| 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 | 38.9 | Very low | 35.6 | Very low | 240 Ų | 240 | 138.6 Ų | 138.6 | 100% | 1.182 | 84% | 0.843 | S | S | * | * | 0 | 103.4 | 0 | -61.2 | 175.1 | 178.7 | 0 | 0 | 104.5 | |||||
| 2 | T | 37.3 | Very low | 35.2 | Very low | 123 Ų | 123 | 142.4 Ų | 142.4 | 76% | 0.755 | 85% | 0.848 | S | S | * | * | cis | -160.6 | 142.1 | 36 | 37.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 3 | D | 34.3 | Very low | 34.9 | Very low | 156 Ų | 156 | 144.9 Ų | 144.9 | 83% | 0.834 | 85% | 0.846 | S | S | * | * | trans | 26.2 | 131.6 | 149.5 | -48.5 | -34.8 | 0 | 0 | 0 | 119.8 | ||||
| 4 | G | 32 | Very low | 34.8 | Very low | 64 Ų | 64 | 145.8 Ų | 145.8 | 66% | 0.66 | 84% | 0.843 | S | S | * | * | cis | 97.9 | 114.1 | 33.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 5 | I | 38.9 | Very low | 34.6 | Very low | 176 Ų | 176 | 143.2 Ų | 143.2 | 90% | 0.903 | 83% | 0.833 | S | S | * | * | trans | 147.7 | 110.3 | 144.9 | -73.1 | 155.9 | 0 | 0 | 0 | 111.7 | ||||
| 6 | L | 41.4 | Very low | 34.8 | Very low | 164 Ų | 164 | 144.6 Ų | 144.6 | 86% | 0.859 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 131.9 | 171.1 | -162.2 | 73.9 | 0 | 0 | 0 | 108.9 | K8 | L6-K8 PolarHBondContact O-N 3.13Š|
| 7 | G | 32.9 | Very low | 34.7 | Very low | 79 Ų | 79 | 146.9 Ų | 146.9 | 81% | 0.814 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 125.3 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 8 | K | 35.6 | Very low | 34.5 | Very low | 204 Ų | 204 | 142.7 Ų | 142.7 | 89% | 0.887 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -90.4 | 128.7 | 170.5 | -72.6 | -177.1 | 173.9 | -178.9 | 0 | 109.7 | L6 | L6-K8 PolarHBondContact O-N 3.13Š|
| 9 | A | 33.4 | Very low | 34.4 | Very low | 97 Ų | 97 | 144.6 Ų | 144.6 | 80% | 0.802 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 132 | 167.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||
| 10 | A | 33.8 | Very low | 34.1 | Very low | 99 Ų | 99 | 141.2 Ų | 141.2 | 82% | 0.818 | 83% | 0.833 | S | S | * | * | trans | -90.1 | 105 | 175 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 11 | T | 32.5 | Very low | 34.2 | Very low | 123 Ų | 123 | 144.3 Ų | 144.3 | 76% | 0.755 | 84% | 0.84 | S | S | * | * | trans | -74.9 | 116.1 | 161.6 | -34.2 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 12 | M | 31.3 | Very low | 33.9 | Very low | 184 Ų | 184 | 137.8 Ų | 137.8 | 91% | 0.906 | 82% | 0.824 | S | S | * | * | trans | -91.3 | 104.1 | 168.4 | -93.3 | -174.6 | -179.5 | 0 | 0 | 108.8 | ||||
| 13 | E | 31.6 | Very low | 33.6 | Very low | 175 Ų | 175 | 143.6 Ų | 143.6 | 82% | 0.818 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 133.1 | 163.9 | -65.4 | -178.2 | 168.6 | 0 | 0 | 109 | ||
| 14 | I | 33 | Very low | 33.5 | Very low | 157 Ų | 157 | 145.8 Ų | 145.8 | 81% | 0.805 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -92.8 | 118.7 | 175.5 | -59.1 | 173.5 | 0 | 0 | 0 | 107.8 | ||
| 15 | P | 32.5 | Very low | 33.6 | Very low | 107 Ų | 107 | 149.8 Ų | 149.8 | 70% | 0.695 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -76 | 136.2 | 177.3 | -11.7 | 27.5 | 0 | 0 | 0 | 112 | ||
| 16 | I | 36.5 | Very low | 33.5 | Very low | 166 Ų | 166 | 147.5 Ų | 147.5 | 85% | 0.851 | 84% | 0.84 | S | S | * | * | trans | -94.2 | 113.6 | 169.7 | -54.8 | -178.3 | 0 | 0 | 0 | 108.7 | ||||
| 17 | H | 33.8 | Very low | 33.5 | Very low | 183 Ų | 183 | 147 Ų | 147 | 85% | 0.847 | 83% | 0.833 | S | S | * | * | trans | -131.9 | 131.8 | 157.9 | -79.9 | -77.7 | 0 | 0 | 0 | 105.1 | ||||
| 18 | G | 30.5 | Very low | 34.2 | Very low | 72 Ų | 72 | 149.1 Ų | 149.1 | 74% | 0.742 | 83% | 0.826 | S | S | * | * | cis | 113.8 | 101 | 39.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 19 | N | 33.2 | Very low | 34.9 | Very low | 178 Ų | 178 | 144.1 Ų | 144.1 | 95% | 0.952 | 81% | 0.808 | S | S | * | * | trans | -14.5 | 134.2 | -178.4 | -88.7 | 8.2 | 0 | 0 | 0 | 119.8 | ||||
| 20 | G | 28.9 | Very low | 36.1 | Very low | 76 Ų | 76 | 141.6 Ų | 141.6 | 78% | 0.784 | 79% | 0.792 | S | S | * | * | trans | 165.8 | 99.6 | 157.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 21 | E | 35.8 | Very low | 36.8 | Very low | 207 Ų | 207 | 142.4 Ų | 142.4 | 97% | 0.967 | 78% | 0.782 | S | S | * | * | trans | 36.6 | 106.4 | 157.3 | -66.5 | -178 | 132.6 | 0 | 0 | 120.1 | ||||
| 22 | A | 31.8 | Very low | 37.8 | Very low | 104 Ų | 104 | 141.9 Ų | 141.9 | 86% | 0.86 | 77% | 0.771 | S | S | * | * | trans | -120.1 | 125.2 | 160.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 23 | R | 31.4 | Very low | 39.1 | Very low | 245 Ų | 245 | 139.4 Ų | 139.4 | 93% | 0.925 | 76% | 0.757 | S | S | * | * | trans | -29.6 | 128.8 | 173.3 | -73.1 | 165.8 | 166.7 | 169.6 | -4.8 | 115.3 | L25 | R23-L25 PolarHBondContact O-N 2.81Š| ||
| 24 | Q | 31.9 | Very low | 40.1 | Very low | 201 Ų | 201 | 135.2 Ų | 135.2 | 94% | 0.939 | 74% | 0.741 | S | S | * | * | trans | -57.5 | 112.5 | 165.7 | -74.7 | 166.5 | -12.1 | 0 | 0 | 110.7 | ||||
| 25 | L | 34.3 | Very low | 41 | Very low | 149 Ų | 149 | 130.7 Ų | 130.7 | 78% | 0.78 | 72% | 0.718 | S | S | * | * | trans | -92.5 | 146.2 | 152.8 | -71.5 | 168.4 | 0 | 0 | 0 | 106.7 | R23 E27 | R23-L25 PolarHBondContact O-N 2.81Å; L25-E27 PolarHBondContact O-N 3.15Å; L25-E27 VanDerWaalsContact O-N 3.08Å | ||
| 26 | P | 38.4 | Very low | 42.1 | Very low | 128 Ų | 128 | 131.1 Ų | 131.1 | 83% | 0.831 | 71% | 0.71 | S | S | * | * | trans | -65.1 | 115.5 | -176.9 | 26.8 | -31.3 | 0 | 0 | 0 | 109.2 | ||||
| 27 | E | 40.8 | Very low | 43 | Very low | 154 Ų | 154 | 129 Ų | 129 | 72% | 0.72 | 70% | 0.697 | S | S | * | * | trans | -69.9 | 133.6 | 171.8 | -62.3 | -171.9 | 131.6 | 0 | 0 | 108.2 | L25 D29 | L25-E27 PolarHBondContact O-N 3.15Å; L25-E27 VanDerWaalsContact O-N 3.08Å; E27-D29 PolarHBondContact O-N 3.34Å | ||
| 28 | D | 46.3 | Very low | 43.9 | Very low | 123 Ų | 123 | 122.4 Ų | 122.4 | 66% | 0.658 | 67% | 0.67 | S | S | * | * | trans | -76.1 | 74.7 | 176.4 | -173.3 | 21.4 | 0 | 0 | 0 | 108.7 | G30 L31 | D28-G30 PolarHBondContact O-N 2.95Å; D28-L31 PolarHBondContact O-N 3.34Å | ||
| 29 | D | 50.9 | Low | 44.9 | Very low | 98 Ų | 98 | 125.6 Ų | 125.6 | 52% | 0.524 | 67% | 0.667 | S | S | . | * | H | α-helix | trans | -56.6 | -16.2 | -175.4 | -68.7 | -39 | 0 | 0 | 0 | 113.9 | E27 L31 Q33 | E27-D29 PolarHBondContact O-N 3.34Å; D29-L31 PolarHBondContact O-N 2.95Å; D29-Q33 WeakPolarHBondContact O-CB 3.49Å; D29-Q33 PolarHBondContact O-N 3.2Å |
| 30 | G | 58 | Low | 45.9 | Very low | 45 Ų | 45 | 123.1 Ų | 123.1 | 46% | 0.464 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -68.1 | -32.5 | -178 | 0 | 0 | 0 | 0 | 0 | 113.5 | D28 D34 | D28-G30 PolarHBondContact O-N 2.95Å; G30-D34 PolarHBondContact O-N 3.43Å |
| 31 | L | 49.4 | Very low | 46.6 | Very low | 115 Ų | 115 | 122.9 Ų | 122.9 | 60% | 0.602 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -82.3 | -35.5 | -177.3 | -65.7 | 176.4 | 0 | 0 | 0 | 112.3 | D28 D29 D34 L35 | D28-L31 PolarHBondContact O-N 3.34Å; D29-L31 PolarHBondContact O-N 2.95Å; L31-D34 PolarHBondContact O-N 3.04Å; L31-L35 WeakPolarHBondContact O-CB 3.31Å; L31-L35 PolarHBondContact O-N 2.91Å; L31-L35 VanDerWaalsContact O-N 3.07Å |
| 32 | E | 53.8 | Low | 47.2 | Very low | 113 Ų | 113 | 115.9 Ų | 115.9 | 53% | 0.528 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -74.3 | -33.4 | 178.6 | -143.9 | 177.8 | 176.8 | 0 | 0 | 111.6 | L35 Q36 | E32-L35 WeakPolarHBondContact O-CB 3.49Å; E32-L35 PolarHBondContact O-N 3.22Å; E32-Q36 WeakPolarHBondContact O-CG 3.24Å; E32-Q36 PolarHBondContact O-N 3.5Å |
| 33 | Q | 57.7 | Low | 47.8 | Very low | 131 Ų | 131 | 115.8 Ų | 115.8 | 61% | 0.612 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -64 | -43.5 | 169.5 | -95.2 | 178.3 | 10.7 | 0 | 0 | 112.7 | D29 L35 Q36 Q37 | D29-Q33 WeakPolarHBondContact O-CB 3.49Å; D29-Q33 PolarHBondContact O-N 3.2Å; Q33-L35 PolarHBondContact O-N 3.33Å; Q33-Q36 PolarHBondContact O-N 2.69Å; Q33-Q37 VanDerWaalsContact O-CB 3.24Å; Q33-Q37 WeakPolarHBondContact O-CB 3.4Å; Q33-Q37 PolarHBondContact O-N 3.19Å |
| 34 | D | 52.2 | Low | 48.6 | Very low | 87 Ų | 87 | 110 Ų | 110 | 47% | 0.465 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -64.4 | -34.5 | 177.1 | -141.2 | 35.1 | 0 | 0 | 0 | 110.4 | G30 L31 V38 | G30-D34 PolarHBondContact O-N 3.43Å; L31-D34 PolarHBondContact O-N 3.04Å; D34-V38 WeakPolarHBondContact O-CB 3.06Å; D34-V38 WeakPolarHBondContact O-CG2 3.21Å; D34-V38 PolarHBondContact O-N 3.34Å |
| 35 | L | 53 | Low | 49.3 | Very low | 63 Ų | 63 | 104.6 Ų | 104.6 | 33% | 0.33 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -64.3 | -48.5 | 174.1 | -154 | 78.5 | 0 | 0 | 0 | 112.1 | L31 E32 Q33 M39 L332 | L31-L35 WeakPolarHBondContact O-CB 3.31Å; L31-L35 PolarHBondContact O-N 2.91Å; L31-L35 VanDerWaalsContact O-N 3.07Å; E32-L35 WeakPolarHBondContact O-CB 3.49Å; E32-L35 PolarHBondContact O-N 3.22Å; Q33-L35 PolarHBondContact O-N 3.33Å; L35-M39 VanDerWaalsContact O-CG 3.25Å; L35-M39 WeakPolarHBondContact O-CG 3.21Å; L35-M39 PolarHBondContact O-N 3.02Å; L35-M39 VanDerWaalsContact O-N 3.12Å; L35-L332 HydrophobicContact CD1-CD2 3.63Å |
| 36 | Q | 55.8 | Low | 49.6 | Very low | 115 Ų | 115 | 103 Ų | 103 | 54% | 0.537 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -67.2 | -37 | 177.4 | -72 | 176.3 | 18.4 | 0 | 0 | 111.6 | E32 Q33 M39 V40 | E32-Q36 WeakPolarHBondContact O-CG 3.24Å; E32-Q36 PolarHBondContact O-N 3.5Å; Q33-Q36 PolarHBondContact O-N 2.69Å; Q36-M39 PolarHBondContact O-N 2.97Å; Q36-V40 WeakPolarHBondContact O-CB 3.36Å; Q36-V40 VanDerWaalsContact O-CG2 3.24Å; Q36-V40 WeakPolarHBondContact O-CG2 3.49Å; Q36-V40 PolarHBondContact O-N 2.73Å |
| 37 | Q | 55.8 | Low | 49.4 | Very low | 123 Ų | 123 | 105.1 Ų | 105.1 | 58% | 0.575 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -68.7 | -36.9 | -179.6 | -169.4 | 167.9 | 14.1 | 0 | 0 | 112.5 | Q33 V40 S41 | Q33-Q37 VanDerWaalsContact O-CB 3.24Å; Q33-Q37 WeakPolarHBondContact O-CB 3.4Å; Q33-Q37 PolarHBondContact O-N 3.19Å; Q37-V40 PolarHBondContact O-N 3.21Å; Q37-S41 VanDerWaalsContact O-CB 3.22Å; Q37-S41 WeakPolarHBondContact O-CB 3.44Å; Q37-S41 PolarHBondContact O-N 3.19Å; Q37-S41 PolarHBondContact O-OG 3.25Å |
| 38 | V | 51.8 | Low | 49.1 | Very low | 44 Ų | 44 | 103.1 Ų | 103.1 | 27% | 0.267 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -73.3 | -30.9 | 174.4 | 174.9 | 0 | 0 | 0 | 0 | 111.9 | D34 S41 L333 | D34-V38 WeakPolarHBondContact O-CB 3.06Å; D34-V38 WeakPolarHBondContact O-CG2 3.21Å; D34-V38 PolarHBondContact O-N 3.34Å; V38-S41 CarbonylContact O-C 3.4Å; V38-L333 HydrophobicContact CG1-CD2 3.87Å |
| 39 | M | 51.5 | Low | 48.4 | Very low | 139 Ų | 139 | 103 Ų | 103 | 69% | 0.685 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -72.9 | -30 | 173.7 | -71.5 | 177.8 | 70.7 | 0 | 0 | 112.9 | L35 Q36 | L35-M39 VanDerWaalsContact O-CG 3.25Å; L35-M39 WeakPolarHBondContact O-CG 3.21Å; L35-M39 PolarHBondContact O-N 3.02Å; L35-M39 VanDerWaalsContact O-N 3.12Å; Q36-M39 PolarHBondContact O-N 2.97Å |
| 40 | V | 53.4 | Low | 47.8 | Very low | 126 Ų | 126 | 105.4 Ų | 105.4 | 76% | 0.764 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -85.6 | -28.2 | 176.9 | 174.3 | 0 | 0 | 0 | 0 | 111.9 | Q36 Q37 | Q36-V40 WeakPolarHBondContact O-CB 3.36Å; Q36-V40 VanDerWaalsContact O-CG2 3.24Å; Q36-V40 WeakPolarHBondContact O-CG2 3.49Å; Q36-V40 PolarHBondContact O-N 2.73Å; Q37-V40 PolarHBondContact O-N 3.21Å |
| 41 | S | 45.3 | Very low | 46.4 | Very low | 70 Ų | 70 | 109.7 Ų | 109.7 | 49% | 0.49 | 61% | 0.609 | S | S | . | * | S | Bend | trans | -109.9 | 84.8 | -179.9 | -46.7 | 0 | 0 | 0 | 0 | 110.6 | Q37 V38 | Q37-S41 VanDerWaalsContact O-CB 3.22Å; Q37-S41 WeakPolarHBondContact O-CB 3.44Å; Q37-S41 PolarHBondContact O-N 3.19Å; Q37-S41 PolarHBondContact O-OG 3.25Å; V38-S41 CarbonylContact O-C 3.4Å |
| 42 | G | 47.7 | Very low | 45.6 | Very low | 60 Ų | 60 | 109.8 Ų | 109.8 | 62% | 0.619 | 62% | 0.619 | S | S | * | * | trans | -54.6 | 143.5 | 166.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | N44 | G42-N44 PolarHBondContact O-N 3.41Š| ||
| 43 | P | 45.2 | Very low | 44.4 | Very low | 102 Ų | 102 | 108.2 Ų | 108.2 | 66% | 0.662 | 63% | 0.634 | S | S | * | * | trans | -62.7 | 122 | -176.3 | 23.2 | -31.3 | 0 | 0 | 0 | 110.9 | L45 | P43-L45 HydrophobicContact CB-CD2 4.49Å; P43-L45 PolarHBondContact O-N 3.44Å | ||
| 44 | N | 47.3 | Very low | 43 | Very low | 123 Ų | 123 | 105 Ų | 105 | 66% | 0.658 | 64% | 0.636 | S | S | * | * | trans | -78 | 108.8 | 167.7 | -169.6 | -4.6 | 0 | 0 | 0 | 108.7 | G42 N46 | G42-N44 PolarHBondContact O-N 3.41Å; N44-N46 VanDerWaalsContact CG-CG 3.46Å; N44-N46 VanDerWaalsContact CG-OD1 3.25Å; N44-N46 PolarHBondContact ND2-ND2 2.8Å; N44-N46 PolarHBondContact ND2-OD1 3.49Å; N44-N46 VanDerWaalsContact OD1-CB 3.3Å; N44-N46 WeakPolarHBondContact OD1-CB 3.06Å; N44-N46 PolarHBondContact OD1-N 3.43Å; N44-N46 PolarHBondContact OD1-ND2 3.22Å; N44-N46 PolarHBondContact OD1-OD1 2.82Å | ||
| 45 | L | 46.7 | Very low | 42 | Very low | 89 Ų | 89 | 112.8 Ų | 112.8 | 47% | 0.466 | 66% | 0.661 | S | S | . | * | trans | -95.6 | 19.6 | -176.2 | -66.1 | 172.4 | 0 | 0 | 0 | 113.1 | P43 E47 T231 | P43-L45 HydrophobicContact CB-CD2 4.49Å; P43-L45 PolarHBondContact O-N 3.44Å; L45-E47 VanDerWaalsContact C-N 3.29Å; L45-E47 PolarHBondContact O-N 3.24Å; L45-T231 HydrophobicContact CD1-CG2 3.81Å | ||
| 46 | N | 40 | Very low | 40.7 | Very low | 114 Ų | 114 | 113.5 Ų | 113.5 | 61% | 0.61 | 68% | 0.683 | S | S | * | * | trans | -76.3 | 1 | -170.1 | 64.5 | -12.6 | 0 | 0 | 0 | 116.3 | N44 | N44-N46 VanDerWaalsContact CG-CG 3.46Å; N44-N46 VanDerWaalsContact CG-OD1 3.25Å; N44-N46 PolarHBondContact ND2-ND2 2.8Å; N44-N46 PolarHBondContact ND2-OD1 3.49Å; N44-N46 VanDerWaalsContact OD1-CB 3.3Å; N44-N46 WeakPolarHBondContact OD1-CB 3.06Å; N44-N46 PolarHBondContact OD1-N 3.43Å; N44-N46 PolarHBondContact OD1-ND2 3.22Å; N44-N46 PolarHBondContact OD1-OD1 2.82Å | ||
| 47 | E | 34.5 | Very low | 39.3 | Very low | 174 Ų | 174 | 111.9 Ų | 111.9 | 81% | 0.813 | 70% | 0.697 | S | S | * | * | trans | -135 | 54.9 | -176.5 | -66.5 | -163 | 155.9 | 0 | 0 | 115.1 | L45 | L45-E47 VanDerWaalsContact C-N 3.29Å; L45-E47 PolarHBondContact O-N 3.24Å | ||
| 48 | T | 35.1 | Very low | 38.1 | Very low | 112 Ų | 112 | 112 Ų | 112 | 69% | 0.687 | 71% | 0.712 | S | S | * | * | trans | -122.6 | 97.3 | 158.1 | 43.6 | 0 | 0 | 0 | 0 | 110.3 | I50 | T48-I50 PolarHBondContact O-N 3.17Å; T48-I50 VanDerWaalsContact O-N 3.15Å | ||
| 49 | S | 30.6 | Very low | 37 | Very low | 121 Ų | 121 | 113.2 Ų | 113.2 | 85% | 0.846 | 73% | 0.732 | S | S | * | * | trans | -71.6 | 103.5 | 168.4 | 59.9 | 0 | 0 | 0 | 0 | 108.9 | V51 | S49-V51 PolarHBondContact O-N 3.49Š| ||
| 50 | I | 39.4 | Very low | 36 | Very low | 148 Ų | 148 | 114.7 Ų | 114.7 | 76% | 0.759 | 74% | 0.743 | S | S | * | * | trans | -87.4 | 108.3 | 171.9 | -57.2 | -177.9 | 0 | 0 | 0 | 107.4 | T48 S52 | T48-I50 PolarHBondContact O-N 3.17Å; T48-I50 VanDerWaalsContact O-N 3.15Å; I50-S52 PolarHBondContact O-N 3.45Å | ||
| 51 | V | 28.5 | Very low | 34.8 | Very low | 134 Ų | 134 | 112.2 Ų | 112.2 | 81% | 0.812 | 74% | 0.743 | S | S | * | * | trans | -67.9 | 110.5 | 166.9 | 162.8 | 0 | 0 | 0 | 0 | 108.4 | S49 G53 | S49-V51 PolarHBondContact O-N 3.49Å; V51-G53 PolarHBondContact O-N 3Å | ||
| 52 | S | 33.3 | Very low | 34 | Very low | 117 Ų | 117 | 116.9 Ų | 116.9 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | trans | -65.8 | 112.8 | 167 | -88.7 | 0 | 0 | 0 | 0 | 110.5 | I50 | I50-S52 PolarHBondContact O-N 3.45Š| ||
| 53 | G | 28.4 | Very low | 33.3 | Very low | 81 Ų | 81 | 121.5 Ų | 121.5 | 84% | 0.835 | 77% | 0.771 | S | S | * | * | trans | -104.3 | 106.3 | 160.9 | 0 | 0 | 0 | 0 | 0 | 109.3 | V51 | V51-G53 PolarHBondContact O-N 3Š| ||
| 54 | G | 26.8 | Very low | 32.7 | Very low | 64 Ų | 64 | 122.4 Ų | 122.4 | 66% | 0.66 | 78% | 0.776 | S | S | * | * | trans | -97.7 | 170 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 55 | Y | 31.3 | Very low | 31.9 | Very low | 250 Ų | 250 | 123 Ų | 123 | 98% | 0.98 | 78% | 0.784 | S | S | * | * | trans | 81.7 | 128.3 | 174.8 | -62.1 | -84.8 | 0 | 0 | 0 | 116.3 | ||||
| 56 | G | 27.2 | Very low | 30.9 | Very low | 77 Ų | 77 | 122 Ų | 122 | 79% | 0.794 | 80% | 0.796 | S | S | * | * | cis | 163.5 | 144.2 | 4.3 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 57 | G | 26.5 | Very low | 30.2 | Very low | 81 Ų | 81 | 126.3 Ų | 126.3 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | trans | 177.4 | 95.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 58 | S | 29.1 | Very low | 30 | Very low | 127 Ų | 127 | 123.5 Ų | 123.5 | 89% | 0.888 | 81% | 0.809 | S | S | * | * | trans | -32.8 | 146.4 | 173.2 | -45.9 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 59 | G | 30.3 | Very low | 29.5 | Very low | 68 Ų | 68 | 125.1 Ų | 125.1 | 70% | 0.701 | 81% | 0.812 | S | S | * | * | 106.7 | 122 | 129 | 0 | 0 | 0 | 0 | 0 | 117.8 | |||||
| 60 | D | 29.1 | Very low | 29.2 | Very low | 171 Ų | 171 | 124 Ų | 124 | 91% | 0.914 | 80% | 0.804 | S | S | * | * | trans | 80.2 | 98.7 | 154.2 | -59.2 | -16.5 | 0 | 0 | 0 | 119.4 | ||||
| 61 | G | 28.8 | Very low | 28.6 | Very low | 73 Ų | 73 | 123.5 Ų | 123.5 | 75% | 0.753 | 81% | 0.812 | S | S | * | * | trans | -80.2 | 138.9 | 158.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 62 | L | 29.2 | Very low | 28.5 | Very low | 169 Ų | 169 | 121.1 Ų | 121.1 | 89% | 0.885 | 81% | 0.806 | S | S | * | * | trans | -151.1 | 119 | 152.7 | -80.1 | -180 | 0 | 0 | 0 | 108.6 | ||||
| 63 | I | 32.1 | Very low | 28.4 | Very low | 157 Ų | 157 | 126.5 Ų | 126.5 | 81% | 0.805 | 81% | 0.809 | S | S | * | * | trans | -83.1 | 136.4 | 165 | -60.5 | 173.3 | 0 | 0 | 0 | 107.6 | ||||
| 64 | P | 33.8 | Very low | 28.4 | Very low | 121 Ų | 121 | 133.3 Ų | 133.3 | 79% | 0.786 | 81% | 0.809 | S | S | * | * | trans | -127.4 | 129.6 | 145.7 | 29.8 | -14.7 | 0 | 0 | 0 | 112.5 | ||||
| 65 | T | 29.3 | Very low | 28.7 | Very low | 134 Ų | 134 | 138.3 Ų | 138.3 | 82% | 0.822 | 82% | 0.815 | S | S | * | * | trans | -77.1 | 141.2 | 168.4 | 38.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 66 | G | 26 | Very low | 28.6 | Very low | 69 Ų | 69 | 131.3 Ų | 131.3 | 71% | 0.711 | 80% | 0.798 | S | S | * | * | trans | 86.4 | 116.9 | 145.1 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 67 | K | 25.9 | Very low | 28.6 | Very low | 204 Ų | 204 | 139.6 Ų | 139.6 | 89% | 0.887 | 81% | 0.806 | S | S | * | * | -177.9 | 117.2 | 118.9 | -95.4 | 164.6 | -170.3 | -178.3 | 0 | 111.3 | |||||
| 68 | S | 28.9 | Very low | 29.1 | Very low | 116 Ų | 116 | 140.4 Ų | 140.4 | 81% | 0.811 | 79% | 0.794 | S | S | * | * | trans | -68 | 139.6 | 154.6 | 177 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 69 | I | 25.7 | Very low | 29.2 | Very low | 146 Ų | 146 | 136.4 Ų | 136.4 | 75% | 0.749 | 77% | 0.774 | S | S | * | * | trans | -166.1 | 116.9 | 154.3 | -93.2 | 144.4 | 0 | 0 | 0 | 110.3 | ||||
| 70 | S | 24.1 | Very low | 29.5 | Very low | 97 Ų | 97 | 138.3 Ų | 138.3 | 68% | 0.678 | 77% | 0.774 | S | S | * | * | trans | 48.9 | 124.7 | 144.9 | 73.7 | 0 | 0 | 0 | 0 | 123.1 | A72 | S70-A72 PolarHBondContact O-N 2.9Š| ||
| 71 | C | 27.4 | Very low | 29.8 | Very low | 138 Ų | 138 | 137.6 Ų | 137.6 | 93% | 0.932 | 77% | 0.765 | S | S | * | * | trans | -41 | 123.3 | 143.3 | -104.3 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 72 | A | 25.3 | Very low | 30.3 | Very low | 83 Ų | 83 | 141.2 Ų | 141.2 | 69% | 0.686 | 76% | 0.756 | S | S | * | * | trans | -142.8 | 106.6 | 157.1 | 0 | 0 | 0 | 0 | 0 | 109 | S70 R74 | S70-A72 PolarHBondContact O-N 2.9Å; A72-R74 PolarHBondContact O-N 2.89Å | ||
| 73 | R | 32.4 | Very low | 30.7 | Very low | 231 Ų | 231 | 134.9 Ų | 134.9 | 87% | 0.872 | 73% | 0.725 | S | S | * | * | trans | -54.3 | 117.4 | 165.2 | 173.8 | -177.2 | -82.2 | -112.3 | 1.6 | 108.3 | ||||
| 74 | R | 27.2 | Very low | 31.2 | Very low | 223 Ų | 223 | 132.8 Ų | 132.8 | 84% | 0.842 | 72% | 0.715 | S | S | * | * | trans | -117.5 | 117.1 | 161.7 | -85.1 | -174.4 | -165.5 | -126.6 | 0.9 | 108.7 | A72 V76 | A72-R74 PolarHBondContact O-N 2.89Å; R74-V76 PolarHBondContact O-N 2.7Å | ||
| 75 | E | 33.5 | Very low | 31.9 | Very low | 169 Ų | 169 | 130.1 Ų | 130.1 | 79% | 0.79 | 70% | 0.696 | S | S | * | * | trans | -65.7 | 123 | 163.2 | -59.6 | -152.4 | 153.7 | 0 | 0 | 108.4 | ||||
| 76 | V | 28.9 | Very low | 32.5 | Very low | 103 Ų | 103 | 129.7 Ų | 129.7 | 62% | 0.624 | 68% | 0.681 | S | S | * | * | trans | -118.8 | 119.2 | 177.1 | 174.6 | 0 | 0 | 0 | 0 | 107 | R74 V78 | R74-V76 PolarHBondContact O-N 2.7Å; V76-V78 VanDerWaalsContact O-CG2 3.28Å; V76-V78 WeakPolarHBondContact O-CG2 3.39Å; V76-V78 PolarHBondContact O-N 3.02Å | ||
| 77 | W | 27 | Very low | 33.6 | Very low | 251 Ų | 251 | 127.8 Ų | 127.8 | 95% | 0.951 | 65% | 0.654 | S | S | * | * | trans | -49.3 | 124.3 | 168 | -85.6 | 49.4 | 0 | 0 | 0 | 110.4 | ||||
| 78 | V | 37.3 | Very low | 34.5 | Very low | 98 Ų | 98 | 126.1 Ų | 126.1 | 59% | 0.594 | 64% | 0.642 | S | S | * | * | trans | -104 | 109.5 | -174.6 | -171.6 | 0 | 0 | 0 | 0 | 109.6 | V76 R82 | V76-V78 VanDerWaalsContact O-CG2 3.28Å; V76-V78 WeakPolarHBondContact O-CG2 3.39Å; V76-V78 PolarHBondContact O-N 3.02Å; V78-R82 HydrophobicContact CG1-CB 3.73Å | ||
| 79 | G | 30.1 | Very low | 35.1 | Very low | 44 Ų | 44 | 126.6 Ų | 126.6 | 45% | 0.454 | 63% | 0.631 | S | S | . | * | trans | -78.1 | 171.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q81 R82 | G79-Q81 VanDerWaalsContact C-N 3.3Å; G79-Q81 PolarHBondContact O-N 3.38Å; G79-Q81 VanDerWaalsContact O-N 3.16Å; G79-R82 PolarHBondContact O-N 3.02Å | ||
| 80 | P | 38.1 | Very low | 35.9 | Very low | 108 Ų | 108 | 121.3 Ų | 121.3 | 70% | 0.701 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -57.4 | -31.3 | -171.5 | -24.8 | 33.6 | 0 | 0 | 0 | 115.4 | R82 C83 | P80-R82 VanDerWaalsContact C-N 3.27Å; P80-R82 PolarHBondContact O-N 3.46Å; P80-C83 PolarHBondContact O-N 2.95Å |
| 81 | Q | 34.6 | Very low | 36.8 | Very low | 155 Ų | 155 | 118.4 Ų | 118.4 | 72% | 0.724 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -60.8 | -30 | -179 | -92.2 | 83.5 | 11.9 | 0 | 0 | 114.1 | G79 V85 | G79-Q81 VanDerWaalsContact C-N 3.3Å; G79-Q81 PolarHBondContact O-N 3.38Å; G79-Q81 VanDerWaalsContact O-N 3.16Å; Q81-V85 PolarHBondContact O-N 3.46Å |
| 82 | R | 40.1 | Very low | 37.7 | Very low | 149 Ų | 149 | 115.5 Ų | 115.5 | 56% | 0.562 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -87.4 | -16.4 | -174.7 | -147 | 177.4 | 172.8 | -154 | -3.2 | 113.5 | V78 G79 P80 L84 V85 Y86 | V78-R82 HydrophobicContact CG1-CB 3.73Å; G79-R82 PolarHBondContact O-N 3.02Å; P80-R82 VanDerWaalsContact C-N 3.27Å; P80-R82 PolarHBondContact O-N 3.46Å; R82-L84 VanDerWaalsContact C-N 3.31Å; R82-V85 HydrophobicContact CG-CB 4.31Å; R82-V85 PolarHBondContact O-N 2.95Å; R82-Y86 PolarHBondContact O-N 3.25Å |
| 83 | C | 38.1 | Very low | 38.2 | Very low | 37 Ų | 37 | 122.1 Ų | 122.1 | 25% | 0.25 | 58% | 0.58 | C | S | . | * | H | α-helix | trans | -65.4 | -38.2 | 167.9 | -115.6 | 0 | 0 | 0 | 0 | 111 | P80 V85 Y86 L87 | P80-C83 PolarHBondContact O-N 2.95Å; C83-V85 VanDerWaalsContact C-N 3.33Å; C83-Y86 PolarHBondContact O-N 2.91Å; C83-L87 WeakPolarHBondContact O-CG 3.38Å; C83-L87 PolarHBondContact O-N 3.47Å |
| 84 | L | 41.8 | Very low | 38.3 | Very low | 112 Ų | 112 | 117.3 Ų | 117.3 | 59% | 0.586 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -65.6 | -35.3 | 172.6 | -70 | 168.8 | 0 | 0 | 0 | 112 | R82 L87 R88 | R82-L84 VanDerWaalsContact C-N 3.31Å; L84-L87 PolarHBondContact O-N 3.46Å; L84-R88 WeakPolarHBondContact O-CB 3.5Å; L84-R88 PolarHBondContact O-N 2.95Å |
| 85 | V | 47.3 | Very low | 38.7 | Very low | 65 Ų | 65 | 114.4 Ų | 114.4 | 39% | 0.394 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -66.7 | -40.8 | 174.5 | 178.6 | 0 | 0 | 0 | 0 | 111.5 | Q81 R82 C83 R88 E89 | Q81-V85 PolarHBondContact O-N 3.46Å; R82-V85 HydrophobicContact CG-CB 4.31Å; R82-V85 PolarHBondContact O-N 2.95Å; C83-V85 VanDerWaalsContact C-N 3.33Å; V85-R88 WeakPolarHBondContact O-CB 3.35Å; V85-R88 PolarHBondContact O-N 3.45Å; V85-E89 WeakPolarHBondContact O-CG 3.41Å; V85-E89 PolarHBondContact O-N 3.29Å |
| 86 | Y | 42.9 | Very low | 38.5 | Very low | 126 Ų | 126 | 112.3 Ų | 112.3 | 49% | 0.494 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.6 | -37 | 174.2 | -115.4 | -84.4 | 0 | 0 | 0 | 112.6 | R82 C83 R88 E89 A90 | R82-Y86 PolarHBondContact O-N 3.25Å; C83-Y86 PolarHBondContact O-N 2.91Å; Y86-R88 VanDerWaalsContact C-N 3.34Å; Y86-E89 PolarHBondContact O-N 3Å; Y86-A90 VanDerWaalsContact O-CB 3.26Å; Y86-A90 WeakPolarHBondContact O-CB 3.36Å; Y86-A90 PolarHBondContact O-N 3.3Å |
| 87 | L | 48.6 | Very low | 38.8 | Very low | 29 Ų | 29 | 113.3 Ų | 113.3 | 15% | 0.152 | 57% | 0.571 | C | S | . | * | H | α-helix | trans | -68.3 | -32.5 | 173 | -72.7 | 164.4 | 0 | 0 | 0 | 112.2 | C83 L84 T136 | C83-L87 WeakPolarHBondContact O-CG 3.38Å; C83-L87 PolarHBondContact O-N 3.47Å; L84-L87 PolarHBondContact O-N 3.46Å; L87-T136 HydrophobicContact CD1-CG2 4.14Å |
| 88 | R | 44.6 | Very low | 39.4 | Very low | 168 Ų | 168 | 108.7 Ų | 108.7 | 63% | 0.634 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -70.5 | -40 | 173 | -162.8 | -179.9 | -163.9 | -155.6 | 6.9 | 112 | L84 V85 Y86 G91 E94 | L84-R88 WeakPolarHBondContact O-CB 3.5Å; L84-R88 PolarHBondContact O-N 2.95Å; V85-R88 WeakPolarHBondContact O-CB 3.35Å; V85-R88 PolarHBondContact O-N 3.45Å; Y86-R88 VanDerWaalsContact C-N 3.34Å; R88-G91 PolarHBondContact O-N 2.96Å; R88-E94 IonicContact CZ-OE2 2.72Å; R88-E94 IonicContact NE-OE2 3.74Å; R88-E94 IonicContact NH2-OE2 3.5Å; R88-E94 PolarHBondContact NH2-OE2 3.48Å |
| 89 | E | 43.1 | Very low | 39 | Very low | 126 Ų | 126 | 107.6 Ų | 107.6 | 59% | 0.589 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -73.5 | -27.8 | 176.1 | -75 | 179.7 | 164.4 | 0 | 0 | 113 | V85 Y86 G91 | V85-E89 WeakPolarHBondContact O-CG 3.41Å; V85-E89 PolarHBondContact O-N 3.29Å; Y86-E89 PolarHBondContact O-N 3Å; E89-G91 PolarHBondContact O-N 2.93Å; E89-G91 VanDerWaalsContact O-N 3.1Å |
| 90 | A | 42.6 | Very low | 39.6 | Very low | 36 Ų | 36 | 111.7 Ų | 111.7 | 30% | 0.298 | 59% | 0.594 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -73.5 | 15 | 171.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y86 | Y86-A90 VanDerWaalsContact O-CB 3.26Å; Y86-A90 WeakPolarHBondContact O-CB 3.36Å; Y86-A90 PolarHBondContact O-N 3.3Å |
| 91 | G | 42.7 | Very low | 39.2 | Very low | 36 Ų | 36 | 109.2 Ų | 109.2 | 37% | 0.371 | 59% | 0.589 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 84.4 | 15.9 | 168.4 | 0 | 0 | 0 | 0 | 0 | 116 | R88 E89 R93 | R88-G91 PolarHBondContact O-N 2.96Å; E89-G91 PolarHBondContact O-N 2.93Å; E89-G91 VanDerWaalsContact O-N 3.1Å; G91-R93 PolarHBondContact O-N 3.14Å; G91-R93 VanDerWaalsContact O-N 3.11Å |
| 92 | V | 44.5 | Very low | 39.4 | Very low | 77 Ų | 77 | 113.9 Ų | 113.9 | 47% | 0.467 | 60% | 0.599 | S | S | . | * | trans | -79.5 | 92.6 | 168.4 | -173.9 | 0 | 0 | 0 | 0 | 108.1 | E94 | V92-E94 PolarHBondContact O-N 3.44Š| ||
| 93 | R | 36.3 | Very low | 39.1 | Very low | 222 Ų | 222 | 115.3 Ų | 115.3 | 84% | 0.838 | 61% | 0.612 | S | S | * | * | trans | -60.2 | 132.3 | 172.9 | -82.8 | -176.1 | 163.9 | -174.9 | -3.9 | 110.1 | G91 L95 | G91-R93 PolarHBondContact O-N 3.14Å; G91-R93 VanDerWaalsContact O-N 3.11Å; R93-L95 PolarHBondContact O-N 3.37Å | ||
| 94 | E | 34.3 | Very low | 39.1 | Very low | 130 Ų | 130 | 119 Ų | 119 | 61% | 0.607 | 64% | 0.636 | S | S | * | * | trans | -58.9 | 108.9 | 164.2 | -158.2 | 162.7 | -166.5 | 0 | 0 | 107.7 | R88 V92 D96 | R88-E94 IonicContact CZ-OE2 2.72Å; R88-E94 IonicContact NE-OE2 3.74Å; R88-E94 IonicContact NH2-OE2 3.5Å; R88-E94 PolarHBondContact NH2-OE2 3.48Å; V92-E94 PolarHBondContact O-N 3.44Å; E94-D96 PolarHBondContact O-N 3.09Å | ||
| 95 | L | 36.2 | Very low | 39 | Very low | 162 Ų | 162 | 119 Ų | 119 | 85% | 0.848 | 65% | 0.645 | S | S | * | * | trans | -82.8 | 98.5 | 156.5 | -78.5 | 170.9 | 0 | 0 | 0 | 105.5 | R93 P97 | R93-L95 PolarHBondContact O-N 3.37Å; L95-P97 WeakPolarHBondContact O-CD 3.49Å | ||
| 96 | D | 30.3 | Very low | 38.4 | Very low | 124 Ų | 124 | 124.8 Ų | 124.8 | 66% | 0.663 | 67% | 0.667 | S | S | * | * | trans | -49.1 | 118 | 163.7 | -93.4 | -40.2 | 0 | 0 | 0 | 108.7 | E94 L98 | E94-D96 PolarHBondContact O-N 3.09Å; D96-L98 PolarHBondContact O-N 3.41Å | ||
| 97 | P | 34.3 | Very low | 38.4 | Very low | 124 Ų | 124 | 123.9 Ų | 123.9 | 81% | 0.805 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -74.7 | -3.2 | 176.5 | -14.4 | 30.2 | 0 | 0 | 0 | 113.1 | L95 | L95-P97 WeakPolarHBondContact O-CD 3.49Š|
| 98 | L | 38.8 | Very low | 37.8 | Very low | 154 Ų | 154 | 129.1 Ų | 129.1 | 81% | 0.806 | 71% | 0.713 | S | S | * | * | trans | -131.3 | 85.2 | -178.8 | -94.5 | 88.8 | 0 | 0 | 0 | 111.3 | D96 S100 | D96-L98 PolarHBondContact O-N 3.41Å; L98-S100 PolarHBondContact O-N 2.88Å | ||
| 99 | G | 29.4 | Very low | 37.8 | Very low | 76 Ų | 76 | 127.8 Ų | 127.8 | 78% | 0.784 | 72% | 0.723 | S | S | * | * | trans | -72 | 112.5 | 159.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | G101 | G99-G101 PolarHBondContact O-N 3.13Š| ||
| 100 | S | 42.4 | Very low | 38 | Very low | 130 Ų | 130 | 127.6 Ų | 127.6 | 91% | 0.909 | 73% | 0.733 | S | S | * | * | trans | -69.1 | 92.1 | 172.4 | -178.2 | 0 | 0 | 0 | 0 | 110.5 | L98 | L98-S100 PolarHBondContact O-N 2.88Š| ||
| 101 | G | 30.7 | Very low | 38.6 | Very low | 56 Ų | 56 | 132.2 Ų | 132.2 | 58% | 0.577 | 76% | 0.763 | S | S | * | * | trans | -105 | 115.6 | 169.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | G99 H103 | G99-G101 PolarHBondContact O-N 3.13Å; G101-H103 PolarHBondContact O-N 2.99Å | ||
| 102 | R | 37.8 | Very low | 39 | Very low | 252 Ų | 252 | 133.4 Ų | 133.4 | 95% | 0.951 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -59 | 116.8 | 168.2 | -89.5 | 170.6 | 151.4 | 179.7 | -7 | 109.7 | ||
| 103 | H | 34.3 | Very low | 39.4 | Very low | 180 Ų | 180 | 135 Ų | 135 | 83% | 0.833 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -90.8 | 138.2 | 164 | -84.6 | -88 | 0 | 0 | 0 | 110.3 | G101 | G101-H103 PolarHBondContact O-N 2.99Š|
| 104 | P | 37.9 | Very low | 40.1 | Very low | 114 Ų | 114 | 126.4 Ų | 126.4 | 74% | 0.74 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 136.2 | 156 | 9.7 | 7.3 | 0 | 0 | 0 | 109.5 | ||
| 105 | S | 40.4 | Very low | 41.1 | Very low | 111 Ų | 111 | 125.8 Ų | 125.8 | 78% | 0.776 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 123.4 | 175.4 | 43 | 0 | 0 | 0 | 0 | 112.6 | ||
| 106 | H | 34.8 | Very low | 41.9 | Very low | 188 Ų | 188 | 125.2 Ų | 125.2 | 87% | 0.87 | 76% | 0.762 | S | S | * | * | trans | -141.6 | 123 | 149.2 | -90.9 | -73.6 | 0 | 0 | 0 | 110.5 | ||||
| 107 | S | 43.4 | Very low | 43.3 | Very low | 107 Ų | 107 | 123.8 Ų | 123.8 | 75% | 0.748 | 76% | 0.757 | S | S | * | * | trans | -78.3 | 123.8 | 175.4 | 47.8 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 108 | T | 35.5 | Very low | 44.5 | Very low | 139 Ų | 139 | 120.4 Ų | 120.4 | 85% | 0.853 | 74% | 0.74 | S | S | * | * | trans | -171.4 | 119.9 | 143.5 | 11.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 109 | T | 44.9 | Very low | 45.5 | Very low | 139 Ų | 139 | 121.1 Ų | 121.1 | 85% | 0.853 | 73% | 0.732 | S | S | * | * | trans | -68 | 142.7 | 156.7 | 34.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 110 | P | 46.4 | Very low | 47.4 | Very low | 122 Ų | 122 | 119.3 Ų | 119.3 | 79% | 0.792 | 71% | 0.713 | S | S | * | * | -138.5 | 156.6 | 111.9 | 33.3 | -18.2 | 0 | 0 | 0 | 114.1 | |||||
| 111 | S | 54.7 | Low | 48.8 | Very low | 133 Ų | 133 | 116.8 Ų | 116.8 | 93% | 0.93 | 69% | 0.689 | S | S | * | * | trans | -57.8 | 128.6 | 177.6 | -24.9 | 0 | 0 | 0 | 0 | 113 | ||||
| 112 | G | 52.6 | Low | 50.8 | Low | 61 Ų | 61 | 116.9 Ų | 116.9 | 63% | 0.629 | 68% | 0.684 | S | S | * | * | S | Bend | trans | 171.6 | 167.7 | 178 | 0 | 0 | 0 | 0 | 0 | 111 | G114 | G112-G114 VanDerWaalsContact C-N 3.29Å; G112-G114 PolarHBondContact O-N 2.84Å |
| 113 | P | 51.6 | Low | 52.7 | Low | 110 Ų | 110 | 106.4 Ų | 106.4 | 71% | 0.714 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -74.2 | 67.4 | -154.3 | 35.1 | -37.4 | 0 | 0 | 0 | 113.6 | ||
| 114 | G | 51.7 | Low | 54.9 | Low | 42 Ų | 42 | 104 Ų | 104 | 43% | 0.433 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -86.1 | -25.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | G112 A118 | G112-G114 VanDerWaalsContact C-N 3.29Å; G112-G114 PolarHBondContact O-N 2.84Å; G114-A118 VanDerWaalsContact O-CB 3.27Å; G114-A118 WeakPolarHBondContact O-CB 3.27Å; G114-A118 PolarHBondContact O-N 3.38Å |
| 115 | D | 54.1 | Low | 57 | Low | 118 Ų | 118 | 105 Ų | 105 | 63% | 0.631 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -71.3 | -37.2 | -174.8 | -94.7 | -1.1 | 0 | 0 | 0 | 113 | R119 | D115-R119 WeakPolarHBondContact O-CB 3.41Å; D115-R119 PolarHBondContact O-N 3.08Å |
| 116 | E | 53.7 | Low | 59.3 | Low | 149 Ų | 149 | 106.2 Ų | 106.2 | 70% | 0.696 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -71.7 | -37.7 | 177.6 | -74.3 | -171.1 | 130.6 | 0 | 0 | 112.4 | R119 G120 | E116-R119 PolarHBondContact O-N 3.42Å; E116-G120 PolarHBondContact O-N 2.94Å |
| 117 | V | 59.4 | Low | 61.7 | Low | 94 Ų | 94 | 101.7 Ų | 101.7 | 57% | 0.57 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -68 | -43.6 | 175.6 | 179.4 | 0 | 0 | 0 | 0 | 110.5 | G120 I121 | V117-G120 PolarHBondContact O-N 2.85Å; V117-I121 HydrophobicContact CG1-CD1 3.92Å; V117-I121 WeakPolarHBondContact O-CD1 3.5Å; V117-I121 WeakPolarHBondContact O-CG1 3.3Å; V117-I121 PolarHBondContact O-N 2.92Å |
| 118 | A | 58.9 | Low | 63.8 | Low | 54 Ų | 54 | 102.2 Ų | 102.2 | 45% | 0.446 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -65.2 | -38.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | G114 I121 A122 | G114-A118 VanDerWaalsContact O-CB 3.27Å; G114-A118 WeakPolarHBondContact O-CB 3.27Å; G114-A118 PolarHBondContact O-N 3.38Å; A118-I121 PolarHBondContact O-N 3.43Å; A118-A122 WeakPolarHBondContact O-CB 3.44Å; A118-A122 PolarHBondContact O-N 2.85Å |
| 119 | R | 60.7 | Low | 66.3 | Low | 169 Ų | 169 | 100 Ų | 100 | 64% | 0.638 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -70.9 | -35.1 | 176.5 | -149 | 179.4 | -68.8 | 155.2 | -2.9 | 111.7 | D115 E116 A122 G123 | D115-R119 WeakPolarHBondContact O-CB 3.41Å; D115-R119 PolarHBondContact O-N 3.08Å; E116-R119 PolarHBondContact O-N 3.42Å; R119-A122 PolarHBondContact O-N 3.15Å; R119-G123 PolarHBondContact O-N 3.44Å |
| 120 | G | 69.9 | Low | 68.5 | Low | 38 Ų | 38 | 99 Ų | 99 | 39% | 0.392 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -63.7 | -47.2 | 170.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | E116 V117 A122 G123 E124 | E116-G120 PolarHBondContact O-N 2.94Å; V117-G120 PolarHBondContact O-N 2.85Å; G120-A122 VanDerWaalsContact C-N 3.32Å; G120-A122 PolarHBondContact O-N 3.3Å; G120-G123 PolarHBondContact O-N 3.02Å; G120-G123 VanDerWaalsContact O-N 3.16Å; G120-E124 WeakPolarHBondContact O-CG 3.48Å; G120-E124 PolarHBondContact O-N 3.28Å |
| 121 | I | 71 | Confident | 70.5 | Confident | 77 Ų | 77 | 100.1 Ų | 100.1 | 40% | 0.395 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -61.9 | -39.3 | 175.6 | -67.5 | 163.9 | 0 | 0 | 0 | 111.3 | V117 A118 K125 | V117-I121 HydrophobicContact CG1-CD1 3.92Å; V117-I121 WeakPolarHBondContact O-CD1 3.5Å; V117-I121 WeakPolarHBondContact O-CG1 3.3Å; V117-I121 PolarHBondContact O-N 2.92Å; A118-I121 PolarHBondContact O-N 3.43Å; I121-K125 HydrophobicContact CG2-CD 4.21Å; I121-K125 WeakPolarHBondContact O-CB 3.25Å; I121-K125 VanDerWaalsContact O-CG 3.27Å; I121-K125 WeakPolarHBondContact O-CG 3.49Å; I121-K125 PolarHBondContact O-N 3.04Å |
| 122 | A | 73.4 | Confident | 72.2 | Confident | 57 Ų | 57 | 100.8 Ų | 100.8 | 47% | 0.471 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -66 | -37.9 | 176 | 0 | 0 | 0 | 0 | 0 | 112.3 | A118 R119 G120 F126 | A118-A122 WeakPolarHBondContact O-CB 3.44Å; A118-A122 PolarHBondContact O-N 2.85Å; R119-A122 PolarHBondContact O-N 3.15Å; G120-A122 VanDerWaalsContact C-N 3.32Å; G120-A122 PolarHBondContact O-N 3.3Å; A122-F126 WeakPolarHBondContact O-CB 3.43Å; A122-F126 PolarHBondContact O-N 3.42Å |
| 123 | G | 77.2 | Confident | 74.1 | Confident | 32 Ų | 32 | 99.3 Ų | 99.3 | 33% | 0.33 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.4 | -48.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | R119 G120 K125 F126 D127 | R119-G123 PolarHBondContact O-N 3.44Å; G120-G123 PolarHBondContact O-N 3.02Å; G120-G123 VanDerWaalsContact O-N 3.16Å; G123-K125 VanDerWaalsContact C-N 3.34Å; G123-K125 PolarHBondContact O-N 3.03Å; G123-F126 WeakPolarHBondContact O-CB 3.38Å; G123-F126 PolarHBondContact O-N 3.47Å; G123-F126 VanDerWaalsContact O-N 3.14Å; G123-D127 PolarHBondContact O-N 2.95Å |
| 124 | E | 80.3 | Confident | 76.1 | Confident | 130 Ų | 130 | 97.8 Ų | 97.8 | 61% | 0.607 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -60.6 | -43 | 177.2 | -70.9 | 176.5 | 172.6 | 0 | 0 | 112.1 | G120 F126 D127 I128 | G120-E124 WeakPolarHBondContact O-CG 3.48Å; G120-E124 PolarHBondContact O-N 3.28Å; E124-F126 VanDerWaalsContact C-N 3.33Å; E124-F126 PolarHBondContact O-N 3.28Å; E124-D127 PolarHBondContact O-N 3.44Å; E124-I128 WeakPolarHBondContact O-CD1 3.45Å; E124-I128 VanDerWaalsContact O-CG1 3.23Å; E124-I128 WeakPolarHBondContact O-CG1 3.48Å; E124-I128 PolarHBondContact O-N 2.91Å |
| 125 | K | 82.2 | Confident | 78 | Confident | 135 Ų | 135 | 97.1 Ų | 97.1 | 59% | 0.587 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.2 | -42.1 | 174.8 | -74.2 | 178.6 | 179.6 | -172 | 0 | 111.8 | I121 G123 I128 V129 | I121-K125 HydrophobicContact CG2-CD 4.21Å; I121-K125 WeakPolarHBondContact O-CB 3.25Å; I121-K125 VanDerWaalsContact O-CG 3.27Å; I121-K125 WeakPolarHBondContact O-CG 3.49Å; I121-K125 PolarHBondContact O-N 3.04Å; G123-K125 VanDerWaalsContact C-N 3.34Å; G123-K125 PolarHBondContact O-N 3.03Å; K125-I128 PolarHBondContact O-N 3.42Å; K125-V129 WeakPolarHBondContact O-CG2 3.44Å; K125-V129 PolarHBondContact O-N 3.22Å; K125-V129 VanDerWaalsContact O-N 3.07Å |
| 126 | F | 88.4 | Confident | 79.8 | Confident | 136 Ų | 136 | 93 Ų | 93 | 60% | 0.596 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -62.8 | -43.5 | 176.3 | 177.7 | -98.5 | 0 | 0 | 0 | 111.8 | A122 G123 E124 I128 V129 K130 | A122-F126 WeakPolarHBondContact O-CB 3.43Å; A122-F126 PolarHBondContact O-N 3.42Å; G123-F126 WeakPolarHBondContact O-CB 3.38Å; G123-F126 PolarHBondContact O-N 3.47Å; G123-F126 VanDerWaalsContact O-N 3.14Å; E124-F126 VanDerWaalsContact C-N 3.33Å; E124-F126 PolarHBondContact O-N 3.28Å; F126-I128 VanDerWaalsContact C-N 3.35Å; F126-I128 PolarHBondContact O-N 3.1Å; F126-V129 PolarHBondContact O-N 3.3Å; F126-K130 HydrophobicContact CE1-CD 4.38Å; F126-K130 WeakPolarHBondContact O-CB 3.36Å; F126-K130 PolarHBondContact O-N 3.21Å |
| 127 | D | 85.6 | Confident | 81.8 | Confident | 94 Ų | 94 | 93.5 Ų | 93.5 | 50% | 0.503 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -65.5 | -37.2 | 178 | -76.7 | -29.8 | 0 | 0 | 0 | 112.6 | G123 E124 K130 K131 | G123-D127 PolarHBondContact O-N 2.95Å; E124-D127 PolarHBondContact O-N 3.44Å; D127-K130 PolarHBondContact O-N 3.01Å; D127-K131 WeakPolarHBondContact O-CB 3.33Å; D127-K131 PolarHBondContact O-N 3.4Å |
| 128 | I | 86.9 | Confident | 83.5 | Confident | 117 Ų | 117 | 90.6 Ų | 90.6 | 60% | 0.6 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -60.1 | -49.1 | 172.3 | -69.3 | 163.3 | 0 | 0 | 0 | 110.4 | E124 K125 F126 K130 K131 W132 | E124-I128 WeakPolarHBondContact O-CD1 3.45Å; E124-I128 VanDerWaalsContact O-CG1 3.23Å; E124-I128 WeakPolarHBondContact O-CG1 3.48Å; E124-I128 PolarHBondContact O-N 2.91Å; K125-I128 PolarHBondContact O-N 3.42Å; F126-I128 VanDerWaalsContact C-N 3.35Å; F126-I128 PolarHBondContact O-N 3.1Å; I128-K130 VanDerWaalsContact C-N 3.33Å; I128-K130 PolarHBondContact O-N 3.36Å; I128-K131 PolarHBondContact O-N 3.46Å; I128-W132 VanDerWaalsContact O-CB 3.31Å; I128-W132 WeakPolarHBondContact O-CB 3.45Å; I128-W132 PolarHBondContact O-N 3.36Å |
| 129 | V | 89.6 | Confident | 85.2 | Confident | 93 Ų | 93 | 88.4 Ų | 88.4 | 56% | 0.564 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -62.4 | -41.5 | 178.9 | 173 | 0 | 0 | 0 | 0 | 111 | K125 F126 W132 G133 | K125-V129 WeakPolarHBondContact O-CG2 3.44Å; K125-V129 PolarHBondContact O-N 3.22Å; K125-V129 VanDerWaalsContact O-N 3.07Å; F126-V129 PolarHBondContact O-N 3.3Å; V129-W132 PolarHBondContact O-N 3.24Å; V129-G133 PolarHBondContact O-N 2.89Å |
| 130 | K | 91.3 | Very high | 86.8 | Confident | 119 Ų | 119 | 81.9 Ų | 81.9 | 52% | 0.517 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -62.9 | -47.8 | 177.1 | -175.1 | -179.9 | 178.1 | -176.7 | 0 | 111.5 | F126 D127 I128 W132 G133 I134 | F126-K130 HydrophobicContact CE1-CD 4.38Å; F126-K130 WeakPolarHBondContact O-CB 3.36Å; F126-K130 PolarHBondContact O-N 3.21Å; D127-K130 PolarHBondContact O-N 3.01Å; I128-K130 VanDerWaalsContact C-N 3.33Å; I128-K130 PolarHBondContact O-N 3.36Å; K130-W132 VanDerWaalsContact C-N 3.33Å; K130-W132 PolarHBondContact O-N 3.28Å; K130-G133 PolarHBondContact O-N 3.21Å; K130-I134 HydrophobicContact CG-CD1 4.15Å; K130-I134 WeakPolarHBondContact O-CG1 3.41Å; K130-I134 PolarHBondContact O-N 3.42Å |
| 131 | K | 87.9 | Confident | 88 | Confident | 145 Ų | 145 | 83.8 Ų | 83.8 | 63% | 0.63 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -62.7 | -41.6 | 177.8 | -171.8 | 173.2 | -178.7 | 177.9 | 0 | 111.3 | D127 I128 I134 N135 | D127-K131 WeakPolarHBondContact O-CB 3.33Å; D127-K131 PolarHBondContact O-N 3.4Å; I128-K131 PolarHBondContact O-N 3.46Å; K131-I134 PolarHBondContact O-N 3.46Å; K131-N135 WeakPolarHBondContact O-CB 3.41Å; K131-N135 PolarHBondContact O-N 3.35Å |
| 132 | W | 89.3 | Confident | 89.2 | Confident | 146 Ų | 146 | 80.3 Ų | 80.3 | 55% | 0.553 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -60.7 | -45.7 | 174 | 173.5 | 84.5 | 0 | 0 | 0 | 112.3 | I128 V129 K130 I134 N135 T136 | I128-W132 VanDerWaalsContact O-CB 3.31Å; I128-W132 WeakPolarHBondContact O-CB 3.45Å; I128-W132 PolarHBondContact O-N 3.36Å; V129-W132 PolarHBondContact O-N 3.24Å; K130-W132 VanDerWaalsContact C-N 3.33Å; K130-W132 PolarHBondContact O-N 3.28Å; W132-I134 PolarHBondContact O-N 3.11Å; W132-N135 PolarHBondContact O-N 3.29Å; W132-T136 WeakPolarHBondContact O-CB 3.49Å; W132-T136 PolarHBondContact O-N 2.93Å; W132-T136 PolarHBondContact O-OG1 3.13Å |
| 133 | G | 94 | Very high | 90.1 | Very high | 31 Ų | 31 | 79.1 Ų | 79.1 | 32% | 0.32 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -62.1 | -43.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | V129 K130 T136 Y137 | V129-G133 PolarHBondContact O-N 2.89Å; K130-G133 PolarHBondContact O-N 3.21Å; G133-T136 PolarHBondContact O-N 3.28Å; G133-Y137 WeakPolarHBondContact O-CB 3.41Å; G133-Y137 PolarHBondContact O-N 3.32Å |
| 134 | I | 91.8 | Very high | 91 | Very high | 78 Ų | 78 | 81.2 Ų | 81.2 | 40% | 0.4 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.8 | -47.4 | 175.5 | -67 | 167 | 0 | 0 | 0 | 110.8 | K130 K131 W132 T136 Y137 K138 | K130-I134 HydrophobicContact CG-CD1 4.15Å; K130-I134 WeakPolarHBondContact O-CG1 3.41Å; K130-I134 PolarHBondContact O-N 3.42Å; K131-I134 PolarHBondContact O-N 3.46Å; W132-I134 PolarHBondContact O-N 3.11Å; I134-T136 VanDerWaalsContact C-N 3.33Å; I134-T136 PolarHBondContact O-N 3.42Å; I134-Y137 PolarHBondContact O-N 3.26Å; I134-K138 HydrophobicContact CG2-CD 4.14Å; I134-K138 HydrophobicContact CG2-CG 4.5Å; I134-K138 WeakPolarHBondContact O-CG 3.33Å; I134-K138 PolarHBondContact O-N 2.89Å |
| 135 | N | 92 | Very high | 91.6 | Very high | 28 Ų | 28 | 76.6 Ų | 76.6 | 15% | 0.15 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -58.8 | -47 | 178.9 | -169.2 | 52.8 | 0 | 0 | 0 | 111.5 | K131 W132 Y137 K138 C139 E267 Y271 | K131-N135 WeakPolarHBondContact O-CB 3.41Å; K131-N135 PolarHBondContact O-N 3.35Å; W132-N135 PolarHBondContact O-N 3.29Å; N135-Y137 PolarHBondContact O-N 3.43Å; N135-K138 PolarHBondContact O-N 3.41Å; N135-C139 WeakPolarHBondContact O-CB 3.28Å; N135-C139 PolarHBondContact O-N 3.4Å; N135-C139 PolarHBondContact O-SG 3.02Å; N135-E267 PolarHBondContact ND2-OE1 3.48Å; N135-Y271 WeakPolarHBondContact OD1-CE2 3.45Å; N135-Y271 PolarHBondContact OD1-OH 3.22Å; N135-Y271 VanDerWaalsContact OD1-OH 3.05Å |
| 136 | T | 93.1 | Very high | 92.1 | Very high | 30 Ų | 30 | 71.6 Ų | 71.6 | 18% | 0.184 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -61.4 | -44.7 | 179.7 | -59.1 | 0 | 0 | 0 | 0 | 111.2 | L87 W132 G133 I134 T140 | L87-T136 HydrophobicContact CD1-CG2 4.14Å; W132-T136 WeakPolarHBondContact O-CB 3.49Å; W132-T136 PolarHBondContact O-N 2.93Å; W132-T136 PolarHBondContact O-OG1 3.13Å; G133-T136 PolarHBondContact O-N 3.28Å; I134-T136 VanDerWaalsContact C-N 3.33Å; I134-T136 PolarHBondContact O-N 3.42Å; T136-T140 VanDerWaalsContact O-CB 3.3Å; T136-T140 WeakPolarHBondContact O-CB 3.39Å; T136-T140 PolarHBondContact O-N 3.45Å; T136-T140 PolarHBondContact O-OG1 3.43Å |
| 137 | Y | 95.2 | Very high | 92.3 | Very high | 160 Ų | 160 | 73.4 Ų | 73.4 | 63% | 0.627 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -60.3 | -49.5 | 175.7 | 171.6 | -102.2 | 0 | 0 | 0 | 111.8 | G133 I134 N135 C139 T140 K141 | G133-Y137 WeakPolarHBondContact O-CB 3.41Å; G133-Y137 PolarHBondContact O-N 3.32Å; I134-Y137 PolarHBondContact O-N 3.26Å; N135-Y137 PolarHBondContact O-N 3.43Å; Y137-C139 PolarHBondContact O-N 3.01Å; Y137-T140 PolarHBondContact O-N 3.49Å; Y137-K141 WeakPolarHBondContact O-CB 3.21Å; Y137-K141 PolarHBondContact O-N 2.92Å |
| 138 | K | 94.3 | Very high | 92.6 | Very high | 33 Ų | 33 | 76 Ų | 76 | 14% | 0.143 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -58.7 | -48.8 | 179 | -75 | -179.3 | 169.7 | -170.8 | 0 | 112 | I134 N135 T140 K141 Q142 A270 Y271 D274 | I134-K138 HydrophobicContact CG2-CD 4.14Å; I134-K138 HydrophobicContact CG2-CG 4.5Å; I134-K138 WeakPolarHBondContact O-CG 3.33Å; I134-K138 PolarHBondContact O-N 2.89Å; N135-K138 PolarHBondContact O-N 3.41Å; K138-T140 VanDerWaalsContact C-N 3.32Å; K138-T140 PolarHBondContact O-N 2.8Å; K138-K141 PolarHBondContact O-N 2.94Å; K138-Q142 WeakPolarHBondContact O-CB 3.37Å; K138-Q142 PolarHBondContact O-N 3.31Å; K138-A270 HydrophobicContact CB-CB 4.13Å; K138-Y271 HydrophobicContact CD-CD1 4.35Å; K138-Y271 HydrophobicContact CD-CE1 3.93Å; K138-Y271 HydrophobicContact CD-CE2 4.35Å; K138-D274 WeakPolarHBondContact CE-OD2 3.48Å; K138-D274 VanDerWaalsContact NZ-CG 3.26Å; K138-D274 IonicContact NZ-OD1 3.83Å; K138-D274 IonicContact NZ-OD2 2.85Å; K138-D274 PolarHBondContact NZ-OD2 3.45Å |
| 139 | C | 94.9 | Very high | 92.7 | Very high | 8 Ų | 8 | 73.8 Ų | 73.8 | 5% | 0.054 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -63.5 | -38.2 | 178.2 | -65.4 | 0 | 0 | 0 | 0 | 112 | N135 Y137 Q142 L143 L266 | N135-C139 WeakPolarHBondContact O-CB 3.28Å; N135-C139 PolarHBondContact O-N 3.4Å; N135-C139 PolarHBondContact O-SG 3.02Å; Y137-C139 PolarHBondContact O-N 3.01Å; C139-Q142 PolarHBondContact O-N 3.43Å; C139-L143 VanDerWaalsContact O-CB 3.31Å; C139-L143 WeakPolarHBondContact O-CB 3.33Å; C139-L143 PolarHBondContact O-N 3Å; C139-L266 HydrophobicContact CB-CD2 4.06Å; C139-L266 HydrophobicContact CB-CG 4.21Å |
| 140 | T | 94.8 | Very high | 92.7 | Very high | 33 Ų | 33 | 79.6 Ų | 79.6 | 20% | 0.202 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -66.5 | -44.7 | 176.4 | -56.7 | 0 | 0 | 0 | 0 | 111.1 | T136 Y137 K138 Q142 L143 L144 | T136-T140 VanDerWaalsContact O-CB 3.3Å; T136-T140 WeakPolarHBondContact O-CB 3.39Å; T136-T140 PolarHBondContact O-N 3.45Å; T136-T140 PolarHBondContact O-OG1 3.43Å; Y137-T140 PolarHBondContact O-N 3.49Å; K138-T140 VanDerWaalsContact C-N 3.32Å; K138-T140 PolarHBondContact O-N 2.8Å; T140-Q142 VanDerWaalsContact C-N 3.34Å; T140-Q142 PolarHBondContact O-N 3.06Å; T140-L143 PolarHBondContact O-N 3.24Å; T140-L144 HydrophobicContact CG2-CD1 4.19Å; T140-L144 WeakPolarHBondContact O-CG 3.39Å; T140-L144 PolarHBondContact O-N 2.87Å |
| 141 | K | 95.2 | Very high | 92.2 | Very high | 78 Ų | 78 | 75 Ų | 75 | 34% | 0.339 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -57.7 | -47.8 | 174.1 | -178.5 | -173.6 | 169.7 | -164.9 | 0 | 110.3 | Y137 K138 L144 S145 E277 | Y137-K141 WeakPolarHBondContact O-CB 3.21Å; Y137-K141 PolarHBondContact O-N 2.92Å; K138-K141 PolarHBondContact O-N 2.94Å; K141-L144 PolarHBondContact O-N 3.23Å; K141-S145 WeakPolarHBondContact O-CB 3.22Å; K141-S145 PolarHBondContact O-N 3.18Å; K141-S145 PolarHBondContact O-OG 3.33Å; K141-E277 IonicContact NZ-OE1 4Å; K141-E277 PolarHBondContact NZ-OE1 2.82Å; K141-E277 IonicContact NZ-OE2 3.71Å; K141-E277 PolarHBondContact NZ-OE2 3.16Å |
| 142 | Q | 95.9 | Very high | 92.2 | Very high | 4 Ų | 4 | 70.9 Ų | 70.9 | 2% | 0.019 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -60.8 | -49.3 | 178.6 | -179.7 | 60 | 26.2 | 0 | 0 | 112 | K138 C139 T140 L144 S145 E146 S152 L266 D269 A270 T273 | K138-Q142 WeakPolarHBondContact O-CB 3.37Å; K138-Q142 PolarHBondContact O-N 3.31Å; C139-Q142 PolarHBondContact O-N 3.43Å; T140-Q142 VanDerWaalsContact C-N 3.34Å; T140-Q142 PolarHBondContact O-N 3.06Å; Q142-L144 VanDerWaalsContact C-N 3.33Å; Q142-L144 PolarHBondContact O-N 3.44Å; Q142-S145 WeakPolarHBondContact O-CB 3.49Å; Q142-S145 PolarHBondContact O-N 3.4Å; Q142-S145 VanDerWaalsContact O-N 3.16Å; Q142-E146 WeakPolarHBondContact CG-OE1 3.43Å; Q142-E146 PolarHBondContact NE2-OE1 3.26Å; Q142-E146 WeakPolarHBondContact O-CG 3.5Å; Q142-E146 PolarHBondContact O-N 3.41Å; Q142-S152 PolarHBondContact NE2-O 2.83Å; Q142-S152 VanDerWaalsContact NE2-O 3.11Å; Q142-L266 HydrophobicContact CB-CD1 4.07Å; Q142-L266 HydrophobicContact CG-CD1 3.7Å; Q142-D269 HydrophobicContact CG-CB 3.97Å; Q142-A270 HydrophobicContact CB-CB 3.71Å; Q142-A270 HydrophobicContact CG-CB 4.13Å; Q142-T273 PolarHBondContact OE1-OG1 3.36Å |
| 143 | L | 93.3 | Very high | 92.5 | Very high | 31 Ų | 31 | 68.5 Ų | 68.5 | 16% | 0.162 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -57.8 | -45.3 | 179.5 | 179.3 | 65.9 | 0 | 0 | 0 | 111.9 | C139 T140 E146 R147 L266 | C139-L143 VanDerWaalsContact O-CB 3.31Å; C139-L143 WeakPolarHBondContact O-CB 3.33Å; C139-L143 PolarHBondContact O-N 3Å; T140-L143 PolarHBondContact O-N 3.24Å; L143-E146 PolarHBondContact O-N 2.86Å; L143-R147 VanDerWaalsContact O-CG 3.22Å; L143-R147 WeakPolarHBondContact O-CG 3.17Å; L143-R147 PolarHBondContact O-N 2.86Å; L143-L266 HydrophobicContact CB-CD1 4.14Å; L143-L266 HydrophobicContact CB-CD2 4.31Å |
| 144 | L | 94.2 | Very high | 92.6 | Very high | 77 Ų | 77 | 68.4 Ų | 68.4 | 40% | 0.403 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -65.5 | -43.7 | 177.5 | -68.3 | 174.9 | 0 | 0 | 0 | 111 | T140 K141 Q142 E146 R147 F148 | T140-L144 HydrophobicContact CG2-CD1 4.19Å; T140-L144 WeakPolarHBondContact O-CG 3.39Å; T140-L144 PolarHBondContact O-N 2.87Å; K141-L144 PolarHBondContact O-N 3.23Å; Q142-L144 VanDerWaalsContact C-N 3.33Å; Q142-L144 PolarHBondContact O-N 3.44Å; L144-E146 VanDerWaalsContact C-N 3.34Å; L144-E146 PolarHBondContact O-N 3.34Å; L144-R147 PolarHBondContact O-N 2.79Å; L144-F148 HydrophobicContact CB-CD2 4.5Å; L144-F148 HydrophobicContact CB-CE2 4.48Å; L144-F148 HydrophobicContact CD2-CE2 4.42Å; L144-F148 WeakPolarHBondContact O-CD2 3.5Å; L144-F148 PolarHBondContact O-N 2.94Å |
| 145 | S | 93.3 | Very high | 92.8 | Very high | 32 Ų | 32 | 68.2 Ų | 68.2 | 22% | 0.224 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -58.6 | -44 | 176.7 | -66.9 | 0 | 0 | 0 | 0 | 112.2 | K141 Q142 F148 G149 R150 G151 | K141-S145 WeakPolarHBondContact O-CB 3.22Å; K141-S145 PolarHBondContact O-N 3.18Å; K141-S145 PolarHBondContact O-OG 3.33Å; Q142-S145 WeakPolarHBondContact O-CB 3.49Å; Q142-S145 PolarHBondContact O-N 3.4Å; Q142-S145 VanDerWaalsContact O-N 3.16Å; S145-F148 PolarHBondContact O-N 3.34Å; S145-G149 PolarHBondContact O-N 3.36Å; S145-R150 PolarHBondContact O-N 3.43Å; S145-G151 PolarHBondContact O-N 3.29Å |
| 146 | E | 93.7 | Very high | 93 | Very high | 31 Ų | 31 | 68.7 Ų | 68.7 | 15% | 0.145 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -60.6 | -46.2 | 174.5 | -71.3 | 176.8 | -157.1 | 0 | 0 | 111.6 | Q142 L143 L144 F148 G149 R153 R265 | Q142-E146 WeakPolarHBondContact CG-OE1 3.43Å; Q142-E146 PolarHBondContact NE2-OE1 3.26Å; Q142-E146 WeakPolarHBondContact O-CG 3.5Å; Q142-E146 PolarHBondContact O-N 3.41Å; L143-E146 PolarHBondContact O-N 2.86Å; L144-E146 VanDerWaalsContact C-N 3.34Å; L144-E146 PolarHBondContact O-N 3.34Å; E146-F148 VanDerWaalsContact C-N 3.3Å; E146-F148 PolarHBondContact O-N 3.27Å; E146-G149 PolarHBondContact O-N 2.94Å; E146-G149 VanDerWaalsContact O-N 3.07Å; E146-R153 HydrophobicContact CG-CB 4.11Å; E146-R265 IonicContact OE2-NH2 3.88Å |
| 147 | R | 91.3 | Very high | 93.2 | Very high | 173 Ų | 173 | 74.1 Ų | 74.1 | 65% | 0.653 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -62.1 | -35.2 | -179.5 | -71.9 | -71.7 | -174.3 | -165.4 | 0.5 | 113.2 | L143 L144 G149 | L143-R147 VanDerWaalsContact O-CG 3.22Å; L143-R147 WeakPolarHBondContact O-CG 3.17Å; L143-R147 PolarHBondContact O-N 2.86Å; L144-R147 PolarHBondContact O-N 2.79Å; R147-G149 VanDerWaalsContact C-N 3.31Å |
| 148 | F | 93.1 | Very high | 93.3 | Very high | 149 Ų | 149 | 73.2 Ų | 73.2 | 65% | 0.654 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.2 | 5.6 | 177.5 | -68.7 | -64.6 | 0 | 0 | 0 | 113.6 | L144 S145 E146 R150 | L144-F148 HydrophobicContact CB-CD2 4.5Å; L144-F148 HydrophobicContact CB-CE2 4.48Å; L144-F148 HydrophobicContact CD2-CE2 4.42Å; L144-F148 WeakPolarHBondContact O-CD2 3.5Å; L144-F148 PolarHBondContact O-N 2.94Å; S145-F148 PolarHBondContact O-N 3.34Å; E146-F148 VanDerWaalsContact C-N 3.3Å; E146-F148 PolarHBondContact O-N 3.27Å; F148-R150 HydrophobicContact CB-CG 4.32Å; F148-R150 PolarHBondContact O-N 2.99Å |
| 149 | G | 89.2 | Confident | 93.4 | Very high | 70 Ų | 70 | 72 Ų | 72 | 72% | 0.722 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.5 | 20.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | S145 E146 R147 | S145-G149 PolarHBondContact O-N 3.36Å; E146-G149 PolarHBondContact O-N 2.94Å; E146-G149 VanDerWaalsContact O-N 3.07Å; R147-G149 VanDerWaalsContact C-N 3.31Å |
| 150 | R | 88.4 | Confident | 93.6 | Very high | 215 Ų | 215 | 73.7 Ų | 73.7 | 81% | 0.811 | 37% | 0.373 | S | S | * | . | trans | -103.4 | -12.4 | -179 | -63 | -178.3 | -177.9 | 176.1 | -0.3 | 113.2 | S145 F148 | S145-R150 PolarHBondContact O-N 3.43Å; F148-R150 HydrophobicContact CB-CG 4.32Å; F148-R150 PolarHBondContact O-N 2.99Å | ||
| 151 | G | 81.1 | Confident | 93.7 | Very high | 23 Ų | 23 | 77.6 Ų | 77.6 | 24% | 0.237 | 39% | 0.392 | C | S | . | . | S | Bend | trans | -110.8 | 144.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112 | S145 | S145-G151 PolarHBondContact O-N 3.29Š|
| 152 | S | 88.9 | Confident | 93.9 | Very high | 59 Ų | 59 | 77.1 Ų | 77.1 | 41% | 0.413 | 39% | 0.391 | S | S | . | . | trans | -80.5 | 128.9 | 171.3 | 48.5 | 0 | 0 | 0 | 0 | 109.8 | Q142 R272 | Q142-S152 PolarHBondContact NE2-O 2.83Å; Q142-S152 VanDerWaalsContact NE2-O 3.11Å; S152-R272 PolarHBondContact O-NH2 3.49Å; S152-R272 VanDerWaalsContact O-NH2 3.13Å; S152-R272 PolarHBondContact OG-NH1 3.47Å; S152-R272 VanDerWaalsContact OG-NH1 3.11Å; S152-R272 PolarHBondContact OG-NH2 2.88Å | ||
| 153 | R | 94.8 | Very high | 94 | Very high | 96 Ų | 96 | 77.1 Ų | 77.1 | 36% | 0.362 | 39% | 0.391 | S | S | . | . | trans | -109.1 | 131.7 | -178.3 | -179.8 | -178.1 | 179.7 | -93.4 | -5.9 | 110 | E146 V155 E160 | E146-R153 HydrophobicContact CG-CB 4.11Å; R153-V155 HydrophobicContact CG-CG2 4.31Å; R153-E160 IonicContact CZ-OE1 3.47Å; R153-E160 IonicContact NH1-OE1 2.89Å; R153-E160 PolarHBondContact NH1-OE1 2.98Å; R153-E160 IonicContact NH1-OE2 2.65Å; R153-E160 PolarHBondContact NH1-OE2 3.01Å; R153-E160 IonicContact NH2-OE1 3.71Å; R153-E160 PolarHBondContact NH2-OE1 2.9Å; R153-E160 IonicContact NH2-OE2 2.64Å | ||
| 154 | T | 96.1 | Very high | 94.3 | Very high | 28 Ų | 28 | 81.4 Ų | 81.4 | 17% | 0.172 | 41% | 0.41 | C | S | . | . | trans | -72.9 | 131.2 | 169.5 | -65.5 | 0 | 0 | 0 | 0 | 110.2 | R265 Y268 D269 Y305 | T154-R265 HydrophobicContact CG2-CG 4.49Å; T154-R265 WeakPolarHBondContact O-CD 3.29Å; T154-Y268 HydrophobicContact CG2-CE1 4.31Å; T154-Y268 WeakPolarHBondContact OG1-CE1 3.44Å; T154-D269 WeakPolarHBondContact CB-OD2 3.24Å; T154-D269 PolarHBondContact N-OD1 3.33Å; T154-D269 PolarHBondContact N-OD2 2.92Å; T154-D269 PolarHBondContact OG1-OD1 2.83Å; T154-D269 PolarHBondContact OG1-OD2 2.7Å; T154-Y305 HydrophobicContact CG2-CE1 4.19Å; T154-Y305 VanDerWaalsContact CG2-OH 3.31Å; T154-Y305 WeakPolarHBondContact CG2-OH 3.35Å | ||
| 155 | V | 95.8 | Very high | 94.5 | Very high | 75 Ų | 75 | 82.5 Ų | 82.5 | 46% | 0.455 | 42% | 0.416 | S | S | . | . | trans | -130.1 | 134.3 | -175.6 | -171.5 | 0 | 0 | 0 | 0 | 110.2 | R153 L157 | R153-V155 HydrophobicContact CG-CG2 4.31Å; V155-L157 HydrophobicContact CG1-CD2 4.36Å; V155-L157 HydrophobicContact CG1-CG 4.07Å | ||
| 156 | D | 96.6 | Very high | 94.7 | Very high | 37 Ų | 37 | 81.7 Ų | 81.7 | 20% | 0.198 | 41% | 0.409 | C | S | . | . | trans | -122.6 | 94.8 | 167.6 | -172.2 | -31.3 | 0 | 0 | 0 | 107.8 | E158 L159 E160 R309 | D156-E158 VanDerWaalsContact C-N 3.33Å; D156-E158 PolarHBondContact O-N 3Å; D156-E158 PolarHBondContact OD1-N 3.24Å; D156-L159 HydrophobicContact CB-CB 4.07Å; D156-L159 PolarHBondContact O-N 2.82Å; D156-L159 WeakPolarHBondContact OD1-CB 3.39Å; D156-L159 PolarHBondContact OD1-N 3.02Å; D156-L159 VanDerWaalsContact OD1-N 3.12Å; D156-E160 VanDerWaalsContact O-CB 3.27Å; D156-E160 WeakPolarHBondContact O-CB 3.33Å; D156-E160 VanDerWaalsContact O-CG 3.24Å; D156-E160 WeakPolarHBondContact O-CG 3.46Å; D156-E160 PolarHBondContact O-N 2.87Å; D156-R309 WeakPolarHBondContact OD2-CD 3.39Å | ||
| 157 | L | 96.9 | Very high | 95 | Very high | 145 Ų | 145 | 84.2 Ų | 84.2 | 76% | 0.759 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -61.1 | -41 | -170.7 | -74 | 150 | 0 | 0 | 0 | 112.4 | V155 L161 | V155-L157 HydrophobicContact CG1-CD2 4.36Å; V155-L157 HydrophobicContact CG1-CG 4.07Å; L157-L161 WeakPolarHBondContact O-CB 3.28Å; L157-L161 PolarHBondContact O-N 3.38Å; L157-L161 VanDerWaalsContact O-N 3.07Å |
| 158 | E | 97.3 | Very high | 95.3 | Very high | 140 Ų | 140 | 79.6 Ų | 79.6 | 65% | 0.654 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -67.9 | -48.1 | -178.7 | -175.4 | 179.1 | -178.5 | 0 | 0 | 110.4 | D156 L161 Q162 | D156-E158 VanDerWaalsContact C-N 3.33Å; D156-E158 PolarHBondContact O-N 3Å; D156-E158 PolarHBondContact OD1-N 3.24Å; E158-L161 PolarHBondContact O-N 3.41Å; E158-Q162 WeakPolarHBondContact O-CG 3.44Å; E158-Q162 PolarHBondContact O-N 3.46Å |
| 159 | L | 97.8 | Very high | 95.6 | Very high | 7 Ų | 7 | 73.6 Ų | 73.6 | 4% | 0.037 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -68 | -38.2 | -179.4 | -161.3 | 66.3 | 0 | 0 | 0 | 111.9 | D156 Q162 I163 Y261 R309 V312 A313 L316 | D156-L159 HydrophobicContact CB-CB 4.07Å; D156-L159 PolarHBondContact O-N 2.82Å; D156-L159 WeakPolarHBondContact OD1-CB 3.39Å; D156-L159 PolarHBondContact OD1-N 3.02Å; D156-L159 VanDerWaalsContact OD1-N 3.12Å; L159-Q162 PolarHBondContact O-N 3.03Å; L159-I163 HydrophobicContact CG-CD1 4.14Å; L159-I163 WeakPolarHBondContact O-CB 3.24Å; L159-I163 WeakPolarHBondContact O-CD1 3.4Å; L159-I163 VanDerWaalsContact O-CG1 3.22Å; L159-I163 WeakPolarHBondContact O-CG1 3.39Å; L159-I163 PolarHBondContact O-N 3.49Å; L159-Y261 HydrophobicContact CD2-CE1 4.15Å; L159-Y261 HydrophobicContact CD2-CE2 4.17Å; L159-R309 HydrophobicContact CD2-CG 3.72Å; L159-V312 HydrophobicContact CD1-CG1 4.04Å; L159-V312 HydrophobicContact CD2-CB 4.44Å; L159-V312 HydrophobicContact CD2-CG1 4.24Å; L159-V312 HydrophobicContact CG-CG1 4.26Å; L159-A313 HydrophobicContact CD1-CB 4Å; L159-L316 HydrophobicContact CD1-CD1 3.81Å |
| 160 | E | 97.7 | Very high | 96 | Very high | 44 Ų | 44 | 71.5 Ų | 71.5 | 21% | 0.206 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -60.3 | -45 | 174.6 | -77.5 | -178.5 | -172.7 | 0 | 0 | 111.4 | R153 D156 Q162 I163 E164 | R153-E160 IonicContact CZ-OE1 3.47Å; R153-E160 IonicContact NH1-OE1 2.89Å; R153-E160 PolarHBondContact NH1-OE1 2.98Å; R153-E160 IonicContact NH1-OE2 2.65Å; R153-E160 PolarHBondContact NH1-OE2 3.01Å; R153-E160 IonicContact NH2-OE1 3.71Å; R153-E160 PolarHBondContact NH2-OE1 2.9Å; R153-E160 IonicContact NH2-OE2 2.64Å; D156-E160 VanDerWaalsContact O-CB 3.27Å; D156-E160 WeakPolarHBondContact O-CB 3.33Å; D156-E160 VanDerWaalsContact O-CG 3.24Å; D156-E160 WeakPolarHBondContact O-CG 3.46Å; D156-E160 PolarHBondContact O-N 2.87Å; E160-Q162 PolarHBondContact O-N 3.43Å; E160-I163 PolarHBondContact O-N 3.2Å; E160-E164 WeakPolarHBondContact O-CG 3.38Å; E160-E164 PolarHBondContact O-N 3.27Å |
| 161 | L | 98.3 | Very high | 96.5 | Very high | 116 Ų | 116 | 68.6 Ų | 68.6 | 61% | 0.607 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -61.7 | -43.9 | 176.5 | -176.6 | 68.2 | 0 | 0 | 0 | 111.8 | L157 E158 I163 E164 L165 | L157-L161 WeakPolarHBondContact O-CB 3.28Å; L157-L161 PolarHBondContact O-N 3.38Å; L157-L161 VanDerWaalsContact O-N 3.07Å; E158-L161 PolarHBondContact O-N 3.41Å; L161-I163 VanDerWaalsContact C-N 3.34Å; L161-I163 PolarHBondContact O-N 2.84Å; L161-E164 PolarHBondContact O-N 3.33Å; L161-L165 WeakPolarHBondContact O-CB 3.36Å; L161-L165 PolarHBondContact O-N 2.97Å |
| 162 | Q | 98.4 | Very high | 97.3 | Very high | 68 Ų | 68 | 73 Ų | 73 | 32% | 0.318 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -63.7 | -39.7 | 177.4 | -70.1 | 177.6 | -7 | 0 | 0 | 112.1 | E158 L159 E160 L165 L166 L316 | E158-Q162 WeakPolarHBondContact O-CG 3.44Å; E158-Q162 PolarHBondContact O-N 3.46Å; L159-Q162 PolarHBondContact O-N 3.03Å; E160-Q162 PolarHBondContact O-N 3.43Å; Q162-L165 PolarHBondContact O-N 3.46Å; Q162-L166 PolarHBondContact O-N 3.27Å; Q162-L316 HydrophobicContact CB-CD1 3.93Å |
| 163 | I | 98.6 | Very high | 97.8 | Very high | 3 Ų | 3 | 72.3 Ų | 72.3 | 2% | 0.015 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -64.7 | -43.4 | 175.4 | -71.5 | 163.3 | 0 | 0 | 0 | 111.1 | L159 E160 L161 L166 R167 V258 Y261 V312 L316 | L159-I163 HydrophobicContact CG-CD1 4.14Å; L159-I163 WeakPolarHBondContact O-CB 3.24Å; L159-I163 WeakPolarHBondContact O-CD1 3.4Å; L159-I163 VanDerWaalsContact O-CG1 3.22Å; L159-I163 WeakPolarHBondContact O-CG1 3.39Å; L159-I163 PolarHBondContact O-N 3.49Å; E160-I163 PolarHBondContact O-N 3.2Å; L161-I163 VanDerWaalsContact C-N 3.34Å; L161-I163 PolarHBondContact O-N 2.84Å; I163-L166 PolarHBondContact O-N 3.48Å; I163-R167 WeakPolarHBondContact O-CG 3.47Å; I163-R167 PolarHBondContact O-N 3.39Å; I163-V258 HydrophobicContact CD1-CG1 3.95Å; I163-V258 HydrophobicContact CD1-CG2 4.26Å; I163-V258 HydrophobicContact CG1-CG1 4.11Å; I163-V258 HydrophobicContact CG1-CG2 3.92Å; I163-V258 HydrophobicContact CG2-CG1 3.64Å; I163-Y261 HydrophobicContact CD1-CD1 4.23Å; I163-Y261 HydrophobicContact CD1-CE1 4.14Å; I163-V312 HydrophobicContact CD1-CG1 4.22Å; I163-V312 HydrophobicContact CG1-CG1 4.31Å; I163-L316 HydrophobicContact CG1-CD1 4.32Å |
| 164 | E | 98.4 | Very high | 98 | Very high | 121 Ų | 121 | 71 Ų | 71 | 57% | 0.565 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -61.8 | -44.1 | 176.8 | -75.7 | -173 | 165.5 | 0 | 0 | 111.6 | E160 L161 L166 R167 E168 | E160-E164 WeakPolarHBondContact O-CG 3.38Å; E160-E164 PolarHBondContact O-N 3.27Å; L161-E164 PolarHBondContact O-N 3.33Å; E164-L166 VanDerWaalsContact C-N 3.34Å; E164-L166 PolarHBondContact O-N 2.82Å; E164-R167 PolarHBondContact O-N 3.25Å; E164-E168 PolarHBondContact O-N 3.3Å |
| 165 | L | 98.4 | Very high | 98.1 | Very high | 101 Ų | 101 | 73 Ų | 73 | 53% | 0.529 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -61.4 | -41 | 175.5 | -176.8 | 63.3 | 0 | 0 | 0 | 111.9 | L161 Q162 E168 T169 | L161-L165 WeakPolarHBondContact O-CB 3.36Å; L161-L165 PolarHBondContact O-N 2.97Å; Q162-L165 PolarHBondContact O-N 3.46Å; L165-E168 PolarHBondContact O-N 2.92Å; L165-T169 VanDerWaalsContact O-CB 3.29Å; L165-T169 WeakPolarHBondContact O-CB 3.38Å; L165-T169 PolarHBondContact O-N 2.99Å; L165-T169 PolarHBondContact O-OG1 3.31Å |
| 166 | L | 98.6 | Very high | 98.2 | Very high | 14 Ų | 14 | 72.5 Ų | 72.5 | 7% | 0.073 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -60.9 | -48.2 | 173.5 | 170.5 | 59.4 | 0 | 0 | 0 | 111.3 | Q162 I163 E164 E168 T169 K170 M251 T254 L255 L316 L319 | Q162-L166 PolarHBondContact O-N 3.27Å; I163-L166 PolarHBondContact O-N 3.48Å; E164-L166 VanDerWaalsContact C-N 3.34Å; E164-L166 PolarHBondContact O-N 2.82Å; L166-E168 VanDerWaalsContact C-N 3.3Å; L166-E168 PolarHBondContact O-N 2.9Å; L166-T169 PolarHBondContact O-N 3.5Å; L166-K170 WeakPolarHBondContact O-CB 3.42Å; L166-K170 PolarHBondContact O-N 3.08Å; L166-M251 HydrophobicContact CD1-CG 4.34Å; L166-T254 HydrophobicContact CD2-CG2 3.75Å; L166-L255 HydrophobicContact CD2-CD2 3.8Å; L166-L255 HydrophobicContact CD2-CG 4.05Å; L166-L255 HydrophobicContact CG-CD2 4.11Å; L166-L255 HydrophobicContact CG-CG 4.43Å; L166-L316 HydrophobicContact CB-CD2 4.21Å; L166-L316 HydrophobicContact CD2-CD2 3.62Å; L166-L316 HydrophobicContact CG-CD2 4.48Å; L166-L319 HydrophobicContact CD1-CD2 3.43Å; L166-L319 VanDerWaalsContact CD1-CD2 3.43Å; L166-L319 HydrophobicContact CD2-CD2 3.96Å; L166-L319 HydrophobicContact CG-CD2 4.35Å |
| 167 | R | 98.7 | Very high | 98.3 | Very high | 85 Ų | 85 | 71 Ų | 71 | 32% | 0.321 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -60.9 | -39.2 | 179 | -73.9 | 169.9 | 169.1 | 154.1 | -0.9 | 111.9 | I163 E164 R171 L255 E262 | I163-R167 WeakPolarHBondContact O-CG 3.47Å; I163-R167 PolarHBondContact O-N 3.39Å; E164-R167 PolarHBondContact O-N 3.25Å; R167-R171 WeakPolarHBondContact O-CG 3.49Å; R167-R171 PolarHBondContact O-N 3.35Å; R167-R171 PolarHBondContact O-NE 2.98Å; R167-L255 HydrophobicContact CG-CD2 3.92Å; R167-E262 IonicContact CZ-OE1 2.79Å; R167-E262 IonicContact CZ-OE2 3.66Å; R167-E262 IonicContact NH1-OE1 3.71Å; R167-E262 PolarHBondContact NH1-OE1 3.12Å; R167-E262 IonicContact NH2-OE1 3.1Å; R167-E262 PolarHBondContact NH2-OE1 3.13Å; R167-E262 IonicContact NH2-OE2 3.77Å; R167-E262 PolarHBondContact NH2-OE2 2.86Å |
| 168 | E | 98.6 | Very high | 98.4 | Very high | 75 Ų | 75 | 69.4 Ų | 69.4 | 35% | 0.35 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -68.4 | -46.6 | 174.6 | -167.3 | -172.1 | 178 | 0 | 0 | 112.1 | E164 L165 L166 K170 R171 K172 | E164-E168 PolarHBondContact O-N 3.3Å; L165-E168 PolarHBondContact O-N 2.92Å; L166-E168 VanDerWaalsContact C-N 3.3Å; L166-E168 PolarHBondContact O-N 2.9Å; E168-K170 VanDerWaalsContact C-N 3.32Å; E168-K170 PolarHBondContact O-N 3.35Å; E168-R171 PolarHBondContact O-N 3.12Å; E168-K172 VanDerWaalsContact CD-NZ 3.31Å; E168-K172 HydrophobicContact CG-CD 4.43Å; E168-K172 WeakPolarHBondContact O-CG 3.34Å; E168-K172 PolarHBondContact O-N 3.48Å; E168-K172 WeakPolarHBondContact OE1-CE 3.08Å; E168-K172 IonicContact OE1-NZ 3.75Å; E168-K172 PolarHBondContact OE1-NZ 3.46Å; E168-K172 IonicContact OE2-NZ 2.68Å |
| 169 | T | 98.6 | Very high | 98.5 | Very high | 23 Ų | 23 | 68.3 Ų | 68.3 | 14% | 0.141 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -58.2 | -45.3 | 178.1 | -60.8 | 0 | 0 | 0 | 0 | 111 | L165 L166 R171 K172 Y173 M251 K323 | L165-T169 VanDerWaalsContact O-CB 3.29Å; L165-T169 WeakPolarHBondContact O-CB 3.38Å; L165-T169 PolarHBondContact O-N 2.99Å; L165-T169 PolarHBondContact O-OG1 3.31Å; L166-T169 PolarHBondContact O-N 3.5Å; T169-R171 PolarHBondContact O-N 2.86Å; T169-K172 PolarHBondContact O-N 3.38Å; T169-Y173 HydrophobicContact CG2-CD1 4.26Å; T169-Y173 HydrophobicContact CG2-CE1 3.97Å; T169-Y173 HydrophobicContact CG2-CE2 4.39Å; T169-Y173 WeakPolarHBondContact O-CD1 3.39Å; T169-Y173 PolarHBondContact O-N 3.32Å; T169-M251 HydrophobicContact CG2-CE 4.12Å; T169-K323 HydrophobicContact CG2-CD 4.12Å |
| 170 | K | 98.6 | Very high | 98.5 | Very high | 26 Ų | 26 | 68.3 Ų | 68.3 | 11% | 0.113 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -57.9 | -48.4 | 175.6 | -174.6 | 174.5 | -174.9 | -78.7 | 0 | 111.8 | L166 E168 K172 Y173 E174 V247 M251 E252 L255 | L166-K170 WeakPolarHBondContact O-CB 3.42Å; L166-K170 PolarHBondContact O-N 3.08Å; E168-K170 VanDerWaalsContact C-N 3.32Å; E168-K170 PolarHBondContact O-N 3.35Å; K170-K172 VanDerWaalsContact C-N 3.33Å; K170-K172 PolarHBondContact O-N 2.79Å; K170-Y173 PolarHBondContact O-N 3.24Å; K170-Y173 VanDerWaalsContact O-N 3.16Å; K170-E174 HydrophobicContact CG-CG 4.49Å; K170-E174 IonicContact NZ-OE1 2.7Å; K170-E174 PolarHBondContact NZ-OE1 3.29Å; K170-E174 WeakPolarHBondContact O-CG 3.39Å; K170-E174 PolarHBondContact O-N 2.68Å; K170-V247 WeakPolarHBondContact CE-O 3.45Å; K170-V247 HydrophobicContact CG-CG1 4.14Å; K170-M251 HydrophobicContact CB-SD 3.94Å; K170-M251 HydrophobicContact CD-CB 4.22Å; K170-M251 HydrophobicContact CG-SD 4.11Å; K170-E252 VanDerWaalsContact CE-OE2 3.22Å; K170-E252 WeakPolarHBondContact CE-OE2 3.24Å; K170-E252 IonicContact NZ-OE2 3.93Å; K170-E252 PolarHBondContact NZ-OE2 2.91Å; K170-L255 HydrophobicContact CD-CD1 3.27Å |
| 171 | R | 98.7 | Very high | 98.6 | Very high | 154 Ų | 154 | 70.8 Ų | 70.8 | 58% | 0.581 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -59 | -42.3 | 177.5 | -76.3 | 179.8 | -70.3 | 145.1 | -4.7 | 112.3 | R167 E168 T169 E174 S175 | R167-R171 WeakPolarHBondContact O-CG 3.49Å; R167-R171 PolarHBondContact O-N 3.35Å; R167-R171 PolarHBondContact O-NE 2.98Å; E168-R171 PolarHBondContact O-N 3.12Å; T169-R171 PolarHBondContact O-N 2.86Å; R171-E174 PolarHBondContact O-N 2.97Å; R171-S175 PolarHBondContact O-N 3.29Å |
| 172 | K | 98.7 | Very high | 98.6 | Very high | 116 Ų | 116 | 67.2 Ų | 67.2 | 50% | 0.504 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -63.2 | -42.6 | 176.3 | -71.3 | 176.4 | -178.3 | 165.8 | 0 | 111.1 | E168 T169 K170 S175 V176 | E168-K172 VanDerWaalsContact CD-NZ 3.31Å; E168-K172 HydrophobicContact CG-CD 4.43Å; E168-K172 WeakPolarHBondContact O-CG 3.34Å; E168-K172 PolarHBondContact O-N 3.48Å; E168-K172 WeakPolarHBondContact OE1-CE 3.08Å; E168-K172 IonicContact OE1-NZ 3.75Å; E168-K172 PolarHBondContact OE1-NZ 3.46Å; E168-K172 IonicContact OE2-NZ 2.68Å; T169-K172 PolarHBondContact O-N 3.38Å; K170-K172 VanDerWaalsContact C-N 3.33Å; K170-K172 PolarHBondContact O-N 2.79Å; K172-S175 WeakPolarHBondContact O-CB 3.48Å; K172-S175 PolarHBondContact O-N 3.24Å; K172-V176 WeakPolarHBondContact O-CG2 3.42Å; K172-V176 PolarHBondContact O-N 3.12Å |
| 173 | Y | 98.8 | Very high | 98.6 | Very high | 45 Ų | 45 | 67.3 Ų | 67.3 | 18% | 0.176 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -71.1 | -33.4 | 179.5 | -76 | 21.4 | 0 | 0 | 0 | 112.1 | T169 K170 S175 V176 L177 L246 V247 M251 K323 M327 | T169-Y173 HydrophobicContact CG2-CD1 4.26Å; T169-Y173 HydrophobicContact CG2-CE1 3.97Å; T169-Y173 HydrophobicContact CG2-CE2 4.39Å; T169-Y173 WeakPolarHBondContact O-CD1 3.39Å; T169-Y173 PolarHBondContact O-N 3.32Å; K170-Y173 PolarHBondContact O-N 3.24Å; K170-Y173 VanDerWaalsContact O-N 3.16Å; Y173-S175 VanDerWaalsContact C-N 3.34Å; Y173-V176 PolarHBondContact O-N 3.16Å; Y173-L177 VanDerWaalsContact O-CB 3.29Å; Y173-L177 WeakPolarHBondContact O-CB 3.5Å; Y173-L177 PolarHBondContact O-N 3.42Å; Y173-L246 HydrophobicContact CD2-CD2 4.12Å; Y173-L246 HydrophobicContact CE2-CD2 3.95Å; Y173-V247 HydrophobicContact CD2-CG2 4.31Å; Y173-V247 HydrophobicContact CG-CG2 4.47Å; Y173-M251 HydrophobicContact CD2-CE 3.59Å; Y173-M251 HydrophobicContact CD2-SD 4.48Å; Y173-M251 HydrophobicContact CE2-CE 3.76Å; Y173-M251 HydrophobicContact CG-CE 4.44Å; Y173-K323 HydrophobicContact CE2-CD 4.22Å; Y173-K323 HydrophobicContact CE2-CG 3.98Å; Y173-M327 HydrophobicContact CD2-SD 4.06Å; Y173-M327 HydrophobicContact CE1-CE 4.44Å; Y173-M327 HydrophobicContact CE2-CE 3.98Å; Y173-M327 HydrophobicContact CE2-CG 3.6Å; Y173-M327 HydrophobicContact CE2-SD 3.47Å; Y173-M327 WeakPolarHBondContact CE2-SD 3.46Å |
| 174 | E | 98.7 | Very high | 98.6 | Very high | 69 Ų | 69 | 68 Ų | 68 | 32% | 0.322 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -60.5 | -43.3 | 169 | -74.3 | 172.1 | 159.2 | 0 | 0 | 111.3 | K170 R171 L177 Q178 V247 | K170-E174 HydrophobicContact CG-CG 4.49Å; K170-E174 IonicContact NZ-OE1 2.7Å; K170-E174 PolarHBondContact NZ-OE1 3.29Å; K170-E174 WeakPolarHBondContact O-CG 3.39Å; K170-E174 PolarHBondContact O-N 2.68Å; R171-E174 PolarHBondContact O-N 2.97Å; E174-L177 WeakPolarHBondContact O-CB 3.45Å; E174-L177 PolarHBondContact O-N 3.32Å; E174-Q178 WeakPolarHBondContact O-CG 3.36Å; E174-Q178 PolarHBondContact O-N 3.01Å; E174-V247 HydrophobicContact CG-CG1 3.48Å; E174-V247 VanDerWaalsContact CG-CG1 3.48Å |
| 175 | S | 98.6 | Very high | 98.6 | Very high | 68 Ų | 68 | 64.7 Ų | 64.7 | 48% | 0.476 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -61.3 | -45 | 174.9 | -171.3 | 0 | 0 | 0 | 0 | 112 | R171 K172 Y173 L177 Q178 L179 | R171-S175 PolarHBondContact O-N 3.29Å; K172-S175 WeakPolarHBondContact O-CB 3.48Å; K172-S175 PolarHBondContact O-N 3.24Å; Y173-S175 VanDerWaalsContact C-N 3.34Å; S175-L177 VanDerWaalsContact C-N 3.3Å; S175-L177 PolarHBondContact O-N 3.15Å; S175-Q178 PolarHBondContact O-N 3.22Å; S175-L179 WeakPolarHBondContact O-CG 3.37Å; S175-L179 PolarHBondContact O-N 2.94Å |
| 176 | V | 98.4 | Very high | 98.6 | Very high | 65 Ų | 65 | 66.2 Ų | 66.2 | 39% | 0.394 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -61.1 | -41.5 | 175.3 | 171.9 | 0 | 0 | 0 | 0 | 110.9 | K172 Y173 Q178 L179 G180 F239 | K172-V176 WeakPolarHBondContact O-CG2 3.42Å; K172-V176 PolarHBondContact O-N 3.12Å; Y173-V176 PolarHBondContact O-N 3.16Å; V176-Q178 VanDerWaalsContact C-N 3.34Å; V176-Q178 PolarHBondContact O-N 3.25Å; V176-L179 PolarHBondContact O-N 3.03Å; V176-G180 PolarHBondContact O-N 2.96Å; V176-F239 HydrophobicContact CG1-CZ 4.46Å |
| 177 | L | 98.4 | Very high | 98.6 | Very high | 5 Ų | 5 | 66.8 Ų | 66.8 | 3% | 0.026 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -62.9 | -39.9 | 177.4 | -178.9 | 63 | 0 | 0 | 0 | 112.1 | Y173 E174 S175 G180 R181 V240 I243 N244 | Y173-L177 VanDerWaalsContact O-CB 3.29Å; Y173-L177 WeakPolarHBondContact O-CB 3.5Å; Y173-L177 PolarHBondContact O-N 3.42Å; E174-L177 WeakPolarHBondContact O-CB 3.45Å; E174-L177 PolarHBondContact O-N 3.32Å; S175-L177 VanDerWaalsContact C-N 3.3Å; S175-L177 PolarHBondContact O-N 3.15Å; L177-G180 PolarHBondContact O-N 3.27Å; L177-R181 WeakPolarHBondContact O-CG 3.27Å; L177-R181 PolarHBondContact O-N 3.23Å; L177-V240 HydrophobicContact CD1-CB 4.47Å; L177-V240 HydrophobicContact CD1-CG1 3.81Å; L177-V240 WeakPolarHBondContact CD1-O 3.14Å; L177-I243 HydrophobicContact CB-CG2 4.22Å; L177-I243 HydrophobicContact CD1-CB 4.24Å; L177-I243 HydrophobicContact CD1-CG2 4.27Å; L177-N244 HydrophobicContact CD1-CB 3.95Å; L177-N244 HydrophobicContact CD2-CB 3.94Å |
| 178 | Q | 98.6 | Very high | 98.6 | Very high | 113 Ų | 113 | 68.9 Ų | 68.9 | 53% | 0.528 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -64.2 | -43.7 | 174.2 | -67.3 | -58.6 | -14.5 | 0 | 0 | 111.7 | E174 S175 V176 G180 R181 A182 | E174-Q178 WeakPolarHBondContact O-CG 3.36Å; E174-Q178 PolarHBondContact O-N 3.01Å; S175-Q178 PolarHBondContact O-N 3.22Å; V176-Q178 VanDerWaalsContact C-N 3.34Å; V176-Q178 PolarHBondContact O-N 3.25Å; Q178-G180 VanDerWaalsContact C-N 3.33Å; Q178-G180 PolarHBondContact O-N 3.07Å; Q178-R181 PolarHBondContact O-N 3.39Å; Q178-A182 PolarHBondContact O-N 2.97Å |
| 179 | L | 98.8 | Very high | 98.6 | Very high | 117 Ų | 117 | 68.6 Ų | 68.6 | 61% | 0.613 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -62.6 | -40.9 | 175.1 | -67.8 | 171.6 | 0 | 0 | 0 | 111.8 | S175 V176 R181 A182 L183 | S175-L179 WeakPolarHBondContact O-CG 3.37Å; S175-L179 PolarHBondContact O-N 2.94Å; V176-L179 PolarHBondContact O-N 3.03Å; L179-R181 PolarHBondContact O-N 3.42Å; L179-A182 PolarHBondContact O-N 3.34Å; L179-L183 WeakPolarHBondContact O-CB 3.44Å; L179-L183 PolarHBondContact O-N 2.99Å |
| 180 | G | 98.6 | Very high | 98.6 | Very high | 7 Ų | 7 | 71.5 Ų | 71.5 | 7% | 0.072 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -60.9 | -43.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | V176 L177 Q178 L183 T184 | V176-G180 PolarHBondContact O-N 2.96Å; L177-G180 PolarHBondContact O-N 3.27Å; Q178-G180 VanDerWaalsContact C-N 3.33Å; Q178-G180 PolarHBondContact O-N 3.07Å; G180-L183 PolarHBondContact O-N 3.4Å; G180-T184 PolarHBondContact O-N 3.37Å; G180-T184 PolarHBondContact O-OG1 3.48Å; G180-T184 VanDerWaalsContact O-OG1 3.12Å |
| 181 | R | 98.6 | Very high | 98.5 | Very high | 95 Ų | 95 | 70.5 Ų | 70.5 | 36% | 0.358 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63.3 | -43.2 | 174.5 | -72.7 | 172.5 | 178.1 | 142.9 | 1.1 | 112.5 | L177 Q178 L179 L183 T184 A185 V240 N244 | L177-R181 WeakPolarHBondContact O-CG 3.27Å; L177-R181 PolarHBondContact O-N 3.23Å; Q178-R181 PolarHBondContact O-N 3.39Å; L179-R181 PolarHBondContact O-N 3.42Å; R181-L183 VanDerWaalsContact C-N 3.33Å; R181-T184 PolarHBondContact O-N 2.85Å; R181-A185 PolarHBondContact O-N 3.49Å; R181-V240 HydrophobicContact CG-CG1 3.76Å; R181-N244 PolarHBondContact NH2-OD1 2.86Å |
| 182 | A | 98.8 | Very high | 98.5 | Very high | 41 Ų | 41 | 67.6 Ų | 67.6 | 34% | 0.339 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62 | -43.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q178 L179 A185 H186 | Q178-A182 PolarHBondContact O-N 2.97Å; L179-A182 PolarHBondContact O-N 3.34Å; A182-A185 PolarHBondContact O-N 2.85Å; A182-H186 VanDerWaalsContact O-CG 3.25Å; A182-H186 PolarHBondContact O-N 3.25Å |
| 183 | L | 98.5 | Very high | 98.5 | Very high | 71 Ų | 71 | 66.4 Ų | 66.4 | 37% | 0.372 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -59.9 | -47.3 | 175 | 179.3 | 62.4 | 0 | 0 | 0 | 111.6 | L179 G180 R181 A185 H186 L187 V236 F334 | L179-L183 WeakPolarHBondContact O-CB 3.44Å; L179-L183 PolarHBondContact O-N 2.99Å; G180-L183 PolarHBondContact O-N 3.4Å; R181-L183 VanDerWaalsContact C-N 3.33Å; L183-A185 VanDerWaalsContact C-N 3.33Å; L183-A185 PolarHBondContact O-N 3.23Å; L183-H186 PolarHBondContact O-N 3.41Å; L183-L187 HydrophobicContact CD1-CD1 4.12Å; L183-L187 HydrophobicContact CD1-CG 4.07Å; L183-L187 HydrophobicContact CG-CD1 3.98Å; L183-L187 HydrophobicContact CG-CG 4.36Å; L183-L187 WeakPolarHBondContact O-CB 3.29Å; L183-L187 WeakPolarHBondContact O-CG 3.48Å; L183-L187 PolarHBondContact O-N 2.97Å; L183-V236 HydrophobicContact CD2-CG1 4.24Å; L183-V236 HydrophobicContact CG-CG1 4.44Å; L183-F334 HydrophobicContact CD2-CE2 4.3Å; L183-F334 HydrophobicContact CD2-CZ 4.1Å |
| 184 | T | 98.4 | Very high | 98.4 | Very high | 18 Ų | 18 | 65.2 Ų | 65.2 | 11% | 0.11 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -55.1 | -47.9 | 174.7 | -64.6 | 0 | 0 | 0 | 0 | 111.6 | G180 R181 L187 Y188 L233 V236 N237 | G180-T184 PolarHBondContact O-N 3.37Å; G180-T184 PolarHBondContact O-OG1 3.48Å; G180-T184 VanDerWaalsContact O-OG1 3.12Å; R181-T184 PolarHBondContact O-N 2.85Å; T184-L187 PolarHBondContact O-N 2.83Å; T184-Y188 WeakPolarHBondContact O-CB 3.39Å; T184-Y188 PolarHBondContact O-N 2.84Å; T184-L233 HydrophobicContact CG2-CD1 3.83Å; T184-L233 WeakPolarHBondContact O-CD1 3.21Å; T184-V236 WeakPolarHBondContact OG1-CG1 3.41Å; T184-N237 WeakPolarHBondContact CG2-ND2 3.33Å; T184-N237 VanDerWaalsContact CG2-OD1 3.24Å; T184-N237 WeakPolarHBondContact CG2-OD1 3.24Å |
| 185 | A | 98.5 | Very high | 98.4 | Very high | 50 Ų | 50 | 64.9 Ų | 64.9 | 41% | 0.413 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62.5 | -46.1 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | R181 A182 L183 Y188 S189 | R181-A185 PolarHBondContact O-N 3.49Å; A182-A185 PolarHBondContact O-N 2.85Å; L183-A185 VanDerWaalsContact C-N 3.33Å; L183-A185 PolarHBondContact O-N 3.23Å; A185-Y188 PolarHBondContact O-N 2.66Å; A185-S189 PolarHBondContact O-N 2.97Å; A185-S189 PolarHBondContact O-OG 3.02Å |
| 186 | H | 98.6 | Very high | 98.4 | Very high | 134 Ų | 134 | 64.5 Ų | 64.5 | 62% | 0.62 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -65.6 | -41.1 | 178.5 | -65.2 | 172.4 | 0 | 0 | 0 | 112.4 | A182 L183 Y188 S189 L190 | A182-H186 VanDerWaalsContact O-CG 3.25Å; A182-H186 PolarHBondContact O-N 3.25Å; L183-H186 PolarHBondContact O-N 3.41Å; H186-Y188 VanDerWaalsContact C-N 3.35Å; H186-S189 PolarHBondContact O-N 3.31Å; H186-L190 WeakPolarHBondContact O-CB 3.1Å; H186-L190 PolarHBondContact O-N 2.89Å |
| 187 | L | 98.1 | Very high | 98.4 | Very high | 26 Ų | 26 | 64.6 Ų | 64.6 | 14% | 0.136 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -61.3 | -45.3 | 174.9 | -76.6 | 175.4 | 0 | 0 | 0 | 110.8 | L183 T184 S189 L190 L191 L232 L233 V236 | L183-L187 HydrophobicContact CD1-CD1 4.12Å; L183-L187 HydrophobicContact CD1-CG 4.07Å; L183-L187 HydrophobicContact CG-CD1 3.98Å; L183-L187 HydrophobicContact CG-CG 4.36Å; L183-L187 WeakPolarHBondContact O-CB 3.29Å; L183-L187 WeakPolarHBondContact O-CG 3.48Å; L183-L187 PolarHBondContact O-N 2.97Å; T184-L187 PolarHBondContact O-N 2.83Å; L187-S189 PolarHBondContact O-N 3.16Å; L187-L190 WeakPolarHBondContact O-CB 3.22Å; L187-L190 PolarHBondContact O-N 2.92Å; L187-L191 WeakPolarHBondContact O-CD1 3.44Å; L187-L191 PolarHBondContact O-N 3.34Å; L187-L232 HydrophobicContact CD1-CD2 4.43Å; L187-L233 HydrophobicContact CB-CD1 3.97Å; L187-V236 HydrophobicContact CD1-CG2 4.04Å |
| 188 | Y | 98.4 | Very high | 98.3 | Very high | 129 Ų | 129 | 64.4 Ų | 64.4 | 51% | 0.506 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -57.7 | -48.2 | 175.9 | 178.9 | -99.8 | 0 | 0 | 0 | 111.9 | T184 A185 H186 L190 L191 Q192 L233 | T184-Y188 WeakPolarHBondContact O-CB 3.39Å; T184-Y188 PolarHBondContact O-N 2.84Å; A185-Y188 PolarHBondContact O-N 2.66Å; H186-Y188 VanDerWaalsContact C-N 3.35Å; Y188-L190 VanDerWaalsContact C-N 3.33Å; Y188-L190 PolarHBondContact O-N 3.4Å; Y188-L191 PolarHBondContact O-N 2.93Å; Y188-Q192 HydrophobicContact CD1-CG 4.38Å; Y188-Q192 HydrophobicContact CE1-CG 3.96Å; Y188-Q192 HydrophobicContact CE2-CG 4.43Å; Y188-Q192 WeakPolarHBondContact O-CG 3.42Å; Y188-Q192 PolarHBondContact O-N 3.46Å; Y188-L233 HydrophobicContact CD2-CD2 3.92Å |
| 189 | S | 98.6 | Very high | 98.3 | Very high | 69 Ų | 69 | 63.9 Ų | 63.9 | 48% | 0.483 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -61.7 | -38.3 | 176.4 | -63.5 | 0 | 0 | 0 | 0 | 113.2 | A185 H186 L187 Q192 T193 | A185-S189 PolarHBondContact O-N 2.97Å; A185-S189 PolarHBondContact O-OG 3.02Å; H186-S189 PolarHBondContact O-N 3.31Å; L187-S189 PolarHBondContact O-N 3.16Å; S189-Q192 PolarHBondContact O-N 3.27Å; S189-T193 PolarHBondContact O-N 3.28Å; S189-T193 VanDerWaalsContact O-N 3.11Å; S189-T193 PolarHBondContact O-OG1 3.15Å |
| 190 | L | 98.2 | Very high | 98.3 | Very high | 83 Ų | 83 | 60.5 Ų | 60.5 | 44% | 0.435 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61.4 | -48.6 | 175.1 | 176.6 | 64 | 0 | 0 | 0 | 110.8 | H186 L187 Y188 Q192 T193 Q194 | H186-L190 WeakPolarHBondContact O-CB 3.1Å; H186-L190 PolarHBondContact O-N 2.89Å; L187-L190 WeakPolarHBondContact O-CB 3.22Å; L187-L190 PolarHBondContact O-N 2.92Å; Y188-L190 VanDerWaalsContact C-N 3.33Å; Y188-L190 PolarHBondContact O-N 3.4Å; L190-Q192 VanDerWaalsContact C-N 3.34Å; L190-Q192 PolarHBondContact O-N 3.49Å; L190-T193 WeakPolarHBondContact O-CB 3.47Å; L190-T193 PolarHBondContact O-N 2.9Å; L190-T193 VanDerWaalsContact O-N 3.13Å; L190-Q194 HydrophobicContact CD1-CG 4.24Å; L190-Q194 HydrophobicContact CG-CG 4.41Å; L190-Q194 WeakPolarHBondContact O-CG 3.2Å; L190-Q194 PolarHBondContact O-N 3.48Å |
| 191 | L | 97.9 | Very high | 98.3 | Very high | 5 Ų | 5 | 62.2 Ų | 62.2 | 3% | 0.026 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59.5 | -42.8 | 178.6 | -93.2 | 63.2 | 0 | 0 | 0 | 112.1 | L187 Y188 T193 Q194 H195 E230 L233 | L187-L191 WeakPolarHBondContact O-CD1 3.44Å; L187-L191 PolarHBondContact O-N 3.34Å; Y188-L191 PolarHBondContact O-N 2.93Å; L191-T193 VanDerWaalsContact C-N 3.29Å; L191-T193 PolarHBondContact O-N 3.24Å; L191-Q194 PolarHBondContact O-N 3.34Å; L191-H195 PolarHBondContact O-CD2 3.48Å; L191-H195 PolarHBondContact O-N 3.34Å; L191-E230 HydrophobicContact CD2-CB 4.37Å; L191-E230 HydrophobicContact CD2-CG 3.71Å; L191-L233 HydrophobicContact CD2-CB 4.33Å; L191-L233 HydrophobicContact CD2-CD2 4.05Å |
| 192 | Q | 98.3 | Very high | 98.3 | Very high | 93 Ų | 93 | 58.6 Ų | 58.6 | 44% | 0.435 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.3 | -40.8 | 176.2 | -66.8 | -55.5 | -54.3 | 0 | 0 | 111.7 | Y188 S189 L190 H195 A196 | Y188-Q192 HydrophobicContact CD1-CG 4.38Å; Y188-Q192 HydrophobicContact CE1-CG 3.96Å; Y188-Q192 HydrophobicContact CE2-CG 4.43Å; Y188-Q192 WeakPolarHBondContact O-CG 3.42Å; Y188-Q192 PolarHBondContact O-N 3.46Å; S189-Q192 PolarHBondContact O-N 3.27Å; L190-Q192 VanDerWaalsContact C-N 3.34Å; L190-Q192 PolarHBondContact O-N 3.49Å; Q192-H195 PolarHBondContact O-N 2.96Å; Q192-A196 PolarHBondContact O-N 3.36Å; Q192-A196 VanDerWaalsContact O-N 3.1Å |
| 193 | T | 98.4 | Very high | 98.3 | Very high | 91 Ų | 91 | 60 Ų | 60 | 56% | 0.558 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -68.3 | -40.6 | 177.6 | -54.1 | 0 | 0 | 0 | 0 | 111.4 | S189 L190 L191 A196 L197 | S189-T193 PolarHBondContact O-N 3.28Å; S189-T193 VanDerWaalsContact O-N 3.11Å; S189-T193 PolarHBondContact O-OG1 3.15Å; L190-T193 WeakPolarHBondContact O-CB 3.47Å; L190-T193 PolarHBondContact O-N 2.9Å; L190-T193 VanDerWaalsContact O-N 3.13Å; L191-T193 VanDerWaalsContact C-N 3.29Å; L191-T193 PolarHBondContact O-N 3.24Å; T193-A196 PolarHBondContact O-N 3.49Å; T193-L197 VanDerWaalsContact O-CB 3.25Å; T193-L197 WeakPolarHBondContact O-CB 3.35Å; T193-L197 PolarHBondContact O-N 3.22Å |
| 194 | Q | 97.5 | Very high | 98.2 | Very high | 20 Ų | 20 | 59.9 Ų | 59.9 | 9% | 0.093 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -64.5 | -39 | 176.4 | -73.2 | -178 | -52 | 0 | 0 | 111.9 | L190 L191 L197 G198 C226 | L190-Q194 HydrophobicContact CD1-CG 4.24Å; L190-Q194 HydrophobicContact CG-CG 4.41Å; L190-Q194 WeakPolarHBondContact O-CG 3.2Å; L190-Q194 PolarHBondContact O-N 3.48Å; L191-Q194 PolarHBondContact O-N 3.34Å; Q194-L197 PolarHBondContact O-N 3.21Å; Q194-G198 PolarHBondContact O-N 3.01Å; Q194-C226 WeakPolarHBondContact CB-SG 3.35Å |
| 195 | H | 98 | Very high | 98.2 | Very high | 62 Ų | 62 | 59.9 Ų | 59.9 | 29% | 0.287 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -60 | -53.7 | 173.4 | -89.5 | -58 | 0 | 0 | 0 | 111 | L191 Q192 L197 G198 D199 C226 E230 | L191-H195 PolarHBondContact O-CD2 3.48Å; L191-H195 PolarHBondContact O-N 3.34Å; Q192-H195 PolarHBondContact O-N 2.96Å; H195-L197 VanDerWaalsContact C-N 3.28Å; H195-L197 PolarHBondContact O-N 2.78Å; H195-G198 PolarHBondContact O-N 3.19Å; H195-G198 VanDerWaalsContact O-N 3.15Å; H195-D199 PolarHBondContact O-N 3.45Å; H195-C226 PolarHBondContact N-SG 2.9Å; H195-E230 IonicContact CE1-OE1 2.94Å; H195-E230 IonicContact NE2-OE1 2.8Å; H195-E230 PolarHBondContact NE2-OE1 2.89Å |
| 196 | A | 98.4 | Very high | 98.1 | Very high | 61 Ų | 61 | 65.1 Ų | 65.1 | 50% | 0.504 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -59.7 | -39.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q192 T193 A200 | Q192-A196 PolarHBondContact O-N 3.36Å; Q192-A196 VanDerWaalsContact O-N 3.1Å; T193-A196 PolarHBondContact O-N 3.49Å; A196-A200 WeakPolarHBondContact O-CB 3.47Å; A196-A200 PolarHBondContact O-N 3.25Å |
| 197 | L | 98.3 | Very high | 98.1 | Very high | 67 Ų | 67 | 65.2 Ų | 65.2 | 35% | 0.351 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -69.3 | -39.5 | 177.5 | -174.2 | 58.9 | 0 | 0 | 0 | 111.9 | T193 Q194 H195 A200 F201 Q222 | T193-L197 VanDerWaalsContact O-CB 3.25Å; T193-L197 WeakPolarHBondContact O-CB 3.35Å; T193-L197 PolarHBondContact O-N 3.22Å; Q194-L197 PolarHBondContact O-N 3.21Å; H195-L197 VanDerWaalsContact C-N 3.28Å; H195-L197 PolarHBondContact O-N 2.78Å; L197-A200 PolarHBondContact O-N 3.34Å; L197-F201 HydrophobicContact CD1-CD2 4.3Å; L197-F201 HydrophobicContact CD1-CE1 4.09Å; L197-F201 HydrophobicContact CD1-CE2 3.79Å; L197-F201 HydrophobicContact CD1-CZ 3.68Å; L197-F201 HydrophobicContact CD2-CE2 4.12Å; L197-F201 HydrophobicContact CD2-CZ 4.49Å; L197-F201 HydrophobicContact CG-CD2 4.07Å; L197-F201 HydrophobicContact CG-CE2 3.65Å; L197-F201 HydrophobicContact CG-CZ 4.07Å; L197-F201 WeakPolarHBondContact O-CD2 3.38Å; L197-F201 WeakPolarHBondContact O-CG 3.22Å; L197-F201 PolarHBondContact O-N 3.43Å; L197-Q222 HydrophobicContact CD2-CG 4.46Å; L197-Q222 VanDerWaalsContact CD2-NE2 3.35Å; L197-Q222 HydrophobicContact CG-CG 4.43Å |
| 198 | G | 97.5 | Very high | 97.9 | Very high | 0 Ų | 0 | 65.7 Ų | 65.7 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -61.5 | -43.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q194 H195 F201 A202 | Q194-G198 PolarHBondContact O-N 3.01Å; H195-G198 PolarHBondContact O-N 3.19Å; H195-G198 VanDerWaalsContact O-N 3.15Å; G198-F201 PolarHBondContact O-N 3.46Å; G198-A202 WeakPolarHBondContact O-CB 3.37Å; G198-A202 PolarHBondContact O-N 3.27Å |
| 199 | D | 98.3 | Very high | 97.7 | Very high | 102 Ų | 102 | 64.5 Ų | 64.5 | 55% | 0.545 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -65.8 | -43.3 | 176.8 | -74.1 | -12.2 | 0 | 0 | 0 | 111.9 | H195 F201 A202 D203 | H195-D199 PolarHBondContact O-N 3.45Å; D199-F201 PolarHBondContact O-N 3.4Å; D199-A202 PolarHBondContact O-N 3.39Å; D199-D203 WeakPolarHBondContact O-CB 3.41Å; D199-D203 PolarHBondContact O-N 2.88Å |
| 200 | A | 98.5 | Very high | 97.5 | Very high | 47 Ų | 47 | 69.8 Ų | 69.8 | 39% | 0.388 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61.8 | -42.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A196 L197 D203 L204 | A196-A200 WeakPolarHBondContact O-CB 3.47Å; A196-A200 PolarHBondContact O-N 3.25Å; L197-A200 PolarHBondContact O-N 3.34Å; A200-D203 PolarHBondContact O-N 3.44Å; A200-L204 WeakPolarHBondContact O-CB 3.4Å; A200-L204 WeakPolarHBondContact O-CG 3.33Å; A200-L204 PolarHBondContact O-N 3.48Å |
| 201 | F | 98.3 | Very high | 97.3 | Very high | 42 Ų | 42 | 69.7 Ų | 69.7 | 18% | 0.184 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -66.2 | -39.8 | 174.6 | -71.7 | -30 | 0 | 0 | 0 | 112.4 | L197 G198 D199 D203 L204 S205 F215 N218 A219 Q222 | L197-F201 HydrophobicContact CD1-CD2 4.3Å; L197-F201 HydrophobicContact CD1-CE1 4.09Å; L197-F201 HydrophobicContact CD1-CE2 3.79Å; L197-F201 HydrophobicContact CD1-CZ 3.68Å; L197-F201 HydrophobicContact CD2-CE2 4.12Å; L197-F201 HydrophobicContact CD2-CZ 4.49Å; L197-F201 HydrophobicContact CG-CD2 4.07Å; L197-F201 HydrophobicContact CG-CE2 3.65Å; L197-F201 HydrophobicContact CG-CZ 4.07Å; L197-F201 WeakPolarHBondContact O-CD2 3.38Å; L197-F201 WeakPolarHBondContact O-CG 3.22Å; L197-F201 PolarHBondContact O-N 3.43Å; G198-F201 PolarHBondContact O-N 3.46Å; D199-F201 PolarHBondContact O-N 3.4Å; F201-D203 VanDerWaalsContact C-N 3.34Å; F201-D203 PolarHBondContact O-N 3Å; F201-L204 PolarHBondContact O-N 2.91Å; F201-S205 WeakPolarHBondContact O-CB 3.29Å; F201-S205 PolarHBondContact O-N 2.87Å; F201-F215 HydrophobicContact CB-CD1 4.44Å; F201-F215 AromaticContact CD1-CD1 3.55Å; F201-F215 HydrophobicContact CD1-CD1 3.55Å; F201-F215 AromaticContact CD1-CE1 3.84Å; F201-F215 HydrophobicContact CD1-CE1 3.84Å; F201-F215 HydrophobicContact CE1-CD1 4.15Å; F201-F215 HydrophobicContact CE1-CE1 4.09Å; F201-F215 HydrophobicContact CG-CD1 4.31Å; F201-N218 HydrophobicContact CD2-CB 3.54Å; F201-N218 HydrophobicContact CE2-CB 3.67Å; F201-N218 HydrophobicContact CG-CB 4.14Å; F201-N218 HydrophobicContact CZ-CB 4.36Å; F201-A219 HydrophobicContact CB-CB 3.72Å; F201-Q222 HydrophobicContact CD2-CG 4.43Å; F201-Q222 HydrophobicContact CE2-CG 4.5Å |
| 202 | A | 98 | Very high | 97.1 | Very high | 20 Ų | 20 | 74.3 Ų | 74.3 | 17% | 0.165 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -62.5 | -41.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | G198 D199 S205 Q206 A219 | G198-A202 WeakPolarHBondContact O-CB 3.37Å; G198-A202 PolarHBondContact O-N 3.27Å; D199-A202 PolarHBondContact O-N 3.39Å; A202-S205 WeakPolarHBondContact O-CB 3.45Å; A202-S205 PolarHBondContact O-N 3.37Å; A202-Q206 WeakPolarHBondContact O-CG 3.37Å; A202-Q206 PolarHBondContact O-N 3.42Å; A202-A219 HydrophobicContact CB-CB 4.05Å |
| 203 | D | 98.4 | Very high | 96.7 | Very high | 70 Ų | 70 | 75.3 Ų | 75.3 | 37% | 0.374 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.6 | -44.4 | 176.6 | -174.7 | 66.5 | 0 | 0 | 0 | 112.1 | D199 A200 F201 S205 Q206 K207 | D199-D203 WeakPolarHBondContact O-CB 3.41Å; D199-D203 PolarHBondContact O-N 2.88Å; A200-D203 PolarHBondContact O-N 3.44Å; F201-D203 VanDerWaalsContact C-N 3.34Å; F201-D203 PolarHBondContact O-N 3Å; D203-S205 PolarHBondContact O-N 3.48Å; D203-Q206 PolarHBondContact O-N 3.14Å; D203-K207 WeakPolarHBondContact O-CG 3.33Å; D203-K207 PolarHBondContact O-N 2.96Å; D203-K207 WeakPolarHBondContact OD1-CE 3.26Å; D203-K207 IonicContact OD1-NZ 2.73Å; D203-K207 PolarHBondContact OD1-NZ 3.38Å; D203-K207 WeakPolarHBondContact OD2-CE 3.22Å; D203-K207 IonicContact OD2-NZ 2.69Å; D203-K207 PolarHBondContact OD2-NZ 2.93Å |
| 204 | L | 98.3 | Very high | 96.4 | Very high | 68 Ų | 68 | 75.7 Ų | 75.7 | 36% | 0.356 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -65.8 | -37 | 177.2 | -74 | 171.8 | 0 | 0 | 0 | 112.8 | A200 F201 Q206 K207 S208 F215 | A200-L204 WeakPolarHBondContact O-CB 3.4Å; A200-L204 WeakPolarHBondContact O-CG 3.33Å; A200-L204 PolarHBondContact O-N 3.48Å; F201-L204 PolarHBondContact O-N 2.91Å; L204-Q206 VanDerWaalsContact C-N 3.31Å; L204-Q206 PolarHBondContact O-N 3.33Å; L204-K207 PolarHBondContact O-N 3.28Å; L204-S208 VanDerWaalsContact O-CB 3.24Å; L204-S208 WeakPolarHBondContact O-CB 3.43Å; L204-S208 PolarHBondContact O-N 3.15Å; L204-S208 PolarHBondContact O-OG 3.32Å; L204-S208 VanDerWaalsContact O-OG 3.04Å; L204-F215 HydrophobicContact CB-CD1 3.91Å; L204-F215 HydrophobicContact CB-CD2 3.87Å; L204-F215 HydrophobicContact CB-CE1 4.02Å; L204-F215 HydrophobicContact CB-CE2 3.97Å; L204-F215 HydrophobicContact CB-CG 3.85Å; L204-F215 HydrophobicContact CB-CZ 4.05Å; L204-F215 HydrophobicContact CD1-CD1 4.18Å; L204-F215 HydrophobicContact CD1-CE1 3.59Å; L204-F215 HydrophobicContact CD1-CE2 4.49Å; L204-F215 HydrophobicContact CD1-CZ 3.77Å; L204-F215 HydrophobicContact CG-CE1 4.45Å; L204-F215 HydrophobicContact CG-CZ 4.44Å |
| 205 | S | 97.6 | Very high | 96.2 | Very high | 18 Ų | 18 | 76.8 Ų | 76.8 | 13% | 0.126 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -57.6 | -43.1 | 174.8 | 178.4 | 0 | 0 | 0 | 0 | 111.7 | F201 A202 D203 Q212 | F201-S205 WeakPolarHBondContact O-CB 3.29Å; F201-S205 PolarHBondContact O-N 2.87Å; A202-S205 WeakPolarHBondContact O-CB 3.45Å; A202-S205 PolarHBondContact O-N 3.37Å; D203-S205 PolarHBondContact O-N 3.48Å; S205-Q212 PolarHBondContact OG-O 2.86Å |
| 206 | Q | 97.2 | Very high | 96 | Very high | 160 Ų | 160 | 74.8 Ų | 74.8 | 75% | 0.748 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -72.2 | -28.7 | 179.1 | -67.5 | 178.3 | 10.5 | 0 | 0 | 113.3 | A202 D203 L204 | A202-Q206 WeakPolarHBondContact O-CG 3.37Å; A202-Q206 PolarHBondContact O-N 3.42Å; D203-Q206 PolarHBondContact O-N 3.14Å; L204-Q206 VanDerWaalsContact C-N 3.31Å; L204-Q206 PolarHBondContact O-N 3.33Å |
| 207 | K | 97.3 | Very high | 95.6 | Very high | 137 Ų | 137 | 77.2 Ų | 77.2 | 60% | 0.596 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -95.7 | -12.9 | -174.8 | -68.5 | 174.6 | -175.8 | 167 | 0 | 114.1 | D203 L204 P209 | D203-K207 WeakPolarHBondContact O-CG 3.33Å; D203-K207 PolarHBondContact O-N 2.96Å; D203-K207 WeakPolarHBondContact OD1-CE 3.26Å; D203-K207 IonicContact OD1-NZ 2.73Å; D203-K207 PolarHBondContact OD1-NZ 3.38Å; D203-K207 WeakPolarHBondContact OD2-CE 3.22Å; D203-K207 IonicContact OD2-NZ 2.69Å; D203-K207 PolarHBondContact OD2-NZ 2.93Å; L204-K207 PolarHBondContact O-N 3.28Å; K207-P209 WeakPolarHBondContact O-CD 3.37Å |
| 208 | S | 95 | Very high | 95.3 | Very high | 35 Ų | 35 | 77.3 Ų | 77.3 | 25% | 0.245 | 40% | 0.398 | C | S | . | . | trans | -124.9 | 81.8 | -175.1 | -46.8 | 0 | 0 | 0 | 0 | 110.3 | L204 E210 L211 Q212 | L204-S208 VanDerWaalsContact O-CB 3.24Å; L204-S208 WeakPolarHBondContact O-CB 3.43Å; L204-S208 PolarHBondContact O-N 3.15Å; L204-S208 PolarHBondContact O-OG 3.32Å; L204-S208 VanDerWaalsContact O-OG 3.04Å; S208-E210 PolarHBondContact O-N 3.33Å; S208-E210 VanDerWaalsContact O-N 3.13Å; S208-L211 CarbonylContact O-C 3.51Å; S208-L211 PolarHBondContact O-N 3.19Å; S208-Q212 WeakPolarHBondContact O-CA 3.46Å; S208-Q212 PolarHBondContact O-N 3.45Å | ||
| 209 | P | 94.3 | Very high | 95.1 | Very high | 105 Ų | 105 | 77.4 Ų | 77.4 | 68% | 0.682 | 40% | 0.398 | S | S | * | . | G | 310 helix | trans | -54.8 | -34.4 | -177.3 | -26.8 | 35 | 0 | 0 | 0 | 113.8 | K207 L211 | K207-P209 WeakPolarHBondContact O-CD 3.37Å; P209-L211 PolarHBondContact O-N 3Å |
| 210 | E | 94.9 | Very high | 94.8 | Very high | 179 Ų | 179 | 77.8 Ų | 77.8 | 84% | 0.836 | 40% | 0.396 | S | S | * | . | G | 310 helix | trans | -67.9 | -20.1 | 179 | -52.3 | -75.9 | -165.4 | 0 | 0 | 113.7 | S208 | S208-E210 PolarHBondContact O-N 3.33Å; S208-E210 VanDerWaalsContact O-N 3.13Å |
| 211 | L | 93.6 | Very high | 94.5 | Very high | 82 Ų | 82 | 77.2 Ų | 77.2 | 43% | 0.429 | 39% | 0.388 | S | S | . | . | G | 310 helix | trans | -129.1 | 18.8 | -178 | -66.6 | 174.1 | 0 | 0 | 0 | 112 | S208 P209 E213 E214 F215 | S208-L211 CarbonylContact O-C 3.51Å; S208-L211 PolarHBondContact O-N 3.19Å; P209-L211 PolarHBondContact O-N 3Å; L211-E213 VanDerWaalsContact C-N 3.3Å; L211-E213 PolarHBondContact O-N 3.35Å; L211-E214 WeakPolarHBondContact CA-OE2 3.45Å; L211-E214 PolarHBondContact O-N 2.61Å; L211-F215 HydrophobicContact CB-CD2 3.76Å; L211-F215 HydrophobicContact CB-CE2 3.84Å; L211-F215 HydrophobicContact CD1-CE2 3.97Å; L211-F215 VanDerWaalsContact O-CD2 3.31Å; L211-F215 WeakPolarHBondContact O-CD2 3.49Å; L211-F215 PolarHBondContact O-N 3.38Å; L211-F215 VanDerWaalsContact O-N 3.15Å |
| 212 | Q | 92.9 | Very high | 94.4 | Very high | 101 Ų | 101 | 76.8 Ų | 76.8 | 47% | 0.472 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -56.3 | -47.1 | -172.2 | 168.3 | -173.8 | -83 | 0 | 0 | 110.9 | S205 S208 G216 | S205-Q212 PolarHBondContact OG-O 2.86Å; S208-Q212 WeakPolarHBondContact O-CA 3.46Å; S208-Q212 PolarHBondContact O-N 3.45Å; Q212-G216 PolarHBondContact O-N 3.24Å |
| 213 | E | 89.9 | Confident | 94.2 | Very high | 114 Ų | 114 | 79.5 Ų | 79.5 | 53% | 0.533 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -70.1 | -44.8 | -172.9 | -65.4 | -170 | 167.5 | 0 | 0 | 111.2 | L211 F215 G216 Y217 | L211-E213 VanDerWaalsContact C-N 3.3Å; L211-E213 PolarHBondContact O-N 3.35Å; E213-F215 PolarHBondContact O-N 3.38Å; E213-G216 PolarHBondContact O-N 2.92Å; E213-Y217 HydrophobicContact CB-CD2 4.42Å; E213-Y217 HydrophobicContact CB-CE2 3.85Å; E213-Y217 WeakPolarHBondContact O-CD2 3.4Å; E213-Y217 PolarHBondContact O-N 3.22Å |
| 214 | E | 91.4 | Very high | 93.9 | Very high | 99 Ų | 99 | 79 Ų | 79 | 46% | 0.463 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62 | -48 | -179.9 | -62.5 | 85.3 | 166.1 | 0 | 0 | 111.3 | L211 G216 N218 | L211-E214 WeakPolarHBondContact CA-OE2 3.45Å; L211-E214 PolarHBondContact O-N 2.61Å; E214-G216 VanDerWaalsContact C-N 3.34Å; E214-N218 PolarHBondContact O-N 2.83Å; E214-N218 PolarHBondContact O-ND2 3.01Å |
| 215 | F | 94.6 | Very high | 93.7 | Very high | 43 Ų | 43 | 77.7 Ų | 77.7 | 19% | 0.189 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -65.2 | -39.8 | 175 | -79.7 | -57.5 | 0 | 0 | 0 | 111.5 | F201 L204 L211 E213 N218 A219 | F201-F215 HydrophobicContact CB-CD1 4.44Å; F201-F215 AromaticContact CD1-CD1 3.55Å; F201-F215 HydrophobicContact CD1-CD1 3.55Å; F201-F215 AromaticContact CD1-CE1 3.84Å; F201-F215 HydrophobicContact CD1-CE1 3.84Å; F201-F215 HydrophobicContact CE1-CD1 4.15Å; F201-F215 HydrophobicContact CE1-CE1 4.09Å; F201-F215 HydrophobicContact CG-CD1 4.31Å; L204-F215 HydrophobicContact CB-CD1 3.91Å; L204-F215 HydrophobicContact CB-CD2 3.87Å; L204-F215 HydrophobicContact CB-CE1 4.02Å; L204-F215 HydrophobicContact CB-CE2 3.97Å; L204-F215 HydrophobicContact CB-CG 3.85Å; L204-F215 HydrophobicContact CB-CZ 4.05Å; L204-F215 HydrophobicContact CD1-CD1 4.18Å; L204-F215 HydrophobicContact CD1-CE1 3.59Å; L204-F215 HydrophobicContact CD1-CE2 4.49Å; L204-F215 HydrophobicContact CD1-CZ 3.77Å; L204-F215 HydrophobicContact CG-CE1 4.45Å; L204-F215 HydrophobicContact CG-CZ 4.44Å; L211-F215 HydrophobicContact CB-CD2 3.76Å; L211-F215 HydrophobicContact CB-CE2 3.84Å; L211-F215 HydrophobicContact CD1-CE2 3.97Å; L211-F215 VanDerWaalsContact O-CD2 3.31Å; L211-F215 WeakPolarHBondContact O-CD2 3.49Å; L211-F215 PolarHBondContact O-N 3.38Å; L211-F215 VanDerWaalsContact O-N 3.15Å; E213-F215 PolarHBondContact O-N 3.38Å; F215-N218 PolarHBondContact O-N 3.49Å; F215-A219 WeakPolarHBondContact O-CB 3.32Å; F215-A219 PolarHBondContact O-N 3.22Å |
| 216 | G | 92.9 | Very high | 93.5 | Very high | 20 Ų | 20 | 76.8 Ų | 76.8 | 21% | 0.206 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -60.9 | -47.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q212 E213 E214 N218 A219 E220 | Q212-G216 PolarHBondContact O-N 3.24Å; E213-G216 PolarHBondContact O-N 2.92Å; E214-G216 VanDerWaalsContact C-N 3.34Å; G216-N218 VanDerWaalsContact C-N 3.34Å; G216-N218 PolarHBondContact O-N 3.43Å; G216-A219 PolarHBondContact O-N 3.03Å; G216-E220 WeakPolarHBondContact O-CG 3.3Å; G216-E220 PolarHBondContact O-N 3.33Å |
| 217 | Y | 89.8 | Confident | 93.4 | Very high | 113 Ų | 113 | 76 Ų | 76 | 44% | 0.443 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -61.3 | -41.2 | 178 | -63.6 | -39.9 | 0 | 0 | 0 | 112.4 | E213 T221 | E213-Y217 HydrophobicContact CB-CD2 4.42Å; E213-Y217 HydrophobicContact CB-CE2 3.85Å; E213-Y217 WeakPolarHBondContact O-CD2 3.4Å; E213-Y217 PolarHBondContact O-N 3.22Å; Y217-T221 WeakPolarHBondContact O-CB 3.41Å; Y217-T221 PolarHBondContact O-N 3.01Å; Y217-T221 VanDerWaalsContact O-N 3.08Å; Y217-T221 PolarHBondContact O-OG1 2.79Å |
| 218 | N | 91.8 | Very high | 93.2 | Very high | 69 Ų | 69 | 71.6 Ų | 71.6 | 37% | 0.369 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -69.8 | -39.8 | 177.2 | -78.6 | -82 | 0 | 0 | 0 | 112 | F201 E214 F215 G216 T221 Q222 | F201-N218 HydrophobicContact CD2-CB 3.54Å; F201-N218 HydrophobicContact CE2-CB 3.67Å; F201-N218 HydrophobicContact CG-CB 4.14Å; F201-N218 HydrophobicContact CZ-CB 4.36Å; E214-N218 PolarHBondContact O-N 2.83Å; E214-N218 PolarHBondContact O-ND2 3.01Å; F215-N218 PolarHBondContact O-N 3.49Å; G216-N218 VanDerWaalsContact C-N 3.34Å; G216-N218 PolarHBondContact O-N 3.43Å; N218-T221 PolarHBondContact O-N 3.41Å; N218-Q222 WeakPolarHBondContact O-CG 3.46Å; N218-Q222 PolarHBondContact O-N 3.08Å |
| 219 | A | 94.6 | Very high | 93.3 | Very high | 1 Ų | 1 | 70 Ų | 70 | 1% | 0.008 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -58.4 | -49.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | F201 A202 F215 G216 T221 Q222 K223 | F201-A219 HydrophobicContact CB-CB 3.72Å; A202-A219 HydrophobicContact CB-CB 4.05Å; F215-A219 WeakPolarHBondContact O-CB 3.32Å; F215-A219 PolarHBondContact O-N 3.22Å; G216-A219 PolarHBondContact O-N 3.03Å; A219-T221 VanDerWaalsContact C-N 3.34Å; A219-T221 PolarHBondContact O-N 3.34Å; A219-Q222 PolarHBondContact O-N 3.36Å; A219-K223 WeakPolarHBondContact O-CG 3.35Å; A219-K223 PolarHBondContact O-N 2.89Å |
| 220 | E | 91.9 | Very high | 93.4 | Very high | 110 Ų | 110 | 69.8 Ų | 69.8 | 51% | 0.514 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -66.3 | -36.4 | -180 | -67.3 | -52.7 | 122 | 0 | 0 | 112.4 | G216 Q222 K223 L224 | G216-E220 WeakPolarHBondContact O-CG 3.3Å; G216-E220 PolarHBondContact O-N 3.33Å; E220-Q222 PolarHBondContact O-N 2.83Å; E220-K223 PolarHBondContact O-N 3.25Å; E220-K223 IonicContact OE1-NZ 2.92Å; E220-K223 PolarHBondContact OE1-NZ 2.97Å; E220-L224 WeakPolarHBondContact O-CB 3.29Å; E220-L224 PolarHBondContact O-N 2.96Å |
| 221 | T | 92.7 | Very high | 93.5 | Very high | 35 Ų | 35 | 65.1 Ų | 65.1 | 22% | 0.215 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -60.5 | -46.3 | 173.7 | -60 | 0 | 0 | 0 | 0 | 111.3 | Y217 N218 A219 L224 L225 | Y217-T221 WeakPolarHBondContact O-CB 3.41Å; Y217-T221 PolarHBondContact O-N 3.01Å; Y217-T221 VanDerWaalsContact O-N 3.08Å; Y217-T221 PolarHBondContact O-OG1 2.79Å; N218-T221 PolarHBondContact O-N 3.41Å; A219-T221 VanDerWaalsContact C-N 3.34Å; A219-T221 PolarHBondContact O-N 3.34Å; T221-L224 PolarHBondContact O-N 3.26Å; T221-L225 HydrophobicContact CG2-CD1 4.07Å; T221-L225 WeakPolarHBondContact O-CG 3.25Å; T221-L225 PolarHBondContact O-N 3.45Å |
| 222 | Q | 94.8 | Very high | 93.7 | Very high | 33 Ų | 33 | 61.8 Ų | 61.8 | 15% | 0.154 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -67.2 | -41.4 | 179.7 | -64.1 | -62.1 | 17.2 | 0 | 0 | 112.5 | L197 F201 N218 A219 E220 L224 L225 C226 | L197-Q222 HydrophobicContact CD2-CG 4.46Å; L197-Q222 VanDerWaalsContact CD2-NE2 3.35Å; L197-Q222 HydrophobicContact CG-CG 4.43Å; F201-Q222 HydrophobicContact CD2-CG 4.43Å; F201-Q222 HydrophobicContact CE2-CG 4.5Å; N218-Q222 WeakPolarHBondContact O-CG 3.46Å; N218-Q222 PolarHBondContact O-N 3.08Å; A219-Q222 PolarHBondContact O-N 3.36Å; E220-Q222 PolarHBondContact O-N 2.83Å; Q222-L224 VanDerWaalsContact C-N 3.32Å; Q222-L224 PolarHBondContact O-N 3.07Å; Q222-L225 PolarHBondContact O-N 3.48Å; Q222-C226 PolarHBondContact O-N 3.33Å; Q222-C226 PolarHBondContact O-SG 2.85Å; Q222-C226 VanDerWaalsContact O-SG 3.32Å |
| 223 | K | 93.8 | Very high | 93.9 | Very high | 78 Ų | 78 | 58 Ų | 58 | 34% | 0.339 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -59.9 | -41.8 | 175.4 | -70.3 | 174.4 | -168.9 | 166.6 | 0 | 112.2 | A219 E220 C226 K227 | A219-K223 WeakPolarHBondContact O-CG 3.35Å; A219-K223 PolarHBondContact O-N 2.89Å; E220-K223 PolarHBondContact O-N 3.25Å; E220-K223 IonicContact OE1-NZ 2.92Å; E220-K223 PolarHBondContact OE1-NZ 2.97Å; K223-C226 WeakPolarHBondContact O-CB 3.48Å; K223-C226 PolarHBondContact O-N 3.47Å; K223-K227 PolarHBondContact O-N 3.42Å |
| 224 | L | 91.9 | Very high | 94.3 | Very high | 59 Ų | 59 | 54.2 Ų | 54.2 | 31% | 0.309 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -64.2 | -47.5 | 176.5 | 178.3 | 64.3 | 0 | 0 | 0 | 111.6 | E220 T221 Q222 C226 K227 N228 Q348 | E220-L224 WeakPolarHBondContact O-CB 3.29Å; E220-L224 PolarHBondContact O-N 2.96Å; T221-L224 PolarHBondContact O-N 3.26Å; Q222-L224 VanDerWaalsContact C-N 3.32Å; Q222-L224 PolarHBondContact O-N 3.07Å; L224-C226 VanDerWaalsContact C-N 3.29Å; L224-C226 PolarHBondContact O-N 3.28Å; L224-K227 PolarHBondContact O-N 2.98Å; L224-N228 PolarHBondContact O-N 2.65Å; L224-Q348 HydrophobicContact CD2-CB 3.97Å; L224-Q348 HydrophobicContact CD2-CG 3.97Å |
| 225 | L | 93.9 | Very high | 94.6 | Very high | 40 Ų | 40 | 50.7 Ų | 50.7 | 21% | 0.209 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.1 | -39.7 | 177.6 | -72.5 | 173.6 | 0 | 0 | 0 | 111.7 | T221 Q222 G229 N345 | T221-L225 HydrophobicContact CG2-CD1 4.07Å; T221-L225 WeakPolarHBondContact O-CG 3.25Å; T221-L225 PolarHBondContact O-N 3.45Å; Q222-L225 PolarHBondContact O-N 3.48Å; L225-G229 WeakPolarHBondContact O-CA 3.21Å; L225-G229 PolarHBondContact O-N 3.42Å; L225-N345 HydrophobicContact CD2-CB 4.03Å |
| 226 | C | 94.9 | Very high | 94.8 | Very high | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -59.4 | -53.7 | 172.6 | -74.9 | 0 | 0 | 0 | 0 | 111.7 | Q194 H195 Q222 K223 L224 N228 G229 E230 | Q194-C226 WeakPolarHBondContact CB-SG 3.35Å; H195-C226 PolarHBondContact N-SG 2.9Å; Q222-C226 PolarHBondContact O-N 3.33Å; Q222-C226 PolarHBondContact O-SG 2.85Å; Q222-C226 VanDerWaalsContact O-SG 3.32Å; K223-C226 WeakPolarHBondContact O-CB 3.48Å; K223-C226 PolarHBondContact O-N 3.47Å; L224-C226 VanDerWaalsContact C-N 3.29Å; L224-C226 PolarHBondContact O-N 3.28Å; C226-N228 PolarHBondContact O-N 2.65Å; C226-G229 CarbonylContact O-C 3.58Å; C226-G229 WeakPolarHBondContact O-CA 3.24Å; C226-G229 PolarHBondContact O-N 3.48Å; C226-E230 WeakPolarHBondContact O-CG 3.41Å; C226-E230 PolarHBondContact O-N 2.96Å |
| 227 | K | 93.6 | Very high | 95.1 | Very high | 143 Ų | 143 | 51.1 Ų | 51.1 | 62% | 0.622 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -57.8 | -46.6 | -177.7 | -177.7 | -177.9 | 177.5 | -178.9 | 0 | 112.1 | K223 L224 G229 E230 | K223-K227 PolarHBondContact O-N 3.42Å; L224-K227 PolarHBondContact O-N 2.98Å; K227-G229 VanDerWaalsContact C-N 3.3Å; K227-E230 PolarHBondContact O-N 2.98Å |
| 228 | N | 94.3 | Very high | 95.5 | Very high | 44 Ų | 44 | 51.2 Ų | 51.2 | 24% | 0.235 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -69.1 | -33.8 | 176.4 | -72 | -6.5 | 0 | 0 | 0 | 111.2 | L224 C226 T231 L232 Y341 N345 | L224-N228 PolarHBondContact O-N 2.65Å; C226-N228 PolarHBondContact O-N 2.65Å; N228-T231 WeakPolarHBondContact O-CB 3.46Å; N228-T231 PolarHBondContact O-N 3.19Å; N228-L232 PolarHBondContact O-N 3.07Å; N228-L232 VanDerWaalsContact O-N 3.12Å; N228-Y341 HydrophobicContact CB-CD2 3.95Å; N228-Y341 HydrophobicContact CB-CE2 4.02Å; N228-Y341 WeakPolarHBondContact O-CD2 3.46Å; N228-N345 PolarHBondContact ND2-OD1 2.73Å |
| 229 | G | 97 | Very high | 95.8 | Very high | 2 Ų | 2 | 48.4 Ų | 48.4 | 2% | 0.021 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -65.3 | -37.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L225 C226 K227 T231 L232 L233 Y341 | L225-G229 WeakPolarHBondContact O-CA 3.21Å; L225-G229 PolarHBondContact O-N 3.42Å; C226-G229 CarbonylContact O-C 3.58Å; C226-G229 WeakPolarHBondContact O-CA 3.24Å; C226-G229 PolarHBondContact O-N 3.48Å; K227-G229 VanDerWaalsContact C-N 3.3Å; G229-T231 VanDerWaalsContact C-N 3.3Å; G229-T231 PolarHBondContact O-N 2.9Å; G229-L232 PolarHBondContact O-N 3.31Å; G229-L233 WeakPolarHBondContact O-CB 3.21Å; G229-L233 PolarHBondContact O-N 3.41Å; G229-Y341 VanDerWaalsContact CA-CE2 3.5Å |
| 230 | E | 96.6 | Very high | 96 | Very high | 100 Ų | 100 | 49 Ų | 49 | 47% | 0.467 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -62.9 | -40 | 176.7 | -74 | 173.2 | -178.5 | 0 | 0 | 111 | L191 H195 C226 K227 L233 G234 | L191-E230 HydrophobicContact CD2-CB 4.37Å; L191-E230 HydrophobicContact CD2-CG 3.71Å; H195-E230 IonicContact CE1-OE1 2.94Å; H195-E230 IonicContact NE2-OE1 2.8Å; H195-E230 PolarHBondContact NE2-OE1 2.89Å; C226-E230 WeakPolarHBondContact O-CG 3.41Å; C226-E230 PolarHBondContact O-N 2.96Å; K227-E230 PolarHBondContact O-N 2.98Å; E230-L233 PolarHBondContact O-N 2.88Å; E230-G234 PolarHBondContact O-N 3.48Å |
| 231 | T | 96.3 | Very high | 96.3 | Very high | 81 Ų | 81 | 47 Ų | 47 | 50% | 0.497 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -62.4 | -47.2 | 173.2 | -63.3 | 0 | 0 | 0 | 0 | 111.6 | L45 N228 G229 L233 G234 A235 | L45-T231 HydrophobicContact CD1-CG2 3.81Å; N228-T231 WeakPolarHBondContact O-CB 3.46Å; N228-T231 PolarHBondContact O-N 3.19Å; G229-T231 VanDerWaalsContact C-N 3.3Å; G229-T231 PolarHBondContact O-N 2.9Å; T231-L233 PolarHBondContact O-N 3.43Å; T231-G234 PolarHBondContact O-N 2.91Å; T231-A235 PolarHBondContact O-N 2.94Å; T231-A235 VanDerWaalsContact O-N 3.12Å |
| 232 | L | 97.9 | Very high | 96.6 | Very high | 12 Ų | 12 | 46.4 Ų | 46.4 | 6% | 0.063 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -60.4 | -45.3 | 175.5 | 175.8 | 63 | 0 | 0 | 0 | 111.4 | L187 N228 G229 G234 A235 V236 A337 V338 Y341 | L187-L232 HydrophobicContact CD1-CD2 4.43Å; N228-L232 PolarHBondContact O-N 3.07Å; N228-L232 VanDerWaalsContact O-N 3.12Å; G229-L232 PolarHBondContact O-N 3.31Å; L232-G234 VanDerWaalsContact C-N 3.28Å; L232-G234 PolarHBondContact O-N 3.49Å; L232-A235 WeakPolarHBondContact O-CB 3.15Å; L232-A235 PolarHBondContact O-N 2.86Å; L232-A235 VanDerWaalsContact O-N 3.08Å; L232-V236 HydrophobicContact CD1-CG2 4.06Å; L232-V236 HydrophobicContact CG-CG2 4.3Å; L232-V236 WeakPolarHBondContact O-CG2 3.47Å; L232-V236 PolarHBondContact O-N 3.45Å; L232-A337 HydrophobicContact CD1-CB 4.22Å; L232-V338 HydrophobicContact CD1-CG2 4.05Å; L232-Y341 HydrophobicContact CB-CD2 4.01Å; L232-Y341 HydrophobicContact CB-CG 4.18Å; L232-Y341 HydrophobicContact CD2-CD1 3.73Å; L232-Y341 HydrophobicContact CD2-CD2 4.06Å; L232-Y341 HydrophobicContact CD2-CE1 4.2Å; L232-Y341 HydrophobicContact CD2-CG 3.64Å; L232-Y341 HydrophobicContact CG-CG 4.43Å |
| 233 | L | 98.3 | Very high | 96.7 | Very high | 23 Ų | 23 | 44.9 Ų | 44.9 | 12% | 0.12 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -58.7 | -40.9 | 178.8 | -179.2 | 64.7 | 0 | 0 | 0 | 111.2 | T184 L187 Y188 L191 G229 E230 T231 V236 N237 | T184-L233 HydrophobicContact CG2-CD1 3.83Å; T184-L233 WeakPolarHBondContact O-CD1 3.21Å; L187-L233 HydrophobicContact CB-CD1 3.97Å; Y188-L233 HydrophobicContact CD2-CD2 3.92Å; L191-L233 HydrophobicContact CD2-CB 4.33Å; L191-L233 HydrophobicContact CD2-CD2 4.05Å; G229-L233 WeakPolarHBondContact O-CB 3.21Å; G229-L233 PolarHBondContact O-N 3.41Å; E230-L233 PolarHBondContact O-N 2.88Å; T231-L233 PolarHBondContact O-N 3.43Å; L233-V236 PolarHBondContact O-N 3.12Å; L233-N237 WeakPolarHBondContact O-CB 3.22Å; L233-N237 PolarHBondContact O-N 3.33Å; L233-N237 PolarHBondContact O-ND2 3.01Å |
| 234 | G | 97.9 | Very high | 97 | Very high | 33 Ų | 33 | 43.3 Ų | 43.3 | 34% | 0.34 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -58.8 | -46.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | E230 T231 L232 N237 F238 | E230-G234 PolarHBondContact O-N 3.48Å; T231-G234 PolarHBondContact O-N 2.91Å; L232-G234 VanDerWaalsContact C-N 3.28Å; L232-G234 PolarHBondContact O-N 3.49Å; G234-N237 PolarHBondContact O-N 3.05Å; G234-F238 PolarHBondContact O-N 2.9Å |
| 235 | A | 98 | Very high | 97.3 | Very high | 25 Ų | 25 | 43.2 Ų | 43.2 | 21% | 0.207 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -64.2 | -42.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | T231 L232 F238 F239 A337 | T231-A235 PolarHBondContact O-N 2.94Å; T231-A235 VanDerWaalsContact O-N 3.12Å; L232-A235 WeakPolarHBondContact O-CB 3.15Å; L232-A235 PolarHBondContact O-N 2.86Å; L232-A235 VanDerWaalsContact O-N 3.08Å; A235-F238 PolarHBondContact O-N 3.29Å; A235-F239 PolarHBondContact O-N 3.3Å; A235-A337 HydrophobicContact CB-CB 3.42Å; A235-A337 VanDerWaalsContact CB-CB 3.42Å |
| 236 | V | 98.3 | Very high | 97.5 | Very high | 1 Ų | 1 | 41.4 Ų | 41.4 | 1% | 0.006 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -65.6 | -40.8 | 176.7 | -179.2 | 0 | 0 | 0 | 0 | 110.9 | L183 T184 L187 L232 L233 F238 F239 V240 F334 | L183-V236 HydrophobicContact CD2-CG1 4.24Å; L183-V236 HydrophobicContact CG-CG1 4.44Å; T184-V236 WeakPolarHBondContact OG1-CG1 3.41Å; L187-V236 HydrophobicContact CD1-CG2 4.04Å; L232-V236 HydrophobicContact CD1-CG2 4.06Å; L232-V236 HydrophobicContact CG-CG2 4.3Å; L232-V236 WeakPolarHBondContact O-CG2 3.47Å; L232-V236 PolarHBondContact O-N 3.45Å; L233-V236 PolarHBondContact O-N 3.12Å; V236-F238 PolarHBondContact O-N 3.49Å; V236-F239 WeakPolarHBondContact O-CB 3.24Å; V236-F239 PolarHBondContact O-N 2.95Å; V236-V240 HydrophobicContact CG1-CG2 4.48Å; V236-V240 WeakPolarHBondContact O-CG2 3.31Å; V236-V240 PolarHBondContact O-N 2.95Å; V236-F334 HydrophobicContact CG1-CE2 4.26Å; V236-F334 HydrophobicContact CG2-CD2 4.4Å; V236-F334 HydrophobicContact CG2-CE2 3.92Å |
| 237 | N | 98.3 | Very high | 97.7 | Very high | 72 Ų | 72 | 41.5 Ų | 41.5 | 39% | 0.385 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -60.5 | -43.4 | 173.5 | -86.6 | -66 | 0 | 0 | 0 | 112.4 | T184 L233 G234 V240 S241 | T184-N237 WeakPolarHBondContact CG2-ND2 3.33Å; T184-N237 VanDerWaalsContact CG2-OD1 3.24Å; T184-N237 WeakPolarHBondContact CG2-OD1 3.24Å; L233-N237 WeakPolarHBondContact O-CB 3.22Å; L233-N237 PolarHBondContact O-N 3.33Å; L233-N237 PolarHBondContact O-ND2 3.01Å; G234-N237 PolarHBondContact O-N 3.05Å; N237-V240 PolarHBondContact O-N 3.36Å; N237-S241 WeakPolarHBondContact O-CB 3.22Å; N237-S241 PolarHBondContact O-N 3.4Å |
| 238 | F | 98.3 | Very high | 97.9 | Very high | 114 Ų | 114 | 37.7 Ų | 37.7 | 50% | 0.5 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -61.6 | -44.4 | 176.8 | 179.5 | -100 | 0 | 0 | 0 | 112 | G234 A235 V236 S241 S242 L333 | G234-F238 PolarHBondContact O-N 2.9Å; A235-F238 PolarHBondContact O-N 3.29Å; V236-F238 PolarHBondContact O-N 3.49Å; F238-S241 PolarHBondContact O-N 2.88Å; F238-S242 WeakPolarHBondContact O-CB 3.45Å; F238-S242 PolarHBondContact O-N 3.48Å; F238-S242 PolarHBondContact O-OG 2.76Å; F238-L333 HydrophobicContact CE1-CD1 4.12Å |
| 239 | F | 98.6 | Very high | 98.1 | Very high | 10 Ų | 10 | 42.3 Ų | 42.3 | 4% | 0.044 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -57 | -53.1 | 173 | 172.4 | -98.7 | 0 | 0 | 0 | 111.2 | V176 A235 V236 S241 S242 I243 Q330 L331 F334 | V176-F239 HydrophobicContact CG1-CZ 4.46Å; A235-F239 PolarHBondContact O-N 3.3Å; V236-F239 WeakPolarHBondContact O-CB 3.24Å; V236-F239 PolarHBondContact O-N 2.95Å; F239-S241 VanDerWaalsContact C-N 3.32Å; F239-S241 PolarHBondContact O-N 3Å; F239-S242 PolarHBondContact O-N 3.16Å; F239-S242 VanDerWaalsContact O-N 3.15Å; F239-I243 HydrophobicContact CD1-CG1 4.32Å; F239-I243 HydrophobicContact CD2-CD1 4.49Å; F239-I243 HydrophobicContact CD2-CG1 4.13Å; F239-I243 HydrophobicContact CE1-CG1 3.95Å; F239-I243 HydrophobicContact CE2-CD1 3.91Å; F239-I243 HydrophobicContact CE2-CG1 3.74Å; F239-I243 HydrophobicContact CG-CG1 4.41Å; F239-I243 HydrophobicContact CZ-CD1 4.13Å; F239-I243 HydrophobicContact CZ-CG1 3.63Å; F239-I243 WeakPolarHBondContact O-CG1 3.42Å; F239-I243 PolarHBondContact O-N 2.97Å; F239-Q330 HydrophobicContact CD2-CB 3.86Å; F239-Q330 WeakPolarHBondContact CD2-O 3.46Å; F239-Q330 HydrophobicContact CE2-CB 4.04Å; F239-L331 HydrophobicContact CE2-CD2 4.28Å; F239-L331 HydrophobicContact CZ-CD2 4.48Å; F239-F334 HydrophobicContact CB-CB 4.47Å; F239-F334 HydrophobicContact CB-CD2 4.1Å; F239-F334 AromaticContact CD1-CD2 3.94Å; F239-F334 HydrophobicContact CD1-CD2 3.94Å; F239-F334 HydrophobicContact CD1-CE2 4.38Å; F239-F334 HydrophobicContact CD2-CB 3.77Å; F239-F334 HydrophobicContact CD2-CD2 4.3Å; F239-F334 HydrophobicContact CD2-CG 4.25Å; F239-F334 HydrophobicContact CE1-CD2 4.47Å; F239-F334 HydrophobicContact CE2-CB 4.21Å; F239-F334 HydrophobicContact CG-CB 4.13Å; F239-F334 AromaticContact CG-CD2 3.85Å; F239-F334 HydrophobicContact CG-CD2 3.85Å; F239-F334 HydrophobicContact CG-CG 4.26Å |
| 240 | V | 98.6 | Very high | 98.1 | Very high | 14 Ų | 14 | 44.4 Ų | 44.4 | 9% | 0.085 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -56 | -44.6 | 179.2 | 166.9 | 0 | 0 | 0 | 0 | 111.7 | L177 R181 V236 N237 S242 N244 | L177-V240 HydrophobicContact CD1-CB 4.47Å; L177-V240 HydrophobicContact CD1-CG1 3.81Å; L177-V240 WeakPolarHBondContact CD1-O 3.14Å; R181-V240 HydrophobicContact CG-CG1 3.76Å; V236-V240 HydrophobicContact CG1-CG2 4.48Å; V236-V240 WeakPolarHBondContact O-CG2 3.31Å; V236-V240 PolarHBondContact O-N 2.95Å; N237-V240 PolarHBondContact O-N 3.36Å; V240-S242 VanDerWaalsContact C-N 3.35Å; V240-S242 PolarHBondContact O-N 3.44Å; V240-N244 VanDerWaalsContact O-CB 3.24Å; V240-N244 WeakPolarHBondContact O-CB 3.46Å; V240-N244 PolarHBondContact O-N 3.03Å |
| 241 | S | 98.6 | Very high | 98.2 | Very high | 69 Ų | 69 | 39.7 Ų | 39.7 | 48% | 0.483 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -63.8 | -40.5 | 179.1 | -174 | 0 | 0 | 0 | 0 | 112.4 | N237 F238 F239 N244 T245 | N237-S241 WeakPolarHBondContact O-CB 3.22Å; N237-S241 PolarHBondContact O-N 3.4Å; F238-S241 PolarHBondContact O-N 2.88Å; F239-S241 VanDerWaalsContact C-N 3.32Å; F239-S241 PolarHBondContact O-N 3Å; S241-N244 WeakPolarHBondContact O-CB 3.32Å; S241-N244 PolarHBondContact O-N 3.35Å; S241-T245 PolarHBondContact O-N 2.71Å; S241-T245 PolarHBondContact O-OG1 3.24Å |
| 242 | S | 98.3 | Very high | 98.3 | Very high | 22 Ų | 22 | 38.3 Ų | 38.3 | 15% | 0.154 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -69.7 | -45.1 | -179.8 | -65.6 | 0 | 0 | 0 | 0 | 111.8 | F238 F239 V240 N244 T245 L246 Q330 | F238-S242 WeakPolarHBondContact O-CB 3.45Å; F238-S242 PolarHBondContact O-N 3.48Å; F238-S242 PolarHBondContact O-OG 2.76Å; F239-S242 PolarHBondContact O-N 3.16Å; F239-S242 VanDerWaalsContact O-N 3.15Å; V240-S242 VanDerWaalsContact C-N 3.35Å; V240-S242 PolarHBondContact O-N 3.44Å; S242-N244 VanDerWaalsContact C-N 3.34Å; S242-N244 PolarHBondContact O-N 3.3Å; S242-T245 PolarHBondContact O-N 3.42Å; S242-L246 PolarHBondContact O-N 2.83Å; S242-L246 VanDerWaalsContact O-N 3.08Å; S242-Q330 VanDerWaalsContact CB-OE1 3.3Å; S242-Q330 PolarHBondContact OG-OE1 2.98Å |
| 243 | I | 98.4 | Very high | 98.3 | Very high | 1 Ų | 1 | 42 Ų | 42 | 1% | 0.005 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.6 | -40.2 | 173.2 | -58.6 | -52.4 | 0 | 0 | 0 | 111.1 | L177 F239 T245 L246 V247 M327 Q330 | L177-I243 HydrophobicContact CB-CG2 4.22Å; L177-I243 HydrophobicContact CD1-CB 4.24Å; L177-I243 HydrophobicContact CD1-CG2 4.27Å; F239-I243 HydrophobicContact CD1-CG1 4.32Å; F239-I243 HydrophobicContact CD2-CD1 4.49Å; F239-I243 HydrophobicContact CD2-CG1 4.13Å; F239-I243 HydrophobicContact CE1-CG1 3.95Å; F239-I243 HydrophobicContact CE2-CD1 3.91Å; F239-I243 HydrophobicContact CE2-CG1 3.74Å; F239-I243 HydrophobicContact CG-CG1 4.41Å; F239-I243 HydrophobicContact CZ-CD1 4.13Å; F239-I243 HydrophobicContact CZ-CG1 3.63Å; F239-I243 WeakPolarHBondContact O-CG1 3.42Å; F239-I243 PolarHBondContact O-N 2.97Å; I243-T245 VanDerWaalsContact C-N 3.3Å; I243-T245 PolarHBondContact O-N 3.34Å; I243-L246 PolarHBondContact O-N 2.87Å; I243-V247 HydrophobicContact CG2-CG2 4.15Å; I243-V247 WeakPolarHBondContact O-CB 3.36Å; I243-V247 WeakPolarHBondContact O-CG2 3.29Å; I243-V247 PolarHBondContact O-N 3.1Å; I243-M327 HydrophobicContact CD1-CE 3.99Å; I243-M327 HydrophobicContact CD1-SD 3.35Å; I243-M327 WeakPolarHBondContact CD1-SD 3.41Å; I243-Q330 HydrophobicContact CD1-CB 4.15Å; I243-Q330 HydrophobicContact CD1-CG 4.44Å |
| 244 | N | 98.6 | Very high | 98.4 | Very high | 45 Ų | 45 | 41.1 Ų | 41.1 | 24% | 0.241 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -57.7 | -44 | 174.8 | -177.9 | 72 | 0 | 0 | 0 | 111.5 | L177 R181 V240 S241 S242 V247 T248 | L177-N244 HydrophobicContact CD1-CB 3.95Å; L177-N244 HydrophobicContact CD2-CB 3.94Å; R181-N244 PolarHBondContact NH2-OD1 2.86Å; V240-N244 VanDerWaalsContact O-CB 3.24Å; V240-N244 WeakPolarHBondContact O-CB 3.46Å; V240-N244 PolarHBondContact O-N 3.03Å; S241-N244 WeakPolarHBondContact O-CB 3.32Å; S241-N244 PolarHBondContact O-N 3.35Å; S242-N244 VanDerWaalsContact C-N 3.34Å; S242-N244 PolarHBondContact O-N 3.3Å; N244-V247 PolarHBondContact O-N 3.47Å; N244-T248 WeakPolarHBondContact O-CB 3.31Å; N244-T248 WeakPolarHBondContact O-CG2 3.47Å; N244-T248 PolarHBondContact O-N 2.95Å; N244-T248 PolarHBondContact O-OG1 3.38Å; N244-T248 WeakPolarHBondContact OD1-CG2 3.34Å |
| 245 | T | 98.6 | Very high | 98.4 | Very high | 57 Ų | 57 | 40.3 Ų | 40.3 | 35% | 0.35 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -62.4 | -47.5 | 177.2 | -68.2 | 0 | 0 | 0 | 0 | 111.8 | S241 S242 I243 V247 K249 T250 | S241-T245 PolarHBondContact O-N 2.71Å; S241-T245 PolarHBondContact O-OG1 3.24Å; S242-T245 PolarHBondContact O-N 3.42Å; I243-T245 VanDerWaalsContact C-N 3.3Å; I243-T245 PolarHBondContact O-N 3.34Å; T245-V247 VanDerWaalsContact C-N 3.32Å; T245-V247 PolarHBondContact O-N 3.01Å; T245-K249 HydrophobicContact CG2-CD 4.26Å; T245-K249 WeakPolarHBondContact O-CA 3.32Å; T245-K249 VanDerWaalsContact O-CB 3.32Å; T245-K249 WeakPolarHBondContact O-CB 3.5Å; T245-K249 PolarHBondContact O-N 2.8Å; T245-T250 PolarHBondContact O-N 3.48Å |
| 246 | L | 98.4 | Very high | 98.4 | Very high | 2 Ų | 2 | 42 Ų | 42 | 1% | 0.01 | 22% | 0.223 | C | C | . | . | I | π-helix | trans | -56.4 | -46.3 | 177.2 | 178.7 | 63.7 | 0 | 0 | 0 | 111.7 | Y173 S242 I243 T250 M251 K323 V326 M327 | Y173-L246 HydrophobicContact CD2-CD2 4.12Å; Y173-L246 HydrophobicContact CE2-CD2 3.95Å; S242-L246 PolarHBondContact O-N 2.83Å; S242-L246 VanDerWaalsContact O-N 3.08Å; I243-L246 PolarHBondContact O-N 2.87Å; L246-T250 HydrophobicContact CD1-CG2 4.42Å; L246-T250 WeakPolarHBondContact O-CB 3.3Å; L246-T250 PolarHBondContact O-N 2.92Å; L246-M251 HydrophobicContact CD2-CE 4.44Å; L246-M251 HydrophobicContact CG-CE 4.28Å; L246-M251 WeakPolarHBondContact O-CG 3.39Å; L246-M251 PolarHBondContact O-N 3.24Å; L246-K323 HydrophobicContact CD1-CB 4.49Å; L246-K323 HydrophobicContact CD2-CG 4.32Å; L246-V326 HydrophobicContact CB-CG1 4.36Å; L246-V326 HydrophobicContact CD2-CB 4.38Å; L246-V326 HydrophobicContact CD2-CG1 4.09Å; L246-M327 HydrophobicContact CD2-CG 3.81Å; L246-M327 HydrophobicContact CD2-SD 3.66Å |
| 247 | V | 98.5 | Very high | 98.4 | Very high | 1 Ų | 1 | 42.4 Ų | 42.4 | 1% | 0.006 | 23% | 0.226 | C | C | . | . | I | π-helix | trans | -75.6 | -49.8 | -175.6 | 170.9 | 0 | 0 | 0 | 0 | 112.5 | K170 Y173 E174 I243 N244 T245 M251 | K170-V247 WeakPolarHBondContact CE-O 3.45Å; K170-V247 HydrophobicContact CG-CG1 4.14Å; Y173-V247 HydrophobicContact CD2-CG2 4.31Å; Y173-V247 HydrophobicContact CG-CG2 4.47Å; E174-V247 HydrophobicContact CG-CG1 3.48Å; E174-V247 VanDerWaalsContact CG-CG1 3.48Å; I243-V247 HydrophobicContact CG2-CG2 4.15Å; I243-V247 WeakPolarHBondContact O-CB 3.36Å; I243-V247 WeakPolarHBondContact O-CG2 3.29Å; I243-V247 PolarHBondContact O-N 3.1Å; N244-V247 PolarHBondContact O-N 3.47Å; T245-V247 VanDerWaalsContact C-N 3.32Å; T245-V247 PolarHBondContact O-N 3.01Å; V247-M251 HydrophobicContact CG2-SD 4.38Å |
| 248 | T | 98 | Very high | 98.5 | Very high | 64 Ų | 64 | 39 Ų | 39 | 39% | 0.393 | 21% | 0.208 | S | C | . | . | I | π-helix | trans | -87.1 | -20.7 | -169.6 | 62.6 | 0 | 0 | 0 | 0 | 113.7 | N244 E252 | N244-T248 WeakPolarHBondContact O-CB 3.31Å; N244-T248 WeakPolarHBondContact O-CG2 3.47Å; N244-T248 PolarHBondContact O-N 2.95Å; N244-T248 PolarHBondContact O-OG1 3.38Å; N244-T248 WeakPolarHBondContact OD1-CG2 3.34Å; T248-E252 VanDerWaalsContact O-CB 3.31Å; T248-E252 WeakPolarHBondContact O-CB 3.24Å |
| 249 | K | 98.3 | Very high | 98.5 | Very high | 140 Ų | 140 | 36.3 Ų | 36.3 | 61% | 0.609 | 20% | 0.196 | S | C | * | . | I | π-helix | trans | -110.7 | -61.9 | 178.1 | -57.5 | -175.8 | 179.9 | 172.7 | 0 | 110.9 | T245 E252 D253 | T245-K249 HydrophobicContact CG2-CD 4.26Å; T245-K249 WeakPolarHBondContact O-CA 3.32Å; T245-K249 VanDerWaalsContact O-CB 3.32Å; T245-K249 WeakPolarHBondContact O-CB 3.5Å; T245-K249 PolarHBondContact O-N 2.8Å; K249-E252 PolarHBondContact O-N 3.11Å; K249-D253 WeakPolarHBondContact O-CB 3.21Å; K249-D253 PolarHBondContact O-N 3.25Å |
| 250 | T | 98.3 | Very high | 98.4 | Very high | 46 Ų | 46 | 40.6 Ų | 40.6 | 28% | 0.282 | 22% | 0.216 | S | C | . | . | I | π-helix | trans | -68 | -51.2 | -170.5 | -42.3 | 0 | 0 | 0 | 0 | 112.5 | T245 L246 L319 | T245-T250 PolarHBondContact O-N 3.48Å; L246-T250 HydrophobicContact CD1-CG2 4.42Å; L246-T250 WeakPolarHBondContact O-CB 3.3Å; L246-T250 PolarHBondContact O-N 2.92Å; T250-L319 HydrophobicContact CG2-CD1 3.58Å |
| 251 | M | 98.6 | Very high | 98.4 | Very high | 1 Ų | 1 | 40 Ų | 40 | 1% | 0.005 | 21% | 0.212 | C | C | . | . | I | π-helix | trans | -68.1 | -36.9 | 177.4 | -68.5 | -178.9 | 172.8 | 0 | 0 | 111.8 | L166 T169 K170 Y173 L246 V247 T254 L255 L319 K323 | L166-M251 HydrophobicContact CD1-CG 4.34Å; T169-M251 HydrophobicContact CG2-CE 4.12Å; K170-M251 HydrophobicContact CB-SD 3.94Å; K170-M251 HydrophobicContact CD-CB 4.22Å; K170-M251 HydrophobicContact CG-SD 4.11Å; Y173-M251 HydrophobicContact CD2-CE 3.59Å; Y173-M251 HydrophobicContact CD2-SD 4.48Å; Y173-M251 HydrophobicContact CE2-CE 3.76Å; Y173-M251 HydrophobicContact CG-CE 4.44Å; L246-M251 HydrophobicContact CD2-CE 4.44Å; L246-M251 HydrophobicContact CG-CE 4.28Å; L246-M251 WeakPolarHBondContact O-CG 3.39Å; L246-M251 PolarHBondContact O-N 3.24Å; V247-M251 HydrophobicContact CG2-SD 4.38Å; M251-T254 PolarHBondContact O-N 3Å; M251-L255 WeakPolarHBondContact O-CG 3.27Å; M251-L255 PolarHBondContact O-N 3.42Å; M251-L319 HydrophobicContact CG-CD1 4.12Å; M251-L319 HydrophobicContact CG-CD2 4.29Å; M251-K323 HydrophobicContact CE-CD 4.02Å; M251-K323 HydrophobicContact CE-CG 3.99Å |
| 252 | E | 98.2 | Very high | 98.4 | Very high | 52 Ų | 52 | 39.3 Ų | 39.3 | 24% | 0.243 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -66.3 | -38.1 | 178.9 | -165.4 | 62.8 | -146.5 | 0 | 0 | 111.9 | K170 T248 K249 T254 L255 M256 K259 | K170-E252 VanDerWaalsContact CE-OE2 3.22Å; K170-E252 WeakPolarHBondContact CE-OE2 3.24Å; K170-E252 IonicContact NZ-OE2 3.93Å; K170-E252 PolarHBondContact NZ-OE2 2.91Å; T248-E252 VanDerWaalsContact O-CB 3.31Å; T248-E252 WeakPolarHBondContact O-CB 3.24Å; K249-E252 PolarHBondContact O-N 3.11Å; E252-T254 VanDerWaalsContact C-N 3.31Å; E252-T254 PolarHBondContact O-N 3.21Å; E252-L255 CarbonylContact O-C 3.57Å; E252-L255 PolarHBondContact O-N 3.4Å; E252-M256 HydrophobicContact CG-CG 4.49Å; E252-M256 VanDerWaalsContact O-CG 3.29Å; E252-M256 WeakPolarHBondContact O-CG 3.43Å; E252-M256 PolarHBondContact O-N 3.41Å; E252-K259 IonicContact OE1-NZ 2.65Å; E252-K259 PolarHBondContact OE1-NZ 3.12Å |
| 253 | D | 98.3 | Very high | 98.4 | Very high | 89 Ų | 89 | 39.5 Ų | 39.5 | 48% | 0.476 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -58 | -42.7 | 174.5 | 176.9 | 74.5 | 0 | 0 | 0 | 112.3 | K249 M256 T257 K315 | K249-D253 WeakPolarHBondContact O-CB 3.21Å; K249-D253 PolarHBondContact O-N 3.25Å; D253-M256 PolarHBondContact O-N 2.85Å; D253-T257 PolarHBondContact O-N 2.7Å; D253-K315 IonicContact OD1-NZ 3.31Å; D253-K315 PolarHBondContact OD1-NZ 3.36Å; D253-K315 IonicContact OD2-NZ 3.43Å; D253-K315 PolarHBondContact OD2-NZ 3.02Å |
| 254 | T | 98.7 | Very high | 98.4 | Very high | 6 Ų | 6 | 39.4 Ų | 39.4 | 4% | 0.037 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -67.3 | -43.7 | 175.6 | -60.6 | 0 | 0 | 0 | 0 | 111.2 | L166 M251 E252 M256 T257 V258 K315 L316 L319 | L166-T254 HydrophobicContact CD2-CG2 3.75Å; M251-T254 PolarHBondContact O-N 3Å; E252-T254 VanDerWaalsContact C-N 3.31Å; E252-T254 PolarHBondContact O-N 3.21Å; T254-M256 VanDerWaalsContact C-N 3.25Å; T254-M256 PolarHBondContact O-N 3.26Å; T254-T257 PolarHBondContact O-N 3.49Å; T254-T257 VanDerWaalsContact O-N 3.11Å; T254-V258 WeakPolarHBondContact O-CG2 3.32Å; T254-V258 PolarHBondContact O-N 3.07Å; T254-K315 HydrophobicContact CG2-CB 4.02Å; T254-L316 HydrophobicContact CG2-CD2 3.99Å; T254-L316 HydrophobicContact CG2-CG 4.37Å; T254-L319 HydrophobicContact CG2-CD2 3.97Å |
| 255 | L | 98.6 | Very high | 98.3 | Very high | 16 Ų | 16 | 38.5 Ų | 38.5 | 8% | 0.084 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -64.5 | -28.7 | 176.8 | -74.9 | 174.7 | 0 | 0 | 0 | 113.1 | L166 R167 K170 M251 E252 V258 K259 | L166-L255 HydrophobicContact CD2-CD2 3.8Å; L166-L255 HydrophobicContact CD2-CG 4.05Å; L166-L255 HydrophobicContact CG-CD2 4.11Å; L166-L255 HydrophobicContact CG-CG 4.43Å; R167-L255 HydrophobicContact CG-CD2 3.92Å; K170-L255 HydrophobicContact CD-CD1 3.27Å; M251-L255 WeakPolarHBondContact O-CG 3.27Å; M251-L255 PolarHBondContact O-N 3.42Å; E252-L255 CarbonylContact O-C 3.57Å; E252-L255 PolarHBondContact O-N 3.4Å; L255-V258 WeakPolarHBondContact O-CB 3.38Å; L255-V258 PolarHBondContact O-N 3.41Å; L255-K259 WeakPolarHBondContact O-CG 3.34Å; L255-K259 PolarHBondContact O-N 3.05Å |
| 256 | M | 98.4 | Very high | 98.3 | Very high | 60 Ų | 60 | 36.7 Ų | 36.7 | 30% | 0.296 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -65.5 | -40.9 | 172.3 | -74.9 | -55.3 | -57 | 0 | 0 | 111.5 | E252 D253 T254 K259 Q260 | E252-M256 HydrophobicContact CG-CG 4.49Å; E252-M256 VanDerWaalsContact O-CG 3.29Å; E252-M256 WeakPolarHBondContact O-CG 3.43Å; E252-M256 PolarHBondContact O-N 3.41Å; D253-M256 PolarHBondContact O-N 2.85Å; T254-M256 VanDerWaalsContact C-N 3.25Å; T254-M256 PolarHBondContact O-N 3.26Å; M256-K259 PolarHBondContact O-N 3.35Å; M256-K259 HydrophobicContact SD-CD 3.92Å; M256-Q260 WeakPolarHBondContact O-CG 3.47Å; M256-Q260 PolarHBondContact O-N 3.07Å; M256-Q260 VanDerWaalsContact O-N 3.14Å |
| 257 | T | 98.6 | Very high | 98.2 | Very high | 10 Ų | 10 | 38 Ų | 38 | 6% | 0.061 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -67.7 | -36.3 | 172.8 | -56.9 | 0 | 0 | 0 | 0 | 111.8 | D253 T254 K259 Q260 Y261 L308 D311 V312 K315 | D253-T257 PolarHBondContact O-N 2.7Å; T254-T257 PolarHBondContact O-N 3.49Å; T254-T257 VanDerWaalsContact O-N 3.11Å; T257-K259 PolarHBondContact O-N 2.93Å; T257-Q260 WeakPolarHBondContact O-CB 3.22Å; T257-Q260 PolarHBondContact O-N 3.4Å; T257-Y261 PolarHBondContact O-N 3.47Å; T257-L308 HydrophobicContact CG2-CD2 4.32Å; T257-D311 HydrophobicContact CG2-CB 4.19Å; T257-V312 HydrophobicContact CG2-CG2 3.79Å; T257-K315 HydrophobicContact CG2-CD 4.19Å; T257-K315 WeakPolarHBondContact OG1-CD 3.36Å; T257-K315 VanDerWaalsContact OG1-CE 3.32Å; T257-K315 WeakPolarHBondContact OG1-CE 3.46Å; T257-K315 PolarHBondContact OG1-NZ 2.88Å |
| 258 | V | 98.7 | Very high | 98.2 | Very high | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58.8 | -45.8 | 171.7 | 169.6 | 0 | 0 | 0 | 0 | 111.5 | I163 T254 L255 Q260 Y261 E262 V312 | I163-V258 HydrophobicContact CD1-CG1 3.95Å; I163-V258 HydrophobicContact CD1-CG2 4.26Å; I163-V258 HydrophobicContact CG1-CG1 4.11Å; I163-V258 HydrophobicContact CG1-CG2 3.92Å; I163-V258 HydrophobicContact CG2-CG1 3.64Å; T254-V258 WeakPolarHBondContact O-CG2 3.32Å; T254-V258 PolarHBondContact O-N 3.07Å; L255-V258 WeakPolarHBondContact O-CB 3.38Å; L255-V258 PolarHBondContact O-N 3.41Å; V258-Q260 VanDerWaalsContact C-N 3.3Å; V258-Q260 PolarHBondContact O-N 3.33Å; V258-Y261 WeakPolarHBondContact O-CB 3.33Å; V258-Y261 PolarHBondContact O-N 2.94Å; V258-E262 HydrophobicContact CG1-CG 4.35Å; V258-E262 WeakPolarHBondContact O-CG 3.35Å; V258-E262 PolarHBondContact O-N 3.35Å; V258-V312 HydrophobicContact CG2-CG1 3.86Å; V258-V312 HydrophobicContact CG2-CG2 4.25Å |
| 259 | K | 98.4 | Very high | 98.2 | Very high | 58 Ų | 58 | 36.2 Ų | 36.2 | 25% | 0.252 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -59.1 | -42.1 | 176.3 | -70.6 | 168.3 | -169.8 | 161.9 | 0 | 111.4 | E252 L255 M256 T257 E262 A263 | E252-K259 IonicContact OE1-NZ 2.65Å; E252-K259 PolarHBondContact OE1-NZ 3.12Å; L255-K259 WeakPolarHBondContact O-CG 3.34Å; L255-K259 PolarHBondContact O-N 3.05Å; M256-K259 PolarHBondContact O-N 3.35Å; M256-K259 HydrophobicContact SD-CD 3.92Å; T257-K259 PolarHBondContact O-N 2.93Å; K259-E262 PolarHBondContact O-N 3.11Å; K259-A263 WeakPolarHBondContact O-CB 3.42Å; K259-A263 PolarHBondContact O-N 2.97Å |
| 260 | Q | 98.3 | Very high | 98.1 | Very high | 99 Ų | 99 | 29.8 Ų | 29.8 | 46% | 0.463 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -63.3 | -42.8 | 176 | -68.6 | 169.9 | -0.8 | 0 | 0 | 112.1 | M256 T257 V258 A263 A264 L308 | M256-Q260 WeakPolarHBondContact O-CG 3.47Å; M256-Q260 PolarHBondContact O-N 3.07Å; M256-Q260 VanDerWaalsContact O-N 3.14Å; T257-Q260 WeakPolarHBondContact O-CB 3.22Å; T257-Q260 PolarHBondContact O-N 3.4Å; V258-Q260 VanDerWaalsContact C-N 3.3Å; V258-Q260 PolarHBondContact O-N 3.33Å; Q260-A263 PolarHBondContact O-N 3.2Å; Q260-A264 WeakPolarHBondContact O-CB 3.45Å; Q260-A264 PolarHBondContact O-N 3.36Å; Q260-L308 HydrophobicContact CB-CD1 4.21Å; Q260-L308 HydrophobicContact CB-CD2 4Å |
| 261 | Y | 98.6 | Very high | 98.1 | Very high | 3 Ų | 3 | 28.2 Ų | 28.2 | 1% | 0.012 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -61.2 | -48.3 | 175 | 161.1 | -102.9 | 0 | 0 | 0 | 112.1 | L159 I163 T257 V258 A263 A264 R265 Y305 L308 R309 V312 | L159-Y261 HydrophobicContact CD2-CE1 4.15Å; L159-Y261 HydrophobicContact CD2-CE2 4.17Å; I163-Y261 HydrophobicContact CD1-CD1 4.23Å; I163-Y261 HydrophobicContact CD1-CE1 4.14Å; T257-Y261 PolarHBondContact O-N 3.47Å; V258-Y261 WeakPolarHBondContact O-CB 3.33Å; V258-Y261 PolarHBondContact O-N 2.94Å; Y261-A263 VanDerWaalsContact C-N 3.31Å; Y261-A263 PolarHBondContact O-N 2.78Å; Y261-A264 PolarHBondContact O-N 3.3Å; Y261-R265 WeakPolarHBondContact O-CB 3.4Å; Y261-R265 PolarHBondContact O-N 3.46Å; Y261-Y305 HydrophobicContact CD2-CD2 4.33Å; Y261-Y305 HydrophobicContact CD2-CE2 4.18Å; Y261-Y305 AromaticContact CE2-CD2 3.99Å; Y261-Y305 HydrophobicContact CE2-CD2 3.99Å; Y261-Y305 AromaticContact CE2-CE2 3.4Å; Y261-Y305 HydrophobicContact CE2-CE2 3.4Å; Y261-Y305 VanDerWaalsContact CE2-CE2 3.4Å; Y261-L308 HydrophobicContact CD2-CB 4.45Å; Y261-R309 HydrophobicContact CD2-CB 4.02Å; Y261-R309 HydrophobicContact CE2-CB 3.67Å; Y261-R309 HydrophobicContact CE2-CG 3.76Å; Y261-V312 HydrophobicContact CG-CG2 4.08Å |
| 262 | E | 98 | Very high | 98 | Very high | 54 Ų | 54 | 30.1 Ų | 30.1 | 25% | 0.252 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -62.6 | -38.4 | 179.1 | -72.4 | 177.1 | 149.4 | 0 | 0 | 111.9 | R167 V258 K259 L266 | R167-E262 IonicContact CZ-OE1 2.79Å; R167-E262 IonicContact CZ-OE2 3.66Å; R167-E262 IonicContact NH1-OE1 3.71Å; R167-E262 PolarHBondContact NH1-OE1 3.12Å; R167-E262 IonicContact NH2-OE1 3.1Å; R167-E262 PolarHBondContact NH2-OE1 3.13Å; R167-E262 IonicContact NH2-OE2 3.77Å; R167-E262 PolarHBondContact NH2-OE2 2.86Å; V258-E262 HydrophobicContact CG1-CG 4.35Å; V258-E262 WeakPolarHBondContact O-CG 3.35Å; V258-E262 PolarHBondContact O-N 3.35Å; K259-E262 PolarHBondContact O-N 3.11Å; E262-L266 PolarHBondContact O-N 2.85Å |
| 263 | A | 97.2 | Very high | 97.8 | Very high | 25 Ų | 25 | 28.9 Ų | 28.9 | 21% | 0.207 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -65.9 | -45.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | K259 Q260 Y261 R265 L266 E267 | K259-A263 WeakPolarHBondContact O-CB 3.42Å; K259-A263 PolarHBondContact O-N 2.97Å; Q260-A263 PolarHBondContact O-N 3.2Å; Y261-A263 VanDerWaalsContact C-N 3.31Å; Y261-A263 PolarHBondContact O-N 2.78Å; A263-R265 VanDerWaalsContact C-N 3.31Å; A263-R265 PolarHBondContact O-N 3.39Å; A263-L266 PolarHBondContact O-N 3.44Å; A263-E267 WeakPolarHBondContact O-CG 3.44Å; A263-E267 PolarHBondContact O-N 3.49Å |
| 264 | A | 98.1 | Very high | 97.6 | Very high | 0 Ų | 0 | 26.4 Ų | 26.4 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -64.2 | -34.8 | 178 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q260 Y261 E267 Y268 K304 L308 | Q260-A264 WeakPolarHBondContact O-CB 3.45Å; Q260-A264 PolarHBondContact O-N 3.36Å; Y261-A264 PolarHBondContact O-N 3.3Å; A264-E267 PolarHBondContact O-N 3.35Å; A264-Y268 VanDerWaalsContact O-CB 3.31Å; A264-Y268 WeakPolarHBondContact O-CB 3.33Å; A264-Y268 PolarHBondContact O-N 3.03Å; A264-K304 HydrophobicContact CB-CD 4.41Å; A264-K304 HydrophobicContact CB-CG 4.25Å; A264-L308 HydrophobicContact CB-CD1 3.55Å |
| 265 | R | 98.1 | Very high | 97.4 | Very high | 25 Ų | 25 | 26.9 Ų | 26.9 | 9% | 0.094 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -60.9 | -47.5 | 172.4 | -173.5 | -150.2 | 77.9 | -144.3 | -2.4 | 111.3 | E146 T154 Y261 A263 Y268 D269 Y305 | E146-R265 IonicContact OE2-NH2 3.88Å; T154-R265 HydrophobicContact CG2-CG 4.49Å; T154-R265 WeakPolarHBondContact O-CD 3.29Å; Y261-R265 WeakPolarHBondContact O-CB 3.4Å; Y261-R265 PolarHBondContact O-N 3.46Å; A263-R265 VanDerWaalsContact C-N 3.31Å; A263-R265 PolarHBondContact O-N 3.39Å; R265-Y268 WeakPolarHBondContact O-CB 3.2Å; R265-Y268 PolarHBondContact O-N 3.1Å; R265-D269 PolarHBondContact O-N 3.32Å; R265-Y305 HydrophobicContact CB-CD2 3.8Å; R265-Y305 HydrophobicContact CB-CE2 3.74Å; R265-Y305 HydrophobicContact CG-CD2 4.24Å; R265-Y305 HydrophobicContact CG-CE2 3.77Å |
| 266 | L | 97.7 | Very high | 97.2 | Very high | 20 Ų | 20 | 30.6 Ų | 30.6 | 11% | 0.105 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -63.5 | -42.2 | 178.7 | -178.4 | 65 | 0 | 0 | 0 | 111.6 | C139 Q142 L143 E262 A263 A270 | C139-L266 HydrophobicContact CB-CD2 4.06Å; C139-L266 HydrophobicContact CB-CG 4.21Å; Q142-L266 HydrophobicContact CB-CD1 4.07Å; Q142-L266 HydrophobicContact CG-CD1 3.7Å; L143-L266 HydrophobicContact CB-CD1 4.14Å; L143-L266 HydrophobicContact CB-CD2 4.31Å; E262-L266 PolarHBondContact O-N 2.85Å; A263-L266 PolarHBondContact O-N 3.44Å; L266-A270 WeakPolarHBondContact O-CB 3.47Å; L266-A270 PolarHBondContact O-N 2.98Å |
| 267 | E | 97.3 | Very high | 96.8 | Very high | 28 Ų | 28 | 32.1 Ų | 32.1 | 13% | 0.131 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -60.4 | -49.7 | 173.4 | -70.4 | 178.7 | 160.4 | 0 | 0 | 110.8 | N135 A263 A264 D269 A270 Y271 H301 K304 | N135-E267 PolarHBondContact ND2-OE1 3.48Å; A263-E267 WeakPolarHBondContact O-CG 3.44Å; A263-E267 PolarHBondContact O-N 3.49Å; A264-E267 PolarHBondContact O-N 3.35Å; E267-D269 PolarHBondContact O-N 3.39Å; E267-A270 WeakPolarHBondContact O-CB 3.44Å; E267-A270 PolarHBondContact O-N 3.43Å; E267-A270 VanDerWaalsContact O-N 3.1Å; E267-Y271 VanDerWaalsContact O-CD2 3.28Å; E267-Y271 WeakPolarHBondContact O-CD2 3.48Å; E267-Y271 PolarHBondContact O-N 3.03Å; E267-H301 WeakPolarHBondContact CB-ND1 3.47Å; E267-H301 IonicContact OE2-CE1 3.21Å; E267-H301 PolarHBondContact OE2-CE1 3.45Å; E267-H301 IonicContact OE2-ND1 2.7Å; E267-H301 PolarHBondContact OE2-ND1 3.47Å; E267-K304 IonicContact OE1-NZ 3.84Å; E267-K304 IonicContact OE2-NZ 3.4Å; E267-K304 PolarHBondContact OE2-NZ 2.96Å |
| 268 | Y | 98.1 | Very high | 96.5 | Very high | 29 Ų | 29 | 33 Ų | 33 | 11% | 0.114 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -53.5 | -50 | 177.9 | 166.2 | -109 | 0 | 0 | 0 | 112.2 | T154 A264 R265 A270 Y271 R272 F298 R302 Y305 | T154-Y268 HydrophobicContact CG2-CE1 4.31Å; T154-Y268 WeakPolarHBondContact OG1-CE1 3.44Å; A264-Y268 VanDerWaalsContact O-CB 3.31Å; A264-Y268 WeakPolarHBondContact O-CB 3.33Å; A264-Y268 PolarHBondContact O-N 3.03Å; R265-Y268 WeakPolarHBondContact O-CB 3.2Å; R265-Y268 PolarHBondContact O-N 3.1Å; Y268-A270 VanDerWaalsContact C-N 3.31Å; Y268-A270 PolarHBondContact O-N 2.89Å; Y268-Y271 PolarHBondContact O-N 3.19Å; Y268-R272 VanDerWaalsContact O-CB 3.31Å; Y268-R272 WeakPolarHBondContact O-CB 3.49Å; Y268-R272 PolarHBondContact O-N 3.17Å; Y268-F298 HydrophobicContact CD2-CE2 4.08Å; Y268-F298 HydrophobicContact CE2-CD2 4.33Å; Y268-F298 AromaticContact CE2-CE2 3.45Å; Y268-F298 HydrophobicContact CE2-CE2 3.45Å; Y268-F298 VanDerWaalsContact CE2-CE2 3.45Å; Y268-F298 AromaticContact CE2-CZ 3.91Å; Y268-F298 HydrophobicContact CE2-CZ 3.91Å; Y268-R302 HydrophobicContact CD2-CB 3.84Å; Y268-R302 HydrophobicContact CD2-CG 4.3Å; Y268-R302 HydrophobicContact CE2-CB 3.76Å; Y268-R302 HydrophobicContact CE2-CG 3.83Å; Y268-Y305 HydrophobicContact CD1-CD1 4.17Å; Y268-Y305 HydrophobicContact CD1-CG 4.4Å; Y268-Y305 HydrophobicContact CG-CD1 4.32Å; Y268-Y305 HydrophobicContact CG-CG 4.34Å |
| 269 | D | 97.8 | Very high | 96.1 | Very high | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63.8 | -35.8 | 178.2 | -80.7 | -38.3 | 0 | 0 | 0 | 112.7 | Q142 T154 R265 E267 R272 T273 | Q142-D269 HydrophobicContact CG-CB 3.97Å; T154-D269 WeakPolarHBondContact CB-OD2 3.24Å; T154-D269 PolarHBondContact N-OD1 3.33Å; T154-D269 PolarHBondContact N-OD2 2.92Å; T154-D269 PolarHBondContact OG1-OD1 2.83Å; T154-D269 PolarHBondContact OG1-OD2 2.7Å; R265-D269 PolarHBondContact O-N 3.32Å; E267-D269 PolarHBondContact O-N 3.39Å; D269-R272 IonicContact OD1-CZ 2.98Å; D269-R272 IonicContact OD1-NE 3.01Å; D269-R272 PolarHBondContact OD1-NE 3.4Å; D269-R272 IonicContact OD1-NH2 2.83Å; D269-R272 PolarHBondContact OD1-NH2 3.44Å; D269-R272 VanDerWaalsContact OD1-NH2 3.1Å; D269-T273 WeakPolarHBondContact O-CB 3.47Å; D269-T273 PolarHBondContact O-N 3.19Å; D269-T273 PolarHBondContact O-OG1 2.93Å |
| 270 | A | 96.9 | Very high | 95.7 | Very high | 4 Ų | 4 | 40.6 Ų | 40.6 | 3% | 0.033 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -67.2 | -44 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | K138 Q142 L266 E267 Y268 D274 | K138-A270 HydrophobicContact CB-CB 4.13Å; Q142-A270 HydrophobicContact CB-CB 3.71Å; Q142-A270 HydrophobicContact CG-CB 4.13Å; L266-A270 WeakPolarHBondContact O-CB 3.47Å; L266-A270 PolarHBondContact O-N 2.98Å; E267-A270 WeakPolarHBondContact O-CB 3.44Å; E267-A270 PolarHBondContact O-N 3.43Å; E267-A270 VanDerWaalsContact O-N 3.1Å; Y268-A270 VanDerWaalsContact C-N 3.31Å; Y268-A270 PolarHBondContact O-N 2.89Å; A270-D274 PolarHBondContact O-N 3.34Å; A270-D274 VanDerWaalsContact O-N 3.08Å |
| 271 | Y | 96.6 | Very high | 95 | Very high | 13 Ų | 13 | 37.2 Ų | 37.2 | 5% | 0.051 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -76.6 | -26.5 | 177 | -75.6 | -93.1 | 0 | 0 | 0 | 112.9 | N135 K138 E267 Y268 L275 H301 | N135-Y271 WeakPolarHBondContact OD1-CE2 3.45Å; N135-Y271 PolarHBondContact OD1-OH 3.22Å; N135-Y271 VanDerWaalsContact OD1-OH 3.05Å; K138-Y271 HydrophobicContact CD-CD1 4.35Å; K138-Y271 HydrophobicContact CD-CE1 3.93Å; K138-Y271 HydrophobicContact CD-CE2 4.35Å; E267-Y271 VanDerWaalsContact O-CD2 3.28Å; E267-Y271 WeakPolarHBondContact O-CD2 3.48Å; E267-Y271 PolarHBondContact O-N 3.03Å; Y268-Y271 PolarHBondContact O-N 3.19Å; Y271-L275 WeakPolarHBondContact O-CB 3.2Å; Y271-L275 PolarHBondContact O-N 3.22Å; Y271-L275 VanDerWaalsContact O-N 3.09Å; Y271-H301 AromaticContact CD2-CD2 3.43Å; Y271-H301 VanDerWaalsContact CD2-CD2 3.43Å; Y271-H301 WeakPolarHBondContact CD2-CD2 3.35Å; Y271-H301 AromaticContact CD2-CG 3.88Å; Y271-H301 AromaticContact CD2-NE2 3.64Å; Y271-H301 AromaticContact CE2-CD2 3.58Å; Y271-H301 AromaticContact CE2-CE1 3.75Å; Y271-H301 AromaticContact CE2-NE2 3.25Å; Y271-H301 VanDerWaalsContact CE2-NE2 3.25Å; Y271-H301 WeakPolarHBondContact CE2-NE2 3.43Å; Y271-H301 AromaticContact CG-CD2 3.75Å; Y271-H301 AromaticContact CZ-CD2 4Å; Y271-H301 AromaticContact CZ-NE2 3.56Å |
| 272 | R | 96.9 | Very high | 94.3 | Very high | 41 Ų | 41 | 41.8 Ų | 41.8 | 16% | 0.155 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -61.1 | -50.5 | 168.6 | -175.3 | 175.2 | 58.7 | 83.8 | 0.2 | 110.7 | S152 Y268 D269 D274 L275 E276 F298 | S152-R272 PolarHBondContact O-NH2 3.49Å; S152-R272 VanDerWaalsContact O-NH2 3.13Å; S152-R272 PolarHBondContact OG-NH1 3.47Å; S152-R272 VanDerWaalsContact OG-NH1 3.11Å; S152-R272 PolarHBondContact OG-NH2 2.88Å; Y268-R272 VanDerWaalsContact O-CB 3.31Å; Y268-R272 WeakPolarHBondContact O-CB 3.49Å; Y268-R272 PolarHBondContact O-N 3.17Å; D269-R272 IonicContact OD1-CZ 2.98Å; D269-R272 IonicContact OD1-NE 3.01Å; D269-R272 PolarHBondContact OD1-NE 3.4Å; D269-R272 IonicContact OD1-NH2 2.83Å; D269-R272 PolarHBondContact OD1-NH2 3.44Å; D269-R272 VanDerWaalsContact OD1-NH2 3.1Å; R272-D274 PolarHBondContact O-N 2.96Å; R272-L275 PolarHBondContact O-N 3.18Å; R272-E276 WeakPolarHBondContact CG-OE1 3.45Å; R272-E276 IonicContact CZ-OE1 3.33Å; R272-E276 IonicContact NH1-OE1 2.76Å; R272-E276 PolarHBondContact NH1-OE1 3.01Å; R272-E276 IonicContact NH1-OE2 2.73Å; R272-E276 WeakPolarHBondContact O-CG 3.49Å; R272-E276 PolarHBondContact O-N 3.33Å; R272-F298 HydrophobicContact CB-CD2 4.04Å; R272-F298 HydrophobicContact CB-CE2 3.72Å; R272-F298 HydrophobicContact CG-CE2 3.93Å |
| 273 | T | 95.2 | Very high | 93.5 | Very high | 26 Ų | 26 | 49.7 Ų | 49.7 | 16% | 0.16 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62 | -41.8 | 178.7 | -57.5 | 0 | 0 | 0 | 0 | 111.8 | Q142 D269 L275 E276 E277 | Q142-T273 PolarHBondContact OE1-OG1 3.36Å; D269-T273 WeakPolarHBondContact O-CB 3.47Å; D269-T273 PolarHBondContact O-N 3.19Å; D269-T273 PolarHBondContact O-OG1 2.93Å; T273-L275 VanDerWaalsContact C-N 3.34Å; T273-L275 PolarHBondContact O-N 2.9Å; T273-E276 PolarHBondContact O-N 3.39Å; T273-E277 HydrophobicContact CG2-CG 4.4Å; T273-E277 WeakPolarHBondContact O-CB 3.47Å; T273-E277 WeakPolarHBondContact O-CG 3.41Å; T273-E277 PolarHBondContact O-N 3.48Å |
| 274 | D | 93.3 | Very high | 93 | Very high | 38 Ų | 38 | 52.2 Ų | 52.2 | 20% | 0.203 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.2 | -39.8 | 177.3 | -168.2 | 69.6 | 0 | 0 | 0 | 112.5 | K138 A270 R272 L278 | K138-D274 WeakPolarHBondContact CE-OD2 3.48Å; K138-D274 VanDerWaalsContact NZ-CG 3.26Å; K138-D274 IonicContact NZ-OD1 3.83Å; K138-D274 IonicContact NZ-OD2 2.85Å; K138-D274 PolarHBondContact NZ-OD2 3.45Å; A270-D274 PolarHBondContact O-N 3.34Å; A270-D274 VanDerWaalsContact O-N 3.08Å; R272-D274 PolarHBondContact O-N 2.96Å; D274-L278 WeakPolarHBondContact O-CB 3.41Å; D274-L278 VanDerWaalsContact O-CG 3.31Å; D274-L278 WeakPolarHBondContact O-CG 3.45Å; D274-L278 PolarHBondContact O-N 2.91Å |
| 275 | L | 94.7 | Very high | 91.9 | Very high | 16 Ų | 16 | 56.5 Ų | 56.5 | 8% | 0.084 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -66.9 | -42.6 | 175.3 | 179.6 | 65.4 | 0 | 0 | 0 | 111.8 | Y271 R272 T273 L278 S279 L291 A294 Q295 F298 | Y271-L275 WeakPolarHBondContact O-CB 3.2Å; Y271-L275 PolarHBondContact O-N 3.22Å; Y271-L275 VanDerWaalsContact O-N 3.09Å; R272-L275 PolarHBondContact O-N 3.18Å; T273-L275 VanDerWaalsContact C-N 3.34Å; T273-L275 PolarHBondContact O-N 2.9Å; L275-L278 PolarHBondContact O-N 3.3Å; L275-S279 WeakPolarHBondContact O-CB 3.45Å; L275-S279 PolarHBondContact O-N 2.97Å; L275-S279 PolarHBondContact O-OG 3.11Å; L275-L291 HydrophobicContact CD1-CD2 3.99Å; L275-A294 HydrophobicContact CD1-CB 3.91Å; L275-Q295 HydrophobicContact CD1-CB 4.36Å; L275-Q295 VanDerWaalsContact CD2-OE1 3.28Å; L275-F298 HydrophobicContact CD2-CB 3.95Å; L275-F298 HydrophobicContact CD2-CD1 3.72Å; L275-F298 HydrophobicContact CD2-CD2 4.4Å; L275-F298 HydrophobicContact CD2-CE1 4.34Å; L275-F298 HydrophobicContact CD2-CG 3.75Å |
| 276 | E | 93.8 | Very high | 91 | Very high | 94 Ų | 94 | 57.5 Ų | 57.5 | 44% | 0.439 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -61 | -45.6 | 174.8 | -71.5 | 170.8 | -168.3 | 0 | 0 | 111.1 | R272 T273 S279 L280 | R272-E276 WeakPolarHBondContact CG-OE1 3.45Å; R272-E276 IonicContact CZ-OE1 3.33Å; R272-E276 IonicContact NH1-OE1 2.76Å; R272-E276 PolarHBondContact NH1-OE1 3.01Å; R272-E276 IonicContact NH1-OE2 2.73Å; R272-E276 WeakPolarHBondContact O-CG 3.49Å; R272-E276 PolarHBondContact O-N 3.33Å; T273-E276 PolarHBondContact O-N 3.39Å; E276-S279 PolarHBondContact O-N 3.48Å; E276-L280 PolarHBondContact O-N 3.21Å |
| 277 | E | 91.3 | Very high | 90.3 | Very high | 92 Ų | 92 | 57.5 Ų | 57.5 | 43% | 0.43 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -60.8 | -45.5 | 176.6 | -75.8 | 179 | -176.2 | 0 | 0 | 112 | K141 T273 S279 L280 | K141-E277 IonicContact NZ-OE1 4Å; K141-E277 PolarHBondContact NZ-OE1 2.82Å; K141-E277 IonicContact NZ-OE2 3.71Å; K141-E277 PolarHBondContact NZ-OE2 3.16Å; T273-E277 HydrophobicContact CG2-CG 4.4Å; T273-E277 WeakPolarHBondContact O-CB 3.47Å; T273-E277 WeakPolarHBondContact O-CG 3.41Å; T273-E277 PolarHBondContact O-N 3.48Å; E277-S279 VanDerWaalsContact C-N 3.3Å; E277-S279 PolarHBondContact O-N 3.47Å; E277-L280 PolarHBondContact O-N 3.14Å |
| 278 | L | 91.2 | Very high | 89.6 | Confident | 29 Ų | 29 | 63.9 Ų | 63.9 | 15% | 0.152 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -66.4 | -31.9 | 177.5 | -73.9 | 170.2 | 0 | 0 | 0 | 112.7 | D274 L275 L280 G281 A294 | D274-L278 WeakPolarHBondContact O-CB 3.41Å; D274-L278 VanDerWaalsContact O-CG 3.31Å; D274-L278 WeakPolarHBondContact O-CG 3.45Å; D274-L278 PolarHBondContact O-N 2.91Å; L275-L278 PolarHBondContact O-N 3.3Å; L278-L280 VanDerWaalsContact C-N 3.26Å; L278-L280 PolarHBondContact O-N 3.31Å; L278-G281 PolarHBondContact O-N 3.39Å; L278-G281 VanDerWaalsContact O-N 3.17Å; L278-A294 HydrophobicContact CD1-CB 3.58Å |
| 279 | S | 90.6 | Very high | 89.1 | Confident | 59 Ų | 59 | 64.1 Ų | 64.1 | 41% | 0.413 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -70.2 | -22.6 | -179.8 | -62.7 | 0 | 0 | 0 | 0 | 113.2 | L275 E276 E277 G281 | L275-S279 WeakPolarHBondContact O-CB 3.45Å; L275-S279 PolarHBondContact O-N 2.97Å; L275-S279 PolarHBondContact O-OG 3.11Å; E276-S279 PolarHBondContact O-N 3.48Å; E277-S279 VanDerWaalsContact C-N 3.3Å; E277-S279 PolarHBondContact O-N 3.47Å; S279-G281 VanDerWaalsContact C-N 3.31Å |
| 280 | L | 89.4 | Confident | 88.6 | Confident | 157 Ų | 157 | 71.4 Ų | 71.4 | 82% | 0.822 | 38% | 0.381 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.1 | -11.2 | 174 | -65.8 | 170.3 | 0 | 0 | 0 | 113 | E276 E277 L278 | E276-L280 PolarHBondContact O-N 3.21Å; E277-L280 PolarHBondContact O-N 3.14Å; L278-L280 VanDerWaalsContact C-N 3.26Å; L278-L280 PolarHBondContact O-N 3.31Å |
| 281 | G | 84 | Confident | 88.3 | Confident | 28 Ų | 28 | 73.5 Ų | 73.5 | 29% | 0.289 | 39% | 0.391 | S | S | . | . | S | Bend | trans | -73.7 | 167.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | L278 S279 | L278-G281 PolarHBondContact O-N 3.39Å; L278-G281 VanDerWaalsContact O-N 3.17Å; S279-G281 VanDerWaalsContact C-N 3.31Å |
| 282 | P | 83.3 | Confident | 88 | Confident | 99 Ų | 99 | 79.2 Ų | 79.2 | 64% | 0.643 | 42% | 0.418 | S | S | * | . | trans | -61.1 | 142.1 | 175.5 | 24.4 | -31.6 | 0 | 0 | 0 | 111.8 | D284 T287 | P282-D284 VanDerWaalsContact C-N 3.26Å; P282-D284 PolarHBondContact O-N 2.72Å; P282-D284 VanDerWaalsContact O-N 3.13Å; P282-T287 WeakPolarHBondContact O-CB 3.33Å; P282-T287 WeakPolarHBondContact O-CG2 3.31Å; P282-T287 PolarHBondContact O-OG1 3.5Å | ||
| 283 | R | 83 | Confident | 87.8 | Confident | 220 Ų | 220 | 81 Ų | 81 | 83% | 0.83 | 44% | 0.437 | S | S | * | . | trans | -87.5 | 45.1 | -176.9 | -65.6 | -171 | 174.4 | -167.5 | -1.9 | 113.7 | ||||
| 284 | D | 86.1 | Confident | 87.7 | Confident | 78 Ų | 78 | 80 Ų | 80 | 42% | 0.417 | 43% | 0.432 | S | S | . | . | trans | -75.2 | 166.9 | 173.3 | 69.6 | -73.4 | 0 | 0 | 0 | 111.8 | P282 G286 T287 R288 | P282-D284 VanDerWaalsContact C-N 3.26Å; P282-D284 PolarHBondContact O-N 2.72Å; P282-D284 VanDerWaalsContact O-N 3.13Å; D284-G286 VanDerWaalsContact C-N 3.26Å; D284-G286 PolarHBondContact O-N 3.33Å; D284-G286 PolarHBondContact OD2-N 3.45Å; D284-G286 VanDerWaalsContact OD2-N 3.08Å; D284-T287 PolarHBondContact O-N 3.46Å; D284-T287 VanDerWaalsContact OD1-CB 3.23Å; D284-T287 WeakPolarHBondContact OD1-CB 3.35Å; D284-T287 PolarHBondContact OD1-OG1 2.78Å; D284-T287 PolarHBondContact OD2-N 2.88Å; D284-R288 PolarHBondContact O-N 2.98Å; D284-R288 VanDerWaalsContact O-N 3.07Å | ||
| 285 | A | 75 | Confident | 87.8 | Confident | 90 Ų | 90 | 82.1 Ų | 82.1 | 74% | 0.744 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -60.7 | -32.3 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 286 | G | 79.7 | Confident | 87.9 | Confident | 46 Ų | 46 | 84.4 Ų | 84.4 | 47% | 0.474 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -73.5 | -38.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | D284 R290 | D284-G286 VanDerWaalsContact C-N 3.26Å; D284-G286 PolarHBondContact O-N 3.33Å; D284-G286 PolarHBondContact OD2-N 3.45Å; D284-G286 VanDerWaalsContact OD2-N 3.08Å; G286-R290 PolarHBondContact O-N 3.27Å |
| 287 | T | 81.7 | Confident | 87.9 | Confident | 21 Ų | 21 | 82.4 Ų | 82.4 | 13% | 0.129 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -67.5 | -35.4 | 176.6 | -60.3 | 0 | 0 | 0 | 0 | 112 | P282 D284 G289 R290 L291 | P282-T287 WeakPolarHBondContact O-CB 3.33Å; P282-T287 WeakPolarHBondContact O-CG2 3.31Å; P282-T287 PolarHBondContact O-OG1 3.5Å; D284-T287 PolarHBondContact O-N 3.46Å; D284-T287 VanDerWaalsContact OD1-CB 3.23Å; D284-T287 WeakPolarHBondContact OD1-CB 3.35Å; D284-T287 PolarHBondContact OD1-OG1 2.78Å; D284-T287 PolarHBondContact OD2-N 2.88Å; T287-G289 PolarHBondContact O-N 3.47Å; T287-R290 PolarHBondContact O-N 3Å; T287-L291 WeakPolarHBondContact O-CB 3.42Å; T287-L291 PolarHBondContact O-N 3.49Å |
| 288 | R | 83.8 | Confident | 88.2 | Confident | 162 Ų | 162 | 79 Ų | 79 | 61% | 0.611 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -58.8 | -47.1 | 177.3 | -73.1 | 178 | 72.1 | 156.3 | 1.1 | 113.2 | D284 R290 L291 E292 | D284-R288 PolarHBondContact O-N 2.98Å; D284-R288 VanDerWaalsContact O-N 3.07Å; R288-R290 VanDerWaalsContact C-N 3.33Å; R288-R290 PolarHBondContact O-N 3.33Å; R288-L291 WeakPolarHBondContact O-CB 3.46Å; R288-L291 PolarHBondContact O-N 3.41Å; R288-E292 PolarHBondContact O-N 2.87Å |
| 289 | G | 86.6 | Confident | 88.6 | Confident | 33 Ų | 33 | 81.3 Ų | 81.3 | 34% | 0.34 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -66 | -33.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | T287 S293 | T287-G289 PolarHBondContact O-N 3.47Å; G289-S293 PolarHBondContact O-N 3.48Å; G289-S293 VanDerWaalsContact O-N 3.17Å; G289-S293 PolarHBondContact O-OG 2.91Å |
| 290 | R | 87.3 | Confident | 88.9 | Confident | 153 Ų | 153 | 81.2 Ų | 81.2 | 58% | 0.577 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -68.1 | -37.9 | 173 | -68.8 | 176.1 | 64.3 | -166.7 | -0.6 | 111.8 | G286 T287 R288 S293 A294 | G286-R290 PolarHBondContact O-N 3.27Å; T287-R290 PolarHBondContact O-N 3Å; R288-R290 VanDerWaalsContact C-N 3.33Å; R288-R290 PolarHBondContact O-N 3.33Å; R290-S293 PolarHBondContact O-N 3.34Å; R290-A294 WeakPolarHBondContact O-CB 3.43Å; R290-A294 PolarHBondContact O-N 3.21Å |
| 291 | L | 90.6 | Very high | 89.3 | Confident | 49 Ų | 49 | 75 Ų | 75 | 26% | 0.257 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -66.4 | -43.5 | 178.3 | -147.1 | 165.3 | 0 | 0 | 0 | 110.9 | L275 T287 R288 S293 A294 Q295 | L275-L291 HydrophobicContact CD1-CD2 3.99Å; T287-L291 WeakPolarHBondContact O-CB 3.42Å; T287-L291 PolarHBondContact O-N 3.49Å; R288-L291 WeakPolarHBondContact O-CB 3.46Å; R288-L291 PolarHBondContact O-N 3.41Å; L291-S293 VanDerWaalsContact C-N 3.34Å; L291-S293 PolarHBondContact O-N 2.99Å; L291-A294 PolarHBondContact O-N 2.78Å; L291-Q295 WeakPolarHBondContact O-CB 3.36Å; L291-Q295 PolarHBondContact O-N 3.19Å |
| 292 | E | 91.4 | Very high | 90 | Very high | 132 Ų | 132 | 78 Ų | 78 | 62% | 0.617 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -59.5 | -44 | 173.7 | -72 | 170.7 | -169.9 | 0 | 0 | 112 | R288 Q295 A296 | R288-E292 PolarHBondContact O-N 2.87Å; E292-Q295 PolarHBondContact O-N 3.1Å; E292-A296 PolarHBondContact O-N 3.11Å |
| 293 | S | 91.3 | Very high | 90.7 | Very high | 78 Ų | 78 | 77.2 Ų | 77.2 | 55% | 0.545 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -65.6 | -41.4 | 176.6 | -59 | 0 | 0 | 0 | 0 | 112.5 | G289 R290 L291 A296 T297 | G289-S293 PolarHBondContact O-N 3.48Å; G289-S293 VanDerWaalsContact O-N 3.17Å; G289-S293 PolarHBondContact O-OG 2.91Å; R290-S293 PolarHBondContact O-N 3.34Å; L291-S293 VanDerWaalsContact C-N 3.34Å; L291-S293 PolarHBondContact O-N 2.99Å; S293-A296 PolarHBondContact O-N 2.89Å; S293-T297 PolarHBondContact O-N 3.47Å; S293-T297 VanDerWaalsContact O-N 3.11Å; S293-T297 PolarHBondContact O-OG1 2.63Å; S293-T297 VanDerWaalsContact O-OG1 3.05Å |
| 294 | A | 93.5 | Very high | 91.5 | Very high | 7 Ų | 7 | 71.1 Ų | 71.1 | 6% | 0.058 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -64.9 | -39.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | L275 L278 R290 L291 T297 F298 | L275-A294 HydrophobicContact CD1-CB 3.91Å; L278-A294 HydrophobicContact CD1-CB 3.58Å; R290-A294 WeakPolarHBondContact O-CB 3.43Å; R290-A294 PolarHBondContact O-N 3.21Å; L291-A294 PolarHBondContact O-N 2.78Å; A294-T297 WeakPolarHBondContact CA-OG1 3.34Å; A294-T297 PolarHBondContact O-N 3.37Å; A294-T297 PolarHBondContact O-OG1 3.44Å; A294-F298 VanDerWaalsContact O-CB 3.27Å; A294-F298 WeakPolarHBondContact O-CB 3.31Å; A294-F298 PolarHBondContact O-N 3.15Å |
| 295 | Q | 96.4 | Very high | 92.1 | Very high | 82 Ų | 82 | 67.8 Ų | 67.8 | 38% | 0.383 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -61.7 | -46.2 | 176.3 | -174.1 | 67.1 | 41 | 0 | 0 | 111.6 | L275 L291 E292 F298 Q299 | L275-Q295 HydrophobicContact CD1-CB 4.36Å; L275-Q295 VanDerWaalsContact CD2-OE1 3.28Å; L291-Q295 WeakPolarHBondContact O-CB 3.36Å; L291-Q295 PolarHBondContact O-N 3.19Å; E292-Q295 PolarHBondContact O-N 3.1Å; Q295-F298 PolarHBondContact O-N 3.22Å; Q295-Q299 PolarHBondContact O-N 3.48Å |
| 296 | A | 96.2 | Very high | 93.2 | Very high | 64 Ų | 64 | 67 Ų | 67 | 53% | 0.529 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -62.9 | -43.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | E292 S293 Q299 A300 | E292-A296 PolarHBondContact O-N 3.11Å; S293-A296 PolarHBondContact O-N 2.89Å; A296-Q299 PolarHBondContact O-N 2.98Å; A296-A300 PolarHBondContact O-N 3.13Å; A296-A300 VanDerWaalsContact O-N 3.09Å |
| 297 | T | 94.8 | Very high | 94.1 | Very high | 52 Ų | 52 | 71.7 Ų | 71.7 | 32% | 0.319 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -69.1 | -40.3 | 177.8 | 50.7 | 0 | 0 | 0 | 0 | 112.5 | S293 A294 Q299 A300 H301 | S293-T297 PolarHBondContact O-N 3.47Å; S293-T297 VanDerWaalsContact O-N 3.11Å; S293-T297 PolarHBondContact O-OG1 2.63Å; S293-T297 VanDerWaalsContact O-OG1 3.05Å; A294-T297 WeakPolarHBondContact CA-OG1 3.34Å; A294-T297 PolarHBondContact O-N 3.37Å; A294-T297 PolarHBondContact O-OG1 3.44Å; T297-Q299 PolarHBondContact O-N 3.47Å; T297-A300 PolarHBondContact O-N 2.85Å; T297-H301 PolarHBondContact O-CD2 3.03Å; T297-H301 VanDerWaalsContact O-CD2 3.25Å; T297-H301 PolarHBondContact O-N 3.43Å |
| 298 | F | 97.3 | Very high | 94.9 | Very high | 21 Ų | 21 | 71.5 Ų | 71.5 | 9% | 0.092 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -55.8 | -48.8 | 171.5 | 164.5 | -103.2 | 0 | 0 | 0 | 111.5 | Y268 R272 L275 A294 Q295 A300 H301 R302 | Y268-F298 HydrophobicContact CD2-CE2 4.08Å; Y268-F298 HydrophobicContact CE2-CD2 4.33Å; Y268-F298 AromaticContact CE2-CE2 3.45Å; Y268-F298 HydrophobicContact CE2-CE2 3.45Å; Y268-F298 VanDerWaalsContact CE2-CE2 3.45Å; Y268-F298 AromaticContact CE2-CZ 3.91Å; Y268-F298 HydrophobicContact CE2-CZ 3.91Å; R272-F298 HydrophobicContact CB-CD2 4.04Å; R272-F298 HydrophobicContact CB-CE2 3.72Å; R272-F298 HydrophobicContact CG-CE2 3.93Å; L275-F298 HydrophobicContact CD2-CB 3.95Å; L275-F298 HydrophobicContact CD2-CD1 3.72Å; L275-F298 HydrophobicContact CD2-CD2 4.4Å; L275-F298 HydrophobicContact CD2-CE1 4.34Å; L275-F298 HydrophobicContact CD2-CG 3.75Å; A294-F298 VanDerWaalsContact O-CB 3.27Å; A294-F298 WeakPolarHBondContact O-CB 3.31Å; A294-F298 PolarHBondContact O-N 3.15Å; Q295-F298 PolarHBondContact O-N 3.22Å; F298-A300 VanDerWaalsContact C-N 3.34Å; F298-A300 PolarHBondContact O-N 2.89Å; F298-H301 PolarHBondContact O-N 3.22Å; F298-R302 WeakPolarHBondContact O-CB 3.49Å; F298-R302 PolarHBondContact O-N 3.31Å |
| 299 | Q | 98.2 | Very high | 95.6 | Very high | 76 Ų | 76 | 68.5 Ų | 68.5 | 36% | 0.355 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -60.9 | -43.9 | 179.4 | -170.9 | 61.6 | 47.9 | 0 | 0 | 111.6 | Q295 A296 T297 H301 R302 D303 | Q295-Q299 PolarHBondContact O-N 3.48Å; A296-Q299 PolarHBondContact O-N 2.98Å; T297-Q299 PolarHBondContact O-N 3.47Å; Q299-H301 VanDerWaalsContact C-N 3.34Å; Q299-H301 PolarHBondContact O-N 3.22Å; Q299-R302 WeakPolarHBondContact O-CB 3.36Å; Q299-R302 PolarHBondContact O-N 3.08Å; Q299-R302 VanDerWaalsContact O-N 3.17Å; Q299-D303 PolarHBondContact NE2-OD1 3.02Å; Q299-D303 VanDerWaalsContact O-CG 3.23Å; Q299-D303 PolarHBondContact O-N 3.44Å |
| 300 | A | 97.8 | Very high | 96.2 | Very high | 58 Ų | 58 | 68.4 Ų | 68.4 | 48% | 0.479 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.7 | -40.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | A296 T297 F298 K304 | A296-A300 PolarHBondContact O-N 3.13Å; A296-A300 VanDerWaalsContact O-N 3.09Å; T297-A300 PolarHBondContact O-N 2.85Å; F298-A300 VanDerWaalsContact C-N 3.34Å; F298-A300 PolarHBondContact O-N 2.89Å; A300-K304 WeakPolarHBondContact O-CB 3.41Å; A300-K304 PolarHBondContact O-N 3.39Å; A300-K304 VanDerWaalsContact O-N 3.13Å |
| 301 | H | 97.9 | Very high | 96.7 | Very high | 27 Ų | 27 | 64 Ų | 64 | 13% | 0.125 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -71.3 | -33.4 | 175.9 | -80.1 | -75.9 | 0 | 0 | 0 | 112.5 | E267 Y271 T297 F298 Q299 Y305 | E267-H301 WeakPolarHBondContact CB-ND1 3.47Å; E267-H301 IonicContact OE2-CE1 3.21Å; E267-H301 PolarHBondContact OE2-CE1 3.45Å; E267-H301 IonicContact OE2-ND1 2.7Å; E267-H301 PolarHBondContact OE2-ND1 3.47Å; Y271-H301 AromaticContact CD2-CD2 3.43Å; Y271-H301 VanDerWaalsContact CD2-CD2 3.43Å; Y271-H301 WeakPolarHBondContact CD2-CD2 3.35Å; Y271-H301 AromaticContact CD2-CG 3.88Å; Y271-H301 AromaticContact CD2-NE2 3.64Å; Y271-H301 AromaticContact CE2-CD2 3.58Å; Y271-H301 AromaticContact CE2-CE1 3.75Å; Y271-H301 AromaticContact CE2-NE2 3.25Å; Y271-H301 VanDerWaalsContact CE2-NE2 3.25Å; Y271-H301 WeakPolarHBondContact CE2-NE2 3.43Å; Y271-H301 AromaticContact CG-CD2 3.75Å; Y271-H301 AromaticContact CZ-CD2 4Å; Y271-H301 AromaticContact CZ-NE2 3.56Å; T297-H301 PolarHBondContact O-CD2 3.03Å; T297-H301 VanDerWaalsContact O-CD2 3.25Å; T297-H301 PolarHBondContact O-N 3.43Å; F298-H301 PolarHBondContact O-N 3.22Å; Q299-H301 VanDerWaalsContact C-N 3.34Å; Q299-H301 PolarHBondContact O-N 3.22Å; H301-Y305 WeakPolarHBondContact O-CB 3.45Å; H301-Y305 PolarHBondContact O-N 3.4Å |
| 302 | R | 98.4 | Very high | 97.1 | Very high | 90 Ų | 90 | 61.6 Ų | 61.6 | 34% | 0.34 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -61.9 | -50.5 | 172 | -177.9 | -176.7 | 171.9 | 134.6 | 8 | 111.4 | Y268 F298 Q299 K304 Y305 E306 | Y268-R302 HydrophobicContact CD2-CB 3.84Å; Y268-R302 HydrophobicContact CD2-CG 4.3Å; Y268-R302 HydrophobicContact CE2-CB 3.76Å; Y268-R302 HydrophobicContact CE2-CG 3.83Å; F298-R302 WeakPolarHBondContact O-CB 3.49Å; F298-R302 PolarHBondContact O-N 3.31Å; Q299-R302 WeakPolarHBondContact O-CB 3.36Å; Q299-R302 PolarHBondContact O-N 3.08Å; Q299-R302 VanDerWaalsContact O-N 3.17Å; R302-K304 VanDerWaalsContact C-N 3.31Å; R302-K304 PolarHBondContact O-N 2.87Å; R302-Y305 PolarHBondContact O-N 3.1Å; R302-Y305 VanDerWaalsContact O-N 3.16Å; R302-E306 HydrophobicContact CG-CG 4.41Å; R302-E306 IonicContact CZ-OE1 3.23Å; R302-E306 VanDerWaalsContact CZ-OE1 3.23Å; R302-E306 IonicContact NE-OE1 2.81Å; R302-E306 PolarHBondContact NE-OE1 3.37Å; R302-E306 IonicContact NH2-OE1 2.83Å; R302-E306 PolarHBondContact NH2-OE1 2.98Å; R302-E306 PolarHBondContact O-N 3.29Å |
| 303 | D | 98.7 | Very high | 97.4 | Very high | 83 Ų | 83 | 56.7 Ų | 56.7 | 44% | 0.444 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.2 | -41.9 | -179.5 | -62.5 | -18.2 | 0 | 0 | 0 | 111 | Q299 K307 | Q299-D303 PolarHBondContact NE2-OD1 3.02Å; Q299-D303 VanDerWaalsContact O-CG 3.23Å; Q299-D303 PolarHBondContact O-N 3.44Å; D303-K307 VanDerWaalsContact O-CB 3.26Å; D303-K307 WeakPolarHBondContact O-CB 3.49Å; D303-K307 PolarHBondContact O-N 2.88Å |
| 304 | K | 98.5 | Very high | 97.8 | Very high | 91 Ų | 91 | 57.5 Ų | 57.5 | 40% | 0.396 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -60.6 | -45.7 | 174.5 | -178.9 | -175.1 | 173.3 | -167.8 | 0 | 111.9 | A264 E267 A300 R302 L308 | A264-K304 HydrophobicContact CB-CD 4.41Å; A264-K304 HydrophobicContact CB-CG 4.25Å; E267-K304 IonicContact OE1-NZ 3.84Å; E267-K304 IonicContact OE2-NZ 3.4Å; E267-K304 PolarHBondContact OE2-NZ 2.96Å; A300-K304 WeakPolarHBondContact O-CB 3.41Å; A300-K304 PolarHBondContact O-N 3.39Å; A300-K304 VanDerWaalsContact O-N 3.13Å; R302-K304 VanDerWaalsContact C-N 3.31Å; R302-K304 PolarHBondContact O-N 2.87Å; K304-L308 HydrophobicContact CG-CD1 4.09Å; K304-L308 WeakPolarHBondContact O-CB 3.48Å; K304-L308 PolarHBondContact O-N 2.86Å |
| 305 | Y | 98.6 | Very high | 98 | Very high | 9 Ų | 9 | 60 Ų | 60 | 4% | 0.035 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63 | -49.9 | 177.8 | 162.7 | -104.5 | 0 | 0 | 0 | 111.7 | T154 Y261 R265 Y268 H301 R302 K307 L308 R309 | T154-Y305 HydrophobicContact CG2-CE1 4.19Å; T154-Y305 VanDerWaalsContact CG2-OH 3.31Å; T154-Y305 WeakPolarHBondContact CG2-OH 3.35Å; Y261-Y305 HydrophobicContact CD2-CD2 4.33Å; Y261-Y305 HydrophobicContact CD2-CE2 4.18Å; Y261-Y305 AromaticContact CE2-CD2 3.99Å; Y261-Y305 HydrophobicContact CE2-CD2 3.99Å; Y261-Y305 AromaticContact CE2-CE2 3.4Å; Y261-Y305 HydrophobicContact CE2-CE2 3.4Å; Y261-Y305 VanDerWaalsContact CE2-CE2 3.4Å; R265-Y305 HydrophobicContact CB-CD2 3.8Å; R265-Y305 HydrophobicContact CB-CE2 3.74Å; R265-Y305 HydrophobicContact CG-CD2 4.24Å; R265-Y305 HydrophobicContact CG-CE2 3.77Å; Y268-Y305 HydrophobicContact CD1-CD1 4.17Å; Y268-Y305 HydrophobicContact CD1-CG 4.4Å; Y268-Y305 HydrophobicContact CG-CD1 4.32Å; Y268-Y305 HydrophobicContact CG-CG 4.34Å; H301-Y305 WeakPolarHBondContact O-CB 3.45Å; H301-Y305 PolarHBondContact O-N 3.4Å; R302-Y305 PolarHBondContact O-N 3.1Å; R302-Y305 VanDerWaalsContact O-N 3.16Å; Y305-K307 VanDerWaalsContact C-N 3.34Å; Y305-K307 PolarHBondContact O-N 3.3Å; Y305-L308 PolarHBondContact O-N 2.98Å; Y305-R309 WeakPolarHBondContact O-CB 3.5Å; Y305-R309 PolarHBondContact O-N 3.41Å |
| 306 | E | 98.6 | Very high | 98.1 | Very high | 73 Ų | 73 | 57 Ų | 57 | 34% | 0.341 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.9 | -40.4 | -179.1 | -72.8 | -177.5 | -179.1 | 0 | 0 | 111.6 | R302 R309 G310 | R302-E306 HydrophobicContact CG-CG 4.41Å; R302-E306 IonicContact CZ-OE1 3.23Å; R302-E306 VanDerWaalsContact CZ-OE1 3.23Å; R302-E306 IonicContact NE-OE1 2.81Å; R302-E306 PolarHBondContact NE-OE1 3.37Å; R302-E306 IonicContact NH2-OE1 2.83Å; R302-E306 PolarHBondContact NH2-OE1 2.98Å; R302-E306 PolarHBondContact O-N 3.29Å; E306-R309 WeakPolarHBondContact O-CB 3.31Å; E306-R309 PolarHBondContact O-N 2.85Å; E306-G310 PolarHBondContact O-N 2.87Å; E306-G310 VanDerWaalsContact O-N 3.13Å |
| 307 | K | 98.6 | Very high | 98.2 | Very high | 145 Ų | 145 | 60.7 Ų | 60.7 | 63% | 0.63 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -59.7 | -53.6 | 173.3 | -179.6 | -177.9 | 175.1 | -178.1 | 0 | 111.6 | D303 Y305 R309 G310 D311 | D303-K307 VanDerWaalsContact O-CB 3.26Å; D303-K307 WeakPolarHBondContact O-CB 3.49Å; D303-K307 PolarHBondContact O-N 2.88Å; Y305-K307 VanDerWaalsContact C-N 3.34Å; Y305-K307 PolarHBondContact O-N 3.3Å; K307-R309 VanDerWaalsContact C-N 3.26Å; K307-R309 PolarHBondContact O-N 3.43Å; K307-G310 WeakPolarHBondContact O-CA 3.28Å; K307-G310 PolarHBondContact O-N 3.33Å; K307-G310 VanDerWaalsContact O-N 3.08Å; K307-D311 PolarHBondContact O-N 2.94Å |
| 308 | L | 98.6 | Very high | 98.4 | Very high | 16 Ų | 16 | 65 Ų | 65 | 8% | 0.084 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -64.5 | -31.5 | -178.6 | -80 | 165.9 | 0 | 0 | 0 | 112.5 | T257 Q260 Y261 A264 K304 Y305 G310 D311 V312 | T257-L308 HydrophobicContact CG2-CD2 4.32Å; Q260-L308 HydrophobicContact CB-CD1 4.21Å; Q260-L308 HydrophobicContact CB-CD2 4Å; Y261-L308 HydrophobicContact CD2-CB 4.45Å; A264-L308 HydrophobicContact CB-CD1 3.55Å; K304-L308 HydrophobicContact CG-CD1 4.09Å; K304-L308 WeakPolarHBondContact O-CB 3.48Å; K304-L308 PolarHBondContact O-N 2.86Å; Y305-L308 PolarHBondContact O-N 2.98Å; L308-G310 VanDerWaalsContact C-N 3.35Å; L308-D311 PolarHBondContact O-N 3.46Å; L308-V312 WeakPolarHBondContact O-CG2 3.46Å; L308-V312 PolarHBondContact O-N 3.38Å |
| 309 | R | 98.7 | Very high | 98.4 | Very high | 99 Ų | 99 | 64.4 Ų | 64.4 | 37% | 0.374 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -59.7 | -46.6 | 171.8 | -167.8 | 178.9 | 72.6 | 175.1 | 1.5 | 111 | D156 L159 Y261 Y305 E306 K307 A313 | D156-R309 WeakPolarHBondContact OD2-CD 3.39Å; L159-R309 HydrophobicContact CD2-CG 3.72Å; Y261-R309 HydrophobicContact CD2-CB 4.02Å; Y261-R309 HydrophobicContact CE2-CB 3.67Å; Y261-R309 HydrophobicContact CE2-CG 3.76Å; Y305-R309 WeakPolarHBondContact O-CB 3.5Å; Y305-R309 PolarHBondContact O-N 3.41Å; E306-R309 WeakPolarHBondContact O-CB 3.31Å; E306-R309 PolarHBondContact O-N 2.85Å; K307-R309 VanDerWaalsContact C-N 3.26Å; K307-R309 PolarHBondContact O-N 3.43Å; R309-A313 PolarHBondContact O-N 2.64Å; R309-A313 VanDerWaalsContact O-N 3.15Å |
| 310 | G | 98.5 | Very high | 98.4 | Very high | 31 Ų | 31 | 64.8 Ų | 64.8 | 32% | 0.32 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.9 | -46.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | E306 K307 L308 V312 A313 I314 | E306-G310 PolarHBondContact O-N 2.87Å; E306-G310 VanDerWaalsContact O-N 3.13Å; K307-G310 WeakPolarHBondContact O-CA 3.28Å; K307-G310 PolarHBondContact O-N 3.33Å; K307-G310 VanDerWaalsContact O-N 3.08Å; L308-G310 VanDerWaalsContact C-N 3.35Å; G310-V312 VanDerWaalsContact C-N 3.35Å; G310-V312 PolarHBondContact O-N 3.2Å; G310-A313 PolarHBondContact O-N 3.43Å; G310-I314 WeakPolarHBondContact O-CG1 3.48Å; G310-I314 PolarHBondContact O-N 2.73Å |
| 311 | D | 98.6 | Very high | 98.4 | Very high | 60 Ų | 60 | 67.1 Ų | 67.1 | 32% | 0.321 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -59.5 | -43.1 | 179.6 | -67.2 | -19.2 | 0 | 0 | 0 | 111.8 | T257 K307 L308 I314 K315 | T257-D311 HydrophobicContact CG2-CB 4.19Å; K307-D311 PolarHBondContact O-N 2.94Å; L308-D311 PolarHBondContact O-N 3.46Å; D311-I314 PolarHBondContact O-N 3.03Å; D311-K315 WeakPolarHBondContact O-CB 3.42Å; D311-K315 WeakPolarHBondContact O-CG 3.42Å; D311-K315 PolarHBondContact O-N 2.85Å |
| 312 | V | 98.8 | Very high | 98.4 | Very high | 0 Ų | 0 | 68.9 Ų | 68.9 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -63.1 | -48.3 | 175.3 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | L159 I163 T257 V258 Y261 L308 G310 I314 K315 L316 | L159-V312 HydrophobicContact CD1-CG1 4.04Å; L159-V312 HydrophobicContact CD2-CB 4.44Å; L159-V312 HydrophobicContact CD2-CG1 4.24Å; L159-V312 HydrophobicContact CG-CG1 4.26Å; I163-V312 HydrophobicContact CD1-CG1 4.22Å; I163-V312 HydrophobicContact CG1-CG1 4.31Å; T257-V312 HydrophobicContact CG2-CG2 3.79Å; V258-V312 HydrophobicContact CG2-CG1 3.86Å; V258-V312 HydrophobicContact CG2-CG2 4.25Å; Y261-V312 HydrophobicContact CG-CG2 4.08Å; L308-V312 WeakPolarHBondContact O-CG2 3.46Å; L308-V312 PolarHBondContact O-N 3.38Å; G310-V312 VanDerWaalsContact C-N 3.35Å; G310-V312 PolarHBondContact O-N 3.2Å; V312-I314 VanDerWaalsContact C-N 3.26Å; V312-I314 PolarHBondContact O-N 2.89Å; V312-K315 PolarHBondContact O-N 2.91Å; V312-L316 HydrophobicContact CG1-CD1 3.68Å; V312-L316 HydrophobicContact CG1-CG 4.14Å; V312-L316 WeakPolarHBondContact O-CB 3.41Å; V312-L316 VanDerWaalsContact O-CG 3.29Å; V312-L316 WeakPolarHBondContact O-CG 3.49Å; V312-L316 PolarHBondContact O-N 3.05Å |
| 313 | A | 98.5 | Very high | 98.3 | Very high | 29 Ų | 29 | 65.9 Ų | 65.9 | 24% | 0.24 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -59.2 | -39.1 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112 | L159 R309 G310 K317 | L159-A313 HydrophobicContact CD1-CB 4Å; R309-A313 PolarHBondContact O-N 2.64Å; R309-A313 VanDerWaalsContact O-N 3.15Å; G310-A313 PolarHBondContact O-N 3.43Å; A313-K317 WeakPolarHBondContact O-CG 3.33Å; A313-K317 PolarHBondContact O-N 3.31Å |
| 314 | I | 98.5 | Very high | 98.3 | Very high | 94 Ų | 94 | 66.6 Ų | 66.6 | 48% | 0.482 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -67.1 | -54 | 174.7 | -67.7 | 169 | 0 | 0 | 0 | 110 | G310 D311 V312 L316 K317 F318 | G310-I314 WeakPolarHBondContact O-CG1 3.48Å; G310-I314 PolarHBondContact O-N 2.73Å; D311-I314 PolarHBondContact O-N 3.03Å; V312-I314 VanDerWaalsContact C-N 3.26Å; V312-I314 PolarHBondContact O-N 2.89Å; I314-L316 VanDerWaalsContact C-N 3.26Å; I314-L316 PolarHBondContact O-N 2.93Å; I314-K317 WeakPolarHBondContact O-CB 3.25Å; I314-K317 PolarHBondContact O-N 2.87Å; I314-F318 HydrophobicContact CG2-CD2 3.62Å; I314-F318 HydrophobicContact CG2-CE2 3.56Å; I314-F318 WeakPolarHBondContact O-CD2 3.46Å; I314-F318 PolarHBondContact O-N 3.48Å; I314-F318 VanDerWaalsContact O-N 3.13Å |
| 315 | K | 98.6 | Very high | 98.3 | Very high | 59 Ų | 59 | 68.8 Ų | 68.8 | 26% | 0.257 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -56.8 | -38.2 | -178.3 | -79.3 | -162.5 | 174.7 | -163.5 | 0 | 113 | D253 T254 T257 D311 V312 K317 F318 L319 | D253-K315 IonicContact OD1-NZ 3.31Å; D253-K315 PolarHBondContact OD1-NZ 3.36Å; D253-K315 IonicContact OD2-NZ 3.43Å; D253-K315 PolarHBondContact OD2-NZ 3.02Å; T254-K315 HydrophobicContact CG2-CB 4.02Å; T257-K315 HydrophobicContact CG2-CD 4.19Å; T257-K315 WeakPolarHBondContact OG1-CD 3.36Å; T257-K315 VanDerWaalsContact OG1-CE 3.32Å; T257-K315 WeakPolarHBondContact OG1-CE 3.46Å; T257-K315 PolarHBondContact OG1-NZ 2.88Å; D311-K315 WeakPolarHBondContact O-CB 3.42Å; D311-K315 WeakPolarHBondContact O-CG 3.42Å; D311-K315 PolarHBondContact O-N 2.85Å; V312-K315 PolarHBondContact O-N 2.91Å; K315-K317 PolarHBondContact O-N 3.35Å; K315-F318 PolarHBondContact O-N 2.88Å; K315-L319 WeakPolarHBondContact O-CB 3.43Å; K315-L319 PolarHBondContact O-N 3.45Å |
| 316 | L | 98.6 | Very high | 98.2 | Very high | 19 Ų | 19 | 70.1 Ų | 70.1 | 10% | 0.099 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -60.5 | -42.2 | 176.3 | -73.9 | 169.4 | 0 | 0 | 0 | 112.3 | L159 Q162 I163 L166 T254 V312 I314 L319 E320 | L159-L316 HydrophobicContact CD1-CD1 3.81Å; Q162-L316 HydrophobicContact CB-CD1 3.93Å; I163-L316 HydrophobicContact CG1-CD1 4.32Å; L166-L316 HydrophobicContact CB-CD2 4.21Å; L166-L316 HydrophobicContact CD2-CD2 3.62Å; L166-L316 HydrophobicContact CG-CD2 4.48Å; T254-L316 HydrophobicContact CG2-CD2 3.99Å; T254-L316 HydrophobicContact CG2-CG 4.37Å; V312-L316 HydrophobicContact CG1-CD1 3.68Å; V312-L316 HydrophobicContact CG1-CG 4.14Å; V312-L316 WeakPolarHBondContact O-CB 3.41Å; V312-L316 VanDerWaalsContact O-CG 3.29Å; V312-L316 WeakPolarHBondContact O-CG 3.49Å; V312-L316 PolarHBondContact O-N 3.05Å; I314-L316 VanDerWaalsContact C-N 3.26Å; I314-L316 PolarHBondContact O-N 2.93Å; L316-L319 PolarHBondContact O-N 3.39Å; L316-E320 WeakPolarHBondContact O-CB 3.34Å; L316-E320 PolarHBondContact O-N 3.25Å |
| 317 | K | 97.9 | Very high | 98.2 | Very high | 142 Ų | 142 | 67.5 Ų | 67.5 | 62% | 0.617 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -64.4 | -49.3 | 176.8 | -68 | 176.3 | -176.6 | 179.9 | 0 | 111.9 | A313 I314 K315 L319 E320 E321 | A313-K317 WeakPolarHBondContact O-CG 3.33Å; A313-K317 PolarHBondContact O-N 3.31Å; I314-K317 WeakPolarHBondContact O-CB 3.25Å; I314-K317 PolarHBondContact O-N 2.87Å; K315-K317 PolarHBondContact O-N 3.35Å; K317-L319 VanDerWaalsContact C-N 3.3Å; K317-L319 PolarHBondContact O-N 2.88Å; K317-E320 PolarHBondContact O-N 3.47Å; K317-E321 PolarHBondContact O-N 3.07Å; K317-E321 VanDerWaalsContact O-N 3.17Å |
| 318 | F | 98.3 | Very high | 98.2 | Very high | 142 Ų | 142 | 66.2 Ų | 66.2 | 62% | 0.623 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -61.3 | -39.5 | 177.4 | -82.7 | -91.2 | 0 | 0 | 0 | 112.2 | I314 K315 N322 | I314-F318 HydrophobicContact CG2-CD2 3.62Å; I314-F318 HydrophobicContact CG2-CE2 3.56Å; I314-F318 WeakPolarHBondContact O-CD2 3.46Å; I314-F318 PolarHBondContact O-N 3.48Å; I314-F318 VanDerWaalsContact O-N 3.13Å; K315-F318 PolarHBondContact O-N 2.88Å; F318-N322 WeakPolarHBondContact O-CB 3.17Å; F318-N322 PolarHBondContact O-N 2.96Å |
| 319 | L | 98.5 | Very high | 98.1 | Very high | 10 Ų | 10 | 70.5 Ų | 70.5 | 5% | 0.052 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -64.7 | -41.6 | 176.7 | 179.8 | 66.9 | 0 | 0 | 0 | 111.3 | L166 T250 M251 T254 K315 L316 K317 N322 K323 | L166-L319 HydrophobicContact CD1-CD2 3.43Å; L166-L319 VanDerWaalsContact CD1-CD2 3.43Å; L166-L319 HydrophobicContact CD2-CD2 3.96Å; L166-L319 HydrophobicContact CG-CD2 4.35Å; T250-L319 HydrophobicContact CG2-CD1 3.58Å; M251-L319 HydrophobicContact CG-CD1 4.12Å; M251-L319 HydrophobicContact CG-CD2 4.29Å; T254-L319 HydrophobicContact CG2-CD2 3.97Å; K315-L319 WeakPolarHBondContact O-CB 3.43Å; K315-L319 PolarHBondContact O-N 3.45Å; L316-L319 PolarHBondContact O-N 3.39Å; K317-L319 VanDerWaalsContact C-N 3.3Å; K317-L319 PolarHBondContact O-N 2.88Å; L319-N322 PolarHBondContact O-N 2.93Å; L319-K323 WeakPolarHBondContact O-CB 3.33Å; L319-K323 PolarHBondContact O-N 3.3Å |
| 320 | E | 98 | Very high | 98.1 | Very high | 84 Ų | 84 | 66.4 Ų | 66.4 | 39% | 0.393 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.1 | -47.2 | 179.8 | -173.1 | 59.3 | -157.7 | 0 | 0 | 111.4 | L316 K317 N322 K323 I324 | L316-E320 WeakPolarHBondContact O-CB 3.34Å; L316-E320 PolarHBondContact O-N 3.25Å; K317-E320 PolarHBondContact O-N 3.47Å; E320-N322 PolarHBondContact O-N 3.46Å; E320-K323 PolarHBondContact O-N 3.01Å; E320-K323 VanDerWaalsContact OE1-CE 3.32Å; E320-K323 WeakPolarHBondContact OE1-CE 3.32Å; E320-K323 IonicContact OE1-NZ 3.33Å; E320-K323 PolarHBondContact OE1-NZ 2.97Å; E320-K323 WeakPolarHBondContact OE2-CE 3.36Å; E320-K323 IonicContact OE2-NZ 2.66Å; E320-K323 PolarHBondContact OE2-NZ 3.47Å; E320-I324 HydrophobicContact CG-CD1 4.21Å; E320-I324 WeakPolarHBondContact O-CG1 3.47Å; E320-I324 PolarHBondContact O-N 3.22Å |
| 321 | E | 97.2 | Very high | 98.1 | Very high | 107 Ų | 107 | 69.3 Ų | 69.3 | 50% | 0.5 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -59.8 | -47.1 | 175.2 | -69.3 | 179.9 | -164.8 | 0 | 0 | 112 | K317 I324 K325 | K317-E321 PolarHBondContact O-N 3.07Å; K317-E321 VanDerWaalsContact O-N 3.17Å; E321-I324 PolarHBondContact O-N 3.08Å; E321-K325 WeakPolarHBondContact O-CG 3.33Å; E321-K325 PolarHBondContact O-N 3.41Å; E321-K325 VanDerWaalsContact O-N 3.1Å |
| 322 | N | 96.8 | Very high | 98 | Very high | 64 Ų | 64 | 69 Ų | 69 | 34% | 0.342 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -64.1 | -42.7 | 178.9 | -176.7 | -101.1 | 0 | 0 | 0 | 111.9 | F318 L319 E320 I324 K325 V326 | F318-N322 WeakPolarHBondContact O-CB 3.17Å; F318-N322 PolarHBondContact O-N 2.96Å; L319-N322 PolarHBondContact O-N 2.93Å; E320-N322 PolarHBondContact O-N 3.46Å; N322-I324 PolarHBondContact O-N 2.91Å; N322-K325 PolarHBondContact O-N 3.37Å; N322-V326 WeakPolarHBondContact O-CG2 3.43Å; N322-V326 PolarHBondContact O-N 3.37Å |
| 323 | K | 98.1 | Very high | 97.9 | Very high | 27 Ų | 27 | 71.1 Ų | 71.1 | 12% | 0.117 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -57.8 | -49.7 | 177.3 | -178.3 | -159.5 | 74.7 | -172.8 | 0 | 110.4 | T169 Y173 L246 M251 L319 E320 K325 V326 M327 | T169-K323 HydrophobicContact CG2-CD 4.12Å; Y173-K323 HydrophobicContact CE2-CD 4.22Å; Y173-K323 HydrophobicContact CE2-CG 3.98Å; L246-K323 HydrophobicContact CD1-CB 4.49Å; L246-K323 HydrophobicContact CD2-CG 4.32Å; M251-K323 HydrophobicContact CE-CD 4.02Å; M251-K323 HydrophobicContact CE-CG 3.99Å; L319-K323 WeakPolarHBondContact O-CB 3.33Å; L319-K323 PolarHBondContact O-N 3.3Å; E320-K323 PolarHBondContact O-N 3.01Å; E320-K323 VanDerWaalsContact OE1-CE 3.32Å; E320-K323 WeakPolarHBondContact OE1-CE 3.32Å; E320-K323 IonicContact OE1-NZ 3.33Å; E320-K323 PolarHBondContact OE1-NZ 2.97Å; E320-K323 WeakPolarHBondContact OE2-CE 3.36Å; E320-K323 IonicContact OE2-NZ 2.66Å; E320-K323 PolarHBondContact OE2-NZ 3.47Å; K323-K325 PolarHBondContact O-N 3.14Å; K323-V326 PolarHBondContact O-N 3.06Å; K323-M327 HydrophobicContact CG-CG 4.22Å; K323-M327 VanDerWaalsContact O-CB 3.24Å; K323-M327 WeakPolarHBondContact O-CB 3.41Å; K323-M327 WeakPolarHBondContact O-CG 3.27Å; K323-M327 PolarHBondContact O-N 3.41Å |
| 324 | I | 98.3 | Very high | 97.9 | Very high | 98 Ų | 98 | 72.2 Ų | 72.2 | 50% | 0.503 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -59.3 | -48.8 | 179.3 | -69.1 | 169.1 | 0 | 0 | 0 | 110.3 | E320 E321 N322 V326 M327 H328 | E320-I324 HydrophobicContact CG-CD1 4.21Å; E320-I324 WeakPolarHBondContact O-CG1 3.47Å; E320-I324 PolarHBondContact O-N 3.22Å; E321-I324 PolarHBondContact O-N 3.08Å; N322-I324 PolarHBondContact O-N 2.91Å; I324-V326 PolarHBondContact O-N 3.26Å; I324-M327 PolarHBondContact O-N 3.08Å; I324-H328 WeakPolarHBondContact O-CB 3.36Å; I324-H328 PolarHBondContact O-N 3.44Å |
| 325 | K | 97.5 | Very high | 97.8 | Very high | 136 Ų | 136 | 73 Ų | 73 | 59% | 0.591 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -59.2 | -49.3 | 179.8 | -71 | 173.7 | -175.2 | 176.1 | 0 | 112.4 | E321 N322 K323 K329 | E321-K325 WeakPolarHBondContact O-CG 3.33Å; E321-K325 PolarHBondContact O-N 3.41Å; E321-K325 VanDerWaalsContact O-N 3.1Å; N322-K325 PolarHBondContact O-N 3.37Å; K323-K325 PolarHBondContact O-N 3.14Å; K325-K329 PolarHBondContact O-N 3.4Å |
| 326 | V | 97.8 | Very high | 97.7 | Very high | 37 Ų | 37 | 72.9 Ų | 72.9 | 22% | 0.224 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -64.3 | -50.9 | 179.5 | 173.7 | 0 | 0 | 0 | 0 | 110.2 | L246 N322 K323 I324 H328 K329 Q330 | L246-V326 HydrophobicContact CB-CG1 4.36Å; L246-V326 HydrophobicContact CD2-CB 4.38Å; L246-V326 HydrophobicContact CD2-CG1 4.09Å; N322-V326 WeakPolarHBondContact O-CG2 3.43Å; N322-V326 PolarHBondContact O-N 3.37Å; K323-V326 PolarHBondContact O-N 3.06Å; I324-V326 PolarHBondContact O-N 3.26Å; V326-H328 VanDerWaalsContact C-N 3.35Å; V326-H328 PolarHBondContact O-N 2.99Å; V326-K329 PolarHBondContact O-N 3.4Å; V326-Q330 HydrophobicContact CG1-CG 3.96Å; V326-Q330 WeakPolarHBondContact O-CB 3.23Å; V326-Q330 VanDerWaalsContact O-CG 3.22Å; V326-Q330 WeakPolarHBondContact O-CG 3.45Å; V326-Q330 PolarHBondContact O-N 3.46Å |
| 327 | M | 98.2 | Very high | 97.6 | Very high | 18 Ų | 18 | 73.1 Ų | 73.1 | 9% | 0.089 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -64.4 | -39.1 | -176.1 | -70.4 | -59.1 | -60.2 | 0 | 0 | 112.5 | Y173 I243 L246 K323 I324 Q330 L331 | Y173-M327 HydrophobicContact CD2-SD 4.06Å; Y173-M327 HydrophobicContact CE1-CE 4.44Å; Y173-M327 HydrophobicContact CE2-CE 3.98Å; Y173-M327 HydrophobicContact CE2-CG 3.6Å; Y173-M327 HydrophobicContact CE2-SD 3.47Å; Y173-M327 WeakPolarHBondContact CE2-SD 3.46Å; I243-M327 HydrophobicContact CD1-CE 3.99Å; I243-M327 HydrophobicContact CD1-SD 3.35Å; I243-M327 WeakPolarHBondContact CD1-SD 3.41Å; L246-M327 HydrophobicContact CD2-CG 3.81Å; L246-M327 HydrophobicContact CD2-SD 3.66Å; K323-M327 HydrophobicContact CG-CG 4.22Å; K323-M327 VanDerWaalsContact O-CB 3.24Å; K323-M327 WeakPolarHBondContact O-CB 3.41Å; K323-M327 WeakPolarHBondContact O-CG 3.27Å; K323-M327 PolarHBondContact O-N 3.41Å; I324-M327 PolarHBondContact O-N 3.08Å; M327-Q330 PolarHBondContact O-N 3.13Å; M327-L331 HydrophobicContact CE-CD1 4.04Å; M327-L331 HydrophobicContact CE-CD2 4.28Å; M327-L331 HydrophobicContact CE-CG 4.05Å; M327-L331 VanDerWaalsContact O-CB 3.22Å; M327-L331 WeakPolarHBondContact O-CB 3.39Å; M327-L331 WeakPolarHBondContact O-CG 3.35Å; M327-L331 PolarHBondContact O-N 3.17Å |
| 328 | H | 98 | Very high | 97.6 | Very high | 118 Ų | 118 | 68.2 Ų | 68.2 | 55% | 0.546 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -57.5 | -53.4 | 175.8 | -176.5 | 80.3 | 0 | 0 | 0 | 111 | I324 V326 Q330 L332 | I324-H328 WeakPolarHBondContact O-CB 3.36Å; I324-H328 PolarHBondContact O-N 3.44Å; V326-H328 VanDerWaalsContact C-N 3.35Å; V326-H328 PolarHBondContact O-N 2.99Å; H328-Q330 PolarHBondContact O-N 3Å; H328-L332 WeakPolarHBondContact O-CB 3.49Å; H328-L332 PolarHBondContact O-N 2.72Å; H328-L332 VanDerWaalsContact O-N 3.14Å |
| 329 | K | 97.6 | Very high | 97.5 | Very high | 106 Ų | 106 | 63.9 Ų | 63.9 | 46% | 0.461 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -60.7 | -47.6 | 178.5 | -176.4 | 168.7 | -174.2 | 161.9 | 0 | 112.2 | K325 V326 L332 L333 | K325-K329 PolarHBondContact O-N 3.4Å; V326-K329 PolarHBondContact O-N 3.4Å; K329-L332 PolarHBondContact O-N 3.27Å; K329-L333 HydrophobicContact CG-CD1 3.96Å; K329-L333 HydrophobicContact CG-CG 4.46Å; K329-L333 WeakPolarHBondContact O-CB 3.34Å; K329-L333 VanDerWaalsContact O-CG 3.29Å; K329-L333 WeakPolarHBondContact O-CG 3.31Å; K329-L333 PolarHBondContact O-N 3.09Å |
| 330 | Q | 98.1 | Very high | 97.2 | Very high | 13 Ų | 13 | 66.4 Ų | 66.4 | 6% | 0.061 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -69.9 | -40.6 | -174.7 | -65.2 | -50.3 | -49.6 | 0 | 0 | 112.6 | F239 S242 I243 V326 M327 H328 L332 F334 | F239-Q330 HydrophobicContact CD2-CB 3.86Å; F239-Q330 WeakPolarHBondContact CD2-O 3.46Å; F239-Q330 HydrophobicContact CE2-CB 4.04Å; S242-Q330 VanDerWaalsContact CB-OE1 3.3Å; S242-Q330 PolarHBondContact OG-OE1 2.98Å; I243-Q330 HydrophobicContact CD1-CB 4.15Å; I243-Q330 HydrophobicContact CD1-CG 4.44Å; V326-Q330 HydrophobicContact CG1-CG 3.96Å; V326-Q330 WeakPolarHBondContact O-CB 3.23Å; V326-Q330 VanDerWaalsContact O-CG 3.22Å; V326-Q330 WeakPolarHBondContact O-CG 3.45Å; V326-Q330 PolarHBondContact O-N 3.46Å; M327-Q330 PolarHBondContact O-N 3.13Å; H328-Q330 PolarHBondContact O-N 3Å; Q330-L332 VanDerWaalsContact C-N 3.34Å; Q330-F334 VanDerWaalsContact O-CB 3.27Å; Q330-F334 WeakPolarHBondContact O-CB 3.31Å; Q330-F334 PolarHBondContact O-N 3.43Å |
| 331 | L | 98.3 | Very high | 97.1 | Very high | 93 Ų | 93 | 63.8 Ų | 63.8 | 49% | 0.487 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -65.3 | -39.5 | 176.8 | -71.9 | 171.7 | 0 | 0 | 0 | 111.6 | F239 M327 H335 | F239-L331 HydrophobicContact CE2-CD2 4.28Å; F239-L331 HydrophobicContact CZ-CD2 4.48Å; M327-L331 HydrophobicContact CE-CD1 4.04Å; M327-L331 HydrophobicContact CE-CD2 4.28Å; M327-L331 HydrophobicContact CE-CG 4.05Å; M327-L331 VanDerWaalsContact O-CB 3.22Å; M327-L331 WeakPolarHBondContact O-CB 3.39Å; M327-L331 WeakPolarHBondContact O-CG 3.35Å; M327-L331 PolarHBondContact O-N 3.17Å; L331-H335 WeakPolarHBondContact O-CB 3.27Å; L331-H335 PolarHBondContact O-N 3.39Å |
| 332 | L | 97.3 | Very high | 96.9 | Very high | 53 Ų | 53 | 65 Ų | 65 | 28% | 0.277 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -67.9 | -47.5 | 178.3 | -173.5 | 63 | 0 | 0 | 0 | 111.8 | L35 H328 K329 Q330 F334 H335 N336 | L35-L332 HydrophobicContact CD1-CD2 3.63Å; H328-L332 WeakPolarHBondContact O-CB 3.49Å; H328-L332 PolarHBondContact O-N 2.72Å; H328-L332 VanDerWaalsContact O-N 3.14Å; K329-L332 PolarHBondContact O-N 3.27Å; Q330-L332 VanDerWaalsContact C-N 3.34Å; L332-F334 VanDerWaalsContact C-N 3.31Å; L332-F334 PolarHBondContact O-N 3.23Å; L332-H335 PolarHBondContact O-N 2.87Å; L332-N336 WeakPolarHBondContact O-CB 3.41Å; L332-N336 VanDerWaalsContact O-CG 3.23Å; L332-N336 PolarHBondContact O-N 3.17Å |
| 333 | L | 96.5 | Very high | 96.6 | Very high | 44 Ų | 44 | 64.7 Ų | 64.7 | 23% | 0.23 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -60.7 | -41.3 | 177 | -71.3 | 176 | 0 | 0 | 0 | 111.9 | V38 F238 K329 N336 A337 | V38-L333 HydrophobicContact CG1-CD2 3.87Å; F238-L333 HydrophobicContact CE1-CD1 4.12Å; K329-L333 HydrophobicContact CG-CD1 3.96Å; K329-L333 HydrophobicContact CG-CG 4.46Å; K329-L333 WeakPolarHBondContact O-CB 3.34Å; K329-L333 VanDerWaalsContact O-CG 3.29Å; K329-L333 WeakPolarHBondContact O-CG 3.31Å; K329-L333 PolarHBondContact O-N 3.09Å; L333-N336 PolarHBondContact O-N 3.29Å; L333-A337 WeakPolarHBondContact O-CB 3.47Å; L333-A337 PolarHBondContact O-N 3.43Å |
| 334 | F | 97.9 | Very high | 96.2 | Very high | 53 Ų | 53 | 65.6 Ų | 65.6 | 23% | 0.232 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -61.2 | -49.9 | 175.4 | 178.2 | -94.8 | 0 | 0 | 0 | 111.5 | L183 V236 F239 Q330 L332 N336 A337 V338 | L183-F334 HydrophobicContact CD2-CE2 4.3Å; L183-F334 HydrophobicContact CD2-CZ 4.1Å; V236-F334 HydrophobicContact CG1-CE2 4.26Å; V236-F334 HydrophobicContact CG2-CD2 4.4Å; V236-F334 HydrophobicContact CG2-CE2 3.92Å; F239-F334 HydrophobicContact CB-CB 4.47Å; F239-F334 HydrophobicContact CB-CD2 4.1Å; F239-F334 AromaticContact CD1-CD2 3.94Å; F239-F334 HydrophobicContact CD1-CD2 3.94Å; F239-F334 HydrophobicContact CD1-CE2 4.38Å; F239-F334 HydrophobicContact CD2-CB 3.77Å; F239-F334 HydrophobicContact CD2-CD2 4.3Å; F239-F334 HydrophobicContact CD2-CG 4.25Å; F239-F334 HydrophobicContact CE1-CD2 4.47Å; F239-F334 HydrophobicContact CE2-CB 4.21Å; F239-F334 HydrophobicContact CG-CB 4.13Å; F239-F334 AromaticContact CG-CD2 3.85Å; F239-F334 HydrophobicContact CG-CD2 3.85Å; F239-F334 HydrophobicContact CG-CG 4.26Å; Q330-F334 VanDerWaalsContact O-CB 3.27Å; Q330-F334 WeakPolarHBondContact O-CB 3.31Å; Q330-F334 PolarHBondContact O-N 3.43Å; L332-F334 VanDerWaalsContact C-N 3.31Å; L332-F334 PolarHBondContact O-N 3.23Å; F334-N336 PolarHBondContact O-N 2.88Å; F334-A337 PolarHBondContact O-N 3.16Å; F334-V338 HydrophobicContact CD1-CG2 4.44Å; F334-V338 HydrophobicContact CE1-CG2 4.08Å; F334-V338 HydrophobicContact CE2-CG2 4.44Å; F334-V338 HydrophobicContact CZ-CG2 4.08Å; F334-V338 WeakPolarHBondContact O-CG2 3.38Å; F334-V338 PolarHBondContact O-N 2.98Å |
| 335 | H | 97.5 | Very high | 95.6 | Very high | 109 Ų | 109 | 61.7 Ų | 61.7 | 51% | 0.505 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -59 | -48 | 177.4 | 174.4 | 73.8 | 0 | 0 | 0 | 111.9 | L331 L332 A337 V338 S339 | L331-H335 WeakPolarHBondContact O-CB 3.27Å; L331-H335 PolarHBondContact O-N 3.39Å; L332-H335 PolarHBondContact O-N 2.87Å; H335-A337 VanDerWaalsContact C-N 3.33Å; H335-A337 PolarHBondContact O-N 2.95Å; H335-V338 PolarHBondContact O-N 3.44Å; H335-S339 PolarHBondContact CE1-OG 3.13Å; H335-S339 VanDerWaalsContact CE1-OG 3.29Å; H335-S339 PolarHBondContact NE2-OG 3.02Å; H335-S339 WeakPolarHBondContact O-CB 3.26Å; H335-S339 PolarHBondContact O-N 3.25Å; H335-S339 PolarHBondContact O-OG 3.32Å |
| 336 | N | 96.3 | Very high | 95 | Very high | 58 Ų | 58 | 60.2 Ų | 60.2 | 31% | 0.31 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.6 | -41.4 | -179.4 | -72.1 | -6.9 | 0 | 0 | 0 | 111.8 | L332 L333 F334 S339 A340 | L332-N336 WeakPolarHBondContact O-CB 3.41Å; L332-N336 VanDerWaalsContact O-CG 3.23Å; L332-N336 PolarHBondContact O-N 3.17Å; L333-N336 PolarHBondContact O-N 3.29Å; F334-N336 PolarHBondContact O-N 2.88Å; N336-S339 PolarHBondContact O-N 3.05Å; N336-A340 WeakPolarHBondContact O-CB 3.45Å; N336-A340 PolarHBondContact O-N 3.05Å |
| 337 | A | 96.8 | Very high | 93.9 | Very high | 23 Ų | 23 | 65.5 Ų | 65.5 | 19% | 0.19 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -63.3 | -43.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L232 A235 L333 F334 H335 Y341 | L232-A337 HydrophobicContact CD1-CB 4.22Å; A235-A337 HydrophobicContact CB-CB 3.42Å; A235-A337 VanDerWaalsContact CB-CB 3.42Å; L333-A337 WeakPolarHBondContact O-CB 3.47Å; L333-A337 PolarHBondContact O-N 3.43Å; F334-A337 PolarHBondContact O-N 3.16Å; H335-A337 VanDerWaalsContact C-N 3.33Å; H335-A337 PolarHBondContact O-N 2.95Å; A337-Y341 WeakPolarHBondContact O-CB 3.38Å; A337-Y341 PolarHBondContact O-N 2.89Å |
| 338 | V | 96.4 | Very high | 92.7 | Very high | 40 Ų | 40 | 68 Ų | 68 | 24% | 0.242 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -62.7 | -51.2 | 176.7 | 172 | 0 | 0 | 0 | 0 | 110.6 | L232 F334 H335 A340 Y341 F342 | L232-V338 HydrophobicContact CD1-CG2 4.05Å; F334-V338 HydrophobicContact CD1-CG2 4.44Å; F334-V338 HydrophobicContact CE1-CG2 4.08Å; F334-V338 HydrophobicContact CE2-CG2 4.44Å; F334-V338 HydrophobicContact CZ-CG2 4.08Å; F334-V338 WeakPolarHBondContact O-CG2 3.38Å; F334-V338 PolarHBondContact O-N 2.98Å; H335-V338 PolarHBondContact O-N 3.44Å; V338-A340 VanDerWaalsContact C-N 3.34Å; V338-A340 PolarHBondContact O-N 2.86Å; V338-Y341 PolarHBondContact O-N 3Å; V338-F342 HydrophobicContact CG1-CD2 3.97Å; V338-F342 HydrophobicContact CG1-CE2 3.84Å; V338-F342 WeakPolarHBondContact O-CD2 3.45Å; V338-F342 PolarHBondContact O-N 3.05Å |
| 339 | S | 96.2 | Very high | 91.5 | Very high | 50 Ų | 50 | 67.4 Ų | 67.4 | 35% | 0.35 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -60.4 | -43.1 | 179.1 | -64.1 | 0 | 0 | 0 | 0 | 111.8 | H335 N336 F342 A343 | H335-S339 PolarHBondContact CE1-OG 3.13Å; H335-S339 VanDerWaalsContact CE1-OG 3.29Å; H335-S339 PolarHBondContact NE2-OG 3.02Å; H335-S339 WeakPolarHBondContact O-CB 3.26Å; H335-S339 PolarHBondContact O-N 3.25Å; H335-S339 PolarHBondContact O-OG 3.32Å; N336-S339 PolarHBondContact O-N 3.05Å; S339-F342 PolarHBondContact O-N 2.86Å; S339-A343 VanDerWaalsContact O-CB 3.24Å; S339-A343 WeakPolarHBondContact O-CB 3.5Å; S339-A343 PolarHBondContact O-N 2.94Å |
| 340 | A | 93.7 | Very high | 90.5 | Very high | 63 Ų | 63 | 66.6 Ų | 66.6 | 52% | 0.521 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -64.7 | -39 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | N336 V338 G344 | N336-A340 WeakPolarHBondContact O-CB 3.45Å; N336-A340 PolarHBondContact O-N 3.05Å; V338-A340 VanDerWaalsContact C-N 3.34Å; V338-A340 PolarHBondContact O-N 2.86Å; A340-G344 PolarHBondContact O-N 3.16Å |
| 341 | Y | 95.3 | Very high | 89.2 | Confident | 29 Ų | 29 | 70.3 Ų | 70.3 | 11% | 0.114 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -59.2 | -50.9 | 175 | 172.3 | -100.9 | 0 | 0 | 0 | 111.3 | N228 G229 L232 A337 V338 N345 | N228-Y341 HydrophobicContact CB-CD2 3.95Å; N228-Y341 HydrophobicContact CB-CE2 4.02Å; N228-Y341 WeakPolarHBondContact O-CD2 3.46Å; G229-Y341 VanDerWaalsContact CA-CE2 3.5Å; L232-Y341 HydrophobicContact CB-CD2 4.01Å; L232-Y341 HydrophobicContact CB-CG 4.18Å; L232-Y341 HydrophobicContact CD2-CD1 3.73Å; L232-Y341 HydrophobicContact CD2-CD2 4.06Å; L232-Y341 HydrophobicContact CD2-CE1 4.2Å; L232-Y341 HydrophobicContact CD2-CG 3.64Å; L232-Y341 HydrophobicContact CG-CG 4.43Å; A337-Y341 WeakPolarHBondContact O-CB 3.38Å; A337-Y341 PolarHBondContact O-N 2.89Å; V338-Y341 PolarHBondContact O-N 3Å; Y341-N345 WeakPolarHBondContact CD2-ND2 3.15Å; Y341-N345 WeakPolarHBondContact CE2-ND2 3.21Å; Y341-N345 VanDerWaalsContact O-CG 3.24Å; Y341-N345 PolarHBondContact O-N 2.98Å; Y341-N345 PolarHBondContact O-ND2 3.4Å |
| 342 | F | 93 | Very high | 87.8 | Confident | 132 Ų | 132 | 67.3 Ų | 67.3 | 58% | 0.579 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -69.9 | -42.4 | -178.6 | -71.3 | -69.6 | 0 | 0 | 0 | 112.5 | V338 S339 N345 Q346 | V338-F342 HydrophobicContact CG1-CD2 3.97Å; V338-F342 HydrophobicContact CG1-CE2 3.84Å; V338-F342 WeakPolarHBondContact O-CD2 3.45Å; V338-F342 PolarHBondContact O-N 3.05Å; S339-F342 PolarHBondContact O-N 2.86Å; F342-N345 PolarHBondContact O-N 3.37Å; F342-Q346 PolarHBondContact O-N 3.5Å |
| 343 | A | 90.8 | Very high | 86.4 | Confident | 59 Ų | 59 | 67.1 Ų | 67.1 | 49% | 0.488 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -63.9 | -41.6 | 177 | 0 | 0 | 0 | 0 | 0 | 112.2 | S339 N345 Q346 | S339-A343 VanDerWaalsContact O-CB 3.24Å; S339-A343 WeakPolarHBondContact O-CB 3.5Å; S339-A343 PolarHBondContact O-N 2.94Å; A343-N345 PolarHBondContact O-N 2.92Å; A343-Q346 WeakPolarHBondContact O-CB 3.45Å; A343-Q346 PolarHBondContact O-N 2.83Å |
| 344 | G | 88.1 | Confident | 84.9 | Confident | 46 Ų | 46 | 72 Ų | 72 | 47% | 0.474 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -63.8 | -26.7 | 177 | 0 | 0 | 0 | 0 | 0 | 113.4 | A340 | A340-G344 PolarHBondContact O-N 3.16Å |
| 345 | N | 87.1 | Confident | 83.2 | Confident | 15 Ų | 15 | 75.2 Ų | 75.2 | 8% | 0.08 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -91 | -16.9 | 176.7 | -67.3 | -36.4 | 0 | 0 | 0 | 113.5 | L225 N228 Y341 F342 A343 K347 Q348 L349 | L225-N345 HydrophobicContact CD2-CB 4.03Å; N228-N345 PolarHBondContact ND2-OD1 2.73Å; Y341-N345 WeakPolarHBondContact CD2-ND2 3.15Å; Y341-N345 WeakPolarHBondContact CE2-ND2 3.21Å; Y341-N345 VanDerWaalsContact O-CG 3.24Å; Y341-N345 PolarHBondContact O-N 2.98Å; Y341-N345 PolarHBondContact O-ND2 3.4Å; F342-N345 PolarHBondContact O-N 3.37Å; A343-N345 PolarHBondContact O-N 2.92Å; N345-K347 PolarHBondContact O-N 3.3Å; N345-Q348 PolarHBondContact O-N 2.96Å; N345-L349 PolarHBondContact O-N 3.43Å |
| 346 | Q | 84.5 | Confident | 81.3 | Confident | 106 Ų | 106 | 76.1 Ų | 76.1 | 50% | 0.495 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -61.2 | -44.9 | -174.1 | -178.9 | 174.9 | -6.7 | 0 | 0 | 112.9 | F342 A343 Q348 L349 E350 | F342-Q346 PolarHBondContact O-N 3.5Å; A343-Q346 WeakPolarHBondContact O-CB 3.45Å; A343-Q346 PolarHBondContact O-N 2.83Å; Q346-Q348 VanDerWaalsContact C-N 3.29Å; Q346-Q348 PolarHBondContact O-N 2.81Å; Q346-L349 WeakPolarHBondContact O-CB 3.27Å; Q346-L349 PolarHBondContact O-N 3.13Å; Q346-L349 VanDerWaalsContact O-N 3.16Å; Q346-E350 HydrophobicContact CG-CG 4.34Å; Q346-E350 WeakPolarHBondContact CG-OE1 3.15Å; Q346-E350 PolarHBondContact NE2-OE1 2.9Å; Q346-E350 WeakPolarHBondContact O-CG 3.35Å; Q346-E350 PolarHBondContact O-N 2.97Å |
| 347 | K | 75.1 | Confident | 79.3 | Confident | 147 Ų | 147 | 80.7 Ų | 80.7 | 64% | 0.639 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -60.4 | -38.7 | -177.2 | -173.8 | 179 | 178.4 | -178 | 0 | 112.5 | N345 Q351 | N345-K347 PolarHBondContact O-N 3.3Å; K347-Q351 WeakPolarHBondContact O-CG 3.18Å; K347-Q351 PolarHBondContact O-N 3.38Å |
| 348 | Q | 71.6 | Confident | 77.3 | Confident | 70 Ų | 70 | 84.1 Ų | 84.1 | 33% | 0.327 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -71.5 | -41.2 | 178 | -169.6 | 63.4 | 29.1 | 0 | 0 | 110.9 | L224 N345 Q346 E350 Q351 T352 | L224-Q348 HydrophobicContact CD2-CB 3.97Å; L224-Q348 HydrophobicContact CD2-CG 3.97Å; N345-Q348 PolarHBondContact O-N 2.96Å; Q346-Q348 VanDerWaalsContact C-N 3.29Å; Q346-Q348 PolarHBondContact O-N 2.81Å; Q348-E350 VanDerWaalsContact C-N 3.31Å; Q348-E350 PolarHBondContact O-N 2.81Å; Q348-Q351 PolarHBondContact O-N 2.59Å; Q348-T352 PolarHBondContact O-N 3.3Å; Q348-T352 PolarHBondContact O-OG1 3.18Å; Q348-T352 VanDerWaalsContact O-OG1 3.13Å |
| 349 | L | 72.7 | Confident | 74.9 | Confident | 107 Ų | 107 | 91.7 Ų | 91.7 | 56% | 0.56 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -60.8 | -41.6 | 176.8 | -174 | 64.6 | 0 | 0 | 0 | 111.7 | N345 Q346 T352 L353 | N345-L349 PolarHBondContact O-N 3.43Å; Q346-L349 WeakPolarHBondContact O-CB 3.27Å; Q346-L349 PolarHBondContact O-N 3.13Å; Q346-L349 VanDerWaalsContact O-N 3.16Å; L349-T352 PolarHBondContact O-N 3.48Å; L349-L353 HydrophobicContact CG-CD1 4.03Å; L349-L353 HydrophobicContact CG-CG 4.48Å; L349-L353 WeakPolarHBondContact O-CB 3.23Å; L349-L353 VanDerWaalsContact O-CG 3.27Å; L349-L353 WeakPolarHBondContact O-CG 3.42Å; L349-L353 PolarHBondContact O-N 3.08Å |
| 350 | E | 77.3 | Confident | 72.8 | Confident | 88 Ų | 88 | 95.5 Ų | 95.5 | 41% | 0.411 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63 | -41.4 | 176.1 | -74.3 | 173.7 | -174.7 | 0 | 0 | 112.4 | Q346 Q348 L353 Q354 | Q346-E350 HydrophobicContact CG-CG 4.34Å; Q346-E350 WeakPolarHBondContact CG-OE1 3.15Å; Q346-E350 PolarHBondContact NE2-OE1 2.9Å; Q346-E350 WeakPolarHBondContact O-CG 3.35Å; Q346-E350 PolarHBondContact O-N 2.97Å; Q348-E350 VanDerWaalsContact C-N 3.31Å; Q348-E350 PolarHBondContact O-N 2.81Å; E350-L353 PolarHBondContact O-N 3.46Å; E350-Q354 VanDerWaalsContact O-CG 3.3Å; E350-Q354 WeakPolarHBondContact O-CG 3.32Å; E350-Q354 PolarHBondContact O-N 3.28Å; E350-Q354 VanDerWaalsContact O-N 3.09Å |
| 351 | Q | 71.4 | Confident | 70.5 | Confident | 92 Ų | 92 | 100.1 Ų | 100.1 | 43% | 0.43 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.5 | -43.1 | 175.6 | -72.6 | 176.3 | -10.8 | 0 | 0 | 111.8 | K347 Q348 Q354 | K347-Q351 WeakPolarHBondContact O-CG 3.18Å; K347-Q351 PolarHBondContact O-N 3.38Å; Q348-Q351 PolarHBondContact O-N 2.59Å; Q351-Q354 PolarHBondContact O-N 2.94Å |
| 352 | T | 68.6 | Low | 68.3 | Low | 30 Ų | 30 | 103 Ų | 103 | 18% | 0.184 | 51% | 0.513 | C | S | . | . | H | α-helix | trans | -64.7 | -43.4 | 175.8 | -58.8 | 0 | 0 | 0 | 0 | 111.7 | Q348 L349 Q354 Q355 F356 | Q348-T352 PolarHBondContact O-N 3.3Å; Q348-T352 PolarHBondContact O-OG1 3.18Å; Q348-T352 VanDerWaalsContact O-OG1 3.13Å; L349-T352 PolarHBondContact O-N 3.48Å; T352-Q354 VanDerWaalsContact C-N 3.31Å; T352-Q354 PolarHBondContact O-N 3.28Å; T352-Q355 WeakPolarHBondContact O-CB 3.35Å; T352-Q355 PolarHBondContact O-N 2.87Å; T352-Q355 VanDerWaalsContact O-N 3.14Å; T352-F356 HydrophobicContact CG2-CD2 4.01Å; T352-F356 HydrophobicContact CG2-CE2 3.59Å; T352-F356 WeakPolarHBondContact O-CD2 3.44Å; T352-F356 PolarHBondContact O-N 3.4Å |
| 353 | L | 67.1 | Low | 66 | Low | 49 Ų | 49 | 103.6 Ų | 103.6 | 26% | 0.257 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65 | -32.3 | 179.8 | -75.6 | 170.4 | 0 | 0 | 0 | 113.3 | L349 E350 Q355 F356 I358 L360 | L349-L353 HydrophobicContact CG-CD1 4.03Å; L349-L353 HydrophobicContact CG-CG 4.48Å; L349-L353 WeakPolarHBondContact O-CB 3.23Å; L349-L353 VanDerWaalsContact O-CG 3.27Å; L349-L353 WeakPolarHBondContact O-CG 3.42Å; L349-L353 PolarHBondContact O-N 3.08Å; E350-L353 PolarHBondContact O-N 3.46Å; L353-Q355 VanDerWaalsContact C-N 3.27Å; L353-Q355 PolarHBondContact O-N 3.44Å; L353-F356 PolarHBondContact O-N 3.17Å; L353-I358 HydrophobicContact CD2-CD1 4.49Å; L353-L360 HydrophobicContact CD1-CD1 4Å |
| 354 | Q | 65.4 | Low | 64.3 | Low | 146 Ų | 146 | 104.3 Ų | 104.3 | 68% | 0.682 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.6 | -34.7 | 174 | -74.5 | 173 | 21.7 | 0 | 0 | 112.1 | E350 Q351 T352 F356 N357 | E350-Q354 VanDerWaalsContact O-CG 3.3Å; E350-Q354 WeakPolarHBondContact O-CG 3.32Å; E350-Q354 PolarHBondContact O-N 3.28Å; E350-Q354 VanDerWaalsContact O-N 3.09Å; Q351-Q354 PolarHBondContact O-N 2.94Å; T352-Q354 VanDerWaalsContact C-N 3.31Å; T352-Q354 PolarHBondContact O-N 3.28Å; Q354-F356 VanDerWaalsContact C-N 3.33Å; Q354-N357 PolarHBondContact O-N 2.83Å |
| 355 | Q | 62.3 | Low | 62.7 | Low | 121 Ų | 121 | 104.1 Ų | 104.1 | 57% | 0.565 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -70.3 | -29.6 | 176.8 | -66.1 | 178.3 | -33.7 | 0 | 0 | 112.6 | T352 L353 N357 | T352-Q355 WeakPolarHBondContact O-CB 3.35Å; T352-Q355 PolarHBondContact O-N 2.87Å; T352-Q355 VanDerWaalsContact O-N 3.14Å; L353-Q355 VanDerWaalsContact C-N 3.27Å; L353-Q355 PolarHBondContact O-N 3.44Å; Q355-N357 VanDerWaalsContact C-N 3.29Å; Q355-N357 PolarHBondContact O-N 3.18Å |
| 356 | F | 58.3 | Low | 60.9 | Low | 127 Ų | 127 | 111.9 Ų | 111.9 | 56% | 0.557 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.8 | -1.3 | 178.9 | -74.1 | -71.4 | 0 | 0 | 0 | 114.3 | T352 L353 Q354 I358 | T352-F356 HydrophobicContact CG2-CD2 4.01Å; T352-F356 HydrophobicContact CG2-CE2 3.59Å; T352-F356 WeakPolarHBondContact O-CD2 3.44Å; T352-F356 PolarHBondContact O-N 3.4Å; L353-F356 PolarHBondContact O-N 3.17Å; Q354-F356 VanDerWaalsContact C-N 3.33Å; F356-I358 HydrophobicContact CB-CD1 3.67Å; F356-I358 HydrophobicContact CB-CG1 3.78Å; F356-I358 HydrophobicContact CG-CD1 4.36Å; F356-I358 PolarHBondContact O-N 3.41Å |
| 357 | N | 54.5 | Low | 59.4 | Low | 155 Ų | 155 | 114.5 Ų | 114.5 | 83% | 0.829 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 51.1 | 22.1 | -173.3 | -101.4 | 13.4 | 0 | 0 | 0 | 113.9 | Q354 Q355 K359 | Q354-N357 PolarHBondContact O-N 2.83Å; Q355-N357 VanDerWaalsContact C-N 3.29Å; Q355-N357 PolarHBondContact O-N 3.18Å; N357-K359 PolarHBondContact O-N 3.11Å |
| 358 | I | 53.1 | Low | 58.3 | Low | 94 Ų | 94 | 112.7 Ų | 112.7 | 48% | 0.482 | 59% | 0.586 | S | S | . | * | trans | -80 | 92.5 | 177.4 | -60.3 | 168.7 | 0 | 0 | 0 | 106.9 | L353 F356 L360 | L353-I358 HydrophobicContact CD2-CD1 4.49Å; F356-I358 HydrophobicContact CB-CD1 3.67Å; F356-I358 HydrophobicContact CB-CG1 3.78Å; F356-I358 HydrophobicContact CG-CD1 4.36Å; F356-I358 PolarHBondContact O-N 3.41Å; I358-L360 VanDerWaalsContact C-N 3.29Å; I358-L360 HydrophobicContact CG2-CD2 4.44Å; I358-L360 HydrophobicContact CG2-CG 4.22Å; I358-L360 PolarHBondContact O-N 3.46Å | ||
| 359 | K | 47.5 | Very low | 57.6 | Low | 200 Ų | 200 | 112.7 Ų | 112.7 | 87% | 0.87 | 59% | 0.594 | S | S | * | * | trans | -66.5 | 94.2 | 161.3 | -72 | -174.3 | -179.3 | -179.7 | 0 | 107.5 | N357 R361 | N357-K359 PolarHBondContact O-N 3.11Å; K359-R361 PolarHBondContact O-N 3.06Å | ||
| 360 | L | 51.9 | Low | 56.8 | Low | 130 Ų | 130 | 118.2 Ų | 118.2 | 68% | 0.681 | 61% | 0.608 | S | S | * | * | trans | -58.2 | 108.5 | 166.9 | -79.8 | 165.2 | 0 | 0 | 0 | 107.5 | L353 I358 | L353-L360 HydrophobicContact CD1-CD1 4Å; I358-L360 VanDerWaalsContact C-N 3.29Å; I358-L360 HydrophobicContact CG2-CD2 4.44Å; I358-L360 HydrophobicContact CG2-CG 4.22Å; I358-L360 PolarHBondContact O-N 3.46Å | ||
| 361 | R | 44.4 | Very low | 55.7 | Low | 159 Ų | 159 | 120.4 Ų | 120.4 | 60% | 0.6 | 62% | 0.621 | S | S | * | * | trans | -67.3 | 123.8 | 178.2 | -162.1 | 179.5 | -146.5 | -156.9 | -2.9 | 107.4 | K359 A365 | K359-R361 PolarHBondContact O-N 3.06Å; R361-A365 HydrophobicContact CG-CB 3.84Å; R361-A365 PolarHBondContact NE-O 3.37Å; R361-A365 PolarHBondContact NH1-O 3.09Å; R361-A365 PolarHBondContact NH2-O 3.47Å | ||
| 362 | P | 49.3 | Very low | 54.9 | Low | 91 Ų | 91 | 123.8 Ų | 123.8 | 59% | 0.591 | 64% | 0.637 | S | S | * | * | trans | -61.9 | 145.8 | 178.7 | 23.3 | -30.5 | 0 | 0 | 0 | 109.9 | G364 A365 | P362-G364 PolarHBondContact O-N 3Å; P362-A365 HydrophobicContact CG-CB 4.42Å; P362-A365 PolarHBondContact O-N 3.47Å | ||
| 363 | P | 45.3 | Very low | 53.8 | Low | 143 Ų | 143 | 130.9 Ų | 130.9 | 93% | 0.929 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.1 | 110.6 | 174.6 | -11.9 | 25.3 | 0 | 0 | 0 | 108.3 | ||
| 364 | G | 55.6 | Low | 52.4 | Low | 75 Ų | 75 | 140.5 Ų | 140.5 | 77% | 0.773 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 124.7 | -5.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | P362 E366 | P362-G364 PolarHBondContact O-N 3Å; G364-E366 PolarHBondContact O-N 3.26Å |
| 365 | A | 53.7 | Low | 51.7 | Low | 41 Ų | 41 | 140.3 Ų | 140.3 | 34% | 0.339 | 71% | 0.713 | S | S | . | * | trans | -80.2 | 70.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | R361 P362 | R361-A365 HydrophobicContact CG-CB 3.84Å; R361-A365 PolarHBondContact NE-O 3.37Å; R361-A365 PolarHBondContact NH1-O 3.09Å; R361-A365 PolarHBondContact NH2-O 3.47Å; P362-A365 HydrophobicContact CG-CB 4.42Å; P362-A365 PolarHBondContact O-N 3.47Å | ||
| 366 | E | 49.6 | Very low | 51.2 | Low | 179 Ų | 179 | 141.3 Ų | 141.3 | 84% | 0.836 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 145.1 | 162.7 | -69.9 | -158 | 152.6 | 0 | 0 | 109.9 | G364 | G364-E366 PolarHBondContact O-N 3.26Š|
| 367 | K | 53.6 | Low | 50.8 | Low | 160 Ų | 160 | 142.1 Ų | 142.1 | 70% | 0.696 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 144.3 | 171.6 | -70.2 | 177.6 | 175.5 | 179 | 0 | 107.8 | S369 | K367-S369 PolarHBondContact O-N 3.07Š|
| 368 | P | 51.2 | Low | 50.6 | Low | 110 Ų | 110 | 141.3 Ų | 141.3 | 71% | 0.714 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 129.5 | 172.6 | 23.5 | -30.5 | 0 | 0 | 0 | 108.6 | ||
| 369 | S | 57.6 | Low | 50.4 | Low | 70 Ų | 70 | 144.3 Ų | 144.3 | 49% | 0.49 | 74% | 0.74 | S | S | . | * | P | Polyproline II helix | trans | -63.9 | 134.6 | 175.5 | -179.6 | 0 | 0 | 0 | 0 | 108 | K367 L371 E372 | K367-S369 PolarHBondContact O-N 3.07Å; S369-L371 PolarHBondContact O-N 3.42Å; S369-E372 PolarHBondContact O-N 3.01Å |
| 370 | W | 55.6 | Low | 50.6 | Low | 223 Ų | 223 | 140.5 Ų | 140.5 | 85% | 0.845 | 73% | 0.731 | S | S | * | * | G | 310 helix | trans | -58.8 | -4.4 | -179.9 | 90.4 | -46.9 | 0 | 0 | 0 | 114.6 | ||
| 371 | L | 53.6 | Low | 50.5 | Low | 133 Ų | 133 | 141.3 Ų | 141.3 | 70% | 0.696 | 74% | 0.735 | S | S | * | * | G | 310 helix | trans | -85.4 | -3.9 | 179.6 | -87.7 | 151.8 | 0 | 0 | 0 | 114.2 | S369 | S369-L371 PolarHBondContact O-N 3.42Š|
| 372 | E | 55.3 | Low | 51 | Low | 164 Ų | 164 | 139.9 Ų | 139.9 | 77% | 0.766 | 75% | 0.745 | S | S | * | * | G | 310 helix | trans | -92.4 | 1.4 | 176 | -69.7 | -178 | 163.3 | 0 | 0 | 113.7 | S369 | S369-E372 PolarHBondContact O-N 3.01Š|
| 373 | E | 44.9 | Very low | 51.1 | Low | 178 Ų | 178 | 144 Ų | 144 | 83% | 0.832 | 76% | 0.758 | S | S | * | * | trans | -109.5 | 28.7 | -175.1 | -108.8 | 179.3 | -171.9 | 0 | 0 | 114.8 | ||||
| 374 | Q | 37.8 | Very low | 51.7 | Low | 252 Ų | 252 | 144.1 Ų | 144.1 | 100% | 1.178 | 74% | 0.742 | S | S | * | * | trans | -122.9 | 0 | 173.3 | -75.6 | -76.6 | -43.4 | 0 | 0 | 112.7 |
Retrieved 374 of 374 residues in 184.9 ms
(Link to these results)