| 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 | 37.8 | Very low | 37.9 | Very low | 252 Ų | 252 | 156.2 Ų | 156.2 | 100% | 1.241 | 90% | 0.897 | S | S | * | * | 0 | 153.4 | 0 | -79.4 | -163.7 | -177.6 | 0 | 0 | 108.9 | |||||
| 2 | A | 39.5 | Very low | 37.9 | Very low | 106 Ų | 106 | 152.8 Ų | 152.8 | 88% | 0.876 | 89% | 0.889 | S | S | * | * | trans | -59.4 | 149.4 | -159.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 3 | G | 36.2 | Very low | 38.4 | Very low | 82 Ų | 82 | 151.1 Ų | 151.1 | 85% | 0.845 | 88% | 0.882 | S | S | * | * | trans | -157.8 | 75.7 | 163.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 4 | R | 38.4 | Very low | 38.9 | Very low | 247 Ų | 247 | 149.1 Ų | 149.1 | 93% | 0.932 | 88% | 0.876 | S | S | * | * | trans | -81.3 | 130.9 | 168.4 | -77.7 | -179.3 | 175 | -150.7 | -1.3 | 108.5 | ||||
| 5 | S | 37.4 | Very low | 39.5 | Very low | 115 Ų | 115 | 143.9 Ų | 143.9 | 80% | 0.804 | 87% | 0.866 | S | S | * | * | trans | -137.3 | 98 | 153.4 | 75.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 6 | L | 40.5 | Very low | 39.9 | Very low | 169 Ų | 169 | 143.4 Ų | 143.4 | 89% | 0.885 | 86% | 0.864 | S | S | * | * | trans | 35.3 | 107.2 | 135.1 | -59.6 | 167.7 | 0 | 0 | 0 | 117.8 | ||||
| 7 | G | 32.6 | Very low | 40.3 | Very low | 78 Ų | 78 | 142.4 Ų | 142.4 | 80% | 0.804 | 86% | 0.862 | S | S | * | * | trans | -69.1 | 139.5 | 162.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 8 | L | 40.4 | Very low | 41 | Very low | 177 Ų | 177 | 143.5 Ų | 143.5 | 93% | 0.927 | 86% | 0.861 | S | S | * | * | trans | -104.7 | 111.5 | 160.6 | -83 | 162.5 | 0 | 0 | 0 | 107.6 | R10 | L8-R10 PolarHBondContact O-N 3.01Š| ||
| 9 | T | 34.5 | Very low | 41.7 | Very low | 142 Ų | 142 | 141.7 Ų | 141.7 | 87% | 0.871 | 85% | 0.853 | S | S | * | * | trans | -66.5 | 118.7 | 166.8 | 31.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 10 | R | 40.2 | Very low | 42.3 | Very low | 239 Ų | 239 | 140.4 Ų | 140.4 | 90% | 0.902 | 85% | 0.848 | S | S | * | * | trans | -117.8 | 115.6 | 153.9 | -98.9 | -172.5 | 171.2 | -146.9 | -1 | 108.6 | L8 | L8-R10 PolarHBondContact O-N 3.01Š| ||
| 11 | S | 39.7 | Very low | 42.5 | Very low | 111 Ų | 111 | 139.4 Ų | 139.4 | 78% | 0.776 | 85% | 0.845 | S | S | * | * | trans | -51.2 | 134 | 169.9 | 175 | 0 | 0 | 0 | 0 | 111 | ||||
| 12 | S | 37.4 | Very low | 43 | Very low | 115 Ų | 115 | 134.3 Ų | 134.3 | 80% | 0.804 | 83% | 0.828 | S | S | * | * | trans | -140.7 | 117 | 166.1 | -63.9 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 13 | V | 44.5 | Very low | 43.2 | Very low | 131 Ų | 131 | 137.5 Ų | 137.5 | 79% | 0.794 | 82% | 0.824 | S | S | * | * | trans | -72.5 | 150.8 | 177.2 | 170.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 14 | P | 45.4 | Very low | 43.9 | Very low | 123 Ų | 123 | 141.7 Ų | 141.7 | 80% | 0.799 | 82% | 0.822 | S | S | * | * | trans | -94 | 152.1 | -156.3 | 35.1 | -29.6 | 0 | 0 | 0 | 113.4 | ||||
| 15 | G | 47.8 | Very low | 44.1 | Very low | 71 Ų | 71 | 136.1 Ų | 136.1 | 73% | 0.732 | 82% | 0.818 | S | S | * | * | trans | 124.8 | 75.8 | 156.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 16 | T | 45.5 | Very low | 44.5 | Very low | 136 Ų | 136 | 135.1 Ų | 135.1 | 83% | 0.834 | 81% | 0.81 | S | S | * | * | trans | -162.1 | 126.9 | 144.1 | -15.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 17 | P | 47.8 | Very low | 45.3 | Very low | 127 Ų | 127 | 132.9 Ų | 132.9 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 128 | 177.6 | -7.6 | 24.1 | 0 | 0 | 0 | 110.7 | ||
| 18 | L | 51.8 | Low | 46.4 | Very low | 162 Ų | 162 | 132.5 Ų | 132.5 | 85% | 0.848 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 143.9 | 168.2 | -72.2 | 165.1 | 0 | 0 | 0 | 110.3 | ||
| 19 | P | 54.4 | Low | 47.5 | Very low | 110 Ų | 110 | 125.5 Ų | 125.5 | 71% | 0.714 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 149.2 | 177.4 | 29.4 | -32.6 | 0 | 0 | 0 | 111.1 | ||
| 20 | P | 53.5 | Low | 49 | Very low | 115 Ų | 115 | 124.5 Ų | 124.5 | 75% | 0.747 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 152.8 | -178.3 | 29.8 | -32.7 | 0 | 0 | 0 | 111.2 | ||
| 21 | P | 46.9 | Very low | 50.6 | Low | 120 Ų | 120 | 119.8 Ų | 119.8 | 78% | 0.779 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 138.2 | 175.9 | -7.6 | 23 | 0 | 0 | 0 | 110.4 | Q23 | P21-Q23 PolarHBondContact O-N 3.09Å; P21-Q23 VanDerWaalsContact O-N 3.08Å |
| 22 | V | 49.5 | Very low | 52.6 | Low | 145 Ų | 145 | 119.9 Ų | 119.9 | 88% | 0.879 | 74% | 0.738 | S | S | * | * | trans | -56.1 | 110.4 | 170.9 | 177.8 | 0 | 0 | 0 | 0 | 109.1 | Q24 | V22-Q24 PolarHBondContact O-N 3.45Š| ||
| 23 | Q | 43.2 | Very low | 54.9 | Low | 173 Ų | 173 | 118 Ų | 118 | 81% | 0.808 | 72% | 0.719 | S | S | * | * | trans | -72.6 | 118.3 | 171.9 | -74.7 | 179.8 | 0.2 | 0 | 0 | 109.1 | P21 | P21-Q23 PolarHBondContact O-N 3.09Å; P21-Q23 VanDerWaalsContact O-N 3.08Å | ||
| 24 | Q | 50.6 | Low | 56.9 | Low | 169 Ų | 169 | 114.2 Ų | 114.2 | 79% | 0.79 | 70% | 0.701 | S | S | * | * | trans | -58.4 | 153.4 | 157.5 | -73.6 | -176.5 | -12.5 | 0 | 0 | 109.5 | V22 S26 | V22-Q24 PolarHBondContact O-N 3.45Å; Q24-S26 PolarHBondContact O-N 3.23Å | ||
| 25 | P | 43.1 | Very low | 59 | Low | 131 Ų | 131 | 113.6 Ų | 113.6 | 85% | 0.851 | 69% | 0.691 | S | S | * | * | trans | -56.2 | 109.9 | -176.6 | 23 | -33.4 | 0 | 0 | 0 | 109.7 | T27 | P25-T27 PolarHBondContact O-N 2.85Š| ||
| 26 | S | 45.7 | Very low | 61 | Low | 93 Ų | 93 | 114.7 Ų | 114.7 | 65% | 0.65 | 68% | 0.677 | S | S | * | * | trans | -59.6 | 126.1 | 174.6 | 31.8 | 0 | 0 | 0 | 0 | 108.2 | Q24 | Q24-S26 PolarHBondContact O-N 3.23Š| ||
| 27 | T | 57.8 | Low | 63.3 | Low | 123 Ų | 123 | 113.8 Ų | 113.8 | 76% | 0.755 | 66% | 0.663 | S | S | * | * | trans | -43.3 | 130.9 | 160.2 | 36.7 | 0 | 0 | 0 | 0 | 108.3 | P25 G29 | P25-T27 PolarHBondContact O-N 2.85Å; T27-G29 PolarHBondContact O-N 3.07Å; T27-G29 VanDerWaalsContact O-N 3.15Å | ||
| 28 | P | 54.4 | Low | 65.4 | Low | 69 Ų | 69 | 113.4 Ų | 113.4 | 45% | 0.448 | 65% | 0.65 | S | S | . | * | trans | -51.3 | 129.3 | 179.3 | -19 | 28.2 | 0 | 0 | 0 | 107.8 | L32 L33 | P28-L32 HydrophobicContact CB-CB 4.05Å; P28-L33 HydrophobicContact CB-CD2 3.94Å; P28-L33 HydrophobicContact CB-CG 4.03Å; P28-L33 HydrophobicContact CG-CD2 4.04Å | ||
| 29 | G | 63 | Low | 67.4 | Low | 31 Ų | 31 | 113.4 Ų | 113.4 | 32% | 0.32 | 64% | 0.64 | S | S | . | * | trans | -51.5 | 149.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | T27 D31 L32 L33 | T27-G29 PolarHBondContact O-N 3.07Å; T27-G29 VanDerWaalsContact O-N 3.15Å; G29-D31 PolarHBondContact O-N 3.33Å; G29-L32 WeakPolarHBondContact O-CB 3.42Å; G29-L32 PolarHBondContact O-N 2.93Å; G29-L33 PolarHBondContact O-N 3.01Å | ||
| 30 | P | 67.2 | Low | 69.4 | Low | 121 Ų | 121 | 113.9 Ų | 113.9 | 79% | 0.786 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -48 | -30.1 | -179.1 | -27.3 | 32.8 | 0 | 0 | 0 | 113.8 | A34 | P30-A34 PolarHBondContact O-N 3.19Å |
| 31 | D | 74.6 | Confident | 71.4 | Confident | 140 Ų | 140 | 116.6 Ų | 116.6 | 75% | 0.749 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -72.6 | -36.4 | 178.1 | -158.4 | 32.6 | 0 | 0 | 0 | 114 | G29 A34 L35 | G29-D31 PolarHBondContact O-N 3.33Å; D31-A34 PolarHBondContact O-N 3.03Å; D31-L35 WeakPolarHBondContact O-CB 3.4Å; D31-L35 PolarHBondContact O-N 3.47Å |
| 32 | L | 80.2 | Confident | 73.8 | Confident | 112 Ų | 112 | 115.5 Ų | 115.5 | 59% | 0.586 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -70.3 | -37.4 | 176.1 | -93.2 | 151.1 | 0 | 0 | 0 | 112 | P28 G29 L35 E36 | P28-L32 HydrophobicContact CB-CB 4.05Å; G29-L32 WeakPolarHBondContact O-CB 3.42Å; G29-L32 PolarHBondContact O-N 2.93Å; L32-L35 PolarHBondContact O-N 2.89Å; L32-E36 WeakPolarHBondContact O-CB 3.43Å; L32-E36 PolarHBondContact O-N 2.86Å |
| 33 | L | 85.3 | Confident | 75.9 | Confident | 76 Ų | 76 | 111.8 Ų | 111.8 | 40% | 0.398 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -67.5 | -41.4 | 175.4 | -66.5 | 175.7 | 0 | 0 | 0 | 111.4 | P28 G29 L35 E36 E37 | P28-L33 HydrophobicContact CB-CD2 3.94Å; P28-L33 HydrophobicContact CB-CG 4.03Å; P28-L33 HydrophobicContact CG-CD2 4.04Å; G29-L33 PolarHBondContact O-N 3.01Å; L33-L35 VanDerWaalsContact C-N 3.34Å; L33-L35 PolarHBondContact O-N 3.46Å; L33-E36 PolarHBondContact O-N 3.45Å; L33-E37 WeakPolarHBondContact O-CG 3.47Å; L33-E37 PolarHBondContact O-N 3.15Å |
| 34 | A | 87.4 | Confident | 78.5 | Confident | 52 Ų | 52 | 106.2 Ų | 106.2 | 43% | 0.43 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -61.4 | -42.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | P30 D31 E37 E38 | P30-A34 PolarHBondContact O-N 3.19Å; D31-A34 PolarHBondContact O-N 3.03Å; A34-E37 PolarHBondContact O-N 2.92Å; A34-E38 PolarHBondContact O-N 3.44Å |
| 35 | L | 90.1 | Very high | 80.6 | Confident | 110 Ų | 110 | 102.8 Ų | 102.8 | 58% | 0.576 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -65.5 | -37.8 | 176.2 | -169.3 | 67.7 | 0 | 0 | 0 | 112.3 | D31 L32 L33 E38 Y39 | D31-L35 WeakPolarHBondContact O-CB 3.4Å; D31-L35 PolarHBondContact O-N 3.47Å; L32-L35 PolarHBondContact O-N 2.89Å; L33-L35 VanDerWaalsContact C-N 3.34Å; L33-L35 PolarHBondContact O-N 3.46Å; L35-E38 PolarHBondContact O-N 3.37Å; L35-Y39 WeakPolarHBondContact O-CB 3.43Å; L35-Y39 PolarHBondContact O-N 2.86Å |
| 36 | E | 89.9 | Confident | 83.1 | Confident | 93 Ų | 93 | 101.1 Ų | 101.1 | 44% | 0.435 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64.5 | -41.5 | 174.8 | -169.4 | -170 | 161.7 | 0 | 0 | 111.8 | L32 L33 Y39 K40 | L32-E36 WeakPolarHBondContact O-CB 3.43Å; L32-E36 PolarHBondContact O-N 2.86Å; L33-E36 PolarHBondContact O-N 3.45Å; E36-Y39 PolarHBondContact O-N 2.88Å; E36-K40 WeakPolarHBondContact O-CB 3.35Å; E36-K40 WeakPolarHBondContact O-CG 3.46Å; E36-K40 PolarHBondContact O-N 3.29Å; E36-K40 WeakPolarHBondContact OE1-CE 3.41Å; E36-K40 IonicContact OE1-NZ 2.86Å; E36-K40 PolarHBondContact OE1-NZ 3.48Å |
| 37 | E | 92.4 | Very high | 85.5 | Confident | 118 Ų | 118 | 102.5 Ų | 102.5 | 55% | 0.551 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65.6 | -39.6 | 175.8 | -74.5 | -175.4 | 177.1 | 0 | 0 | 112.5 | L33 A34 K40 R41 | L33-E37 WeakPolarHBondContact O-CG 3.47Å; L33-E37 PolarHBondContact O-N 3.15Å; A34-E37 PolarHBondContact O-N 2.92Å; E37-K40 PolarHBondContact O-N 3Å; E37-R41 PolarHBondContact O-N 3.45Å |
| 38 | E | 92.4 | Very high | 87.3 | Confident | 118 Ų | 118 | 99.2 Ų | 99.2 | 55% | 0.551 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.2 | -43.3 | 174.8 | -169.6 | 177.2 | -170 | 0 | 0 | 111.2 | A34 L35 K40 R41 L42 | A34-E38 PolarHBondContact O-N 3.44Å; L35-E38 PolarHBondContact O-N 3.37Å; E38-K40 VanDerWaalsContact C-N 3.33Å; E38-K40 PolarHBondContact O-N 3.46Å; E38-R41 PolarHBondContact O-N 2.76Å; E38-R41 VanDerWaalsContact O-N 3.16Å; E38-L42 WeakPolarHBondContact O-CB 3.35Å; E38-L42 PolarHBondContact O-N 3.29Å |
| 39 | Y | 95 | Very high | 89.3 | Confident | 163 Ų | 163 | 101.6 Ų | 101.6 | 64% | 0.639 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.1 | -41.7 | 175.1 | -171.2 | -94.7 | 0 | 0 | 0 | 111.8 | L35 E36 L42 N43 | L35-Y39 WeakPolarHBondContact O-CB 3.43Å; L35-Y39 PolarHBondContact O-N 2.86Å; E36-Y39 PolarHBondContact O-N 2.88Å; Y39-L42 PolarHBondContact O-N 2.93Å; Y39-N43 VanDerWaalsContact O-CB 3.27Å; Y39-N43 WeakPolarHBondContact O-CB 3.35Å; Y39-N43 PolarHBondContact O-N 3.23Å |
| 40 | K | 95.3 | Very high | 90.9 | Very high | 120 Ų | 120 | 104 Ų | 104 | 52% | 0.522 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.5 | -42.8 | 174 | -76.9 | 172.8 | -175.3 | 164.1 | 0 | 111.8 | E36 E37 E38 N43 A44 | E36-K40 WeakPolarHBondContact O-CB 3.35Å; E36-K40 WeakPolarHBondContact O-CG 3.46Å; E36-K40 PolarHBondContact O-N 3.29Å; E36-K40 WeakPolarHBondContact OE1-CE 3.41Å; E36-K40 IonicContact OE1-NZ 2.86Å; E36-K40 PolarHBondContact OE1-NZ 3.48Å; E37-K40 PolarHBondContact O-N 3Å; E38-K40 VanDerWaalsContact C-N 3.33Å; E38-K40 PolarHBondContact O-N 3.46Å; K40-N43 PolarHBondContact O-N 3.38Å; K40-A44 WeakPolarHBondContact O-CB 3.34Å; K40-A44 PolarHBondContact O-N 3.45Å |
| 41 | R | 96.1 | Very high | 92.3 | Very high | 171 Ų | 171 | 101.1 Ų | 101.1 | 65% | 0.645 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.6 | -47.6 | 175.5 | -91.2 | -169.2 | -96.4 | 141.4 | -7 | 112 | E37 E38 N43 A44 E45 | E37-R41 PolarHBondContact O-N 3.45Å; E38-R41 PolarHBondContact O-N 2.76Å; E38-R41 VanDerWaalsContact O-N 3.16Å; R41-N43 VanDerWaalsContact C-N 3.31Å; R41-N43 PolarHBondContact O-N 2.9Å; R41-A44 PolarHBondContact O-N 3.34Å; R41-E45 PolarHBondContact O-N 3.5Å |
| 42 | L | 95.9 | Very high | 93.3 | Very high | 97 Ų | 97 | 97.7 Ų | 97.7 | 51% | 0.508 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.4 | -38.9 | 179.7 | -172.6 | 63.9 | 0 | 0 | 0 | 111.7 | E38 Y39 E45 L46 | E38-L42 WeakPolarHBondContact O-CB 3.35Å; E38-L42 PolarHBondContact O-N 3.29Å; Y39-L42 PolarHBondContact O-N 2.93Å; L42-E45 PolarHBondContact O-N 2.93Å; L42-L46 WeakPolarHBondContact O-CB 3.45Å; L42-L46 PolarHBondContact O-N 3.44Å |
| 43 | N | 95.1 | Very high | 94.1 | Very high | 68 Ų | 68 | 96.9 Ų | 96.9 | 36% | 0.364 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -67.9 | -39.2 | 176.5 | -161.3 | 13.9 | 0 | 0 | 0 | 111.8 | Y39 K40 R41 L46 Q47 | Y39-N43 VanDerWaalsContact O-CB 3.27Å; Y39-N43 WeakPolarHBondContact O-CB 3.35Å; Y39-N43 PolarHBondContact O-N 3.23Å; K40-N43 PolarHBondContact O-N 3.38Å; R41-N43 VanDerWaalsContact C-N 3.31Å; R41-N43 PolarHBondContact O-N 2.9Å; N43-L46 PolarHBondContact O-N 3.47Å; N43-Q47 VanDerWaalsContact O-CG 3.31Å; N43-Q47 WeakPolarHBondContact O-CG 3.28Å; N43-Q47 PolarHBondContact O-N 3.42Å |
| 44 | A | 96.5 | Very high | 94.6 | Very high | 55 Ų | 55 | 96.5 Ų | 96.5 | 46% | 0.455 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.1 | -40.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | K40 R41 Q47 A48 | K40-A44 WeakPolarHBondContact O-CB 3.34Å; K40-A44 PolarHBondContact O-N 3.45Å; R41-A44 PolarHBondContact O-N 3.34Å; A44-Q47 PolarHBondContact O-N 3.39Å; A44-A48 PolarHBondContact O-N 3.5Å |
| 45 | E | 96 | Very high | 95.1 | Very high | 98 Ų | 98 | 101.2 Ų | 101.2 | 46% | 0.458 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.9 | -41.9 | 175.3 | -168.3 | -171.8 | 151.5 | 0 | 0 | 112 | R41 L42 Q47 A48 K49 | R41-E45 PolarHBondContact O-N 3.5Å; L42-E45 PolarHBondContact O-N 2.93Å; E45-Q47 VanDerWaalsContact C-N 3.33Å; E45-Q47 PolarHBondContact O-N 2.84Å; E45-A48 PolarHBondContact O-N 3.41Å; E45-K49 HydrophobicContact CG-CD 4.45Å; E45-K49 WeakPolarHBondContact O-CG 3.32Å; E45-K49 PolarHBondContact O-N 2.88Å; E45-K49 WeakPolarHBondContact OE1-CE 3.49Å; E45-K49 IonicContact OE1-NZ 2.68Å; E45-K49 PolarHBondContact OE1-NZ 3.34Å |
| 46 | L | 95.6 | Very high | 95.3 | Very high | 96 Ų | 96 | 101.5 Ų | 101.5 | 50% | 0.503 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.2 | -42.7 | 173.8 | -95.1 | 165 | 0 | 0 | 0 | 111.9 | L42 N43 K49 T50 | L42-L46 WeakPolarHBondContact O-CB 3.45Å; L42-L46 PolarHBondContact O-N 3.44Å; N43-L46 PolarHBondContact O-N 3.47Å; L46-K49 PolarHBondContact O-N 2.87Å; L46-T50 WeakPolarHBondContact O-CB 3.44Å; L46-T50 PolarHBondContact O-N 2.94Å; L46-T50 PolarHBondContact O-OG1 3.25Å |
| 47 | Q | 94.8 | Very high | 95.5 | Very high | 122 Ų | 122 | 99.3 Ų | 99.3 | 57% | 0.57 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65 | -41.7 | 176 | -73.3 | 177 | 16.5 | 0 | 0 | 111.8 | N43 A44 E45 T50 A51 | N43-Q47 VanDerWaalsContact O-CG 3.31Å; N43-Q47 WeakPolarHBondContact O-CG 3.28Å; N43-Q47 PolarHBondContact O-N 3.42Å; A44-Q47 PolarHBondContact O-N 3.39Å; E45-Q47 VanDerWaalsContact C-N 3.33Å; E45-Q47 PolarHBondContact O-N 2.84Å; Q47-T50 PolarHBondContact O-N 2.86Å; Q47-A51 WeakPolarHBondContact O-CB 3.44Å; Q47-A51 PolarHBondContact O-N 2.86Å |
| 48 | A | 96.6 | Very high | 95.5 | Very high | 53 Ų | 53 | 100.1 Ų | 100.1 | 44% | 0.438 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.9 | -47.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | A44 E45 T50 A51 D52 | A44-A48 PolarHBondContact O-N 3.5Å; E45-A48 PolarHBondContact O-N 3.41Å; A48-T50 VanDerWaalsContact C-N 3.31Å; A48-T50 PolarHBondContact O-N 3.23Å; A48-A51 WeakPolarHBondContact O-CB 3.22Å; A48-A51 PolarHBondContact O-N 3.3Å; A48-D52 PolarHBondContact O-N 2.91Å |
| 49 | K | 96.4 | Very high | 95.6 | Very high | 119 Ų | 119 | 98.6 Ų | 98.6 | 52% | 0.517 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.8 | -40.5 | 175.6 | -76.9 | 173.8 | 170.4 | 164.8 | 0 | 112.1 | E45 L46 D52 V53 | E45-K49 HydrophobicContact CG-CD 4.45Å; E45-K49 WeakPolarHBondContact O-CG 3.32Å; E45-K49 PolarHBondContact O-N 2.88Å; E45-K49 WeakPolarHBondContact OE1-CE 3.49Å; E45-K49 IonicContact OE1-NZ 2.68Å; E45-K49 PolarHBondContact OE1-NZ 3.34Å; L46-K49 PolarHBondContact O-N 2.87Å; K49-D52 PolarHBondContact O-N 3.28Å; K49-V53 WeakPolarHBondContact O-CG2 3.46Å; K49-V53 PolarHBondContact O-N 3.08Å |
| 50 | T | 96.4 | Very high | 95.6 | Very high | 83 Ų | 83 | 96.3 Ų | 96.3 | 51% | 0.509 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.8 | -43.4 | 175.9 | -57.8 | 0 | 0 | 0 | 0 | 111 | L46 Q47 A48 D52 V53 V54 | L46-T50 WeakPolarHBondContact O-CB 3.44Å; L46-T50 PolarHBondContact O-N 2.94Å; L46-T50 PolarHBondContact O-OG1 3.25Å; Q47-T50 PolarHBondContact O-N 2.86Å; A48-T50 VanDerWaalsContact C-N 3.31Å; A48-T50 PolarHBondContact O-N 3.23Å; T50-D52 VanDerWaalsContact C-N 3.31Å; T50-D52 PolarHBondContact O-N 2.91Å; T50-V53 PolarHBondContact O-N 3.4Å; T50-V54 WeakPolarHBondContact O-CB 3.4Å; T50-V54 VanDerWaalsContact O-CG2 3.26Å; T50-V54 WeakPolarHBondContact O-CG2 3.24Å; T50-V54 PolarHBondContact O-N 2.92Å |
| 51 | A | 95.8 | Very high | 95.5 | Very high | 59 Ų | 59 | 95.7 Ų | 95.7 | 49% | 0.488 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62 | -38.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q47 A48 V54 R55 | Q47-A51 WeakPolarHBondContact O-CB 3.44Å; Q47-A51 PolarHBondContact O-N 2.86Å; A48-A51 WeakPolarHBondContact O-CB 3.22Å; A48-A51 PolarHBondContact O-N 3.3Å; A51-V54 PolarHBondContact O-N 2.65Å; A51-R55 VanDerWaalsContact O-CB 3.31Å; A51-R55 WeakPolarHBondContact O-CB 3.39Å; A51-R55 PolarHBondContact O-N 2.88Å |
| 52 | D | 96.9 | Very high | 95.3 | Very high | 68 Ų | 68 | 93.6 Ų | 93.6 | 36% | 0.364 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.4 | -45.2 | 177.1 | -79.6 | -15.6 | 0 | 0 | 0 | 113 | A48 K49 T50 V54 R55 Q56 | A48-D52 PolarHBondContact O-N 2.91Å; K49-D52 PolarHBondContact O-N 3.28Å; T50-D52 VanDerWaalsContact C-N 3.31Å; T50-D52 PolarHBondContact O-N 2.91Å; D52-V54 VanDerWaalsContact C-N 3.32Å; D52-V54 PolarHBondContact O-N 2.91Å; D52-R55 WeakPolarHBondContact O-CB 3.47Å; D52-R55 PolarHBondContact O-N 3.08Å; D52-R55 IonicContact OD1-CZ 2.67Å; D52-R55 IonicContact OD1-NE 3.92Å; D52-R55 IonicContact OD1-NH2 3.47Å; D52-R55 PolarHBondContact OD1-NH2 3.37Å; D52-R55 IonicContact OD2-NH2 3.27Å; D52-Q56 WeakPolarHBondContact O-CG 3.34Å; D52-Q56 PolarHBondContact O-N 3.47Å |
| 53 | V | 96.3 | Very high | 95.1 | Very high | 95 Ų | 95 | 92.8 Ų | 92.8 | 58% | 0.576 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -62 | -42.7 | 175.3 | 173.2 | 0 | 0 | 0 | 0 | 110.7 | K49 T50 R55 Q56 A57 | K49-V53 WeakPolarHBondContact O-CG2 3.46Å; K49-V53 PolarHBondContact O-N 3.08Å; T50-V53 PolarHBondContact O-N 3.4Å; V53-R55 VanDerWaalsContact C-N 3.32Å; V53-R55 PolarHBondContact O-N 3.26Å; V53-Q56 PolarHBondContact O-N 2.94Å; V53-A57 WeakPolarHBondContact O-CB 3.5Å; V53-A57 PolarHBondContact O-N 3.22Å |
| 54 | V | 96.4 | Very high | 94.8 | Very high | 69 Ų | 69 | 99.1 Ų | 99.1 | 42% | 0.418 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.8 | -38.4 | 176.2 | 169.9 | 0 | 0 | 0 | 0 | 111.4 | T50 A51 D52 A57 K58 | T50-V54 WeakPolarHBondContact O-CB 3.4Å; T50-V54 VanDerWaalsContact O-CG2 3.26Å; T50-V54 WeakPolarHBondContact O-CG2 3.24Å; T50-V54 PolarHBondContact O-N 2.92Å; A51-V54 PolarHBondContact O-N 2.65Å; D52-V54 VanDerWaalsContact C-N 3.32Å; D52-V54 PolarHBondContact O-N 2.91Å; V54-A57 PolarHBondContact O-N 2.65Å; V54-K58 HydrophobicContact CG1-CD 4.29Å; V54-K58 WeakPolarHBondContact O-CG 3.41Å; V54-K58 PolarHBondContact O-N 2.88Å |
| 55 | R | 96.7 | Very high | 94.3 | Very high | 151 Ų | 151 | 102.6 Ų | 102.6 | 57% | 0.57 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.1 | -46.8 | 175.9 | 177.3 | 173.5 | 55.3 | 131.8 | -3 | 111.5 | A51 D52 V53 A57 K58 E59 | A51-R55 VanDerWaalsContact O-CB 3.31Å; A51-R55 WeakPolarHBondContact O-CB 3.39Å; A51-R55 PolarHBondContact O-N 2.88Å; D52-R55 WeakPolarHBondContact O-CB 3.47Å; D52-R55 PolarHBondContact O-N 3.08Å; D52-R55 IonicContact OD1-CZ 2.67Å; D52-R55 IonicContact OD1-NE 3.92Å; D52-R55 IonicContact OD1-NH2 3.47Å; D52-R55 PolarHBondContact OD1-NH2 3.37Å; D52-R55 IonicContact OD2-NH2 3.27Å; V53-R55 VanDerWaalsContact C-N 3.32Å; V53-R55 PolarHBondContact O-N 3.26Å; R55-A57 VanDerWaalsContact C-N 3.33Å; R55-A57 PolarHBondContact O-N 2.92Å; R55-K58 PolarHBondContact O-N 3.24Å; R55-E59 PolarHBondContact O-N 3.4Å |
| 56 | Q | 95.6 | Very high | 93.8 | Very high | 115 Ų | 115 | 102.8 Ų | 102.8 | 54% | 0.537 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.7 | -42.6 | 175.5 | -71.2 | 178.1 | 27.3 | 0 | 0 | 111.6 | D52 V53 K58 E59 I60 | D52-Q56 WeakPolarHBondContact O-CG 3.34Å; D52-Q56 PolarHBondContact O-N 3.47Å; V53-Q56 PolarHBondContact O-N 2.94Å; Q56-K58 VanDerWaalsContact C-N 3.34Å; Q56-K58 PolarHBondContact O-N 2.86Å; Q56-E59 PolarHBondContact O-N 3.31Å; Q56-I60 WeakPolarHBondContact O-CG1 3.39Å; Q56-I60 PolarHBondContact O-N 2.92Å |
| 57 | A | 92.9 | Very high | 93.1 | Very high | 47 Ų | 47 | 103.8 Ų | 103.8 | 39% | 0.388 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.5 | -42.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | V53 V54 R55 E59 I60 I61 | V53-A57 WeakPolarHBondContact O-CB 3.5Å; V53-A57 PolarHBondContact O-N 3.22Å; V54-A57 PolarHBondContact O-N 2.65Å; R55-A57 VanDerWaalsContact C-N 3.33Å; R55-A57 PolarHBondContact O-N 2.92Å; A57-E59 VanDerWaalsContact C-N 3.34Å; A57-I60 PolarHBondContact O-N 3.41Å; A57-I61 WeakPolarHBondContact O-CD1 3.44Å; A57-I61 VanDerWaalsContact O-CG1 3.22Å; A57-I61 WeakPolarHBondContact O-CG1 3.42Å; A57-I61 PolarHBondContact O-N 3.3Å; A57-I61 VanDerWaalsContact O-N 3.08Å |
| 58 | K | 93.6 | Very high | 92.1 | Very high | 136 Ų | 136 | 108.8 Ų | 108.8 | 59% | 0.591 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -64.6 | -37.5 | 176.1 | -76.1 | 177.5 | 178.4 | 178.6 | 0 | 112.5 | V54 R55 Q56 I61 R62 | V54-K58 HydrophobicContact CG1-CD 4.29Å; V54-K58 WeakPolarHBondContact O-CG 3.41Å; V54-K58 PolarHBondContact O-N 2.88Å; R55-K58 PolarHBondContact O-N 3.24Å; Q56-K58 VanDerWaalsContact C-N 3.34Å; Q56-K58 PolarHBondContact O-N 2.86Å; K58-I61 PolarHBondContact O-N 3Å; K58-R62 WeakPolarHBondContact O-CB 3.29Å; K58-R62 PolarHBondContact O-N 3.34Å |
| 59 | E | 94.4 | Very high | 91.1 | Very high | 86 Ų | 86 | 110.2 Ų | 110.2 | 40% | 0.402 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65 | -48.3 | 176.2 | -178.8 | 154.8 | -124.6 | 0 | 0 | 111.8 | R55 Q56 A57 I61 R62 D63 | R55-E59 PolarHBondContact O-N 3.4Å; Q56-E59 PolarHBondContact O-N 3.31Å; A57-E59 VanDerWaalsContact C-N 3.34Å; E59-I61 VanDerWaalsContact C-N 3.26Å; E59-I61 PolarHBondContact O-N 3.44Å; E59-R62 WeakPolarHBondContact O-CB 3.45Å; E59-R62 PolarHBondContact O-N 2.81Å; E59-R62 IonicContact OE1-NH2 2.74Å; E59-R62 PolarHBondContact OE1-NH2 2.88Å; E59-D63 VanDerWaalsContact O-CG 3.26Å; E59-D63 PolarHBondContact O-N 2.68Å |
| 60 | I | 94.1 | Very high | 89.7 | Confident | 115 Ų | 115 | 113.6 Ų | 113.6 | 59% | 0.59 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -58.9 | -39.7 | 175.8 | -66.5 | 162.6 | 0 | 0 | 0 | 111.5 | Q56 A57 R64 | Q56-I60 WeakPolarHBondContact O-CG1 3.39Å; Q56-I60 PolarHBondContact O-N 2.92Å; A57-I60 PolarHBondContact O-N 3.41Å; I60-R64 VanDerWaalsContact O-CB 3.29Å; I60-R64 WeakPolarHBondContact O-CB 3.48Å; I60-R64 PolarHBondContact O-N 2.67Å |
| 61 | I | 92.6 | Very high | 87.5 | Confident | 106 Ų | 106 | 115.2 Ų | 115.2 | 54% | 0.544 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64.7 | -43.8 | 176.5 | -69.7 | 165.2 | 0 | 0 | 0 | 110.7 | A57 K58 E59 Q65 | A57-I61 WeakPolarHBondContact O-CD1 3.44Å; A57-I61 VanDerWaalsContact O-CG1 3.22Å; A57-I61 WeakPolarHBondContact O-CG1 3.42Å; A57-I61 PolarHBondContact O-N 3.3Å; A57-I61 VanDerWaalsContact O-N 3.08Å; K58-I61 PolarHBondContact O-N 3Å; E59-I61 VanDerWaalsContact C-N 3.26Å; E59-I61 PolarHBondContact O-N 3.44Å; I61-Q65 WeakPolarHBondContact O-CB 3.49Å; I61-Q65 PolarHBondContact O-N 2.84Å |
| 62 | R | 93.4 | Very high | 85.5 | Confident | 128 Ų | 128 | 119.3 Ų | 119.3 | 48% | 0.483 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -64.4 | -47.3 | 178.5 | 176.7 | 178.9 | 55.4 | -135.9 | -3.2 | 111.5 | K58 E59 R64 Q65 E66 | K58-R62 WeakPolarHBondContact O-CB 3.29Å; K58-R62 PolarHBondContact O-N 3.34Å; E59-R62 WeakPolarHBondContact O-CB 3.45Å; E59-R62 PolarHBondContact O-N 2.81Å; E59-R62 IonicContact OE1-NH2 2.74Å; E59-R62 PolarHBondContact OE1-NH2 2.88Å; R62-R64 VanDerWaalsContact C-N 3.3Å; R62-R64 PolarHBondContact O-N 3.29Å; R62-Q65 CarbonylContact O-C 3.56Å; R62-Q65 WeakPolarHBondContact O-CA 3.27Å; R62-Q65 WeakPolarHBondContact O-CB 3.38Å; R62-Q65 PolarHBondContact O-N 2.9Å; R62-E66 WeakPolarHBondContact O-CB 3.47Å; R62-E66 PolarHBondContact O-N 3.12Å |
| 63 | D | 91.1 | Very high | 82.9 | Confident | 79 Ų | 79 | 121.3 Ų | 121.3 | 42% | 0.422 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -60.7 | -43.6 | 179.4 | -64.9 | -6.4 | 0 | 0 | 0 | 110.6 | E59 Q65 E66 V67 | E59-D63 VanDerWaalsContact O-CG 3.26Å; E59-D63 PolarHBondContact O-N 2.68Å; D63-Q65 VanDerWaalsContact C-N 3.31Å; D63-Q65 PolarHBondContact O-N 2.99Å; D63-E66 PolarHBondContact O-N 3.39Å; D63-V67 VanDerWaalsContact O-CG2 3.27Å; D63-V67 WeakPolarHBondContact O-CG2 3.26Å; D63-V67 PolarHBondContact O-N 3.13Å |
| 64 | R | 89.4 | Confident | 80.2 | Confident | 202 Ų | 202 | 125.1 Ų | 125.1 | 76% | 0.762 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -63.4 | -38.1 | 175.2 | -173.2 | 176.8 | -179.7 | -175 | 1 | 112.1 | I60 R62 R68 | I60-R64 VanDerWaalsContact O-CB 3.29Å; I60-R64 WeakPolarHBondContact O-CB 3.48Å; I60-R64 PolarHBondContact O-N 2.67Å; R62-R64 VanDerWaalsContact C-N 3.3Å; R62-R64 PolarHBondContact O-N 3.29Å; R64-R68 WeakPolarHBondContact O-CB 3.48Å; R64-R68 PolarHBondContact O-N 2.99Å |
| 65 | Q | 86.1 | Confident | 77.2 | Confident | 128 Ų | 128 | 130.9 Ų | 130.9 | 60% | 0.598 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -70.2 | -42 | 177.2 | -172.6 | 171.6 | 0 | 0 | 0 | 111.2 | I61 R62 D63 V67 R68 S69 | I61-Q65 WeakPolarHBondContact O-CB 3.49Å; I61-Q65 PolarHBondContact O-N 2.84Å; R62-Q65 CarbonylContact O-C 3.56Å; R62-Q65 WeakPolarHBondContact O-CA 3.27Å; R62-Q65 WeakPolarHBondContact O-CB 3.38Å; R62-Q65 PolarHBondContact O-N 2.9Å; D63-Q65 VanDerWaalsContact C-N 3.31Å; D63-Q65 PolarHBondContact O-N 2.99Å; Q65-V67 PolarHBondContact O-N 3.12Å; Q65-R68 CarbonylContact O-C 3.49Å; Q65-R68 WeakPolarHBondContact O-CA 3.28Å; Q65-R68 WeakPolarHBondContact O-CB 3.2Å; Q65-R68 PolarHBondContact O-N 3.01Å; Q65-S69 PolarHBondContact O-N 3.08Å; Q65-S69 PolarHBondContact O-OG 3.45Å |
| 66 | E | 85.7 | Confident | 74.5 | Confident | 102 Ų | 102 | 131.7 Ų | 131.7 | 48% | 0.477 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -62.4 | -43.3 | 178.9 | -170.8 | 171.7 | 176.8 | 0 | 0 | 111.9 | R62 D63 R68 S69 R70 | R62-E66 WeakPolarHBondContact O-CB 3.47Å; R62-E66 PolarHBondContact O-N 3.12Å; D63-E66 PolarHBondContact O-N 3.39Å; E66-R68 VanDerWaalsContact C-N 3.26Å; E66-R68 PolarHBondContact O-N 3.5Å; E66-S69 WeakPolarHBondContact CA-OG 3.45Å; E66-S69 PolarHBondContact O-N 3.41Å; E66-S69 PolarHBondContact O-OG 2.87Å; E66-R70 PolarHBondContact O-N 3.38Å |
| 67 | V | 79.3 | Confident | 71.8 | Confident | 117 Ų | 117 | 135.7 Ų | 135.7 | 71% | 0.709 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -61.3 | -35.8 | 172.2 | 173.3 | 0 | 0 | 0 | 0 | 111.4 | D63 Q65 | D63-V67 VanDerWaalsContact O-CG2 3.27Å; D63-V67 WeakPolarHBondContact O-CG2 3.26Å; D63-V67 PolarHBondContact O-N 3.13Å; Q65-V67 PolarHBondContact O-N 3.12Å |
| 68 | R | 73.9 | Confident | 69.3 | Low | 227 Ų | 227 | 138.9 Ų | 138.9 | 86% | 0.857 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -76.6 | -26.9 | 177.9 | -171 | 176.9 | -179.1 | -177.2 | 0.9 | 113.3 | R64 Q65 E66 | R64-R68 WeakPolarHBondContact O-CB 3.48Å; R64-R68 PolarHBondContact O-N 2.99Å; Q65-R68 CarbonylContact O-C 3.49Å; Q65-R68 WeakPolarHBondContact O-CA 3.28Å; Q65-R68 WeakPolarHBondContact O-CB 3.2Å; Q65-R68 PolarHBondContact O-N 3.01Å; E66-R68 VanDerWaalsContact C-N 3.26Å; E66-R68 PolarHBondContact O-N 3.5Å |
| 69 | S | 76.3 | Confident | 66.2 | Low | 83 Ų | 83 | 138.1 Ų | 138.1 | 58% | 0.58 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -95.8 | -0.6 | -177.1 | 47.3 | 0 | 0 | 0 | 0 | 114.9 | Q65 E66 P71 | Q65-S69 PolarHBondContact O-N 3.08Å; Q65-S69 PolarHBondContact O-OG 3.45Å; E66-S69 WeakPolarHBondContact CA-OG 3.45Å; E66-S69 PolarHBondContact O-N 3.41Å; E66-S69 PolarHBondContact O-OG 2.87Å; S69-P71 WeakPolarHBondContact O-CD 3.39Å |
| 70 | R | 67.8 | Low | 63.5 | Low | 189 Ų | 189 | 140.8 Ų | 140.8 | 71% | 0.713 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -69.2 | 120.4 | 168.3 | -81.9 | -175.6 | 179.4 | -171.4 | 1 | 110 | E66 V72 | E66-R70 PolarHBondContact O-N 3.38Å; R70-V72 PolarHBondContact O-N 2.86Å |
| 71 | P | 50 | Low | 60.7 | Low | 117 Ų | 117 | 143 Ų | 143 | 76% | 0.76 | 72% | 0.721 | S | S | * | * | trans | -69.4 | 131.3 | 177.8 | 25.7 | -30.5 | 0 | 0 | 0 | 111 | S69 S73 | S69-P71 WeakPolarHBondContact O-CD 3.39Å; P71-S73 VanDerWaalsContact C-N 3.33Å; P71-S73 PolarHBondContact O-N 3.48Å | ||
| 72 | V | 53.7 | Low | 58.2 | Low | 146 Ų | 146 | 145.7 Ų | 145.7 | 89% | 0.885 | 73% | 0.731 | S | S | * | * | trans | -70.7 | 90.4 | 167 | 178.2 | 0 | 0 | 0 | 0 | 107.8 | R70 K74 | R70-V72 PolarHBondContact O-N 2.86Å; V72-K74 PolarHBondContact O-N 2.71Å | ||
| 73 | S | 41.7 | Very low | 55.4 | Low | 110 Ų | 110 | 146.5 Ų | 146.5 | 77% | 0.769 | 75% | 0.745 | S | S | * | * | trans | -80.1 | 111.7 | 174.3 | 178.5 | 0 | 0 | 0 | 0 | 110 | P71 | P71-S73 VanDerWaalsContact C-N 3.33Å; P71-S73 PolarHBondContact O-N 3.48Å | ||
| 74 | K | 40.1 | Very low | 52.8 | Low | 174 Ų | 174 | 149.7 Ų | 149.7 | 76% | 0.757 | 76% | 0.762 | S | S | * | * | trans | -53.9 | 131.7 | 167.9 | -77.2 | 175.9 | 172.7 | 178.9 | 0 | 111.3 | V72 | V72-K74 PolarHBondContact O-N 2.71Š| ||
| 75 | Q | 32.6 | Very low | 50.5 | Low | 191 Ų | 191 | 150 Ų | 150 | 89% | 0.893 | 76% | 0.764 | S | S | * | * | trans | -109 | 87.2 | 150.9 | -169.4 | 171.8 | -0.2 | 0 | 0 | 108 | ||||
| 76 | M | 40.1 | Very low | 48.4 | Very low | 167 Ų | 167 | 149.6 Ų | 149.6 | 82% | 0.823 | 78% | 0.776 | S | S | * | * | trans | -93.6 | 116.5 | 150.8 | -91.2 | 170.3 | 73.1 | 0 | 0 | 106.2 | ||||
| 77 | K | 39 | Very low | 46 | Very low | 199 Ų | 199 | 153.6 Ų | 153.6 | 87% | 0.865 | 80% | 0.8 | S | S | * | * | trans | -146 | 122.7 | 155.5 | -118.2 | 175.5 | -178.1 | 179.9 | 0 | 108.7 | ||||
| 78 | S | 40.9 | Very low | 44.2 | Very low | 115 Ų | 115 | 160.1 Ų | 160.1 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | trans | -63 | 149.8 | 175.4 | 49.4 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 79 | C | 28.4 | Very low | 42.1 | Very low | 120 Ų | 120 | 152.5 Ų | 152.5 | 81% | 0.811 | 80% | 0.804 | S | S | * | * | 161.1 | 145.6 | 115.8 | -156.5 | 0 | 0 | 0 | 0 | 109 | |||||
| 80 | D | 38.4 | Very low | 40.1 | Very low | 142 Ų | 142 | 155.2 Ų | 155.2 | 76% | 0.759 | 82% | 0.817 | S | S | * | * | trans | -45.6 | 142.5 | 176.9 | -63.6 | -53 | 0 | 0 | 0 | 114.7 | ||||
| 81 | D | 33.4 | Very low | 38.4 | Very low | 161 Ų | 161 | 154 Ų | 154 | 86% | 0.861 | 82% | 0.823 | S | S | * | * | -177.1 | 155.8 | 117.4 | -97.5 | -25.2 | 0 | 0 | 0 | 112 | |||||
| 82 | E | 40.7 | Very low | 37.8 | Very low | 163 Ų | 163 | 154.2 Ų | 154.2 | 76% | 0.762 | 83% | 0.825 | S | S | * | * | trans | -60 | 160.4 | -167.2 | -66.7 | -77 | 179.3 | 0 | 0 | 117.7 | ||||
| 83 | D | 34.1 | Very low | 36.8 | Very low | 144 Ų | 144 | 152.9 Ų | 152.9 | 77% | 0.77 | 82% | 0.822 | S | S | * | * | trans | 72.3 | 134.1 | 150.9 | -71.1 | -37.1 | 0 | 0 | 0 | 123.1 | ||||
| 84 | D | 36.7 | Very low | 36.5 | Very low | 147 Ų | 147 | 155.5 Ų | 155.5 | 79% | 0.786 | 82% | 0.822 | S | S | * | * | trans | 102.1 | 141.9 | 140.9 | -127.6 | 25.7 | 0 | 0 | 0 | 121.1 | ||||
| 85 | Y | 42.3 | Very low | 35.9 | Very low | 207 Ų | 207 | 151 Ų | 151 | 81% | 0.812 | 83% | 0.825 | S | S | * | * | trans | -55.1 | 131 | -158.8 | -77.8 | -113.3 | 0 | 0 | 0 | 117.7 | ||||
| 86 | S | 41.8 | Very low | 36 | Very low | 121 Ų | 121 | 148.3 Ų | 148.3 | 85% | 0.846 | 82% | 0.815 | S | S | * | * | 154.7 | 111.2 | 121.7 | -76.2 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 87 | L | 35.1 | Very low | 35.6 | Very low | 186 Ų | 186 | 147.4 Ų | 147.4 | 97% | 0.974 | 82% | 0.819 | S | S | * | * | trans | -107.1 | 108.7 | 176.5 | -107.9 | 135.8 | 0 | 0 | 0 | 111.2 | ||||
| 88 | R | 40.7 | Very low | 35.4 | Very low | 253 Ų | 253 | 145.2 Ų | 145.2 | 96% | 0.955 | 81% | 0.811 | S | S | * | * | trans | -134 | 121.9 | 162.8 | 178.1 | 177 | -76.6 | -106.6 | 1.4 | 108.4 | ||||
| 89 | G | 29.5 | Very low | 34.9 | Very low | 67 Ų | 67 | 145.8 Ų | 145.8 | 69% | 0.691 | 81% | 0.805 | S | S | * | * | trans | 146.9 | 85.7 | 169.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 90 | V | 34.5 | Very low | 34.9 | Very low | 141 Ų | 141 | 149.7 Ų | 149.7 | 86% | 0.855 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 121.9 | 176.8 | 172.7 | 0 | 0 | 0 | 0 | 109.7 | ||
| 91 | L | 33.4 | Very low | 34.7 | Very low | 162 Ų | 162 | 147.5 Ų | 147.5 | 85% | 0.848 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -89.7 | 136.2 | 157.1 | -74.4 | 167.8 | 0 | 0 | 0 | 108.7 | ||
| 92 | P | 37.3 | Very low | 34.5 | Very low | 123 Ų | 123 | 149.2 Ų | 149.2 | 80% | 0.799 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 120.1 | 162.8 | -3.1 | 21.5 | 0 | 0 | 0 | 109.9 | ||
| 93 | S | 32.8 | Very low | 34.2 | Very low | 117 Ų | 117 | 147.9 Ų | 147.9 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 140.1 | 169.7 | -178.6 | 0 | 0 | 0 | 0 | 111.4 | ||
| 94 | E | 34.3 | Very low | 34.2 | Very low | 166 Ų | 166 | 150.5 Ų | 150.5 | 78% | 0.776 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 149.5 | 171.2 | -63.6 | 176.2 | 144.6 | 0 | 0 | 112.6 | ||
| 95 | G | 28.1 | Very low | 34.1 | Very low | 80 Ų | 80 | 149.5 Ų | 149.5 | 83% | 0.825 | 82% | 0.819 | S | S | * | * | trans | -134.2 | 72.9 | 164.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 96 | I | 34 | Very low | 33.7 | Very low | 133 Ų | 133 | 149.7 Ų | 149.7 | 68% | 0.682 | 82% | 0.824 | S | S | * | * | trans | -81.8 | 118.1 | 164.4 | -70.6 | 170.1 | 0 | 0 | 0 | 107.3 | H98 | I96-H98 HydrophobicContact CG2-CB 4.46Š| ||
| 97 | V | 31.9 | Very low | 33.2 | Very low | 148 Ų | 148 | 149.9 Ų | 149.9 | 90% | 0.897 | 82% | 0.82 | S | S | * | * | trans | -114.2 | 116.5 | 156.5 | -173 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 98 | H | 34.3 | Very low | 33.1 | Very low | 153 Ų | 153 | 149.8 Ų | 149.8 | 71% | 0.708 | 81% | 0.812 | S | S | * | * | trans | -99.5 | 147.7 | 178.3 | -159.7 | 72.2 | 0 | 0 | 0 | 108.6 | I96 | I96-H98 HydrophobicContact CG2-CB 4.46Š| ||
| 99 | L | 32 | Very low | 32.7 | Very low | 128 Ų | 128 | 144.2 Ų | 144.2 | 67% | 0.67 | 80% | 0.801 | S | S | * | * | 152.3 | 111.1 | 125.4 | -79.7 | 154.6 | 0 | 0 | 0 | 112.2 | |||||
| 100 | H | 27.3 | Very low | 32.8 | Very low | 201 Ų | 201 | 149.1 Ų | 149.1 | 93% | 0.931 | 81% | 0.81 | S | S | * | * | trans | -126.5 | 112.9 | 144.4 | -97.1 | -78.2 | 0 | 0 | 0 | 107.3 | ||||
| 101 | S | 34.4 | Very low | 32.6 | Very low | 96 Ų | 96 | 149.2 Ų | 149.2 | 67% | 0.671 | 81% | 0.805 | S | S | * | * | trans | -84.5 | 121.9 | -179.1 | -42.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 102 | E | 30.4 | Very low | 33.7 | Very low | 198 Ų | 198 | 146.8 Ų | 146.8 | 93% | 0.925 | 80% | 0.799 | S | S | * | * | trans | -77.2 | 127.7 | 164.4 | -71.8 | -179.3 | 155.8 | 0 | 0 | 109.5 | ||||
| 103 | T | 32.7 | Very low | 33.4 | Very low | 135 Ų | 135 | 147.1 Ų | 147.1 | 83% | 0.828 | 80% | 0.798 | S | S | * | * | trans | -121.1 | 131 | 169.3 | -37.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 104 | K | 34.1 | Very low | 33.4 | Very low | 199 Ų | 199 | 148 Ų | 148 | 87% | 0.865 | 79% | 0.794 | S | S | * | * | trans | -61 | 153.9 | -177.9 | -62.4 | 176.9 | 176 | 179.8 | 0 | 113.2 | ||||
| 105 | P | 36.5 | Very low | 33.4 | Very low | 126 Ų | 126 | 148.9 Ų | 148.9 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -88.7 | 145 | 174.7 | 34.9 | -30.4 | 0 | 0 | 0 | 112.1 | ||||
| 106 | K | 32 | Very low | 33.5 | Very low | 210 Ų | 210 | 152 Ų | 152 | 91% | 0.913 | 80% | 0.798 | S | S | * | * | trans | -128.7 | 144.4 | 161.6 | -90 | -175 | 177.2 | 178.6 | 0 | 110 | ||||
| 107 | T | 31.7 | Very low | 33.5 | Very low | 126 Ų | 126 | 153.6 Ų | 153.6 | 77% | 0.773 | 80% | 0.803 | S | S | * | * | trans | -65.5 | 145.8 | -178.3 | 32.9 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 108 | K | 33.5 | Very low | 33.5 | Very low | 183 Ų | 183 | 153.6 Ų | 153.6 | 80% | 0.796 | 80% | 0.798 | S | S | * | * | 158.2 | 126 | 112.8 | -82.1 | -178.3 | -175.2 | -177.3 | 0 | 111.8 | |||||
| 109 | N | 32 | Very low | 33.4 | Very low | 137 Ų | 137 | 155 Ų | 155 | 73% | 0.733 | 80% | 0.802 | S | S | * | * | trans | 30.6 | 131.9 | 143.7 | -57.1 | -42.9 | 0 | 0 | 0 | 121.3 | ||||
| 110 | I | 32.6 | Very low | 33.5 | Very low | 170 Ų | 170 | 157 Ų | 157 | 87% | 0.872 | 81% | 0.812 | S | S | * | * | -167.1 | 126 | 119.8 | -85.8 | 144.5 | 0 | 0 | 0 | 107.7 | |||||
| 111 | D | 29.8 | Very low | 33.8 | Very low | 143 Ų | 143 | 154.4 Ų | 154.4 | 77% | 0.765 | 80% | 0.8 | S | S | * | * | trans | -87.5 | -159.8 | 177.3 | -62 | -57.5 | 0 | 0 | 0 | 112.1 | ||||
| 112 | P | 56.2 | Low | 33.9 | Very low | 111 Ų | 111 | 154.9 Ų | 154.9 | 72% | 0.721 | 80% | 0.803 | S | S | * | * | -134.7 | 167.1 | -99.6 | 41.3 | -22 | 0 | 0 | 0 | 113.3 | |||||
| 113 | V | 30.4 | Very low | 34 | Very low | 129 Ų | 129 | 150.4 Ų | 150.4 | 78% | 0.782 | 80% | 0.801 | S | S | * | * | trans | -149.8 | 112.8 | 162.3 | 171.7 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 114 | N | 33.7 | Very low | 34.1 | Very low | 136 Ų | 136 | 151.2 Ų | 151.2 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | 41 | 144.1 | 127.7 | -50.5 | -42.6 | 0 | 0 | 0 | 119.7 | |||||
| 115 | K | 33.2 | Very low | 34.6 | Very low | 184 Ų | 184 | 151.9 Ų | 151.9 | 80% | 0.8 | 80% | 0.803 | S | S | * | * | cis | -156.2 | 153.4 | 35.5 | -71.5 | 173.4 | 169.6 | 165.8 | 0 | 106.6 | ||||
| 116 | V | 30.1 | Very low | 34.4 | Very low | 145 Ų | 145 | 149.5 Ų | 149.5 | 88% | 0.879 | 80% | 0.801 | S | S | * | * | -160.6 | 137.5 | 89.2 | 160.8 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 117 | Q | 34.7 | Very low | 34.6 | Very low | 167 Ų | 167 | 149.5 Ų | 149.5 | 78% | 0.78 | 80% | 0.795 | S | S | * | * | trans | -84.5 | 140.6 | -172.3 | -75.2 | 166.7 | -58.6 | 0 | 0 | 114.2 | ||||
| 118 | N | 32.3 | Very low | 34.9 | Very low | 149 Ų | 149 | 150.8 Ų | 150.8 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | 26.4 | 137 | 126.8 | -60.3 | -11.1 | 0 | 0 | 0 | 120.7 | |||||
| 119 | K | 31.9 | Very low | 35.1 | Very low | 183 Ų | 183 | 147.5 Ų | 147.5 | 80% | 0.796 | 79% | 0.785 | S | S | * | * | -158 | 122.1 | 124.4 | -113.9 | 177.2 | -177.5 | -172.2 | 0 | 112.9 | |||||
| 120 | L | 33.5 | Very low | 35.2 | Very low | 168 Ų | 168 | 148.4 Ų | 148.4 | 88% | 0.88 | 79% | 0.79 | S | S | * | * | trans | -115.7 | 130.2 | 156.9 | -100.7 | 162.6 | 0 | 0 | 0 | 107.1 | ||||
| 121 | H | 34.1 | Very low | 35.6 | Very low | 147 Ų | 147 | 145.5 Ų | 145.5 | 68% | 0.681 | 79% | 0.785 | S | S | * | * | trans | -144.1 | 107.9 | 161.1 | -69 | -67.4 | 0 | 0 | 0 | 104.2 | ||||
| 122 | S | 37.6 | Very low | 35.9 | Very low | 106 Ų | 106 | 143.9 Ų | 143.9 | 74% | 0.741 | 79% | 0.785 | S | S | * | * | 50.2 | 102.6 | 72.1 | -163.3 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 123 | A | 31 | Very low | 35.4 | Very low | 105 Ų | 105 | 145.1 Ų | 145.1 | 87% | 0.868 | 79% | 0.79 | S | S | * | * | trans | -144.6 | 110.2 | 157.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 124 | N | 36.4 | Very low | 35.6 | Very low | 152 Ų | 152 | 148.1 Ų | 148.1 | 81% | 0.813 | 79% | 0.793 | S | S | * | * | trans | -78.4 | 141.6 | 169.7 | -82.6 | -38.2 | 0 | 0 | 0 | 111.5 | ||||
| 125 | K | 43.1 | Very low | 35.8 | Very low | 213 Ų | 213 | 149.1 Ų | 149.1 | 93% | 0.926 | 80% | 0.797 | S | S | * | * | trans | -148.1 | 101.4 | 140.9 | -89.7 | -174.5 | 177.6 | 175.3 | 0 | 105.8 | ||||
| 126 | G | 33.1 | Very low | 35.7 | Very low | 75 Ų | 75 | 149.5 Ų | 149.5 | 77% | 0.773 | 80% | 0.799 | S | S | * | * | 77 | 126 | 95.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 127 | R | 36.6 | Very low | 35.8 | Very low | 210 Ų | 210 | 153.2 Ų | 153.2 | 79% | 0.792 | 80% | 0.798 | S | S | * | * | cis | -179.3 | 142.2 | 34.6 | -179.9 | 177.5 | -171.9 | -159.6 | 2.5 | 109.1 | ||||
| 128 | K | 36.4 | Very low | 35.8 | Very low | 154 Ų | 154 | 150.2 Ų | 150.2 | 67% | 0.67 | 80% | 0.796 | S | S | * | * | trans | 74 | 107.5 | 150.8 | -77.3 | 173.6 | 178 | -169.6 | 0 | 122 | ||||
| 129 | T | 39.4 | Very low | 36.3 | Very low | 113 Ų | 113 | 150.3 Ų | 150.3 | 69% | 0.693 | 80% | 0.797 | S | S | * | * | 11.1 | 127.6 | 124.7 | 57.8 | 0 | 0 | 0 | 0 | 118.8 | |||||
| 130 | N | 34 | Very low | 36.6 | Very low | 156 Ų | 156 | 147.5 Ų | 147.5 | 83% | 0.834 | 79% | 0.794 | S | S | * | * | -174 | 149.4 | 109.3 | -80.5 | -22.3 | 0 | 0 | 0 | 112 | |||||
| 131 | S | 40.2 | Very low | 37.1 | Very low | 110 Ų | 110 | 148 Ų | 148 | 77% | 0.769 | 79% | 0.792 | S | S | * | * | trans | -58.2 | 145.9 | 179.2 | 55.8 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 132 | S | 35.5 | Very low | 37.6 | Very low | 108 Ų | 108 | 147.5 Ų | 147.5 | 76% | 0.755 | 80% | 0.799 | S | S | * | * | 173.6 | 129.1 | 111.5 | 60.9 | 0 | 0 | 0 | 0 | 110.3 | K134 | S132-K134 PolarHBondContact O-N 3.31Š| |||
| 133 | V | 45.9 | Very low | 37.8 | Very low | 138 Ų | 138 | 146.7 Ų | 146.7 | 84% | 0.836 | 80% | 0.799 | S | S | * | * | trans | -61.3 | 123.2 | 170 | 172.8 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 134 | K | 35 | Very low | 38.6 | Very low | 192 Ų | 192 | 150 Ų | 150 | 84% | 0.835 | 80% | 0.803 | S | S | * | * | trans | -137.1 | 109.5 | 156.8 | -122.1 | -179.9 | -178.7 | 179.7 | 0 | 107.3 | S132 K136 | S132-K134 PolarHBondContact O-N 3.31Å; K134-K136 PolarHBondContact O-N 2.85Å; K134-K136 VanDerWaalsContact O-N 3.11Å | ||
| 135 | L | 37.3 | Very low | 39.2 | Very low | 156 Ų | 156 | 150.1 Ų | 150.1 | 82% | 0.817 | 80% | 0.803 | S | S | * | * | trans | -51.3 | 114.2 | 168.5 | -96.9 | 112.8 | 0 | 0 | 0 | 108.6 | ||||
| 136 | K | 32.6 | Very low | 39.6 | Very low | 193 Ų | 193 | 145.5 Ų | 145.5 | 84% | 0.839 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -99.9 | 118.7 | 156.8 | -87 | -166.7 | 170.1 | -170.3 | 0 | 106.7 | K134 S138 | K134-K136 PolarHBondContact O-N 2.85Å; K134-K136 VanDerWaalsContact O-N 3.11Å; K136-S138 PolarHBondContact O-N 3.34Å |
| 137 | Y | 31.8 | Very low | 40.6 | Very low | 222 Ų | 222 | 146.7 Ų | 146.7 | 87% | 0.871 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -54 | 125.8 | 161.6 | -106.1 | -103.9 | 0 | 0 | 0 | 108.1 | D139 | Y137-D139 PolarHBondContact O-N 2.83Š|
| 138 | S | 34.6 | Very low | 41.3 | Very low | 104 Ų | 104 | 142.6 Ų | 142.6 | 73% | 0.727 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 124.4 | 170.2 | -47.9 | 0 | 0 | 0 | 0 | 108.4 | K136 V140 | K136-S138 PolarHBondContact O-N 3.34Å; S138-V140 PolarHBondContact O-N 3Å |
| 139 | D | 42.5 | Very low | 42 | Very low | 152 Ų | 152 | 139.7 Ų | 139.7 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | trans | -47.5 | 114.3 | 163.8 | -170.9 | 28.4 | 0 | 0 | 0 | 109.5 | Y137 Q141 | Y137-D139 PolarHBondContact O-N 2.83Å; D139-Q141 PolarHBondContact O-N 3.37Å | ||
| 140 | V | 38.3 | Very low | 42.7 | Very low | 123 Ų | 123 | 143.2 Ų | 143.2 | 75% | 0.745 | 79% | 0.793 | S | S | * | * | trans | -80.5 | 108.8 | 178.8 | 177.9 | 0 | 0 | 0 | 0 | 106.8 | S138 T142 | S138-V140 PolarHBondContact O-N 3Å; V140-T142 PolarHBondContact O-N 3.39Å | ||
| 141 | Q | 44.5 | Very low | 43.7 | Very low | 180 Ų | 180 | 142.9 Ų | 142.9 | 84% | 0.841 | 79% | 0.791 | S | S | * | * | trans | -55.1 | 110.5 | 165.1 | -73.4 | 175.8 | -26.7 | 0 | 0 | 108.8 | D139 A143 | D139-Q141 PolarHBondContact O-N 3.37Å; Q141-A143 PolarHBondContact O-N 2.76Å | ||
| 142 | T | 43.2 | Very low | 44.3 | Very low | 135 Ų | 135 | 144.4 Ų | 144.4 | 83% | 0.828 | 78% | 0.784 | S | S | * | * | trans | -61.2 | 122.7 | 168.1 | 31.5 | 0 | 0 | 0 | 0 | 109.3 | V140 | V140-T142 PolarHBondContact O-N 3.39Š| ||
| 143 | A | 41.5 | Very low | 45.3 | Very low | 89 Ų | 89 | 144.3 Ų | 144.3 | 74% | 0.736 | 78% | 0.783 | S | S | * | * | trans | -70.2 | 139.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | Q141 D145 | Q141-A143 PolarHBondContact O-N 2.76Å; A143-D145 PolarHBondContact O-N 2.96Å; A143-D145 VanDerWaalsContact O-N 3.1Å | ||
| 144 | D | 48.3 | Very low | 45.8 | Very low | 176 Ų | 176 | 144.6 Ų | 144.6 | 94% | 0.941 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -81.1 | 22.9 | -166 | -132.7 | -0.4 | 0 | 0 | 0 | 114.6 | ||
| 145 | D | 49.8 | Very low | 46.7 | Very low | 154 Ų | 154 | 143 Ų | 143 | 82% | 0.824 | 77% | 0.773 | S | S | * | * | trans | -140.9 | 49.4 | -171.7 | -154.7 | 18.2 | 0 | 0 | 0 | 113.4 | A143 | A143-D145 PolarHBondContact O-N 2.96Å; A143-D145 VanDerWaalsContact O-N 3.1Å | ||
| 146 | V | 50.8 | Low | 48.4 | Very low | 116 Ų | 116 | 138.4 Ų | 138.4 | 70% | 0.703 | 75% | 0.754 | S | S | * | * | trans | -127.1 | 113.2 | 164.1 | -175.9 | 0 | 0 | 0 | 0 | 107.5 | I148 | V146-I148 PolarHBondContact O-N 3.38Š| ||
| 147 | A | 54.2 | Low | 50.2 | Low | 99 Ų | 99 | 135.3 Ų | 135.3 | 82% | 0.818 | 75% | 0.746 | S | S | * | * | trans | -64 | 98 | 171.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | P149 | A147-P149 WeakPolarHBondContact O-CD 3.36Š| ||
| 148 | I | 52.3 | Low | 52.3 | Low | 125 Ų | 125 | 127.7 Ų | 127.7 | 64% | 0.641 | 73% | 0.729 | S | S | * | * | trans | -81.7 | 117.9 | 166.6 | -57.1 | -171.7 | 0 | 0 | 0 | 106.2 | V146 E150 | V146-I148 PolarHBondContact O-N 3.38Å; I148-E150 PolarHBondContact O-N 3.46Å | ||
| 149 | P | 50.4 | Low | 54.3 | Low | 92 Ų | 92 | 129.9 Ų | 129.9 | 60% | 0.597 | 73% | 0.725 | S | S | * | * | trans | -55.1 | 128.3 | 171.4 | -23.2 | 34 | 0 | 0 | 0 | 109.8 | A147 D151 | A147-P149 WeakPolarHBondContact O-CD 3.36Å; P149-D151 PolarHBondContact O-N 3.4Å | ||
| 150 | E | 54.9 | Low | 56 | Low | 188 Ų | 188 | 125.2 Ų | 125.2 | 88% | 0.879 | 70% | 0.702 | S | S | * | * | G | 310 helix | trans | -59.4 | -5.6 | -168.8 | -119.2 | 151.2 | 166.9 | 0 | 0 | 115.6 | I148 | I148-E150 PolarHBondContact O-N 3.46Š|
| 151 | D | 54.8 | Low | 57.8 | Low | 149 Ų | 149 | 123 Ų | 123 | 80% | 0.797 | 69% | 0.685 | S | S | * | * | G | 310 helix | trans | -90 | 3.2 | -175.1 | -83.7 | -19.3 | 0 | 0 | 0 | 115.7 | P149 | P149-D151 PolarHBondContact O-N 3.4Š|
| 152 | F | 51.6 | Low | 59.4 | Low | 142 Ų | 142 | 118 Ų | 118 | 62% | 0.623 | 67% | 0.671 | S | S | * | * | G | 310 helix | trans | -114.9 | 2.5 | -176.6 | -75.9 | -81.8 | 0 | 0 | 0 | 116.2 | D154 F155 | F152-D154 PolarHBondContact O-N 2.97Å; F152-D154 VanDerWaalsContact O-N 3.15Å; F152-F155 PolarHBondContact O-N 2.99Å |
| 153 | S | 56.3 | Low | 61.2 | Low | 105 Ų | 105 | 118.3 Ų | 118.3 | 73% | 0.734 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.7 | -10.8 | 176 | -60.2 | 0 | 0 | 0 | 0 | 113.9 | ||
| 154 | D | 56.1 | Low | 62.7 | Low | 145 Ų | 145 | 118.6 Ų | 118.6 | 78% | 0.775 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | 1.1 | -178.8 | -78.7 | -9.3 | 0 | 0 | 0 | 114.5 | F152 S156 | F152-D154 PolarHBondContact O-N 2.97Å; F152-D154 VanDerWaalsContact O-N 3.15Å; D154-S156 PolarHBondContact O-N 3.36Å; D154-S156 VanDerWaalsContact O-N 3.07Å |
| 155 | F | 54.2 | Low | 63.8 | Low | 158 Ų | 158 | 115.9 Ų | 115.9 | 69% | 0.693 | 63% | 0.63 | S | S | * | * | trans | -86.1 | 76.5 | -179.1 | -129.4 | -86.2 | 0 | 0 | 0 | 112.1 | F152 | F152-F155 PolarHBondContact O-N 2.99Š| ||
| 156 | S | 74.7 | Confident | 64.8 | Low | 59 Ų | 59 | 110.2 Ų | 110.2 | 41% | 0.413 | 61% | 0.608 | S | S | . | * | trans | -82.8 | 114.2 | 168.8 | 173.4 | 0 | 0 | 0 | 0 | 110.3 | D154 A158 K159 T160 | D154-S156 PolarHBondContact O-N 3.36Å; D154-S156 VanDerWaalsContact O-N 3.07Å; S156-A158 PolarHBondContact O-N 3.39Å; S156-A158 PolarHBondContact OG-N 3.12Å; S156-K159 WeakPolarHBondContact O-CA 3.47Å; S156-K159 VanDerWaalsContact O-CB 3.3Å; S156-K159 WeakPolarHBondContact O-CB 3.31Å; S156-K159 PolarHBondContact O-N 3.36Å; S156-K159 PolarHBondContact OG-N 2.9Å; S156-T160 PolarHBondContact O-N 3.01Å; S156-T160 VanDerWaalsContact O-N 3.11Å; S156-T160 PolarHBondContact O-OG1 3.41Å | ||
| 157 | L | 70.1 | Confident | 65.3 | Low | 129 Ų | 129 | 109.9 Ų | 109.9 | 68% | 0.675 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -52.8 | -36.6 | 174.1 | -177.7 | 65.4 | 0 | 0 | 0 | 111.7 | K159 T160 I161 | L157-K159 VanDerWaalsContact C-N 3.31Å; L157-K159 PolarHBondContact O-N 2.87Å; L157-T160 PolarHBondContact O-N 3.19Å; L157-I161 HydrophobicContact CD1-CD1 4.35Å; L157-I161 HydrophobicContact CD2-CD1 4.49Å; L157-I161 HydrophobicContact CG-CD1 3.89Å; L157-I161 VanDerWaalsContact O-CG1 3.25Å; L157-I161 WeakPolarHBondContact O-CG1 3.43Å; L157-I161 PolarHBondContact O-N 2.93Å |
| 158 | A | 74.8 | Confident | 65.5 | Low | 61 Ų | 61 | 111.9 Ų | 111.9 | 50% | 0.504 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -63.4 | -37 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | S156 I161 S162 | S156-A158 PolarHBondContact O-N 3.39Å; S156-A158 PolarHBondContact OG-N 3.12Å; A158-I161 PolarHBondContact O-N 2.74Å; A158-S162 PolarHBondContact O-N 3.33Å; A158-S162 PolarHBondContact O-OG 3.35Å; A158-S162 VanDerWaalsContact O-OG 3.12Å |
| 159 | K | 77.6 | Confident | 65.8 | Low | 150 Ų | 150 | 114.4 Ų | 114.4 | 65% | 0.652 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -71.5 | -34 | 178.4 | -151.8 | 174.6 | -170.6 | -179.2 | 0 | 111.6 | S156 L157 K163 | S156-K159 WeakPolarHBondContact O-CA 3.47Å; S156-K159 VanDerWaalsContact O-CB 3.3Å; S156-K159 WeakPolarHBondContact O-CB 3.31Å; S156-K159 PolarHBondContact O-N 3.36Å; S156-K159 PolarHBondContact OG-N 2.9Å; L157-K159 VanDerWaalsContact C-N 3.31Å; L157-K159 PolarHBondContact O-N 2.87Å; K159-K163 WeakPolarHBondContact O-CB 3.44Å; K159-K163 PolarHBondContact O-N 3.15Å; K159-K163 VanDerWaalsContact O-N 3.12Å |
| 160 | T | 77.3 | Confident | 66 | Low | 54 Ų | 54 | 118.3 Ų | 118.3 | 33% | 0.331 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -70.4 | -41.3 | 172.9 | -53.2 | 0 | 0 | 0 | 0 | 111.6 | S156 L157 K163 I164 | S156-T160 PolarHBondContact O-N 3.01Å; S156-T160 VanDerWaalsContact O-N 3.11Å; S156-T160 PolarHBondContact O-OG1 3.41Å; L157-T160 PolarHBondContact O-N 3.19Å; T160-K163 PolarHBondContact O-N 3.48Å; T160-I164 HydrophobicContact CG2-CD1 4.13Å; T160-I164 WeakPolarHBondContact O-CG1 3.43Å; T160-I164 PolarHBondContact O-N 3.29Å |
| 161 | I | 75.8 | Confident | 65.8 | Low | 76 Ų | 76 | 117.2 Ų | 117.2 | 39% | 0.39 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -64.3 | -48.1 | 176.5 | -68.1 | 165.5 | 0 | 0 | 0 | 110.6 | L157 A158 K163 I164 E165 | L157-I161 HydrophobicContact CD1-CD1 4.35Å; L157-I161 HydrophobicContact CD2-CD1 4.49Å; L157-I161 HydrophobicContact CG-CD1 3.89Å; L157-I161 VanDerWaalsContact O-CG1 3.25Å; L157-I161 WeakPolarHBondContact O-CG1 3.43Å; L157-I161 PolarHBondContact O-N 2.93Å; A158-I161 PolarHBondContact O-N 2.74Å; I161-K163 PolarHBondContact O-N 3.22Å; I161-I164 PolarHBondContact O-N 3.1Å; I161-I164 VanDerWaalsContact O-N 3.09Å; I161-E165 HydrophobicContact CG2-CG 4.32Å; I161-E165 WeakPolarHBondContact O-CG 3.41Å; I161-E165 PolarHBondContact O-N 3.23Å |
| 162 | S | 79.5 | Confident | 65.4 | Low | 76 Ų | 76 | 112.8 Ų | 112.8 | 53% | 0.531 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -63.1 | -28 | 176.4 | -61.5 | 0 | 0 | 0 | 0 | 113.4 | A158 G166 | A158-S162 PolarHBondContact O-N 3.33Å; A158-S162 PolarHBondContact O-OG 3.35Å; A158-S162 VanDerWaalsContact O-OG 3.12Å; S162-G166 PolarHBondContact O-N 3.06Å |
| 163 | K | 80.4 | Confident | 65.2 | Low | 141 Ų | 141 | 113.7 Ų | 113.7 | 61% | 0.613 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -72.5 | -37.7 | 173.9 | -170 | 177.3 | -179 | -176.5 | 0 | 111.9 | K159 T160 I161 Q167 | K159-K163 WeakPolarHBondContact O-CB 3.44Å; K159-K163 PolarHBondContact O-N 3.15Å; K159-K163 VanDerWaalsContact O-N 3.12Å; T160-K163 PolarHBondContact O-N 3.48Å; I161-K163 PolarHBondContact O-N 3.22Å; K163-Q167 WeakPolarHBondContact O-CB 3.28Å; K163-Q167 VanDerWaalsContact O-CG 3.23Å; K163-Q167 WeakPolarHBondContact O-CG 3.44Å; K163-Q167 PolarHBondContact O-N 2.84Å |
| 164 | I | 72.1 | Confident | 64.8 | Low | 95 Ų | 95 | 114.4 Ų | 114.4 | 49% | 0.487 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -71 | -43.5 | 176.1 | -66.4 | 164.9 | 0 | 0 | 0 | 110.4 | T160 I161 Q167 L168 | T160-I164 HydrophobicContact CG2-CD1 4.13Å; T160-I164 WeakPolarHBondContact O-CG1 3.43Å; T160-I164 PolarHBondContact O-N 3.29Å; I161-I164 PolarHBondContact O-N 3.1Å; I161-I164 VanDerWaalsContact O-N 3.09Å; I164-Q167 PolarHBondContact O-N 3.37Å; I164-L168 WeakPolarHBondContact O-CB 3.17Å; I164-L168 PolarHBondContact O-N 3.32Å |
| 165 | E | 72.2 | Confident | 64.1 | Low | 119 Ų | 119 | 115.6 Ų | 115.6 | 56% | 0.556 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -63.3 | -42 | 175.9 | -71.3 | 174.5 | 160.1 | 0 | 0 | 111.5 | I161 L168 E169 | I161-E165 HydrophobicContact CG2-CG 4.32Å; I161-E165 WeakPolarHBondContact O-CG 3.41Å; I161-E165 PolarHBondContact O-N 3.23Å; E165-L168 PolarHBondContact O-N 2.85Å; E165-E169 PolarHBondContact O-N 3.21Å; E165-E169 VanDerWaalsContact O-N 3.15Å |
| 166 | G | 70.6 | Confident | 63.9 | Low | 35 Ų | 35 | 117.1 Ų | 117.1 | 36% | 0.361 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -65.7 | -35.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | S162 L168 E169 E170 | S162-G166 PolarHBondContact O-N 3.06Å; G166-L168 VanDerWaalsContact C-N 3.33Å; G166-E169 PolarHBondContact O-N 2.81Å; G166-E170 WeakPolarHBondContact O-CB 3.41Å; G166-E170 PolarHBondContact O-N 3.23Å; G166-E170 VanDerWaalsContact O-N 3.1Å |
| 167 | Q | 61.6 | Low | 62.4 | Low | 110 Ų | 110 | 119.8 Ų | 119.8 | 51% | 0.514 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -69.7 | -30.5 | 174.2 | -76.9 | -179.8 | -25.1 | 0 | 0 | 112.4 | K163 I164 E171 | K163-Q167 WeakPolarHBondContact O-CB 3.28Å; K163-Q167 VanDerWaalsContact O-CG 3.23Å; K163-Q167 WeakPolarHBondContact O-CG 3.44Å; K163-Q167 PolarHBondContact O-N 2.84Å; I164-Q167 PolarHBondContact O-N 3.37Å; Q167-E171 VanDerWaalsContact O-CB 3.29Å; Q167-E171 WeakPolarHBondContact O-CB 3.49Å; Q167-E171 PolarHBondContact O-N 3.24Å; Q167-E171 VanDerWaalsContact O-N 3.1Å |
| 168 | L | 58 | Low | 60.8 | Low | 141 Ų | 141 | 118.3 Ų | 118.3 | 74% | 0.738 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -77.9 | -22.9 | 178.2 | -140.7 | 120.9 | 0 | 0 | 0 | 113.1 | I164 E165 G166 | I164-L168 WeakPolarHBondContact O-CB 3.17Å; I164-L168 PolarHBondContact O-N 3.32Å; E165-L168 PolarHBondContact O-N 2.85Å; G166-L168 VanDerWaalsContact C-N 3.33Å |
| 169 | E | 59.1 | Low | 59.3 | Low | 177 Ų | 177 | 122.6 Ų | 122.6 | 83% | 0.827 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -88 | -27.8 | 173.4 | -72.7 | -166.4 | 172.1 | 0 | 0 | 113.3 | E165 G166 | E165-E169 PolarHBondContact O-N 3.21Å; E165-E169 VanDerWaalsContact O-N 3.15Å; G166-E169 PolarHBondContact O-N 2.81Å |
| 170 | E | 54.5 | Low | 58 | Low | 175 Ų | 175 | 121.5 Ų | 121.5 | 82% | 0.818 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -84.7 | -29.6 | 178 | -168.4 | 170.9 | -172.6 | 0 | 0 | 112.7 | G166 G172 | G166-E170 WeakPolarHBondContact O-CB 3.41Å; G166-E170 PolarHBondContact O-N 3.23Å; G166-E170 VanDerWaalsContact O-N 3.1Å; E170-G172 PolarHBondContact O-N 2.86Å |
| 171 | E | 49.8 | Very low | 56.5 | Low | 164 Ų | 164 | 125.7 Ų | 125.7 | 77% | 0.766 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -93.3 | 70.9 | 175.1 | -133.6 | 162.3 | -152 | 0 | 0 | 109.5 | Q167 L173 | Q167-E171 VanDerWaalsContact O-CB 3.29Å; Q167-E171 WeakPolarHBondContact O-CB 3.49Å; Q167-E171 PolarHBondContact O-N 3.24Å; Q167-E171 VanDerWaalsContact O-N 3.1Å; E171-L173 PolarHBondContact O-N 3.09Å |
| 172 | G | 46.4 | Very low | 55.4 | Low | 57 Ų | 57 | 127.1 Ų | 127.1 | 59% | 0.588 | 67% | 0.667 | S | S | * | * | trans | -47.2 | 136.1 | 168.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | E170 | E170-G172 PolarHBondContact O-N 2.86Š| ||
| 173 | L | 47.3 | Very low | 54.1 | Low | 161 Ų | 161 | 126.8 Ų | 126.8 | 84% | 0.843 | 68% | 0.676 | S | S | * | * | trans | -36.9 | 124.8 | 170.7 | -128 | 95.7 | 0 | 0 | 0 | 108.8 | E171 E175 | E171-L173 PolarHBondContact O-N 3.09Å; L173-E175 PolarHBondContact O-N 2.96Å | ||
| 174 | P | 48.5 | Very low | 52.4 | Low | 120 Ų | 120 | 123.5 Ų | 123.5 | 78% | 0.779 | 67% | 0.667 | S | S | * | * | trans | -63.6 | 100.9 | 162.5 | 25.7 | -27.8 | 0 | 0 | 0 | 105.2 | Y176 | P174-Y176 PolarHBondContact O-N 3.32Š| ||
| 175 | E | 41.7 | Very low | 51 | Low | 170 Ų | 170 | 123 Ų | 123 | 79% | 0.794 | 67% | 0.673 | S | S | * | * | trans | -41.3 | 112.9 | 158.9 | -168.7 | 163.9 | -158 | 0 | 0 | 105.3 | L173 T177 | L173-E175 PolarHBondContact O-N 2.96Å; E175-T177 PolarHBondContact O-N 3.01Å | ||
| 176 | Y | 49.6 | Very low | 50.1 | Low | 190 Ų | 190 | 125.7 Ų | 125.7 | 75% | 0.745 | 69% | 0.691 | S | S | * | * | trans | -56 | 91.5 | 176.8 | 172.1 | -95.3 | 0 | 0 | 0 | 106.2 | P174 D178 | P174-Y176 PolarHBondContact O-N 3.32Å; Y176-D178 HydrophobicContact CD1-CB 4.16Å; Y176-D178 HydrophobicContact CE1-CB 3.74Å; Y176-D178 VanDerWaalsContact CE1-OD1 3.24Å; Y176-D178 WeakPolarHBondContact CE1-OD1 3.48Å; Y176-D178 PolarHBondContact O-N 3.03Å; Y176-D178 PolarHBondContact OH-OD1 3.03Å; Y176-D178 VanDerWaalsContact OH-OD1 3.08Å | ||
| 177 | T | 42.9 | Very low | 49.2 | Very low | 115 Ų | 115 | 131 Ų | 131 | 71% | 0.706 | 71% | 0.711 | S | S | * | * | trans | -65.7 | 91.3 | 159.4 | 52 | 0 | 0 | 0 | 0 | 103.1 | E175 D179 | E175-T177 PolarHBondContact O-N 3.01Å; T177-D179 VanDerWaalsContact C-N 3.33Å; T177-D179 PolarHBondContact O-N 3.15Å | ||
| 178 | D | 37.6 | Very low | 49.1 | Very low | 97 Ų | 97 | 130.4 Ų | 130.4 | 52% | 0.519 | 71% | 0.71 | S | S | . | * | trans | -38.5 | 110.3 | 154 | -150.4 | 20.7 | 0 | 0 | 0 | 104.6 | Y176 I180 | Y176-D178 HydrophobicContact CD1-CB 4.16Å; Y176-D178 HydrophobicContact CE1-CB 3.74Å; Y176-D178 VanDerWaalsContact CE1-OD1 3.24Å; Y176-D178 WeakPolarHBondContact CE1-OD1 3.48Å; Y176-D178 PolarHBondContact O-N 3.03Å; Y176-D178 PolarHBondContact OH-OD1 3.03Å; Y176-D178 VanDerWaalsContact OH-OD1 3.08Å; D178-I180 WeakPolarHBondContact O-CG1 3.48Å; D178-I180 PolarHBondContact O-N 3.48Å | ||
| 179 | D | 43.5 | Very low | 49.8 | Very low | 152 Ų | 152 | 126.2 Ų | 126.2 | 81% | 0.813 | 70% | 0.7 | S | S | * | * | trans | -66.5 | 78 | 173.5 | -112.4 | -15.4 | 0 | 0 | 0 | 104.9 | T177 F181 | T177-D179 VanDerWaalsContact C-N 3.33Å; T177-D179 PolarHBondContact O-N 3.15Å; D179-F181 VanDerWaalsContact C-N 3.34Å; D179-F181 PolarHBondContact O-N 2.67Å | ||
| 180 | I | 49 | Very low | 50.7 | Low | 127 Ų | 127 | 123 Ų | 123 | 65% | 0.651 | 69% | 0.693 | S | S | * | * | trans | -51.2 | 107.8 | 166.4 | -67.9 | 166.9 | 0 | 0 | 0 | 103 | D178 S182 | D178-I180 WeakPolarHBondContact O-CG1 3.48Å; D178-I180 PolarHBondContact O-N 3.48Å; I180-S182 WeakPolarHBondContact CG2-OG 3.37Å; I180-S182 WeakPolarHBondContact O-CB 3.5Å; I180-S182 PolarHBondContact O-N 3.25Å; I180-S182 PolarHBondContact O-OG 3.1Å | ||
| 181 | F | 47.6 | Very low | 51.8 | Low | 142 Ų | 142 | 119.5 Ų | 119.5 | 62% | 0.623 | 68% | 0.677 | S | S | * | * | trans | -57.9 | 82.7 | 176.8 | -149.5 | -93.9 | 0 | 0 | 0 | 108.7 | D179 V184 | D179-F181 VanDerWaalsContact C-N 3.34Å; D179-F181 PolarHBondContact O-N 2.67Å; F181-V184 HydrophobicContact CE1-CB 4.14Å; F181-V184 HydrophobicContact CE1-CG2 3.69Å; F181-V184 HydrophobicContact CZ-CG2 4.09Å | ||
| 182 | S | 51.4 | Low | 53.4 | Low | 106 Ų | 106 | 113.8 Ų | 113.8 | 74% | 0.741 | 66% | 0.657 | S | S | * | * | trans | -103.7 | 85.4 | -176.7 | -53 | 0 | 0 | 0 | 0 | 107.1 | I180 | I180-S182 WeakPolarHBondContact CG2-OG 3.37Å; I180-S182 WeakPolarHBondContact O-CB 3.5Å; I180-S182 PolarHBondContact O-N 3.25Å; I180-S182 PolarHBondContact O-OG 3.1Å | ||
| 183 | G | 51.7 | Low | 55.1 | Low | 69 Ų | 69 | 115.1 Ų | 115.1 | 71% | 0.711 | 65% | 0.648 | S | S | * | * | trans | 115.5 | 68.5 | 162.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 184 | V | 45.5 | Very low | 56.8 | Low | 72 Ų | 72 | 111.4 Ų | 111.4 | 44% | 0.436 | 63% | 0.629 | S | S | . | * | trans | -106.5 | 100.2 | 138.7 | 176.9 | 0 | 0 | 0 | 0 | 106.3 | F181 I188 | F181-V184 HydrophobicContact CE1-CB 4.14Å; F181-V184 HydrophobicContact CE1-CG2 3.69Å; F181-V184 HydrophobicContact CZ-CG2 4.09Å; V184-I188 HydrophobicContact CG1-CG2 4.12Å | ||
| 185 | S | 42.6 | Very low | 58.8 | Low | 85 Ų | 85 | 113.4 Ų | 113.4 | 59% | 0.594 | 62% | 0.621 | S | S | * | * | trans | -30.1 | 134.4 | 163.8 | 171.4 | 0 | 0 | 0 | 0 | 112 | D187 | S185-D187 PolarHBondContact O-N 3.08Š| ||
| 186 | N | 52.8 | Low | 61 | Low | 175 Ų | 175 | 110.8 Ų | 110.8 | 94% | 0.936 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -63.3 | 26.7 | 176.6 | -75.5 | -28.4 | 0 | 0 | 0 | 114.5 | ||
| 187 | D | 53.1 | Low | 62.9 | Low | 146 Ų | 146 | 106.6 Ų | 106.6 | 78% | 0.781 | 60% | 0.597 | S | S | * | * | trans | -118 | 19 | -172.4 | -144.4 | 19.8 | 0 | 0 | 0 | 112.8 | S185 | S185-D187 PolarHBondContact O-N 3.08Š| ||
| 188 | I | 58.3 | Low | 65.3 | Low | 98 Ų | 98 | 107.4 Ų | 107.4 | 50% | 0.503 | 59% | 0.591 | S | S | . | * | S | Bend | trans | -124.1 | 126.4 | 173.4 | -134.5 | 87.5 | 0 | 0 | 0 | 109.2 | V184 A192 Q193 | V184-I188 HydrophobicContact CG1-CG2 4.12Å; I188-A192 HydrophobicContact CG1-CB 3.91Å; I188-A192 HydrophobicContact CG2-CB 4.42Å; I188-Q193 HydrophobicContact CG2-CG 3.95Å |
| 189 | G | 73.3 | Confident | 67.9 | Low | 52 Ų | 52 | 105.1 Ų | 105.1 | 54% | 0.536 | 59% | 0.585 | S | S | . | * | trans | -63.2 | 150.7 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | E191 A192 Q193 | G189-E191 PolarHBondContact O-N 3.29Å; G189-E191 VanDerWaalsContact O-N 3.07Å; G189-A192 WeakPolarHBondContact O-CB 3.29Å; G189-A192 PolarHBondContact O-N 2.95Å; G189-Q193 PolarHBondContact O-N 3.45Å | ||
| 190 | T | 77.2 | Confident | 70.3 | Confident | 110 Ų | 110 | 103.2 Ų | 103.2 | 68% | 0.675 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -51.9 | -33.6 | -176.7 | 51.8 | 0 | 0 | 0 | 0 | 114.3 | A192 Q193 I194 | T190-A192 VanDerWaalsContact C-N 3.33Å; T190-A192 PolarHBondContact O-N 3.33Å; T190-Q193 PolarHBondContact O-N 3.36Å; T190-I194 WeakPolarHBondContact O-CG1 3.44Å; T190-I194 PolarHBondContact O-N 3.01Å; T190-I194 VanDerWaalsContact O-N 3.09Å |
| 191 | E | 78.5 | Confident | 72.4 | Confident | 102 Ų | 102 | 102.5 Ų | 102.5 | 48% | 0.477 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63.4 | -34.2 | 175.1 | 176.1 | 57.2 | -158.9 | 0 | 0 | 113 | G189 R195 | G189-E191 PolarHBondContact O-N 3.29Å; G189-E191 VanDerWaalsContact O-N 3.07Å; E191-R195 WeakPolarHBondContact O-CG 3.34Å; E191-R195 PolarHBondContact O-N 2.98Å; E191-R195 IonicContact OE1-CZ 3.37Å; E191-R195 IonicContact OE1-NE 2.93Å; E191-R195 PolarHBondContact OE1-NE 2.87Å; E191-R195 IonicContact OE1-NH2 2.89Å; E191-R195 PolarHBondContact OE1-NH2 3.11Å |
| 192 | A | 82.1 | Confident | 74.7 | Confident | 43 Ų | 43 | 104.7 Ų | 104.7 | 36% | 0.355 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -72.8 | -38 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | I188 G189 T190 R195 F196 | I188-A192 HydrophobicContact CG1-CB 3.91Å; I188-A192 HydrophobicContact CG2-CB 4.42Å; G189-A192 WeakPolarHBondContact O-CB 3.29Å; G189-A192 PolarHBondContact O-N 2.95Å; T190-A192 VanDerWaalsContact C-N 3.33Å; T190-A192 PolarHBondContact O-N 3.33Å; A192-R195 PolarHBondContact O-N 3.21Å; A192-F196 PolarHBondContact O-N 2.86Å |
| 193 | Q | 81.9 | Confident | 76.8 | Confident | 85 Ų | 85 | 103.2 Ų | 103.2 | 40% | 0.397 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63 | -42.3 | 173.4 | -83.5 | 179.2 | -6.8 | 0 | 0 | 112.2 | I188 G189 T190 R195 F196 L197 | I188-Q193 HydrophobicContact CG2-CG 3.95Å; G189-Q193 PolarHBondContact O-N 3.45Å; T190-Q193 PolarHBondContact O-N 3.36Å; Q193-R195 VanDerWaalsContact C-N 3.34Å; Q193-R195 PolarHBondContact O-N 3.45Å; Q193-F196 PolarHBondContact O-N 2.91Å; Q193-L197 WeakPolarHBondContact O-CG 3.47Å; Q193-L197 PolarHBondContact O-N 3.38Å |
| 194 | I | 84.7 | Confident | 78.8 | Confident | 84 Ų | 84 | 105.2 Ų | 105.2 | 43% | 0.431 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63 | -40.5 | 177.2 | -68.1 | 168.5 | 0 | 0 | 0 | 111.3 | T190 K198 | T190-I194 WeakPolarHBondContact O-CG1 3.44Å; T190-I194 PolarHBondContact O-N 3.01Å; T190-I194 VanDerWaalsContact O-N 3.09Å; I194-K198 HydrophobicContact CG2-CD 4.27Å; I194-K198 WeakPolarHBondContact O-CB 3.46Å; I194-K198 WeakPolarHBondContact O-CG 3.25Å; I194-K198 PolarHBondContact O-N 2.82Å |
| 195 | R | 88.9 | Confident | 81.2 | Confident | 162 Ų | 162 | 106 Ų | 106 | 61% | 0.611 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -64.9 | -42.5 | 175 | -73.1 | -179.3 | -152.3 | 175.6 | 6.9 | 112.3 | E191 A192 Q193 K198 A199 | E191-R195 WeakPolarHBondContact O-CG 3.34Å; E191-R195 PolarHBondContact O-N 2.98Å; E191-R195 IonicContact OE1-CZ 3.37Å; E191-R195 IonicContact OE1-NE 2.93Å; E191-R195 PolarHBondContact OE1-NE 2.87Å; E191-R195 IonicContact OE1-NH2 2.89Å; E191-R195 PolarHBondContact OE1-NH2 3.11Å; A192-R195 PolarHBondContact O-N 3.21Å; Q193-R195 VanDerWaalsContact C-N 3.34Å; Q193-R195 PolarHBondContact O-N 3.45Å; R195-K198 PolarHBondContact O-N 3.42Å; R195-A199 WeakPolarHBondContact O-CB 3.41Å; R195-A199 PolarHBondContact O-N 3.36Å |
| 196 | F | 88.8 | Confident | 83.7 | Confident | 115 Ų | 115 | 108.7 Ų | 108.7 | 50% | 0.504 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -61.3 | -48.1 | 176.2 | 175.2 | -98.2 | 0 | 0 | 0 | 111.9 | A192 Q193 K198 A199 K200 | A192-F196 PolarHBondContact O-N 2.86Å; Q193-F196 PolarHBondContact O-N 2.91Å; F196-K198 PolarHBondContact O-N 3.11Å; F196-A199 WeakPolarHBondContact O-CB 3.35Å; F196-A199 PolarHBondContact O-N 3.12Å; F196-A199 VanDerWaalsContact O-N 3.15Å; F196-K200 PolarHBondContact O-N 3.32Å |
| 197 | L | 89.3 | Confident | 85.8 | Confident | 101 Ų | 101 | 105.9 Ų | 105.9 | 53% | 0.529 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.9 | -41.1 | 178 | -71.3 | 172.3 | 0 | 0 | 0 | 112.1 | Q193 A199 K200 L201 | Q193-L197 WeakPolarHBondContact O-CG 3.47Å; Q193-L197 PolarHBondContact O-N 3.38Å; L197-A199 VanDerWaalsContact C-N 3.33Å; L197-A199 PolarHBondContact O-N 3.5Å; L197-K200 PolarHBondContact O-N 3.08Å; L197-L201 WeakPolarHBondContact O-CB 3.4Å; L197-L201 PolarHBondContact O-N 3.19Å |
| 198 | K | 92.6 | Very high | 87.8 | Confident | 133 Ų | 133 | 103.6 Ų | 103.6 | 58% | 0.578 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.6 | -36.8 | 173.3 | -78.7 | 179.1 | 178.4 | 176.2 | 0 | 112.7 | I194 R195 F196 R202 | I194-K198 HydrophobicContact CG2-CD 4.27Å; I194-K198 WeakPolarHBondContact O-CB 3.46Å; I194-K198 WeakPolarHBondContact O-CG 3.25Å; I194-K198 PolarHBondContact O-N 2.82Å; R195-K198 PolarHBondContact O-N 3.42Å; F196-K198 PolarHBondContact O-N 3.11Å; K198-R202 PolarHBondContact O-N 2.94Å |
| 199 | A | 92.5 | Very high | 89.6 | Confident | 49 Ų | 49 | 103 Ų | 103 | 41% | 0.405 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67 | -46.3 | 175 | 0 | 0 | 0 | 0 | 0 | 111 | R195 F196 L197 L201 R202 V203 | R195-A199 WeakPolarHBondContact O-CB 3.41Å; R195-A199 PolarHBondContact O-N 3.36Å; F196-A199 WeakPolarHBondContact O-CB 3.35Å; F196-A199 PolarHBondContact O-N 3.12Å; F196-A199 VanDerWaalsContact O-N 3.15Å; L197-A199 VanDerWaalsContact C-N 3.33Å; L197-A199 PolarHBondContact O-N 3.5Å; A199-L201 PolarHBondContact O-N 3.31Å; A199-R202 PolarHBondContact O-N 3.43Å; A199-V203 WeakPolarHBondContact O-CG2 3.23Å; A199-V203 PolarHBondContact O-N 3.47Å |
| 200 | K | 93.9 | Very high | 90.7 | Very high | 111 Ų | 111 | 105.2 Ų | 105.2 | 48% | 0.483 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.1 | -43.5 | 175.5 | -171 | 174.8 | -177 | 177.9 | 0 | 111.8 | F196 L197 R202 V203 M204 | F196-K200 PolarHBondContact O-N 3.32Å; L197-K200 PolarHBondContact O-N 3.08Å; K200-R202 VanDerWaalsContact C-N 3.33Å; K200-R202 PolarHBondContact O-N 3.12Å; K200-V203 PolarHBondContact O-N 2.89Å; K200-M204 HydrophobicContact CG-SD 4.35Å; K200-M204 WeakPolarHBondContact O-CB 3.32Å; K200-M204 WeakPolarHBondContact O-CG 3.34Å; K200-M204 PolarHBondContact O-N 3.29Å |
| 201 | L | 94.2 | Very high | 91.6 | Very high | 113 Ų | 113 | 103.9 Ų | 103.9 | 59% | 0.592 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.2 | -39.7 | 176.9 | -160.8 | 158.1 | 0 | 0 | 0 | 111.3 | L197 A199 M204 Q205 | L197-L201 WeakPolarHBondContact O-CB 3.4Å; L197-L201 PolarHBondContact O-N 3.19Å; A199-L201 PolarHBondContact O-N 3.31Å; L201-M204 PolarHBondContact O-N 2.92Å; L201-Q205 WeakPolarHBondContact O-CB 3.42Å; L201-Q205 PolarHBondContact O-N 3.44Å |
| 202 | R | 94.9 | Very high | 92.5 | Very high | 188 Ų | 188 | 102.3 Ų | 102.3 | 71% | 0.709 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.4 | -43.8 | 173.8 | -84.7 | -156.4 | -87.4 | -133.6 | 1.8 | 113.2 | K198 A199 K200 M204 Q205 E206 | K198-R202 PolarHBondContact O-N 2.94Å; A199-R202 PolarHBondContact O-N 3.43Å; K200-R202 VanDerWaalsContact C-N 3.33Å; K200-R202 PolarHBondContact O-N 3.12Å; R202-M204 VanDerWaalsContact C-N 3.35Å; R202-Q205 PolarHBondContact O-N 3.48Å; R202-E206 WeakPolarHBondContact O-CB 3.29Å; R202-E206 PolarHBondContact O-N 3.13Å |
| 203 | V | 95.5 | Very high | 93.1 | Very high | 75 Ų | 75 | 103.4 Ų | 103.4 | 46% | 0.455 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.4 | -46.4 | 174.9 | 173 | 0 | 0 | 0 | 0 | 110.2 | A199 K200 Q205 E206 E207 | A199-V203 WeakPolarHBondContact O-CG2 3.23Å; A199-V203 PolarHBondContact O-N 3.47Å; K200-V203 PolarHBondContact O-N 2.89Å; V203-Q205 VanDerWaalsContact C-N 3.33Å; V203-Q205 PolarHBondContact O-N 3.11Å; V203-E206 PolarHBondContact O-N 2.86Å; V203-E207 HydrophobicContact CG1-CG 4.46Å; V203-E207 WeakPolarHBondContact O-CG 3.42Å; V203-E207 PolarHBondContact O-N 3.12Å |
| 204 | M | 95.1 | Very high | 93.9 | Very high | 111 Ų | 111 | 103 Ų | 103 | 55% | 0.547 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.9 | -36.6 | 176.1 | -71.9 | -176.9 | 71.4 | 0 | 0 | 112.9 | K200 L201 R202 L208 | K200-M204 HydrophobicContact CG-SD 4.35Å; K200-M204 WeakPolarHBondContact O-CB 3.32Å; K200-M204 WeakPolarHBondContact O-CG 3.34Å; K200-M204 PolarHBondContact O-N 3.29Å; L201-M204 PolarHBondContact O-N 2.92Å; R202-M204 VanDerWaalsContact C-N 3.35Å; M204-L208 WeakPolarHBondContact O-CB 3.35Å; M204-L208 PolarHBondContact O-N 3.41Å |
| 205 | Q | 95.4 | Very high | 94.4 | Very high | 88 Ų | 88 | 102.6 Ų | 102.6 | 41% | 0.411 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.4 | -42.7 | 175.1 | -175.5 | 64.9 | 55.8 | 0 | 0 | 111.3 | L201 R202 V203 L208 D209 | L201-Q205 WeakPolarHBondContact O-CB 3.42Å; L201-Q205 PolarHBondContact O-N 3.44Å; R202-Q205 PolarHBondContact O-N 3.48Å; V203-Q205 VanDerWaalsContact C-N 3.33Å; V203-Q205 PolarHBondContact O-N 3.11Å; Q205-L208 PolarHBondContact O-N 3.22Å; Q205-D209 PolarHBondContact NE2-OD1 3.26Å; Q205-D209 WeakPolarHBondContact O-CB 3.46Å; Q205-D209 PolarHBondContact O-N 3.49Å |
| 206 | E | 95.6 | Very high | 94.8 | Very high | 141 Ų | 141 | 99.4 Ų | 99.4 | 66% | 0.659 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.9 | -40.3 | 176.6 | -174.3 | 172.1 | -167.6 | 0 | 0 | 111.7 | R202 V203 D209 N210 | R202-E206 WeakPolarHBondContact O-CB 3.29Å; R202-E206 PolarHBondContact O-N 3.13Å; V203-E206 PolarHBondContact O-N 2.86Å; E206-D209 PolarHBondContact O-N 3.4Å; E206-N210 VanDerWaalsContact O-CB 3.22Å; E206-N210 WeakPolarHBondContact O-CB 3.49Å; E206-N210 PolarHBondContact O-N 3.35Å |
| 207 | E | 95.3 | Very high | 95.2 | Very high | 116 Ų | 116 | 99.6 Ų | 99.6 | 54% | 0.542 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.7 | -42.2 | 172.7 | -74.4 | 176 | 174.2 | 0 | 0 | 111.7 | V203 N210 V211 | V203-E207 HydrophobicContact CG1-CG 4.46Å; V203-E207 WeakPolarHBondContact O-CG 3.42Å; V203-E207 PolarHBondContact O-N 3.12Å; E207-N210 PolarHBondContact O-N 2.9Å; E207-V211 WeakPolarHBondContact O-CB 3.44Å; E207-V211 VanDerWaalsContact O-CG2 3.27Å; E207-V211 WeakPolarHBondContact O-CG2 3.34Å; E207-V211 PolarHBondContact O-N 2.89Å |
| 208 | L | 95.4 | Very high | 95.5 | Very high | 99 Ų | 99 | 100 Ų | 100 | 52% | 0.518 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.1 | -47.5 | 175.2 | -176.6 | 65.1 | 0 | 0 | 0 | 111.4 | M204 Q205 N210 V211 V212 | M204-L208 WeakPolarHBondContact O-CB 3.35Å; M204-L208 PolarHBondContact O-N 3.41Å; Q205-L208 PolarHBondContact O-N 3.22Å; L208-N210 VanDerWaalsContact C-N 3.29Å; L208-N210 PolarHBondContact O-N 3.21Å; L208-V211 PolarHBondContact O-N 3.05Å; L208-V212 WeakPolarHBondContact O-CB 3.48Å; L208-V212 VanDerWaalsContact O-CG2 3.28Å; L208-V212 WeakPolarHBondContact O-CG2 3.48Å; L208-V212 PolarHBondContact O-N 3.09Å |
| 209 | D | 96.3 | Very high | 95.8 | Very high | 86 Ų | 86 | 98 Ų | 98 | 46% | 0.46 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63 | -36.8 | 178 | -68.8 | -14.8 | 0 | 0 | 0 | 111.3 | Q205 E206 V212 C213 | Q205-D209 PolarHBondContact NE2-OD1 3.26Å; Q205-D209 WeakPolarHBondContact O-CB 3.46Å; Q205-D209 PolarHBondContact O-N 3.49Å; E206-D209 PolarHBondContact O-N 3.4Å; D209-V212 PolarHBondContact O-N 2.67Å; D209-C213 WeakPolarHBondContact O-CB 3.4Å; D209-C213 PolarHBondContact O-N 3.06Å; D209-C213 PolarHBondContact O-SG 3.27Å |
| 210 | N | 96.6 | Very high | 96 | Very high | 97 Ų | 97 | 100.8 Ų | 100.8 | 52% | 0.519 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66 | -46.9 | 174.6 | -174.2 | 49.1 | 0 | 0 | 0 | 111.5 | E206 E207 L208 V212 C213 E214 | E206-N210 VanDerWaalsContact O-CB 3.22Å; E206-N210 WeakPolarHBondContact O-CB 3.49Å; E206-N210 PolarHBondContact O-N 3.35Å; E207-N210 PolarHBondContact O-N 2.9Å; L208-N210 VanDerWaalsContact C-N 3.29Å; L208-N210 PolarHBondContact O-N 3.21Å; N210-V212 VanDerWaalsContact C-N 3.32Å; N210-V212 PolarHBondContact O-N 3.15Å; N210-C213 WeakPolarHBondContact O-CB 3.36Å; N210-C213 PolarHBondContact O-N 3.3Å; N210-E214 WeakPolarHBondContact O-CG 3.48Å; N210-E214 PolarHBondContact O-N 3.07Å |
| 211 | V | 96.8 | Very high | 96.2 | Very high | 83 Ų | 83 | 100 Ų | 100 | 50% | 0.503 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.5 | -42.4 | 175.1 | 170.3 | 0 | 0 | 0 | 0 | 110.8 | E207 L208 E214 C215 | E207-V211 WeakPolarHBondContact O-CB 3.44Å; E207-V211 VanDerWaalsContact O-CG2 3.27Å; E207-V211 WeakPolarHBondContact O-CG2 3.34Å; E207-V211 PolarHBondContact O-N 2.89Å; L208-V211 PolarHBondContact O-N 3.05Å; V211-E214 PolarHBondContact O-N 3.39Å; V211-C215 WeakPolarHBondContact O-CB 3.19Å; V211-C215 PolarHBondContact O-N 3.15Å; V211-C215 PolarHBondContact O-SG 3.47Å |
| 212 | V | 97.4 | Very high | 96.3 | Very high | 68 Ų | 68 | 99.1 Ų | 99.1 | 41% | 0.412 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.1 | -44.2 | 175.5 | 169.6 | 0 | 0 | 0 | 0 | 111.3 | L208 D209 N210 E214 C215 N216 | L208-V212 WeakPolarHBondContact O-CB 3.48Å; L208-V212 VanDerWaalsContact O-CG2 3.28Å; L208-V212 WeakPolarHBondContact O-CG2 3.48Å; L208-V212 PolarHBondContact O-N 3.09Å; D209-V212 PolarHBondContact O-N 2.67Å; N210-V212 VanDerWaalsContact C-N 3.32Å; N210-V212 PolarHBondContact O-N 3.15Å; V212-E214 PolarHBondContact O-N 3.48Å; V212-C215 PolarHBondContact O-N 3.42Å; V212-N216 VanDerWaalsContact O-CG 3.27Å; V212-N216 PolarHBondContact O-N 3.23Å; V212-N216 PolarHBondContact O-ND2 3.32Å |
| 213 | C | 95.3 | Very high | 96.4 | Very high | 66 Ų | 66 | 95.4 Ų | 95.4 | 45% | 0.446 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59.6 | -45 | 174.4 | -84 | 0 | 0 | 0 | 0 | 112.3 | D209 N210 N216 K217 | D209-C213 WeakPolarHBondContact O-CB 3.4Å; D209-C213 PolarHBondContact O-N 3.06Å; D209-C213 PolarHBondContact O-SG 3.27Å; N210-C213 WeakPolarHBondContact O-CB 3.36Å; N210-C213 PolarHBondContact O-N 3.3Å; C213-N216 PolarHBondContact O-N 3.01Å; C213-K217 WeakPolarHBondContact O-CG 3.3Å; C213-K217 PolarHBondContact O-N 3.44Å |
| 214 | E | 96.8 | Very high | 96.5 | Very high | 78 Ų | 78 | 95.9 Ų | 95.9 | 36% | 0.364 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.6 | -40.5 | 176.7 | -71.1 | -57.7 | 123.8 | 0 | 0 | 112 | N210 V211 V212 N216 K217 K218 | N210-E214 WeakPolarHBondContact O-CG 3.48Å; N210-E214 PolarHBondContact O-N 3.07Å; V211-E214 PolarHBondContact O-N 3.39Å; V212-E214 PolarHBondContact O-N 3.48Å; E214-N216 VanDerWaalsContact C-N 3.33Å; E214-N216 PolarHBondContact O-N 3Å; E214-K217 PolarHBondContact O-N 2.99Å; E214-K217 IonicContact OE1-NZ 2.68Å; E214-K217 PolarHBondContact OE1-NZ 3.4Å; E214-K218 WeakPolarHBondContact O-CB 3.1Å; E214-K218 VanDerWaalsContact O-CG 3.29Å; E214-K218 WeakPolarHBondContact O-CG 3.4Å; E214-K218 PolarHBondContact O-N 2.89Å |
| 215 | C | 96.2 | Very high | 96.6 | Very high | 74 Ų | 74 | 95 Ų | 95 | 50% | 0.5 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -58.6 | -44 | 172.7 | -74.2 | 0 | 0 | 0 | 0 | 111.6 | V211 V212 K218 E219 | V211-C215 WeakPolarHBondContact O-CB 3.19Å; V211-C215 PolarHBondContact O-N 3.15Å; V211-C215 PolarHBondContact O-SG 3.47Å; V212-C215 PolarHBondContact O-N 3.42Å; C215-K218 PolarHBondContact O-N 2.97Å; C215-E219 WeakPolarHBondContact O-CB 3.44Å; C215-E219 PolarHBondContact O-N 3.48Å |
| 216 | N | 96.2 | Very high | 96.7 | Very high | 95 Ų | 95 | 98.4 Ų | 98.4 | 51% | 0.508 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.5 | -43.5 | 177.3 | -69.8 | -26.7 | 0 | 0 | 0 | 111.9 | V212 C213 E214 K218 E219 D220 | V212-N216 VanDerWaalsContact O-CG 3.27Å; V212-N216 PolarHBondContact O-N 3.23Å; V212-N216 PolarHBondContact O-ND2 3.32Å; C213-N216 PolarHBondContact O-N 3.01Å; E214-N216 VanDerWaalsContact C-N 3.33Å; E214-N216 PolarHBondContact O-N 3Å; N216-K218 VanDerWaalsContact C-N 3.3Å; N216-K218 PolarHBondContact O-N 2.86Å; N216-E219 PolarHBondContact O-N 2.96Å; N216-D220 PolarHBondContact O-N 3.33Å |
| 217 | K | 97.6 | Very high | 96.8 | Very high | 119 Ų | 119 | 94 Ų | 94 | 52% | 0.517 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.1 | -41.5 | 174.9 | -70.6 | 172.8 | -169 | 168.3 | 0 | 111.8 | C213 E214 D220 E221 | C213-K217 WeakPolarHBondContact O-CG 3.3Å; C213-K217 PolarHBondContact O-N 3.44Å; E214-K217 PolarHBondContact O-N 2.99Å; E214-K217 IonicContact OE1-NZ 2.68Å; E214-K217 PolarHBondContact OE1-NZ 3.4Å; K217-D220 PolarHBondContact O-N 2.97Å; K217-E221 WeakPolarHBondContact O-CB 3.35Å; K217-E221 PolarHBondContact O-N 3Å |
| 218 | K | 96.9 | Very high | 97 | Very high | 111 Ų | 111 | 92.1 Ų | 92.1 | 48% | 0.483 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -68.1 | -38.2 | 177.4 | -70.6 | -72.2 | 162 | -158.6 | 0 | 111.8 | E214 C215 N216 E221 I222 | E214-K218 WeakPolarHBondContact O-CB 3.1Å; E214-K218 VanDerWaalsContact O-CG 3.29Å; E214-K218 WeakPolarHBondContact O-CG 3.4Å; E214-K218 PolarHBondContact O-N 2.89Å; C215-K218 PolarHBondContact O-N 2.97Å; N216-K218 VanDerWaalsContact C-N 3.3Å; N216-K218 PolarHBondContact O-N 2.86Å; K218-E221 IonicContact NZ-OE2 2.86Å; K218-E221 PolarHBondContact NZ-OE2 3.23Å; K218-E221 PolarHBondContact O-N 3.5Å; K218-I222 WeakPolarHBondContact O-CB 3.31Å; K218-I222 WeakPolarHBondContact O-CD1 3.34Å; K218-I222 WeakPolarHBondContact O-CG1 3.42Å; K218-I222 PolarHBondContact O-N 3.48Å |
| 219 | E | 97.2 | Very high | 97.1 | Very high | 90 Ų | 90 | 91.2 Ų | 91.2 | 42% | 0.421 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.4 | -45.4 | 173.5 | -177.9 | 57.9 | -146.5 | 0 | 0 | 111.4 | C215 N216 E221 I222 Q223 | C215-E219 WeakPolarHBondContact O-CB 3.44Å; C215-E219 PolarHBondContact O-N 3.48Å; N216-E219 PolarHBondContact O-N 2.96Å; E219-E221 VanDerWaalsContact C-N 3.32Å; E219-E221 PolarHBondContact O-N 3.42Å; E219-I222 PolarHBondContact O-N 3.39Å; E219-Q223 WeakPolarHBondContact O-CG 3.5Å; E219-Q223 PolarHBondContact O-N 2.93Å; E219-Q223 PolarHBondContact OE1-NE2 2.96Å; E219-Q223 VanDerWaalsContact OE1-NE2 3.08Å |
| 220 | D | 97.3 | Very high | 97.2 | Very high | 108 Ų | 108 | 93.1 Ų | 93.1 | 58% | 0.578 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -60.4 | -42 | 175.1 | -71.7 | -23.6 | 0 | 0 | 0 | 111.8 | N216 K217 Q223 N224 | N216-D220 PolarHBondContact O-N 3.33Å; K217-D220 PolarHBondContact O-N 2.97Å; D220-Q223 PolarHBondContact O-N 3.41Å; D220-N224 WeakPolarHBondContact O-CB 3.42Å; D220-N224 PolarHBondContact O-N 3.27Å |
| 221 | E | 97.6 | Very high | 97.2 | Very high | 94 Ų | 94 | 94.7 Ų | 94.7 | 44% | 0.439 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64 | -42.6 | 175.9 | -171.7 | 169.4 | -151 | 0 | 0 | 111.6 | K217 K218 E219 N224 L225 | K217-E221 WeakPolarHBondContact O-CB 3.35Å; K217-E221 PolarHBondContact O-N 3Å; K218-E221 IonicContact NZ-OE2 2.86Å; K218-E221 PolarHBondContact NZ-OE2 3.23Å; K218-E221 PolarHBondContact O-N 3.5Å; E219-E221 VanDerWaalsContact C-N 3.32Å; E219-E221 PolarHBondContact O-N 3.42Å; E221-N224 PolarHBondContact O-N 3.33Å; E221-L225 HydrophobicContact CG-CD1 4.32Å; E221-L225 WeakPolarHBondContact O-CB 3.42Å; E221-L225 VanDerWaalsContact O-CG 3.31Å; E221-L225 WeakPolarHBondContact O-CG 3.31Å; E221-L225 PolarHBondContact O-N 3.37Å |
| 222 | I | 96.8 | Very high | 97.2 | Very high | 94 Ų | 94 | 97.4 Ų | 97.4 | 48% | 0.482 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.1 | -45.3 | 174.4 | -72.8 | 164 | 0 | 0 | 0 | 110.7 | K218 E219 N224 L225 K226 | K218-I222 WeakPolarHBondContact O-CB 3.31Å; K218-I222 WeakPolarHBondContact O-CD1 3.34Å; K218-I222 WeakPolarHBondContact O-CG1 3.42Å; K218-I222 PolarHBondContact O-N 3.48Å; E219-I222 PolarHBondContact O-N 3.39Å; I222-N224 VanDerWaalsContact C-N 3.34Å; I222-N224 PolarHBondContact O-N 3.48Å; I222-L225 PolarHBondContact O-N 3.1Å; I222-K226 VanDerWaalsContact O-CB 3.28Å; I222-K226 WeakPolarHBondContact O-CB 3.47Å; I222-K226 PolarHBondContact O-N 3.03Å |
| 223 | Q | 97.8 | Very high | 97.3 | Very high | 111 Ų | 111 | 99.8 Ų | 99.8 | 52% | 0.519 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.7 | -41 | 177.8 | -71.3 | -170.3 | 14.5 | 0 | 0 | 111.8 | E219 D220 K226 S227 | E219-Q223 WeakPolarHBondContact O-CG 3.5Å; E219-Q223 PolarHBondContact O-N 2.93Å; E219-Q223 PolarHBondContact OE1-NE2 2.96Å; E219-Q223 VanDerWaalsContact OE1-NE2 3.08Å; D220-Q223 PolarHBondContact O-N 3.41Å; Q223-K226 PolarHBondContact O-N 3.43Å; Q223-S227 PolarHBondContact O-N 2.99Å |
| 224 | N | 97.8 | Very high | 97.4 | Very high | 85 Ų | 85 | 101.4 Ų | 101.4 | 46% | 0.455 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.8 | -49.2 | 174.9 | -177.4 | 37.3 | 0 | 0 | 0 | 111.6 | D220 E221 I222 K226 S227 Q228 | D220-N224 WeakPolarHBondContact O-CB 3.42Å; D220-N224 PolarHBondContact O-N 3.27Å; E221-N224 PolarHBondContact O-N 3.33Å; I222-N224 VanDerWaalsContact C-N 3.34Å; I222-N224 PolarHBondContact O-N 3.48Å; N224-K226 VanDerWaalsContact C-N 3.32Å; N224-K226 PolarHBondContact O-N 3.46Å; N224-S227 WeakPolarHBondContact O-CB 3.5Å; N224-S227 PolarHBondContact O-N 3.43Å; N224-S227 VanDerWaalsContact O-N 3.13Å; N224-S227 PolarHBondContact O-OG 2.84Å; N224-Q228 PolarHBondContact ND2-NE2 2.88Å; N224-Q228 PolarHBondContact O-N 2.91Å |
| 225 | L | 97.4 | Very high | 97.4 | Very high | 93 Ų | 93 | 100.8 Ų | 100.8 | 49% | 0.487 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.5 | -42.6 | 177.3 | -73.3 | 173.5 | 0 | 0 | 0 | 111.6 | E221 I222 S227 Q228 V229 | E221-L225 HydrophobicContact CG-CD1 4.32Å; E221-L225 WeakPolarHBondContact O-CB 3.42Å; E221-L225 VanDerWaalsContact O-CG 3.31Å; E221-L225 WeakPolarHBondContact O-CG 3.31Å; E221-L225 PolarHBondContact O-N 3.37Å; I222-L225 PolarHBondContact O-N 3.1Å; L225-S227 VanDerWaalsContact C-N 3.31Å; L225-S227 PolarHBondContact O-N 2.94Å; L225-Q228 WeakPolarHBondContact O-CB 3.39Å; L225-Q228 PolarHBondContact O-N 3.26Å; L225-Q228 VanDerWaalsContact O-N 3.12Å; L225-V229 WeakPolarHBondContact O-CG2 3.42Å; L225-V229 PolarHBondContact O-N 2.87Å |
| 226 | K | 97.7 | Very high | 97.5 | Very high | 159 Ų | 159 | 103.2 Ų | 103.2 | 69% | 0.691 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -60.2 | -40.3 | 175.1 | -173.3 | 177 | -177.4 | 177 | 0 | 112.2 | I222 Q223 N224 Q228 V229 K230 | I222-K226 VanDerWaalsContact O-CB 3.28Å; I222-K226 WeakPolarHBondContact O-CB 3.47Å; I222-K226 PolarHBondContact O-N 3.03Å; Q223-K226 PolarHBondContact O-N 3.43Å; N224-K226 VanDerWaalsContact C-N 3.32Å; N224-K226 PolarHBondContact O-N 3.46Å; K226-Q228 VanDerWaalsContact C-N 3.33Å; K226-V229 PolarHBondContact O-N 3.43Å; K226-K230 PolarHBondContact O-N 3.48Å; K226-K230 VanDerWaalsContact O-N 3.08Å |
| 227 | S | 97.5 | Very high | 97.6 | Very high | 49 Ų | 49 | 103.5 Ų | 103.5 | 34% | 0.343 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.7 | -36 | 175.5 | 85 | 0 | 0 | 0 | 0 | 112.4 | Q223 N224 L225 K231 | Q223-S227 PolarHBondContact O-N 2.99Å; N224-S227 WeakPolarHBondContact O-CB 3.5Å; N224-S227 PolarHBondContact O-N 3.43Å; N224-S227 VanDerWaalsContact O-N 3.13Å; N224-S227 PolarHBondContact O-OG 2.84Å; L225-S227 VanDerWaalsContact C-N 3.31Å; L225-S227 PolarHBondContact O-N 2.94Å; S227-K231 WeakPolarHBondContact O-CG 3.5Å; S227-K231 PolarHBondContact O-N 3.26Å; S227-K231 VanDerWaalsContact O-N 3.12Å |
| 228 | Q | 98.1 | Very high | 97.6 | Very high | 75 Ų | 75 | 104 Ų | 104 | 35% | 0.35 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -69.2 | -45.7 | 175.7 | -72.2 | -177.3 | 53.1 | 0 | 0 | 111.6 | N224 L225 K226 K230 K231 F232 | N224-Q228 PolarHBondContact ND2-NE2 2.88Å; N224-Q228 PolarHBondContact O-N 2.91Å; L225-Q228 WeakPolarHBondContact O-CB 3.39Å; L225-Q228 PolarHBondContact O-N 3.26Å; L225-Q228 VanDerWaalsContact O-N 3.12Å; K226-Q228 VanDerWaalsContact C-N 3.33Å; Q228-K230 VanDerWaalsContact C-N 3.29Å; Q228-K230 PolarHBondContact O-N 2.87Å; Q228-K231 WeakPolarHBondContact O-CB 3.3Å; Q228-K231 PolarHBondContact O-N 3.37Å; Q228-K231 VanDerWaalsContact O-N 3.12Å; Q228-F232 HydrophobicContact CB-CE2 4.27Å; Q228-F232 WeakPolarHBondContact O-CD2 3.49Å; Q228-F232 PolarHBondContact O-N 3.28Å |
| 229 | V | 97.6 | Very high | 97.7 | Very high | 81 Ų | 81 | 104.7 Ų | 104.7 | 49% | 0.491 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -55.3 | -47.1 | 175.3 | 170.8 | 0 | 0 | 0 | 0 | 110.4 | L225 K226 K231 F232 E233 | L225-V229 WeakPolarHBondContact O-CG2 3.42Å; L225-V229 PolarHBondContact O-N 2.87Å; K226-V229 PolarHBondContact O-N 3.43Å; V229-K231 VanDerWaalsContact C-N 3.35Å; V229-K231 PolarHBondContact O-N 2.9Å; V229-F232 PolarHBondContact O-N 3.22Å; V229-E233 HydrophobicContact CG1-CG 4.4Å; V229-E233 WeakPolarHBondContact O-CG 3.35Å; V229-E233 PolarHBondContact O-N 2.83Å |
| 230 | K | 98.1 | Very high | 97.7 | Very high | 125 Ų | 125 | 103.7 Ų | 103.7 | 54% | 0.543 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.4 | -41.6 | 177.6 | -171.8 | 178.6 | 177 | -175.3 | 0 | 112.7 | K226 Q228 E233 E234 | K226-K230 PolarHBondContact O-N 3.48Å; K226-K230 VanDerWaalsContact O-N 3.08Å; Q228-K230 VanDerWaalsContact C-N 3.29Å; Q228-K230 PolarHBondContact O-N 2.87Å; K230-E233 PolarHBondContact O-N 3.37Å; K230-E234 VanDerWaalsContact CE-OE1 3.26Å; K230-E234 WeakPolarHBondContact CE-OE1 3.43Å; K230-E234 WeakPolarHBondContact O-CG 3.41Å; K230-E234 PolarHBondContact O-N 2.78Å |
| 231 | K | 97.9 | Very high | 97.8 | Very high | 131 Ų | 131 | 106.6 Ų | 106.6 | 57% | 0.57 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62.4 | -44.7 | 175.5 | -73.7 | 173.3 | -177.5 | 176 | 0 | 111.5 | S227 Q228 V229 E234 D235 | S227-K231 WeakPolarHBondContact O-CG 3.5Å; S227-K231 PolarHBondContact O-N 3.26Å; S227-K231 VanDerWaalsContact O-N 3.12Å; Q228-K231 WeakPolarHBondContact O-CB 3.3Å; Q228-K231 PolarHBondContact O-N 3.37Å; Q228-K231 VanDerWaalsContact O-N 3.12Å; V229-K231 VanDerWaalsContact C-N 3.35Å; V229-K231 PolarHBondContact O-N 2.9Å; K231-E234 PolarHBondContact O-N 3.04Å; K231-D235 WeakPolarHBondContact O-CB 3.38Å; K231-D235 PolarHBondContact O-N 3.06Å |
| 232 | F | 97.1 | Very high | 97.8 | Very high | 139 Ų | 139 | 105.5 Ų | 105.5 | 61% | 0.61 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -65.4 | -37.8 | 177.4 | -69.9 | -52.4 | 0 | 0 | 0 | 112.6 | Q228 V229 D235 F236 | Q228-F232 HydrophobicContact CB-CE2 4.27Å; Q228-F232 WeakPolarHBondContact O-CD2 3.49Å; Q228-F232 PolarHBondContact O-N 3.28Å; V229-F232 PolarHBondContact O-N 3.22Å; F232-D235 PolarHBondContact O-N 3.39Å; F232-F236 VanDerWaalsContact O-CB 3.29Å; F232-F236 WeakPolarHBondContact O-CB 3.49Å; F232-F236 PolarHBondContact O-N 3.05Å |
| 233 | E | 97.6 | Very high | 97.8 | Very high | 118 Ų | 118 | 104.4 Ų | 104.4 | 55% | 0.551 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.3 | -44.8 | 173.6 | -75.5 | 175.5 | 170.9 | 0 | 0 | 112 | V229 K230 D235 F236 M237 | V229-E233 HydrophobicContact CG1-CG 4.4Å; V229-E233 WeakPolarHBondContact O-CG 3.35Å; V229-E233 PolarHBondContact O-N 2.83Å; K230-E233 PolarHBondContact O-N 3.37Å; E233-D235 VanDerWaalsContact C-N 3.33Å; E233-D235 PolarHBondContact O-N 2.85Å; E233-F236 PolarHBondContact O-N 3.24Å; E233-M237 VanDerWaalsContact O-CG 3.28Å; E233-M237 WeakPolarHBondContact O-CG 3.35Å; E233-M237 PolarHBondContact O-N 3.35Å |
| 234 | E | 97.8 | Very high | 97.9 | Very high | 100 Ų | 100 | 103 Ų | 103 | 47% | 0.467 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.1 | -40.6 | 176 | -73.6 | 175.7 | -166.9 | 0 | 0 | 111.8 | K230 K231 R238 | K230-E234 VanDerWaalsContact CE-OE1 3.26Å; K230-E234 WeakPolarHBondContact CE-OE1 3.43Å; K230-E234 WeakPolarHBondContact O-CG 3.41Å; K230-E234 PolarHBondContact O-N 2.78Å; K231-E234 PolarHBondContact O-N 3.04Å; E234-R238 WeakPolarHBondContact O-CB 3.5Å; E234-R238 PolarHBondContact O-N 3.5Å |
| 235 | D | 97.6 | Very high | 97.9 | Very high | 66 Ų | 66 | 104.3 Ų | 104.3 | 35% | 0.353 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -70 | -39.9 | 176.3 | -77.6 | -19.7 | 0 | 0 | 0 | 112.8 | K231 F232 E233 M237 R238 Q239 | K231-D235 WeakPolarHBondContact O-CB 3.38Å; K231-D235 PolarHBondContact O-N 3.06Å; F232-D235 PolarHBondContact O-N 3.39Å; E233-D235 VanDerWaalsContact C-N 3.33Å; E233-D235 PolarHBondContact O-N 2.85Å; D235-M237 VanDerWaalsContact C-N 3.35Å; D235-M237 PolarHBondContact O-N 3.23Å; D235-R238 WeakPolarHBondContact O-CB 3.42Å; D235-R238 PolarHBondContact O-N 2.98Å; D235-R238 IonicContact OD1-CZ 2.83Å; D235-R238 IonicContact OD1-NE 3.38Å; D235-R238 PolarHBondContact OD1-NE 3.44Å; D235-R238 VanDerWaalsContact OD1-NE 3.15Å; D235-R238 IonicContact OD1-NH2 3.15Å; D235-R238 PolarHBondContact OD1-NH2 3.46Å; D235-Q239 WeakPolarHBondContact O-CB 3.42Å; D235-Q239 WeakPolarHBondContact O-CG 3.35Å; D235-Q239 PolarHBondContact O-N 3.45Å |
| 236 | F | 97.9 | Very high | 97.9 | Very high | 124 Ų | 124 | 105.1 Ų | 105.1 | 54% | 0.544 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.2 | -48.1 | 172.5 | 177 | -97.1 | 0 | 0 | 0 | 110.7 | F232 E233 R238 Q239 Q240 | F232-F236 VanDerWaalsContact O-CB 3.29Å; F232-F236 WeakPolarHBondContact O-CB 3.49Å; F232-F236 PolarHBondContact O-N 3.05Å; E233-F236 PolarHBondContact O-N 3.24Å; F236-R238 VanDerWaalsContact C-N 3.3Å; F236-R238 PolarHBondContact O-N 2.96Å; F236-Q239 PolarHBondContact O-N 3.25Å; F236-Q240 WeakPolarHBondContact O-CB 3.45Å; F236-Q240 PolarHBondContact O-N 2.95Å |
| 237 | M | 98.2 | Very high | 97.9 | Very high | 101 Ų | 101 | 103.1 Ų | 103.1 | 50% | 0.498 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.5 | -35.9 | 177.6 | -69.6 | -62.9 | -73.5 | 0 | 0 | 112.4 | E233 D235 R241 | E233-M237 VanDerWaalsContact O-CG 3.28Å; E233-M237 WeakPolarHBondContact O-CG 3.35Å; E233-M237 PolarHBondContact O-N 3.35Å; D235-M237 VanDerWaalsContact C-N 3.35Å; D235-M237 PolarHBondContact O-N 3.23Å; M237-R241 WeakPolarHBondContact O-CG 3.26Å; M237-R241 PolarHBondContact O-N 2.87Å |
| 238 | R | 98.2 | Very high | 98 | Very high | 131 Ų | 131 | 104 Ų | 104 | 49% | 0.494 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.4 | -48.6 | 175 | -167.1 | -164.7 | -37 | -77.8 | -6.1 | 111.3 | E234 D235 F236 R241 T242 | E234-R238 WeakPolarHBondContact O-CB 3.5Å; E234-R238 PolarHBondContact O-N 3.5Å; D235-R238 WeakPolarHBondContact O-CB 3.42Å; D235-R238 PolarHBondContact O-N 2.98Å; D235-R238 IonicContact OD1-CZ 2.83Å; D235-R238 IonicContact OD1-NE 3.38Å; D235-R238 PolarHBondContact OD1-NE 3.44Å; D235-R238 VanDerWaalsContact OD1-NE 3.15Å; D235-R238 IonicContact OD1-NH2 3.15Å; D235-R238 PolarHBondContact OD1-NH2 3.46Å; F236-R238 VanDerWaalsContact C-N 3.3Å; F236-R238 PolarHBondContact O-N 2.96Å; R238-R241 PolarHBondContact O-N 3.44Å; R238-T242 PolarHBondContact O-N 3Å; R238-T242 PolarHBondContact O-OG1 3.41Å |
| 239 | Q | 98 | Very high | 98 | Very high | 124 Ų | 124 | 104.7 Ų | 104.7 | 58% | 0.579 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63 | -42.6 | 177.9 | -72.5 | 178.7 | -0.9 | 0 | 0 | 111.4 | D235 F236 R241 T242 I243 | D235-Q239 WeakPolarHBondContact O-CB 3.42Å; D235-Q239 WeakPolarHBondContact O-CG 3.35Å; D235-Q239 PolarHBondContact O-N 3.45Å; F236-Q239 PolarHBondContact O-N 3.25Å; Q239-R241 VanDerWaalsContact C-N 3.3Å; Q239-R241 PolarHBondContact O-N 3.44Å; Q239-T242 WeakPolarHBondContact O-CB 3.47Å; Q239-T242 PolarHBondContact O-N 3.46Å; Q239-I243 WeakPolarHBondContact O-CG1 3.46Å; Q239-I243 PolarHBondContact O-N 3.43Å |
| 240 | Q | 98.2 | Very high | 98 | Very high | 69 Ų | 69 | 105.2 Ų | 105.2 | 32% | 0.322 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.2 | -39.7 | 177.8 | -172 | 62.1 | 61.4 | 0 | 0 | 112.3 | F236 I243 N244 | F236-Q240 WeakPolarHBondContact O-CB 3.45Å; F236-Q240 PolarHBondContact O-N 2.95Å; Q240-I243 PolarHBondContact O-N 3.21Å; Q240-N244 PolarHBondContact NE2-OD1 3.48Å; Q240-N244 PolarHBondContact O-N 2.74Å; Q240-N244 PolarHBondContact O-OD1 3.33Å |
| 241 | R | 98.3 | Very high | 98.1 | Very high | 169 Ų | 169 | 104.2 Ų | 104.2 | 64% | 0.638 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.2 | -41.5 | 174.1 | -69 | 175.1 | -154.9 | 152.8 | 6.1 | 112 | M237 R238 Q239 N244 M245 | M237-R241 WeakPolarHBondContact O-CG 3.26Å; M237-R241 PolarHBondContact O-N 2.87Å; R238-R241 PolarHBondContact O-N 3.44Å; Q239-R241 VanDerWaalsContact C-N 3.3Å; Q239-R241 PolarHBondContact O-N 3.44Å; R241-N244 PolarHBondContact O-N 2.91Å; R241-M245 WeakPolarHBondContact O-CB 3.38Å; R241-M245 PolarHBondContact O-N 3.27Å |
| 242 | T | 97.9 | Very high | 98.1 | Very high | 71 Ų | 71 | 104.5 Ų | 104.5 | 44% | 0.436 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.2 | -43.1 | 176.9 | -58.6 | 0 | 0 | 0 | 0 | 111.5 | R238 Q239 M245 Q246 | R238-T242 PolarHBondContact O-N 3Å; R238-T242 PolarHBondContact O-OG1 3.41Å; Q239-T242 WeakPolarHBondContact O-CB 3.47Å; Q239-T242 PolarHBondContact O-N 3.46Å; T242-M245 PolarHBondContact O-N 2.68Å; T242-Q246 HydrophobicContact CG2-CG 4.4Å; T242-Q246 WeakPolarHBondContact O-CB 3.46Å; T242-Q246 WeakPolarHBondContact O-CG 3.42Å; T242-Q246 PolarHBondContact O-N 3.28Å |
| 243 | I | 98.1 | Very high | 98.1 | Very high | 72 Ų | 72 | 105.3 Ų | 105.3 | 37% | 0.369 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.6 | -49.5 | 176 | -70.1 | 167.5 | 0 | 0 | 0 | 110.2 | Q239 Q240 M245 Q246 Q247 | Q239-I243 WeakPolarHBondContact O-CG1 3.46Å; Q239-I243 PolarHBondContact O-N 3.43Å; Q240-I243 PolarHBondContact O-N 3.21Å; I243-M245 VanDerWaalsContact C-N 3.3Å; I243-M245 PolarHBondContact O-N 2.96Å; I243-Q246 PolarHBondContact O-N 3.18Å; I243-Q247 HydrophobicContact CG2-CG 4.32Å; I243-Q247 WeakPolarHBondContact O-CB 3.31Å; I243-Q247 WeakPolarHBondContact O-CG 3.35Å; I243-Q247 PolarHBondContact O-N 2.88Å |
| 244 | N | 98.3 | Very high | 98.2 | Very high | 81 Ų | 81 | 104.6 Ų | 104.6 | 43% | 0.433 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.8 | -39.5 | 179.4 | -67 | -4.4 | 0 | 0 | 0 | 111.7 | Q240 R241 S248 | Q240-N244 PolarHBondContact NE2-OD1 3.48Å; Q240-N244 PolarHBondContact O-N 2.74Å; Q240-N244 PolarHBondContact O-OD1 3.33Å; R241-N244 PolarHBondContact O-N 2.91Å; N244-S248 PolarHBondContact O-N 3.4Å; N244-S248 VanDerWaalsContact O-N 3.08Å |
| 245 | M | 98.3 | Very high | 98.2 | Very high | 112 Ų | 112 | 103 Ų | 103 | 55% | 0.552 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -63.2 | -48 | 174.9 | -178.1 | 64.8 | 70.2 | 0 | 0 | 111.4 | R241 T242 I243 S248 Q249 | R241-M245 WeakPolarHBondContact O-CB 3.38Å; R241-M245 PolarHBondContact O-N 3.27Å; T242-M245 PolarHBondContact O-N 2.68Å; I243-M245 VanDerWaalsContact C-N 3.3Å; I243-M245 PolarHBondContact O-N 2.96Å; M245-S248 PolarHBondContact O-N 3.34Å; M245-S248 PolarHBondContact O-OG 3.36Å; M245-Q249 WeakPolarHBondContact O-CG 3.5Å; M245-Q249 PolarHBondContact O-N 2.91Å; M245-Q249 VanDerWaalsContact O-N 3.11Å |
| 246 | Q | 97.9 | Very high | 98.2 | Very high | 111 Ų | 111 | 103.9 Ų | 103.9 | 52% | 0.519 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.3 | -41.5 | 178.7 | -73.6 | 175.3 | -18.5 | 0 | 0 | 112 | T242 I243 S248 Q249 V250 | T242-Q246 HydrophobicContact CG2-CG 4.4Å; T242-Q246 WeakPolarHBondContact O-CB 3.46Å; T242-Q246 WeakPolarHBondContact O-CG 3.42Å; T242-Q246 PolarHBondContact O-N 3.28Å; I243-Q246 PolarHBondContact O-N 3.18Å; Q246-S248 VanDerWaalsContact C-N 3.32Å; Q246-S248 PolarHBondContact O-N 2.93Å; Q246-Q249 WeakPolarHBondContact O-CB 3.45Å; Q246-Q249 PolarHBondContact O-N 2.92Å; Q246-Q249 VanDerWaalsContact O-N 3.09Å; Q246-V250 WeakPolarHBondContact O-CG2 3.27Å; Q246-V250 PolarHBondContact O-N 2.94Å |
| 247 | Q | 98.3 | Very high | 98.2 | Very high | 116 Ų | 116 | 104.5 Ų | 104.5 | 54% | 0.542 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -56.5 | -45.6 | 173.3 | -77.6 | 175.5 | -13.2 | 0 | 0 | 111.4 | I243 Q249 V250 E251 | I243-Q247 HydrophobicContact CG2-CG 4.32Å; I243-Q247 WeakPolarHBondContact O-CB 3.31Å; I243-Q247 WeakPolarHBondContact O-CG 3.35Å; I243-Q247 PolarHBondContact O-N 2.88Å; Q247-Q249 VanDerWaalsContact C-N 3.28Å; Q247-Q249 PolarHBondContact O-N 2.93Å; Q247-V250 PolarHBondContact O-N 3.47Å; Q247-E251 PolarHBondContact O-N 3.37Å |
| 248 | S | 98.3 | Very high | 98.3 | Very high | 68 Ų | 68 | 103.6 Ų | 103.6 | 48% | 0.476 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.6 | -34.6 | 176.5 | 77.4 | 0 | 0 | 0 | 0 | 113.1 | N244 M245 Q246 K252 | N244-S248 PolarHBondContact O-N 3.4Å; N244-S248 VanDerWaalsContact O-N 3.08Å; M245-S248 PolarHBondContact O-N 3.34Å; M245-S248 PolarHBondContact O-OG 3.36Å; Q246-S248 VanDerWaalsContact C-N 3.32Å; Q246-S248 PolarHBondContact O-N 2.93Å; S248-K252 WeakPolarHBondContact O-CB 3.5Å; S248-K252 PolarHBondContact O-N 3.42Å; S248-K252 VanDerWaalsContact O-N 3.12Å |
| 249 | Q | 98.5 | Very high | 98.3 | Very high | 89 Ų | 89 | 103.2 Ų | 103.2 | 42% | 0.416 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -70.9 | -41.8 | 175.8 | -69.6 | -179.5 | 25.6 | 0 | 0 | 111.9 | M245 Q246 Q247 E251 K252 Y253 | M245-Q249 WeakPolarHBondContact O-CG 3.5Å; M245-Q249 PolarHBondContact O-N 2.91Å; M245-Q249 VanDerWaalsContact O-N 3.11Å; Q246-Q249 WeakPolarHBondContact O-CB 3.45Å; Q246-Q249 PolarHBondContact O-N 2.92Å; Q246-Q249 VanDerWaalsContact O-N 3.09Å; Q247-Q249 VanDerWaalsContact C-N 3.28Å; Q247-Q249 PolarHBondContact O-N 2.93Å; Q249-E251 PolarHBondContact O-N 3.23Å; Q249-K252 WeakPolarHBondContact O-CB 3.39Å; Q249-K252 PolarHBondContact O-N 3.4Å; Q249-Y253 HydrophobicContact CB-CD2 4.49Å; Q249-Y253 HydrophobicContact CB-CE2 4.33Å; Q249-Y253 WeakPolarHBondContact O-CD2 3.41Å; Q249-Y253 PolarHBondContact O-N 3.43Å |
| 250 | V | 98.4 | Very high | 98.3 | Very high | 92 Ų | 92 | 99.8 Ų | 99.8 | 56% | 0.558 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -59.5 | -47 | 176.8 | 169.8 | 0 | 0 | 0 | 0 | 110.6 | Q246 Q247 K252 Y253 K254 | Q246-V250 WeakPolarHBondContact O-CG2 3.27Å; Q246-V250 PolarHBondContact O-N 2.94Å; Q247-V250 PolarHBondContact O-N 3.47Å; V250-K252 VanDerWaalsContact C-N 3.32Å; V250-K252 PolarHBondContact O-N 2.86Å; V250-Y253 PolarHBondContact O-N 2.98Å; V250-K254 WeakPolarHBondContact O-CB 3.41Å; V250-K254 PolarHBondContact O-N 3.07Å |
| 251 | E | 98.4 | Very high | 98.3 | Very high | 105 Ų | 105 | 100.2 Ų | 100.2 | 49% | 0.491 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.4 | -37.8 | 177.1 | -69.3 | -57.5 | 146.9 | 0 | 0 | 112.3 | Q247 Q249 K254 T255 | Q247-E251 PolarHBondContact O-N 3.37Å; Q249-E251 PolarHBondContact O-N 3.23Å; E251-K254 PolarHBondContact O-N 2.91Å; E251-T255 WeakPolarHBondContact O-CG2 3.41Å; E251-T255 PolarHBondContact O-N 3.36Å; E251-T255 PolarHBondContact O-OG1 3.22Å |
| 252 | K | 98.6 | Very high | 98.3 | Very high | 136 Ų | 136 | 99 Ų | 99 | 59% | 0.591 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63 | -43.7 | 173.5 | -173.9 | -178.8 | 178 | -176.9 | 0 | 112.2 | S248 Q249 V250 T255 L256 | S248-K252 WeakPolarHBondContact O-CB 3.5Å; S248-K252 PolarHBondContact O-N 3.42Å; S248-K252 VanDerWaalsContact O-N 3.12Å; Q249-K252 WeakPolarHBondContact O-CB 3.39Å; Q249-K252 PolarHBondContact O-N 3.4Å; V250-K252 VanDerWaalsContact C-N 3.32Å; V250-K252 PolarHBondContact O-N 2.86Å; K252-T255 PolarHBondContact O-OG1 3.16Å; K252-L256 HydrophobicContact CG-CD1 4.34Å; K252-L256 WeakPolarHBondContact O-CG 3.49Å; K252-L256 PolarHBondContact O-N 2.91Å; K252-L256 VanDerWaalsContact O-N 3.13Å |
| 253 | Y | 98.2 | Very high | 98.3 | Very high | 156 Ų | 156 | 102.6 Ų | 102.6 | 61% | 0.612 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -70.3 | -34.5 | 178.1 | -72.4 | -57.9 | 0 | 0 | 0 | 112.4 | Q249 V250 L256 F257 | Q249-Y253 HydrophobicContact CB-CD2 4.49Å; Q249-Y253 HydrophobicContact CB-CE2 4.33Å; Q249-Y253 WeakPolarHBondContact O-CD2 3.41Å; Q249-Y253 PolarHBondContact O-N 3.43Å; V250-Y253 PolarHBondContact O-N 2.98Å; Y253-L256 HydrophobicContact CD1-CD1 4.47Å; Y253-L256 PolarHBondContact O-N 2.93Å; Y253-F257 VanDerWaalsContact O-CB 3.31Å; Y253-F257 WeakPolarHBondContact O-CB 3.35Å; Y253-F257 PolarHBondContact O-N 2.9Å |
| 254 | K | 98.6 | Very high | 98.3 | Very high | 104 Ų | 104 | 102.7 Ų | 102.7 | 45% | 0.452 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.1 | -48.2 | 174.8 | -175.8 | -179 | 173.9 | -171.2 | 0 | 111.8 | V250 E251 F257 E258 | V250-K254 WeakPolarHBondContact O-CB 3.41Å; V250-K254 PolarHBondContact O-N 3.07Å; E251-K254 PolarHBondContact O-N 2.91Å; K254-F257 PolarHBondContact O-N 3.4Å; K254-E258 WeakPolarHBondContact CE-OE1 3.22Å; K254-E258 WeakPolarHBondContact O-CG 3.29Å; K254-E258 PolarHBondContact O-N 3.1Å |
| 255 | T | 98.3 | Very high | 98.3 | Very high | 65 Ų | 65 | 102.5 Ų | 102.5 | 40% | 0.399 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.5 | -44.6 | 176.6 | 48.5 | 0 | 0 | 0 | 0 | 112.2 | E251 K252 F257 E258 E259 | E251-T255 WeakPolarHBondContact O-CG2 3.41Å; E251-T255 PolarHBondContact O-N 3.36Å; E251-T255 PolarHBondContact O-OG1 3.22Å; K252-T255 PolarHBondContact O-OG1 3.16Å; T255-F257 VanDerWaalsContact C-N 3.34Å; T255-F257 PolarHBondContact O-N 3.02Å; T255-E258 PolarHBondContact O-N 3.28Å; T255-E259 WeakPolarHBondContact O-CG 3.45Å; T255-E259 PolarHBondContact O-N 3.2Å |
| 256 | L | 98.3 | Very high | 98.3 | Very high | 85 Ų | 85 | 98.5 Ų | 98.5 | 45% | 0.445 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.7 | -39.9 | 175 | -73.1 | 172.4 | 0 | 0 | 0 | 112.8 | K252 Y253 E259 A260 | K252-L256 HydrophobicContact CG-CD1 4.34Å; K252-L256 WeakPolarHBondContact O-CG 3.49Å; K252-L256 PolarHBondContact O-N 2.91Å; K252-L256 VanDerWaalsContact O-N 3.13Å; Y253-L256 HydrophobicContact CD1-CD1 4.47Å; Y253-L256 PolarHBondContact O-N 2.93Å; L256-E259 PolarHBondContact O-N 2.98Å; L256-A260 WeakPolarHBondContact O-CB 3.39Å; L256-A260 PolarHBondContact O-N 2.85Å |
| 257 | F | 97.9 | Very high | 98.3 | Very high | 137 Ų | 137 | 97.4 Ų | 97.4 | 60% | 0.601 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64 | -46.2 | 176.2 | 175.8 | -98 | 0 | 0 | 0 | 111.4 | Y253 K254 T255 E259 A260 N261 | Y253-F257 VanDerWaalsContact O-CB 3.31Å; Y253-F257 WeakPolarHBondContact O-CB 3.35Å; Y253-F257 PolarHBondContact O-N 2.9Å; K254-F257 PolarHBondContact O-N 3.4Å; T255-F257 VanDerWaalsContact C-N 3.34Å; T255-F257 PolarHBondContact O-N 3.02Å; F257-E259 VanDerWaalsContact C-N 3.34Å; F257-E259 PolarHBondContact O-N 3.39Å; F257-A260 PolarHBondContact O-N 2.93Å; F257-N261 WeakPolarHBondContact O-CB 3.43Å; F257-N261 PolarHBondContact O-N 3.27Å |
| 258 | E | 98.4 | Very high | 98.3 | Very high | 83 Ų | 83 | 98 Ų | 98 | 39% | 0.388 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.3 | -40 | 177 | -72.4 | 174.2 | -165.4 | 0 | 0 | 112.3 | K254 T255 N261 K262 | K254-E258 WeakPolarHBondContact CE-OE1 3.22Å; K254-E258 WeakPolarHBondContact O-CG 3.29Å; K254-E258 PolarHBondContact O-N 3.1Å; T255-E258 PolarHBondContact O-N 3.28Å; E258-N261 PolarHBondContact O-N 3.44Å; E258-K262 VanDerWaalsContact O-CG 3.3Å; E258-K262 WeakPolarHBondContact O-CG 3.27Å; E258-K262 PolarHBondContact O-N 3.48Å |
| 259 | E | 98.3 | Very high | 98.3 | Very high | 122 Ų | 122 | 101.6 Ų | 101.6 | 57% | 0.57 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -64.7 | -44.8 | 174.5 | -74.8 | 178.6 | -174.5 | 0 | 0 | 112.4 | T255 L256 F257 N261 K262 K263 | T255-E259 WeakPolarHBondContact O-CG 3.45Å; T255-E259 PolarHBondContact O-N 3.2Å; L256-E259 PolarHBondContact O-N 2.98Å; F257-E259 VanDerWaalsContact C-N 3.34Å; F257-E259 PolarHBondContact O-N 3.39Å; E259-N261 VanDerWaalsContact C-N 3.3Å; E259-N261 PolarHBondContact O-N 3.22Å; E259-K262 PolarHBondContact O-N 3Å; E259-K263 PolarHBondContact O-N 3.43Å |
| 260 | A | 98.1 | Very high | 98.3 | Very high | 53 Ų | 53 | 103.4 Ų | 103.4 | 44% | 0.438 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.4 | -41.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L256 F257 K263 C264 | L256-A260 WeakPolarHBondContact O-CB 3.39Å; L256-A260 PolarHBondContact O-N 2.85Å; F257-A260 PolarHBondContact O-N 2.93Å; A260-K263 WeakPolarHBondContact O-CB 3.36Å; A260-K263 PolarHBondContact O-N 3.45Å; A260-C264 PolarHBondContact O-N 3.06Å; A260-C264 PolarHBondContact O-SG 3.08Å; A260-C264 VanDerWaalsContact O-SG 3.37Å |
| 261 | N | 98.3 | Very high | 98.3 | Very high | 78 Ų | 78 | 104.2 Ų | 104.2 | 42% | 0.417 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.5 | -44.9 | 179.4 | -147.1 | 36 | 0 | 0 | 0 | 111.6 | F257 E258 E259 K263 C264 D265 | F257-N261 WeakPolarHBondContact O-CB 3.43Å; F257-N261 PolarHBondContact O-N 3.27Å; E258-N261 PolarHBondContact O-N 3.44Å; E259-N261 VanDerWaalsContact C-N 3.3Å; E259-N261 PolarHBondContact O-N 3.22Å; N261-K263 PolarHBondContact O-N 3.49Å; N261-C264 WeakPolarHBondContact O-CB 3.41Å; N261-C264 PolarHBondContact O-N 2.83Å; N261-C264 VanDerWaalsContact O-N 3.1Å; N261-D265 PolarHBondContact O-N 2.94Å |
| 262 | K | 98.4 | Very high | 98.3 | Very high | 143 Ų | 143 | 102.3 Ų | 102.3 | 62% | 0.622 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -57.7 | -38 | 172.8 | -73.3 | 169.3 | -174.9 | 167.6 | 0 | 112.3 | E258 E259 G266 | E258-K262 VanDerWaalsContact O-CG 3.3Å; E258-K262 WeakPolarHBondContact O-CG 3.27Å; E258-K262 PolarHBondContact O-N 3.48Å; E259-K262 PolarHBondContact O-N 3Å; K262-G266 PolarHBondContact O-N 3.05Å |
| 263 | K | 98.5 | Very high | 98.3 | Very high | 147 Ų | 147 | 97.8 Ų | 97.8 | 64% | 0.639 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -68.2 | -41.9 | 176 | -172.1 | 179.4 | 179.9 | -178.2 | 0 | 111.6 | E259 A260 N261 G266 L267 | E259-K263 PolarHBondContact O-N 3.43Å; A260-K263 WeakPolarHBondContact O-CB 3.36Å; A260-K263 PolarHBondContact O-N 3.45Å; N261-K263 PolarHBondContact O-N 3.49Å; K263-G266 PolarHBondContact O-N 3.33Å; K263-L267 HydrophobicContact CG-CD1 4.34Å; K263-L267 WeakPolarHBondContact O-CG 3.35Å; K263-L267 PolarHBondContact O-N 2.97Å |
| 264 | C | 98.1 | Very high | 98.3 | Very high | 73 Ų | 73 | 94.4 Ų | 94.4 | 49% | 0.493 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.3 | -47.8 | 173.9 | -72.1 | 0 | 0 | 0 | 0 | 111.3 | A260 N261 G266 L267 Q268 | A260-C264 PolarHBondContact O-N 3.06Å; A260-C264 PolarHBondContact O-SG 3.08Å; A260-C264 VanDerWaalsContact O-SG 3.37Å; N261-C264 WeakPolarHBondContact O-CB 3.41Å; N261-C264 PolarHBondContact O-N 2.83Å; N261-C264 VanDerWaalsContact O-N 3.1Å; C264-G266 VanDerWaalsContact C-N 3.33Å; C264-G266 PolarHBondContact O-N 2.65Å; C264-L267 PolarHBondContact O-N 3.3Å; C264-Q268 WeakPolarHBondContact O-CB 3.45Å; C264-Q268 PolarHBondContact O-N 2.98Å |
| 265 | D | 98.3 | Very high | 98.3 | Very high | 78 Ų | 78 | 95.4 Ų | 95.4 | 42% | 0.417 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59 | -44.1 | 176.8 | -68.1 | -20.4 | 0 | 0 | 0 | 111.6 | N261 Q268 Q269 | N261-D265 PolarHBondContact O-N 2.94Å; D265-Q268 PolarHBondContact O-N 2.92Å; D265-Q269 WeakPolarHBondContact O-CG 3.39Å; D265-Q269 PolarHBondContact O-N 3.37Å |
| 266 | G | 98.4 | Very high | 98.3 | Very high | 28 Ų | 28 | 99.6 Ų | 99.6 | 29% | 0.289 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.4 | -42.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | K262 K263 C264 Q269 Q270 | K262-G266 PolarHBondContact O-N 3.05Å; K263-G266 PolarHBondContact O-N 3.33Å; C264-G266 VanDerWaalsContact C-N 3.33Å; C264-G266 PolarHBondContact O-N 2.65Å; G266-Q269 PolarHBondContact O-N 3.47Å; G266-Q270 WeakPolarHBondContact O-CG 3.37Å; G266-Q270 PolarHBondContact O-N 3.09Å; G266-Q270 VanDerWaalsContact O-N 3.09Å |
| 267 | L | 98.1 | Very high | 98.3 | Very high | 88 Ų | 88 | 100.6 Ų | 100.6 | 46% | 0.461 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.4 | -38.2 | 175.3 | -72.7 | 173 | 0 | 0 | 0 | 111.8 | K263 C264 Q270 L271 | K263-L267 HydrophobicContact CG-CD1 4.34Å; K263-L267 WeakPolarHBondContact O-CG 3.35Å; K263-L267 PolarHBondContact O-N 2.97Å; C264-L267 PolarHBondContact O-N 3.3Å; L267-Q270 PolarHBondContact O-N 2.89Å; L267-L271 PolarHBondContact O-N 3.48Å |
| 268 | Q | 98.4 | Very high | 98.3 | Very high | 127 Ų | 127 | 98 Ų | 98 | 59% | 0.593 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.6 | -42.1 | 177.2 | -173.6 | 160.7 | 6.3 | 0 | 0 | 111.6 | C264 D265 Q270 L271 S272 | C264-Q268 WeakPolarHBondContact O-CB 3.45Å; C264-Q268 PolarHBondContact O-N 2.98Å; D265-Q268 PolarHBondContact O-N 2.92Å; Q268-Q270 VanDerWaalsContact C-N 3.35Å; Q268-Q270 PolarHBondContact O-N 3.28Å; Q268-L271 PolarHBondContact O-N 2.96Å; Q268-S272 PolarHBondContact O-N 2.89Å; Q268-S272 PolarHBondContact O-OG 3.36Å |
| 269 | Q | 98.5 | Very high | 98.3 | Very high | 144 Ų | 144 | 98.7 Ų | 98.7 | 67% | 0.673 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62 | -41.1 | 173.4 | -71.2 | 176 | 8.4 | 0 | 0 | 112.3 | D265 G266 S272 S273 | D265-Q269 WeakPolarHBondContact O-CG 3.39Å; D265-Q269 PolarHBondContact O-N 3.37Å; G266-Q269 PolarHBondContact O-N 3.47Å; Q269-S272 PolarHBondContact O-N 3.17Å; Q269-S273 PolarHBondContact O-N 3.48Å |
| 270 | Q | 98.4 | Very high | 98.3 | Very high | 127 Ų | 127 | 96.8 Ų | 96.8 | 59% | 0.593 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.9 | -45.2 | 175.9 | -73.6 | 179.7 | 3.6 | 0 | 0 | 111.9 | G266 L267 Q268 S272 S273 V274 | G266-Q270 WeakPolarHBondContact O-CG 3.37Å; G266-Q270 PolarHBondContact O-N 3.09Å; G266-Q270 VanDerWaalsContact O-N 3.09Å; L267-Q270 PolarHBondContact O-N 2.89Å; Q268-Q270 VanDerWaalsContact C-N 3.35Å; Q268-Q270 PolarHBondContact O-N 3.28Å; Q270-S272 PolarHBondContact O-N 3.48Å; Q270-S273 PolarHBondContact O-N 3.21Å; Q270-V274 WeakPolarHBondContact O-CG2 3.31Å; Q270-V274 PolarHBondContact O-N 2.99Å |
| 271 | L | 98.1 | Very high | 98.3 | Very high | 109 Ų | 109 | 101.3 Ų | 101.3 | 57% | 0.571 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -56.2 | -50.8 | 174.8 | -82.3 | 169.8 | 0 | 0 | 0 | 111 | L267 Q268 S273 V274 E275 | L267-L271 PolarHBondContact O-N 3.48Å; Q268-L271 PolarHBondContact O-N 2.96Å; L271-S273 VanDerWaalsContact C-N 3.28Å; L271-S273 PolarHBondContact O-N 2.86Å; L271-V274 PolarHBondContact O-N 3.18Å; L271-E275 WeakPolarHBondContact O-CB 3.35Å; L271-E275 VanDerWaalsContact O-CG 3.31Å; L271-E275 WeakPolarHBondContact O-CG 3.49Å; L271-E275 PolarHBondContact O-N 3.19Å |
| 272 | S | 98.4 | Very high | 98.3 | Very high | 65 Ų | 65 | 103.9 Ų | 103.9 | 46% | 0.455 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.7 | -34.3 | 177.7 | -60.9 | 0 | 0 | 0 | 0 | 113.1 | Q268 Q269 Q270 R276 | Q268-S272 PolarHBondContact O-N 2.89Å; Q268-S272 PolarHBondContact O-OG 3.36Å; Q269-S272 PolarHBondContact O-N 3.17Å; Q270-S272 PolarHBondContact O-N 3.48Å; S272-R276 WeakPolarHBondContact O-CB 3.35Å; S272-R276 PolarHBondContact O-N 3.46Å |
| 273 | S | 98.4 | Very high | 98.3 | Very high | 41 Ų | 41 | 105.6 Ų | 105.6 | 29% | 0.287 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.6 | -45.7 | 174.7 | -167.8 | 0 | 0 | 0 | 0 | 111.8 | Q269 Q270 L271 R276 E277 | Q269-S273 PolarHBondContact O-N 3.48Å; Q270-S273 PolarHBondContact O-N 3.21Å; L271-S273 VanDerWaalsContact C-N 3.28Å; L271-S273 PolarHBondContact O-N 2.86Å; S273-R276 PolarHBondContact O-N 3.26Å; S273-R276 PolarHBondContact OG-NH2 2.85Å; S273-E277 WeakPolarHBondContact O-CG 3.48Å; S273-E277 PolarHBondContact O-N 3.44Å |
| 274 | V | 98.3 | Very high | 98.3 | Very high | 86 Ų | 86 | 103.2 Ų | 103.2 | 52% | 0.521 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65 | -41 | 179 | 171.6 | 0 | 0 | 0 | 0 | 111.1 | Q270 L271 R276 E277 L278 | Q270-V274 WeakPolarHBondContact O-CG2 3.31Å; Q270-V274 PolarHBondContact O-N 2.99Å; L271-V274 PolarHBondContact O-N 3.18Å; V274-R276 VanDerWaalsContact C-N 3.34Å; V274-R276 PolarHBondContact O-N 2.99Å; V274-E277 PolarHBondContact O-N 3.33Å; V274-L278 WeakPolarHBondContact O-CB 3.45Å; V274-L278 PolarHBondContact O-N 3.3Å |
| 275 | E | 98.4 | Very high | 98.3 | Very high | 125 Ų | 125 | 106.3 Ų | 106.3 | 58% | 0.584 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -58.9 | -44.7 | 175.2 | -75.1 | 175.2 | 154.2 | 0 | 0 | 111.8 | L271 L278 E279 | L271-E275 WeakPolarHBondContact O-CB 3.35Å; L271-E275 VanDerWaalsContact O-CG 3.31Å; L271-E275 WeakPolarHBondContact O-CG 3.49Å; L271-E275 PolarHBondContact O-N 3.19Å; E275-L278 PolarHBondContact O-N 2.9Å; E275-E279 PolarHBondContact O-N 3.37Å |
| 276 | R | 98.5 | Very high | 98.3 | Very high | 152 Ų | 152 | 109.6 Ų | 109.6 | 57% | 0.574 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -65.2 | -39.8 | 176.7 | -177 | -179.8 | 56.2 | 103.1 | 9.4 | 112.2 | S272 S273 V274 N280 | S272-R276 WeakPolarHBondContact O-CB 3.35Å; S272-R276 PolarHBondContact O-N 3.46Å; S273-R276 PolarHBondContact O-N 3.26Å; S273-R276 PolarHBondContact OG-NH2 2.85Å; V274-R276 VanDerWaalsContact C-N 3.34Å; V274-R276 PolarHBondContact O-N 2.99Å; R276-N280 WeakPolarHBondContact O-CB 3.33Å; R276-N280 PolarHBondContact O-N 3.28Å; R276-N280 PolarHBondContact O-ND2 2.96Å |
| 277 | E | 98.1 | Very high | 98.3 | Very high | 107 Ų | 107 | 114.2 Ų | 114.2 | 50% | 0.5 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64.7 | -41.9 | 174.1 | -75.4 | 178.8 | -157.8 | 0 | 0 | 112 | S273 V274 N280 K281 | S273-E277 WeakPolarHBondContact O-CG 3.48Å; S273-E277 PolarHBondContact O-N 3.44Å; V274-E277 PolarHBondContact O-N 3.33Å; E277-N280 WeakPolarHBondContact O-CB 3.48Å; E277-N280 PolarHBondContact O-N 3.49Å; E277-K281 WeakPolarHBondContact O-CG 3.4Å; E277-K281 PolarHBondContact O-N 2.87Å |
| 278 | L | 98.2 | Very high | 98.3 | Very high | 81 Ų | 81 | 112.8 Ų | 112.8 | 42% | 0.424 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62 | -44.6 | 177.6 | -168.4 | 156.8 | 0 | 0 | 0 | 111 | V274 E275 N280 K281 R282 | V274-L278 WeakPolarHBondContact O-CB 3.45Å; V274-L278 PolarHBondContact O-N 3.3Å; E275-L278 PolarHBondContact O-N 2.9Å; L278-N280 PolarHBondContact O-N 3.06Å; L278-K281 PolarHBondContact O-N 3.48Å; L278-R282 HydrophobicContact CD2-CG 4.14Å; L278-R282 PolarHBondContact O-N 3.34Å |
| 279 | E | 98.4 | Very high | 98.3 | Very high | 99 Ų | 99 | 109.2 Ų | 109.2 | 46% | 0.463 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.1 | -40.9 | 176.7 | -171 | 53 | -143.3 | 0 | 0 | 111.8 | E275 K281 R282 R283 | E275-E279 PolarHBondContact O-N 3.37Å; E279-K281 PolarHBondContact O-N 2.9Å; E279-R282 PolarHBondContact O-N 3.44Å; E279-R282 IonicContact OE2-NH1 3.47Å; E279-R283 PolarHBondContact O-N 3.23Å |
| 280 | N | 98.4 | Very high | 98.3 | Very high | 82 Ų | 82 | 106 Ų | 106 | 44% | 0.439 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.3 | -43 | 173.1 | -79.7 | -26.6 | 0 | 0 | 0 | 112.3 | R276 E277 L278 R283 L284 | R276-N280 WeakPolarHBondContact O-CB 3.33Å; R276-N280 PolarHBondContact O-N 3.28Å; R276-N280 PolarHBondContact O-ND2 2.96Å; E277-N280 WeakPolarHBondContact O-CB 3.48Å; E277-N280 PolarHBondContact O-N 3.49Å; L278-N280 PolarHBondContact O-N 3.06Å; N280-R283 PolarHBondContact O-N 3.31Å; N280-L284 WeakPolarHBondContact O-CG 3.42Å; N280-L284 PolarHBondContact O-N 3.47Å |
| 281 | K | 98.3 | Very high | 98.3 | Very high | 147 Ų | 147 | 103.4 Ų | 103.4 | 64% | 0.639 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65 | -40.7 | 176.4 | -67.5 | -63.6 | -178.4 | -177.6 | 0 | 111.9 | E277 L278 E279 R283 L284 Q285 | E277-K281 WeakPolarHBondContact O-CG 3.4Å; E277-K281 PolarHBondContact O-N 2.87Å; L278-K281 PolarHBondContact O-N 3.48Å; E279-K281 PolarHBondContact O-N 2.9Å; K281-R283 VanDerWaalsContact C-N 3.35Å; K281-R283 PolarHBondContact O-N 3.3Å; K281-L284 PolarHBondContact O-N 3.34Å; K281-Q285 WeakPolarHBondContact O-CB 3.49Å; K281-Q285 PolarHBondContact O-N 2.84Å |
| 282 | R | 98.5 | Very high | 98.2 | Very high | 133 Ų | 133 | 104.3 Ų | 104.3 | 50% | 0.502 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60 | -43.3 | 173.2 | -80.5 | -177.9 | 175.9 | 150.3 | 0.6 | 112 | L278 E279 Q285 K286 | L278-R282 HydrophobicContact CD2-CG 4.14Å; L278-R282 PolarHBondContact O-N 3.34Å; E279-R282 PolarHBondContact O-N 3.44Å; E279-R282 IonicContact OE2-NH1 3.47Å; R282-Q285 PolarHBondContact O-N 2.86Å; R282-K286 WeakPolarHBondContact O-CG 3.37Å; R282-K286 PolarHBondContact O-N 3.35Å |
| 283 | R | 98.4 | Very high | 98.3 | Very high | 179 Ų | 179 | 104.3 Ų | 104.3 | 68% | 0.675 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -62 | -46.9 | 176.5 | -176.4 | 179.8 | 174 | -176.9 | -0.7 | 111.7 | E279 N280 K281 Q285 K286 Q287 | E279-R283 PolarHBondContact O-N 3.23Å; N280-R283 PolarHBondContact O-N 3.31Å; K281-R283 VanDerWaalsContact C-N 3.35Å; K281-R283 PolarHBondContact O-N 3.3Å; R283-Q285 VanDerWaalsContact C-N 3.32Å; R283-Q285 PolarHBondContact O-N 2.99Å; R283-K286 PolarHBondContact O-N 3.05Å; R283-Q287 PolarHBondContact O-N 3.3Å |
| 284 | L | 98.4 | Very high | 98.2 | Very high | 96 Ų | 96 | 104.3 Ų | 104.3 | 50% | 0.503 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62 | -40 | 176.6 | -73 | 171.4 | 0 | 0 | 0 | 111.9 | N280 K281 Q287 A288 | N280-L284 WeakPolarHBondContact O-CG 3.42Å; N280-L284 PolarHBondContact O-N 3.47Å; K281-L284 PolarHBondContact O-N 3.34Å; L284-Q287 PolarHBondContact O-N 2.94Å; L284-A288 WeakPolarHBondContact O-CB 3.45Å; L284-A288 PolarHBondContact O-N 3.28Å |
| 285 | Q | 98.1 | Very high | 98.2 | Very high | 138 Ų | 138 | 103.6 Ų | 103.6 | 65% | 0.645 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.6 | -44.9 | 175.6 | -174.8 | -175.7 | 17.8 | 0 | 0 | 111.8 | K281 R282 R283 Q287 A288 A289 | K281-Q285 WeakPolarHBondContact O-CB 3.49Å; K281-Q285 PolarHBondContact O-N 2.84Å; R282-Q285 PolarHBondContact O-N 2.86Å; R283-Q285 VanDerWaalsContact C-N 3.32Å; R283-Q285 PolarHBondContact O-N 2.99Å; Q285-Q287 VanDerWaalsContact C-N 3.32Å; Q285-Q287 PolarHBondContact O-N 3.45Å; Q285-A288 PolarHBondContact O-N 2.7Å; Q285-A289 WeakPolarHBondContact O-CB 3.35Å; Q285-A289 PolarHBondContact O-N 3Å |
| 286 | K | 98.4 | Very high | 98.2 | Very high | 148 Ų | 148 | 102.7 Ų | 102.7 | 64% | 0.643 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.7 | -41.9 | 175.9 | -73.3 | 176.7 | -179.4 | 175.8 | 0 | 111.8 | R282 R283 A289 S290 | R282-K286 WeakPolarHBondContact O-CG 3.37Å; R282-K286 PolarHBondContact O-N 3.35Å; R283-K286 PolarHBondContact O-N 3.05Å; K286-A289 PolarHBondContact O-N 3.25Å; K286-S290 PolarHBondContact O-N 3.5Å; K286-S290 PolarHBondContact O-OG 3.3Å |
| 287 | Q | 98.1 | Very high | 98.2 | Very high | 124 Ų | 124 | 100 Ų | 100 | 58% | 0.579 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -66.9 | -40.6 | 176.7 | -173.4 | 178.7 | 15 | 0 | 0 | 112.3 | R283 L284 Q285 S290 S291 | R283-Q287 PolarHBondContact O-N 3.3Å; L284-Q287 PolarHBondContact O-N 2.94Å; Q285-Q287 VanDerWaalsContact C-N 3.32Å; Q285-Q287 PolarHBondContact O-N 3.45Å; Q287-S290 PolarHBondContact O-OG 2.98Å; Q287-S291 WeakPolarHBondContact O-CB 3.41Å; Q287-S291 PolarHBondContact O-N 3.03Å |
| 288 | A | 97.9 | Very high | 98.2 | Very high | 58 Ų | 58 | 103 Ų | 103 | 48% | 0.479 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65 | -43.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | L284 Q285 S290 S291 Q292 | L284-A288 WeakPolarHBondContact O-CB 3.45Å; L284-A288 PolarHBondContact O-N 3.28Å; Q285-A288 PolarHBondContact O-N 2.7Å; A288-S290 PolarHBondContact O-N 2.91Å; A288-S291 PolarHBondContact O-N 3.12Å; A288-Q292 VanDerWaalsContact O-CB 3.3Å; A288-Q292 WeakPolarHBondContact O-CB 3.34Å; A288-Q292 PolarHBondContact O-N 3.4Å |
| 289 | A | 98.2 | Very high | 98.3 | Very high | 52 Ų | 52 | 104 Ų | 104 | 43% | 0.43 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.4 | -41.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q285 K286 Q292 S293 | Q285-A289 WeakPolarHBondContact O-CB 3.35Å; Q285-A289 PolarHBondContact O-N 3Å; K286-A289 PolarHBondContact O-N 3.25Å; A289-Q292 PolarHBondContact O-N 2.8Å; A289-S293 WeakPolarHBondContact O-CB 3.47Å; A289-S293 PolarHBondContact O-N 3.49Å |
| 290 | S | 97.8 | Very high | 98.3 | Very high | 77 Ų | 77 | 102.7 Ų | 102.7 | 54% | 0.538 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -68 | -40 | 176.4 | 67 | 0 | 0 | 0 | 0 | 112.2 | K286 Q287 A288 S293 A294 | K286-S290 PolarHBondContact O-N 3.5Å; K286-S290 PolarHBondContact O-OG 3.3Å; Q287-S290 PolarHBondContact O-OG 2.98Å; A288-S290 PolarHBondContact O-N 2.91Å; S290-S293 PolarHBondContact O-N 3.06Å; S290-A294 WeakPolarHBondContact O-CB 3.41Å; S290-A294 PolarHBondContact O-N 3.43Å |
| 291 | S | 97.9 | Very high | 98.3 | Very high | 72 Ų | 72 | 106.2 Ų | 106.2 | 50% | 0.503 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.1 | -43.9 | 172.9 | -175.5 | 0 | 0 | 0 | 0 | 111.8 | Q287 A288 A294 T295 | Q287-S291 WeakPolarHBondContact O-CB 3.41Å; Q287-S291 PolarHBondContact O-N 3.03Å; A288-S291 PolarHBondContact O-N 3.12Å; S291-A294 PolarHBondContact O-N 3.37Å; S291-T295 WeakPolarHBondContact O-CG2 3.49Å; S291-T295 PolarHBondContact O-N 2.85Å; S291-T295 PolarHBondContact O-OG1 3.18Å |
| 292 | Q | 97.9 | Very high | 98.2 | Very high | 129 Ų | 129 | 101.7 Ų | 101.7 | 60% | 0.603 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -61.9 | -48.3 | 177.9 | -176.7 | 177.9 | 0.5 | 0 | 0 | 111.2 | A288 A289 A294 T295 E296 | A288-Q292 VanDerWaalsContact O-CB 3.3Å; A288-Q292 WeakPolarHBondContact O-CB 3.34Å; A288-Q292 PolarHBondContact O-N 3.4Å; A289-Q292 PolarHBondContact O-N 2.8Å; Q292-A294 VanDerWaalsContact C-N 3.3Å; Q292-A294 PolarHBondContact O-N 2.96Å; Q292-T295 WeakPolarHBondContact CA-OG1 3.36Å; Q292-T295 PolarHBondContact O-N 3.32Å; Q292-T295 VanDerWaalsContact O-N 3.12Å; Q292-T295 PolarHBondContact O-OG1 2.88Å; Q292-E296 WeakPolarHBondContact O-CB 3.42Å; Q292-E296 PolarHBondContact O-N 3.32Å |
| 293 | S | 98.5 | Very high | 98.2 | Very high | 64 Ų | 64 | 99.7 Ų | 99.7 | 45% | 0.448 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -58.1 | -42.4 | 175.6 | 178.2 | 0 | 0 | 0 | 0 | 111.7 | A289 S290 T295 E296 V297 | A289-S293 WeakPolarHBondContact O-CB 3.47Å; A289-S293 PolarHBondContact O-N 3.49Å; S290-S293 PolarHBondContact O-N 3.06Å; S293-T295 PolarHBondContact O-N 3.46Å; S293-E296 PolarHBondContact O-N 3.13Å; S293-V297 WeakPolarHBondContact O-CG2 3.3Å; S293-V297 PolarHBondContact O-N 3.49Å |
| 294 | A | 98.3 | Very high | 98.2 | Very high | 42 Ų | 42 | 97.4 Ų | 97.4 | 35% | 0.347 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.9 | -39.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | S290 S291 Q292 R298 | S290-A294 WeakPolarHBondContact O-CB 3.41Å; S290-A294 PolarHBondContact O-N 3.43Å; S291-A294 PolarHBondContact O-N 3.37Å; Q292-A294 VanDerWaalsContact C-N 3.3Å; Q292-A294 PolarHBondContact O-N 2.96Å; A294-R298 WeakPolarHBondContact O-CG 3.34Å; A294-R298 PolarHBondContact O-N 3.4Å |
| 295 | T | 97.9 | Very high | 98.2 | Very high | 71 Ų | 71 | 97.1 Ų | 97.1 | 44% | 0.436 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -69 | -36.6 | 175.4 | 51.5 | 0 | 0 | 0 | 0 | 112.6 | S291 Q292 S293 R298 L299 | S291-T295 WeakPolarHBondContact O-CG2 3.49Å; S291-T295 PolarHBondContact O-N 2.85Å; S291-T295 PolarHBondContact O-OG1 3.18Å; Q292-T295 WeakPolarHBondContact CA-OG1 3.36Å; Q292-T295 PolarHBondContact O-N 3.32Å; Q292-T295 VanDerWaalsContact O-N 3.12Å; Q292-T295 PolarHBondContact O-OG1 2.88Å; S293-T295 PolarHBondContact O-N 3.46Å; T295-R298 PolarHBondContact O-N 3.22Å; T295-L299 WeakPolarHBondContact O-CB 3.49Å; T295-L299 PolarHBondContact O-N 3.32Å |
| 296 | E | 98.4 | Very high | 98.2 | Very high | 106 Ų | 106 | 93.2 Ų | 93.2 | 50% | 0.495 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.5 | -43.5 | 177.3 | -175 | 175.3 | -171.1 | 0 | 0 | 111.4 | Q292 S293 R298 L299 N300 | Q292-E296 WeakPolarHBondContact O-CB 3.42Å; Q292-E296 PolarHBondContact O-N 3.32Å; S293-E296 PolarHBondContact O-N 3.13Å; E296-R298 VanDerWaalsContact C-N 3.34Å; E296-R298 PolarHBondContact O-N 2.89Å; E296-L299 WeakPolarHBondContact O-CB 3.39Å; E296-L299 PolarHBondContact O-N 3.28Å; E296-N300 WeakPolarHBondContact O-CB 3.45Å; E296-N300 VanDerWaalsContact O-CG 3.31Å; E296-N300 PolarHBondContact O-N 3.46Å; E296-N300 PolarHBondContact O-ND2 3.46Å |
| 297 | V | 98.7 | Very high | 98.2 | Very high | 95 Ų | 95 | 92.4 Ų | 92.4 | 58% | 0.576 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.6 | -43.3 | 174.7 | 172.5 | 0 | 0 | 0 | 0 | 111.6 | S293 L299 N300 R301 | S293-V297 WeakPolarHBondContact O-CG2 3.3Å; S293-V297 PolarHBondContact O-N 3.49Å; V297-L299 VanDerWaalsContact C-N 3.35Å; V297-N300 PolarHBondContact O-N 2.99Å; V297-R301 PolarHBondContact O-N 2.88Å |
| 298 | R | 98.4 | Very high | 98.2 | Very high | 170 Ų | 170 | 92.2 Ų | 92.2 | 64% | 0.642 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.2 | -39.7 | 176.9 | -69.5 | 177 | -165.8 | 159.1 | 4.6 | 111.9 | A294 T295 E296 A302 | A294-R298 WeakPolarHBondContact O-CG 3.34Å; A294-R298 PolarHBondContact O-N 3.4Å; T295-R298 PolarHBondContact O-N 3.22Å; E296-R298 VanDerWaalsContact C-N 3.34Å; E296-R298 PolarHBondContact O-N 2.89Å; R298-A302 WeakPolarHBondContact O-CB 3.46Å; R298-A302 PolarHBondContact O-N 3.03Å |
| 299 | L | 98.3 | Very high | 98.2 | Very high | 102 Ų | 102 | 96.5 Ų | 96.5 | 53% | 0.534 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63 | -49 | 176.8 | 177.7 | 62.6 | 0 | 0 | 0 | 110.7 | T295 E296 V297 R301 A302 L303 | T295-L299 WeakPolarHBondContact O-CB 3.49Å; T295-L299 PolarHBondContact O-N 3.32Å; E296-L299 WeakPolarHBondContact O-CB 3.39Å; E296-L299 PolarHBondContact O-N 3.28Å; V297-L299 VanDerWaalsContact C-N 3.35Å; L299-R301 VanDerWaalsContact C-N 3.33Å; L299-R301 PolarHBondContact O-N 3.42Å; L299-A302 PolarHBondContact O-N 3.3Å; L299-A302 VanDerWaalsContact O-N 3.13Å; L299-L303 HydrophobicContact CD1-CD1 4.38Å; L299-L303 HydrophobicContact CD1-CG 4.33Å; L299-L303 HydrophobicContact CG-CD1 4.12Å; L299-L303 HydrophobicContact CG-CG 4.48Å; L299-L303 WeakPolarHBondContact O-CG 3.42Å; L299-L303 PolarHBondContact O-N 3.47Å |
| 300 | N | 98.4 | Very high | 98.3 | Very high | 71 Ų | 71 | 101.5 Ų | 101.5 | 38% | 0.38 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.7 | -43.6 | 178.7 | -70.6 | -17.4 | 0 | 0 | 0 | 111.5 | E296 V297 A302 L303 E304 | E296-N300 WeakPolarHBondContact O-CB 3.45Å; E296-N300 VanDerWaalsContact O-CG 3.31Å; E296-N300 PolarHBondContact O-N 3.46Å; E296-N300 PolarHBondContact O-ND2 3.46Å; V297-N300 PolarHBondContact O-N 2.99Å; N300-A302 PolarHBondContact O-N 2.89Å; N300-L303 WeakPolarHBondContact O-CB 3.49Å; N300-L303 PolarHBondContact O-N 2.86Å; N300-E304 WeakPolarHBondContact O-CG 3.39Å; N300-E304 PolarHBondContact O-N 3.03Å |
| 301 | R | 98.4 | Very high | 98.3 | Very high | 156 Ų | 156 | 103.8 Ų | 103.8 | 59% | 0.589 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -59.8 | -44.3 | 174.3 | -169.9 | -178.7 | 72.3 | 176 | 3.8 | 112.4 | V297 L299 L303 E304 E305 | V297-R301 PolarHBondContact O-N 2.88Å; L299-R301 VanDerWaalsContact C-N 3.33Å; L299-R301 PolarHBondContact O-N 3.42Å; R301-L303 VanDerWaalsContact C-N 3.3Å; R301-L303 PolarHBondContact O-N 3.49Å; R301-E304 PolarHBondContact O-N 3.42Å; R301-E305 IonicContact NE-OE1 3.52Å; R301-E305 WeakPolarHBondContact O-CB 3.5Å; R301-E305 WeakPolarHBondContact O-CG 3.35Å; R301-E305 PolarHBondContact O-N 3.26Å |
| 302 | A | 98.1 | Very high | 98.3 | Very high | 52 Ų | 52 | 105.1 Ų | 105.1 | 43% | 0.43 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.7 | -35.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | R298 L299 N300 A306 | R298-A302 WeakPolarHBondContact O-CB 3.46Å; R298-A302 PolarHBondContact O-N 3.03Å; L299-A302 PolarHBondContact O-N 3.3Å; L299-A302 VanDerWaalsContact O-N 3.13Å; N300-A302 PolarHBondContact O-N 2.89Å; A302-A306 WeakPolarHBondContact O-CB 3.46Å; A302-A306 PolarHBondContact O-N 2.97Å |
| 303 | L | 98.1 | Very high | 98.3 | Very high | 91 Ų | 91 | 103.1 Ų | 103.1 | 48% | 0.476 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -67 | -45.7 | 174.6 | -70.7 | 173.7 | 0 | 0 | 0 | 111.6 | L299 N300 R301 E305 A306 E307 | L299-L303 HydrophobicContact CD1-CD1 4.38Å; L299-L303 HydrophobicContact CD1-CG 4.33Å; L299-L303 HydrophobicContact CG-CD1 4.12Å; L299-L303 HydrophobicContact CG-CG 4.48Å; L299-L303 WeakPolarHBondContact O-CG 3.42Å; L299-L303 PolarHBondContact O-N 3.47Å; N300-L303 WeakPolarHBondContact O-CB 3.49Å; N300-L303 PolarHBondContact O-N 2.86Å; R301-L303 VanDerWaalsContact C-N 3.3Å; R301-L303 PolarHBondContact O-N 3.49Å; L303-E305 VanDerWaalsContact C-N 3.35Å; L303-E305 PolarHBondContact O-N 2.97Å; L303-A306 PolarHBondContact O-N 3.2Å; L303-E307 WeakPolarHBondContact O-CG 3.43Å; L303-E307 PolarHBondContact O-N 3.21Å |
| 304 | E | 98.1 | Very high | 98.3 | Very high | 131 Ų | 131 | 103.7 Ų | 103.7 | 61% | 0.612 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59.2 | -44.3 | 175.4 | -72.3 | 170.6 | -165.2 | 0 | 0 | 111.8 | N300 R301 E307 K308 | N300-E304 WeakPolarHBondContact O-CG 3.39Å; N300-E304 PolarHBondContact O-N 3.03Å; R301-E304 PolarHBondContact O-N 3.42Å; E304-E307 PolarHBondContact O-N 2.97Å; E304-K308 WeakPolarHBondContact O-CB 3.37Å; E304-K308 PolarHBondContact O-N 3.4Å |
| 305 | E | 98.3 | Very high | 98.3 | Very high | 90 Ų | 90 | 109.5 Ų | 109.5 | 42% | 0.421 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.5 | -42.8 | 175.1 | -73.8 | 172.5 | -163.2 | 0 | 0 | 111.6 | R301 L303 K308 Y309 | R301-E305 IonicContact NE-OE1 3.52Å; R301-E305 WeakPolarHBondContact O-CB 3.5Å; R301-E305 WeakPolarHBondContact O-CG 3.35Å; R301-E305 PolarHBondContact O-N 3.26Å; L303-E305 VanDerWaalsContact C-N 3.35Å; L303-E305 PolarHBondContact O-N 2.97Å; E305-K308 WeakPolarHBondContact O-CB 3.5Å; E305-K308 PolarHBondContact O-N 3.28Å; E305-Y309 WeakPolarHBondContact O-CD2 3.41Å; E305-Y309 PolarHBondContact O-N 2.98Å |
| 306 | A | 98.3 | Very high | 98.3 | Very high | 56 Ų | 56 | 110.8 Ų | 110.8 | 46% | 0.463 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.7 | -41.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | A302 L303 Y309 K310 | A302-A306 WeakPolarHBondContact O-CB 3.46Å; A302-A306 PolarHBondContact O-N 2.97Å; L303-A306 PolarHBondContact O-N 3.2Å; A306-Y309 PolarHBondContact O-N 2.89Å; A306-K310 WeakPolarHBondContact O-CB 3.47Å; A306-K310 PolarHBondContact O-N 3Å |
| 307 | E | 98.2 | Very high | 98.3 | Very high | 132 Ų | 132 | 114 Ų | 114 | 62% | 0.617 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -63.9 | -41.9 | 175.1 | -74.9 | -171.8 | 167.2 | 0 | 0 | 111.8 | L303 E304 K310 L311 | L303-E307 WeakPolarHBondContact O-CG 3.43Å; L303-E307 PolarHBondContact O-N 3.21Å; E304-E307 PolarHBondContact O-N 2.97Å; E307-K310 PolarHBondContact O-N 3.33Å; E307-L311 WeakPolarHBondContact O-CG 3.27Å; E307-L311 PolarHBondContact O-N 3.38Å |
| 308 | K | 98.6 | Very high | 98.2 | Very high | 120 Ų | 120 | 114 Ų | 114 | 52% | 0.522 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -57.6 | -50.5 | 174.3 | -178.5 | -176.1 | 172.4 | -174.3 | 0 | 111.5 | E304 E305 K310 L311 E312 | E304-K308 WeakPolarHBondContact O-CB 3.37Å; E304-K308 PolarHBondContact O-N 3.4Å; E305-K308 WeakPolarHBondContact O-CB 3.5Å; E305-K308 PolarHBondContact O-N 3.28Å; K308-K310 VanDerWaalsContact C-N 3.31Å; K308-K310 PolarHBondContact O-N 2.93Å; K308-L311 PolarHBondContact O-N 2.97Å; K308-E312 WeakPolarHBondContact CE-OE1 3.41Å; K308-E312 WeakPolarHBondContact O-CG 3.1Å; K308-E312 PolarHBondContact O-N 3.38Å |
| 309 | Y | 98.4 | Very high | 98.2 | Very high | 147 Ų | 147 | 109.9 Ų | 109.9 | 58% | 0.576 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.7 | -35.1 | 179 | -71.4 | -53.2 | 0 | 0 | 0 | 112.9 | E305 A306 E312 L313 | E305-Y309 WeakPolarHBondContact O-CD2 3.41Å; E305-Y309 PolarHBondContact O-N 2.98Å; A306-Y309 PolarHBondContact O-N 2.89Å; Y309-E312 PolarHBondContact O-N 3.45Å; Y309-L313 VanDerWaalsContact O-CB 3.27Å; Y309-L313 WeakPolarHBondContact O-CB 3.36Å; Y309-L313 PolarHBondContact O-N 3.43Å |
| 310 | K | 98.4 | Very high | 98.2 | Very high | 157 Ų | 157 | 109.4 Ų | 109.4 | 68% | 0.683 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.9 | -42.5 | 174.1 | -174.5 | -179.3 | 177.4 | -177.3 | 0 | 111.6 | A306 E307 K308 S314 | A306-K310 WeakPolarHBondContact O-CB 3.47Å; A306-K310 PolarHBondContact O-N 3Å; E307-K310 PolarHBondContact O-N 3.33Å; K308-K310 VanDerWaalsContact C-N 3.31Å; K308-K310 PolarHBondContact O-N 2.93Å; K310-S314 WeakPolarHBondContact O-CB 3.43Å; K310-S314 PolarHBondContact O-N 3.07Å |
| 311 | L | 98.4 | Very high | 98.2 | Very high | 126 Ų | 126 | 112.1 Ų | 112.1 | 66% | 0.66 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -65.5 | -46 | 175.8 | -72.6 | 172.1 | 0 | 0 | 0 | 111.8 | E307 K308 L313 S314 K315 | E307-L311 WeakPolarHBondContact O-CG 3.27Å; E307-L311 PolarHBondContact O-N 3.38Å; K308-L311 PolarHBondContact O-N 2.97Å; L311-L313 VanDerWaalsContact C-N 3.34Å; L311-L313 PolarHBondContact O-N 3.38Å; L311-S314 PolarHBondContact O-N 2.98Å; L311-K315 WeakPolarHBondContact O-CB 3.31Å; L311-K315 PolarHBondContact O-N 3.43Å |
| 312 | E | 98.2 | Very high | 98.1 | Very high | 99 Ų | 99 | 107.9 Ų | 107.9 | 46% | 0.463 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.5 | -44.2 | 176.2 | -73.9 | 177.3 | -176.3 | 0 | 0 | 111.7 | K308 Y309 K315 L316 | K308-E312 WeakPolarHBondContact CE-OE1 3.41Å; K308-E312 WeakPolarHBondContact O-CG 3.1Å; K308-E312 PolarHBondContact O-N 3.38Å; Y309-E312 PolarHBondContact O-N 3.45Å; E312-K315 PolarHBondContact O-N 3.05Å; E312-L316 WeakPolarHBondContact O-CB 3.44Å; E312-L316 PolarHBondContact O-N 2.92Å |
| 313 | L | 98.2 | Very high | 98.1 | Very high | 88 Ų | 88 | 108.5 Ų | 108.5 | 46% | 0.461 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.8 | -43.8 | 176.1 | -179.3 | 63.9 | 0 | 0 | 0 | 111.9 | Y309 L311 K315 L316 R317 | Y309-L313 VanDerWaalsContact O-CB 3.27Å; Y309-L313 WeakPolarHBondContact O-CB 3.36Å; Y309-L313 PolarHBondContact O-N 3.43Å; L311-L313 VanDerWaalsContact C-N 3.34Å; L311-L313 PolarHBondContact O-N 3.38Å; L313-K315 VanDerWaalsContact C-N 3.33Å; L313-K315 PolarHBondContact O-N 3.09Å; L313-L316 PolarHBondContact O-N 2.91Å; L313-R317 WeakPolarHBondContact O-CB 3.47Å; L313-R317 WeakPolarHBondContact O-CG 3.05Å; L313-R317 PolarHBondContact O-N 2.88Å |
| 314 | S | 98.3 | Very high | 98.1 | Very high | 75 Ų | 75 | 106.7 Ų | 106.7 | 52% | 0.524 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.8 | -43 | 176.8 | -170.1 | 0 | 0 | 0 | 0 | 111.3 | K310 L311 R317 Q318 | K310-S314 WeakPolarHBondContact O-CB 3.43Å; K310-S314 PolarHBondContact O-N 3.07Å; L311-S314 PolarHBondContact O-N 2.98Å; S314-R317 PolarHBondContact O-N 3.5Å; S314-Q318 PolarHBondContact O-N 3.31Å |
| 315 | K | 98.4 | Very high | 98.1 | Very high | 165 Ų | 165 | 104 Ų | 104 | 72% | 0.717 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.6 | -43.7 | 176.9 | -173.7 | 178.6 | 179.4 | -179.2 | 0 | 111.4 | L311 E312 L313 Q318 N319 | L311-K315 WeakPolarHBondContact O-CB 3.31Å; L311-K315 PolarHBondContact O-N 3.43Å; E312-K315 PolarHBondContact O-N 3.05Å; L313-K315 VanDerWaalsContact C-N 3.33Å; L313-K315 PolarHBondContact O-N 3.09Å; K315-Q318 PolarHBondContact O-N 3.46Å; K315-N319 WeakPolarHBondContact O-CB 3.44Å; K315-N319 PolarHBondContact O-N 2.93Å |
| 316 | L | 97.8 | Very high | 98 | Very high | 97 Ų | 97 | 106 Ų | 106 | 51% | 0.508 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65 | -41.5 | 178.1 | -171.3 | 66 | 0 | 0 | 0 | 111.8 | E312 L313 Q318 N319 N320 | E312-L316 WeakPolarHBondContact O-CB 3.44Å; E312-L316 PolarHBondContact O-N 2.92Å; L313-L316 PolarHBondContact O-N 2.91Å; L316-Q318 PolarHBondContact O-N 3.39Å; L316-N319 PolarHBondContact O-N 3.49Å; L316-N320 WeakPolarHBondContact O-CB 3.49Å; L316-N320 VanDerWaalsContact O-CG 3.29Å; L316-N320 PolarHBondContact O-N 3.36Å |
| 317 | R | 98.1 | Very high | 98 | Very high | 174 Ų | 174 | 109 Ų | 109 | 66% | 0.657 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.4 | -44.3 | 174.5 | -77.5 | 178.5 | 175.1 | -177 | -1 | 112.1 | L313 S314 K321 | L313-R317 WeakPolarHBondContact O-CB 3.47Å; L313-R317 WeakPolarHBondContact O-CG 3.05Å; L313-R317 PolarHBondContact O-N 2.88Å; S314-R317 PolarHBondContact O-N 3.5Å; R317-K321 PolarHBondContact O-N 3.17Å; R317-K321 VanDerWaalsContact O-N 3.07Å |
| 318 | Q | 97.9 | Very high | 98 | Very high | 95 Ų | 95 | 108 Ų | 108 | 44% | 0.444 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.6 | -47.2 | 177.4 | -176.1 | 55.4 | 45.3 | 0 | 0 | 111.1 | S314 K315 L316 N320 K321 D322 | S314-Q318 PolarHBondContact O-N 3.31Å; K315-Q318 PolarHBondContact O-N 3.46Å; L316-Q318 PolarHBondContact O-N 3.39Å; Q318-N320 VanDerWaalsContact C-N 3.34Å; Q318-N320 PolarHBondContact O-N 3.17Å; Q318-K321 WeakPolarHBondContact O-CB 3.43Å; Q318-K321 PolarHBondContact O-N 2.94Å; Q318-K321 VanDerWaalsContact O-N 3.09Å; Q318-D322 VanDerWaalsContact NE2-CG 3.28Å; Q318-D322 PolarHBondContact NE2-OD1 3.01Å; Q318-D322 PolarHBondContact NE2-OD2 2.89Å; Q318-D322 VanDerWaalsContact O-CG 3.32Å; Q318-D322 PolarHBondContact O-N 2.91Å |
| 319 | N | 97.9 | Very high | 97.9 | Very high | 83 Ų | 83 | 109.4 Ų | 109.4 | 44% | 0.444 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -58.5 | -44.4 | 177.2 | -168.7 | 16.8 | 0 | 0 | 0 | 112 | K315 L316 K321 D322 I323 | K315-N319 WeakPolarHBondContact O-CB 3.44Å; K315-N319 PolarHBondContact O-N 2.93Å; L316-N319 PolarHBondContact O-N 3.49Å; N319-K321 VanDerWaalsContact C-N 3.31Å; N319-K321 PolarHBondContact O-N 3Å; N319-D322 PolarHBondContact O-N 3.35Å; N319-D322 VanDerWaalsContact O-N 3.17Å; N319-I323 VanDerWaalsContact O-CG1 3.32Å; N319-I323 WeakPolarHBondContact O-CG1 3.39Å; N319-I323 PolarHBondContact O-N 2.86Å |
| 320 | N | 97.8 | Very high | 97.9 | Very high | 92 Ų | 92 | 109.3 Ų | 109.3 | 49% | 0.492 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.8 | -38.2 | 176.2 | -74.2 | -4.2 | 0 | 0 | 0 | 112.5 | L316 Q318 A324 | L316-N320 WeakPolarHBondContact O-CB 3.49Å; L316-N320 VanDerWaalsContact O-CG 3.29Å; L316-N320 PolarHBondContact O-N 3.36Å; Q318-N320 VanDerWaalsContact C-N 3.34Å; Q318-N320 PolarHBondContact O-N 3.17Å; N320-A324 VanDerWaalsContact O-CB 3.31Å; N320-A324 WeakPolarHBondContact O-CB 3.41Å; N320-A324 PolarHBondContact O-N 2.92Å |
| 321 | K | 98.1 | Very high | 97.9 | Very high | 128 Ų | 128 | 106.6 Ų | 106.6 | 56% | 0.557 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.3 | -41.8 | 174.9 | -175.6 | 179.1 | 179.6 | -179.8 | 0 | 111.2 | R317 Q318 N319 N325 | R317-K321 PolarHBondContact O-N 3.17Å; R317-K321 VanDerWaalsContact O-N 3.07Å; Q318-K321 WeakPolarHBondContact O-CB 3.43Å; Q318-K321 PolarHBondContact O-N 2.94Å; Q318-K321 VanDerWaalsContact O-N 3.09Å; N319-K321 VanDerWaalsContact C-N 3.31Å; N319-K321 PolarHBondContact O-N 3Å; K321-N325 WeakPolarHBondContact O-CB 3.47Å; K321-N325 PolarHBondContact O-N 2.98Å; K321-N325 PolarHBondContact O-ND2 3Å |
| 322 | D | 97.7 | Very high | 97.8 | Very high | 67 Ų | 67 | 104.4 Ų | 104.4 | 36% | 0.358 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -67.7 | -44.7 | 179.6 | -64.6 | -30 | 0 | 0 | 0 | 111.4 | Q318 N319 A324 N325 E326 | Q318-D322 VanDerWaalsContact NE2-CG 3.28Å; Q318-D322 PolarHBondContact NE2-OD1 3.01Å; Q318-D322 PolarHBondContact NE2-OD2 2.89Å; Q318-D322 VanDerWaalsContact O-CG 3.32Å; Q318-D322 PolarHBondContact O-N 2.91Å; N319-D322 PolarHBondContact O-N 3.35Å; N319-D322 VanDerWaalsContact O-N 3.17Å; D322-A324 PolarHBondContact O-N 2.93Å; D322-N325 WeakPolarHBondContact O-CB 3.46Å; D322-N325 PolarHBondContact O-N 3.38Å; D322-E326 WeakPolarHBondContact O-CG 3.32Å; D322-E326 PolarHBondContact O-N 3.44Å |
| 323 | I | 97.6 | Very high | 97.8 | Very high | 65 Ų | 65 | 104.1 Ų | 104.1 | 33% | 0.333 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -58.6 | -48.9 | 173.6 | -67 | 166.8 | 0 | 0 | 0 | 110.7 | N319 N325 E326 E327 | N319-I323 VanDerWaalsContact O-CG1 3.32Å; N319-I323 WeakPolarHBondContact O-CG1 3.39Å; N319-I323 PolarHBondContact O-N 2.86Å; I323-N325 VanDerWaalsContact C-N 3.28Å; I323-N325 PolarHBondContact O-N 3.29Å; I323-E326 PolarHBondContact O-N 3.28Å; I323-E326 VanDerWaalsContact O-N 3.17Å; I323-E327 HydrophobicContact CG2-CG 4.31Å; I323-E327 WeakPolarHBondContact O-CB 3.44Å; I323-E327 WeakPolarHBondContact O-CG 3.34Å; I323-E327 PolarHBondContact O-N 3Å |
| 324 | A | 97.5 | Very high | 97.8 | Very high | 53 Ų | 53 | 104.4 Ų | 104.4 | 44% | 0.438 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.4 | -38.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | N320 D322 H328 | N320-A324 VanDerWaalsContact O-CB 3.31Å; N320-A324 WeakPolarHBondContact O-CB 3.41Å; N320-A324 PolarHBondContact O-N 2.92Å; D322-A324 PolarHBondContact O-N 2.93Å; A324-H328 WeakPolarHBondContact O-CB 3.42Å; A324-H328 PolarHBondContact O-N 3.48Å |
| 325 | N | 97.4 | Very high | 97.8 | Very high | 74 Ų | 74 | 105.5 Ų | 105.5 | 40% | 0.396 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.7 | -41.6 | 175.3 | -74 | -28 | 0 | 0 | 0 | 112.4 | K321 D322 I323 H328 K329 | K321-N325 WeakPolarHBondContact O-CB 3.47Å; K321-N325 PolarHBondContact O-N 2.98Å; K321-N325 PolarHBondContact O-ND2 3Å; D322-N325 WeakPolarHBondContact O-CB 3.46Å; D322-N325 PolarHBondContact O-N 3.38Å; I323-N325 VanDerWaalsContact C-N 3.28Å; I323-N325 PolarHBondContact O-N 3.29Å; N325-H328 PolarHBondContact O-N 3.36Å; N325-K329 WeakPolarHBondContact O-CG 3.34Å; N325-K329 PolarHBondContact O-N 2.84Å |
| 326 | E | 97.7 | Very high | 97.7 | Very high | 134 Ų | 134 | 101.1 Ų | 101.1 | 63% | 0.626 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.4 | -45 | 175.8 | -75.2 | -177.1 | -180 | 0 | 0 | 111.9 | D322 I323 H328 K329 K330 | D322-E326 WeakPolarHBondContact O-CG 3.32Å; D322-E326 PolarHBondContact O-N 3.44Å; I323-E326 PolarHBondContact O-N 3.28Å; I323-E326 VanDerWaalsContact O-N 3.17Å; E326-H328 VanDerWaalsContact C-N 3.34Å; E326-H328 PolarHBondContact O-N 3.49Å; E326-K329 PolarHBondContact O-N 3.17Å; E326-K330 WeakPolarHBondContact O-CB 3.26Å; E326-K330 PolarHBondContact O-N 3.32Å |
| 327 | E | 97.3 | Very high | 97.7 | Very high | 119 Ų | 119 | 101.4 Ų | 101.4 | 56% | 0.556 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -59.7 | -44.8 | 174 | -74.6 | -177.2 | 167.8 | 0 | 0 | 111.1 | I323 K329 K330 I331 | I323-E327 HydrophobicContact CG2-CG 4.31Å; I323-E327 WeakPolarHBondContact O-CB 3.44Å; I323-E327 WeakPolarHBondContact O-CG 3.34Å; I323-E327 PolarHBondContact O-N 3Å; E327-K329 PolarHBondContact O-N 2.89Å; E327-K330 PolarHBondContact O-N 3.21Å; E327-I331 WeakPolarHBondContact O-CB 3.39Å; E327-I331 VanDerWaalsContact O-CG1 3.26Å; E327-I331 WeakPolarHBondContact O-CG1 3.32Å; E327-I331 PolarHBondContact O-N 2.88Å |
| 328 | H | 97.7 | Very high | 97.7 | Very high | 109 Ų | 109 | 98.1 Ų | 98.1 | 51% | 0.505 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.6 | -44.5 | 176.9 | -170.3 | -4.1 | 0 | 0 | 0 | 111.8 | A324 N325 E326 K330 I331 E332 | A324-H328 WeakPolarHBondContact O-CB 3.42Å; A324-H328 PolarHBondContact O-N 3.48Å; N325-H328 PolarHBondContact O-N 3.36Å; E326-H328 VanDerWaalsContact C-N 3.34Å; E326-H328 PolarHBondContact O-N 3.49Å; H328-K330 PolarHBondContact O-N 3.48Å; H328-I331 PolarHBondContact O-N 3.43Å; H328-E332 PolarHBondContact O-N 3.23Å |
| 329 | K | 97.7 | Very high | 97.7 | Very high | 150 Ų | 150 | 99.9 Ų | 99.9 | 65% | 0.652 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.1 | -45.3 | 175.2 | -73.4 | 171.9 | -176.7 | 175.4 | 0 | 111.4 | N325 E326 E327 E332 V333 | N325-K329 WeakPolarHBondContact O-CG 3.34Å; N325-K329 PolarHBondContact O-N 2.84Å; E326-K329 PolarHBondContact O-N 3.17Å; E327-K329 PolarHBondContact O-N 2.89Å; K329-E332 PolarHBondContact O-N 3.45Å; K329-V333 WeakPolarHBondContact O-CG2 3.14Å; K329-V333 PolarHBondContact O-N 3.1Å |
| 330 | K | 97.7 | Very high | 97.7 | Very high | 145 Ų | 145 | 102.3 Ų | 102.3 | 63% | 0.63 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -62.2 | -43.3 | 178.2 | -174.1 | 178.3 | -179.9 | -179.4 | 0 | 111.8 | E326 E327 H328 E332 V333 L334 | E326-K330 WeakPolarHBondContact O-CB 3.26Å; E326-K330 PolarHBondContact O-N 3.32Å; E327-K330 PolarHBondContact O-N 3.21Å; H328-K330 PolarHBondContact O-N 3.48Å; K330-E332 VanDerWaalsContact C-N 3.35Å; K330-V333 PolarHBondContact O-N 3.4Å; K330-L334 HydrophobicContact CG-CD1 4.21Å; K330-L334 WeakPolarHBondContact O-CB 3.46Å; K330-L334 WeakPolarHBondContact O-CG 3.39Å; K330-L334 PolarHBondContact O-N 3Å |
| 331 | I | 97.6 | Very high | 97.7 | Very high | 100 Ų | 100 | 102.3 Ų | 102.3 | 51% | 0.513 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60 | -45.4 | 175.8 | -71.9 | 166.7 | 0 | 0 | 0 | 110.5 | E327 H328 L334 K335 | E327-I331 WeakPolarHBondContact O-CB 3.39Å; E327-I331 VanDerWaalsContact O-CG1 3.26Å; E327-I331 WeakPolarHBondContact O-CG1 3.32Å; E327-I331 PolarHBondContact O-N 2.88Å; H328-I331 PolarHBondContact O-N 3.43Å; I331-L334 PolarHBondContact O-N 3.08Å; I331-K335 WeakPolarHBondContact O-CB 3.39Å; I331-K335 PolarHBondContact O-N 3.1Å |
| 332 | E | 97.4 | Very high | 97.6 | Very high | 81 Ų | 81 | 101 Ų | 101 | 38% | 0.379 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.1 | -39.3 | 179.5 | -76.7 | -60.8 | 131 | 0 | 0 | 112.6 | H328 K329 K330 K335 S336 | H328-E332 PolarHBondContact O-N 3.23Å; K329-E332 PolarHBondContact O-N 3.45Å; K330-E332 VanDerWaalsContact C-N 3.35Å; E332-K335 PolarHBondContact O-N 2.95Å; E332-K335 WeakPolarHBondContact OE1-CD 3.5Å; E332-K335 IonicContact OE1-NZ 3.85Å; E332-K335 PolarHBondContact OE1-NZ 3.41Å; E332-K335 IonicContact OE2-NZ 2.65Å; E332-S336 WeakPolarHBondContact O-CB 3.5Å; E332-S336 PolarHBondContact O-N 2.86Å |
| 333 | V | 97.8 | Very high | 97.6 | Very high | 92 Ų | 92 | 105 Ų | 105 | 56% | 0.558 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -59.8 | -54 | 172.9 | 171.9 | 0 | 0 | 0 | 0 | 110.6 | K329 K330 K335 S336 E337 | K329-V333 WeakPolarHBondContact O-CG2 3.14Å; K329-V333 PolarHBondContact O-N 3.1Å; K330-V333 PolarHBondContact O-N 3.4Å; V333-K335 VanDerWaalsContact C-N 3.28Å; V333-K335 PolarHBondContact O-N 3.31Å; V333-S336 PolarHBondContact O-N 3.42Å; V333-S336 VanDerWaalsContact O-N 3.1Å; V333-S336 PolarHBondContact O-OG 3.4Å; V333-E337 PolarHBondContact O-N 2.72Å |
| 334 | L | 97.7 | Very high | 97.6 | Very high | 94 Ų | 94 | 106.4 Ų | 106.4 | 49% | 0.492 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.2 | -39.2 | 179.5 | -73.2 | 172.9 | 0 | 0 | 0 | 112.1 | K330 I331 E337 N338 | K330-L334 HydrophobicContact CG-CD1 4.21Å; K330-L334 WeakPolarHBondContact O-CB 3.46Å; K330-L334 WeakPolarHBondContact O-CG 3.39Å; K330-L334 PolarHBondContact O-N 3Å; I331-L334 PolarHBondContact O-N 3.08Å; L334-E337 PolarHBondContact O-N 3.38Å; L334-N338 VanDerWaalsContact O-CB 3.23Å; L334-N338 WeakPolarHBondContact O-CB 3.23Å; L334-N338 PolarHBondContact O-N 2.99Å |
| 335 | K | 98 | Very high | 97.6 | Very high | 99 Ų | 99 | 109.4 Ų | 109.4 | 43% | 0.43 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.9 | -39.5 | 177 | -177 | -178.9 | 176.3 | -172.9 | 0 | 111.9 | I331 E332 V333 K339 | I331-K335 WeakPolarHBondContact O-CB 3.39Å; I331-K335 PolarHBondContact O-N 3.1Å; E332-K335 PolarHBondContact O-N 2.95Å; E332-K335 WeakPolarHBondContact OE1-CD 3.5Å; E332-K335 IonicContact OE1-NZ 3.85Å; E332-K335 PolarHBondContact OE1-NZ 3.41Å; E332-K335 IonicContact OE2-NZ 2.65Å; V333-K335 VanDerWaalsContact C-N 3.28Å; V333-K335 PolarHBondContact O-N 3.31Å; K335-K339 VanDerWaalsContact O-CG 3.32Å; K335-K339 WeakPolarHBondContact O-CG 3.32Å; K335-K339 PolarHBondContact O-N 2.84Å; K335-K339 VanDerWaalsContact O-N 3.1Å |
| 336 | S | 97.8 | Very high | 97.6 | Very high | 72 Ų | 72 | 107.4 Ų | 107.4 | 50% | 0.503 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -67.8 | -40.4 | 176 | 77 | 0 | 0 | 0 | 0 | 112.2 | E332 V333 K339 K340 | E332-S336 WeakPolarHBondContact O-CB 3.5Å; E332-S336 PolarHBondContact O-N 2.86Å; V333-S336 PolarHBondContact O-N 3.42Å; V333-S336 VanDerWaalsContact O-N 3.1Å; V333-S336 PolarHBondContact O-OG 3.4Å; S336-K339 PolarHBondContact O-N 3.22Å; S336-K340 PolarHBondContact O-N 2.97Å; S336-K340 VanDerWaalsContact O-N 3.08Å |
| 337 | E | 97.4 | Very high | 97.6 | Very high | 104 Ų | 104 | 107.4 Ų | 107.4 | 49% | 0.486 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -67.5 | -44.1 | 176.9 | -176.2 | 170.9 | -159.5 | 0 | 0 | 111.5 | V333 L334 K339 K340 L341 | V333-E337 PolarHBondContact O-N 2.72Å; L334-E337 PolarHBondContact O-N 3.38Å; E337-K339 VanDerWaalsContact C-N 3.33Å; E337-K339 PolarHBondContact O-N 2.91Å; E337-K340 WeakPolarHBondContact O-CA 3.47Å; E337-K340 WeakPolarHBondContact O-CB 3.46Å; E337-K340 PolarHBondContact O-N 3.47Å; E337-L341 HydrophobicContact CG-CD1 4.28Å; E337-L341 WeakPolarHBondContact O-CG 3.39Å; E337-L341 PolarHBondContact O-N 3Å |
| 338 | N | 97.3 | Very high | 97.7 | Very high | 105 Ų | 105 | 106.9 Ų | 106.9 | 56% | 0.561 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59.5 | -43.6 | 176.1 | -165.3 | -48.2 | 0 | 0 | 0 | 111.3 | L334 K340 L341 E342 | L334-N338 VanDerWaalsContact O-CB 3.23Å; L334-N338 WeakPolarHBondContact O-CB 3.23Å; L334-N338 PolarHBondContact O-N 2.99Å; N338-K340 VanDerWaalsContact C-N 3.3Å; N338-K340 PolarHBondContact O-N 3.28Å; N338-L341 PolarHBondContact O-N 3.09Å; N338-E342 PolarHBondContact O-N 3.41Å |
| 339 | K | 97.9 | Very high | 97.7 | Very high | 132 Ų | 132 | 106.4 Ų | 106.4 | 57% | 0.574 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -58.9 | -38.5 | 172.1 | -76.3 | 176.2 | 179.2 | -178.5 | 0 | 112.8 | K335 S336 E337 K343 | K335-K339 VanDerWaalsContact O-CG 3.32Å; K335-K339 WeakPolarHBondContact O-CG 3.32Å; K335-K339 PolarHBondContact O-N 2.84Å; K335-K339 VanDerWaalsContact O-N 3.1Å; S336-K339 PolarHBondContact O-N 3.22Å; E337-K339 VanDerWaalsContact C-N 3.33Å; E337-K339 PolarHBondContact O-N 2.91Å; K339-K343 WeakPolarHBondContact O-CG 3.46Å; K339-K343 PolarHBondContact O-N 2.86Å |
| 340 | K | 98.1 | Very high | 97.7 | Very high | 133 Ų | 133 | 103.7 Ų | 103.7 | 58% | 0.578 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -68.3 | -44.9 | 177.7 | -176.3 | -177.1 | 176.3 | -174.8 | 0 | 111.2 | S336 E337 N338 K343 Q344 | S336-K340 PolarHBondContact O-N 2.97Å; S336-K340 VanDerWaalsContact O-N 3.08Å; E337-K340 WeakPolarHBondContact O-CA 3.47Å; E337-K340 WeakPolarHBondContact O-CB 3.46Å; E337-K340 PolarHBondContact O-N 3.47Å; N338-K340 VanDerWaalsContact C-N 3.3Å; N338-K340 PolarHBondContact O-N 3.28Å; K340-K343 WeakPolarHBondContact O-CB 3.47Å; K340-K343 PolarHBondContact O-N 2.92Å; K340-Q344 WeakPolarHBondContact O-CG 3.47Å; K340-Q344 PolarHBondContact O-N 3Å |
| 341 | L | 97.5 | Very high | 97.7 | Very high | 93 Ų | 93 | 98.2 Ų | 98.2 | 49% | 0.487 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.1 | -42.4 | 177.2 | -70.9 | 172.8 | 0 | 0 | 0 | 111.7 | E337 N338 K343 Q344 K345 | E337-L341 HydrophobicContact CG-CD1 4.28Å; E337-L341 WeakPolarHBondContact O-CG 3.39Å; E337-L341 PolarHBondContact O-N 3Å; N338-L341 PolarHBondContact O-N 3.09Å; L341-K343 VanDerWaalsContact C-N 3.31Å; L341-K343 PolarHBondContact O-N 2.93Å; L341-Q344 PolarHBondContact O-N 2.86Å; L341-K345 VanDerWaalsContact O-CB 3.31Å; L341-K345 WeakPolarHBondContact O-CB 3.36Å; L341-K345 PolarHBondContact O-N 3.06Å |
| 342 | E | 97.3 | Very high | 97.7 | Very high | 101 Ų | 101 | 98.5 Ų | 98.5 | 47% | 0.472 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.8 | -36.3 | 177.8 | -161 | 63.4 | -143.3 | 0 | 0 | 111.6 | N338 K345 G346 | N338-E342 PolarHBondContact O-N 3.41Å; E342-K345 IonicContact OE1-NZ 3.67Å; E342-K345 PolarHBondContact OE1-NZ 3.41Å; E342-K345 IonicContact OE2-NZ 2.76Å; E342-K345 PolarHBondContact OE2-NZ 3.27Å; E342-G346 PolarHBondContact O-N 2.9Å |
| 343 | K | 97.8 | Very high | 97.8 | Very high | 151 Ų | 151 | 100.8 Ų | 100.8 | 66% | 0.657 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.9 | -49.9 | 172 | -73.9 | 179 | -179.2 | -174.3 | 0 | 112 | K339 K340 L341 K345 G346 E347 | K339-K343 WeakPolarHBondContact O-CG 3.46Å; K339-K343 PolarHBondContact O-N 2.86Å; K340-K343 WeakPolarHBondContact O-CB 3.47Å; K340-K343 PolarHBondContact O-N 2.92Å; L341-K343 VanDerWaalsContact C-N 3.31Å; L341-K343 PolarHBondContact O-N 2.93Å; K343-K345 VanDerWaalsContact C-N 3.32Å; K343-K345 PolarHBondContact O-N 3.29Å; K343-G346 WeakPolarHBondContact O-CA 3.35Å; K343-G346 PolarHBondContact O-N 2.86Å; K343-G346 VanDerWaalsContact O-N 3.09Å; K343-E347 WeakPolarHBondContact O-CG 3.44Å; K343-E347 PolarHBondContact O-N 3.35Å |
| 344 | Q | 97.8 | Very high | 97.8 | Very high | 94 Ų | 94 | 103.3 Ų | 103.3 | 44% | 0.439 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60 | -42.4 | 178.7 | -72.5 | 178.5 | -27.5 | 0 | 0 | 111.9 | K340 L341 E347 L348 | K340-Q344 WeakPolarHBondContact O-CG 3.47Å; K340-Q344 PolarHBondContact O-N 3Å; L341-Q344 PolarHBondContact O-N 2.86Å; Q344-E347 PolarHBondContact O-N 3.11Å; Q344-L348 WeakPolarHBondContact O-CB 3.46Å; Q344-L348 PolarHBondContact O-N 2.89Å |
| 345 | K | 98 | Very high | 97.8 | Very high | 116 Ų | 116 | 104.3 Ų | 104.3 | 50% | 0.504 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.9 | -43.6 | 173.1 | 178 | -174.1 | 162.8 | -151.5 | 0 | 111.4 | L341 E342 K343 L348 M349 | L341-K345 VanDerWaalsContact O-CB 3.31Å; L341-K345 WeakPolarHBondContact O-CB 3.36Å; L341-K345 PolarHBondContact O-N 3.06Å; E342-K345 IonicContact OE1-NZ 3.67Å; E342-K345 PolarHBondContact OE1-NZ 3.41Å; E342-K345 IonicContact OE2-NZ 2.76Å; E342-K345 PolarHBondContact OE2-NZ 3.27Å; K343-K345 VanDerWaalsContact C-N 3.32Å; K343-K345 PolarHBondContact O-N 3.29Å; K345-L348 PolarHBondContact O-N 3Å; K345-M349 WeakPolarHBondContact O-CB 3.24Å; K345-M349 VanDerWaalsContact O-CG 3.24Å; K345-M349 WeakPolarHBondContact O-CG 3.42Å; K345-M349 PolarHBondContact O-N 3.22Å |
| 346 | G | 97.4 | Very high | 97.8 | Very high | 31 Ų | 31 | 104.7 Ų | 104.7 | 32% | 0.32 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59.4 | -46.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | E342 K343 M349 I350 | E342-G346 PolarHBondContact O-N 2.9Å; K343-G346 WeakPolarHBondContact O-CA 3.35Å; K343-G346 PolarHBondContact O-N 2.86Å; K343-G346 VanDerWaalsContact O-N 3.09Å; G346-M349 PolarHBondContact O-N 2.97Å; G346-I350 VanDerWaalsContact O-CG1 3.32Å; G346-I350 WeakPolarHBondContact O-CG1 3.44Å; G346-I350 PolarHBondContact O-N 3.34Å |
| 347 | E | 97.4 | Very high | 97.8 | Very high | 135 Ų | 135 | 108.4 Ų | 108.4 | 63% | 0.631 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61 | -45.4 | 176.1 | -71.8 | 170.3 | -172 | 0 | 0 | 111.8 | K343 Q344 M349 I350 G351 | K343-E347 WeakPolarHBondContact O-CG 3.44Å; K343-E347 PolarHBondContact O-N 3.35Å; Q344-E347 PolarHBondContact O-N 3.11Å; E347-M349 PolarHBondContact O-N 3.43Å; E347-I350 WeakPolarHBondContact O-CB 3.31Å; E347-I350 PolarHBondContact O-N 2.9Å; E347-G351 PolarHBondContact O-N 3.37Å |
| 348 | L | 98.1 | Very high | 97.8 | Very high | 107 Ų | 107 | 108.1 Ų | 108.1 | 56% | 0.56 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.8 | -43.9 | 176.7 | -176.5 | 62.1 | 0 | 0 | 0 | 111.7 | Q344 K345 I350 G351 F352 | Q344-L348 WeakPolarHBondContact O-CB 3.46Å; Q344-L348 PolarHBondContact O-N 2.89Å; K345-L348 PolarHBondContact O-N 3Å; L348-I350 VanDerWaalsContact C-N 3.32Å; L348-I350 PolarHBondContact O-N 3.39Å; L348-G351 WeakPolarHBondContact O-CA 3.5Å; L348-G351 PolarHBondContact O-N 2.87Å; L348-G351 VanDerWaalsContact O-N 3.11Å; L348-F352 HydrophobicContact CD1-CD2 4.19Å; L348-F352 HydrophobicContact CD1-CE2 3.79Å; L348-F352 HydrophobicContact CD1-CZ 4.45Å; L348-F352 HydrophobicContact CD2-CE2 4.09Å; L348-F352 HydrophobicContact CG-CD2 3.95Å; L348-F352 HydrophobicContact CG-CE2 3.68Å; L348-F352 WeakPolarHBondContact O-CD2 3.41Å; L348-F352 PolarHBondContact O-N 3.23Å |
| 349 | M | 97.9 | Very high | 97.8 | Very high | 99 Ų | 99 | 106.7 Ų | 106.7 | 49% | 0.488 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61 | -39.7 | 175.3 | -75.2 | -60.1 | -63.6 | 0 | 0 | 112.3 | K345 G346 E347 G351 K353 | K345-M349 WeakPolarHBondContact O-CB 3.24Å; K345-M349 VanDerWaalsContact O-CG 3.24Å; K345-M349 WeakPolarHBondContact O-CG 3.42Å; K345-M349 PolarHBondContact O-N 3.22Å; G346-M349 PolarHBondContact O-N 2.97Å; E347-M349 PolarHBondContact O-N 3.43Å; M349-G351 VanDerWaalsContact C-N 3.35Å; M349-K353 WeakPolarHBondContact O-CG 3.45Å; M349-K353 PolarHBondContact O-N 3.49Å |
| 350 | I | 98 | Very high | 97.8 | Very high | 94 Ų | 94 | 105.1 Ų | 105.1 | 48% | 0.482 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64 | -42.4 | 173.3 | -68.9 | 164.9 | 0 | 0 | 0 | 110.3 | G346 E347 L348 K353 K354 | G346-I350 VanDerWaalsContact O-CG1 3.32Å; G346-I350 WeakPolarHBondContact O-CG1 3.44Å; G346-I350 PolarHBondContact O-N 3.34Å; E347-I350 WeakPolarHBondContact O-CB 3.31Å; E347-I350 PolarHBondContact O-N 2.9Å; L348-I350 VanDerWaalsContact C-N 3.32Å; L348-I350 PolarHBondContact O-N 3.39Å; I350-K353 PolarHBondContact O-N 3.3Å; I350-K354 HydrophobicContact CG2-CD 4.36Å; I350-K354 WeakPolarHBondContact O-CG 3.48Å; I350-K354 PolarHBondContact O-N 2.94Å |
| 351 | G | 97.9 | Very high | 97.8 | Very high | 29 Ų | 29 | 102.2 Ų | 102.2 | 30% | 0.299 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -56.1 | -51.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | E347 L348 M349 K353 K354 Q355 | E347-G351 PolarHBondContact O-N 3.37Å; L348-G351 WeakPolarHBondContact O-CA 3.5Å; L348-G351 PolarHBondContact O-N 2.87Å; L348-G351 VanDerWaalsContact O-N 3.11Å; M349-G351 VanDerWaalsContact C-N 3.35Å; G351-K353 PolarHBondContact O-N 3.41Å; G351-K354 WeakPolarHBondContact O-CB 3.42Å; G351-K354 PolarHBondContact O-N 3.32Å; G351-K354 VanDerWaalsContact O-N 3.13Å; G351-Q355 PolarHBondContact O-N 2.93Å |
| 352 | F | 97.9 | Very high | 97.8 | Very high | 106 Ų | 106 | 101.9 Ų | 101.9 | 47% | 0.465 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.3 | -43 | 176.3 | -81.4 | -59.3 | 0 | 0 | 0 | 112.6 | L348 K354 Q355 L356 | L348-F352 HydrophobicContact CD1-CD2 4.19Å; L348-F352 HydrophobicContact CD1-CE2 3.79Å; L348-F352 HydrophobicContact CD1-CZ 4.45Å; L348-F352 HydrophobicContact CD2-CE2 4.09Å; L348-F352 HydrophobicContact CG-CD2 3.95Å; L348-F352 HydrophobicContact CG-CE2 3.68Å; L348-F352 WeakPolarHBondContact O-CD2 3.41Å; L348-F352 PolarHBondContact O-N 3.23Å; F352-K354 VanDerWaalsContact C-N 3.3Å; F352-K354 PolarHBondContact O-N 3.06Å; F352-Q355 PolarHBondContact O-N 3.19Å; F352-L356 WeakPolarHBondContact O-CG 3.41Å; F352-L356 PolarHBondContact O-N 3.47Å |
| 353 | K | 98.2 | Very high | 97.8 | Very high | 130 Ų | 130 | 103.6 Ų | 103.6 | 57% | 0.565 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -60 | -39.4 | 175.5 | -74.6 | 175.9 | -179.1 | -179.6 | 0 | 112.2 | M349 I350 G351 K357 | M349-K353 WeakPolarHBondContact O-CG 3.45Å; M349-K353 PolarHBondContact O-N 3.49Å; I350-K353 PolarHBondContact O-N 3.3Å; G351-K353 PolarHBondContact O-N 3.41Å; K353-K357 WeakPolarHBondContact O-CG 3.46Å; K353-K357 PolarHBondContact O-N 3.38Å |
| 354 | K | 98.2 | Very high | 97.7 | Very high | 144 Ų | 144 | 104.4 Ų | 104.4 | 63% | 0.626 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67.8 | -43.1 | 175.5 | -72.1 | 177.2 | 178.9 | -179.5 | 0 | 111.7 | I350 G351 F352 K357 L358 | I350-K354 HydrophobicContact CG2-CD 4.36Å; I350-K354 WeakPolarHBondContact O-CG 3.48Å; I350-K354 PolarHBondContact O-N 2.94Å; G351-K354 WeakPolarHBondContact O-CB 3.42Å; G351-K354 PolarHBondContact O-N 3.32Å; G351-K354 VanDerWaalsContact O-N 3.13Å; F352-K354 VanDerWaalsContact C-N 3.3Å; F352-K354 PolarHBondContact O-N 3.06Å; K354-K357 PolarHBondContact O-N 3.13Å; K354-L358 PolarHBondContact O-N 3.14Å |
| 355 | Q | 97.9 | Very high | 97.7 | Very high | 115 Ų | 115 | 104.7 Ų | 104.7 | 54% | 0.537 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.9 | -43.3 | 176.2 | -74.5 | 179.4 | -13.2 | 0 | 0 | 112 | G351 F352 K357 L358 I359 | G351-Q355 PolarHBondContact O-N 2.93Å; F352-Q355 PolarHBondContact O-N 3.19Å; Q355-K357 PolarHBondContact O-N 2.9Å; Q355-L358 WeakPolarHBondContact O-CB 3.46Å; Q355-L358 PolarHBondContact O-N 3.41Å; Q355-I359 WeakPolarHBondContact O-CG1 3.42Å; Q355-I359 PolarHBondContact O-N 3.32Å |
| 356 | L | 97.5 | Very high | 97.6 | Very high | 108 Ų | 108 | 105.1 Ų | 105.1 | 57% | 0.565 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -58.1 | -47.6 | 174.9 | -74 | 169.7 | 0 | 0 | 0 | 111.6 | F352 L358 I359 D360 | F352-L356 WeakPolarHBondContact O-CG 3.41Å; F352-L356 PolarHBondContact O-N 3.47Å; L356-L358 VanDerWaalsContact C-N 3.32Å; L356-L358 PolarHBondContact O-N 3.23Å; L356-I359 WeakPolarHBondContact O-CB 3.44Å; L356-I359 PolarHBondContact O-N 2.91Å; L356-D360 PolarHBondContact O-N 3.22Å; L356-D360 VanDerWaalsContact O-N 3.08Å |
| 357 | K | 97.6 | Very high | 97.6 | Very high | 149 Ų | 149 | 109.6 Ų | 109.6 | 65% | 0.648 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.7 | -39.9 | 175.4 | -71.2 | -178.8 | 179 | -172.1 | 0 | 112.7 | K353 K354 Q355 D360 V361 | K353-K357 WeakPolarHBondContact O-CG 3.46Å; K353-K357 PolarHBondContact O-N 3.38Å; K354-K357 PolarHBondContact O-N 3.13Å; Q355-K357 PolarHBondContact O-N 2.9Å; K357-D360 PolarHBondContact O-N 3.39Å; K357-V361 WeakPolarHBondContact O-CG2 3.29Å; K357-V361 PolarHBondContact O-N 2.9Å |
| 358 | L | 97.9 | Very high | 97.5 | Very high | 98 Ų | 98 | 108.9 Ų | 108.9 | 51% | 0.513 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.9 | -42.7 | 176.8 | 178.5 | 62 | 0 | 0 | 0 | 111.3 | K354 Q355 L356 D360 V361 L362 | K354-L358 PolarHBondContact O-N 3.14Å; Q355-L358 WeakPolarHBondContact O-CB 3.46Å; Q355-L358 PolarHBondContact O-N 3.41Å; L356-L358 VanDerWaalsContact C-N 3.32Å; L356-L358 PolarHBondContact O-N 3.23Å; L358-D360 VanDerWaalsContact C-N 3.29Å; L358-D360 PolarHBondContact O-N 3.13Å; L358-V361 PolarHBondContact O-N 3.21Å; L358-L362 HydrophobicContact CD1-CD1 4.14Å; L358-L362 HydrophobicContact CD1-CG 4.07Å; L358-L362 HydrophobicContact CD2-CD1 4.48Å; L358-L362 HydrophobicContact CG-CD1 3.87Å; L358-L362 HydrophobicContact CG-CG 4.26Å; L358-L362 WeakPolarHBondContact O-CB 3.39Å; L358-L362 VanDerWaalsContact O-CG 3.29Å; L358-L362 WeakPolarHBondContact O-CG 3.41Å; L358-L362 PolarHBondContact O-N 3.25Å |
| 359 | I | 97.6 | Very high | 97.4 | Very high | 76 Ų | 76 | 108.4 Ų | 108.4 | 39% | 0.39 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -57.5 | -44.3 | 174.7 | -70.3 | 165.8 | 0 | 0 | 0 | 110.5 | Q355 L356 V361 L362 K363 | Q355-I359 WeakPolarHBondContact O-CG1 3.42Å; Q355-I359 PolarHBondContact O-N 3.32Å; L356-I359 WeakPolarHBondContact O-CB 3.44Å; L356-I359 PolarHBondContact O-N 2.91Å; I359-V361 PolarHBondContact O-N 3.49Å; I359-L362 PolarHBondContact O-N 2.88Å; I359-K363 HydrophobicContact CG2-CD 3.98Å; I359-K363 HydrophobicContact CG2-CG 4.35Å; I359-K363 WeakPolarHBondContact O-CB 3.48Å; I359-K363 VanDerWaalsContact O-CG 3.3Å; I359-K363 WeakPolarHBondContact O-CG 3.46Å; I359-K363 PolarHBondContact O-N 3.08Å |
| 360 | D | 97.8 | Very high | 97.2 | Very high | 98 Ų | 98 | 108.4 Ų | 108.4 | 52% | 0.524 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.8 | -42.8 | 178.5 | -66.3 | -26 | 0 | 0 | 0 | 112.2 | L356 K357 L358 R364 | L356-D360 PolarHBondContact O-N 3.22Å; L356-D360 VanDerWaalsContact O-N 3.08Å; K357-D360 PolarHBondContact O-N 3.39Å; L358-D360 VanDerWaalsContact C-N 3.29Å; L358-D360 PolarHBondContact O-N 3.13Å; D360-R364 PolarHBondContact O-N 2.88Å; D360-R364 VanDerWaalsContact O-N 3.14Å |
| 361 | V | 97.5 | Very high | 97 | Very high | 72 Ų | 72 | 106.4 Ų | 106.4 | 44% | 0.436 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.7 | -47 | 175.4 | 172.7 | 0 | 0 | 0 | 0 | 111.1 | K357 L358 I359 K363 R364 Q365 | K357-V361 WeakPolarHBondContact O-CG2 3.29Å; K357-V361 PolarHBondContact O-N 2.9Å; L358-V361 PolarHBondContact O-N 3.21Å; I359-V361 PolarHBondContact O-N 3.49Å; V361-K363 PolarHBondContact O-N 3.37Å; V361-R364 WeakPolarHBondContact O-CB 3.3Å; V361-R364 PolarHBondContact O-N 2.86Å; V361-Q365 HydrophobicContact CG1-CG 4.39Å; V361-Q365 WeakPolarHBondContact O-CG 3.42Å; V361-Q365 PolarHBondContact O-N 3.5Å |
| 362 | L | 97.3 | Very high | 96.8 | Very high | 87 Ų | 87 | 107.7 Ų | 107.7 | 46% | 0.455 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64 | -40.4 | 180 | -72.4 | 172.7 | 0 | 0 | 0 | 112.1 | L358 I359 R364 Q365 K366 | L358-L362 HydrophobicContact CD1-CD1 4.14Å; L358-L362 HydrophobicContact CD1-CG 4.07Å; L358-L362 HydrophobicContact CD2-CD1 4.48Å; L358-L362 HydrophobicContact CG-CD1 3.87Å; L358-L362 HydrophobicContact CG-CG 4.26Å; L358-L362 WeakPolarHBondContact O-CB 3.39Å; L358-L362 VanDerWaalsContact O-CG 3.29Å; L358-L362 WeakPolarHBondContact O-CG 3.41Å; L358-L362 PolarHBondContact O-N 3.25Å; I359-L362 PolarHBondContact O-N 2.88Å; L362-R364 VanDerWaalsContact C-N 3.32Å; L362-R364 PolarHBondContact O-N 2.91Å; L362-Q365 PolarHBondContact O-N 3.27Å; L362-K366 WeakPolarHBondContact O-CB 3.35Å; L362-K366 PolarHBondContact O-N 2.91Å |
| 363 | K | 97.5 | Very high | 96.6 | Very high | 137 Ų | 137 | 109.3 Ų | 109.3 | 60% | 0.596 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -59.9 | -42.9 | 173.9 | -78.1 | 176 | 176.3 | 177.5 | 0 | 111.5 | I359 V361 K366 M367 | I359-K363 HydrophobicContact CG2-CD 3.98Å; I359-K363 HydrophobicContact CG2-CG 4.35Å; I359-K363 WeakPolarHBondContact O-CB 3.48Å; I359-K363 VanDerWaalsContact O-CG 3.3Å; I359-K363 WeakPolarHBondContact O-CG 3.46Å; I359-K363 PolarHBondContact O-N 3.08Å; V361-K363 PolarHBondContact O-N 3.37Å; K363-K366 PolarHBondContact O-N 3.47Å; K363-M367 PolarHBondContact O-N 2.95Å |
| 364 | R | 96.9 | Very high | 96.3 | Very high | 167 Ų | 167 | 109.2 Ų | 109.2 | 63% | 0.63 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65.3 | -44.3 | 176.1 | -170.9 | -173 | -58.4 | -95.3 | -2.1 | 111.9 | D360 V361 L362 M367 H368 | D360-R364 PolarHBondContact O-N 2.88Å; D360-R364 VanDerWaalsContact O-N 3.14Å; V361-R364 WeakPolarHBondContact O-CB 3.3Å; V361-R364 PolarHBondContact O-N 2.86Å; L362-R364 VanDerWaalsContact C-N 3.32Å; L362-R364 PolarHBondContact O-N 2.91Å; R364-M367 WeakPolarHBondContact O-CB 3.38Å; R364-M367 PolarHBondContact O-N 3.47Å; R364-H368 PolarHBondContact O-CD2 2.84Å; R364-H368 PolarHBondContact O-N 2.99Å |
| 365 | Q | 96.8 | Very high | 95.9 | Very high | 100 Ų | 100 | 107.6 Ų | 107.6 | 47% | 0.467 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.5 | -44.9 | 175.6 | -74.3 | 177.1 | -19.4 | 0 | 0 | 111.9 | V361 L362 M367 H368 I369 | V361-Q365 HydrophobicContact CG1-CG 4.39Å; V361-Q365 WeakPolarHBondContact O-CG 3.42Å; V361-Q365 PolarHBondContact O-N 3.5Å; L362-Q365 PolarHBondContact O-N 3.27Å; Q365-M367 VanDerWaalsContact C-N 3.31Å; Q365-M367 PolarHBondContact O-N 3.2Å; Q365-H368 PolarHBondContact O-N 3.41Å; Q365-I369 WeakPolarHBondContact O-CG1 3.4Å; Q365-I369 PolarHBondContact O-N 3.33Å |
| 366 | K | 96.8 | Very high | 95.6 | Very high | 126 Ų | 126 | 104.3 Ų | 104.3 | 55% | 0.548 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -55.7 | -47.7 | 174.7 | 179 | -179.8 | 171 | -178.8 | 0 | 111 | L362 K363 H368 I369 E370 | L362-K366 WeakPolarHBondContact O-CB 3.35Å; L362-K366 PolarHBondContact O-N 2.91Å; K363-K366 PolarHBondContact O-N 3.47Å; K366-H368 PolarHBondContact O-N 3.31Å; K366-I369 PolarHBondContact O-N 3.46Å; K366-E370 WeakPolarHBondContact CE-OE1 3.34Å; K366-E370 HydrophobicContact CG-CG 4.44Å; K366-E370 IonicContact NZ-OE1 3.73Å; K366-E370 WeakPolarHBondContact O-CB 3.32Å; K366-E370 WeakPolarHBondContact O-CG 3.4Å; K366-E370 PolarHBondContact O-N 3.3Å |
| 367 | M | 96 | Very high | 95.2 | Very high | 125 Ų | 125 | 104.7 Ų | 104.7 | 62% | 0.616 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -58.7 | -45.8 | 176.6 | -177.8 | -169.4 | -67.1 | 0 | 0 | 112.2 | K363 R364 Q365 E370 A371 | K363-M367 PolarHBondContact O-N 2.95Å; R364-M367 WeakPolarHBondContact O-CB 3.38Å; R364-M367 PolarHBondContact O-N 3.47Å; Q365-M367 VanDerWaalsContact C-N 3.31Å; Q365-M367 PolarHBondContact O-N 3.2Å; M367-E370 PolarHBondContact O-N 3.49Å; M367-A371 WeakPolarHBondContact O-CB 2.77Å; M367-A371 PolarHBondContact O-N 3.48Å |
| 368 | H | 96.3 | Very high | 94.8 | Very high | 119 Ų | 119 | 101.7 Ų | 101.7 | 55% | 0.551 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.7 | -41.6 | 176.9 | -70.8 | -52.3 | 0 | 0 | 0 | 112.7 | R364 Q365 K366 A371 A372 | R364-H368 PolarHBondContact O-CD2 2.84Å; R364-H368 PolarHBondContact O-N 2.99Å; Q365-H368 PolarHBondContact O-N 3.41Å; K366-H368 PolarHBondContact O-N 3.31Å; H368-A371 PolarHBondContact O-N 3.05Å; H368-A372 WeakPolarHBondContact O-CB 3.4Å; H368-A372 PolarHBondContact O-N 3.49Å |
| 369 | I | 96 | Very high | 94.3 | Very high | 97 Ų | 97 | 103.1 Ų | 103.1 | 50% | 0.497 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.6 | -43.5 | 177.8 | -68.4 | 167.7 | 0 | 0 | 0 | 111 | Q365 K366 A372 K373 | Q365-I369 WeakPolarHBondContact O-CG1 3.4Å; Q365-I369 PolarHBondContact O-N 3.33Å; K366-I369 PolarHBondContact O-N 3.46Å; I369-A372 PolarHBondContact O-N 3.43Å; I369-K373 HydrophobicContact CG2-CD 4.37Å; I369-K373 WeakPolarHBondContact O-CG 3.42Å; I369-K373 PolarHBondContact O-N 2.9Å |
| 370 | E | 94.6 | Very high | 93.8 | Very high | 100 Ų | 100 | 104.8 Ų | 104.8 | 47% | 0.467 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62 | -43.6 | 176.4 | -75.6 | 175.3 | 170.2 | 0 | 0 | 111.3 | K366 M367 A372 K373 M374 | K366-E370 WeakPolarHBondContact CE-OE1 3.34Å; K366-E370 HydrophobicContact CG-CG 4.44Å; K366-E370 IonicContact NZ-OE1 3.73Å; K366-E370 WeakPolarHBondContact O-CB 3.32Å; K366-E370 WeakPolarHBondContact O-CG 3.4Å; K366-E370 PolarHBondContact O-N 3.3Å; M367-E370 PolarHBondContact O-N 3.49Å; E370-A372 PolarHBondContact O-N 2.88Å; E370-K373 PolarHBondContact O-N 2.96Å; E370-M374 WeakPolarHBondContact O-CG 3.47Å; E370-M374 PolarHBondContact O-N 3.32Å |
| 371 | A | 93.5 | Very high | 93.2 | Very high | 51 Ų | 51 | 104 Ų | 104 | 42% | 0.421 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.4 | -44.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | M367 H368 K373 M374 L375 | M367-A371 WeakPolarHBondContact O-CB 2.77Å; M367-A371 PolarHBondContact O-N 3.48Å; H368-A371 PolarHBondContact O-N 3.05Å; A371-K373 PolarHBondContact O-N 2.96Å; A371-M374 PolarHBondContact O-N 2.95Å; A371-L375 WeakPolarHBondContact O-CG 3.43Å; A371-L375 PolarHBondContact O-N 3.31Å |
| 372 | A | 93.3 | Very high | 92.6 | Very high | 57 Ų | 57 | 107.1 Ų | 107.1 | 47% | 0.471 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63 | -39.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | H368 I369 E370 L375 S376 | H368-A372 WeakPolarHBondContact O-CB 3.4Å; H368-A372 PolarHBondContact O-N 3.49Å; I369-A372 PolarHBondContact O-N 3.43Å; E370-A372 PolarHBondContact O-N 2.88Å; A372-L375 PolarHBondContact O-N 2.79Å; A372-S376 PolarHBondContact O-N 2.9Å |
| 373 | K | 93.3 | Very high | 92.1 | Very high | 140 Ų | 140 | 108.1 Ų | 108.1 | 61% | 0.609 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -66.2 | -40.1 | 174.5 | -76.1 | -178.5 | 177.2 | -174.4 | 0 | 112.9 | I369 E370 A371 L375 S376 F377 | I369-K373 HydrophobicContact CG2-CD 4.37Å; I369-K373 WeakPolarHBondContact O-CG 3.42Å; I369-K373 PolarHBondContact O-N 2.9Å; E370-K373 PolarHBondContact O-N 2.96Å; A371-K373 PolarHBondContact O-N 2.96Å; K373-L375 VanDerWaalsContact C-N 3.3Å; K373-S376 PolarHBondContact O-N 2.84Å; K373-S376 PolarHBondContact O-OG 3.37Å; K373-F377 PolarHBondContact O-N 3.38Å |
| 374 | M | 91.5 | Very high | 91.5 | Very high | 127 Ų | 127 | 106.1 Ų | 106.1 | 63% | 0.626 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -65.5 | -37.5 | 175.5 | -69.6 | -61.8 | -65 | 0 | 0 | 111.2 | E370 A371 T378 | E370-M374 WeakPolarHBondContact O-CG 3.47Å; E370-M374 PolarHBondContact O-N 3.32Å; A371-M374 PolarHBondContact O-N 2.95Å; M374-T378 PolarHBondContact O-N 2.9Å; M374-T378 VanDerWaalsContact O-N 3.07Å; M374-T378 PolarHBondContact O-OG1 3.43Å |
| 375 | L | 90.9 | Very high | 90.7 | Very high | 110 Ų | 110 | 101.2 Ų | 101.2 | 58% | 0.576 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.8 | -48 | 172.3 | -74.9 | 169 | 0 | 0 | 0 | 111.5 | A371 A372 K373 F377 T378 E379 | A371-L375 WeakPolarHBondContact O-CG 3.43Å; A371-L375 PolarHBondContact O-N 3.31Å; A372-L375 PolarHBondContact O-N 2.79Å; K373-L375 VanDerWaalsContact C-N 3.3Å; L375-F377 VanDerWaalsContact C-N 3.32Å; L375-F377 PolarHBondContact O-N 3.07Å; L375-T378 WeakPolarHBondContact O-CB 3.46Å; L375-T378 PolarHBondContact O-N 3.35Å; L375-T378 VanDerWaalsContact O-N 3.07Å; L375-E379 WeakPolarHBondContact O-CG 3.42Å; L375-E379 PolarHBondContact O-N 3.07Å |
| 376 | S | 90 | Very high | 89.8 | Confident | 46 Ų | 46 | 101.2 Ų | 101.2 | 32% | 0.322 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.3 | -37.2 | 178.4 | 70.9 | 0 | 0 | 0 | 0 | 112.6 | A372 K373 T378 E379 E380 | A372-S376 PolarHBondContact O-N 2.9Å; K373-S376 PolarHBondContact O-N 2.84Å; K373-S376 PolarHBondContact O-OG 3.37Å; S376-T378 VanDerWaalsContact C-N 3.35Å; S376-E379 PolarHBondContact O-N 3.36Å; S376-E380 WeakPolarHBondContact O-CB 3.45Å; S376-E380 WeakPolarHBondContact O-CG 3.27Å; S376-E380 PolarHBondContact O-N 2.94Å |
| 377 | F | 90.5 | Very high | 88.6 | Confident | 116 Ų | 116 | 101.5 Ų | 101.5 | 51% | 0.509 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.6 | -40.9 | 173 | -176.4 | -98.4 | 0 | 0 | 0 | 111.9 | K373 L375 E380 E381 | K373-F377 PolarHBondContact O-N 3.38Å; L375-F377 VanDerWaalsContact C-N 3.32Å; L375-F377 PolarHBondContact O-N 3.07Å; F377-E380 PolarHBondContact O-N 2.94Å; F377-E381 HydrophobicContact CD1-CG 4.21Å; F377-E381 HydrophobicContact CE1-CG 3.79Å; F377-E381 HydrophobicContact CE2-CG 4.37Å; F377-E381 HydrophobicContact CZ-CG 3.88Å; F377-E381 WeakPolarHBondContact O-CB 3.27Å; F377-E381 WeakPolarHBondContact O-CG 3.43Å; F377-E381 PolarHBondContact O-N 2.98Å |
| 378 | T | 88.6 | Confident | 87 | Confident | 87 Ų | 87 | 106.3 Ų | 106.3 | 53% | 0.534 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66 | -40.7 | 176.3 | -51.4 | 0 | 0 | 0 | 0 | 111.2 | M374 L375 S376 F382 | M374-T378 PolarHBondContact O-N 2.9Å; M374-T378 VanDerWaalsContact O-N 3.07Å; M374-T378 PolarHBondContact O-OG1 3.43Å; L375-T378 WeakPolarHBondContact O-CB 3.46Å; L375-T378 PolarHBondContact O-N 3.35Å; L375-T378 VanDerWaalsContact O-N 3.07Å; S376-T378 VanDerWaalsContact C-N 3.35Å; T378-F382 VanDerWaalsContact O-CB 3.27Å; T378-F382 WeakPolarHBondContact O-CB 3.43Å; T378-F382 PolarHBondContact O-N 2.87Å |
| 379 | E | 87.9 | Confident | 85.2 | Confident | 128 Ų | 128 | 103.6 Ų | 103.6 | 60% | 0.598 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -62.7 | -44.9 | 173.9 | -73 | 175 | -178.6 | 0 | 0 | 111.9 | L375 S376 F382 M383 | L375-E379 WeakPolarHBondContact O-CG 3.42Å; L375-E379 PolarHBondContact O-N 3.07Å; S376-E379 PolarHBondContact O-N 3.36Å; E379-F382 PolarHBondContact O-N 3.4Å; E379-M383 VanDerWaalsContact O-CG 3.27Å; E379-M383 WeakPolarHBondContact O-CG 3.37Å; E379-M383 PolarHBondContact O-N 2.98Å |
| 380 | E | 87 | Confident | 83.1 | Confident | 111 Ų | 111 | 106.1 Ų | 106.1 | 52% | 0.519 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61.9 | -46.4 | 176.3 | -78.9 | 176.4 | -162.8 | 0 | 0 | 112.3 | S376 F377 F382 M383 K384 | S376-E380 WeakPolarHBondContact O-CB 3.45Å; S376-E380 WeakPolarHBondContact O-CG 3.27Å; S376-E380 PolarHBondContact O-N 2.94Å; F377-E380 PolarHBondContact O-N 2.94Å; E380-F382 VanDerWaalsContact C-N 3.33Å; E380-F382 PolarHBondContact O-N 3.44Å; E380-M383 PolarHBondContact O-N 3.43Å; E380-K384 WeakPolarHBondContact O-CG 3.39Å; E380-K384 PolarHBondContact O-N 3Å |
| 381 | E | 85.9 | Confident | 80.9 | Confident | 82 Ų | 82 | 110.2 Ų | 110.2 | 38% | 0.383 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -64.6 | -38.1 | 176.6 | -71.4 | -62.2 | 125.2 | 0 | 0 | 111.8 | F377 K384 A385 | F377-E381 HydrophobicContact CD1-CG 4.21Å; F377-E381 HydrophobicContact CE1-CG 3.79Å; F377-E381 HydrophobicContact CE2-CG 4.37Å; F377-E381 HydrophobicContact CZ-CG 3.88Å; F377-E381 WeakPolarHBondContact O-CB 3.27Å; F377-E381 WeakPolarHBondContact O-CG 3.43Å; F377-E381 PolarHBondContact O-N 2.98Å; E381-K384 PolarHBondContact O-N 2.97Å; E381-K384 IonicContact OE1-NZ 3.88Å; E381-K384 PolarHBondContact OE1-NZ 3.25Å; E381-A385 WeakPolarHBondContact O-CB 3.49Å; E381-A385 PolarHBondContact O-N 3.14Å |
| 382 | F | 84.8 | Confident | 80.2 | Confident | 136 Ų | 136 | 113.2 Ų | 113.2 | 60% | 0.596 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -62.6 | -43.5 | 173.4 | -177.9 | -99.7 | 0 | 0 | 0 | 112 | T378 E379 E380 A385 L386 | T378-F382 VanDerWaalsContact O-CB 3.27Å; T378-F382 WeakPolarHBondContact O-CB 3.43Å; T378-F382 PolarHBondContact O-N 2.87Å; E379-F382 PolarHBondContact O-N 3.4Å; E380-F382 VanDerWaalsContact C-N 3.33Å; E380-F382 PolarHBondContact O-N 3.44Å; F382-A385 PolarHBondContact O-N 3.12Å; F382-L386 HydrophobicContact CD1-CD1 4.01Å; F382-L386 HydrophobicContact CE1-CD1 3.55Å; F382-L386 HydrophobicContact CE1-CG 4.3Å; F382-L386 HydrophobicContact CZ-CD1 4.13Å; F382-L386 PolarHBondContact O-N 3.32Å; F382-L386 VanDerWaalsContact O-N 3.12Å |
| 383 | M | 85.9 | Confident | 79.6 | Confident | 109 Ų | 109 | 116.1 Ų | 116.1 | 54% | 0.537 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -64.2 | -42.1 | 176.2 | -71.5 | -69.5 | -73.9 | 0 | 0 | 112.1 | E379 E380 A385 L386 E387 | E379-M383 VanDerWaalsContact O-CG 3.27Å; E379-M383 WeakPolarHBondContact O-CG 3.37Å; E379-M383 PolarHBondContact O-N 2.98Å; E380-M383 PolarHBondContact O-N 3.43Å; M383-A385 VanDerWaalsContact C-N 3.33Å; M383-A385 PolarHBondContact O-N 2.95Å; M383-L386 WeakPolarHBondContact O-CB 3.49Å; M383-L386 PolarHBondContact O-N 3.29Å; M383-L386 VanDerWaalsContact O-N 3.14Å; M383-L386 HydrophobicContact SD-CD1 4.43Å; M383-E387 PolarHBondContact O-N 3.5Å |
| 384 | K | 84 | Confident | 78.8 | Confident | 94 Ų | 94 | 114.8 Ų | 114.8 | 41% | 0.409 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -60.6 | -41.3 | 173.8 | -72.1 | 176.2 | -164.3 | 161.6 | 0 | 112.3 | E380 E381 L386 E387 W388 | E380-K384 WeakPolarHBondContact O-CG 3.39Å; E380-K384 PolarHBondContact O-N 3Å; E381-K384 PolarHBondContact O-N 2.97Å; E381-K384 IonicContact OE1-NZ 3.88Å; E381-K384 PolarHBondContact OE1-NZ 3.25Å; K384-L386 VanDerWaalsContact C-N 3.25Å; K384-L386 PolarHBondContact O-N 3.19Å; K384-E387 PolarHBondContact O-N 3.01Å; K384-W388 PolarHBondContact O-N 3.18Å |
| 385 | A | 80.4 | Confident | 78 | Confident | 64 Ų | 64 | 114.1 Ų | 114.1 | 53% | 0.529 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -63.3 | -32.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | E381 F382 M383 | E381-A385 WeakPolarHBondContact O-CB 3.49Å; E381-A385 PolarHBondContact O-N 3.14Å; F382-A385 PolarHBondContact O-N 3.12Å; M383-A385 VanDerWaalsContact C-N 3.33Å; M383-A385 PolarHBondContact O-N 2.95Å |
| 386 | L | 77.8 | Confident | 77.2 | Confident | 100 Ų | 100 | 114.3 Ų | 114.3 | 52% | 0.524 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -71.1 | -39.5 | 171.6 | -71.9 | 172.8 | 0 | 0 | 0 | 112.5 | F382 M383 K384 G389 | F382-L386 HydrophobicContact CD1-CD1 4.01Å; F382-L386 HydrophobicContact CE1-CD1 3.55Å; F382-L386 HydrophobicContact CE1-CG 4.3Å; F382-L386 HydrophobicContact CZ-CD1 4.13Å; F382-L386 PolarHBondContact O-N 3.32Å; F382-L386 VanDerWaalsContact O-N 3.12Å; M383-L386 WeakPolarHBondContact O-CB 3.49Å; M383-L386 PolarHBondContact O-N 3.29Å; M383-L386 VanDerWaalsContact O-N 3.14Å; M383-L386 HydrophobicContact SD-CD1 4.43Å; K384-L386 VanDerWaalsContact C-N 3.25Å; K384-L386 PolarHBondContact O-N 3.19Å; L386-G389 PolarHBondContact O-N 3.39Å |
| 387 | E | 72.9 | Confident | 76.4 | Confident | 133 Ų | 133 | 118.9 Ų | 118.9 | 62% | 0.621 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -67.7 | -31.7 | 177.8 | -73.3 | 178.8 | 174.8 | 0 | 0 | 113.1 | M383 K384 G389 N390 | M383-E387 PolarHBondContact O-N 3.5Å; K384-E387 PolarHBondContact O-N 3.01Å; E387-G389 PolarHBondContact O-N 2.76Å; E387-N390 PolarHBondContact O-N 3.2Å |
| 388 | W | 61.3 | Low | 75.4 | Confident | 226 Ų | 226 | 119.1 Ų | 119.1 | 86% | 0.856 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.1 | -13.1 | 172.3 | -78.6 | 1 | 0 | 0 | 0 | 114.5 | K384 | K384-W388 PolarHBondContact O-N 3.18Š|
| 389 | G | 58.2 | Low | 74.4 | Confident | 61 Ų | 61 | 121.5 Ų | 121.5 | 63% | 0.629 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | -8.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | L386 E387 | L386-G389 PolarHBondContact O-N 3.39Å; E387-G389 PolarHBondContact O-N 2.76Å |
| 390 | N | 53.7 | Low | 73.2 | Confident | 150 Ų | 150 | 121 Ų | 121 | 80% | 0.802 | 64% | 0.642 | S | S | * | * | trans | -111.6 | 58.1 | -178.1 | -79.8 | -12.9 | 0 | 0 | 0 | 112.3 | E387 | E387-N390 PolarHBondContact O-N 3.2Š| ||
| 391 | S | 47.1 | Very low | 72 | Confident | 186 Ų | 186 | 121.9 Ų | 121.9 | 100% | 1.301 | 65% | 0.653 | S | S | * | * | trans | -101 | 0 | 156.5 | -74.8 | 0 | 0 | 0 | 0 | 111 |
Retrieved 391 of 391 residues in 178.3 ms
(Link to these results)