94Å; L157-Y159 VanDerWaalsContact C-N 3.3Å; L157-Y159 PolarHBondContact O-N 3.46Å; L157-T160 WeakPolarHBondContact CA-OG1 3.18Å; L157-T160 PolarHBondContact O-N 2.88Å; L157-T160 PolarHBondContact O-OG1 2.95Å; L157-D161 VanDerWaalsContact O-CB 3.28Å; L157-D161 WeakPolarHBondContact O-CB 3.25Å; L157-D161 PolarHBondContact O-N 2.96Å |
| 158 | V | 81.3 | Confident | 79.4 | Confident | 69 Ų | 69 | 80.1 Ų | 80.1 | 42% | 0.418 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63.5 | -36.7 | 178.9 | 168 | 0 | 0 | 0 | 0 | 111.5 | N154 M155 M162 | N154-V158 WeakPolarHBondContact O-CB 3.35Å; N154-V158 VanDerWaalsContact O-CG2 3.24Å; N154-V158 WeakPolarHBondContact O-CG2 3.26Å; N154-V158 PolarHBondContact O-N 2.89Å; M155-V158 PolarHBondContact O-N 3.48Å; V158-M162 HydrophobicContact CG1-CE 3.3Å; V158-M162 WeakPolarHBondContact O-CB 3.24Å; V158-M162 PolarHBondContact O-N 3.21Å |
| 159 | Y | 78.6 | Confident | 78.8 | Confident | 60 Ų | 60 | 84.5 Ų | 84.5 | 24% | 0.235 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -72.8 | -43.2 | 177.2 | -68.8 | -49 | 0 | 0 | 0 | 112.8 | R117 M155 D156 L157 D161 M162 V163 | R117-Y159 WeakPolarHBondContact CD-OH 3.4Å; M155-Y159 HydrophobicContact CB-CD2 4.26Å; M155-Y159 HydrophobicContact CB-CE2 3.92Å; M155-Y159 HydrophobicContact CE-CE1 4.14Å; M155-Y159 HydrophobicContact CE-CE2 3.61Å; M155-Y159 WeakPolarHBondContact CE-OH 2.95Å; M155-Y159 WeakPolarHBondContact O-CB 3.46Å; M155-Y159 WeakPolarHBondContact O-CD2 3.47Å; M155-Y159 VanDerWaalsContact O-CG 3.31Å; M155-Y159 PolarHBondContact O-N 2.89Å; D156-Y159 PolarHBondContact O-N 3.43Å; L157-Y159 VanDerWaalsContact C-N 3.3Å; L157-Y159 PolarHBondContact O-N 3.46Å; Y159-D161 VanDerWaalsContact C-N 3.33Å; Y159-D161 PolarHBondContact O-N 2.97Å; Y159-M162 PolarHBondContact O-N 3.29Å; Y159-V163 WeakPolarHBondContact O-CB 3.31Å; Y159-V163 WeakPolarHBondContact O-CG2 3.49Å; Y159-V163 PolarHBondContact O-N 3.14Å |
| 160 | T | 76 | Confident | 78.4 | Confident | 85 Ų | 85 | 86.2 Ų | 86.2 | 52% | 0.521 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -64 | -38.9 | 176.1 | 49.1 | 0 | 0 | 0 | 0 | 111.8 | D156 L157 T164 | D156-T160 WeakPolarHBondContact O-CB 3.48Å; D156-T160 VanDerWaalsContact O-CG2 3.32Å; D156-T160 WeakPolarHBondContact O-CG2 3.25Å; D156-T160 PolarHBondContact O-N 2.91Å; D156-T160 PolarHBondContact O-OG1 3.33Å; L157-T160 WeakPolarHBondContact CA-OG1 3.18Å; L157-T160 PolarHBondContact O-N 2.88Å; L157-T160 PolarHBondContact O-OG1 2.95Å; T160-T164 WeakPolarHBondContact O-CB 3.32Å; T160-T164 VanDerWaalsContact O-CG2 3.26Å; T160-T164 WeakPolarHBondContact O-CG2 3.46Å; T160-T164 PolarHBondContact O-N 2.79Å; T160-T164 VanDerWaalsContact O-N 3.1Å; T160-T164 PolarHBondContact O-OG1 2.8Å |
| 161 | D | 76.9 | Confident | 78 | Confident | 73 Ų | 73 | 87.1 Ų | 87.1 | 39% | 0.39 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -70.4 | -41 | 175.5 | -176.7 | 57.7 | 0 | 0 | 0 | 112.7 | L157 Y159 T164 K165 | L157-D161 VanDerWaalsContact O-CB 3.28Å; L157-D161 WeakPolarHBondContact O-CB 3.25Å; L157-D161 PolarHBondContact O-N 2.96Å; Y159-D161 VanDerWaalsContact C-N 3.33Å; Y159-D161 PolarHBondContact O-N 2.97Å; D161-T164 WeakPolarHBondContact CA-OG1 3.21Å; D161-T164 PolarHBondContact O-OG1 3.24Å; D161-K165 WeakPolarHBondContact O-CB 3.36Å; D161-K165 VanDerWaalsContact O-CG 3.25Å; D161-K165 WeakPolarHBondContact O-CG 3.28Å; D161-K165 PolarHBondContact O-N 2.94Å; D161-K165 WeakPolarHBondContact OD1-CE 3.3Å; D161-K165 IonicContact OD1-NZ 3.13Å; D161-K165 PolarHBondContact OD1-NZ 2.98Å; D161-K165 VanDerWaalsContact OD2-CE 3.25Å; D161-K165 WeakPolarHBondContact OD2-CE 3.45Å; D161-K165 IonicContact OD2-NZ 3.84Å; D161-K165 PolarHBondContact OD2-NZ 2.94Å |
| 162 | M | 71.6 | Confident | 77.5 | Confident | 91 Ų | 91 | 90.1 Ų | 90.1 | 45% | 0.448 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -65 | -43.5 | 174.7 | -106.8 | -175.2 | -76.1 | 0 | 0 | 112.6 | V158 Y159 T164 K165 V166 | V158-M162 HydrophobicContact CG1-CE 3.3Å; V158-M162 WeakPolarHBondContact O-CB 3.24Å; V158-M162 PolarHBondContact O-N 3.21Å; Y159-M162 PolarHBondContact O-N 3.29Å; M162-T164 VanDerWaalsContact C-N 3.34Å; M162-K165 PolarHBondContact O-N 2.99Å; M162-V166 WeakPolarHBondContact O-CG2 3.34Å; M162-V166 PolarHBondContact O-N 2.91Å |
| 163 | V | 66.3 | Low | 77.3 | Confident | 84 Ų | 84 | 90 Ų | 90 | 51% | 0.509 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64.3 | -41.9 | -179.2 | 168.5 | 0 | 0 | 0 | 0 | 110.6 | Y159 Q167 | Y159-V163 WeakPolarHBondContact O-CB 3.31Å; Y159-V163 WeakPolarHBondContact O-CG2 3.49Å; Y159-V163 PolarHBondContact O-N 3.14Å; V163-Q167 PolarHBondContact O-N 2.89Å |
| 164 | T | 70.1 | Confident | 77.1 | Confident | 68 Ų | 68 | 91.8 Ų | 91.8 | 42% | 0.417 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -68 | -41.2 | 176.5 | 51 | 0 | 0 | 0 | 0 | 111.8 | T160 D161 M162 V166 Q167 Q168 | T160-T164 WeakPolarHBondContact O-CB 3.32Å; T160-T164 VanDerWaalsContact O-CG2 3.26Å; T160-T164 WeakPolarHBondContact O-CG2 3.46Å; T160-T164 PolarHBondContact O-N 2.79Å; T160-T164 VanDerWaalsContact O-N 3.1Å; T160-T164 PolarHBondContact O-OG1 2.8Å; D161-T164 WeakPolarHBondContact CA-OG1 3.21Å; D161-T164 PolarHBondContact O-OG1 3.24Å; M162-T164 VanDerWaalsContact C-N 3.34Å; T164-V166 PolarHBondContact O-N 3.16Å; T164-Q167 PolarHBondContact O-N 3.14Å; T164-Q168 WeakPolarHBondContact O-CB 3.33Å; T164-Q168 PolarHBondContact O-N 2.83Å |
| 165 | K | 71.5 | Confident | 77 | Confident | 115 Ų | 115 | 92.8 Ų | 92.8 | 50% | 0.5 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.7 | -42.2 | 175.1 | -76.3 | 171.6 | 177.3 | 168.6 | 0 | 113.1 | D161 M162 Q169 | D161-K165 WeakPolarHBondContact O-CB 3.36Å; D161-K165 VanDerWaalsContact O-CG 3.25Å; D161-K165 WeakPolarHBondContact O-CG 3.28Å; D161-K165 PolarHBondContact O-N 2.94Å; D161-K165 WeakPolarHBondContact OD1-CE 3.3Å; D161-K165 IonicContact OD1-NZ 3.13Å; D161-K165 PolarHBondContact OD1-NZ 2.98Å; D161-K165 VanDerWaalsContact OD2-CE 3.25Å; D161-K165 WeakPolarHBondContact OD2-CE 3.45Å; D161-K165 IonicContact OD2-NZ 3.84Å; D161-K165 PolarHBondContact OD2-NZ 2.94Å; M162-K165 PolarHBondContact O-N 2.99Å; K165-Q169 WeakPolarHBondContact O-CB 3.27Å; K165-Q169 PolarHBondContact O-N 3.43Å |
| 166 | V | 73.8 | Confident | 77.3 | Confident | 94 Ų | 94 | 93.8 Ų | 93.8 | 57% | 0.57 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -66.3 | -47.9 | 178.1 | 172.1 | 0 | 0 | 0 | 0 | 111 | M162 T164 Q168 Q169 E170 | M162-V166 WeakPolarHBondContact O-CG2 3.34Å; M162-V166 PolarHBondContact O-N 2.91Å; T164-V166 PolarHBondContact O-N 3.16Å; V166-Q168 PolarHBondContact O-N 2.97Å; V166-Q169 PolarHBondContact O-N 3.49Å; V166-E170 PolarHBondContact O-N 2.94Å |
| 167 | Q | 72.8 | Confident | 77.5 | Confident | 115 Ų | 115 | 93.1 Ų | 93.1 | 54% | 0.537 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.3 | -41.6 | 176.1 | -81.2 | -179.9 | -29.6 | 0 | 0 | 112.4 | V163 T164 Q169 E170 I171 | V163-Q167 PolarHBondContact O-N 2.89Å; T164-Q167 PolarHBondContact O-N 3.14Å; Q167-Q169 VanDerWaalsContact C-N 3.33Å; Q167-Q169 PolarHBondContact O-N 2.99Å; Q167-E170 PolarHBondContact O-N 3.23Å; Q167-I171 WeakPolarHBondContact O-CD1 3.37Å; Q167-I171 VanDerWaalsContact O-CG1 3.25Å; Q167-I171 WeakPolarHBondContact O-CG1 3.29Å; Q167-I171 PolarHBondContact O-N 3.39Å |
| 168 | Q | 71.9 | Confident | 77.8 | Confident | 134 Ų | 134 | 91.2 Ų | 91.2 | 63% | 0.626 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -69.1 | -34.1 | -179.6 | -164.2 | 170.5 | 9.8 | 0 | 0 | 111.6 | T164 V166 M172 | T164-Q168 WeakPolarHBondContact O-CB 3.33Å; T164-Q168 PolarHBondContact O-N 2.83Å; V166-Q168 PolarHBondContact O-N 2.97Å; Q168-M172 VanDerWaalsContact O-CB 3.27Å; Q168-M172 WeakPolarHBondContact O-CB 3.03Å; Q168-M172 PolarHBondContact O-N 3.45Å |
| 169 | Q | 74.8 | Confident | 78.3 | Confident | 129 Ų | 129 | 94.6 Ų | 94.6 | 60% | 0.603 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -66.3 | -39.3 | 172.1 | -173.1 | 170.6 | -4.5 | 0 | 0 | 111.9 | K165 V166 Q167 L173 | K165-Q169 WeakPolarHBondContact O-CB 3.27Å; K165-Q169 PolarHBondContact O-N 3.43Å; V166-Q169 PolarHBondContact O-N 3.49Å; Q167-Q169 VanDerWaalsContact C-N 3.33Å; Q167-Q169 PolarHBondContact O-N 2.99Å; Q169-L173 WeakPolarHBondContact O-CB 3.25Å; Q169-L173 PolarHBondContact O-N 3.44Å |
| 170 | E | 78.6 | Confident | 79 | Confident | 70 Ų | 70 | 96.1 Ų | 96.1 | 33% | 0.327 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.9 | -45.8 | 174.5 | -172.2 | 175.4 | -179.1 | 0 | 0 | 112 | V166 Q167 M172 L173 Q174 | V166-E170 PolarHBondContact O-N 2.94Å; Q167-E170 PolarHBondContact O-N 3.23Å; E170-M172 VanDerWaalsContact C-N 3.34Å; E170-M172 PolarHBondContact O-N 3.48Å; E170-L173 PolarHBondContact O-N 2.91Å; E170-Q174 WeakPolarHBondContact O-CG 3.4Å; E170-Q174 PolarHBondContact O-N 3.14Å |
| 171 | I | 80.3 | Confident | 79.7 | Confident | 92 Ų | 92 | 94.9 Ų | 94.9 | 47% | 0.472 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.5 | -43.9 | 176.9 | -66.6 | 162.2 | 0 | 0 | 0 | 110.7 | Q167 L173 Q174 Q175 | Q167-I171 WeakPolarHBondContact O-CD1 3.37Å; Q167-I171 VanDerWaalsContact O-CG1 3.25Å; Q167-I171 WeakPolarHBondContact O-CG1 3.29Å; Q167-I171 PolarHBondContact O-N 3.39Å; I171-L173 VanDerWaalsContact C-N 3.32Å; I171-L173 PolarHBondContact O-N 3.34Å; I171-Q174 PolarHBondContact O-N 3.3Å; I171-Q175 WeakPolarHBondContact O-CB 3.28Å; I171-Q175 WeakPolarHBondContact O-CG 3.42Å; I171-Q175 PolarHBondContact O-N 3.43Å |
| 172 | M | 74.9 | Confident | 80.5 | Confident | 109 Ų | 109 | 93.7 Ų | 93.7 | 54% | 0.537 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.5 | -42 | 176.1 | -178.6 | -177.6 | 62.6 | 0 | 0 | 111.2 | Q168 E170 Q175 V176 | Q168-M172 VanDerWaalsContact O-CB 3.27Å; Q168-M172 WeakPolarHBondContact O-CB 3.03Å; Q168-M172 PolarHBondContact O-N 3.45Å; E170-M172 VanDerWaalsContact C-N 3.34Å; E170-M172 PolarHBondContact O-N 3.48Å; M172-Q175 PolarHBondContact O-N 3.36Å; M172-V176 WeakPolarHBondContact O-CG2 3.36Å; M172-V176 PolarHBondContact O-N 3.48Å |
| 173 | L | 81.7 | Confident | 81.6 | Confident | 79 Ų | 79 | 94.1 Ų | 94.1 | 41% | 0.414 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.6 | -43.9 | 177.4 | -174 | 137.2 | 0 | 0 | 0 | 111.4 | L107 Q169 E170 I171 Q175 V176 M177 | L107-L173 HydrophobicContact CD2-CD2 4.13Å; Q169-L173 WeakPolarHBondContact O-CB 3.25Å; Q169-L173 PolarHBondContact O-N 3.44Å; E170-L173 PolarHBondContact O-N 2.91Å; I171-L173 VanDerWaalsContact C-N 3.32Å; I171-L173 PolarHBondContact O-N 3.34Å; L173-Q175 VanDerWaalsContact C-N 3.32Å; L173-Q175 PolarHBondContact O-N 2.86Å; L173-V176 PolarHBondContact O-N 2.9Å; L173-M177 HydrophobicContact CD2-CG 4.21Å; L173-M177 VanDerWaalsContact O-CG 3.27Å; L173-M177 WeakPolarHBondContact O-CG 3.05Å; L173-M177 PolarHBondContact O-N 2.97Å |
| 174 | Q | 84.8 | Confident | 82.8 | Confident | 106 Ų | 106 | 95.1 Ų | 95.1 | 50% | 0.495 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.2 | -39.9 | 174.1 | -72 | -177.9 | 0.2 | 0 | 0 | 112.1 | E170 I171 M177 S178 | E170-Q174 WeakPolarHBondContact O-CG 3.4Å; E170-Q174 PolarHBondContact O-N 3.14Å; I171-Q174 PolarHBondContact O-N 3.3Å; Q174-M177 PolarHBondContact O-N 3.27Å; Q174-S178 PolarHBondContact O-N 2.94Å; Q174-S178 PolarHBondContact O-OG 2.92Å |
| 175 | Q | 83.4 | Confident | 83.9 | Confident | 109 Ų | 109 | 98.2 Ų | 98.2 | 51% | 0.509 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.1 | -38.2 | 174.4 | -77.2 | -177.7 | -12.1 | 0 | 0 | 112.9 | I171 M172 L173 S178 K179 | I171-Q175 WeakPolarHBondContact O-CB 3.28Å; I171-Q175 WeakPolarHBondContact O-CG 3.42Å; I171-Q175 PolarHBondContact O-N 3.43Å; M172-Q175 PolarHBondContact O-N 3.36Å; L173-Q175 VanDerWaalsContact C-N 3.32Å; L173-Q175 PolarHBondContact O-N 2.86Å; Q175-S178 PolarHBondContact O-OG 3.32Å; Q175-K179 VanDerWaalsContact O-CG 3.3Å; Q175-K179 WeakPolarHBondContact O-CG 3.41Å; Q175-K179 PolarHBondContact O-N 3.13Å; Q175-K179 VanDerWaalsContact O-N 3.16Å |
| 176 | V | 87.3 | Confident | 84.9 | Confident | 70 Ų | 70 | 97.3 Ų | 97.3 | 42% | 0.424 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.9 | -42.6 | 174.7 | 170.3 | 0 | 0 | 0 | 0 | 110.1 | M172 L173 S178 K179 I180 | M172-V176 WeakPolarHBondContact O-CG2 3.36Å; M172-V176 PolarHBondContact O-N 3.48Å; L173-V176 PolarHBondContact O-N 2.9Å; V176-S178 PolarHBondContact O-N 3.33Å; V176-K179 PolarHBondContact O-N 3.33Å; V176-I180 HydrophobicContact CG1-CD1 3.8Å; V176-I180 HydrophobicContact CG1-CG1 4.45Å; V176-I180 VanDerWaalsContact O-CG1 3.29Å; V176-I180 WeakPolarHBondContact O-CG1 3.28Å; V176-I180 PolarHBondContact O-N 3.11Å |
| 177 | M | 87.3 | Confident | 85.7 | Confident | 90 Ų | 90 | 97.4 Ų | 97.4 | 44% | 0.443 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.3 | -39.9 | 178.2 | -69.6 | -61.9 | 148.3 | 0 | 0 | 112.5 | L173 Q174 I180 A181 | L173-M177 HydrophobicContact CD2-CG 4.21Å; L173-M177 VanDerWaalsContact O-CG 3.27Å; L173-M177 WeakPolarHBondContact O-CG 3.05Å; L173-M177 PolarHBondContact O-N 2.97Å; Q174-M177 PolarHBondContact O-N 3.27Å; M177-I180 HydrophobicContact CE-CD1 4.36Å; M177-I180 PolarHBondContact O-N 2.85Å; M177-I180 HydrophobicContact SD-CD1 4.27Å; M177-A181 WeakPolarHBondContact O-CB 3.42Å; M177-A181 PolarHBondContact O-N 3.22Å |
| 178 | S | 89.4 | Confident | 86.5 | Confident | 73 Ų | 73 | 95 Ų | 95 | 51% | 0.51 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.9 | -38.6 | 176 | 70.7 | 0 | 0 | 0 | 0 | 112.2 | Q174 Q175 V176 A181 A182 | Q174-S178 PolarHBondContact O-N 2.94Å; Q174-S178 PolarHBondContact O-OG 2.92Å; Q175-S178 PolarHBondContact O-OG 3.32Å; V176-S178 PolarHBondContact O-N 3.33Å; S178-A181 WeakPolarHBondContact O-CB 3.3Å; S178-A181 PolarHBondContact O-N 3.25Å; S178-A182 PolarHBondContact O-N 3.21Å |
| 179 | K | 92.4 | Very high | 87.3 | Confident | 140 Ų | 140 | 92.4 Ų | 92.4 | 61% | 0.609 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -63.5 | -43 | 172.9 | -72.9 | 174.2 | -178.2 | 178.6 | 0 | 112 | Q175 V176 A181 A182 V183 | Q175-K179 VanDerWaalsContact O-CG 3.3Å; Q175-K179 WeakPolarHBondContact O-CG 3.41Å; Q175-K179 PolarHBondContact O-N 3.13Å; Q175-K179 VanDerWaalsContact O-N 3.16Å; V176-K179 PolarHBondContact O-N 3.33Å; K179-A181 VanDerWaalsContact C-N 3.3Å; K179-A181 PolarHBondContact O-N 3.03Å; K179-A182 PolarHBondContact O-N 2.75Å; K179-V183 WeakPolarHBondContact O-CG2 3.37Å; K179-V183 PolarHBondContact O-N 3.22Å |
| 180 | I | 92.9 | Very high | 87.9 | Confident | 93 Ų | 93 | 90.9 Ų | 90.9 | 48% | 0.477 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.7 | -41.6 | 174.8 | -67.8 | 165.4 | 0 | 0 | 0 | 110.3 | V176 M177 V183 K184 | V176-I180 HydrophobicContact CG1-CD1 3.8Å; V176-I180 HydrophobicContact CG1-CG1 4.45Å; V176-I180 VanDerWaalsContact O-CG1 3.29Å; V176-I180 WeakPolarHBondContact O-CG1 3.28Å; V176-I180 PolarHBondContact O-N 3.11Å; M177-I180 HydrophobicContact CE-CD1 4.36Å; M177-I180 PolarHBondContact O-N 2.85Å; M177-I180 HydrophobicContact SD-CD1 4.27Å; I180-V183 PolarHBondContact O-N 2.86Å; I180-K184 WeakPolarHBondContact O-CB 3.48Å; I180-K184 PolarHBondContact O-N 3.04Å |
| 181 | A | 91.4 | Very high | 88.1 | Confident | 58 Ų | 58 | 91.4 Ų | 91.4 | 48% | 0.479 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.8 | -39.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | M177 S178 K179 K184 K185 | M177-A181 WeakPolarHBondContact O-CB 3.42Å; M177-A181 PolarHBondContact O-N 3.22Å; S178-A181 WeakPolarHBondContact O-CB 3.3Å; S178-A181 PolarHBondContact O-N 3.25Å; K179-A181 VanDerWaalsContact C-N 3.3Å; K179-A181 PolarHBondContact O-N 3.03Å; A181-K184 PolarHBondContact O-N 3.46Å; A181-K185 PolarHBondContact O-N 3.4Å |
| 182 | A | 93.1 | Very high | 88.5 | Confident | 49 Ų | 49 | 94.3 Ų | 94.3 | 41% | 0.405 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.2 | -50.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | S178 K179 K184 K185 D186 | S178-A182 PolarHBondContact O-N 3.21Å; K179-A182 PolarHBondContact O-N 2.75Å; A182-K184 VanDerWaalsContact C-N 3.25Å; A182-K184 PolarHBondContact O-N 3.22Å; A182-K185 WeakPolarHBondContact O-CB 3.21Å; A182-K185 PolarHBondContact O-N 3.4Å; A182-D186 PolarHBondContact O-N 3.49Å |
| 183 | V | 93.9 | Very high | 89.1 | Confident | 99 Ų | 99 | 92.3 Ų | 92.3 | 60% | 0.6 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -58.4 | -39.3 | 176.9 | 172.3 | 0 | 0 | 0 | 0 | 111.4 | K179 I180 D186 M187 | K179-V183 WeakPolarHBondContact O-CG2 3.37Å; K179-V183 PolarHBondContact O-N 3.22Å; I180-V183 PolarHBondContact O-N 2.86Å; V183-D186 PolarHBondContact O-N 2.96Å; V183-M187 WeakPolarHBondContact O-CB 3.36Å; V183-M187 PolarHBondContact O-N 2.88Å |
| 184 | K | 93.3 | Very high | 89.2 | Confident | 106 Ų | 106 | 93.8 Ų | 93.8 | 46% | 0.461 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.7 | -41.8 | 176 | -177.7 | -179.5 | 177.1 | -177.3 | 0 | 112.2 | I180 A181 A182 D186 M187 I188 | I180-K184 WeakPolarHBondContact O-CB 3.48Å; I180-K184 PolarHBondContact O-N 3.04Å; A181-K184 PolarHBondContact O-N 3.46Å; A182-K184 VanDerWaalsContact C-N 3.25Å; A182-K184 PolarHBondContact O-N 3.22Å; K184-D186 VanDerWaalsContact C-N 3.34Å; K184-M187 PolarHBondContact O-N 2.94Å; K184-I188 HydrophobicContact CG-CD1 4.11Å; K184-I188 VanDerWaalsContact O-CG1 3.3Å; K184-I188 WeakPolarHBondContact O-CG1 3.35Å; K184-I188 PolarHBondContact O-N 3.33Å |
| 185 | K | 92.5 | Very high | 89.4 | Confident | 132 Ų | 132 | 94.6 Ų | 94.6 | 57% | 0.574 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -61.3 | -46.1 | 175.1 | 172.5 | -172.7 | 149.4 | 75 | 0 | 110.2 | A181 A182 M187 I188 I189 | A181-K185 PolarHBondContact O-N 3.4Å; A182-K185 WeakPolarHBondContact O-CB 3.21Å; A182-K185 PolarHBondContact O-N 3.4Å; K185-M187 VanDerWaalsContact C-N 3.34Å; K185-M187 PolarHBondContact O-N 2.93Å; K185-I188 PolarHBondContact O-N 2.93Å; K185-I189 HydrophobicContact CD-CD1 4.41Å; K185-I189 HydrophobicContact CG-CD1 3.76Å; K185-I189 HydrophobicContact CG-CG1 4.49Å; K185-I189 VanDerWaalsContact O-CG1 3.28Å; K185-I189 WeakPolarHBondContact O-CG1 3.5Å; K185-I189 PolarHBondContact O-N 3.43Å |
| 186 | D | 91.6 | Very high | 89.6 | Confident | 96 Ų | 96 | 92.5 Ų | 92.5 | 51% | 0.513 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.8 | -41 | -179.8 | -64.6 | -17.5 | 0 | 0 | 0 | 111.4 | A182 V183 K184 I188 I189 L190 | A182-D186 PolarHBondContact O-N 3.49Å; V183-D186 PolarHBondContact O-N 2.96Å; K184-D186 VanDerWaalsContact C-N 3.34Å; D186-I188 PolarHBondContact O-N 3.24Å; D186-I189 PolarHBondContact O-N 2.94Å; D186-L190 WeakPolarHBondContact O-CB 3.13Å; D186-L190 PolarHBondContact O-N 3.01Å |
| 187 | M | 92 | Very high | 89.9 | Confident | 96 Ų | 96 | 92.2 Ų | 92.2 | 47% | 0.473 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59.2 | -46.6 | 173.5 | -174.9 | 173.9 | 114.6 | 0 | 0 | 112.1 | V183 K184 K185 I189 L190 E191 | V183-M187 WeakPolarHBondContact O-CB 3.36Å; V183-M187 PolarHBondContact O-N 2.88Å; K184-M187 PolarHBondContact O-N 2.94Å; K185-M187 VanDerWaalsContact C-N 3.34Å; K185-M187 PolarHBondContact O-N 2.93Å; M187-I189 VanDerWaalsContact C-N 3.31Å; M187-I189 PolarHBondContact O-N 3.36Å; M187-L190 PolarHBondContact O-N 2.86Å; M187-E191 HydrophobicContact CG-CG 4.45Å; M187-E191 WeakPolarHBondContact O-CB 3.36Å; M187-E191 WeakPolarHBondContact O-CG 3.44Å; M187-E191 PolarHBondContact O-N 3.2Å |
| 188 | I | 88.8 | Confident | 90.1 | Very high | 66 Ų | 66 | 92.8 Ų | 92.8 | 34% | 0.338 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.3 | -38 | 178.1 | -67.4 | 166.6 | 0 | 0 | 0 | 111.1 | K184 K185 D186 K192 | K184-I188 HydrophobicContact CG-CD1 4.11Å; K184-I188 VanDerWaalsContact O-CG1 3.3Å; K184-I188 WeakPolarHBondContact O-CG1 3.35Å; K184-I188 PolarHBondContact O-N 3.33Å; K185-I188 PolarHBondContact O-N 2.93Å; D186-I188 PolarHBondContact O-N 3.24Å; I188-K192 HydrophobicContact CG2-CD 3.93Å; I188-K192 HydrophobicContact CG2-CG 4.38Å; I188-K192 VanDerWaalsContact O-CB 3.28Å; I188-K192 WeakPolarHBondContact O-CB 3.45Å; I188-K192 WeakPolarHBondContact O-CG 3.39Å; I188-K192 PolarHBondContact O-N 3.28Å |
| 189 | I | 89.1 | Confident | 90.2 | Very high | 79 Ų | 79 | 93.3 Ų | 93.3 | 41% | 0.405 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66 | -45.4 | 176.6 | -68.4 | 165.5 | 0 | 0 | 0 | 110.2 | K185 D186 M187 K192 S193 | K185-I189 HydrophobicContact CD-CD1 4.41Å; K185-I189 HydrophobicContact CG-CD1 3.76Å; K185-I189 HydrophobicContact CG-CG1 4.49Å; K185-I189 VanDerWaalsContact O-CG1 3.28Å; K185-I189 WeakPolarHBondContact O-CG1 3.5Å; K185-I189 PolarHBondContact O-N 3.43Å; D186-I189 PolarHBondContact O-N 2.94Å; M187-I189 VanDerWaalsContact C-N 3.31Å; M187-I189 PolarHBondContact O-N 3.36Å; I189-K192 PolarHBondContact O-N 3.39Å; I189-S193 WeakPolarHBondContact O-CA 3.45Å; I189-S193 WeakPolarHBondContact O-CB 3.4Å; I189-S193 PolarHBondContact O-N 3.32Å |
| 190 | L | 86.9 | Confident | 90.3 | Very high | 96 Ų | 96 | 90.4 Ų | 90.4 | 50% | 0.503 | 48% | 0.481 | S | S | . | . | I | π-helix | trans | -60.8 | -48.9 | 177.8 | -154.2 | 83.5 | 0 | 0 | 0 | 111 | D186 M187 K192 E194 F195 | D186-L190 WeakPolarHBondContact O-CB 3.13Å; D186-L190 PolarHBondContact O-N 3.01Å; M187-L190 PolarHBondContact O-N 2.86Å; L190-K192 PolarHBondContact O-N 2.96Å; L190-E194 HydrophobicContact CD1-CG 4.25Å; L190-E194 WeakPolarHBondContact CD1-OE1 3.3Å; L190-E194 WeakPolarHBondContact CD1-OE2 3.44Å; L190-E194 WeakPolarHBondContact O-CB 3.32Å; L190-E194 PolarHBondContact O-N 3.03Å; L190-E194 VanDerWaalsContact O-N 3.14Å; L190-F195 PolarHBondContact O-N 3.15Å |
| 191 | E | 83.1 | Confident | 90.4 | Very high | 81 Ų | 81 | 90.7 Ų | 90.7 | 38% | 0.379 | 48% | 0.48 | S | S | . | . | I | π-helix | trans | -64.7 | -35.5 | 179.4 | -75.6 | -179.9 | 176.4 | 0 | 0 | 112.8 | M187 F195 | M187-E191 HydrophobicContact CG-CG 4.45Å; M187-E191 WeakPolarHBondContact O-CB 3.36Å; M187-E191 WeakPolarHBondContact O-CG 3.44Å; M187-E191 PolarHBondContact O-N 3.2Å; E191-F195 WeakPolarHBondContact O-CB 3.33Å |
| 192 | K | 87.8 | Confident | 90.7 | Very high | 154 Ų | 154 | 93 Ų | 93 | 67% | 0.67 | 49% | 0.485 | S | S | * | . | I | π-helix | trans | -88.7 | -42.8 | -178.4 | -71.4 | -173.7 | 176 | -177.1 | 0 | 113.2 | I188 I189 L190 S196 | I188-K192 HydrophobicContact CG2-CD 3.93Å; I188-K192 HydrophobicContact CG2-CG 4.38Å; I188-K192 VanDerWaalsContact O-CB 3.28Å; I188-K192 WeakPolarHBondContact O-CB 3.45Å; I188-K192 WeakPolarHBondContact O-CG 3.39Å; I188-K192 PolarHBondContact O-N 3.28Å; I189-K192 PolarHBondContact O-N 3.39Å; L190-K192 PolarHBondContact O-N 2.96Å; K192-S196 WeakPolarHBondContact O-CB 3.12Å |
| 193 | S | 87.7 | Confident | 90.8 | Very high | 67 Ų | 67 | 96.7 Ų | 96.7 | 47% | 0.469 | 49% | 0.494 | S | S | . | . | I | π-helix | trans | -83.1 | -56.3 | -173.4 | -173.5 | 0 | 0 | 0 | 0 | 111.4 | I189 T197 | I189-S193 WeakPolarHBondContact O-CA 3.45Å; I189-S193 WeakPolarHBondContact O-CB 3.4Å; I189-S193 PolarHBondContact O-N 3.32Å; S193-T197 WeakPolarHBondContact O-CB 3.48Å; S193-T197 PolarHBondContact O-N 3.47Å; S193-T197 VanDerWaalsContact O-N 3.11Å; S193-T197 PolarHBondContact O-OG1 2.88Å |
| 194 | E | 83.8 | Confident | 91 | Very high | 110 Ų | 110 | 98.1 Ų | 98.1 | 51% | 0.514 | 49% | 0.492 | S | S | . | . | I | π-helix | trans | -75.8 | -42.6 | -172.1 | -60.8 | -171.2 | 176.2 | 0 | 0 | 111.1 | L190 S196 T197 L198 | L190-E194 HydrophobicContact CD1-CG 4.25Å; L190-E194 WeakPolarHBondContact CD1-OE1 3.3Å; L190-E194 WeakPolarHBondContact CD1-OE2 3.44Å; L190-E194 WeakPolarHBondContact O-CB 3.32Å; L190-E194 PolarHBondContact O-N 3.03Å; L190-E194 VanDerWaalsContact O-N 3.14Å; E194-S196 PolarHBondContact O-N 3.41Å; E194-T197 PolarHBondContact O-N 2.91Å; E194-L198 WeakPolarHBondContact O-CB 3.34Å; E194-L198 WeakPolarHBondContact O-CG 3.37Å; E194-L198 PolarHBondContact O-N 2.89Å |
| 195 | F | 89.3 | Confident | 91.2 | Very high | 122 Ų | 122 | 98.1 Ų | 98.1 | 54% | 0.535 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.9 | -41.4 | 177.8 | -165.7 | -107.4 | 0 | 0 | 0 | 112.1 | L190 E191 T197 L198 L199 | L190-F195 PolarHBondContact O-N 3.15Å; E191-F195 WeakPolarHBondContact O-CB 3.33Å; F195-T197 VanDerWaalsContact C-N 3.3Å; F195-T197 PolarHBondContact O-N 3.45Å; F195-L198 PolarHBondContact O-N 2.9Å; F195-L199 HydrophobicContact CD1-CD1 3.85Å; F195-L199 HydrophobicContact CD1-CG 4.16Å; F195-L199 HydrophobicContact CE1-CD1 3.53Å; F195-L199 HydrophobicContact CE1-CD2 4.32Å; F195-L199 HydrophobicContact CE1-CG 3.95Å; F195-L199 HydrophobicContact CZ-CD1 4.27Å; F195-L199 HydrophobicContact CZ-CD2 4.25Å; F195-L199 HydrophobicContact CZ-CG 4.31Å; F195-L199 WeakPolarHBondContact O-CB 3.42Å; F195-L199 WeakPolarHBondContact O-CG 3.4Å; F195-L199 PolarHBondContact O-N 2.92Å |
| 196 | S | 88.4 | Confident | 91.5 | Very high | 66 Ų | 66 | 98.1 Ų | 98.1 | 46% | 0.462 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64 | -38 | 176 | -174.2 | 0 | 0 | 0 | 0 | 111.7 | K192 E194 T200 | K192-S196 WeakPolarHBondContact O-CB 3.12Å; E194-S196 PolarHBondContact O-N 3.41Å; S196-T200 WeakPolarHBondContact O-CG2 3.47Å; S196-T200 PolarHBondContact O-N 3.12Å; S196-T200 VanDerWaalsContact O-N 3.13Å; S196-T200 PolarHBondContact O-OG1 3.12Å |
| 197 | T | 92.7 | Very high | 91.8 | Very high | 63 Ų | 63 | 98.8 Ų | 98.8 | 39% | 0.387 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.4 | -44.9 | 176.9 | -55.9 | 0 | 0 | 0 | 0 | 110.7 | S193 E194 F195 L199 T200 E201 | S193-T197 WeakPolarHBondContact O-CB 3.48Å; S193-T197 PolarHBondContact O-N 3.47Å; S193-T197 VanDerWaalsContact O-N 3.11Å; S193-T197 PolarHBondContact O-OG1 2.88Å; E194-T197 PolarHBondContact O-N 2.91Å; F195-T197 VanDerWaalsContact C-N 3.3Å; F195-T197 PolarHBondContact O-N 3.45Å; T197-L199 VanDerWaalsContact C-N 3.32Å; T197-L199 PolarHBondContact O-N 3.18Å; T197-T200 PolarHBondContact O-N 2.94Å; T197-T200 PolarHBondContact O-OG1 3.3Å; T197-E201 HydrophobicContact CG2-CG 4.45Å; T197-E201 WeakPolarHBondContact O-CB 3.4Å; T197-E201 WeakPolarHBondContact O-CG 3.44Å; T197-E201 PolarHBondContact O-N 3.46Å |
| 198 | L | 91.8 | Very high | 92 | Very high | 102 Ų | 102 | 98.5 Ų | 98.5 | 53% | 0.534 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.9 | -37.7 | 176.9 | -71.8 | 175.3 | 0 | 0 | 0 | 112.4 | E194 F195 N202 | E194-L198 WeakPolarHBondContact O-CB 3.34Å; E194-L198 WeakPolarHBondContact O-CG 3.37Å; E194-L198 PolarHBondContact O-N 2.89Å; F195-L198 PolarHBondContact O-N 2.9Å; L198-N202 VanDerWaalsContact O-CB 3.25Å; L198-N202 WeakPolarHBondContact O-CB 3.4Å; L198-N202 PolarHBondContact O-N 3.48Å |
| 199 | L | 91.6 | Very high | 92.5 | Very high | 85 Ų | 85 | 99.6 Ų | 99.6 | 45% | 0.445 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.6 | -47.2 | 175.8 | -75.1 | -175.5 | 0 | 0 | 0 | 112 | F195 T197 E201 N202 E203 | F195-L199 HydrophobicContact CD1-CD1 3.85Å; F195-L199 HydrophobicContact CD1-CG 4.16Å; F195-L199 HydrophobicContact CE1-CD1 3.53Å; F195-L199 HydrophobicContact CE1-CD2 4.32Å; F195-L199 HydrophobicContact CE1-CG 3.95Å; F195-L199 HydrophobicContact CZ-CD1 4.27Å; F195-L199 HydrophobicContact CZ-CD2 4.25Å; F195-L199 HydrophobicContact CZ-CG 4.31Å; F195-L199 WeakPolarHBondContact O-CB 3.42Å; F195-L199 WeakPolarHBondContact O-CG 3.4Å; F195-L199 PolarHBondContact O-N 2.92Å; T197-L199 VanDerWaalsContact C-N 3.32Å; T197-L199 PolarHBondContact O-N 3.18Å; L199-E201 VanDerWaalsContact C-N 3.34Å; L199-E201 PolarHBondContact O-N 2.8Å; L199-N202 PolarHBondContact O-N 2.92Å; L199-E203 WeakPolarHBondContact O-CG 3.17Å; L199-E203 PolarHBondContact O-N 3.46Å |
| 200 | T | 95.3 | Very high | 92.9 | Very high | 78 Ų | 78 | 100.4 Ų | 100.4 | 48% | 0.479 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66 | -38.1 | 179.1 | 59 | 0 | 0 | 0 | 0 | 111.8 | S196 T197 E203 K204 | S196-T200 WeakPolarHBondContact O-CG2 3.47Å; S196-T200 PolarHBondContact O-N 3.12Å; S196-T200 VanDerWaalsContact O-N 3.13Å; S196-T200 PolarHBondContact O-OG1 3.12Å; T197-T200 PolarHBondContact O-N 2.94Å; T197-T200 PolarHBondContact O-OG1 3.3Å; T200-E203 PolarHBondContact O-N 3.35Å; T200-K204 VanDerWaalsContact O-CB 3.3Å; T200-K204 WeakPolarHBondContact O-CB 3.25Å; T200-K204 PolarHBondContact O-N 3.49Å |
| 201 | E | 95.6 | Very high | 93.4 | Very high | 100 Ų | 100 | 101.1 Ų | 101.1 | 47% | 0.467 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.9 | -42 | 172.7 | -74.3 | -178.8 | 177 | 0 | 0 | 112 | T197 L199 K204 L205 | T197-E201 HydrophobicContact CG2-CG 4.45Å; T197-E201 WeakPolarHBondContact O-CB 3.4Å; T197-E201 WeakPolarHBondContact O-CG 3.44Å; T197-E201 PolarHBondContact O-N 3.46Å; L199-E201 VanDerWaalsContact C-N 3.34Å; L199-E201 PolarHBondContact O-N 2.8Å; E201-K204 PolarHBondContact O-N 2.81Å; E201-L205 WeakPolarHBondContact O-CB 3.32Å; E201-L205 VanDerWaalsContact O-CG 3.3Å; E201-L205 WeakPolarHBondContact O-CG 3.3Å; E201-L205 PolarHBondContact O-N 3.33Å |
| 202 | N | 95.8 | Very high | 94.1 | Very high | 107 Ų | 107 | 102.5 Ų | 102.5 | 57% | 0.572 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.9 | -43.7 | 177.7 | -157.2 | -81.2 | 0 | 0 | 0 | 111.7 | L198 L199 L205 K206 | L198-N202 VanDerWaalsContact O-CB 3.25Å; L198-N202 WeakPolarHBondContact O-CB 3.4Å; L198-N202 PolarHBondContact O-N 3.48Å; L199-N202 PolarHBondContact O-N 2.92Å; N202-L205 PolarHBondContact O-N 2.9Å; N202-K206 WeakPolarHBondContact O-CB 3.45Å; N202-K206 PolarHBondContact O-N 2.75Å |
| 203 | E | 96.5 | Very high | 94.6 | Very high | 126 Ų | 126 | 100.6 Ų | 100.6 | 59% | 0.589 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.9 | -44.6 | 174.4 | -74 | -178.8 | 175.8 | 0 | 0 | 111.8 | L199 T200 K206 I207 | L199-E203 WeakPolarHBondContact O-CG 3.17Å; L199-E203 PolarHBondContact O-N 3.46Å; T200-E203 PolarHBondContact O-N 3.35Å; E203-K206 WeakPolarHBondContact O-CB 3.42Å; E203-K206 PolarHBondContact O-N 3.11Å; E203-I207 WeakPolarHBondContact O-CG1 3.41Å; E203-I207 PolarHBondContact O-N 2.99Å |
| 204 | K | 97.8 | Very high | 95.1 | Very high | 128 Ų | 128 | 102.4 Ų | 102.4 | 56% | 0.557 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -59.5 | -47.9 | 175.6 | -179 | -178.1 | 177.2 | -176.3 | 0 | 111.7 | T200 E201 K206 I207 Q208 | T200-K204 VanDerWaalsContact O-CB 3.3Å; T200-K204 WeakPolarHBondContact O-CB 3.25Å; T200-K204 PolarHBondContact O-N 3.49Å; E201-K204 PolarHBondContact O-N 2.81Å; K204-K206 VanDerWaalsContact C-N 3.28Å; K204-K206 PolarHBondContact O-N 2.99Å; K204-I207 PolarHBondContact O-N 3.29Å; K204-Q208 WeakPolarHBondContact O-CG 3.41Å; K204-Q208 PolarHBondContact O-N 3.28Å |
| 205 | L | 97.8 | Very high | 95.8 | Very high | 106 Ų | 106 | 101.9 Ų | 101.9 | 56% | 0.555 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.8 | -39.3 | 177.1 | -74.1 | 173.8 | 0 | 0 | 0 | 111.4 | E201 N202 Q208 L209 | E201-L205 WeakPolarHBondContact O-CB 3.32Å; E201-L205 VanDerWaalsContact O-CG 3.3Å; E201-L205 WeakPolarHBondContact O-CG 3.3Å; E201-L205 PolarHBondContact O-N 3.33Å; N202-L205 PolarHBondContact O-N 2.9Å; L205-Q208 PolarHBondContact O-N 2.9Å; L205-L209 VanDerWaalsContact O-CB 3.27Å; L205-L209 WeakPolarHBondContact O-CB 3.49Å; L205-L209 PolarHBondContact O-N 2.86Å |
| 206 | K | 97.6 | Very high | 96.2 | Very high | 132 Ų | 132 | 101.4 Ų | 101.4 | 57% | 0.574 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.9 | -42.8 | 175.9 | -173.2 | 178.2 | 178.7 | -178.5 | 0 | 111.8 | N202 E203 K204 L209 L210 | N202-K206 WeakPolarHBondContact O-CB 3.45Å; N202-K206 PolarHBondContact O-N 2.75Å; E203-K206 WeakPolarHBondContact O-CB 3.42Å; E203-K206 PolarHBondContact O-N 3.11Å; K204-K206 VanDerWaalsContact C-N 3.28Å; K204-K206 PolarHBondContact O-N 2.99Å; K206-L209 PolarHBondContact O-N 3.07Å; K206-L210 WeakPolarHBondContact O-CG 3.27Å; K206-L210 PolarHBondContact O-N 3.47Å |
| 207 | I | 97.9 | Very high | 96.7 | Very high | 111 Ų | 111 | 100.5 Ų | 100.5 | 57% | 0.569 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.9 | -48.1 | 176 | -66.3 | 165.6 | 0 | 0 | 0 | 110.5 | E203 K204 L209 L210 Q211 | E203-I207 WeakPolarHBondContact O-CG1 3.41Å; E203-I207 PolarHBondContact O-N 2.99Å; K204-I207 PolarHBondContact O-N 3.29Å; I207-L209 VanDerWaalsContact C-N 3.29Å; I207-L209 PolarHBondContact O-N 2.95Å; I207-L210 PolarHBondContact O-N 2.89Å; I207-L210 VanDerWaalsContact O-N 3.15Å; I207-Q211 PolarHBondContact O-N 3.49Å |
| 208 | Q | 97.9 | Very high | 96.9 | Very high | 89 Ų | 89 | 102.7 Ų | 102.7 | 42% | 0.416 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -59.6 | -40.7 | 178.2 | -72.4 | 179.6 | -28.1 | 0 | 0 | 112 | K204 L205 Q211 L212 | K204-Q208 WeakPolarHBondContact O-CG 3.41Å; K204-Q208 PolarHBondContact O-N 3.28Å; L205-Q208 PolarHBondContact O-N 2.9Å; Q208-Q211 PolarHBondContact O-N 2.94Å; Q208-L212 WeakPolarHBondContact O-CB 3.41Å; Q208-L212 WeakPolarHBondContact O-CG 3.45Å; Q208-L212 PolarHBondContact O-N 2.84Å |
| 209 | L | 97.9 | Very high | 97.2 | Very high | 89 Ų | 89 | 101.9 Ų | 101.9 | 47% | 0.466 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.6 | -44.5 | 175.9 | -170.7 | 164.6 | 0 | 0 | 0 | 111.3 | L205 K206 I207 L212 K213 | L205-L209 VanDerWaalsContact O-CB 3.27Å; L205-L209 WeakPolarHBondContact O-CB 3.49Å; L205-L209 PolarHBondContact O-N 2.86Å; K206-L209 PolarHBondContact O-N 3.07Å; I207-L209 VanDerWaalsContact C-N 3.29Å; I207-L209 PolarHBondContact O-N 2.95Å; L209-L212 PolarHBondContact O-N 2.91Å; L209-K213 HydrophobicContact CD2-CD 3.66Å; L209-K213 VanDerWaalsContact CD2-CE 3.41Å; L209-K213 HydrophobicContact CD2-CG 4.11Å; L209-K213 WeakPolarHBondContact O-CG 3.39Å; L209-K213 PolarHBondContact O-N 2.89Å |
| 210 | L | 97.9 | Very high | 97.5 | Very high | 97 Ų | 97 | 102.9 Ų | 102.9 | 51% | 0.508 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.4 | -43 | 175.8 | -70.7 | 173.6 | 0 | 0 | 0 | 111.5 | K206 I207 K213 V214 | K206-L210 WeakPolarHBondContact O-CG 3.27Å; K206-L210 PolarHBondContact O-N 3.47Å; I207-L210 PolarHBondContact O-N 2.89Å; I207-L210 VanDerWaalsContact O-N 3.15Å; L210-K213 WeakPolarHBondContact O-CB 3.36Å; L210-K213 PolarHBondContact O-N 3.26Å; L210-V214 WeakPolarHBondContact O-CG2 3.2Å; L210-V214 PolarHBondContact O-N 3.39Å |
| 211 | Q | 98.1 | Very high | 97.7 | Very high | 111 Ų | 111 | 103.1 Ų | 103.1 | 52% | 0.519 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62 | -46.9 | 177 | -173.9 | 176.3 | -1.5 | 0 | 0 | 111.8 | I207 Q208 K213 V214 Q215 | I207-Q211 PolarHBondContact O-N 3.49Å; Q208-Q211 PolarHBondContact O-N 2.94Å; Q211-K213 VanDerWaalsContact C-N 3.3Å; Q211-K213 PolarHBondContact O-N 3.5Å; Q211-V214 PolarHBondContact O-N 3.38Å; Q211-Q215 WeakPolarHBondContact O-CG 3.24Å; Q211-Q215 PolarHBondContact O-N 3.31Å |
| 212 | L | 98.1 | Very high | 97.8 | Very high | 110 Ų | 110 | 104.1 Ų | 104.1 | 58% | 0.576 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.5 | -37.7 | 176.2 | -75.1 | 173.7 | 0 | 0 | 0 | 112.1 | Q208 L209 Q215 L216 | Q208-L212 WeakPolarHBondContact O-CB 3.41Å; Q208-L212 WeakPolarHBondContact O-CG 3.45Å; Q208-L212 PolarHBondContact O-N 2.84Å; L209-L212 PolarHBondContact O-N 2.91Å; L212-Q215 PolarHBondContact O-N 2.88Å; L212-L216 VanDerWaalsContact O-CB 3.24Å; L212-L216 WeakPolarHBondContact O-CB 3.44Å; L212-L216 PolarHBondContact O-N 3.18Å |
| 213 | K | 97.7 | Very high | 97.9 | Very high | 114 Ų | 114 | 103.2 Ų | 103.2 | 50% | 0.496 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63 | -43.1 | 174.7 | -81.3 | -176.3 | 173.5 | 175.2 | 0 | 112.4 | L209 L210 Q211 A217 | L209-K213 HydrophobicContact CD2-CD 3.66Å; L209-K213 VanDerWaalsContact CD2-CE 3.41Å; L209-K213 HydrophobicContact CD2-CG 4.11Å; L209-K213 WeakPolarHBondContact O-CG 3.39Å; L209-K213 PolarHBondContact O-N 2.89Å; L210-K213 WeakPolarHBondContact O-CB 3.36Å; L210-K213 PolarHBondContact O-N 3.26Å; Q211-K213 VanDerWaalsContact C-N 3.3Å; Q211-K213 PolarHBondContact O-N 3.5Å; K213-A217 WeakPolarHBondContact O-CB 3.4Å; K213-A217 PolarHBondContact O-N 3.25Å |
| 214 | V | 98.1 | Very high | 98 | Very high | 105 Ų | 105 | 103.9 Ų | 103.9 | 64% | 0.636 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65 | -47.1 | 177.3 | 172.7 | 0 | 0 | 0 | 0 | 110.4 | L210 Q211 L216 A217 D218 | L210-V214 WeakPolarHBondContact O-CG2 3.2Å; L210-V214 PolarHBondContact O-N 3.39Å; Q211-V214 PolarHBondContact O-N 3.38Å; V214-L216 VanDerWaalsContact C-N 3.35Å; V214-L216 PolarHBondContact O-N 3.25Å; V214-A217 PolarHBondContact O-N 3.13Å; V214-D218 PolarHBondContact O-N 2.99Å |
| 215 | Q | 98 | Very high | 98 | Very high | 98 Ų | 98 | 101.1 Ų | 101.1 | 46% | 0.458 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.3 | -43.2 | 177.2 | -73.4 | -179.5 | -27.2 | 0 | 0 | 112.2 | Q211 L212 A217 D218 V219 | Q211-Q215 WeakPolarHBondContact O-CG 3.24Å; Q211-Q215 PolarHBondContact O-N 3.31Å; L212-Q215 PolarHBondContact O-N 2.88Å; Q215-A217 VanDerWaalsContact C-N 3.35Å; Q215-A217 PolarHBondContact O-N 2.92Å; Q215-D218 PolarHBondContact O-N 3.07Å; Q215-V219 WeakPolarHBondContact O-CG2 3.46Å; Q215-V219 PolarHBondContact O-N 2.88Å |
| 216 | L | 97.9 | Very high | 98 | Very high | 112 Ų | 112 | 99.7 Ų | 99.7 | 59% | 0.586 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64 | -41 | 177.6 | -176.9 | 63.7 | 0 | 0 | 0 | 111.8 | L212 V214 D218 M220 | L212-L216 VanDerWaalsContact O-CB 3.24Å; L212-L216 WeakPolarHBondContact O-CB 3.44Å; L212-L216 PolarHBondContact O-N 3.18Å; V214-L216 VanDerWaalsContact C-N 3.35Å; V214-L216 PolarHBondContact O-N 3.25Å; L216-D218 VanDerWaalsContact C-N 3.35Å; L216-M220 WeakPolarHBondContact O-CB 3.33Å; L216-M220 PolarHBondContact O-N 3.47Å |
| 217 | A | 98 | Very high | 98 | Very high | 48 Ų | 48 | 97.6 Ų | 97.6 | 40% | 0.397 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.3 | -42 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | K213 V214 Q215 M220 N221 | K213-A217 WeakPolarHBondContact O-CB 3.4Å; K213-A217 PolarHBondContact O-N 3.25Å; V214-A217 PolarHBondContact O-N 3.13Å; Q215-A217 VanDerWaalsContact C-N 3.35Å; Q215-A217 PolarHBondContact O-N 2.92Å; A217-M220 PolarHBondContact O-N 3.5Å; A217-N221 WeakPolarHBondContact O-CB 3.27Å; A217-N221 PolarHBondContact O-N 2.98Å; A217-N221 PolarHBondContact O-ND2 3.3Å; A217-N221 VanDerWaalsContact O-ND2 3.12Å |
| 218 | D | 98.4 | Very high | 98 | Very high | 108 Ų | 108 | 96.5 Ų | 96.5 | 58% | 0.578 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.2 | -50.6 | 177.1 | -173.1 | 39 | 0 | 0 | 0 | 111.8 | V214 Q215 L216 M220 N221 K222 | V214-D218 PolarHBondContact O-N 2.99Å; Q215-D218 PolarHBondContact O-N 3.07Å; L216-D218 VanDerWaalsContact C-N 3.35Å; D218-M220 VanDerWaalsContact C-N 3.3Å; D218-M220 PolarHBondContact O-N 2.83Å; D218-N221 PolarHBondContact O-N 3.44Å; D218-N221 VanDerWaalsContact O-N 3.12Å; D218-K222 WeakPolarHBondContact O-CB 3.24Å; D218-K222 PolarHBondContact O-N 3.15Å |
| 219 | V | 98.3 | Very high | 98 | Very high | 85 Ų | 85 | 97 Ų | 97 | 52% | 0.515 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59 | -42 | 176.1 | 172.8 | 0 | 0 | 0 | 0 | 111.2 | Q215 N221 K222 V223 | Q215-V219 WeakPolarHBondContact O-CG2 3.46Å; Q215-V219 PolarHBondContact O-N 2.88Å; V219-N221 PolarHBondContact O-N 3.24Å; V219-K222 PolarHBondContact O-N 3.23Å; V219-V223 HydrophobicContact CG1-CG2 4.33Å; V219-V223 WeakPolarHBondContact O-CB 3.43Å; V219-V223 VanDerWaalsContact O-CG2 3.3Å; V219-V223 WeakPolarHBondContact O-CG2 3.43Å; V219-V223 PolarHBondContact O-N 2.89Å |
| 220 | M | 97.9 | Very high | 98 | Very high | 107 Ų | 107 | 96.4 Ų | 96.4 | 53% | 0.527 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.1 | -41.7 | 176.5 | -178.3 | 174.2 | -67 | 0 | 0 | 112.2 | L216 A217 D218 R224 | L216-M220 WeakPolarHBondContact O-CB 3.33Å; L216-M220 PolarHBondContact O-N 3.47Å; A217-M220 PolarHBondContact O-N 3.5Å; D218-M220 VanDerWaalsContact C-N 3.3Å; D218-M220 PolarHBondContact O-N 2.83Å; M220-R224 VanDerWaalsContact O-CB 3.24Å; M220-R224 WeakPolarHBondContact O-CB 3.28Å; M220-R224 PolarHBondContact O-N 3.28Å |
| 221 | N | 98.1 | Very high | 98 | Very high | 82 Ų | 82 | 96.1 Ų | 96.1 | 44% | 0.439 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.3 | -38.8 | 177.1 | -73.4 | -30.2 | 0 | 0 | 0 | 111.9 | A217 D218 V219 R224 S225 | A217-N221 WeakPolarHBondContact O-CB 3.27Å; A217-N221 PolarHBondContact O-N 2.98Å; A217-N221 PolarHBondContact O-ND2 3.3Å; A217-N221 VanDerWaalsContact O-ND2 3.12Å; D218-N221 PolarHBondContact O-N 3.44Å; D218-N221 VanDerWaalsContact O-N 3.12Å; V219-N221 PolarHBondContact O-N 3.24Å; N221-R224 PolarHBondContact O-N 3.48Å; N221-S225 WeakPolarHBondContact O-CB 3.3Å; N221-S225 PolarHBondContact O-N 3.36Å; N221-S225 PolarHBondContact O-OG 2.91Å |
| 222 | K | 98.4 | Very high | 98 | Very high | 121 Ų | 121 | 95.3 Ų | 95.3 | 53% | 0.526 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.6 | -54.5 | 174.2 | -174.7 | -178.5 | -178.3 | -61.4 | 0 | 110.9 | D218 V219 R224 S225 D226 | D218-K222 WeakPolarHBondContact O-CB 3.24Å; D218-K222 PolarHBondContact O-N 3.15Å; V219-K222 PolarHBondContact O-N 3.23Å; K222-R224 VanDerWaalsContact C-N 3.27Å; K222-R224 PolarHBondContact O-N 2.92Å; K222-S225 PolarHBondContact O-N 3.48Å; K222-S225 VanDerWaalsContact O-N 3.07Å; K222-D226 IonicContact NZ-OD2 2.65Å; K222-D226 PolarHBondContact NZ-OD2 3.06Å; K222-D226 WeakPolarHBondContact O-CB 3.47Å; K222-D226 VanDerWaalsContact O-CG 3.25Å; K222-D226 PolarHBondContact O-N 3.21Å |
| 223 | V | 98.3 | Very high | 98 | Very high | 88 Ų | 88 | 93.9 Ų | 93.9 | 53% | 0.533 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.2 | -40.5 | 178 | 171.2 | 0 | 0 | 0 | 0 | 111.4 | V219 N227 | V219-V223 HydrophobicContact CG1-CG2 4.33Å; V219-V223 WeakPolarHBondContact O-CB 3.43Å; V219-V223 VanDerWaalsContact O-CG2 3.3Å; V219-V223 WeakPolarHBondContact O-CG2 3.43Å; V219-V223 PolarHBondContact O-N 2.89Å; V223-N227 VanDerWaalsContact O-CB 3.28Å; V223-N227 WeakPolarHBondContact O-CB 3.44Å; V223-N227 PolarHBondContact O-N 2.88Å |
| 224 | R | 97.6 | Very high | 98 | Very high | 141 Ų | 141 | 93.5 Ų | 93.5 | 53% | 0.532 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.2 | -46.7 | 175.2 | 177.4 | -177.4 | -65.9 | 170 | 1.6 | 111.8 | M220 N221 K222 N227 I228 | M220-R224 VanDerWaalsContact O-CB 3.24Å; M220-R224 WeakPolarHBondContact O-CB 3.28Å; M220-R224 PolarHBondContact O-N 3.28Å; N221-R224 PolarHBondContact O-N 3.48Å; K222-R224 VanDerWaalsContact C-N 3.27Å; K222-R224 PolarHBondContact O-N 2.92Å; R224-N227 PolarHBondContact O-N 3.44Å; R224-I228 HydrophobicContact CG-CD1 3.93Å; R224-I228 VanDerWaalsContact O-CG1 3.27Å; R224-I228 WeakPolarHBondContact O-CG1 3.37Å; R224-I228 PolarHBondContact O-N 3.27Å |
| 225 | S | 97.6 | Very high | 98 | Very high | 69 Ų | 69 | 94.5 Ų | 94.5 | 48% | 0.483 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -67.7 | -42.6 | -178.3 | -56.3 | 0 | 0 | 0 | 0 | 111.1 | N221 K222 N227 I228 L229 | N221-S225 WeakPolarHBondContact O-CB 3.3Å; N221-S225 PolarHBondContact O-N 3.36Å; N221-S225 PolarHBondContact O-OG 2.91Å; K222-S225 PolarHBondContact O-N 3.48Å; K222-S225 VanDerWaalsContact O-N 3.07Å; S225-N227 PolarHBondContact O-N 2.82Å; S225-I228 PolarHBondContact O-N 3.49Å; S225-L229 WeakPolarHBondContact O-CB 3.41Å; S225-L229 PolarHBondContact O-N 2.58Å |
| 226 | D | 98.1 | Very high | 98 | Very high | 77 Ų | 77 | 93.4 Ų | 93.4 | 41% | 0.412 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.2 | -46.5 | 175.2 | -68.7 | -12.3 | 0 | 0 | 0 | 110.5 | K222 L229 D230 | K222-D226 IonicContact NZ-OD2 2.65Å; K222-D226 PolarHBondContact NZ-OD2 3.06Å; K222-D226 WeakPolarHBondContact O-CB 3.47Å; K222-D226 VanDerWaalsContact O-CG 3.25Å; K222-D226 PolarHBondContact O-N 3.21Å; D226-L229 PolarHBondContact O-N 3.26Å; D226-D230 WeakPolarHBondContact O-CB 3.46Å; D226-D230 PolarHBondContact O-N 3.38Å |
| 227 | N | 98.1 | Very high | 98 | Very high | 88 Ų | 88 | 95.3 Ų | 95.3 | 47% | 0.471 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.1 | -39.5 | 178.2 | -172.8 | 45.9 | 0 | 0 | 0 | 112.8 | V223 R224 S225 L229 D230 L231 | V223-N227 VanDerWaalsContact O-CB 3.28Å; V223-N227 WeakPolarHBondContact O-CB 3.44Å; V223-N227 PolarHBondContact O-N 2.88Å; R224-N227 PolarHBondContact O-N 3.44Å; S225-N227 PolarHBondContact O-N 2.82Å; N227-L229 VanDerWaalsContact C-N 3.32Å; N227-D230 PolarHBondContact O-N 2.95Å; N227-L231 WeakPolarHBondContact O-CB 3.46Å; N227-L231 VanDerWaalsContact O-CG 3.25Å; N227-L231 WeakPolarHBondContact O-CG 3.45Å; N227-L231 PolarHBondContact O-N 3.43Å |
| 228 | I | 98 | Very high | 98 | Very high | 88 Ų | 88 | 95.9 Ų | 95.9 | 45% | 0.451 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.5 | -42.9 | 175 | -71.5 | 168 | 0 | 0 | 0 | 110.3 | R224 S225 N232 | R224-I228 HydrophobicContact CG-CD1 3.93Å; R224-I228 VanDerWaalsContact O-CG1 3.27Å; R224-I228 WeakPolarHBondContact O-CG1 3.37Å; R224-I228 PolarHBondContact O-N 3.27Å; S225-I228 PolarHBondContact O-N 3.49Å; I228-N232 WeakPolarHBondContact CG2-ND2 3.48Å; I228-N232 WeakPolarHBondContact O-CB 3.41Å; I228-N232 PolarHBondContact O-N 3.48Å; I228-N232 PolarHBondContact O-ND2 3.45Å |
| 229 | L | 97.9 | Very high | 98 | Very high | 100 Ų | 100 | 97.1 Ų | 97.1 | 52% | 0.524 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62 | -47.8 | 177.4 | 179.2 | 62.8 | 0 | 0 | 0 | 110.8 | S225 D226 N227 N232 L233 | S225-L229 WeakPolarHBondContact O-CB 3.41Å; S225-L229 PolarHBondContact O-N 2.58Å; D226-L229 PolarHBondContact O-N 3.26Å; N227-L229 VanDerWaalsContact C-N 3.32Å; L229-N232 WeakPolarHBondContact O-CB 3.36Å; L229-N232 PolarHBondContact O-N 3.06Å; L229-N232 VanDerWaalsContact O-N 3.13Å; L229-L233 HydrophobicContact CD1-CD1 4.45Å; L229-L233 HydrophobicContact CD1-CG 4.36Å; L229-L233 HydrophobicContact CG-CD1 4.2Å; L229-L233 HydrophobicContact CG-CG 4.5Å; L229-L233 WeakPolarHBondContact O-CG 3.49Å; L229-L233 PolarHBondContact O-N 3.41Å |
| 230 | D | 98.2 | Very high | 98 | Very high | 76 Ų | 76 | 98.1 Ų | 98.1 | 41% | 0.406 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.2 | -48.8 | -179.9 | -167.3 | 39.3 | 0 | 0 | 0 | 111.8 | D226 N227 N232 L233 E234 | D226-D230 WeakPolarHBondContact O-CB 3.46Å; D226-D230 PolarHBondContact O-N 3.38Å; N227-D230 PolarHBondContact O-N 2.95Å; D230-N232 VanDerWaalsContact C-N 3.26Å; D230-N232 PolarHBondContact O-N 3.11Å; D230-L233 WeakPolarHBondContact O-CB 3.39Å; D230-L233 PolarHBondContact O-N 3.46Å; D230-E234 PolarHBondContact O-N 2.88Å |
| 231 | L | 97.8 | Very high | 98 | Very high | 91 Ų | 91 | 97.5 Ų | 97.5 | 48% | 0.476 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59 | -36.9 | 174.6 | -71 | 175.9 | 0 | 0 | 0 | 112.6 | N227 K235 | N227-L231 WeakPolarHBondContact O-CB 3.46Å; N227-L231 VanDerWaalsContact O-CG 3.25Å; N227-L231 WeakPolarHBondContact O-CG 3.45Å; N227-L231 PolarHBondContact O-N 3.43Å; L231-K235 WeakPolarHBondContact O-CB 3.25Å; L231-K235 PolarHBondContact O-N 3.43Å |
| 232 | N | 98.1 | Very high | 97.9 | Very high | 93 Ų | 93 | 100 Ų | 100 | 50% | 0.497 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -69 | -39.4 | 176.3 | -75.9 | -36 | 0 | 0 | 0 | 111.8 | I228 L229 D230 K235 S236 | I228-N232 WeakPolarHBondContact CG2-ND2 3.48Å; I228-N232 WeakPolarHBondContact O-CB 3.41Å; I228-N232 PolarHBondContact O-N 3.48Å; I228-N232 PolarHBondContact O-ND2 3.45Å; L229-N232 WeakPolarHBondContact O-CB 3.36Å; L229-N232 PolarHBondContact O-N 3.06Å; L229-N232 VanDerWaalsContact O-N 3.13Å; D230-N232 VanDerWaalsContact C-N 3.26Å; D230-N232 PolarHBondContact O-N 3.11Å; N232-K235 PolarHBondContact O-N 3.49Å; N232-S236 WeakPolarHBondContact O-CB 3.49Å; N232-S236 PolarHBondContact O-N 3.25Å |
| 233 | L | 98.2 | Very high | 97.9 | Very high | 80 Ų | 80 | 96.8 Ų | 96.8 | 42% | 0.419 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.7 | -47.5 | 175.4 | -69.3 | 175.4 | 0 | 0 | 0 | 111.1 | L229 D230 K235 S236 R237 | L229-L233 HydrophobicContact CD1-CD1 4.45Å; L229-L233 HydrophobicContact CD1-CG 4.36Å; L229-L233 HydrophobicContact CG-CD1 4.2Å; L229-L233 HydrophobicContact CG-CG 4.5Å; L229-L233 WeakPolarHBondContact O-CG 3.49Å; L229-L233 PolarHBondContact O-N 3.41Å; D230-L233 WeakPolarHBondContact O-CB 3.39Å; D230-L233 PolarHBondContact O-N 3.46Å; L233-K235 VanDerWaalsContact C-N 3.35Å; L233-K235 PolarHBondContact O-N 2.91Å; L233-S236 WeakPolarHBondContact O-CB 3.38Å; L233-S236 PolarHBondContact O-N 2.98Å; L233-R237 WeakPolarHBondContact O-CG 3.29Å; L233-R237 PolarHBondContact O-N 3.38Å |
| 234 | E | 97.6 | Very high | 97.9 | Very high | 106 Ų | 106 | 96.7 Ų | 96.7 | 50% | 0.495 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.3 | -43.8 | 174.8 | -72.1 | -164.6 | 150.2 | 0 | 0 | 111.9 | D230 S236 R237 A238 | D230-E234 PolarHBondContact O-N 2.88Å; E234-S236 VanDerWaalsContact C-N 3.29Å; E234-S236 PolarHBondContact O-N 2.89Å; E234-R237 PolarHBondContact O-N 3.44Å; E234-A238 WeakPolarHBondContact O-CB 3.11Å; E234-A238 PolarHBondContact O-N 2.89Å |
| 235 | K | 97.9 | Very high | 97.9 | Very high | 127 Ų | 127 | 95.7 Ų | 95.7 | 55% | 0.552 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -60.8 | -39 | 175.2 | -176.2 | 178.5 | -175.8 | 178.7 | 0 | 111.9 | L231 N232 L233 K239 | L231-K235 WeakPolarHBondContact O-CB 3.25Å; L231-K235 PolarHBondContact O-N 3.43Å; N232-K235 PolarHBondContact O-N 3.49Å; L233-K235 VanDerWaalsContact C-N 3.35Å; L233-K235 PolarHBondContact O-N 2.91Å; K235-K239 WeakPolarHBondContact O-CB 3.41Å; K235-K239 VanDerWaalsContact O-CG 3.29Å; K235-K239 WeakPolarHBondContact O-CG 3.36Å; K235-K239 PolarHBondContact O-N 3.29Å |
| 236 | S | 98 | Very high | 97.8 | Very high | 75 Ų | 75 | 96.6 Ų | 96.6 | 52% | 0.524 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.3 | -44.9 | 175.3 | -165 | 0 | 0 | 0 | 0 | 111.2 | N232 L233 E234 A238 K239 E240 | N232-S236 WeakPolarHBondContact O-CB 3.49Å; N232-S236 PolarHBondContact O-N 3.25Å; L233-S236 WeakPolarHBondContact O-CB 3.38Å; L233-S236 PolarHBondContact O-N 2.98Å; E234-S236 VanDerWaalsContact C-N 3.29Å; E234-S236 PolarHBondContact O-N 2.89Å; S236-A238 PolarHBondContact O-N 2.84Å; S236-K239 PolarHBondContact O-N 3.14Å; S236-E240 WeakPolarHBondContact O-CB 3.4Å; S236-E240 PolarHBondContact O-N 3.31Å |
| 237 | R | 98.2 | Very high | 97.8 | Very high | 152 Ų | 152 | 99.1 Ų | 99.1 | 57% | 0.574 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.6 | -44.5 | 175.9 | -71.9 | 179 | -175.3 | 128.6 | -0.8 | 112 | L233 E234 K239 E240 L241 | L233-R237 WeakPolarHBondContact O-CG 3.29Å; L233-R237 PolarHBondContact O-N 3.38Å; E234-R237 PolarHBondContact O-N 3.44Å; R237-K239 VanDerWaalsContact C-N 3.33Å; R237-K239 PolarHBondContact O-N 3.36Å; R237-E240 PolarHBondContact O-N 3Å; R237-L241 WeakPolarHBondContact O-CG 3.4Å; R237-L241 PolarHBondContact O-N 3.16Å |
| 238 | A | 97.8 | Very high | 97.8 | Very high | 60 Ų | 60 | 101 Ų | 101 | 50% | 0.496 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.9 | -39.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | E234 S236 K242 | E234-A238 WeakPolarHBondContact O-CB 3.11Å; E234-A238 PolarHBondContact O-N 2.89Å; S236-A238 PolarHBondContact O-N 2.84Å; A238-K242 WeakPolarHBondContact O-CB 3.34Å; A238-K242 PolarHBondContact O-N 3.35Å |
| 239 | K | 97.8 | Very high | 97.8 | Very high | 134 Ų | 134 | 100.6 Ų | 100.6 | 58% | 0.583 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.9 | -44 | 174.2 | -77.5 | 176.9 | 174.9 | -169.8 | 0 | 112.2 | K235 S236 R237 K242 A243 | K235-K239 WeakPolarHBondContact O-CB 3.41Å; K235-K239 VanDerWaalsContact O-CG 3.29Å; K235-K239 WeakPolarHBondContact O-CG 3.36Å; K235-K239 PolarHBondContact O-N 3.29Å; S236-K239 PolarHBondContact O-N 3.14Å; R237-K239 VanDerWaalsContact C-N 3.33Å; R237-K239 PolarHBondContact O-N 3.36Å; K239-K242 PolarHBondContact O-N 3.12Å; K239-A243 WeakPolarHBondContact O-CB 2.9Å; K239-A243 PolarHBondContact O-N 3.41Å |
| 240 | E | 97.9 | Very high | 97.8 | Very high | 105 Ų | 105 | 101 Ų | 101 | 49% | 0.491 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.3 | -47.8 | 178.2 | 179.2 | 55.1 | -147.9 | 0 | 0 | 110.9 | S236 R237 K242 A243 Q244 | S236-E240 WeakPolarHBondContact O-CB 3.4Å; S236-E240 PolarHBondContact O-N 3.31Å; R237-E240 PolarHBondContact O-N 3Å; E240-K242 VanDerWaalsContact C-N 3.3Å; E240-K242 PolarHBondContact O-N 3.16Å; E240-A243 PolarHBondContact O-N 3.18Å; E240-A243 VanDerWaalsContact O-N 3.16Å; E240-Q244 WeakPolarHBondContact O-CG 3.49Å; E240-Q244 PolarHBondContact O-N 3.15Å; E240-Q244 PolarHBondContact OE1-NE2 3.5Å |
| 241 | L | 97.6 | Very high | 97.7 | Very high | 94 Ų | 94 | 101.8 Ų | 101.8 | 49% | 0.492 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.6 | -43.4 | 175.2 | -72.1 | 174.1 | 0 | 0 | 0 | 111.6 | R237 Q244 H245 | R237-L241 WeakPolarHBondContact O-CG 3.4Å; R237-L241 PolarHBondContact O-N 3.16Å; L241-Q244 PolarHBondContact O-N 3.47Å; L241-H245 PolarHBondContact O-CD2 2.92Å; L241-H245 PolarHBondContact O-N 3.04Å |
| 242 | K | 97.6 | Very high | 97.7 | Very high | 136 Ų | 136 | 100.7 Ų | 100.7 | 59% | 0.591 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -60.7 | -46.8 | 175.6 | -173.2 | -176.3 | 175.8 | -174.6 | 0 | 111.6 | A238 K239 E240 Q244 H245 D246 | A238-K242 WeakPolarHBondContact O-CB 3.34Å; A238-K242 PolarHBondContact O-N 3.35Å; K239-K242 PolarHBondContact O-N 3.12Å; E240-K242 VanDerWaalsContact C-N 3.3Å; E240-K242 PolarHBondContact O-N 3.16Å; K242-Q244 VanDerWaalsContact C-N 3.28Å; K242-Q244 PolarHBondContact O-N 3.45Å; K242-H245 PolarHBondContact O-N 3.44Å; K242-H245 VanDerWaalsContact O-N 3.14Å; K242-D246 WeakPolarHBondContact O-CB 3.43Å; K242-D246 PolarHBondContact O-N 2.99Å |
| 243 | A | 97.7 | Very high | 97.6 | Very high | 52 Ų | 52 | 103.5 Ų | 103.5 | 43% | 0.43 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.4 | -39.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | K239 E240 D246 K247 | K239-A243 WeakPolarHBondContact O-CB 2.9Å; K239-A243 PolarHBondContact O-N 3.41Å; E240-A243 PolarHBondContact O-N 3.18Å; E240-A243 VanDerWaalsContact O-N 3.16Å; A243-D246 PolarHBondContact O-N 3.33Å; A243-K247 WeakPolarHBondContact O-CB 3.49Å; A243-K247 PolarHBondContact O-N 2.92Å |
| 244 | Q | 97.9 | Very high | 97.6 | Very high | 87 Ų | 87 | 102.8 Ų | 102.8 | 41% | 0.407 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.3 | -41.6 | 174.1 | -70.5 | 176.6 | 9.3 | 0 | 0 | 112.4 | E240 L241 K242 K247 K248 | E240-Q244 WeakPolarHBondContact O-CG 3.49Å; E240-Q244 PolarHBondContact O-N 3.15Å; E240-Q244 PolarHBondContact OE1-NE2 3.5Å; L241-Q244 PolarHBondContact O-N 3.47Å; K242-Q244 VanDerWaalsContact C-N 3.28Å; K242-Q244 PolarHBondContact O-N 3.45Å; Q244-K247 PolarHBondContact O-N 3.43Å; Q244-K248 WeakPolarHBondContact O-CG 3.48Å; Q244-K248 PolarHBondContact O-N 3.03Å |
| 245 | H | 97.7 | Very high | 97.5 | Very high | 120 Ų | 120 | 103 Ų | 103 | 56% | 0.556 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.9 | -45 | 174.8 | -78.1 | -66.5 | 0 | 0 | 0 | 112.1 | L241 K242 K247 K248 L249 | L241-H245 PolarHBondContact O-CD2 2.92Å; L241-H245 PolarHBondContact O-N 3.04Å; K242-H245 PolarHBondContact O-N 3.44Å; K242-H245 VanDerWaalsContact O-N 3.14Å; H245-K247 VanDerWaalsContact C-N 3.28Å; H245-K247 PolarHBondContact O-N 3.22Å; H245-K248 PolarHBondContact O-N 2.73Å; H245-L249 VanDerWaalsContact O-CB 3.26Å; H245-L249 WeakPolarHBondContact O-CB 3.43Å; H245-L249 PolarHBondContact O-N 2.88Å |
| 246 | D | 96.9 | Very high | 97.5 | Very high | 87 Ų | 87 | 101.5 Ų | 101.5 | 47% | 0.465 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.2 | -39.8 | 177.3 | -70.3 | -19.9 | 0 | 0 | 0 | 110.7 | K242 A243 L249 L250 | K242-D246 WeakPolarHBondContact O-CB 3.43Å; K242-D246 PolarHBondContact O-N 2.99Å; A243-D246 PolarHBondContact O-N 3.33Å; D246-L249 PolarHBondContact O-N 3.44Å; D246-L250 WeakPolarHBondContact O-CB 3.42Å; D246-L250 PolarHBondContact O-N 3.42Å |
| 247 | K | 97.8 | Very high | 97.4 | Very high | 131 Ų | 131 | 103.3 Ų | 103.3 | 57% | 0.57 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.4 | -51.7 | 174 | -179 | 179.3 | 170.4 | -179 | 0 | 112 | A243 Q244 H245 L249 L250 E251 | A243-K247 WeakPolarHBondContact O-CB 3.49Å; A243-K247 PolarHBondContact O-N 2.92Å; Q244-K247 PolarHBondContact O-N 3.43Å; H245-K247 VanDerWaalsContact C-N 3.28Å; H245-K247 PolarHBondContact O-N 3.22Å; K247-L249 PolarHBondContact O-N 3.18Å; K247-L250 WeakPolarHBondContact O-CB 3.5Å; K247-L250 PolarHBondContact O-N 3.48Å; K247-L250 VanDerWaalsContact O-N 3.08Å; K247-E251 WeakPolarHBondContact CE-OE1 3.34Å; K247-E251 IonicContact NZ-OE1 3.82Å; K247-E251 WeakPolarHBondContact O-CG 3.42Å; K247-E251 PolarHBondContact O-N 3.2Å |
| 248 | K | 97.5 | Very high | 97.3 | Very high | 127 Ų | 127 | 102.3 Ų | 102.3 | 55% | 0.552 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -59 | -38.8 | 177.5 | -74.1 | 178.8 | -178.7 | -178.4 | 0 | 111.9 | Q244 H245 L250 E251 T252 | Q244-K248 WeakPolarHBondContact O-CG 3.48Å; Q244-K248 PolarHBondContact O-N 3.03Å; H245-K248 PolarHBondContact O-N 2.73Å; K248-L250 VanDerWaalsContact C-N 3.32Å; K248-E251 PolarHBondContact O-N 2.94Å; K248-T252 WeakPolarHBondContact O-CG2 3.47Å; K248-T252 PolarHBondContact O-N 3.38Å; K248-T252 PolarHBondContact O-OG1 2.89Å |
| 249 | L | 97.9 | Very high | 97.2 | Very high | 80 Ų | 80 | 104.1 Ų | 104.1 | 42% | 0.419 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -69 | -33.2 | 178 | -175.3 | 146.4 | 0 | 0 | 0 | 111.9 | H245 D246 K247 T252 R253 | H245-L249 VanDerWaalsContact O-CB 3.26Å; H245-L249 WeakPolarHBondContact O-CB 3.43Å; H245-L249 PolarHBondContact O-N 2.88Å; D246-L249 PolarHBondContact O-N 3.44Å; K247-L249 PolarHBondContact O-N 3.18Å; L249-T252 PolarHBondContact O-OG1 3.3Å; L249-T252 VanDerWaalsContact O-OG1 3.1Å; L249-R253 WeakPolarHBondContact O-CB 3.4Å; L249-R253 VanDerWaalsContact O-CG 3.23Å; L249-R253 WeakPolarHBondContact O-CG 3.45Å; L249-R253 PolarHBondContact O-N 3.34Å; L249-R253 VanDerWaalsContact O-N 3.13Å |
| 250 | L | 97.5 | Very high | 97.1 | Very high | 107 Ų | 107 | 100.5 Ų | 100.5 | 56% | 0.56 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -68.7 | -45.5 | 171.5 | -171.3 | 69 | 0 | 0 | 0 | 111.1 | D246 K247 K248 T252 R253 T254 | D246-L250 WeakPolarHBondContact O-CB 3.42Å; D246-L250 PolarHBondContact O-N 3.42Å; K247-L250 WeakPolarHBondContact O-CB 3.5Å; K247-L250 PolarHBondContact O-N 3.48Å; K247-L250 VanDerWaalsContact O-N 3.08Å; K248-L250 VanDerWaalsContact C-N 3.32Å; L250-T252 PolarHBondContact O-N 3.08Å; L250-R253 WeakPolarHBondContact O-CB 3.23Å; L250-R253 PolarHBondContact O-N 3.31Å; L250-T254 WeakPolarHBondContact O-CG2 3.37Å; L250-T254 PolarHBondContact O-N 2.88Å; L250-T254 PolarHBondContact O-OG1 3.5Å |
| 251 | E | 97.1 | Very high | 97 | Very high | 94 Ų | 94 | 100.3 Ų | 100.3 | 44% | 0.439 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.8 | -45.6 | 177.6 | -72.3 | 170.1 | 171.6 | 0 | 0 | 111.9 | K247 K248 R253 T254 E255 | K247-E251 WeakPolarHBondContact CE-OE1 3.34Å; K247-E251 IonicContact NZ-OE1 3.82Å; K247-E251 WeakPolarHBondContact O-CG 3.42Å; K247-E251 PolarHBondContact O-N 3.2Å; K248-E251 PolarHBondContact O-N 2.94Å; E251-R253 VanDerWaalsContact C-N 3.34Å; E251-R253 PolarHBondContact O-N 2.93Å; E251-T254 WeakPolarHBondContact CA-OG1 3.46Å; E251-T254 PolarHBondContact O-N 3.43Å; E251-T254 PolarHBondContact O-OG1 2.97Å; E251-E255 WeakPolarHBondContact O-CB 3.34Å; E251-E255 PolarHBondContact O-N 3.48Å |
| 252 | T | 96.9 | Very high | 96.9 | Very high | 67 Ų | 67 | 101.4 Ų | 101.4 | 41% | 0.411 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.1 | -35.4 | 176.4 | 56.3 | 0 | 0 | 0 | 0 | 112.3 | K248 L249 L250 E255 I256 | K248-T252 WeakPolarHBondContact O-CG2 3.47Å; K248-T252 PolarHBondContact O-N 3.38Å; K248-T252 PolarHBondContact O-OG1 2.89Å; L249-T252 PolarHBondContact O-OG1 3.3Å; L249-T252 VanDerWaalsContact O-OG1 3.1Å; L250-T252 PolarHBondContact O-N 3.08Å; T252-E255 PolarHBondContact O-N 2.94Å; T252-I256 WeakPolarHBondContact O-CB 3.26Å; T252-I256 WeakPolarHBondContact O-CD1 3.44Å; T252-I256 VanDerWaalsContact O-CG1 3.23Å; T252-I256 WeakPolarHBondContact O-CG1 3.31Å; T252-I256 PolarHBondContact O-N 3.46Å |
| 253 | R | 96.9 | Very high | 96.9 | Very high | 152 Ų | 152 | 100.8 Ų | 100.8 | 57% | 0.574 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -64.3 | -41.6 | 173.1 | -80.2 | 176 | 176 | 171.8 | -0.4 | 111.8 | L249 L250 E251 I256 L257 | L249-R253 WeakPolarHBondContact O-CB 3.4Å; L249-R253 VanDerWaalsContact O-CG 3.23Å; L249-R253 WeakPolarHBondContact O-CG 3.45Å; L249-R253 PolarHBondContact O-N 3.34Å; L249-R253 VanDerWaalsContact O-N 3.13Å; L250-R253 WeakPolarHBondContact O-CB 3.23Å; L250-R253 PolarHBondContact O-N 3.31Å; E251-R253 VanDerWaalsContact C-N 3.34Å; E251-R253 PolarHBondContact O-N 2.93Å; R253-I256 PolarHBondContact O-N 3.13Å; R253-L257 VanDerWaalsContact O-CG 3.31Å; R253-L257 WeakPolarHBondContact O-CG 3.49Å; R253-L257 PolarHBondContact O-N 2.95Å |
| 254 | T | 96.9 | Very high | 96.8 | Very high | 65 Ų | 65 | 102.5 Ų | 102.5 | 40% | 0.399 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.9 | -42.3 | 177.3 | 48.3 | 0 | 0 | 0 | 0 | 111.2 | L250 E251 I256 L257 E258 | L250-T254 WeakPolarHBondContact O-CG2 3.37Å; L250-T254 PolarHBondContact O-N 2.88Å; L250-T254 PolarHBondContact O-OG1 3.5Å; E251-T254 WeakPolarHBondContact CA-OG1 3.46Å; E251-T254 PolarHBondContact O-N 3.43Å; E251-T254 PolarHBondContact O-OG1 2.97Å; T254-I256 PolarHBondContact O-N 3.2Å; T254-L257 PolarHBondContact O-N 3.48Å; T254-E258 WeakPolarHBondContact O-CG 3.35Å; T254-E258 PolarHBondContact O-N 3.1Å |
| 255 | E | 97.1 | Very high | 96.7 | Very high | 112 Ų | 112 | 104.7 Ų | 104.7 | 52% | 0.523 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.8 | -43.6 | 176.4 | -174.1 | 178.6 | -167.3 | 0 | 0 | 112 | E251 T252 L257 E258 M259 | E251-E255 WeakPolarHBondContact O-CB 3.34Å; E251-E255 PolarHBondContact O-N 3.48Å; T252-E255 PolarHBondContact O-N 2.94Å; E255-L257 VanDerWaalsContact C-N 3.32Å; E255-L257 PolarHBondContact O-N 3.27Å; E255-E258 PolarHBondContact O-N 3.4Å; E255-M259 HydrophobicContact CG-CE 4.39Å; E255-M259 WeakPolarHBondContact O-CG 3.23Å; E255-M259 PolarHBondContact O-N 3.06Å |
| 256 | I | 96.6 | Very high | 96.5 | Very high | 95 Ų | 95 | 103.7 Ų | 103.7 | 49% | 0.487 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.3 | -41.5 | 175.1 | -70.4 | 165.2 | 0 | 0 | 0 | 111.5 | T252 R253 T254 M259 T260 | T252-I256 WeakPolarHBondContact O-CB 3.26Å; T252-I256 WeakPolarHBondContact O-CD1 3.44Å; T252-I256 VanDerWaalsContact O-CG1 3.23Å; T252-I256 WeakPolarHBondContact O-CG1 3.31Å; T252-I256 PolarHBondContact O-N 3.46Å; R253-I256 PolarHBondContact O-N 3.13Å; T254-I256 PolarHBondContact O-N 3.2Å; I256-M259 HydrophobicContact CG1-CE 4.15Å; I256-T260 WeakPolarHBondContact O-CB 3.4Å; I256-T260 PolarHBondContact O-N 3.49Å; I256-T260 PolarHBondContact O-OG1 2.97Å |
| 257 | L | 96.8 | Very high | 96.5 | Very high | 113 Ų | 113 | 103.4 Ų | 103.4 | 59% | 0.592 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.2 | -44.1 | 178.1 | -74.6 | 170.5 | 0 | 0 | 0 | 111.5 | R253 T254 E255 T260 V261 | R253-L257 VanDerWaalsContact O-CG 3.31Å; R253-L257 WeakPolarHBondContact O-CG 3.49Å; R253-L257 PolarHBondContact O-N 2.95Å; T254-L257 PolarHBondContact O-N 3.48Å; E255-L257 VanDerWaalsContact C-N 3.32Å; E255-L257 PolarHBondContact O-N 3.27Å; L257-T260 PolarHBondContact O-N 3.41Å; L257-V261 WeakPolarHBondContact O-CG2 3.49Å; L257-V261 PolarHBondContact O-N 3.2Å |
| 258 | E | 95.9 | Very high | 96.3 | Very high | 130 Ų | 130 | 100.9 Ų | 100.9 | 61% | 0.607 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.3 | -49.4 | 175.5 | -73.6 | 179.1 | 178.4 | 0 | 0 | 111.2 | T254 E255 T260 V261 E262 | T254-E258 WeakPolarHBondContact O-CG 3.35Å; T254-E258 PolarHBondContact O-N 3.1Å; E255-E258 PolarHBondContact O-N 3.4Å; E258-T260 VanDerWaalsContact C-N 3.28Å; E258-T260 PolarHBondContact O-N 3.44Å; E258-V261 PolarHBondContact O-N 2.95Å; E258-E262 WeakPolarHBondContact O-CG 3.47Å; E258-E262 PolarHBondContact O-N 2.72Å |
| 259 | M | 95.4 | Very high | 96.2 | Very high | 98 Ų | 98 | 99 Ų | 99 | 48% | 0.483 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.1 | -38.6 | 175.5 | -71.2 | -169.4 | -63.7 | 0 | 0 | 112.7 | E255 I256 E262 Q263 | E255-M259 HydrophobicContact CG-CE 4.39Å; E255-M259 WeakPolarHBondContact O-CG 3.23Å; E255-M259 PolarHBondContact O-N 3.06Å; I256-M259 HydrophobicContact CG1-CE 4.15Å; M259-E262 PolarHBondContact O-N 3.23Å; M259-Q263 WeakPolarHBondContact O-CB 3.39Å; M259-Q263 PolarHBondContact O-N 2.93Å |
| 260 | T | 96.1 | Very high | 96.1 | Very high | 59 Ų | 59 | 98.1 Ų | 98.1 | 36% | 0.362 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.4 | -44.3 | 177.9 | -57.5 | 0 | 0 | 0 | 0 | 110.9 | I256 L257 E258 E262 Q263 D264 | I256-T260 WeakPolarHBondContact O-CB 3.4Å; I256-T260 PolarHBondContact O-N 3.49Å; I256-T260 PolarHBondContact O-OG1 2.97Å; L257-T260 PolarHBondContact O-N 3.41Å; E258-T260 VanDerWaalsContact C-N 3.28Å; E258-T260 PolarHBondContact O-N 3.44Å; T260-E262 VanDerWaalsContact C-N 3.35Å; T260-E262 PolarHBondContact O-N 2.92Å; T260-Q263 PolarHBondContact O-N 2.86Å; T260-D264 PolarHBondContact O-N 3.5Å |
| 261 | V | 96.1 | Very high | 96 | Very high | 100 Ų | 100 | 97 Ų | 97 | 61% | 0.606 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -63.2 | -42 | 176.8 | 171.4 | 0 | 0 | 0 | 0 | 111.1 | L257 E258 D264 R265 | L257-V261 WeakPolarHBondContact O-CG2 3.49Å; L257-V261 PolarHBondContact O-N 3.2Å; E258-V261 PolarHBondContact O-N 2.95Å; V261-D264 PolarHBondContact O-N 2.89Å; V261-R265 WeakPolarHBondContact O-CB 3.38Å; V261-R265 PolarHBondContact O-N 3.32Å |
| 262 | E | 95.4 | Very high | 95.9 | Very high | 118 Ų | 118 | 98.2 Ų | 98.2 | 55% | 0.551 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -60.5 | -47.7 | 174 | -72.9 | -175.6 | 168 | 0 | 0 | 111.3 | E258 M259 T260 D264 R265 H266 | E258-E262 WeakPolarHBondContact O-CG 3.47Å; E258-E262 PolarHBondContact O-N 2.72Å; M259-E262 PolarHBondContact O-N 3.23Å; T260-E262 VanDerWaalsContact C-N 3.35Å; T260-E262 PolarHBondContact O-N 2.92Å; E262-D264 VanDerWaalsContact C-N 3.35Å; E262-D264 PolarHBondContact O-N 2.87Å; E262-R265 WeakPolarHBondContact O-CB 3.31Å; E262-R265 PolarHBondContact O-N 3.19Å; E262-H266 PolarHBondContact O-CD2 2.92Å; E262-H266 PolarHBondContact O-N 3.44Å |
| 263 | Q | 95.9 | Very high | 95.9 | Very high | 122 Ų | 122 | 100.3 Ų | 100.3 | 57% | 0.57 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -59.1 | -44.5 | 177.6 | -175.2 | 175.9 | -4.3 | 0 | 0 | 111.7 | M259 T260 R265 H266 L267 | M259-Q263 WeakPolarHBondContact O-CB 3.39Å; M259-Q263 PolarHBondContact O-N 2.93Å; T260-Q263 PolarHBondContact O-N 2.86Å; Q263-R265 VanDerWaalsContact C-N 3.33Å; Q263-R265 PolarHBondContact O-N 3.45Å; Q263-H266 WeakPolarHBondContact O-CB 3.34Å; Q263-H266 PolarHBondContact O-N 2.87Å; Q263-H266 VanDerWaalsContact O-N 3.16Å; Q263-L267 HydrophobicContact CG-CD1 4.38Å; Q263-L267 HydrophobicContact CG-CG 4.49Å; Q263-L267 WeakPolarHBondContact O-CB 3.46Å; Q263-L267 WeakPolarHBondContact O-CG 3.44Å; Q263-L267 PolarHBondContact O-N 3.37Å |
| 264 | D | 95.9 | Very high | 95.8 | Very high | 89 Ų | 89 | 97.3 Ų | 97.3 | 48% | 0.476 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.2 | -38.7 | 176.6 | -78.7 | -15.9 | 0 | 0 | 0 | 112 | T260 V261 E262 H266 L267 T268 | T260-D264 PolarHBondContact O-N 3.5Å; V261-D264 PolarHBondContact O-N 2.89Å; E262-D264 VanDerWaalsContact C-N 3.35Å; E262-D264 PolarHBondContact O-N 2.87Å; D264-H266 VanDerWaalsContact C-N 3.34Å; D264-H266 PolarHBondContact O-N 2.92Å; D264-L267 PolarHBondContact O-N 3.16Å; D264-T268 WeakPolarHBondContact O-CB 3.38Å; D264-T268 VanDerWaalsContact O-CG2 3.31Å; D264-T268 WeakPolarHBondContact O-CG2 3.39Å; D264-T268 PolarHBondContact O-N 3.06Å; D264-T268 PolarHBondContact O-OG1 2.99Å |
| 265 | R | 95.3 | Very high | 95.8 | Very high | 132 Ų | 132 | 98.8 Ų | 98.8 | 50% | 0.498 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.6 | -41.9 | 173.1 | -167 | -167.2 | 68.7 | 73.9 | 2.6 | 111.4 | V261 E262 Q263 T268 Q269 | V261-R265 WeakPolarHBondContact O-CB 3.38Å; V261-R265 PolarHBondContact O-N 3.32Å; E262-R265 WeakPolarHBondContact O-CB 3.31Å; E262-R265 PolarHBondContact O-N 3.19Å; Q263-R265 VanDerWaalsContact C-N 3.33Å; Q263-R265 PolarHBondContact O-N 3.45Å; R265-T268 WeakPolarHBondContact CA-OG1 3.5Å; R265-T268 PolarHBondContact O-OG1 3.49Å; R265-Q269 WeakPolarHBondContact O-CB 3.49Å; R265-Q269 PolarHBondContact O-N 3.08Å |
| 266 | H | 95.4 | Very high | 95.7 | Very high | 99 Ų | 99 | 98 Ų | 98 | 46% | 0.458 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.2 | -44.3 | 175.6 | -79.1 | -73.2 | 0 | 0 | 0 | 111.7 | E262 Q263 D264 Q269 T270 | E262-H266 PolarHBondContact O-CD2 2.92Å; E262-H266 PolarHBondContact O-N 3.44Å; Q263-H266 WeakPolarHBondContact O-CB 3.34Å; Q263-H266 PolarHBondContact O-N 2.87Å; Q263-H266 VanDerWaalsContact O-N 3.16Å; D264-H266 VanDerWaalsContact C-N 3.34Å; D264-H266 PolarHBondContact O-N 2.92Å; H266-Q269 PolarHBondContact O-N 3.3Å; H266-T270 PolarHBondContact O-N 3.33Å; H266-T270 PolarHBondContact O-OG1 3.19Å |
| 267 | L | 95.8 | Very high | 95.6 | Very high | 82 Ų | 82 | 99.5 Ų | 99.5 | 43% | 0.429 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.7 | -45.4 | 177.6 | -75.5 | -179.9 | 0 | 0 | 0 | 112.5 | Q263 D264 Q269 T270 N271 | Q263-L267 HydrophobicContact CG-CD1 4.38Å; Q263-L267 HydrophobicContact CG-CG 4.49Å; Q263-L267 WeakPolarHBondContact O-CB 3.46Å; Q263-L267 WeakPolarHBondContact O-CG 3.44Å; Q263-L267 PolarHBondContact O-N 3.37Å; D264-L267 PolarHBondContact O-N 3.16Å; L267-Q269 VanDerWaalsContact C-N 3.35Å; L267-Q269 PolarHBondContact O-N 3.46Å; L267-T270 WeakPolarHBondContact CA-OG1 3.3Å; L267-T270 PolarHBondContact O-N 3.22Å; L267-T270 PolarHBondContact O-OG1 2.88Å; L267-N271 WeakPolarHBondContact O-CB 3.46Å; L267-N271 VanDerWaalsContact O-CG 3.24Å; L267-N271 PolarHBondContact O-N 3.27Å; L267-N271 PolarHBondContact O-ND2 3.35Å |
| 268 | T | 94.6 | Very high | 95.5 | Very high | 78 Ų | 78 | 98.2 Ų | 98.2 | 48% | 0.479 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.7 | -41.9 | 176.2 | 49.3 | 0 | 0 | 0 | 0 | 111.5 | D264 R265 T270 N271 M272 | D264-T268 WeakPolarHBondContact O-CB 3.38Å; D264-T268 VanDerWaalsContact O-CG2 3.31Å; D264-T268 WeakPolarHBondContact O-CG2 3.39Å; D264-T268 PolarHBondContact O-N 3.06Å; D264-T268 PolarHBondContact O-OG1 2.99Å; R265-T268 WeakPolarHBondContact CA-OG1 3.5Å; R265-T268 PolarHBondContact O-OG1 3.49Å; T268-T270 PolarHBondContact O-N 2.83Å; T268-N271 PolarHBondContact O-N 3.27Å; T268-M272 VanDerWaalsContact O-CG 3.3Å; T268-M272 WeakPolarHBondContact O-CG 3.43Å; T268-M272 PolarHBondContact O-N 2.78Å |
| 269 | Q | 95.4 | Very high | 95.4 | Very high | 86 Ų | 86 | 94.6 Ų | 94.6 | 40% | 0.402 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.4 | -42.1 | 174.9 | -173.9 | 180 | -2.4 | 0 | 0 | 112.1 | R265 H266 L267 K273 | R265-Q269 WeakPolarHBondContact O-CB 3.49Å; R265-Q269 PolarHBondContact O-N 3.08Å; H266-Q269 PolarHBondContact O-N 3.3Å; L267-Q269 VanDerWaalsContact C-N 3.35Å; L267-Q269 PolarHBondContact O-N 3.46Å; Q269-K273 WeakPolarHBondContact O-CG 3.37Å; Q269-K273 PolarHBondContact O-N 3.39Å |
| 270 | T | 95.8 | Very high | 95.3 | Very high | 63 Ų | 63 | 91.4 Ų | 91.4 | 39% | 0.387 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -67.7 | -39.2 | 176.3 | 49.1 | 0 | 0 | 0 | 0 | 112.3 | H266 L267 T268 M272 K273 I274 | H266-T270 PolarHBondContact O-N 3.33Å; H266-T270 PolarHBondContact O-OG1 3.19Å; L267-T270 WeakPolarHBondContact CA-OG1 3.3Å; L267-T270 PolarHBondContact O-N 3.22Å; L267-T270 PolarHBondContact O-OG1 2.88Å; T268-T270 PolarHBondContact O-N 2.83Å; T270-M272 PolarHBondContact O-N 3.21Å; T270-K273 WeakPolarHBondContact O-CB 3.36Å; T270-K273 PolarHBondContact O-N 3.2Å; T270-I274 VanDerWaalsContact O-CG1 3.31Å; T270-I274 WeakPolarHBondContact O-CG1 3.37Å; T270-I274 PolarHBondContact O-N 3.02Å |
| 271 | N | 95.4 | Very high | 95.2 | Very high | 83 Ų | 83 | 94 Ų | 94 | 44% | 0.444 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.5 | -45.6 | 176.8 | -73.2 | -22.5 | 0 | 0 | 0 | 111.2 | L267 T268 K273 I274 D275 | L267-N271 WeakPolarHBondContact O-CB 3.46Å; L267-N271 VanDerWaalsContact O-CG 3.24Å; L267-N271 PolarHBondContact O-N 3.27Å; L267-N271 PolarHBondContact O-ND2 3.35Å; T268-N271 PolarHBondContact O-N 3.27Å; N271-K273 VanDerWaalsContact C-N 3.3Å; N271-K273 PolarHBondContact O-N 2.97Å; N271-I274 PolarHBondContact O-N 3.49Å; N271-D275 PolarHBondContact O-N 3.49Å |
| 272 | M | 94.8 | Very high | 95.2 | Very high | 119 Ų | 119 | 95.1 Ų | 95.1 | 59% | 0.586 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -60.8 | -38.9 | 176.4 | -65.9 | -65.7 | 130.2 | 0 | 0 | 112.2 | T268 T270 D275 T276 | T268-M272 VanDerWaalsContact O-CG 3.3Å; T268-M272 WeakPolarHBondContact O-CG 3.43Å; T268-M272 PolarHBondContact O-N 2.78Å; T270-M272 PolarHBondContact O-N 3.21Å; M272-D275 PolarHBondContact O-N 2.93Å; M272-T276 WeakPolarHBondContact O-CG2 3.46Å; M272-T276 PolarHBondContact O-N 3.18Å; M272-T276 PolarHBondContact O-OG1 3.23Å |
| 273 | K | 96.2 | Very high | 95.1 | Very high | 111 Ų | 111 | 93.7 Ų | 93.7 | 48% | 0.483 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.9 | -47.7 | 174.5 | -73.3 | 178.8 | 179.4 | -176.9 | 0 | 111.6 | Q269 T270 N271 D275 T276 E277 | Q269-K273 WeakPolarHBondContact O-CG 3.37Å; Q269-K273 PolarHBondContact O-N 3.39Å; T270-K273 WeakPolarHBondContact O-CB 3.36Å; T270-K273 PolarHBondContact O-N 3.2Å; N271-K273 VanDerWaalsContact C-N 3.3Å; N271-K273 PolarHBondContact O-N 2.97Å; K273-D275 VanDerWaalsContact C-N 3.3Å; K273-D275 PolarHBondContact O-N 3.4Å; K273-T276 WeakPolarHBondContact CA-OG1 3.48Å; K273-T276 PolarHBondContact O-N 3.35Å; K273-T276 PolarHBondContact O-OG1 2.72Å; K273-E277 WeakPolarHBondContact O-CG 3.49Å; K273-E277 PolarHBondContact O-N 3.28Å |
| 274 | I | 95.9 | Very high | 94.9 | Very high | 89 Ų | 89 | 93.8 Ų | 93.8 | 46% | 0.456 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -56.9 | -47 | 176.7 | -67.8 | 164.2 | 0 | 0 | 0 | 109.9 | T270 N271 T276 E277 V278 | T270-I274 VanDerWaalsContact O-CG1 3.31Å; T270-I274 WeakPolarHBondContact O-CG1 3.37Å; T270-I274 PolarHBondContact O-N 3.02Å; N271-I274 PolarHBondContact O-N 3.49Å; I274-T276 VanDerWaalsContact C-N 3.34Å; I274-T276 PolarHBondContact O-N 2.87Å; I274-E277 PolarHBondContact O-N 2.94Å; I274-V278 HydrophobicContact CG2-CG2 4.13Å; I274-V278 WeakPolarHBondContact O-CB 3.28Å; I274-V278 VanDerWaalsContact O-CG2 3.23Å; I274-V278 WeakPolarHBondContact O-CG2 3.38Å; I274-V278 PolarHBondContact O-N 3.28Å |
| 275 | D | 95.4 | Very high | 94.7 | Very high | 96 Ų | 96 | 95.5 Ų | 95.5 | 51% | 0.513 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.8 | -42 | 179.3 | -70.6 | -26 | 0 | 0 | 0 | 112 | N271 M272 K273 V278 A279 | N271-D275 PolarHBondContact O-N 3.49Å; M272-D275 PolarHBondContact O-N 2.93Å; K273-D275 VanDerWaalsContact C-N 3.3Å; K273-D275 PolarHBondContact O-N 3.4Å; D275-V278 PolarHBondContact O-N 3.43Å; D275-A279 WeakPolarHBondContact O-CB 3.47Å; D275-A279 PolarHBondContact O-N 2.88Å |
| 276 | T | 94.8 | Very high | 94.6 | Very high | 95 Ų | 95 | 94.1 Ų | 94.1 | 58% | 0.583 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -66.7 | -40.3 | 176.1 | 56.3 | 0 | 0 | 0 | 0 | 113 | M272 K273 I274 A279 G280 | M272-T276 WeakPolarHBondContact O-CG2 3.46Å; M272-T276 PolarHBondContact O-N 3.18Å; M272-T276 PolarHBondContact O-OG1 3.23Å; K273-T276 WeakPolarHBondContact CA-OG1 3.48Å; K273-T276 PolarHBondContact O-N 3.35Å; K273-T276 PolarHBondContact O-OG1 2.72Å; I274-T276 VanDerWaalsContact C-N 3.34Å; I274-T276 PolarHBondContact O-N 2.87Å; T276-A279 PolarHBondContact O-N 3.49Å; T276-G280 PolarHBondContact O-N 2.9Å |
| 277 | E | 95.1 | Very high | 94.3 | Very high | 128 Ų | 128 | 91.9 Ų | 91.9 | 60% | 0.598 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -67.4 | -41.3 | 176.5 | -73.5 | 179.1 | -168.3 | 0 | 0 | 111.2 | K273 I274 G280 L281 | K273-E277 WeakPolarHBondContact O-CG 3.49Å; K273-E277 PolarHBondContact O-N 3.28Å; I274-E277 PolarHBondContact O-N 2.94Å; E277-G280 PolarHBondContact O-N 2.79Å; E277-L281 WeakPolarHBondContact O-CB 3.31Å; E277-L281 VanDerWaalsContact O-CG 3.3Å; E277-L281 WeakPolarHBondContact O-CG 3.4Å; E277-L281 PolarHBondContact O-N 3.27Å |
| 278 | V | 95.4 | Very high | 94.1 | Very high | 86 Ų | 86 | 94 Ų | 94 | 52% | 0.521 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.5 | -44.9 | 175.5 | 169.1 | 0 | 0 | 0 | 0 | 110.9 | I274 D275 K282 | I274-V278 HydrophobicContact CG2-CG2 4.13Å; I274-V278 WeakPolarHBondContact O-CB 3.28Å; I274-V278 VanDerWaalsContact O-CG2 3.23Å; I274-V278 WeakPolarHBondContact O-CG2 3.38Å; I274-V278 PolarHBondContact O-N 3.28Å; D275-V278 PolarHBondContact O-N 3.43Å; V278-K282 VanDerWaalsContact O-CB 3.28Å; V278-K282 WeakPolarHBondContact O-CB 3.23Å; V278-K282 PolarHBondContact O-N 2.94Å |
| 279 | A | 93.1 | Very high | 94.1 | Very high | 53 Ų | 53 | 97 Ų | 97 | 44% | 0.438 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.6 | -44.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | D275 T276 K282 T283 | D275-A279 WeakPolarHBondContact O-CB 3.47Å; D275-A279 PolarHBondContact O-N 2.88Å; T276-A279 PolarHBondContact O-N 3.49Å; A279-K282 WeakPolarHBondContact O-CB 3.3Å; A279-K282 PolarHBondContact O-N 2.91Å; A279-T283 WeakPolarHBondContact O-CG2 3.24Å; A279-T283 PolarHBondContact O-N 2.72Å |
| 280 | G | 94.1 | Very high | 94 | Very high | 32 Ų | 32 | 97.8 Ų | 97.8 | 33% | 0.33 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -58.5 | -52.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | T276 E277 K282 T283 M284 | T276-G280 PolarHBondContact O-N 2.9Å; E277-G280 PolarHBondContact O-N 2.79Å; G280-K282 VanDerWaalsContact C-N 3.28Å; G280-K282 PolarHBondContact O-N 2.82Å; G280-T283 PolarHBondContact O-N 3.17Å; G280-T283 VanDerWaalsContact O-N 3.17Å; G280-T283 PolarHBondContact O-OG1 3.34Å; G280-M284 PolarHBondContact O-N 2.96Å |
| 281 | L | 94.5 | Very high | 93.9 | Very high | 112 Ų | 112 | 97.7 Ų | 97.7 | 59% | 0.586 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -58.6 | -39.5 | 175.8 | -72.3 | 174.8 | 0 | 0 | 0 | 111.9 | E277 M284 L285 | E277-L281 WeakPolarHBondContact O-CB 3.31Å; E277-L281 VanDerWaalsContact O-CG 3.3Å; E277-L281 WeakPolarHBondContact O-CG 3.4Å; E277-L281 PolarHBondContact O-N 3.27Å; L281-M284 PolarHBondContact O-N 2.88Å; L281-L285 WeakPolarHBondContact O-CB 3.4Å; L281-L285 PolarHBondContact O-N 2.85Å |
| 282 | K | 94.9 | Very high | 93.7 | Very high | 125 Ų | 125 | 97.2 Ų | 97.2 | 54% | 0.543 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.5 | -45.5 | 175.4 | -175.4 | 177.9 | 177.9 | -177 | 0 | 112 | V278 A279 G280 M284 L285 E286 | V278-K282 VanDerWaalsContact O-CB 3.28Å; V278-K282 WeakPolarHBondContact O-CB 3.23Å; V278-K282 PolarHBondContact O-N 2.94Å; A279-K282 WeakPolarHBondContact O-CB 3.3Å; A279-K282 PolarHBondContact O-N 2.91Å; G280-K282 VanDerWaalsContact C-N 3.28Å; G280-K282 PolarHBondContact O-N 2.82Å; K282-M284 VanDerWaalsContact C-N 3.34Å; K282-M284 PolarHBondContact O-N 2.88Å; K282-L285 WeakPolarHBondContact O-CB 3.38Å; K282-L285 PolarHBondContact O-N 3.34Å; K282-E286 VanDerWaalsContact CE-OE1 3.24Å; K282-E286 WeakPolarHBondContact CE-OE1 3.49Å; K282-E286 WeakPolarHBondContact O-CG 3.48Å; K282-E286 PolarHBondContact O-N 3.44Å |
| 283 | T | 93.3 | Very high | 93.6 | Very high | 88 Ų | 88 | 96 Ų | 96 | 54% | 0.54 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.8 | -39.2 | 176.4 | 61.3 | 0 | 0 | 0 | 0 | 112.3 | A279 G280 E286 S287 | A279-T283 WeakPolarHBondContact O-CG2 3.24Å; A279-T283 PolarHBondContact O-N 2.72Å; G280-T283 PolarHBondContact O-N 3.17Å; G280-T283 VanDerWaalsContact O-N 3.17Å; G280-T283 PolarHBondContact O-OG1 3.34Å; T283-E286 PolarHBondContact O-N 2.89Å; T283-S287 PolarHBondContact O-N 3.28Å; T283-S287 PolarHBondContact O-OG 3.48Å |
| 284 | M | 91.1 | Very high | 93.3 | Very high | 124 Ų | 124 | 97.1 Ų | 97.1 | 61% | 0.611 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.8 | -38.3 | 175.8 | -173 | -173.4 | -70.6 | 0 | 0 | 111.7 | G280 L281 K282 S287 H288 | G280-M284 PolarHBondContact O-N 2.96Å; L281-M284 PolarHBondContact O-N 2.88Å; K282-M284 VanDerWaalsContact C-N 3.34Å; K282-M284 PolarHBondContact O-N 2.88Å; M284-S287 WeakPolarHBondContact CA-OG 3.33Å; M284-S287 PolarHBondContact O-OG 3Å; M284-H288 WeakPolarHBondContact O-CB 3.47Å; M284-H288 PolarHBondContact O-N 2.86Å |
| 285 | L | 92.7 | Very high | 93.2 | Very high | 125 Ų | 125 | 101.6 Ų | 101.6 | 65% | 0.654 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65.4 | -45.1 | 174.1 | -174.2 | 77.3 | 0 | 0 | 0 | 111.1 | L281 K282 H288 K289 | L281-L285 WeakPolarHBondContact O-CB 3.4Å; L281-L285 PolarHBondContact O-N 2.85Å; K282-L285 WeakPolarHBondContact O-CB 3.38Å; K282-L285 PolarHBondContact O-N 3.34Å; L285-H288 PolarHBondContact O-N 3.37Å; L285-K289 WeakPolarHBondContact O-CB 3.34Å; L285-K289 PolarHBondContact O-N 3.46Å |
| 286 | E | 92.4 | Very high | 93 | Very high | 102 Ų | 102 | 102.5 Ų | 102.5 | 48% | 0.477 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.3 | -42.6 | 177.2 | -75.4 | 176.3 | -171.3 | 0 | 0 | 111.3 | K282 T283 K289 L290 | K282-E286 VanDerWaalsContact CE-OE1 3.24Å; K282-E286 WeakPolarHBondContact CE-OE1 3.49Å; K282-E286 WeakPolarHBondContact O-CG 3.48Å; K282-E286 PolarHBondContact O-N 3.44Å; T283-E286 PolarHBondContact O-N 2.89Å; E286-K289 PolarHBondContact O-N 3.14Å; E286-L290 WeakPolarHBondContact O-CG 3.35Å; E286-L290 PolarHBondContact O-N 2.93Å |
| 287 | S | 89.8 | Confident | 92.9 | Very high | 52 Ų | 52 | 100.9 Ų | 100.9 | 36% | 0.364 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.9 | -44.4 | 175 | 69.3 | 0 | 0 | 0 | 0 | 111.9 | T283 M284 K289 L290 D291 | T283-S287 PolarHBondContact O-N 3.28Å; T283-S287 PolarHBondContact O-OG 3.48Å; M284-S287 WeakPolarHBondContact CA-OG 3.33Å; M284-S287 PolarHBondContact O-OG 3Å; S287-K289 VanDerWaalsContact C-N 3.31Å; S287-K289 PolarHBondContact O-N 3Å; S287-L290 PolarHBondContact O-N 3.38Å; S287-L290 VanDerWaalsContact O-N 3.14Å; S287-D291 PolarHBondContact O-N 3.35Å |
| 288 | H | 92.6 | Very high | 92.8 | Very high | 126 Ų | 126 | 96.5 Ų | 96.5 | 58% | 0.583 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.7 | -38.9 | 177.3 | -175.1 | -88.8 | 0 | 0 | 0 | 112.2 | M284 L285 D291 T292 | M284-H288 WeakPolarHBondContact O-CB 3.47Å; M284-H288 PolarHBondContact O-N 2.86Å; L285-H288 PolarHBondContact O-N 3.37Å; H288-D291 PolarHBondContact O-N 2.95Å; H288-T292 WeakPolarHBondContact O-CB 3.37Å; H288-T292 PolarHBondContact O-N 3.11Å; H288-T292 PolarHBondContact O-OG1 3.1Å |
| 289 | K | 94.2 | Very high | 92.7 | Very high | 142 Ų | 142 | 95.9 Ų | 95.9 | 62% | 0.617 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.8 | -46.1 | 173.2 | -178.1 | -178.7 | 177.5 | -178.5 | 0 | 111.3 | L285 E286 S287 T292 I293 | L285-K289 WeakPolarHBondContact O-CB 3.34Å; L285-K289 PolarHBondContact O-N 3.46Å; E286-K289 PolarHBondContact O-N 3.14Å; S287-K289 VanDerWaalsContact C-N 3.31Å; S287-K289 PolarHBondContact O-N 3Å; K289-T292 PolarHBondContact O-N 3.37Å; K289-I293 HydrophobicContact CG-CD1 4.25Å; K289-I293 VanDerWaalsContact O-CG1 3.32Å; K289-I293 WeakPolarHBondContact O-CG1 3.48Å; K289-I293 PolarHBondContact O-N 3.35Å; K289-I293 VanDerWaalsContact O-N 3.1Å |
| 290 | L | 92.9 | Very high | 92.6 | Very high | 102 Ų | 102 | 97 Ų | 97 | 53% | 0.534 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64 | -41.2 | 178.1 | -69.8 | 175.9 | 0 | 0 | 0 | 112 | E286 S287 I293 K294 | E286-L290 WeakPolarHBondContact O-CG 3.35Å; E286-L290 PolarHBondContact O-N 2.93Å; S287-L290 PolarHBondContact O-N 3.38Å; S287-L290 VanDerWaalsContact O-N 3.14Å; L290-I293 PolarHBondContact O-N 3.48Å; L290-K294 WeakPolarHBondContact O-CG 3.03Å; L290-K294 PolarHBondContact O-N 2.81Å |
| 291 | D | 92.9 | Very high | 92.5 | Very high | 61 Ų | 61 | 102.3 Ų | 102.3 | 33% | 0.326 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67.6 | -41.1 | 178.7 | -70.6 | -19.9 | 0 | 0 | 0 | 111.7 | S287 H288 I293 K294 Y295 | S287-D291 PolarHBondContact O-N 3.35Å; H288-D291 PolarHBondContact O-N 2.95Å; D291-I293 VanDerWaalsContact C-N 3.29Å; D291-I293 PolarHBondContact O-N 2.87Å; D291-K294 WeakPolarHBondContact O-CB 3.32Å; D291-K294 PolarHBondContact O-N 2.96Å; D291-K294 VanDerWaalsContact O-N 3.11Å; D291-K294 IonicContact OD1-NZ 3.88Å; D291-K294 PolarHBondContact OD1-NZ 3.43Å; D291-Y295 HydrophobicContact CB-CD2 4.35Å; D291-Y295 HydrophobicContact CB-CE2 4.13Å; D291-Y295 WeakPolarHBondContact O-CD2 3.31Å; D291-Y295 PolarHBondContact O-N 2.9Å |
| 292 | T | 91.3 | Very high | 92.4 | Very high | 74 Ų | 74 | 101 Ų | 101 | 45% | 0.454 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -57 | -43.5 | 172.5 | -56 | 0 | 0 | 0 | 0 | 111.4 | H288 K289 Y295 L296 | H288-T292 WeakPolarHBondContact O-CB 3.37Å; H288-T292 PolarHBondContact O-N 3.11Å; H288-T292 PolarHBondContact O-OG1 3.1Å; K289-T292 PolarHBondContact O-N 3.37Å; T292-Y295 PolarHBondContact O-N 2.97Å; T292-L296 VanDerWaalsContact O-CB 3.31Å; T292-L296 WeakPolarHBondContact O-CB 3.44Å; T292-L296 PolarHBondContact O-N 3.29Å |
| 293 | I | 92.8 | Very high | 92.1 | Very high | 94 Ų | 94 | 98.6 Ų | 98.6 | 48% | 0.482 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.7 | -43.5 | 176 | -68.4 | 166.6 | 0 | 0 | 0 | 111 | K289 L290 D291 L296 A297 | K289-I293 HydrophobicContact CG-CD1 4.25Å; K289-I293 VanDerWaalsContact O-CG1 3.32Å; K289-I293 WeakPolarHBondContact O-CG1 3.48Å; K289-I293 PolarHBondContact O-N 3.35Å; K289-I293 VanDerWaalsContact O-N 3.1Å; L290-I293 PolarHBondContact O-N 3.48Å; D291-I293 VanDerWaalsContact C-N 3.29Å; D291-I293 PolarHBondContact O-N 2.87Å; I293-L296 PolarHBondContact O-N 2.96Å; I293-A297 WeakPolarHBondContact O-CB 3.31Å; I293-A297 PolarHBondContact O-N 2.98Å |
| 294 | K | 89.8 | Confident | 91.9 | Very high | 133 Ų | 133 | 99 Ų | 99 | 58% | 0.578 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.7 | -47.4 | 177.3 | -69.8 | 171.2 | -167 | 159 | 0 | 112.3 | L290 D291 L296 A297 G298 | L290-K294 WeakPolarHBondContact O-CG 3.03Å; L290-K294 PolarHBondContact O-N 2.81Å; D291-K294 WeakPolarHBondContact O-CB 3.32Å; D291-K294 PolarHBondContact O-N 2.96Å; D291-K294 VanDerWaalsContact O-N 3.11Å; D291-K294 IonicContact OD1-NZ 3.88Å; D291-K294 PolarHBondContact OD1-NZ 3.43Å; K294-L296 VanDerWaalsContact C-N 3.33Å; K294-L296 PolarHBondContact O-N 3.48Å; K294-A297 PolarHBondContact O-N 2.98Å; K294-G298 PolarHBondContact O-N 3.46Å |
| 295 | Y | 93.4 | Very high | 91.8 | Very high | 183 Ų | 183 | 96.7 Ų | 96.7 | 72% | 0.718 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.6 | -39.1 | 178.8 | -73.7 | -63.3 | 0 | 0 | 0 | 111.8 | D291 T292 G298 S299 | D291-Y295 HydrophobicContact CB-CD2 4.35Å; D291-Y295 HydrophobicContact CB-CE2 4.13Å; D291-Y295 WeakPolarHBondContact O-CD2 3.31Å; D291-Y295 PolarHBondContact O-N 2.9Å; T292-Y295 PolarHBondContact O-N 2.97Å; Y295-G298 PolarHBondContact O-N 2.98Å; Y295-S299 WeakPolarHBondContact O-CB 3.45Å; Y295-S299 PolarHBondContact O-N 2.91Å |
| 296 | L | 92.5 | Very high | 91.7 | Very high | 116 Ų | 116 | 94.7 Ų | 94.7 | 61% | 0.607 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.1 | -50.2 | 174.6 | -177.2 | 68.7 | 0 | 0 | 0 | 111.3 | T292 I293 K294 G298 S299 V300 | T292-L296 VanDerWaalsContact O-CB 3.31Å; T292-L296 WeakPolarHBondContact O-CB 3.44Å; T292-L296 PolarHBondContact O-N 3.29Å; I293-L296 PolarHBondContact O-N 2.96Å; K294-L296 VanDerWaalsContact C-N 3.33Å; K294-L296 PolarHBondContact O-N 3.48Å; L296-G298 VanDerWaalsContact C-N 3.33Å; L296-G298 PolarHBondContact O-N 3.49Å; L296-S299 PolarHBondContact O-N 3.46Å; L296-V300 WeakPolarHBondContact O-CG2 3.41Å; L296-V300 PolarHBondContact O-N 3.35Å |
| 297 | A | 92.7 | Very high | 91.5 | Very high | 60 Ų | 60 | 94 Ų | 94 | 50% | 0.496 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.7 | -43.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | I293 K294 V300 F301 | I293-A297 WeakPolarHBondContact O-CB 3.31Å; I293-A297 PolarHBondContact O-N 2.98Å; K294-A297 PolarHBondContact O-N 2.98Å; A297-V300 PolarHBondContact O-N 3.26Å; A297-F301 VanDerWaalsContact O-CB 3.31Å; A297-F301 WeakPolarHBondContact O-CB 3.35Å; A297-F301 PolarHBondContact O-N 3.48Å |
| 298 | G | 92.9 | Very high | 91.4 | Very high | 36 Ų | 36 | 97 Ų | 97 | 37% | 0.371 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.5 | -45.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | K294 Y295 L296 F301 T302 | K294-G298 PolarHBondContact O-N 3.46Å; Y295-G298 PolarHBondContact O-N 2.98Å; L296-G298 VanDerWaalsContact C-N 3.33Å; L296-G298 PolarHBondContact O-N 3.49Å; G298-F301 PolarHBondContact O-N 3.47Å; G298-T302 WeakPolarHBondContact O-CG2 3.37Å; G298-T302 PolarHBondContact O-N 3.16Å; G298-T302 PolarHBondContact O-OG1 2.88Å |
| 299 | S | 92 | Very high | 91.1 | Very high | 74 Ų | 74 | 92.7 Ų | 92.7 | 52% | 0.517 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.4 | -43 | 178.5 | -177.3 | 0 | 0 | 0 | 0 | 112.8 | Y295 L296 F301 T302 C303 | Y295-S299 WeakPolarHBondContact O-CB 3.45Å; Y295-S299 PolarHBondContact O-N 2.91Å; L296-S299 PolarHBondContact O-N 3.46Å; S299-F301 VanDerWaalsContact C-N 3.33Å; S299-F301 PolarHBondContact O-N 3.49Å; S299-T302 WeakPolarHBondContact CA-OG1 3.23Å; S299-T302 PolarHBondContact O-N 3.44Å; S299-T302 PolarHBondContact O-OG1 2.92Å; S299-C303 VanDerWaalsContact O-CB 3.23Å; S299-C303 WeakPolarHBondContact O-CB 3.41Å; S299-C303 PolarHBondContact O-N 2.98Å |
| 300 | V | 92.4 | Very high | 90.7 | Very high | 77 Ų | 77 | 92.9 Ų | 92.9 | 47% | 0.467 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.1 | -40.6 | 175.8 | 175.5 | 0 | 0 | 0 | 0 | 110.6 | L296 A297 C303 L304 | L296-V300 WeakPolarHBondContact O-CG2 3.41Å; L296-V300 PolarHBondContact O-N 3.35Å; A297-V300 PolarHBondContact O-N 3.26Å; V300-C303 PolarHBondContact O-N 2.75Å; V300-L304 HydrophobicContact CG1-CD1 4Å; V300-L304 HydrophobicContact CG1-CG 4.47Å; V300-L304 WeakPolarHBondContact O-CB 3.31Å; V300-L304 VanDerWaalsContact O-CG 3.31Å; V300-L304 WeakPolarHBondContact O-CG 3.4Å; V300-L304 PolarHBondContact O-N 2.9Å |
| 301 | F | 92.3 | Very high | 90.4 | Very high | 143 Ų | 143 | 95.7 Ų | 95.7 | 63% | 0.627 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -67.4 | -40.9 | 178.4 | -169.3 | -98.5 | 0 | 0 | 0 | 112.8 | A297 G298 S299 L304 T305 | A297-F301 VanDerWaalsContact O-CB 3.31Å; A297-F301 WeakPolarHBondContact O-CB 3.35Å; A297-F301 PolarHBondContact O-N 3.48Å; G298-F301 PolarHBondContact O-N 3.47Å; S299-F301 VanDerWaalsContact C-N 3.33Å; S299-F301 PolarHBondContact O-N 3.49Å; F301-L304 PolarHBondContact O-N 3.32Å; F301-T305 WeakPolarHBondContact O-CB 3.33Å; F301-T305 PolarHBondContact O-N 2.89Å; F301-T305 PolarHBondContact O-OG1 3.48Å |
| 302 | T | 91.1 | Very high | 89.8 | Confident | 83 Ų | 83 | 102.9 Ų | 102.9 | 51% | 0.509 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -67.4 | -40.6 | 174.6 | 55.2 | 0 | 0 | 0 | 0 | 111.3 | G298 S299 T305 V306 | G298-T302 WeakPolarHBondContact O-CG2 3.37Å; G298-T302 PolarHBondContact O-N 3.16Å; G298-T302 PolarHBondContact O-OG1 2.88Å; S299-T302 WeakPolarHBondContact CA-OG1 3.23Å; S299-T302 PolarHBondContact O-N 3.44Å; S299-T302 PolarHBondContact O-OG1 2.92Å; T302-T305 PolarHBondContact O-N 2.89Å; T302-V306 WeakPolarHBondContact O-CG2 3.48Å; T302-V306 PolarHBondContact O-N 2.91Å |
| 303 | C | 88.2 | Confident | 89.3 | Confident | 75 Ų | 75 | 106.3 Ų | 106.3 | 51% | 0.507 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -58.9 | -49.1 | 173.6 | -174.9 | 0 | 0 | 0 | 0 | 111.5 | S299 V300 T305 V306 V307 | S299-C303 VanDerWaalsContact O-CB 3.23Å; S299-C303 WeakPolarHBondContact O-CB 3.41Å; S299-C303 PolarHBondContact O-N 2.98Å; V300-C303 PolarHBondContact O-N 2.75Å; C303-T305 VanDerWaalsContact C-N 3.31Å; C303-T305 PolarHBondContact O-N 3.44Å; C303-V306 PolarHBondContact O-N 3.23Å; C303-V307 WeakPolarHBondContact O-CG2 3.3Å; C303-V307 PolarHBondContact O-N 3.36Å |
| 304 | L | 90.3 | Very high | 88.4 | Confident | 97 Ų | 97 | 113.1 Ų | 113.1 | 51% | 0.508 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -58.4 | -42.2 | 174.6 | -77.3 | 168.1 | 0 | 0 | 0 | 112.1 | V300 F301 V307 L308 | V300-L304 HydrophobicContact CG1-CD1 4Å; V300-L304 HydrophobicContact CG1-CG 4.47Å; V300-L304 WeakPolarHBondContact O-CB 3.31Å; V300-L304 VanDerWaalsContact O-CG 3.31Å; V300-L304 WeakPolarHBondContact O-CG 3.4Å; V300-L304 PolarHBondContact O-N 2.9Å; F301-L304 PolarHBondContact O-N 3.32Å; L304-V307 PolarHBondContact O-N 3.49Å; L304-L308 WeakPolarHBondContact O-CB 3.34Å; L304-L308 VanDerWaalsContact O-CG 3.3Å; L304-L308 WeakPolarHBondContact O-CG 3.35Å; L304-L308 PolarHBondContact O-N 2.94Å |
| 305 | T | 89.6 | Confident | 86.9 | Confident | 75 Ų | 75 | 116.1 Ų | 116.1 | 46% | 0.46 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -63.1 | -42.2 | 178 | -57.5 | 0 | 0 | 0 | 0 | 111.6 | F301 T302 C303 L308 G309 | F301-T305 WeakPolarHBondContact O-CB 3.33Å; F301-T305 PolarHBondContact O-N 2.89Å; F301-T305 PolarHBondContact O-OG1 3.48Å; T302-T305 PolarHBondContact O-N 2.89Å; C303-T305 VanDerWaalsContact C-N 3.31Å; C303-T305 PolarHBondContact O-N 3.44Å; T305-L308 PolarHBondContact O-N 2.9Å; T305-G309 PolarHBondContact O-N 3.3Å |
| 306 | V | 90.3 | Very high | 86.5 | Confident | 83 Ų | 83 | 112.8 Ų | 112.8 | 50% | 0.503 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -63.7 | -47.5 | 175.8 | 171.6 | 0 | 0 | 0 | 0 | 110.6 | T302 C303 L308 G309 F310 | T302-V306 WeakPolarHBondContact O-CG2 3.48Å; T302-V306 PolarHBondContact O-N 2.91Å; C303-V306 PolarHBondContact O-N 3.23Å; V306-L308 PolarHBondContact O-N 3.23Å; V306-G309 PolarHBondContact O-N 3.3Å; V306-G309 VanDerWaalsContact O-N 3.17Å; V306-F310 HydrophobicContact CG1-CD2 3.69Å; V306-F310 HydrophobicContact CG1-CE2 3.7Å; V306-F310 WeakPolarHBondContact O-CD2 3.41Å; V306-F310 PolarHBondContact O-N 3.39Å |
| 307 | V | 88.7 | Confident | 86.2 | Confident | 87 Ų | 87 | 112.6 Ų | 112.6 | 53% | 0.527 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -59.2 | -45.4 | 177.7 | 172.4 | 0 | 0 | 0 | 0 | 111.3 | C303 L304 F310 Y311 | C303-V307 WeakPolarHBondContact O-CG2 3.3Å; C303-V307 PolarHBondContact O-N 3.36Å; L304-V307 PolarHBondContact O-N 3.49Å; V307-F310 PolarHBondContact O-N 3.17Å; V307-Y311 WeakPolarHBondContact O-CB 3.44Å; V307-Y311 PolarHBondContact O-N 2.86Å |
| 308 | L | 86.4 | Confident | 85.8 | Confident | 116 Ų | 116 | 115.6 Ų | 115.6 | 61% | 0.607 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -65.2 | -37.4 | 175.9 | -72.4 | 170.7 | 0 | 0 | 0 | 112.4 | L304 T305 V306 Y311 R312 | L304-L308 WeakPolarHBondContact O-CB 3.34Å; L304-L308 VanDerWaalsContact O-CG 3.3Å; L304-L308 WeakPolarHBondContact O-CG 3.35Å; L304-L308 PolarHBondContact O-N 2.94Å; T305-L308 PolarHBondContact O-N 2.9Å; V306-L308 PolarHBondContact O-N 3.23Å; L308-Y311 PolarHBondContact O-N 3Å; L308-R312 WeakPolarHBondContact O-CB 3.43Å; L308-R312 PolarHBondContact O-N 3.39Å |
| 309 | G | 87.3 | Confident | 85.4 | Confident | 35 Ų | 35 | 120.2 Ų | 120.2 | 36% | 0.361 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -62.1 | -45.2 | 174 | 0 | 0 | 0 | 0 | 0 | 112.6 | T305 V306 R312 I313 | T305-G309 PolarHBondContact O-N 3.3Å; V306-G309 PolarHBondContact O-N 3.3Å; V306-G309 VanDerWaalsContact O-N 3.17Å; G309-R312 PolarHBondContact O-N 3.14Å; G309-I313 PolarHBondContact O-N 3.15Å |
| 310 | F | 85.5 | Confident | 85 | Confident | 147 Ų | 147 | 123.1 Ų | 123.1 | 65% | 0.645 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -63.8 | -43.5 | 173.8 | -88.7 | -76 | 0 | 0 | 0 | 112.2 | V306 V307 R312 I313 W314 | V306-F310 HydrophobicContact CG1-CD2 3.69Å; V306-F310 HydrophobicContact CG1-CE2 3.7Å; V306-F310 WeakPolarHBondContact O-CD2 3.41Å; V306-F310 PolarHBondContact O-N 3.39Å; V307-F310 PolarHBondContact O-N 3.17Å; F310-R312 PolarHBondContact O-N 3.23Å; F310-I313 PolarHBondContact O-N 3.38Å; F310-I313 VanDerWaalsContact O-N 3.14Å; F310-W314 PolarHBondContact O-N 3.42Å; F310-W314 VanDerWaalsContact O-N 3.15Å |
| 311 | Y | 86.5 | Confident | 84.5 | Confident | 161 Ų | 161 | 126.2 Ų | 126.2 | 63% | 0.631 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -58.6 | -36.6 | 176.2 | -174.1 | -99.4 | 0 | 0 | 0 | 111.9 | V307 L308 W314 M315 | V307-Y311 WeakPolarHBondContact O-CB 3.44Å; V307-Y311 PolarHBondContact O-N 2.86Å; L308-Y311 PolarHBondContact O-N 3Å; Y311-W314 PolarHBondContact O-N 2.92Å; Y311-M315 PolarHBondContact O-N 3.49Å |
| 312 | R | 80.1 | Confident | 84 | Confident | 212 Ų | 212 | 125 Ų | 125 | 80% | 0.8 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -72 | -26.5 | 177.3 | -164.8 | -176.4 | -178.6 | 127.6 | 2.2 | 114.3 | L308 G309 F310 | L308-R312 WeakPolarHBondContact O-CB 3.43Å; L308-R312 PolarHBondContact O-N 3.39Å; G309-R312 PolarHBondContact O-N 3.14Å; F310-R312 PolarHBondContact O-N 3.23Å |
| 313 | I | 80.7 | Confident | 83.4 | Confident | 146 Ų | 146 | 128.2 Ų | 128.2 | 75% | 0.749 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -82.4 | -25.8 | 176 | -109 | 90.2 | 0 | 0 | 0 | 112 | G309 F310 | G309-I313 PolarHBondContact O-N 3.15Å; F310-I313 PolarHBondContact O-N 3.38Å; F310-I313 VanDerWaalsContact O-N 3.14Å |
| 314 | W | 73.7 | Confident | 83 | Confident | 236 Ų | 236 | 132.7 Ų | 132.7 | 89% | 0.894 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -88.2 | -16.3 | -176 | -172.4 | -84.8 | 0 | 0 | 0 | 113.8 | F310 Y311 | F310-W314 PolarHBondContact O-N 3.42Å; F310-W314 VanDerWaalsContact O-N 3.15Å; Y311-W314 PolarHBondContact O-N 2.92Å |
| 315 | M | 57.4 | Low | 82.4 | Confident | 197 Ų | 197 | 135.9 Ų | 135.9 | 97% | 0.97 | 65% | 0.65 | S | S | * | * | trans | -100.3 | 0 | 175 | -143.5 | -91.8 | -91.4 | 0 | 0 | 110 | Y311 | Y311-M315 PolarHBondContact O-N 3.49Š|
Retrieved 315 of 315 residues in 107.9 ms
(Link to these results)