| 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 | 39.1 | Very low | 38.5 | Very low | 242 Ų | 242 | 156.5 Ų | 156.5 | 100% | 1.192 | 78% | 0.784 | S | S | * | * | 0 | 128.7 | 0 | -69.6 | -165.8 | 153.9 | 0 | 0 | 107.5 | |||||
| 2 | S | 36 | Very low | 37.9 | Very low | 106 Ų | 106 | 155.1 Ų | 155.1 | 74% | 0.741 | 78% | 0.781 | S | S | * | * | cis | -174.7 | 128.6 | -19 | -87.1 | 0 | 0 | 0 | 0 | 103.7 | ||||
| 3 | R | 40.3 | Very low | 37.8 | Very low | 222 Ų | 222 | 151.2 Ų | 151.2 | 84% | 0.838 | 77% | 0.771 | S | S | * | * | trans | 64.7 | 147.2 | 152.3 | -75.7 | -180 | 167.7 | 163.9 | 0.1 | 117.6 | ||||
| 4 | K | 41.1 | Very low | 37.3 | Very low | 162 Ų | 162 | 149 Ų | 149 | 70% | 0.704 | 77% | 0.768 | S | S | * | * | cis | -166.6 | 126.5 | 13.4 | -113.5 | 161.8 | 174.6 | -166.8 | 0 | 104 | ||||
| 5 | Q | 43.8 | Very low | 37.4 | Very low | 181 Ų | 181 | 145.5 Ų | 145.5 | 85% | 0.846 | 76% | 0.762 | S | S | * | * | 38.5 | 111.2 | 88.6 | -106.8 | 166.8 | -16.3 | 0 | 0 | 115.1 | |||||
| 6 | Q | 39.7 | Very low | 37.4 | Very low | 166 Ų | 166 | 142.1 Ų | 142.1 | 78% | 0.776 | 76% | 0.762 | S | S | * | * | trans | -142.3 | 105.4 | 145.5 | -153.1 | 153.1 | -14.3 | 0 | 0 | 109.1 | ||||
| 7 | V | 39.4 | Very low | 37.3 | Very low | 111 Ų | 111 | 144.6 Ų | 144.6 | 67% | 0.673 | 77% | 0.768 | S | S | * | * | trans | -91.3 | 133.6 | 157.4 | 165.2 | 0 | 0 | 0 | 0 | 104.7 | ||||
| 8 | E | 40 | Very low | 37.2 | Very low | 169 Ų | 169 | 145.7 Ų | 145.7 | 79% | 0.79 | 77% | 0.767 | S | S | * | * | trans | -133.7 | 103.7 | 155.8 | -94.2 | 176.8 | -163.7 | 0 | 0 | 107.2 | ||||
| 9 | D | 36.2 | Very low | 37.2 | Very low | 137 Ų | 137 | 146.5 Ų | 146.5 | 73% | 0.733 | 77% | 0.772 | S | S | * | * | trans | -69.2 | 143.1 | 145.5 | -79.6 | -43.8 | 0 | 0 | 0 | 108 | ||||
| 10 | D | 34.6 | Very low | 37.2 | Very low | 146 Ų | 146 | 148.1 Ų | 148.1 | 78% | 0.781 | 77% | 0.774 | S | S | * | * | trans | -172.9 | 105.7 | 130.7 | -98.1 | -28.3 | 0 | 0 | 0 | 107.5 | ||||
| 11 | S | 33.8 | Very low | 37.2 | Very low | 79 Ų | 79 | 145.9 Ų | 145.9 | 55% | 0.552 | 77% | 0.771 | S | S | * | * | 61.9 | 106 | 85.7 | 82.6 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 12 | N | 31.2 | Very low | 37 | Very low | 140 Ų | 140 | 142.8 Ų | 142.8 | 75% | 0.749 | 75% | 0.754 | S | S | * | * | 129.5 | 141.8 | 120 | -80.4 | -22.5 | 0 | 0 | 0 | 105.2 | |||||
| 13 | T | 36.8 | Very low | 36.8 | Very low | 105 Ų | 105 | 145.4 Ų | 145.4 | 64% | 0.644 | 76% | 0.759 | S | S | * | * | cis | 178.7 | 152.2 | 20.5 | 18.2 | 0 | 0 | 0 | 0 | 104.4 | ||||
| 14 | T | 30.6 | Very low | 36.6 | Very low | 120 Ų | 120 | 142.2 Ų | 142.2 | 74% | 0.736 | 76% | 0.757 | S | S | * | * | trans | 47.3 | 116.9 | 141 | 63.8 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 15 | S | 39.1 | Very low | 36.2 | Very low | 96 Ų | 96 | 138.4 Ų | 138.4 | 67% | 0.671 | 75% | 0.751 | S | S | * | * | -169.6 | 129 | 74.5 | -64.6 | 0 | 0 | 0 | 0 | 106.5 | |||||
| 16 | A | 36.5 | Very low | 36 | Very low | 92 Ų | 92 | 139 Ų | 139 | 76% | 0.76 | 75% | 0.751 | S | S | * | * | 46 | 59 | 57.6 | 0 | 0 | 0 | 0 | 0 | 112 | E18 | A16-E18 VanDerWaalsContact C-N 3.31Å; A16-E18 PolarHBondContact O-N 3.46Å | |||
| 17 | E | 35.8 | Very low | 35.8 | Very low | 185 Ų | 185 | 138.4 Ų | 138.4 | 86% | 0.864 | 75% | 0.748 | S | S | * | * | trans | -90.2 | 85 | 155.7 | -75.9 | -177.4 | 172.7 | 0 | 0 | 107.1 | L19 | E17-L19 PolarHBondContact O-N 3.48Š| ||
| 18 | E | 35.3 | Very low | 35.9 | Very low | 163 Ų | 163 | 140 Ų | 140 | 76% | 0.762 | 75% | 0.752 | S | S | * | * | trans | -48.4 | 125.3 | 159.1 | -77.7 | 170.7 | 140.6 | 0 | 0 | 108.7 | A16 H20 | A16-E18 VanDerWaalsContact C-N 3.31Å; A16-E18 PolarHBondContact O-N 3.46Å; E18-H20 VanDerWaalsContact C-N 3.35Å; E18-H20 PolarHBondContact O-N 3.39Å | ||
| 19 | L | 38.3 | Very low | 35.9 | Very low | 162 Ų | 162 | 137.5 Ų | 137.5 | 85% | 0.848 | 75% | 0.749 | S | S | * | * | trans | -52.9 | 103.9 | 158.7 | -75.9 | 157 | 0 | 0 | 0 | 107.2 | E17 S21 | E17-L19 PolarHBondContact O-N 3.48Å; L19-S21 PolarHBondContact O-N 3.43Å | ||
| 20 | H | 35.5 | Very low | 36.1 | Very low | 178 Ų | 178 | 136.8 Ų | 136.8 | 82% | 0.824 | 74% | 0.741 | S | S | * | * | trans | -58.5 | 86.8 | 157.7 | -78.8 | -52.9 | 0 | 0 | 0 | 107.5 | E18 E22 | E18-H20 VanDerWaalsContact C-N 3.35Å; E18-H20 PolarHBondContact O-N 3.39Å; H20-E22 PolarHBondContact O-N 3.23Å; H20-E22 VanDerWaalsContact O-N 3.12Å | ||
| 21 | S | 37.3 | Very low | 36.5 | Very low | 101 Ų | 101 | 136.3 Ų | 136.3 | 71% | 0.706 | 74% | 0.744 | S | S | * | * | trans | -68.3 | 98.2 | 152 | -56.5 | 0 | 0 | 0 | 0 | 103.5 | L19 D23 | L19-S21 PolarHBondContact O-N 3.43Å; S21-D23 PolarHBondContact O-N 3.49Å | ||
| 22 | E | 34.9 | Very low | 36.9 | Very low | 177 Ų | 177 | 136.6 Ų | 136.6 | 83% | 0.827 | 74% | 0.739 | S | S | * | * | trans | -50 | 113.2 | 168 | -74.9 | 178.7 | 157.3 | 0 | 0 | 106.8 | H20 I24 | H20-E22 PolarHBondContact O-N 3.23Å; H20-E22 VanDerWaalsContact O-N 3.12Å; E22-I24 VanDerWaalsContact C-N 3.28Å; E22-I24 PolarHBondContact O-N 3.21Å | ||
| 23 | D | 33.5 | Very low | 37.6 | Very low | 161 Ų | 161 | 133.8 Ų | 133.8 | 86% | 0.861 | 73% | 0.73 | S | S | * | * | trans | -48 | 101.8 | 162.5 | -86.9 | -41.8 | 0 | 0 | 0 | 106.4 | S21 S25 | S21-D23 PolarHBondContact O-N 3.49Å; D23-S25 PolarHBondContact O-N 2.91Å | ||
| 24 | I | 35 | Very low | 37.7 | Very low | 155 Ų | 155 | 136.6 Ų | 136.6 | 80% | 0.795 | 74% | 0.736 | S | S | * | * | trans | -63.8 | 88.4 | 155.8 | -62.6 | 174.8 | 0 | 0 | 0 | 103.5 | E22 K26 | E22-I24 VanDerWaalsContact C-N 3.28Å; E22-I24 PolarHBondContact O-N 3.21Å; I24-K26 VanDerWaalsContact C-N 3.27Å; I24-K26 PolarHBondContact O-N 3.32Å | ||
| 25 | S | 32.9 | Very low | 38.4 | Very low | 83 Ų | 83 | 133.2 Ų | 133.2 | 58% | 0.58 | 72% | 0.72 | S | S | * | * | trans | -43.1 | 102.8 | 158.9 | 177.6 | 0 | 0 | 0 | 0 | 105.6 | D23 H27 | D23-S25 PolarHBondContact O-N 2.91Å; S25-H27 PolarHBondContact O-N 3.3Å | ||
| 26 | K | 39.8 | Very low | 38.8 | Very low | 193 Ų | 193 | 131 Ų | 131 | 84% | 0.839 | 71% | 0.708 | S | S | * | * | trans | -63.6 | 80.3 | 158.3 | -72.3 | 178.6 | 179.8 | 177.1 | 0 | 104.6 | I24 D28 | I24-K26 VanDerWaalsContact C-N 3.27Å; I24-K26 PolarHBondContact O-N 3.32Å; K26-D28 PolarHBondContact O-N 2.85Å | ||
| 27 | H | 34.8 | Very low | 39.4 | Very low | 153 Ų | 153 | 132.2 Ų | 132.2 | 71% | 0.708 | 70% | 0.701 | S | S | * | * | trans | -60.8 | 99.6 | 152.2 | -112.2 | -62 | 0 | 0 | 0 | 104.5 | S25 V29 | S25-H27 PolarHBondContact O-N 3.3Å; H27-V29 HydrophobicContact CB-CG2 4.24Å; H27-V29 PolarHBondContact O-N 3.46Å | ||
| 28 | D | 42.8 | Very low | 40 | Very low | 144 Ų | 144 | 126.9 Ų | 126.9 | 77% | 0.77 | 68% | 0.683 | S | S | * | * | trans | -48.1 | 80.6 | 144.7 | -89 | -33.3 | 0 | 0 | 0 | 107 | K26 H30 | K26-D28 PolarHBondContact O-N 2.85Å; D28-H30 PolarHBondContact O-N 3.02Å | ||
| 29 | V | 40.3 | Very low | 40.6 | Very low | 118 Ų | 118 | 125.7 Ų | 125.7 | 72% | 0.715 | 68% | 0.678 | S | S | * | * | trans | -85.3 | 85.2 | 150.5 | -179.4 | 0 | 0 | 0 | 0 | 103.6 | H27 | H27-V29 HydrophobicContact CB-CG2 4.24Å; H27-V29 PolarHBondContact O-N 3.46Å | ||
| 30 | H | 38.8 | Very low | 41.3 | Very low | 121 Ų | 121 | 121.9 Ų | 121.9 | 56% | 0.56 | 66% | 0.661 | S | S | * | * | trans | 28.3 | 117.2 | 139.3 | -67.7 | -20 | 0 | 0 | 0 | 115.9 | D28 D32 | D28-H30 PolarHBondContact O-N 3.02Å; H30-D32 HydrophobicContact CB-CB 3.75Å; H30-D32 WeakPolarHBondContact CB-OD2 3.32Å; H30-D32 IonicContact CD2-OD2 3.32Å; H30-D32 PolarHBondContact CD2-OD2 2.85Å; H30-D32 VanDerWaalsContact CD2-OD2 3.32Å; H30-D32 IonicContact CG-OD2 3.4Å; H30-D32 PolarHBondContact O-N 3.4Å | ||
| 31 | T | 44.3 | Very low | 42.3 | Very low | 137 Ų | 137 | 116.1 Ų | 116.1 | 84% | 0.84 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -41.9 | 28.3 | 140.7 | 34.1 | 0 | 0 | 0 | 0 | 115.7 | ||
| 32 | D | 40.4 | Very low | 43.1 | Very low | 84 Ų | 84 | 116.6 Ų | 116.6 | 45% | 0.449 | 64% | 0.639 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -109.8 | -10.5 | -178.2 | -62.6 | -10.4 | 0 | 0 | 0 | 111.8 | H30 A36 | H30-D32 HydrophobicContact CB-CB 3.75Å; H30-D32 WeakPolarHBondContact CB-OD2 3.32Å; H30-D32 IonicContact CD2-OD2 3.32Å; H30-D32 PolarHBondContact CD2-OD2 2.85Å; H30-D32 VanDerWaalsContact CD2-OD2 3.32Å; H30-D32 IonicContact CG-OD2 3.4Å; H30-D32 PolarHBondContact O-N 3.4Å; D32-A36 WeakPolarHBondContact O-CB 3.36Å; D32-A36 PolarHBondContact O-N 3.19Å |
| 33 | S | 47.8 | Very low | 44 | Very low | 82 Ų | 82 | 113.1 Ų | 113.1 | 57% | 0.573 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -76.9 | -31.5 | 176.4 | -160.9 | 0 | 0 | 0 | 0 | 112.9 | L37 | S33-L37 WeakPolarHBondContact O-CB 3.44Å; S33-L37 WeakPolarHBondContact O-CD1 3.39Å; S33-L37 VanDerWaalsContact O-CG 3.27Å; S33-L37 WeakPolarHBondContact O-CG 3.43Å; S33-L37 PolarHBondContact O-N 3.34Å |
| 34 | E | 38.8 | Very low | 45.2 | Very low | 164 Ų | 164 | 109.6 Ų | 109.6 | 77% | 0.766 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -73.1 | -37.8 | 170.9 | -69.5 | -174.6 | 170.1 | 0 | 0 | 110.8 | C38 | E34-C38 VanDerWaalsContact O-CB 3.22Å; E34-C38 WeakPolarHBondContact O-CB 3.25Å; E34-C38 PolarHBondContact O-N 2.84Å; E34-C38 PolarHBondContact O-SG 3.47Å |
| 35 | A | 45.3 | Very low | 46.3 | Very low | 48 Ų | 48 | 104.7 Ų | 104.7 | 40% | 0.397 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -70.1 | -37.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | C38 E39 | A35-C38 CarbonylContact O-C 3.56Å; A35-C38 PolarHBondContact O-N 3.26Å; A35-E39 WeakPolarHBondContact O-CB 3.43Å; A35-E39 PolarHBondContact O-N 3Å |
| 36 | A | 47.2 | Very low | 47.4 | Very low | 51 Ų | 51 | 106.7 Ų | 106.7 | 42% | 0.421 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -77.1 | -33.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | D32 C38 T40 | D32-A36 WeakPolarHBondContact O-CB 3.36Å; D32-A36 PolarHBondContact O-N 3.19Å; A36-C38 VanDerWaalsContact C-N 3.32Å; A36-T40 WeakPolarHBondContact O-CB 3.3Å; A36-T40 PolarHBondContact O-N 3.41Å; A36-T40 PolarHBondContact O-OG1 3.02Å |
| 37 | L | 47.8 | Very low | 48.2 | Very low | 116 Ų | 116 | 103.6 Ų | 103.6 | 61% | 0.607 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -67.2 | -36.8 | 168.3 | -73.7 | 171.7 | 0 | 0 | 0 | 110.7 | S33 T40 A41 | S33-L37 WeakPolarHBondContact O-CB 3.44Å; S33-L37 WeakPolarHBondContact O-CD1 3.39Å; S33-L37 VanDerWaalsContact O-CG 3.27Å; S33-L37 WeakPolarHBondContact O-CG 3.43Å; S33-L37 PolarHBondContact O-N 3.34Å; L37-T40 PolarHBondContact O-OG1 2.94Å; L37-A41 WeakPolarHBondContact O-CB 3.5Å; L37-A41 PolarHBondContact O-N 3.27Å |
| 38 | C | 48.8 | Very low | 49.3 | Very low | 73 Ų | 73 | 98.8 Ų | 98.8 | 49% | 0.493 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -69.7 | -43.3 | 173 | -74.7 | 0 | 0 | 0 | 0 | 112.1 | E34 A35 A36 A41 L42 | E34-C38 VanDerWaalsContact O-CB 3.22Å; E34-C38 WeakPolarHBondContact O-CB 3.25Å; E34-C38 PolarHBondContact O-N 2.84Å; E34-C38 PolarHBondContact O-SG 3.47Å; A35-C38 CarbonylContact O-C 3.56Å; A35-C38 PolarHBondContact O-N 3.26Å; A36-C38 VanDerWaalsContact C-N 3.32Å; C38-A41 PolarHBondContact O-N 2.82Å; C38-L42 HydrophobicContact CB-CD1 4.49Å; C38-L42 WeakPolarHBondContact O-CA 3.42Å; C38-L42 WeakPolarHBondContact O-CB 3.33Å; C38-L42 WeakPolarHBondContact O-CD1 3.41Å; C38-L42 WeakPolarHBondContact O-CG 3.44Å; C38-L42 PolarHBondContact O-N 2.91Å |
| 39 | E | 48.1 | Very low | 50 | Low | 139 Ų | 139 | 99 Ų | 99 | 65% | 0.65 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -66.7 | -40.3 | 178 | -92.2 | -176 | 151.3 | 0 | 0 | 111.8 | A35 L42 L43 | A35-E39 WeakPolarHBondContact O-CB 3.43Å; A35-E39 PolarHBondContact O-N 3Å; E39-L42 PolarHBondContact O-N 3.25Å; E39-L43 WeakPolarHBondContact O-CB 3.26Å; E39-L43 PolarHBondContact O-N 3.14Å |
| 40 | T | 54 | Low | 50.8 | Low | 81 Ų | 81 | 101.8 Ų | 101.8 | 50% | 0.497 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -70.7 | -37.4 | 174.3 | 48.2 | 0 | 0 | 0 | 0 | 112.5 | A36 L37 N44 | A36-T40 WeakPolarHBondContact O-CB 3.3Å; A36-T40 PolarHBondContact O-N 3.41Å; A36-T40 PolarHBondContact O-OG1 3.02Å; L37-T40 PolarHBondContact O-OG1 2.94Å; T40-N44 VanDerWaalsContact O-CB 3.25Å; T40-N44 WeakPolarHBondContact O-CB 3.4Å; T40-N44 PolarHBondContact O-N 2.7Å; T40-N44 PolarHBondContact O-ND2 3.11Å; T40-N44 VanDerWaalsContact O-ND2 3.1Å |
| 41 | A | 54.7 | Low | 51.8 | Low | 58 Ų | 58 | 100.5 Ų | 100.5 | 48% | 0.479 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -66.6 | -37.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L37 C38 A45 | L37-A41 WeakPolarHBondContact O-CB 3.5Å; L37-A41 PolarHBondContact O-N 3.27Å; C38-A41 PolarHBondContact O-N 2.82Å; A41-A45 VanDerWaalsContact O-CB 3.22Å; A41-A45 WeakPolarHBondContact O-CB 3.24Å; A41-A45 PolarHBondContact O-N 3.01Å |
| 42 | L | 54.1 | Low | 53 | Low | 111 Ų | 111 | 96.5 Ų | 96.5 | 58% | 0.581 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -71.9 | -39.9 | 177.1 | -74.6 | 166.7 | 0 | 0 | 0 | 111.7 | C38 E39 N44 A45 L46 | C38-L42 HydrophobicContact CB-CD1 4.49Å; C38-L42 WeakPolarHBondContact O-CA 3.42Å; C38-L42 WeakPolarHBondContact O-CB 3.33Å; C38-L42 WeakPolarHBondContact O-CD1 3.41Å; C38-L42 WeakPolarHBondContact O-CG 3.44Å; C38-L42 PolarHBondContact O-N 2.91Å; E39-L42 PolarHBondContact O-N 3.25Å; L42-N44 VanDerWaalsContact C-N 3.34Å; L42-A45 PolarHBondContact O-N 3.28Å; L42-L46 WeakPolarHBondContact O-CB 3.47Å; L42-L46 PolarHBondContact O-N 2.84Å |
| 43 | L | 55 | Low | 54.8 | Low | 104 Ų | 104 | 100.1 Ų | 100.1 | 55% | 0.545 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -72.9 | -29.8 | 177.4 | -142.6 | 150 | 0 | 0 | 0 | 111.5 | E39 K47 | E39-L43 WeakPolarHBondContact O-CB 3.26Å; E39-L43 PolarHBondContact O-N 3.14Å; L43-K47 HydrophobicContact CD2-CD 4.46Å; L43-K47 WeakPolarHBondContact O-CB 3.34Å; L43-K47 WeakPolarHBondContact O-CG 3.42Å; L43-K47 PolarHBondContact O-N 3.48Å |
| 44 | N | 59.3 | Low | 56.3 | Low | 86 Ų | 86 | 104.8 Ų | 104.8 | 46% | 0.46 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -70.4 | -47.8 | 167.4 | -72.3 | -24.9 | 0 | 0 | 0 | 110.7 | T40 L42 L46 K47 M48 | T40-N44 VanDerWaalsContact O-CB 3.25Å; T40-N44 WeakPolarHBondContact O-CB 3.4Å; T40-N44 PolarHBondContact O-N 2.7Å; T40-N44 PolarHBondContact O-ND2 3.11Å; T40-N44 VanDerWaalsContact O-ND2 3.1Å; L42-N44 VanDerWaalsContact C-N 3.34Å; N44-L46 PolarHBondContact O-N 2.96Å; N44-K47 PolarHBondContact O-N 2.81Å; N44-M48 WeakPolarHBondContact O-CG 3.5Å; N44-M48 PolarHBondContact O-N 3.43Å |
| 45 | A | 57.4 | Low | 58.3 | Low | 52 Ų | 52 | 98.5 Ų | 98.5 | 43% | 0.43 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -59.9 | -42.7 | 178 | 0 | 0 | 0 | 0 | 0 | 113 | A41 L42 K47 M48 D49 | A41-A45 VanDerWaalsContact O-CB 3.22Å; A41-A45 WeakPolarHBondContact O-CB 3.24Å; A41-A45 PolarHBondContact O-N 3.01Å; L42-A45 PolarHBondContact O-N 3.28Å; A45-K47 VanDerWaalsContact C-N 3.34Å; A45-K47 PolarHBondContact O-N 2.83Å; A45-M48 WeakPolarHBondContact O-CB 3.31Å; A45-M48 PolarHBondContact O-N 3.25Å; A45-M48 VanDerWaalsContact O-N 3.09Å; A45-D49 PolarHBondContact O-N 3.5Å |
| 46 | L | 55.7 | Low | 60.2 | Low | 125 Ų | 125 | 97.6 Ų | 97.6 | 65% | 0.654 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -67.8 | -31.3 | 177.8 | -134.1 | 92.8 | 0 | 0 | 0 | 113 | L42 N44 M48 | L42-L46 WeakPolarHBondContact O-CB 3.47Å; L42-L46 PolarHBondContact O-N 2.84Å; N44-L46 PolarHBondContact O-N 2.96Å; L46-M48 VanDerWaalsContact C-N 3.32Å |
| 47 | K | 57.1 | Low | 62 | Low | 129 Ų | 129 | 97 Ų | 97 | 56% | 0.561 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -71.1 | -29.2 | 171.3 | -84.8 | 177.9 | 176.6 | 174.8 | 0 | 112.1 | L43 N44 A45 M51 | L43-K47 HydrophobicContact CD2-CD 4.46Å; L43-K47 WeakPolarHBondContact O-CB 3.34Å; L43-K47 WeakPolarHBondContact O-CG 3.42Å; L43-K47 PolarHBondContact O-N 3.48Å; N44-K47 PolarHBondContact O-N 2.81Å; A45-K47 VanDerWaalsContact C-N 3.34Å; A45-K47 PolarHBondContact O-N 2.83Å; K47-M51 PolarHBondContact O-N 2.85Å |
| 48 | M | 57.3 | Low | 64 | Low | 51 Ų | 51 | 98.2 Ų | 98.2 | 25% | 0.251 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -75.4 | -30.3 | -178.2 | -57.1 | -98.2 | -83.7 | 0 | 0 | 111.3 | N44 A45 L46 Q50 M51 L56 L59 F60 | N44-M48 WeakPolarHBondContact O-CG 3.5Å; N44-M48 PolarHBondContact O-N 3.43Å; A45-M48 WeakPolarHBondContact O-CB 3.31Å; A45-M48 PolarHBondContact O-N 3.25Å; A45-M48 VanDerWaalsContact O-N 3.09Å; L46-M48 VanDerWaalsContact C-N 3.32Å; M48-Q50 VanDerWaalsContact C-N 3.33Å; M48-Q50 PolarHBondContact O-N 3.28Å; M48-M51 PolarHBondContact O-N 3.16Å; M48-L56 HydrophobicContact CB-CD1 4.12Å; M48-L56 HydrophobicContact CE-CD1 3.1Å; M48-L56 HydrophobicContact CG-CD1 4.17Å; M48-L56 HydrophobicContact SD-CD1 3.1Å; M48-L56 WeakPolarHBondContact SD-CD1 3.34Å; M48-L59 HydrophobicContact SD-CD2 4.03Å; M48-F60 HydrophobicContact CE-CE1 3.93Å; M48-F60 HydrophobicContact CE-CE2 4.02Å; M48-F60 HydrophobicContact CE-CZ 3.5Å; M48-F60 VanDerWaalsContact CE-CZ 3.5Å |
| 49 | D | 57.4 | Low | 65.8 | Low | 148 Ų | 148 | 97.9 Ų | 97.9 | 79% | 0.791 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.8 | -19.7 | 174.8 | -84.5 | -12.3 | 0 | 0 | 0 | 114.4 | A45 | A45-D49 PolarHBondContact O-N 3.5Š|
| 50 | Q | 58.1 | Low | 67.9 | Low | 177 Ų | 177 | 96.4 Ų | 96.4 | 83% | 0.827 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.2 | -5.5 | 175.5 | -71.8 | -177.8 | 13.3 | 0 | 0 | 113.5 | M48 | M48-Q50 VanDerWaalsContact C-N 3.33Å; M48-Q50 PolarHBondContact O-N 3.28Å |
| 51 | M | 59.3 | Low | 69.7 | Low | 94 Ų | 94 | 98 Ų | 98 | 46% | 0.463 | 52% | 0.523 | S | S | . | . | S | Bend | trans | -90.1 | 132.4 | -179.5 | -131.1 | 100 | -177 | 0 | 0 | 109.9 | K47 M48 A55 | K47-M51 PolarHBondContact O-N 2.85Å; M48-M51 PolarHBondContact O-N 3.16Å; M51-A55 HydrophobicContact CB-CB 4.46Å; M51-A55 HydrophobicContact CE-CB 4.1Å; M51-A55 HydrophobicContact CG-CB 3.44Å; M51-A55 VanDerWaalsContact CG-CB 3.44Å |
| 52 | G | 69.9 | Low | 71.5 | Confident | 53 Ų | 53 | 101.3 Ų | 101.3 | 55% | 0.546 | 52% | 0.524 | S | S | . | . | trans | -61.6 | 147.8 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | K54 A55 L56 | G52-K54 PolarHBondContact O-N 3.07Å; G52-A55 PolarHBondContact O-N 3.34Å; G52-L56 PolarHBondContact O-N 3.5Å | ||
| 53 | M | 78.1 | Confident | 73.4 | Confident | 160 Ų | 160 | 102.3 Ų | 102.3 | 79% | 0.788 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -47.4 | -28.7 | -175.4 | -68.6 | -66.8 | -80.3 | 0 | 0 | 115.1 | L56 G57 | M53-L56 HydrophobicContact SD-CD2 4.41Å; M53-G57 PolarHBondContact O-N 2.73Å; M53-G57 VanDerWaalsContact O-N 3.15Å |
| 54 | K | 78.3 | Confident | 75.2 | Confident | 181 Ų | 181 | 102.1 Ų | 102.1 | 79% | 0.787 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -70.7 | -46.6 | 176.4 | -65.5 | -178.3 | 179.6 | 178.8 | 0 | 113.1 | G52 L56 G57 E58 | G52-K54 PolarHBondContact O-N 3.07Å; K54-L56 VanDerWaalsContact C-N 3.3Å; K54-L56 PolarHBondContact O-N 3.22Å; K54-G57 PolarHBondContact O-N 3.37Å; K54-E58 WeakPolarHBondContact O-CG 3.27Å; K54-E58 PolarHBondContact O-N 2.96Å |
| 55 | A | 81.2 | Confident | 77 | Confident | 31 Ų | 31 | 104.1 Ų | 104.1 | 26% | 0.256 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -69.1 | -31.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | M51 G52 L59 | M51-A55 HydrophobicContact CB-CB 4.46Å; M51-A55 HydrophobicContact CE-CB 4.1Å; M51-A55 HydrophobicContact CG-CB 3.44Å; M51-A55 VanDerWaalsContact CG-CB 3.44Å; G52-A55 PolarHBondContact O-N 3.34Å; A55-L59 WeakPolarHBondContact O-CB 3.47Å; A55-L59 PolarHBondContact O-N 2.87Å; A55-L59 VanDerWaalsContact O-N 3.16Å |
| 56 | L | 85.1 | Confident | 78.8 | Confident | 30 Ų | 30 | 105.6 Ų | 105.6 | 16% | 0.157 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -62.9 | -45.7 | 169.7 | 176.7 | 59.5 | 0 | 0 | 0 | 111.9 | M48 G52 M53 K54 L59 F60 | M48-L56 HydrophobicContact CB-CD1 4.12Å; M48-L56 HydrophobicContact CE-CD1 3.1Å; M48-L56 HydrophobicContact CG-CD1 4.17Å; M48-L56 HydrophobicContact SD-CD1 3.1Å; M48-L56 WeakPolarHBondContact SD-CD1 3.34Å; G52-L56 PolarHBondContact O-N 3.5Å; M53-L56 HydrophobicContact SD-CD2 4.41Å; K54-L56 VanDerWaalsContact C-N 3.3Å; K54-L56 PolarHBondContact O-N 3.22Å; L56-L59 PolarHBondContact O-N 3.41Å; L56-F60 HydrophobicContact CD1-CD2 3.95Å; L56-F60 HydrophobicContact CD1-CE2 3.45Å; L56-F60 VanDerWaalsContact CD1-CE2 3.45Å; L56-F60 HydrophobicContact CD1-CZ 4.07Å; L56-F60 HydrophobicContact CD2-CE2 4.25Å; L56-F60 HydrophobicContact CG-CD2 4Å; L56-F60 HydrophobicContact CG-CE2 3.67Å; L56-F60 VanDerWaalsContact O-CD2 3.3Å; L56-F60 WeakPolarHBondContact O-CD2 3.44Å; L56-F60 PolarHBondContact O-N 2.91Å |
| 57 | G | 85.6 | Confident | 80.7 | Confident | 37 Ų | 37 | 103.3 Ų | 103.3 | 38% | 0.381 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.8 | -43.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | M53 K54 L59 F60 E61 | M53-G57 PolarHBondContact O-N 2.73Å; M53-G57 VanDerWaalsContact O-N 3.15Å; K54-G57 PolarHBondContact O-N 3.37Å; G57-L59 VanDerWaalsContact C-N 3.29Å; G57-L59 PolarHBondContact O-N 2.82Å; G57-F60 PolarHBondContact O-N 2.91Å; G57-E61 WeakPolarHBondContact O-CB 3.46Å; G57-E61 PolarHBondContact O-N 3.46Å |
| 58 | E | 88.8 | Confident | 82.4 | Confident | 142 Ų | 142 | 98.4 Ų | 98.4 | 66% | 0.664 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.9 | -35.9 | 176 | -71.3 | 169.1 | -170.2 | 0 | 0 | 112.5 | K54 Y62 | K54-E58 WeakPolarHBondContact O-CG 3.27Å; K54-E58 PolarHBondContact O-N 2.96Å; E58-Y62 WeakPolarHBondContact O-CB 3.45Å; E58-Y62 PolarHBondContact O-N 3.32Å |
| 59 | L | 88.3 | Confident | 84.3 | Confident | 67 Ų | 67 | 96.9 Ų | 96.9 | 35% | 0.351 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -73.3 | -38.9 | 178.4 | -158.4 | 136 | 0 | 0 | 0 | 111.8 | M48 A55 L56 G57 Y62 W63 | M48-L59 HydrophobicContact SD-CD2 4.03Å; A55-L59 WeakPolarHBondContact O-CB 3.47Å; A55-L59 PolarHBondContact O-N 2.87Å; A55-L59 VanDerWaalsContact O-N 3.16Å; L56-L59 PolarHBondContact O-N 3.41Å; G57-L59 VanDerWaalsContact C-N 3.29Å; G57-L59 PolarHBondContact O-N 2.82Å; L59-Y62 PolarHBondContact O-N 2.69Å; L59-W63 VanDerWaalsContact CD2-NE1 3.3Å; L59-W63 PolarHBondContact O-N 2.86Å |
| 60 | F | 90.7 | Very high | 86.2 | Confident | 107 Ų | 107 | 94.8 Ų | 94.8 | 47% | 0.469 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.8 | -44.5 | 170.2 | -78.1 | -54.8 | 0 | 0 | 0 | 111.9 | M48 L56 G57 Y62 W63 I64 | M48-F60 HydrophobicContact CE-CE1 3.93Å; M48-F60 HydrophobicContact CE-CE2 4.02Å; M48-F60 HydrophobicContact CE-CZ 3.5Å; M48-F60 VanDerWaalsContact CE-CZ 3.5Å; L56-F60 HydrophobicContact CD1-CD2 3.95Å; L56-F60 HydrophobicContact CD1-CE2 3.45Å; L56-F60 VanDerWaalsContact CD1-CE2 3.45Å; L56-F60 HydrophobicContact CD1-CZ 4.07Å; L56-F60 HydrophobicContact CD2-CE2 4.25Å; L56-F60 HydrophobicContact CG-CD2 4Å; L56-F60 HydrophobicContact CG-CE2 3.67Å; L56-F60 VanDerWaalsContact O-CD2 3.3Å; L56-F60 WeakPolarHBondContact O-CD2 3.44Å; L56-F60 PolarHBondContact O-N 2.91Å; G57-F60 PolarHBondContact O-N 2.91Å; F60-Y62 VanDerWaalsContact C-N 3.28Å; F60-Y62 PolarHBondContact O-N 2.95Å; F60-W63 PolarHBondContact O-N 3.13Å; F60-W63 VanDerWaalsContact O-N 3.16Å; F60-I64 WeakPolarHBondContact O-CB 3.27Å; F60-I64 WeakPolarHBondContact O-CD1 3.32Å; F60-I64 WeakPolarHBondContact O-CG1 3.48Å; F60-I64 PolarHBondContact O-N 2.95Å |
| 61 | E | 93.1 | Very high | 88 | Confident | 116 Ų | 116 | 90.7 Ų | 90.7 | 54% | 0.542 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -60.3 | -41.3 | 177.2 | -163.6 | 62.9 | -145.4 | 0 | 0 | 111 | G57 I64 Q65 | G57-E61 WeakPolarHBondContact O-CB 3.46Å; G57-E61 PolarHBondContact O-N 3.46Å; E61-I64 PolarHBondContact O-N 2.9Å; E61-Q65 VanDerWaalsContact O-CB 3.31Å; E61-Q65 WeakPolarHBondContact O-CB 3.37Å; E61-Q65 PolarHBondContact O-N 3.24Å |
| 62 | Y | 92.8 | Very high | 89.8 | Confident | 127 Ų | 127 | 92.9 Ų | 92.9 | 50% | 0.498 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -59.3 | -47.5 | 173.4 | 176.4 | -97.6 | 0 | 0 | 0 | 112.4 | E58 L59 F60 Q65 Q66 | E58-Y62 WeakPolarHBondContact O-CB 3.45Å; E58-Y62 PolarHBondContact O-N 3.32Å; L59-Y62 PolarHBondContact O-N 2.69Å; F60-Y62 VanDerWaalsContact C-N 3.28Å; F60-Y62 PolarHBondContact O-N 2.95Å; Y62-Q65 PolarHBondContact O-N 3.41Å; Y62-Q66 HydrophobicContact CD1-CG 4.31Å; Y62-Q66 HydrophobicContact CE1-CG 3.89Å; Y62-Q66 HydrophobicContact CE2-CG 4.33Å; Y62-Q66 WeakPolarHBondContact O-CG 3.37Å; Y62-Q66 PolarHBondContact O-N 3.27Å; Y62-Q66 PolarHBondContact OH-NE2 2.89Å |
| 63 | W | 93.4 | Very high | 91.1 | Very high | 131 Ų | 131 | 95.5 Ų | 95.5 | 50% | 0.496 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -67.4 | -39.1 | 178.1 | -73.8 | 116.4 | 0 | 0 | 0 | 112.9 | L59 F60 Q65 Q66 V67 | L59-W63 VanDerWaalsContact CD2-NE1 3.3Å; L59-W63 PolarHBondContact O-N 2.86Å; F60-W63 PolarHBondContact O-N 3.13Å; F60-W63 VanDerWaalsContact O-N 3.16Å; W63-Q65 PolarHBondContact O-N 3.34Å; W63-Q66 HydrophobicContact CE3-CB 4.49Å; W63-Q66 PolarHBondContact O-N 3.49Å; W63-V67 WeakPolarHBondContact O-CB 3.49Å; W63-V67 WeakPolarHBondContact O-CG2 3.23Å; W63-V67 PolarHBondContact O-N 3.38Å |
| 64 | I | 93.4 | Very high | 92 | Very high | 100 Ų | 100 | 93.8 Ų | 93.8 | 51% | 0.513 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -59.2 | -42.3 | 173.1 | -69.9 | 164.3 | 0 | 0 | 0 | 109.5 | F60 E61 V67 S68 | F60-I64 WeakPolarHBondContact O-CB 3.27Å; F60-I64 WeakPolarHBondContact O-CD1 3.32Å; F60-I64 WeakPolarHBondContact O-CG1 3.48Å; F60-I64 PolarHBondContact O-N 2.95Å; E61-I64 PolarHBondContact O-N 2.9Å; I64-V67 PolarHBondContact O-N 2.92Å; I64-S68 VanDerWaalsContact O-CB 3.29Å; I64-S68 WeakPolarHBondContact O-CB 3.5Å; I64-S68 PolarHBondContact O-N 3.42Å; I64-S68 PolarHBondContact O-OG 2.92Å; I64-S68 VanDerWaalsContact O-OG 3.05Å |
| 65 | Q | 95.3 | Very high | 92.9 | Very high | 129 Ų | 129 | 88.4 Ų | 88.4 | 60% | 0.603 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -68.6 | -36 | 178.3 | -160.7 | 157.6 | 19.8 | 0 | 0 | 112.5 | E61 Y62 W63 S68 G69 | E61-Q65 VanDerWaalsContact O-CB 3.31Å; E61-Q65 WeakPolarHBondContact O-CB 3.37Å; E61-Q65 PolarHBondContact O-N 3.24Å; Y62-Q65 PolarHBondContact O-N 3.41Å; W63-Q65 PolarHBondContact O-N 3.34Å; Q65-S68 WeakPolarHBondContact CA-OG 3.48Å; Q65-S68 PolarHBondContact O-OG 3.34Å; Q65-G69 PolarHBondContact O-N 3.04Å |
| 66 | Q | 95.2 | Very high | 93.6 | Very high | 83 Ų | 83 | 92.2 Ų | 92.2 | 39% | 0.388 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -67.3 | -47.6 | 173.3 | -70.6 | -61.9 | -23.1 | 0 | 0 | 112.4 | Y62 W63 S68 G69 L70 | Y62-Q66 HydrophobicContact CD1-CG 4.31Å; Y62-Q66 HydrophobicContact CE1-CG 3.89Å; Y62-Q66 HydrophobicContact CE2-CG 4.33Å; Y62-Q66 WeakPolarHBondContact O-CG 3.37Å; Y62-Q66 PolarHBondContact O-N 3.27Å; Y62-Q66 PolarHBondContact OH-NE2 2.89Å; W63-Q66 HydrophobicContact CE3-CB 4.49Å; W63-Q66 PolarHBondContact O-N 3.49Å; Q66-S68 PolarHBondContact O-N 2.99Å; Q66-G69 WeakPolarHBondContact O-CA 3.5Å; Q66-G69 PolarHBondContact O-N 2.76Å; Q66-G69 VanDerWaalsContact O-N 3.09Å; Q66-L70 PolarHBondContact O-N 3.01Å |
| 67 | V | 95.9 | Very high | 94.2 | Very high | 76 Ų | 76 | 95.6 Ų | 95.6 | 46% | 0.461 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -62.7 | -43.8 | 178.1 | 173.2 | 0 | 0 | 0 | 0 | 110.4 | W63 I64 G69 L70 E71 | W63-V67 WeakPolarHBondContact O-CB 3.49Å; W63-V67 WeakPolarHBondContact O-CG2 3.23Å; W63-V67 PolarHBondContact O-N 3.38Å; I64-V67 PolarHBondContact O-N 2.92Å; V67-G69 PolarHBondContact O-N 3.01Å; V67-L70 PolarHBondContact O-N 2.96Å; V67-L70 VanDerWaalsContact O-N 3.11Å; V67-E71 HydrophobicContact CG1-CG 4.37Å; V67-E71 WeakPolarHBondContact O-CG 3.47Å; V67-E71 PolarHBondContact O-N 3.46Å |
| 68 | S | 94.3 | Very high | 94.7 | Very high | 27 Ų | 27 | 97.5 Ų | 97.5 | 19% | 0.189 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -64 | -29.7 | 174.7 | 68.4 | 0 | 0 | 0 | 0 | 113 | I64 Q65 Q66 R72 | I64-S68 VanDerWaalsContact O-CB 3.29Å; I64-S68 WeakPolarHBondContact O-CB 3.5Å; I64-S68 PolarHBondContact O-N 3.42Å; I64-S68 PolarHBondContact O-OG 2.92Å; I64-S68 VanDerWaalsContact O-OG 3.05Å; Q65-S68 WeakPolarHBondContact CA-OG 3.48Å; Q65-S68 PolarHBondContact O-OG 3.34Å; Q66-S68 PolarHBondContact O-N 2.99Å; S68-R72 WeakPolarHBondContact O-CG 3.45Å; S68-R72 VanDerWaalsContact O-CZ 3.28Å; S68-R72 PolarHBondContact O-N 2.95Å; S68-R72 VanDerWaalsContact O-N 3.14Å; S68-R72 PolarHBondContact O-NH1 2.97Å; S68-R72 PolarHBondContact OG-NH2 3.31Å |
| 69 | G | 96.6 | Very high | 95 | Very high | 18 Ų | 18 | 97.1 Ų | 97.1 | 19% | 0.186 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -59.9 | -51.3 | 168.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q65 Q66 V67 R72 Q73 | Q65-G69 PolarHBondContact O-N 3.04Å; Q66-G69 WeakPolarHBondContact O-CA 3.5Å; Q66-G69 PolarHBondContact O-N 2.76Å; Q66-G69 VanDerWaalsContact O-N 3.09Å; V67-G69 PolarHBondContact O-N 3.01Å; G69-R72 VanDerWaalsContact CA-NH1 3.32Å; G69-R72 PolarHBondContact O-N 3.24Å; G69-Q73 WeakPolarHBondContact O-CG 3.35Å; G69-Q73 PolarHBondContact O-N 3.36Å |
| 70 | L | 96.8 | Very high | 95.3 | Very high | 105 Ų | 105 | 100.2 Ų | 100.2 | 55% | 0.55 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -66.8 | -36.4 | 179.2 | -66.5 | 172.4 | 0 | 0 | 0 | 112.4 | Q66 V67 Q73 R74 | Q66-L70 PolarHBondContact O-N 3.01Å; V67-L70 PolarHBondContact O-N 2.96Å; V67-L70 VanDerWaalsContact O-N 3.11Å; L70-Q73 PolarHBondContact O-N 3.46Å; L70-R74 WeakPolarHBondContact O-CB 3.22Å; L70-R74 PolarHBondContact O-N 3.25Å |
| 71 | E | 96.4 | Very high | 95.6 | Very high | 91 Ų | 91 | 100.8 Ų | 100.8 | 43% | 0.425 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.1 | -43.8 | 174.8 | -74.2 | 177.5 | 161.5 | 0 | 0 | 111.6 | V67 R74 D75 | V67-E71 HydrophobicContact CG1-CG 4.37Å; V67-E71 WeakPolarHBondContact O-CG 3.47Å; V67-E71 PolarHBondContact O-N 3.46Å; E71-R74 PolarHBondContact O-N 3.2Å; E71-D75 WeakPolarHBondContact O-CB 3.28Å; E71-D75 PolarHBondContact O-N 3.1Å |
| 72 | R | 96.6 | Very high | 95.6 | Very high | 139 Ų | 139 | 99.8 Ų | 99.8 | 53% | 0.525 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.7 | -45.2 | 173.7 | -73.2 | -177 | -128.8 | 94.9 | 7.5 | 111.7 | S68 G69 R74 D75 E76 | S68-R72 WeakPolarHBondContact O-CG 3.45Å; S68-R72 VanDerWaalsContact O-CZ 3.28Å; S68-R72 PolarHBondContact O-N 2.95Å; S68-R72 VanDerWaalsContact O-N 3.14Å; S68-R72 PolarHBondContact O-NH1 2.97Å; S68-R72 PolarHBondContact OG-NH2 3.31Å; G69-R72 VanDerWaalsContact CA-NH1 3.32Å; G69-R72 PolarHBondContact O-N 3.24Å; R72-R74 PolarHBondContact O-N 3.29Å; R72-D75 PolarHBondContact O-N 3.47Å; R72-E76 WeakPolarHBondContact O-CG 3.46Å; R72-E76 PolarHBondContact O-N 2.92Å |
| 73 | Q | 96.8 | Very high | 95.7 | Very high | 109 Ų | 109 | 96.8 Ų | 96.8 | 51% | 0.509 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.4 | -41.8 | 177.3 | -73.2 | 176.6 | -13.7 | 0 | 0 | 112.3 | G69 L70 D75 E76 L77 | G69-Q73 WeakPolarHBondContact O-CG 3.35Å; G69-Q73 PolarHBondContact O-N 3.36Å; L70-Q73 PolarHBondContact O-N 3.46Å; Q73-D75 VanDerWaalsContact C-N 3.33Å; Q73-D75 PolarHBondContact O-N 2.86Å; Q73-E76 PolarHBondContact O-N 3.21Å; Q73-L77 WeakPolarHBondContact O-CB 3.45Å; Q73-L77 VanDerWaalsContact O-CG 3.26Å; Q73-L77 WeakPolarHBondContact O-CG 3.47Å; Q73-L77 PolarHBondContact O-N 2.98Å |
| 74 | R | 97.1 | Very high | 95.7 | Very high | 124 Ų | 124 | 96.4 Ų | 96.4 | 47% | 0.468 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.2 | -46.3 | 173.2 | 177.9 | -152 | 62.8 | -151.8 | -8.5 | 110.5 | L70 E71 R72 L77 I78 | L70-R74 WeakPolarHBondContact O-CB 3.22Å; L70-R74 PolarHBondContact O-N 3.25Å; E71-R74 PolarHBondContact O-N 3.2Å; R72-R74 PolarHBondContact O-N 3.29Å; R74-L77 PolarHBondContact O-N 3.25Å; R74-I78 HydrophobicContact CG-CD1 3.79Å; R74-I78 HydrophobicContact CG-CG1 4.43Å; R74-I78 WeakPolarHBondContact O-CB 3.47Å; R74-I78 VanDerWaalsContact O-CG1 3.25Å; R74-I78 WeakPolarHBondContact O-CG1 3.4Å; R74-I78 PolarHBondContact O-N 3.47Å |
| 75 | D | 97.4 | Very high | 95.8 | Very high | 67 Ų | 67 | 95.3 Ų | 95.3 | 36% | 0.358 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -67.1 | -38.8 | -177.5 | -67.9 | -15.4 | 0 | 0 | 0 | 112 | E71 R72 Q73 I78 Q79 | E71-D75 WeakPolarHBondContact O-CB 3.28Å; E71-D75 PolarHBondContact O-N 3.1Å; R72-D75 PolarHBondContact O-N 3.47Å; Q73-D75 VanDerWaalsContact C-N 3.33Å; Q73-D75 PolarHBondContact O-N 2.86Å; D75-I78 PolarHBondContact O-N 3.23Å; D75-Q79 VanDerWaalsContact O-CG 3.3Å; D75-Q79 WeakPolarHBondContact O-CG 3.33Å; D75-Q79 PolarHBondContact O-N 3.15Å |
| 76 | E | 97.1 | Very high | 95.7 | Very high | 112 Ų | 112 | 96 Ų | 96 | 52% | 0.523 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -59.7 | -48.8 | 171.2 | -73.4 | 167.8 | -173.1 | 0 | 0 | 111.1 | R72 Q73 I78 Q79 E80 | R72-E76 WeakPolarHBondContact O-CG 3.46Å; R72-E76 PolarHBondContact O-N 2.92Å; Q73-E76 PolarHBondContact O-N 3.21Å; E76-I78 VanDerWaalsContact C-N 3.35Å; E76-I78 PolarHBondContact O-N 2.93Å; E76-Q79 WeakPolarHBondContact O-CB 3.31Å; E76-Q79 PolarHBondContact O-N 2.69Å; E76-Q79 VanDerWaalsContact O-N 3.13Å; E76-E80 WeakPolarHBondContact O-CG 3.42Å; E76-E80 PolarHBondContact O-N 3.48Å |
| 77 | L | 96.8 | Very high | 95.6 | Very high | 100 Ų | 100 | 94.7 Ų | 94.7 | 52% | 0.524 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.8 | -38.8 | 177.4 | -72 | 171.5 | 0 | 0 | 0 | 112.6 | Q73 R74 Q79 E80 L81 | Q73-L77 WeakPolarHBondContact O-CB 3.45Å; Q73-L77 VanDerWaalsContact O-CG 3.26Å; Q73-L77 WeakPolarHBondContact O-CG 3.47Å; Q73-L77 PolarHBondContact O-N 2.98Å; R74-L77 PolarHBondContact O-N 3.25Å; L77-Q79 VanDerWaalsContact C-N 3.32Å; L77-Q79 PolarHBondContact O-N 3.38Å; L77-E80 PolarHBondContact O-N 2.86Å; L77-L81 WeakPolarHBondContact O-CB 3.48Å; L77-L81 VanDerWaalsContact O-CG 3.27Å; L77-L81 WeakPolarHBondContact O-CG 3.45Å; L77-L81 PolarHBondContact O-N 3.37Å |
| 78 | I | 95.4 | Very high | 95.6 | Very high | 78 Ų | 78 | 97.2 Ų | 97.2 | 40% | 0.4 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.8 | -42.2 | 174.7 | -71.5 | 167.1 | 0 | 0 | 0 | 110.1 | R74 D75 E76 L81 L82 | R74-I78 HydrophobicContact CG-CD1 3.79Å; R74-I78 HydrophobicContact CG-CG1 4.43Å; R74-I78 WeakPolarHBondContact O-CB 3.47Å; R74-I78 VanDerWaalsContact O-CG1 3.25Å; R74-I78 WeakPolarHBondContact O-CG1 3.4Å; R74-I78 PolarHBondContact O-N 3.47Å; D75-I78 PolarHBondContact O-N 3.23Å; E76-I78 VanDerWaalsContact C-N 3.35Å; E76-I78 PolarHBondContact O-N 2.93Å; I78-L81 PolarHBondContact O-N 3.42Å; I78-L82 HydrophobicContact CG2-CD1 3.92Å; I78-L82 HydrophobicContact CG2-CG 4.39Å; I78-L82 WeakPolarHBondContact O-CB 3.34Å; I78-L82 VanDerWaalsContact O-CG 3.24Å; I78-L82 WeakPolarHBondContact O-CG 3.41Å; I78-L82 PolarHBondContact O-N 2.85Å |
| 79 | Q | 95.7 | Very high | 95.6 | Very high | 134 Ų | 134 | 100 Ų | 100 | 63% | 0.626 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.9 | -42.8 | 177.9 | -72.1 | 176.2 | 20.4 | 0 | 0 | 112.1 | D75 E76 L77 L82 A83 | D75-Q79 VanDerWaalsContact O-CG 3.3Å; D75-Q79 WeakPolarHBondContact O-CG 3.33Å; D75-Q79 PolarHBondContact O-N 3.15Å; E76-Q79 WeakPolarHBondContact O-CB 3.31Å; E76-Q79 PolarHBondContact O-N 2.69Å; E76-Q79 VanDerWaalsContact O-N 3.13Å; L77-Q79 VanDerWaalsContact C-N 3.32Å; L77-Q79 PolarHBondContact O-N 3.38Å; Q79-L82 PolarHBondContact O-N 3.21Å; Q79-A83 VanDerWaalsContact O-CB 3.29Å; Q79-A83 WeakPolarHBondContact O-CB 3.39Å; Q79-A83 PolarHBondContact O-N 3.3Å |
| 80 | E | 95.3 | Very high | 95.6 | Very high | 132 Ų | 132 | 105.3 Ų | 105.3 | 62% | 0.617 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.3 | -44.5 | 175 | -71.8 | -177 | 173.2 | 0 | 0 | 111.6 | E76 L77 L82 A83 L84 | E76-E80 WeakPolarHBondContact O-CG 3.42Å; E76-E80 PolarHBondContact O-N 3.48Å; L77-E80 PolarHBondContact O-N 2.86Å; E80-L82 PolarHBondContact O-N 3.42Å; E80-A83 PolarHBondContact O-N 3.01Å; E80-L84 PolarHBondContact O-N 2.91Å |
| 81 | L | 95.6 | Very high | 95.6 | Very high | 118 Ų | 118 | 104.3 Ų | 104.3 | 62% | 0.618 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.6 | -43.8 | 175.5 | -76.1 | 172.6 | 0 | 0 | 0 | 112 | L77 I78 A83 L84 N85 | L77-L81 WeakPolarHBondContact O-CB 3.48Å; L77-L81 VanDerWaalsContact O-CG 3.27Å; L77-L81 WeakPolarHBondContact O-CG 3.45Å; L77-L81 PolarHBondContact O-N 3.37Å; I78-L81 PolarHBondContact O-N 3.42Å; L81-A83 VanDerWaalsContact C-N 3.35Å; L81-L84 PolarHBondContact O-N 2.96Å; L81-N85 VanDerWaalsContact O-CB 3.27Å; L81-N85 WeakPolarHBondContact O-CB 3.49Å; L81-N85 PolarHBondContact O-N 3.36Å |
| 82 | L | 94.3 | Very high | 95.7 | Very high | 95 Ų | 95 | 102.5 Ų | 102.5 | 50% | 0.497 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67.2 | -36.3 | 176.8 | -71.8 | 174.1 | 0 | 0 | 0 | 112.2 | I78 Q79 E80 L84 N85 K86 | I78-L82 HydrophobicContact CG2-CD1 3.92Å; I78-L82 HydrophobicContact CG2-CG 4.39Å; I78-L82 WeakPolarHBondContact O-CB 3.34Å; I78-L82 VanDerWaalsContact O-CG 3.24Å; I78-L82 WeakPolarHBondContact O-CG 3.41Å; I78-L82 PolarHBondContact O-N 2.85Å; Q79-L82 PolarHBondContact O-N 3.21Å; E80-L82 PolarHBondContact O-N 3.42Å; L82-L84 VanDerWaalsContact C-N 3.31Å; L82-N85 PolarHBondContact O-N 3.3Å; L82-K86 WeakPolarHBondContact O-CG 3.33Å; L82-K86 PolarHBondContact O-N 3.08Å |
| 83 | A | 94.2 | Very high | 95.7 | Very high | 65 Ų | 65 | 101 Ų | 101 | 54% | 0.537 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.9 | -35.4 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q79 E80 L81 P87 | Q79-A83 VanDerWaalsContact O-CB 3.29Å; Q79-A83 WeakPolarHBondContact O-CB 3.39Å; Q79-A83 PolarHBondContact O-N 3.3Å; E80-A83 PolarHBondContact O-N 3.01Å; L81-A83 VanDerWaalsContact C-N 3.35Å; A83-P87 WeakPolarHBondContact O-CD 3.39Å; A83-P87 WeakPolarHBondContact O-CG 3.49Å |
| 84 | L | 94.5 | Very high | 95.7 | Very high | 122 Ų | 122 | 100.3 Ų | 100.3 | 64% | 0.639 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -80.1 | -34.6 | 176.2 | -172.2 | 65.2 | 0 | 0 | 0 | 113.3 | E80 L81 L82 K86 P87 M88 | E80-L84 PolarHBondContact O-N 2.91Å; L81-L84 PolarHBondContact O-N 2.96Å; L82-L84 VanDerWaalsContact C-N 3.31Å; L84-K86 PolarHBondContact O-N 3.37Å; L84-P87 WeakPolarHBondContact O-CD 3.34Å; L84-P87 VanDerWaalsContact O-CG 3.26Å; L84-P87 WeakPolarHBondContact O-CG 3.33Å; L84-M88 PolarHBondContact O-N 2.84Å |
| 85 | N | 95.1 | Very high | 95.8 | Very high | 77 Ų | 77 | 99.1 Ų | 99.1 | 41% | 0.412 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -67.3 | -37.9 | -177.4 | -169.5 | 20.2 | 0 | 0 | 0 | 112.5 | L81 L82 M88 L89 | L81-N85 VanDerWaalsContact O-CB 3.27Å; L81-N85 WeakPolarHBondContact O-CB 3.49Å; L81-N85 PolarHBondContact O-N 3.36Å; L82-N85 PolarHBondContact O-N 3.3Å; N85-M88 PolarHBondContact O-N 2.91Å; N85-L89 WeakPolarHBondContact O-CG 3.39Å; N85-L89 PolarHBondContact O-N 3.24Å |
| 86 | K | 92.2 | Very high | 95.8 | Very high | 144 Ų | 144 | 103.8 Ų | 103.8 | 63% | 0.626 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -56.9 | -54.5 | 178.3 | -73.4 | 176.2 | -177.2 | 177 | 0 | 113.9 | L82 L84 M88 L89 Q90 | L82-K86 WeakPolarHBondContact O-CG 3.33Å; L82-K86 PolarHBondContact O-N 3.08Å; L84-K86 PolarHBondContact O-N 3.37Å; K86-M88 VanDerWaalsContact C-N 3.32Å; K86-M88 PolarHBondContact O-N 3.3Å; K86-L89 PolarHBondContact O-N 3.42Å; K86-Q90 WeakPolarHBondContact O-CG 3.43Å; K86-Q90 PolarHBondContact O-N 3.31Å; K86-Q90 VanDerWaalsContact O-N 3.15Å |
| 87 | P | 94.2 | Very high | 95.8 | Very high | 56 Ų | 56 | 105 Ų | 105 | 36% | 0.364 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -67.2 | -33 | 178.2 | 25.7 | -34.3 | 0 | 0 | 0 | 112.2 | A83 L84 Q90 V91 | A83-P87 WeakPolarHBondContact O-CD 3.39Å; A83-P87 WeakPolarHBondContact O-CG 3.49Å; L84-P87 WeakPolarHBondContact O-CD 3.34Å; L84-P87 VanDerWaalsContact O-CG 3.26Å; L84-P87 WeakPolarHBondContact O-CG 3.33Å; P87-Q90 PolarHBondContact O-N 3.08Å; P87-V91 WeakPolarHBondContact O-CG2 3.44Å; P87-V91 PolarHBondContact O-N 3.47Å |
| 88 | M | 94.8 | Very high | 95.9 | Very high | 128 Ų | 128 | 105.8 Ų | 105.8 | 63% | 0.631 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -60.8 | -46.6 | 175.2 | -172.9 | -175.1 | -120.8 | 0 | 0 | 111.4 | L84 N85 K86 V91 V92 | L84-M88 PolarHBondContact O-N 2.84Å; N85-M88 PolarHBondContact O-N 2.91Å; K86-M88 VanDerWaalsContact C-N 3.32Å; K86-M88 PolarHBondContact O-N 3.3Å; M88-V91 PolarHBondContact O-N 3.01Å; M88-V92 VanDerWaalsContact O-CG2 3.32Å; M88-V92 WeakPolarHBondContact O-CG2 3.43Å; M88-V92 PolarHBondContact O-N 3.22Å |
| 89 | L | 95.9 | Very high | 96 | Very high | 86 Ų | 86 | 105.8 Ų | 105.8 | 45% | 0.45 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.2 | -44.9 | 176.5 | -76.4 | 166.4 | 0 | 0 | 0 | 112.1 | N85 K86 V91 V92 E93 | N85-L89 WeakPolarHBondContact O-CG 3.39Å; N85-L89 PolarHBondContact O-N 3.24Å; K86-L89 PolarHBondContact O-N 3.42Å; L89-V91 VanDerWaalsContact C-N 3.33Å; L89-V91 PolarHBondContact O-N 3.35Å; L89-V92 PolarHBondContact O-N 3.02Å; L89-E93 WeakPolarHBondContact O-CG 3.4Å; L89-E93 PolarHBondContact O-N 3.47Å |
| 90 | Q | 95.8 | Very high | 96.2 | Very high | 129 Ų | 129 | 103.8 Ų | 103.8 | 60% | 0.603 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -59.6 | -41.6 | 177.2 | -71.8 | 174.9 | -10.4 | 0 | 0 | 112.4 | K86 P87 E93 H94 | K86-Q90 WeakPolarHBondContact O-CG 3.43Å; K86-Q90 PolarHBondContact O-N 3.31Å; K86-Q90 VanDerWaalsContact O-N 3.15Å; P87-Q90 PolarHBondContact O-N 3.08Å; Q90-E93 PolarHBondContact O-N 3.45Å; Q90-H94 WeakPolarHBondContact O-CB 3.29Å; Q90-H94 PolarHBondContact O-N 3.43Å |
| 91 | V | 96.9 | Very high | 96.3 | Very high | 84 Ų | 84 | 99.7 Ų | 99.7 | 51% | 0.509 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.1 | -42.6 | 176.6 | 172.1 | 0 | 0 | 0 | 0 | 110.9 | P87 M88 L89 H94 L95 | P87-V91 WeakPolarHBondContact O-CG2 3.44Å; P87-V91 PolarHBondContact O-N 3.47Å; M88-V91 PolarHBondContact O-N 3.01Å; L89-V91 VanDerWaalsContact C-N 3.33Å; L89-V91 PolarHBondContact O-N 3.35Å; V91-H94 PolarHBondContact O-N 3.03Å; V91-L95 HydrophobicContact CG1-CD1 3.9Å; V91-L95 HydrophobicContact CG1-CG 4.32Å; V91-L95 WeakPolarHBondContact O-CB 3.31Å; V91-L95 VanDerWaalsContact O-CG 3.26Å; V91-L95 WeakPolarHBondContact O-CG 3.45Å; V91-L95 PolarHBondContact O-N 3.34Å |
| 92 | V | 97.3 | Very high | 96.4 | Very high | 54 Ų | 54 | 96.8 Ų | 96.8 | 33% | 0.327 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.9 | -43.3 | 177.8 | 170.3 | 0 | 0 | 0 | 0 | 111.2 | M88 L89 L95 R96 | M88-V92 VanDerWaalsContact O-CG2 3.32Å; M88-V92 WeakPolarHBondContact O-CG2 3.43Å; M88-V92 PolarHBondContact O-N 3.22Å; L89-V92 PolarHBondContact O-N 3.02Å; V92-L95 PolarHBondContact O-N 3.1Å; V92-R96 WeakPolarHBondContact O-CB 3.35Å; V92-R96 VanDerWaalsContact O-CG 3.27Å; V92-R96 WeakPolarHBondContact O-CG 3.5Å; V92-R96 PolarHBondContact O-N 3.47Å |
| 93 | E | 97.3 | Very high | 96.6 | Very high | 107 Ų | 107 | 99.4 Ų | 99.4 | 50% | 0.5 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.8 | -48.7 | 176.1 | -73.3 | 173.1 | 173.1 | 0 | 0 | 111.5 | L89 Q90 L95 R96 E97 | L89-E93 WeakPolarHBondContact O-CG 3.4Å; L89-E93 PolarHBondContact O-N 3.47Å; Q90-E93 PolarHBondContact O-N 3.45Å; E93-L95 VanDerWaalsContact C-N 3.33Å; E93-L95 PolarHBondContact O-N 3.29Å; E93-R96 WeakPolarHBondContact O-CB 3.46Å; E93-R96 PolarHBondContact O-N 2.69Å; E93-R96 VanDerWaalsContact O-N 3.11Å; E93-E97 WeakPolarHBondContact O-CG 3.38Å; E93-E97 PolarHBondContact O-N 2.96Å |
| 94 | H | 97.6 | Very high | 96.8 | Very high | 94 Ų | 94 | 104.6 Ų | 104.6 | 44% | 0.435 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.5 | -41.7 | 176.7 | -176.6 | 52.9 | 0 | 0 | 0 | 113 | Q90 V91 R96 E97 K98 | Q90-H94 WeakPolarHBondContact O-CB 3.29Å; Q90-H94 PolarHBondContact O-N 3.43Å; V91-H94 PolarHBondContact O-N 3.03Å; H94-R96 VanDerWaalsContact C-N 3.35Å; H94-E97 PolarHBondContact O-N 3.43Å; H94-K98 VanDerWaalsContact CE1-CE 3.43Å; H94-K98 WeakPolarHBondContact CE1-CE 3.25Å; H94-K98 WeakPolarHBondContact NE2-CE 3.33Å; H94-K98 PolarHBondContact NE2-NZ 3.14Å; H94-K98 VanDerWaalsContact NE2-NZ 3.16Å; H94-K98 WeakPolarHBondContact O-CG 3.43Å; H94-K98 PolarHBondContact O-N 2.91Å |
| 95 | L | 97.9 | Very high | 97 | Very high | 100 Ų | 100 | 104.7 Ų | 104.7 | 52% | 0.524 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.4 | -38 | 176.4 | -72.6 | 174.9 | 0 | 0 | 0 | 111.6 | V91 V92 E93 K98 L99 | V91-L95 HydrophobicContact CG1-CD1 3.9Å; V91-L95 HydrophobicContact CG1-CG 4.32Å; V91-L95 WeakPolarHBondContact O-CB 3.31Å; V91-L95 VanDerWaalsContact O-CG 3.26Å; V91-L95 WeakPolarHBondContact O-CG 3.45Å; V91-L95 PolarHBondContact O-N 3.34Å; V92-L95 PolarHBondContact O-N 3.1Å; E93-L95 VanDerWaalsContact C-N 3.33Å; E93-L95 PolarHBondContact O-N 3.29Å; L95-K98 PolarHBondContact O-N 3.02Å; L95-L99 VanDerWaalsContact O-CB 3.23Å; L95-L99 WeakPolarHBondContact O-CB 3.35Å; L95-L99 PolarHBondContact O-N 3.37Å |
| 96 | R | 97.9 | Very high | 97.1 | Very high | 165 Ų | 165 | 105.7 Ų | 105.7 | 62% | 0.623 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63 | -43.9 | 173.8 | -75.9 | 172 | 178.3 | 167.8 | 1.3 | 111.3 | V92 E93 H94 L99 M100 | V92-R96 WeakPolarHBondContact O-CB 3.35Å; V92-R96 VanDerWaalsContact O-CG 3.27Å; V92-R96 WeakPolarHBondContact O-CG 3.5Å; V92-R96 PolarHBondContact O-N 3.47Å; E93-R96 WeakPolarHBondContact O-CB 3.46Å; E93-R96 PolarHBondContact O-N 2.69Å; E93-R96 VanDerWaalsContact O-N 3.11Å; H94-R96 VanDerWaalsContact C-N 3.35Å; R96-L99 PolarHBondContact O-N 3.33Å; R96-M100 WeakPolarHBondContact O-CB 3.39Å; R96-M100 VanDerWaalsContact O-CG 3.26Å; R96-M100 WeakPolarHBondContact O-CG 3.28Å; R96-M100 PolarHBondContact O-N 3.49Å |
| 97 | E | 98.1 | Very high | 97.4 | Very high | 136 Ų | 136 | 102.4 Ų | 102.4 | 64% | 0.636 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.1 | -48.1 | 176.3 | -72 | 179.5 | 177.2 | 0 | 0 | 111.9 | E93 H94 L99 M100 A101 | E93-E97 WeakPolarHBondContact O-CG 3.38Å; E93-E97 PolarHBondContact O-N 2.96Å; H94-E97 PolarHBondContact O-N 3.43Å; E97-L99 VanDerWaalsContact C-N 3.33Å; E97-L99 PolarHBondContact O-N 3.36Å; E97-M100 PolarHBondContact O-N 3.23Å; E97-A101 PolarHBondContact O-N 3.45Å |
| 98 | K | 98.1 | Very high | 97.6 | Very high | 117 Ų | 117 | 104.5 Ų | 104.5 | 51% | 0.509 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.3 | -43.6 | 175.8 | -77.7 | 178.7 | 169.6 | 175.1 | 0 | 112.4 | H94 L95 M100 A101 A102 | H94-K98 VanDerWaalsContact CE1-CE 3.43Å; H94-K98 WeakPolarHBondContact CE1-CE 3.25Å; H94-K98 WeakPolarHBondContact NE2-CE 3.33Å; H94-K98 PolarHBondContact NE2-NZ 3.14Å; H94-K98 VanDerWaalsContact NE2-NZ 3.16Å; H94-K98 WeakPolarHBondContact O-CG 3.43Å; H94-K98 PolarHBondContact O-N 2.91Å; L95-K98 PolarHBondContact O-N 3.02Å; K98-M100 VanDerWaalsContact C-N 3.34Å; K98-A101 PolarHBondContact O-N 3.29Å; K98-A102 WeakPolarHBondContact O-CB 3.42Å; K98-A102 PolarHBondContact O-N 3.48Å |
| 99 | L | 98.2 | Very high | 97.8 | Very high | 79 Ų | 79 | 101 Ų | 101 | 41% | 0.414 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.5 | -41.1 | 177.4 | 173.5 | 158.5 | 0 | 0 | 0 | 111.2 | L95 R96 E97 A102 R103 | L95-L99 VanDerWaalsContact O-CB 3.23Å; L95-L99 WeakPolarHBondContact O-CB 3.35Å; L95-L99 PolarHBondContact O-N 3.37Å; R96-L99 PolarHBondContact O-N 3.33Å; E97-L99 VanDerWaalsContact C-N 3.33Å; E97-L99 PolarHBondContact O-N 3.36Å; L99-A102 PolarHBondContact O-N 2.89Å; L99-R103 HydrophobicContact CD2-CG 4.39Å; L99-R103 VanDerWaalsContact CD2-NE 3.33Å; L99-R103 WeakPolarHBondContact O-CB 3.36Å; L99-R103 WeakPolarHBondContact O-CG 3.12Å; L99-R103 PolarHBondContact O-N 2.9Å |
| 100 | M | 98.2 | Very high | 97.9 | Very high | 91 Ų | 91 | 101.9 Ų | 101.9 | 45% | 0.448 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.8 | -41.4 | 175.6 | -71.6 | -63.9 | -72.9 | 0 | 0 | 111.9 | R96 E97 K98 R103 R104 | R96-M100 WeakPolarHBondContact O-CB 3.39Å; R96-M100 VanDerWaalsContact O-CG 3.26Å; R96-M100 WeakPolarHBondContact O-CG 3.28Å; R96-M100 PolarHBondContact O-N 3.49Å; E97-M100 PolarHBondContact O-N 3.23Å; K98-M100 VanDerWaalsContact C-N 3.34Å; M100-R103 PolarHBondContact O-N 3.49Å; M100-R104 WeakPolarHBondContact O-CG 3.21Å; M100-R104 PolarHBondContact O-N 2.73Å |
| 101 | A | 98.3 | Very high | 98 | Very high | 47 Ų | 47 | 101.6 Ų | 101.6 | 39% | 0.388 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.7 | -45.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | E97 K98 R103 R104 L105 | E97-A101 PolarHBondContact O-N 3.45Å; K98-A101 PolarHBondContact O-N 3.29Å; A101-R103 PolarHBondContact O-N 2.95Å; A101-R104 PolarHBondContact O-N 2.94Å; A101-L105 WeakPolarHBondContact O-CG 3.4Å; A101-L105 PolarHBondContact O-N 3.27Å |
| 102 | A | 98 | Very high | 98.1 | Very high | 57 Ų | 57 | 101.8 Ų | 101.8 | 47% | 0.471 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.1 | -41.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | K98 L99 L105 L106 | K98-A102 WeakPolarHBondContact O-CB 3.42Å; K98-A102 PolarHBondContact O-N 3.48Å; L99-A102 PolarHBondContact O-N 2.89Å; A102-L105 PolarHBondContact O-N 3.03Å; A102-L106 WeakPolarHBondContact O-CB 3.32Å; A102-L106 PolarHBondContact O-N 3.5Å |
| 103 | R | 98 | Very high | 98.1 | Very high | 150 Ų | 150 | 106.6 Ų | 106.6 | 57% | 0.566 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62 | -42.5 | 174.7 | -76.3 | 179.5 | -177.7 | 175.4 | -0.4 | 112.2 | L99 M100 A101 L106 T107 | L99-R103 HydrophobicContact CD2-CG 4.39Å; L99-R103 VanDerWaalsContact CD2-NE 3.33Å; L99-R103 WeakPolarHBondContact O-CB 3.36Å; L99-R103 WeakPolarHBondContact O-CG 3.12Å; L99-R103 PolarHBondContact O-N 2.9Å; M100-R103 PolarHBondContact O-N 3.49Å; A101-R103 PolarHBondContact O-N 2.95Å; R103-L106 PolarHBondContact O-N 3.22Å; R103-T107 WeakPolarHBondContact O-CG2 3.27Å; R103-T107 PolarHBondContact O-N 3.34Å; R103-T107 PolarHBondContact O-OG1 3.22Å |
| 104 | R | 98.3 | Very high | 98.2 | Very high | 174 Ų | 174 | 104.9 Ų | 104.9 | 66% | 0.657 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.7 | -45.1 | 176.1 | -72.5 | 173.5 | -175.9 | 175.2 | 2.4 | 111.8 | M100 A101 L106 T107 L108 | M100-R104 WeakPolarHBondContact O-CG 3.21Å; M100-R104 PolarHBondContact O-N 2.73Å; A101-R104 PolarHBondContact O-N 2.94Å; R104-L106 VanDerWaalsContact C-N 3.33Å; R104-L106 PolarHBondContact O-N 3.18Å; R104-T107 WeakPolarHBondContact CA-OG1 3.35Å; R104-T107 PolarHBondContact O-N 2.96Å; R104-T107 PolarHBondContact O-OG1 3.44Å; R104-L108 PolarHBondContact O-N 2.93Å |
| 105 | L | 98.5 | Very high | 98.2 | Very high | 123 Ų | 123 | 102.5 Ų | 102.5 | 64% | 0.644 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.3 | -41.7 | 175.9 | -73.1 | 170.3 | 0 | 0 | 0 | 111.7 | A101 A102 L108 A109 | A101-L105 WeakPolarHBondContact O-CG 3.4Å; A101-L105 PolarHBondContact O-N 3.27Å; A102-L105 PolarHBondContact O-N 3.03Å; L105-L108 PolarHBondContact O-N 3.35Å; L105-A109 WeakPolarHBondContact O-CB 3.47Å; L105-A109 PolarHBondContact O-N 3.37Å |
| 106 | L | 98.3 | Very high | 98.2 | Very high | 98 Ų | 98 | 101.2 Ų | 101.2 | 51% | 0.513 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61 | -45.9 | 175.4 | 179.8 | 64 | 0 | 0 | 0 | 111.5 | A102 R103 R104 L108 A109 Q110 | A102-L106 WeakPolarHBondContact O-CB 3.32Å; A102-L106 PolarHBondContact O-N 3.5Å; R103-L106 PolarHBondContact O-N 3.22Å; R104-L106 VanDerWaalsContact C-N 3.33Å; R104-L106 PolarHBondContact O-N 3.18Å; L106-L108 VanDerWaalsContact C-N 3.29Å; L106-L108 PolarHBondContact O-N 3.08Å; L106-A109 PolarHBondContact O-N 3.15Å; L106-Q110 HydrophobicContact CD1-CG 4.36Å; L106-Q110 WeakPolarHBondContact O-CB 3.42Å; L106-Q110 VanDerWaalsContact O-CG 3.24Å; L106-Q110 WeakPolarHBondContact O-CG 3.33Å; L106-Q110 PolarHBondContact O-N 3.01Å |
| 107 | T | 98.1 | Very high | 98.2 | Very high | 75 Ų | 75 | 97.4 Ų | 97.4 | 46% | 0.46 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.8 | -37.6 | 177.5 | 51.3 | 0 | 0 | 0 | 0 | 112.1 | R103 R104 Q110 L111 | R103-T107 WeakPolarHBondContact O-CG2 3.27Å; R103-T107 PolarHBondContact O-N 3.34Å; R103-T107 PolarHBondContact O-OG1 3.22Å; R104-T107 WeakPolarHBondContact CA-OG1 3.35Å; R104-T107 PolarHBondContact O-N 2.96Å; R104-T107 PolarHBondContact O-OG1 3.44Å; T107-Q110 PolarHBondContact O-N 3Å; T107-L111 WeakPolarHBondContact O-CG 3.36Å; T107-L111 PolarHBondContact O-N 3.42Å; T107-L111 VanDerWaalsContact O-N 3.09Å |
| 108 | L | 98.6 | Very high | 98.2 | Very high | 101 Ų | 101 | 96.6 Ų | 96.6 | 53% | 0.529 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67.7 | -47.5 | 177.8 | -171.6 | 133.6 | 0 | 0 | 0 | 111.2 | R104 L105 L106 Q110 L111 D112 | R104-L108 PolarHBondContact O-N 2.93Å; L105-L108 PolarHBondContact O-N 3.35Å; L106-L108 VanDerWaalsContact C-N 3.29Å; L106-L108 PolarHBondContact O-N 3.08Å; L108-Q110 VanDerWaalsContact C-N 3.27Å; L108-Q110 PolarHBondContact O-N 3.13Å; L108-L111 PolarHBondContact O-N 2.89Å; L108-L111 VanDerWaalsContact O-N 3.11Å; L108-D112 WeakPolarHBondContact CD2-OD2 3.28Å; L108-D112 PolarHBondContact O-N 3.25Å |
| 109 | A | 98.3 | Very high | 98.2 | Very high | 54 Ų | 54 | 97 Ų | 97 | 45% | 0.446 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.6 | -34.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | L105 L106 Y113 | L105-A109 WeakPolarHBondContact O-CB 3.47Å; L105-A109 PolarHBondContact O-N 3.37Å; L106-A109 PolarHBondContact O-N 3.15Å; A109-Y113 VanDerWaalsContact O-CB 3.3Å; A109-Y113 WeakPolarHBondContact O-CB 3.33Å; A109-Y113 PolarHBondContact O-N 3.35Å |
| 110 | Q | 98.3 | Very high | 98.2 | Very high | 105 Ų | 105 | 97.7 Ų | 97.7 | 49% | 0.491 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.8 | -40.3 | 174.3 | -77.1 | 172.7 | -15.2 | 0 | 0 | 112 | L106 T107 L108 Y113 V114 | L106-Q110 HydrophobicContact CD1-CG 4.36Å; L106-Q110 WeakPolarHBondContact O-CB 3.42Å; L106-Q110 VanDerWaalsContact O-CG 3.24Å; L106-Q110 WeakPolarHBondContact O-CG 3.33Å; L106-Q110 PolarHBondContact O-N 3.01Å; T107-Q110 PolarHBondContact O-N 3Å; L108-Q110 VanDerWaalsContact C-N 3.27Å; L108-Q110 PolarHBondContact O-N 3.13Å; Q110-Y113 PolarHBondContact O-N 3.47Å; Q110-V114 WeakPolarHBondContact O-CG2 3.45Å; Q110-V114 PolarHBondContact O-N 2.98Å |
| 111 | L | 98.3 | Very high | 98.2 | Very high | 123 Ų | 123 | 95.8 Ų | 95.8 | 64% | 0.644 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -66 | -44.4 | 175.4 | -69.1 | 172 | 0 | 0 | 0 | 111.4 | T107 L108 Y113 V114 A115 | T107-L111 WeakPolarHBondContact O-CG 3.36Å; T107-L111 PolarHBondContact O-N 3.42Å; T107-L111 VanDerWaalsContact O-N 3.09Å; L108-L111 PolarHBondContact O-N 2.89Å; L108-L111 VanDerWaalsContact O-N 3.11Å; L111-Y113 VanDerWaalsContact C-N 3.31Å; L111-Y113 PolarHBondContact O-N 3.27Å; L111-V114 PolarHBondContact O-N 3.43Å; L111-A115 WeakPolarHBondContact O-CB 3.39Å; L111-A115 PolarHBondContact O-N 3.44Å |
| 112 | D | 98.3 | Very high | 98.3 | Very high | 88 Ų | 88 | 98 Ų | 98 | 47% | 0.471 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.4 | -40 | 176.5 | -67.3 | -20.7 | 0 | 0 | 0 | 111.5 | L108 A115 T116 | L108-D112 WeakPolarHBondContact CD2-OD2 3.28Å; L108-D112 PolarHBondContact O-N 3.25Å; D112-A115 PolarHBondContact O-N 2.86Å; D112-T116 WeakPolarHBondContact O-CB 3.36Å; D112-T116 VanDerWaalsContact O-CG2 3.3Å; D112-T116 WeakPolarHBondContact O-CG2 3.26Å; D112-T116 PolarHBondContact O-N 3.31Å; D112-T116 PolarHBondContact O-OG1 2.9Å |
| 113 | Y | 98.1 | Very high | 98.3 | Very high | 154 Ų | 154 | 99.7 Ų | 99.7 | 60% | 0.604 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.5 | -46.3 | 173.9 | 175.1 | -95.2 | 0 | 0 | 0 | 111.7 | A109 Q110 L111 T116 H117 | A109-Y113 VanDerWaalsContact O-CB 3.3Å; A109-Y113 WeakPolarHBondContact O-CB 3.33Å; A109-Y113 PolarHBondContact O-N 3.35Å; Q110-Y113 PolarHBondContact O-N 3.47Å; L111-Y113 VanDerWaalsContact C-N 3.31Å; L111-Y113 PolarHBondContact O-N 3.27Å; Y113-T116 WeakPolarHBondContact CA-OG1 3.49Å; Y113-T116 PolarHBondContact O-OG1 3.04Å; Y113-T116 VanDerWaalsContact O-OG1 3.04Å; Y113-H117 WeakPolarHBondContact O-CB 3.34Å; Y113-H117 PolarHBondContact O-N 3.28Å |
| 114 | V | 98.3 | Very high | 98.3 | Very high | 72 Ų | 72 | 98 Ų | 98 | 44% | 0.436 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.6 | -45.6 | 178.1 | 171.8 | 0 | 0 | 0 | 0 | 110.8 | Q110 L111 H117 E118 | Q110-V114 WeakPolarHBondContact O-CG2 3.45Å; Q110-V114 PolarHBondContact O-N 2.98Å; L111-V114 PolarHBondContact O-N 3.43Å; V114-H117 PolarHBondContact O-N 3.13Å; V114-E118 WeakPolarHBondContact O-CG 3.37Å; V114-E118 PolarHBondContact O-N 3.43Å |
| 115 | A | 97.8 | Very high | 98.3 | Very high | 44 Ų | 44 | 96.9 Ų | 96.9 | 36% | 0.364 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.7 | -49.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112 | L111 D112 H117 E118 E119 | L111-A115 WeakPolarHBondContact O-CB 3.39Å; L111-A115 PolarHBondContact O-N 3.44Å; D112-A115 PolarHBondContact O-N 2.86Å; A115-H117 VanDerWaalsContact C-N 3.34Å; A115-H117 PolarHBondContact O-N 3.38Å; A115-E118 PolarHBondContact O-N 3.44Å; A115-E119 WeakPolarHBondContact O-CG 3.36Å; A115-E119 PolarHBondContact O-N 2.97Å |
| 116 | T | 98.1 | Very high | 98.3 | Very high | 73 Ų | 73 | 96.7 Ų | 96.7 | 45% | 0.448 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.8 | -37.4 | 178 | 52.9 | 0 | 0 | 0 | 0 | 112.2 | D112 Y113 E119 V120 | D112-T116 WeakPolarHBondContact O-CB 3.36Å; D112-T116 VanDerWaalsContact O-CG2 3.3Å; D112-T116 WeakPolarHBondContact O-CG2 3.26Å; D112-T116 PolarHBondContact O-N 3.31Å; D112-T116 PolarHBondContact O-OG1 2.9Å; Y113-T116 WeakPolarHBondContact CA-OG1 3.49Å; Y113-T116 PolarHBondContact O-OG1 3.04Å; Y113-T116 VanDerWaalsContact O-OG1 3.04Å; T116-E119 PolarHBondContact O-N 3.28Å; T116-V120 VanDerWaalsContact O-CG2 3.29Å; T116-V120 WeakPolarHBondContact O-CG2 3.47Å; T116-V120 PolarHBondContact O-N 3.28Å |
| 117 | H | 98.3 | Very high | 98.3 | Very high | 85 Ų | 85 | 97.7 Ų | 97.7 | 39% | 0.394 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.7 | -44.1 | 174.7 | -178.2 | -76.5 | 0 | 0 | 0 | 111.9 | Y113 V114 A115 E119 V120 D121 | Y113-H117 WeakPolarHBondContact O-CB 3.34Å; Y113-H117 PolarHBondContact O-N 3.28Å; V114-H117 PolarHBondContact O-N 3.13Å; A115-H117 VanDerWaalsContact C-N 3.34Å; A115-H117 PolarHBondContact O-N 3.38Å; H117-E119 PolarHBondContact O-N 2.91Å; H117-V120 PolarHBondContact O-N 3.06Å; H117-D121 IonicContact CE1-OD2 3.95Å; H117-D121 PolarHBondContact CE1-OD2 2.91Å; H117-D121 IonicContact ND1-OD2 3.4Å; H117-D121 PolarHBondContact ND1-OD2 3.49Å; H117-D121 PolarHBondContact O-N 3.22Å |
| 118 | E | 98.4 | Very high | 98.3 | Very high | 119 Ų | 119 | 100.5 Ų | 100.5 | 56% | 0.556 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.5 | -40.7 | 176.5 | -73.8 | 177.9 | -178.4 | 0 | 0 | 112.5 | V114 A115 D121 Q122 | V114-E118 WeakPolarHBondContact O-CG 3.37Å; V114-E118 PolarHBondContact O-N 3.43Å; A115-E118 PolarHBondContact O-N 3.44Å; E118-D121 PolarHBondContact O-N 3.04Å; E118-Q122 WeakPolarHBondContact O-CB 3.15Å; E118-Q122 PolarHBondContact O-N 2.9Å |
| 119 | E | 98.4 | Very high | 98.3 | Very high | 126 Ų | 126 | 98.5 Ų | 98.5 | 59% | 0.589 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -61.8 | -46.8 | 174.3 | -72.7 | -179.9 | 178.6 | 0 | 0 | 111.6 | A115 T116 H117 D121 Q122 V123 | A115-E119 WeakPolarHBondContact O-CG 3.36Å; A115-E119 PolarHBondContact O-N 2.97Å; T116-E119 PolarHBondContact O-N 3.28Å; H117-E119 PolarHBondContact O-N 2.91Å; E119-D121 VanDerWaalsContact C-N 3.33Å; E119-D121 PolarHBondContact O-N 3.3Å; E119-Q122 WeakPolarHBondContact O-CB 3.45Å; E119-Q122 PolarHBondContact O-N 3.27Å; E119-Q122 VanDerWaalsContact O-N 3.14Å; E119-V123 WeakPolarHBondContact O-CG2 3.41Å; E119-V123 PolarHBondContact O-N 2.92Å |
| 120 | V | 98.5 | Very high | 98.4 | Very high | 93 Ų | 93 | 98.7 Ų | 98.7 | 56% | 0.564 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -59 | -45.4 | 176.5 | 168.7 | 0 | 0 | 0 | 0 | 110.8 | T116 H117 Q122 V123 K124 | T116-V120 VanDerWaalsContact O-CG2 3.29Å; T116-V120 WeakPolarHBondContact O-CG2 3.47Å; T116-V120 PolarHBondContact O-N 3.28Å; H117-V120 PolarHBondContact O-N 3.06Å; V120-Q122 VanDerWaalsContact C-N 3.3Å; V120-Q122 PolarHBondContact O-N 2.83Å; V120-V123 PolarHBondContact O-N 3.46Å; V120-K124 VanDerWaalsContact O-CB 3.26Å; V120-K124 WeakPolarHBondContact O-CB 3.46Å; V120-K124 PolarHBondContact O-N 2.83Å |
| 121 | D | 98.2 | Very high | 98.4 | Very high | 50 Ų | 50 | 96 Ų | 96 | 27% | 0.267 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.1 | -36 | 177 | -85.8 | -24.9 | 0 | 0 | 0 | 112.5 | H117 E118 E119 R125 | H117-D121 IonicContact CE1-OD2 3.95Å; H117-D121 PolarHBondContact CE1-OD2 2.91Å; H117-D121 IonicContact ND1-OD2 3.4Å; H117-D121 PolarHBondContact ND1-OD2 3.49Å; H117-D121 PolarHBondContact O-N 3.22Å; E118-D121 PolarHBondContact O-N 3.04Å; E119-D121 VanDerWaalsContact C-N 3.33Å; E119-D121 PolarHBondContact O-N 3.3Å; D121-R125 WeakPolarHBondContact O-CB 3.46Å; D121-R125 WeakPolarHBondContact O-CG 3.49Å; D121-R125 PolarHBondContact O-N 3.34Å; D121-R125 PolarHBondContact O-NE 3.43Å |
| 122 | Q | 98.6 | Very high | 98.4 | Very high | 94 Ų | 94 | 97.2 Ų | 97.2 | 44% | 0.439 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -67.8 | -44.3 | 176.2 | -162.8 | -167.6 | 68.7 | 0 | 0 | 111.4 | E118 E119 V120 R125 K126 | E118-Q122 WeakPolarHBondContact O-CB 3.15Å; E118-Q122 PolarHBondContact O-N 2.9Å; E119-Q122 WeakPolarHBondContact O-CB 3.45Å; E119-Q122 PolarHBondContact O-N 3.27Å; E119-Q122 VanDerWaalsContact O-N 3.14Å; V120-Q122 VanDerWaalsContact C-N 3.3Å; V120-Q122 PolarHBondContact O-N 2.83Å; Q122-R125 PolarHBondContact O-N 3.49Å; Q122-K126 HydrophobicContact CG-CD 4.48Å; Q122-K126 WeakPolarHBondContact O-CG 3.3Å; Q122-K126 PolarHBondContact O-N 2.81Å |
| 123 | V | 98.5 | Very high | 98.4 | Very high | 93 Ų | 93 | 96.8 Ų | 96.8 | 56% | 0.564 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.3 | -45.7 | 175.8 | 171.5 | 0 | 0 | 0 | 0 | 110.3 | E119 V120 R125 K126 L127 | E119-V123 WeakPolarHBondContact O-CG2 3.41Å; E119-V123 PolarHBondContact O-N 2.92Å; V120-V123 PolarHBondContact O-N 3.46Å; V123-R125 PolarHBondContact O-N 3.49Å; V123-K126 PolarHBondContact O-N 3.01Å; V123-L127 WeakPolarHBondContact O-CB 3.34Å; V123-L127 PolarHBondContact O-N 3.06Å |
| 124 | K | 98.3 | Very high | 98.4 | Very high | 115 Ų | 115 | 92.5 Ų | 92.5 | 50% | 0.5 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -54.6 | -50.7 | 175.1 | 179.4 | -178.4 | 173.8 | -175.9 | 0 | 111.1 | V120 K126 L127 F128 | V120-K124 VanDerWaalsContact O-CB 3.26Å; V120-K124 WeakPolarHBondContact O-CB 3.46Å; V120-K124 PolarHBondContact O-N 2.83Å; K124-K126 PolarHBondContact O-N 3.01Å; K124-L127 PolarHBondContact O-N 3.45Å; K124-F128 HydrophobicContact CD-CE2 4.22Å; K124-F128 HydrophobicContact CG-CD2 3.75Å; K124-F128 HydrophobicContact CG-CE2 3.52Å; K124-F128 WeakPolarHBondContact O-CD2 3.29Å; K124-F128 PolarHBondContact O-N 3.42Å |
| 125 | R | 98.3 | Very high | 98.4 | Very high | 149 Ų | 149 | 94 Ų | 94 | 56% | 0.562 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -57.5 | -47.1 | 176.9 | -78.1 | 177.9 | -103.6 | 134.8 | -6.4 | 112 | D121 Q122 V123 L127 F128 T129 | D121-R125 WeakPolarHBondContact O-CB 3.46Å; D121-R125 WeakPolarHBondContact O-CG 3.49Å; D121-R125 PolarHBondContact O-N 3.34Å; D121-R125 PolarHBondContact O-NE 3.43Å; Q122-R125 PolarHBondContact O-N 3.49Å; V123-R125 PolarHBondContact O-N 3.49Å; R125-L127 PolarHBondContact O-N 3.3Å; R125-F128 PolarHBondContact O-N 3.5Å; R125-T129 PolarHBondContact O-N 2.88Å; R125-T129 PolarHBondContact O-OG1 2.94Å |
| 126 | K | 98.6 | Very high | 98.5 | Very high | 119 Ų | 119 | 97.7 Ų | 97.7 | 52% | 0.517 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62 | -40.5 | 177.7 | -73.4 | 171 | 176 | 168.7 | 0 | 112.5 | Q122 V123 K124 T129 A130 | Q122-K126 HydrophobicContact CG-CD 4.48Å; Q122-K126 WeakPolarHBondContact O-CG 3.3Å; Q122-K126 PolarHBondContact O-N 2.81Å; V123-K126 PolarHBondContact O-N 3.01Å; K124-K126 PolarHBondContact O-N 3.01Å; K126-T129 WeakPolarHBondContact CA-OG1 3.49Å; K126-T129 PolarHBondContact O-N 2.9Å; K126-T129 PolarHBondContact O-OG1 3.28Å; K126-A130 WeakPolarHBondContact O-CB 3.45Å; K126-A130 PolarHBondContact O-N 3.21Å |
| 127 | L | 98.7 | Very high | 98.4 | Very high | 119 Ų | 119 | 97.7 Ų | 97.7 | 62% | 0.623 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.4 | -45.3 | 177 | -169.7 | 85.4 | 0 | 0 | 0 | 110.9 | V123 K124 R125 T129 A130 A131 | V123-L127 WeakPolarHBondContact O-CB 3.34Å; V123-L127 PolarHBondContact O-N 3.06Å; K124-L127 PolarHBondContact O-N 3.45Å; R125-L127 PolarHBondContact O-N 3.3Å; L127-T129 PolarHBondContact O-N 3.44Å; L127-A130 PolarHBondContact O-N 3.24Å; L127-A131 VanDerWaalsContact O-CB 3.27Å; L127-A131 WeakPolarHBondContact O-CB 3.36Å; L127-A131 PolarHBondContact O-N 2.84Å |
| 128 | F | 98.6 | Very high | 98.4 | Very high | 135 Ų | 135 | 99.4 Ų | 99.4 | 59% | 0.592 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.1 | -41.3 | 177.3 | -83.1 | -67.3 | 0 | 0 | 0 | 112.4 | K124 R125 R132 | K124-F128 HydrophobicContact CD-CE2 4.22Å; K124-F128 HydrophobicContact CG-CD2 3.75Å; K124-F128 HydrophobicContact CG-CE2 3.52Å; K124-F128 WeakPolarHBondContact O-CD2 3.29Å; K124-F128 PolarHBondContact O-N 3.42Å; R125-F128 PolarHBondContact O-N 3.5Å; F128-R132 WeakPolarHBondContact O-CB 3.46Å; F128-R132 PolarHBondContact O-N 3.49Å |
| 129 | T | 98.5 | Very high | 98.4 | Very high | 59 Ų | 59 | 98.5 Ų | 98.5 | 36% | 0.362 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.1 | -47.1 | 174.8 | 49.4 | 0 | 0 | 0 | 0 | 111.2 | R125 K126 L127 A131 R132 D133 | R125-T129 PolarHBondContact O-N 2.88Å; R125-T129 PolarHBondContact O-OG1 2.94Å; K126-T129 WeakPolarHBondContact CA-OG1 3.49Å; K126-T129 PolarHBondContact O-N 2.9Å; K126-T129 PolarHBondContact O-OG1 3.28Å; L127-T129 PolarHBondContact O-N 3.44Å; T129-A131 PolarHBondContact O-N 3.32Å; T129-R132 PolarHBondContact O-N 2.88Å; T129-D133 WeakPolarHBondContact O-CB 3.44Å; T129-D133 PolarHBondContact O-N 2.98Å |
| 130 | A | 98.6 | Very high | 98.4 | Very high | 58 Ų | 58 | 96 Ų | 96 | 48% | 0.479 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.5 | -40.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | K126 L127 D133 C134 | K126-A130 WeakPolarHBondContact O-CB 3.45Å; K126-A130 PolarHBondContact O-N 3.21Å; L127-A130 PolarHBondContact O-N 3.24Å; A130-D133 PolarHBondContact O-N 3.29Å; A130-C134 VanDerWaalsContact O-CB 3.28Å; A130-C134 WeakPolarHBondContact O-CB 3.38Å; A130-C134 PolarHBondContact O-N 3Å |
| 131 | A | 98.6 | Very high | 98.4 | Very high | 49 Ų | 49 | 95.5 Ų | 95.5 | 41% | 0.405 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.1 | -44.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | L127 T129 C134 I135 | L127-A131 VanDerWaalsContact O-CB 3.27Å; L127-A131 WeakPolarHBondContact O-CB 3.36Å; L127-A131 PolarHBondContact O-N 2.84Å; T129-A131 PolarHBondContact O-N 3.32Å; A131-C134 WeakPolarHBondContact O-CB 3.34Å; A131-C134 PolarHBondContact O-N 3.41Å; A131-I135 WeakPolarHBondContact O-CG1 3.3Å; A131-I135 PolarHBondContact O-N 3.43Å |
| 132 | R | 98.5 | Very high | 98.5 | Very high | 147 Ų | 147 | 95.7 Ų | 95.7 | 56% | 0.555 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -61 | -46.7 | 175.3 | -177.8 | -169.8 | 64.7 | -164.1 | -3.8 | 111.4 | F128 T129 C134 I135 Q136 | F128-R132 WeakPolarHBondContact O-CB 3.46Å; F128-R132 PolarHBondContact O-N 3.49Å; T129-R132 PolarHBondContact O-N 2.88Å; R132-C134 VanDerWaalsContact C-N 3.3Å; R132-C134 PolarHBondContact O-N 3.14Å; R132-I135 PolarHBondContact O-N 3.45Å; R132-Q136 WeakPolarHBondContact O-CB 3.4Å; R132-Q136 PolarHBondContact O-N 3.2Å |
| 133 | D | 98.5 | Very high | 98.4 | Very high | 80 Ų | 80 | 92.8 Ų | 92.8 | 43% | 0.428 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66.9 | -34.7 | -178.3 | -60.1 | -10.3 | 0 | 0 | 0 | 110.8 | T129 A130 Q136 S137 | T129-D133 WeakPolarHBondContact O-CB 3.44Å; T129-D133 PolarHBondContact O-N 2.98Å; A130-D133 PolarHBondContact O-N 3.29Å; D133-Q136 PolarHBondContact O-N 3.36Å; D133-S137 WeakPolarHBondContact O-CB 3.33Å; D133-S137 PolarHBondContact O-N 3.42Å |
| 134 | C | 98.5 | Very high | 98.4 | Very high | 63 Ų | 63 | 94 Ų | 94 | 43% | 0.426 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.9 | -48.2 | 171.5 | -177.3 | 0 | 0 | 0 | 0 | 112.2 | A130 A131 R132 Q136 S137 Q138 | A130-C134 VanDerWaalsContact O-CB 3.28Å; A130-C134 WeakPolarHBondContact O-CB 3.38Å; A130-C134 PolarHBondContact O-N 3Å; A131-C134 WeakPolarHBondContact O-CB 3.34Å; A131-C134 PolarHBondContact O-N 3.41Å; R132-C134 VanDerWaalsContact C-N 3.3Å; R132-C134 PolarHBondContact O-N 3.14Å; C134-Q136 VanDerWaalsContact C-N 3.31Å; C134-Q136 PolarHBondContact O-N 2.93Å; C134-S137 PolarHBondContact O-N 2.98Å; C134-Q138 WeakPolarHBondContact O-CG 3.37Å; C134-Q138 PolarHBondContact O-N 3.42Å |
| 135 | I | 98.5 | Very high | 98.4 | Very high | 105 Ų | 105 | 94.2 Ų | 94.2 | 54% | 0.538 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60 | -44.7 | 176.3 | -68.1 | 164.4 | 0 | 0 | 0 | 110.2 | A131 R132 S137 Q138 V139 | A131-I135 WeakPolarHBondContact O-CG1 3.3Å; A131-I135 PolarHBondContact O-N 3.43Å; R132-I135 PolarHBondContact O-N 3.45Å; I135-S137 VanDerWaalsContact C-N 3.34Å; I135-S137 PolarHBondContact O-N 2.97Å; I135-Q138 PolarHBondContact O-N 2.93Å; I135-V139 WeakPolarHBondContact O-CG2 3.34Å; I135-V139 PolarHBondContact O-N 3.48Å |
| 136 | Q | 98.5 | Very high | 98.4 | Very high | 121 Ų | 121 | 94.1 Ų | 94.1 | 57% | 0.565 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.7 | -43.1 | 178.4 | -174.6 | 160.5 | 3.1 | 0 | 0 | 111.5 | R132 D133 C134 Q138 V139 T140 | R132-Q136 WeakPolarHBondContact O-CB 3.4Å; R132-Q136 PolarHBondContact O-N 3.2Å; D133-Q136 PolarHBondContact O-N 3.36Å; C134-Q136 VanDerWaalsContact C-N 3.31Å; C134-Q136 PolarHBondContact O-N 2.93Å; Q136-Q138 PolarHBondContact O-N 2.95Å; Q136-V139 PolarHBondContact O-N 3.42Å; Q136-T140 WeakPolarHBondContact O-CG2 3.44Å; Q136-T140 PolarHBondContact O-N 2.91Å; Q136-T140 PolarHBondContact O-OG1 3.18Å |
| 137 | S | 97.9 | Very high | 98.4 | Very high | 72 Ų | 72 | 95 Ų | 95 | 50% | 0.503 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.2 | -43.6 | 174.8 | -178.8 | 0 | 0 | 0 | 0 | 111.9 | D133 C134 I135 V139 T140 L141 | D133-S137 WeakPolarHBondContact O-CB 3.33Å; D133-S137 PolarHBondContact O-N 3.42Å; C134-S137 PolarHBondContact O-N 2.98Å; I135-S137 VanDerWaalsContact C-N 3.34Å; I135-S137 PolarHBondContact O-N 2.97Å; S137-V139 PolarHBondContact O-N 3.33Å; S137-T140 WeakPolarHBondContact CA-OG1 3.43Å; S137-T140 PolarHBondContact O-N 3.27Å; S137-T140 PolarHBondContact O-OG1 3.5Å; S137-L141 WeakPolarHBondContact O-CB 3.33Å; S137-L141 PolarHBondContact O-N 3Å |
| 138 | Q | 98.4 | Very high | 98.4 | Very high | 121 Ų | 121 | 94.1 Ų | 94.1 | 57% | 0.565 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.1 | -44.6 | 175.9 | -74.2 | 177.3 | 8.5 | 0 | 0 | 112.3 | C134 I135 Q136 T140 L141 A142 | C134-Q138 WeakPolarHBondContact O-CG 3.37Å; C134-Q138 PolarHBondContact O-N 3.42Å; I135-Q138 PolarHBondContact O-N 2.93Å; Q136-Q138 PolarHBondContact O-N 2.95Å; Q138-T140 VanDerWaalsContact C-N 3.35Å; Q138-T140 PolarHBondContact O-N 3.36Å; Q138-L141 PolarHBondContact O-N 2.95Å; Q138-A142 WeakPolarHBondContact O-CB 3.16Å; Q138-A142 PolarHBondContact O-N 3.33Å |
| 139 | V | 98.4 | Very high | 98.3 | Very high | 100 Ų | 100 | 90.4 Ų | 90.4 | 61% | 0.606 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.1 | -42.7 | 177.1 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | I135 Q136 S137 A142 G143 | I135-V139 WeakPolarHBondContact O-CG2 3.34Å; I135-V139 PolarHBondContact O-N 3.48Å; Q136-V139 PolarHBondContact O-N 3.42Å; S137-V139 PolarHBondContact O-N 3.33Å; V139-A142 PolarHBondContact O-N 2.96Å; V139-G143 PolarHBondContact O-N 3.49Å |
| 140 | T | 98.3 | Very high | 98.3 | Very high | 73 Ų | 73 | 91.3 Ų | 91.3 | 45% | 0.448 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65 | -39.6 | 177.3 | 53.7 | 0 | 0 | 0 | 0 | 112.5 | Q136 S137 Q138 G143 Q144 | Q136-T140 WeakPolarHBondContact O-CG2 3.44Å; Q136-T140 PolarHBondContact O-N 2.91Å; Q136-T140 PolarHBondContact O-OG1 3.18Å; S137-T140 WeakPolarHBondContact CA-OG1 3.43Å; S137-T140 PolarHBondContact O-N 3.27Å; S137-T140 PolarHBondContact O-OG1 3.5Å; Q138-T140 VanDerWaalsContact C-N 3.35Å; Q138-T140 PolarHBondContact O-N 3.36Å; T140-G143 PolarHBondContact O-N 2.82Å; T140-Q144 WeakPolarHBondContact O-CG 3.24Å; T140-Q144 PolarHBondContact O-N 3.04Å |
| 141 | L | 98.5 | Very high | 98.2 | Very high | 84 Ų | 84 | 91.5 Ų | 91.5 | 44% | 0.44 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.5 | -46.9 | 177.8 | -178.6 | 65.2 | 0 | 0 | 0 | 111.1 | S137 Q138 G143 Q144 E145 | S137-L141 WeakPolarHBondContact O-CB 3.33Å; S137-L141 PolarHBondContact O-N 3Å; Q138-L141 PolarHBondContact O-N 2.95Å; L141-G143 PolarHBondContact O-N 2.93Å; L141-Q144 WeakPolarHBondContact O-CB 3.34Å; L141-Q144 PolarHBondContact O-N 3.25Å; L141-Q144 VanDerWaalsContact O-N 3.08Å; L141-E145 HydrophobicContact CG-CG 4.45Å; L141-E145 WeakPolarHBondContact O-CG 3.41Å; L141-E145 PolarHBondContact O-N 3.28Å |
| 142 | A | 98.5 | Very high | 98.2 | Very high | 53 Ų | 53 | 90.2 Ų | 90.2 | 44% | 0.438 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -59.8 | -36.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q138 V139 Y146 | Q138-A142 WeakPolarHBondContact O-CB 3.16Å; Q138-A142 PolarHBondContact O-N 3.33Å; V139-A142 PolarHBondContact O-N 2.96Å; A142-Y146 WeakPolarHBondContact O-CB 3.44Å; A142-Y146 PolarHBondContact O-N 3.44Å |
| 143 | G | 97.9 | Very high | 98.2 | Very high | 34 Ų | 34 | 87.4 Ų | 87.4 | 35% | 0.351 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.9 | -46.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | V139 T140 L141 Y146 E147 | V139-G143 PolarHBondContact O-N 3.49Å; T140-G143 PolarHBondContact O-N 2.82Å; L141-G143 PolarHBondContact O-N 2.93Å; G143-Y146 PolarHBondContact O-N 3.42Å; G143-E147 WeakPolarHBondContact O-CG 3.49Å; G143-E147 PolarHBondContact O-N 3.33Å |
| 144 | Q | 98.3 | Very high | 98.1 | Very high | 117 Ų | 117 | 86.9 Ų | 86.9 | 55% | 0.547 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.5 | -43.1 | 176.9 | -70.9 | 174.4 | -3.5 | 0 | 0 | 112.3 | T140 L141 Y146 E147 V148 | T140-Q144 WeakPolarHBondContact O-CG 3.24Å; T140-Q144 PolarHBondContact O-N 3.04Å; L141-Q144 WeakPolarHBondContact O-CB 3.34Å; L141-Q144 PolarHBondContact O-N 3.25Å; L141-Q144 VanDerWaalsContact O-N 3.08Å; Q144-Y146 VanDerWaalsContact C-N 3.3Å; Q144-Y146 PolarHBondContact O-N 2.8Å; Q144-E147 PolarHBondContact O-N 2.9Å; Q144-V148 VanDerWaalsContact O-CG2 3.31Å; Q144-V148 WeakPolarHBondContact O-CG2 3.4Å; Q144-V148 PolarHBondContact O-N 3.04Å |
| 145 | E | 98.1 | Very high | 98 | Very high | 121 Ų | 121 | 88.9 Ų | 88.9 | 57% | 0.565 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -59.9 | -41.3 | 175.9 | -73 | 177.1 | 170.4 | 0 | 0 | 111.5 | L141 V148 A149 | L141-E145 HydrophobicContact CG-CG 4.45Å; L141-E145 WeakPolarHBondContact O-CG 3.41Å; L141-E145 PolarHBondContact O-N 3.28Å; E145-V148 PolarHBondContact O-N 2.97Å; E145-A149 WeakPolarHBondContact O-CB 3.44Å; E145-A149 PolarHBondContact O-N 3.32Å |
| 146 | Y | 98.3 | Very high | 98 | Very high | 147 Ų | 147 | 89.9 Ų | 89.9 | 58% | 0.576 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.2 | -46.2 | 174.5 | 175.8 | -96.4 | 0 | 0 | 0 | 112.2 | A142 G143 Q144 V148 A149 Q150 | A142-Y146 WeakPolarHBondContact O-CB 3.44Å; A142-Y146 PolarHBondContact O-N 3.44Å; G143-Y146 PolarHBondContact O-N 3.42Å; Q144-Y146 VanDerWaalsContact C-N 3.3Å; Q144-Y146 PolarHBondContact O-N 2.8Å; Y146-V148 VanDerWaalsContact C-N 3.32Å; Y146-V148 PolarHBondContact O-N 3.49Å; Y146-A149 PolarHBondContact O-N 2.9Å; Y146-Q150 HydrophobicContact CD1-CG 4.14Å; Y146-Q150 HydrophobicContact CD2-CG 4.48Å; Y146-Q150 HydrophobicContact CE1-CG 3.67Å; Y146-Q150 HydrophobicContact CE2-CG 4.06Å; Y146-Q150 WeakPolarHBondContact O-CG 3.35Å; Y146-Q150 PolarHBondContact O-N 3.23Å; Y146-Q150 PolarHBondContact OH-NE2 2.96Å |
| 147 | E | 98.2 | Very high | 98 | Very high | 138 Ų | 138 | 90.5 Ų | 90.5 | 65% | 0.645 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.6 | -41.9 | 176.7 | -73.6 | 178.8 | -178.2 | 0 | 0 | 111.8 | G143 Q144 Q150 S151 | G143-E147 WeakPolarHBondContact O-CG 3.49Å; G143-E147 PolarHBondContact O-N 3.33Å; Q144-E147 PolarHBondContact O-N 2.9Å; E147-Q150 PolarHBondContact O-N 3.31Å; E147-S151 WeakPolarHBondContact O-CB 3.3Å; E147-S151 PolarHBondContact O-N 2.97Å |
| 148 | V | 98.4 | Very high | 98 | Very high | 99 Ų | 99 | 92.3 Ų | 92.3 | 60% | 0.6 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.8 | -46 | 175.4 | 170.9 | 0 | 0 | 0 | 0 | 110.6 | Q144 E145 Y146 Q150 S151 G152 | Q144-V148 VanDerWaalsContact O-CG2 3.31Å; Q144-V148 WeakPolarHBondContact O-CG2 3.4Å; Q144-V148 PolarHBondContact O-N 3.04Å; E145-V148 PolarHBondContact O-N 2.97Å; Y146-V148 VanDerWaalsContact C-N 3.32Å; Y146-V148 PolarHBondContact O-N 3.49Å; V148-Q150 PolarHBondContact O-N 3.39Å; V148-S151 PolarHBondContact O-N 3.41Å; V148-S151 PolarHBondContact O-OG 2.95Å; V148-G152 PolarHBondContact O-N 2.94Å |
| 149 | A | 97.6 | Very high | 98 | Very high | 58 Ų | 58 | 92 Ų | 92 | 48% | 0.479 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.8 | -44.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | E145 Y146 S151 G152 L153 | E145-A149 WeakPolarHBondContact O-CB 3.44Å; E145-A149 PolarHBondContact O-N 3.32Å; Y146-A149 PolarHBondContact O-N 2.9Å; A149-S151 VanDerWaalsContact C-N 3.35Å; A149-S151 PolarHBondContact O-N 3.33Å; A149-G152 PolarHBondContact O-N 3.44Å; A149-L153 PolarHBondContact O-N 3.17Å; A149-L153 VanDerWaalsContact O-N 3.15Å |
| 150 | Q | 97.6 | Very high | 97.9 | Very high | 77 Ų | 77 | 89.7 Ų | 89.7 | 36% | 0.36 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.1 | -42.1 | 175.7 | -70.7 | -63 | -29.2 | 0 | 0 | 111.8 | Y146 E147 V148 G152 L153 T154 | Y146-Q150 HydrophobicContact CD1-CG 4.14Å; Y146-Q150 HydrophobicContact CD2-CG 4.48Å; Y146-Q150 HydrophobicContact CE1-CG 3.67Å; Y146-Q150 HydrophobicContact CE2-CG 4.06Å; Y146-Q150 WeakPolarHBondContact O-CG 3.35Å; Y146-Q150 PolarHBondContact O-N 3.23Å; Y146-Q150 PolarHBondContact OH-NE2 2.96Å; E147-Q150 PolarHBondContact O-N 3.31Å; V148-Q150 PolarHBondContact O-N 3.39Å; Q150-G152 VanDerWaalsContact C-N 3.27Å; Q150-G152 PolarHBondContact O-N 2.92Å; Q150-L153 PolarHBondContact O-N 3.08Å; Q150-T154 WeakPolarHBondContact O-CG2 3.33Å; Q150-T154 PolarHBondContact O-N 3.4Å; Q150-T154 PolarHBondContact O-OG1 3.43Å |
| 151 | S | 97.1 | Very high | 97.9 | Very high | 62 Ų | 62 | 89 Ų | 89 | 43% | 0.434 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.2 | -38.3 | 176.2 | 78.2 | 0 | 0 | 0 | 0 | 111.8 | E147 V148 A149 T154 Q155 | E147-S151 WeakPolarHBondContact O-CB 3.3Å; E147-S151 PolarHBondContact O-N 2.97Å; V148-S151 PolarHBondContact O-N 3.41Å; V148-S151 PolarHBondContact O-OG 2.95Å; A149-S151 VanDerWaalsContact C-N 3.35Å; A149-S151 PolarHBondContact O-N 3.33Å; S151-T154 WeakPolarHBondContact CA-OG1 3.49Å; S151-T154 PolarHBondContact O-N 2.89Å; S151-T154 PolarHBondContact O-OG1 3.4Å; S151-Q155 WeakPolarHBondContact O-CB 3.47Å; S151-Q155 PolarHBondContact O-N 2.9Å |
| 152 | G | 97.9 | Very high | 97.9 | Very high | 23 Ų | 23 | 90.1 Ų | 90.1 | 24% | 0.237 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -59.6 | -47 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | V148 A149 Q150 Q155 E156 | V148-G152 PolarHBondContact O-N 2.94Å; A149-G152 PolarHBondContact O-N 3.44Å; Q150-G152 VanDerWaalsContact C-N 3.27Å; Q150-G152 PolarHBondContact O-N 2.92Å; G152-Q155 WeakPolarHBondContact O-CB 3.4Å; G152-Q155 PolarHBondContact O-N 3.46Å; G152-E156 WeakPolarHBondContact O-CG 3.19Å; G152-E156 PolarHBondContact O-N 2.93Å |
| 153 | L | 98 | Very high | 97.8 | Very high | 88 Ų | 88 | 94 Ų | 94 | 46% | 0.461 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.8 | -49.4 | 176.8 | -65 | 175.7 | 0 | 0 | 0 | 111.9 | A149 Q150 Q155 E156 E157 | A149-L153 PolarHBondContact O-N 3.17Å; A149-L153 VanDerWaalsContact O-N 3.15Å; Q150-L153 PolarHBondContact O-N 3.08Å; L153-Q155 PolarHBondContact O-N 2.98Å; L153-E156 PolarHBondContact O-N 3.11Å; L153-E156 VanDerWaalsContact O-N 3.1Å; L153-E157 WeakPolarHBondContact O-CG 3.44Å; L153-E157 PolarHBondContact O-N 2.91Å |
| 154 | T | 96.6 | Very high | 97.8 | Very high | 69 Ų | 69 | 97 Ų | 97 | 42% | 0.423 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.9 | -34.3 | 178 | 61 | 0 | 0 | 0 | 0 | 112.2 | Q150 S151 L158 | Q150-T154 WeakPolarHBondContact O-CG2 3.33Å; Q150-T154 PolarHBondContact O-N 3.4Å; Q150-T154 PolarHBondContact O-OG1 3.43Å; S151-T154 WeakPolarHBondContact CA-OG1 3.49Å; S151-T154 PolarHBondContact O-N 2.89Å; S151-T154 PolarHBondContact O-OG1 3.4Å; T154-L158 WeakPolarHBondContact O-CB 3.39Å; T154-L158 VanDerWaalsContact O-CG 3.22Å; T154-L158 WeakPolarHBondContact O-CG 3.44Å; T154-L158 PolarHBondContact O-N 3.03Å |
| 155 | Q | 97.9 | Very high | 97.8 | Very high | 105 Ų | 105 | 95.9 Ų | 95.9 | 49% | 0.491 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.5 | -39.7 | 175.1 | -170.7 | -173.7 | 6.7 | 0 | 0 | 111.7 | S151 G152 L153 K159 | S151-Q155 WeakPolarHBondContact O-CB 3.47Å; S151-Q155 PolarHBondContact O-N 2.9Å; G152-Q155 WeakPolarHBondContact O-CB 3.4Å; G152-Q155 PolarHBondContact O-N 3.46Å; L153-Q155 PolarHBondContact O-N 2.98Å; Q155-K159 HydrophobicContact CG-CD 4.48Å; Q155-K159 WeakPolarHBondContact O-CB 3.45Å; Q155-K159 VanDerWaalsContact O-CG 3.27Å; Q155-K159 WeakPolarHBondContact O-CG 3.24Å; Q155-K159 PolarHBondContact O-N 2.96Å |
| 156 | E | 97.9 | Very high | 97.8 | Very high | 125 Ų | 125 | 92.7 Ų | 92.7 | 58% | 0.584 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -66.2 | -44.3 | 175.9 | -72.2 | 175.9 | -179.1 | 0 | 0 | 111.9 | G152 L153 L158 K159 A160 | G152-E156 WeakPolarHBondContact O-CG 3.19Å; G152-E156 PolarHBondContact O-N 2.93Å; L153-E156 PolarHBondContact O-N 3.11Å; L153-E156 VanDerWaalsContact O-N 3.1Å; E156-L158 VanDerWaalsContact C-N 3.35Å; E156-L158 PolarHBondContact O-N 3.09Å; E156-K159 WeakPolarHBondContact O-CB 3.22Å; E156-K159 PolarHBondContact O-N 3.32Å; E156-A160 PolarHBondContact O-N 3.4Å |
| 157 | E | 97.8 | Very high | 97.7 | Very high | 135 Ų | 135 | 91.2 Ų | 91.2 | 63% | 0.631 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -58.8 | -45.4 | 174 | -70.2 | 175.4 | 173.1 | 0 | 0 | 111.7 | L153 K159 A160 S161 | L153-E157 WeakPolarHBondContact O-CG 3.44Å; L153-E157 PolarHBondContact O-N 2.91Å; E157-K159 PolarHBondContact O-N 3.21Å; E157-A160 PolarHBondContact O-N 3.05Å; E157-S161 PolarHBondContact O-N 2.97Å |
| 158 | L | 98 | Very high | 97.7 | Very high | 109 Ų | 109 | 90.6 Ų | 90.6 | 57% | 0.571 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.7 | -41.7 | 176.1 | -73.2 | 172.1 | 0 | 0 | 0 | 111.5 | T154 E156 A160 S161 L162 | T154-L158 WeakPolarHBondContact O-CB 3.39Å; T154-L158 VanDerWaalsContact O-CG 3.22Å; T154-L158 WeakPolarHBondContact O-CG 3.44Å; T154-L158 PolarHBondContact O-N 3.03Å; E156-L158 VanDerWaalsContact C-N 3.35Å; E156-L158 PolarHBondContact O-N 3.09Å; L158-A160 PolarHBondContact O-N 3.4Å; L158-S161 WeakPolarHBondContact CA-OG 3.43Å; L158-S161 PolarHBondContact O-N 2.99Å; L158-S161 PolarHBondContact O-OG 3.38Å; L158-L162 WeakPolarHBondContact O-CB 3.44Å; L158-L162 WeakPolarHBondContact O-CG 3.48Å; L158-L162 PolarHBondContact O-N 3.16Å |
| 159 | K | 98 | Very high | 97.7 | Very high | 114 Ų | 114 | 90.9 Ų | 90.9 | 50% | 0.496 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.1 | -41.5 | 175.2 | -76.8 | 170.1 | -177.8 | 167.9 | 0 | 112.1 | Q155 E156 E157 L162 H163 | Q155-K159 HydrophobicContact CG-CD 4.48Å; Q155-K159 WeakPolarHBondContact O-CB 3.45Å; Q155-K159 VanDerWaalsContact O-CG 3.27Å; Q155-K159 WeakPolarHBondContact O-CG 3.24Å; Q155-K159 PolarHBondContact O-N 2.96Å; E156-K159 WeakPolarHBondContact O-CB 3.22Å; E156-K159 PolarHBondContact O-N 3.32Å; E157-K159 PolarHBondContact O-N 3.21Å; K159-L162 PolarHBondContact O-N 3.44Å; K159-H163 PolarHBondContact O-N 3.47Å |
| 160 | A | 97.5 | Very high | 97.6 | Very high | 53 Ų | 53 | 94 Ų | 94 | 44% | 0.438 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.3 | -47.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111 | E156 E157 L158 L162 H163 D164 | E156-A160 PolarHBondContact O-N 3.4Å; E157-A160 PolarHBondContact O-N 3.05Å; L158-A160 PolarHBondContact O-N 3.4Å; A160-L162 VanDerWaalsContact C-N 3.31Å; A160-L162 PolarHBondContact O-N 3.32Å; A160-H163 WeakPolarHBondContact O-CA 3.38Å; A160-H163 WeakPolarHBondContact O-CB 3.47Å; A160-H163 PolarHBondContact O-N 3.42Å; A160-D164 PolarHBondContact O-N 3.27Å |
| 161 | S | 97.7 | Very high | 97.6 | Very high | 59 Ų | 59 | 94.4 Ų | 94.4 | 41% | 0.413 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.8 | -37.2 | 177.5 | 73.9 | 0 | 0 | 0 | 0 | 113.3 | E157 L158 H163 D164 L165 | E157-S161 PolarHBondContact O-N 2.97Å; L158-S161 WeakPolarHBondContact CA-OG 3.43Å; L158-S161 PolarHBondContact O-N 2.99Å; L158-S161 PolarHBondContact O-OG 3.38Å; S161-H163 VanDerWaalsContact C-N 3.33Å; S161-D164 PolarHBondContact O-N 2.98Å; S161-L165 WeakPolarHBondContact O-CB 3.26Å; S161-L165 PolarHBondContact O-N 2.98Å |
| 162 | L | 98.1 | Very high | 97.6 | Very high | 107 Ų | 107 | 96.9 Ų | 96.9 | 56% | 0.56 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.9 | -37.5 | 173.9 | -78 | 172.4 | 0 | 0 | 0 | 111.6 | L158 K159 A160 S166 | L158-L162 WeakPolarHBondContact O-CB 3.44Å; L158-L162 WeakPolarHBondContact O-CG 3.48Å; L158-L162 PolarHBondContact O-N 3.16Å; K159-L162 PolarHBondContact O-N 3.44Å; A160-L162 VanDerWaalsContact C-N 3.31Å; A160-L162 PolarHBondContact O-N 3.32Å; L162-S166 VanDerWaalsContact O-CB 3.27Å; L162-S166 WeakPolarHBondContact O-CB 3.31Å; L162-S166 PolarHBondContact O-N 3.06Å; L162-S166 PolarHBondContact O-OG 3.25Å |
| 163 | H | 98 | Very high | 97.6 | Very high | 134 Ų | 134 | 102.2 Ų | 102.2 | 62% | 0.62 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -65.7 | -46.7 | 175.7 | -170.4 | 69.1 | 0 | 0 | 0 | 111.3 | K159 A160 S161 S166 H167 | K159-H163 PolarHBondContact O-N 3.47Å; A160-H163 WeakPolarHBondContact O-CA 3.38Å; A160-H163 WeakPolarHBondContact O-CB 3.47Å; A160-H163 PolarHBondContact O-N 3.42Å; S161-H163 VanDerWaalsContact C-N 3.33Å; H163-S166 WeakPolarHBondContact O-CB 3.32Å; H163-S166 PolarHBondContact O-N 3.35Å; H163-H167 PolarHBondContact O-N 2.97Å |
| 164 | D | 97.6 | Very high | 97.5 | Very high | 97 Ų | 97 | 101.2 Ų | 101.2 | 52% | 0.519 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.1 | -48.4 | 177 | -67.4 | -21 | 0 | 0 | 0 | 111.4 | A160 S161 S166 H167 E168 | A160-D164 PolarHBondContact O-N 3.27Å; S161-D164 PolarHBondContact O-N 2.98Å; D164-S166 VanDerWaalsContact C-N 3.3Å; D164-S166 PolarHBondContact O-N 3.1Å; D164-H167 WeakPolarHBondContact O-CB 3.34Å; D164-H167 PolarHBondContact O-N 2.99Å; D164-H167 VanDerWaalsContact O-N 3.13Å; D164-E168 WeakPolarHBondContact O-CG 3.42Å; D164-E168 PolarHBondContact O-N 2.89Å |
| 165 | L | 98.1 | Very high | 97.4 | Very high | 93 Ų | 93 | 101 Ų | 101 | 49% | 0.487 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.1 | -37.9 | 177.5 | -174.4 | 65.8 | 0 | 0 | 0 | 111.9 | S161 H167 E168 L169 | S161-L165 WeakPolarHBondContact O-CB 3.26Å; S161-L165 PolarHBondContact O-N 2.98Å; L165-H167 VanDerWaalsContact C-N 3.34Å; L165-E168 PolarHBondContact O-N 3.31Å; L165-L169 WeakPolarHBondContact O-CB 3.48Å; L165-L169 VanDerWaalsContact O-CG 3.32Å; L165-L169 WeakPolarHBondContact O-CG 3.18Å; L165-L169 PolarHBondContact O-N 3.49Å |
| 166 | S | 97.1 | Very high | 97.2 | Very high | 55 Ų | 55 | 101 Ų | 101 | 39% | 0.385 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.1 | -43.4 | 174.6 | -62.3 | 0 | 0 | 0 | 0 | 110.7 | L162 H163 D164 L169 H170 | L162-S166 VanDerWaalsContact O-CB 3.27Å; L162-S166 WeakPolarHBondContact O-CB 3.31Å; L162-S166 PolarHBondContact O-N 3.06Å; L162-S166 PolarHBondContact O-OG 3.25Å; H163-S166 WeakPolarHBondContact O-CB 3.32Å; H163-S166 PolarHBondContact O-N 3.35Å; D164-S166 VanDerWaalsContact C-N 3.3Å; D164-S166 PolarHBondContact O-N 3.1Å; S166-L169 PolarHBondContact O-N 3.47Å; S166-H170 PolarHBondContact O-N 3.36Å; S166-H170 PolarHBondContact O-ND1 2.99Å |
| 167 | H | 97.7 | Very high | 97.1 | Very high | 116 Ų | 116 | 100 Ų | 100 | 54% | 0.537 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.7 | -45.9 | 175.7 | 179.7 | -81.5 | 0 | 0 | 0 | 111.6 | H163 D164 L165 L169 H170 Q171 | H163-H167 PolarHBondContact O-N 2.97Å; D164-H167 WeakPolarHBondContact O-CB 3.34Å; D164-H167 PolarHBondContact O-N 2.99Å; D164-H167 VanDerWaalsContact O-N 3.13Å; L165-H167 VanDerWaalsContact C-N 3.34Å; H167-L169 VanDerWaalsContact C-N 3.33Å; H167-L169 PolarHBondContact O-N 3.28Å; H167-H170 PolarHBondContact O-N 2.9Å; H167-Q171 WeakPolarHBondContact O-CB 3.41Å; H167-Q171 PolarHBondContact O-N 2.72Å |
| 168 | E | 97.6 | Very high | 96.8 | Very high | 125 Ų | 125 | 98.1 Ų | 98.1 | 58% | 0.584 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -58.8 | -41.5 | 175.3 | -73.1 | -173.6 | 174.2 | 0 | 0 | 112.5 | D164 L165 Q171 L172 | D164-E168 WeakPolarHBondContact O-CG 3.42Å; D164-E168 PolarHBondContact O-N 2.89Å; L165-E168 PolarHBondContact O-N 3.31Å; E168-Q171 PolarHBondContact O-N 3.26Å; E168-L172 VanDerWaalsContact O-CB 3.31Å; E168-L172 WeakPolarHBondContact O-CB 3.47Å; E168-L172 PolarHBondContact O-N 2.92Å |
| 169 | L | 97.6 | Very high | 96.6 | Very high | 104 Ų | 104 | 98.4 Ų | 98.4 | 55% | 0.545 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.2 | -43.8 | 175.8 | -76.8 | 173.9 | 0 | 0 | 0 | 111.9 | L165 S166 H167 L172 Q173 | L165-L169 WeakPolarHBondContact O-CB 3.48Å; L165-L169 VanDerWaalsContact O-CG 3.32Å; L165-L169 WeakPolarHBondContact O-CG 3.18Å; L165-L169 PolarHBondContact O-N 3.49Å; S166-L169 PolarHBondContact O-N 3.47Å; H167-L169 VanDerWaalsContact C-N 3.33Å; H167-L169 PolarHBondContact O-N 3.28Å; L169-L172 PolarHBondContact O-N 3Å; L169-Q173 WeakPolarHBondContact O-CB 3.5Å; L169-Q173 PolarHBondContact O-N 3.45Å |
| 170 | H | 96.8 | Very high | 96.2 | Very high | 124 Ų | 124 | 96.8 Ų | 96.8 | 57% | 0.574 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.3 | -43.3 | 175.6 | -74 | 79.6 | 0 | 0 | 0 | 111.1 | S166 H167 Q173 T174 | S166-H170 PolarHBondContact O-N 3.36Å; S166-H170 PolarHBondContact O-ND1 2.99Å; H167-H170 PolarHBondContact O-N 2.9Å; H170-Q173 PolarHBondContact O-N 3.41Å; H170-T174 WeakPolarHBondContact O-CG2 3.41Å; H170-T174 PolarHBondContact O-N 3.21Å; H170-T174 PolarHBondContact O-OG1 3.19Å |
| 171 | Q | 97 | Very high | 95.8 | Very high | 85 Ų | 85 | 98 Ų | 98 | 40% | 0.397 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.9 | -48.9 | 177.1 | -172.6 | 62.6 | 43.1 | 0 | 0 | 111.1 | H167 E168 Q173 T174 D175 | H167-Q171 WeakPolarHBondContact O-CB 3.41Å; H167-Q171 PolarHBondContact O-N 2.72Å; E168-Q171 PolarHBondContact O-N 3.26Å; Q171-Q173 VanDerWaalsContact C-N 3.28Å; Q171-Q173 PolarHBondContact O-N 2.71Å; Q171-T174 PolarHBondContact O-N 2.83Å; Q171-T174 VanDerWaalsContact O-N 3.11Å; Q171-T174 PolarHBondContact O-OG1 3.08Å; Q171-D175 PolarHBondContact NE2-OD1 3.31Å; Q171-D175 VanDerWaalsContact NE2-OD1 3.16Å; Q171-D175 WeakPolarHBondContact O-CB 3.4Å; Q171-D175 PolarHBondContact O-N 3.23Å |
| 172 | L | 96.9 | Very high | 95.3 | Very high | 114 Ų | 114 | 97.2 Ų | 97.2 | 60% | 0.597 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -60.1 | -39.4 | 177.6 | -174.5 | 67.2 | 0 | 0 | 0 | 111.6 | E168 L169 D175 H176 | E168-L172 VanDerWaalsContact O-CB 3.31Å; E168-L172 WeakPolarHBondContact O-CB 3.47Å; E168-L172 PolarHBondContact O-N 2.92Å; L169-L172 PolarHBondContact O-N 3Å; L172-D175 PolarHBondContact O-N 3.14Å; L172-H176 VanDerWaalsContact O-CB 3.24Å; L172-H176 WeakPolarHBondContact O-CB 3.47Å; L172-H176 PolarHBondContact O-N 2.9Å |
| 173 | Q | 97.1 | Very high | 94.6 | Very high | 135 Ų | 135 | 96.7 Ų | 96.7 | 63% | 0.631 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -63.5 | -43.4 | 175.5 | -172 | 176.7 | -0.6 | 0 | 0 | 111.4 | L169 H170 Q171 Q177 | L169-Q173 WeakPolarHBondContact O-CB 3.5Å; L169-Q173 PolarHBondContact O-N 3.45Å; H170-Q173 PolarHBondContact O-N 3.41Å; Q171-Q173 VanDerWaalsContact C-N 3.28Å; Q171-Q173 PolarHBondContact O-N 2.71Å; Q173-Q177 WeakPolarHBondContact O-CB 3.23Å; Q173-Q177 PolarHBondContact O-N 3.42Å |
| 174 | T | 96.8 | Very high | 94 | Very high | 68 Ų | 68 | 99.7 Ų | 99.7 | 42% | 0.417 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.9 | -42.5 | 175.3 | 60.9 | 0 | 0 | 0 | 0 | 112.4 | H170 Q171 H176 Q177 N178 | H170-T174 WeakPolarHBondContact O-CG2 3.41Å; H170-T174 PolarHBondContact O-N 3.21Å; H170-T174 PolarHBondContact O-OG1 3.19Å; Q171-T174 PolarHBondContact O-N 2.83Å; Q171-T174 VanDerWaalsContact O-N 3.11Å; Q171-T174 PolarHBondContact O-OG1 3.08Å; T174-H176 PolarHBondContact O-N 3.39Å; T174-Q177 PolarHBondContact O-N 3.46Å; T174-N178 WeakPolarHBondContact O-CB 3.26Å; T174-N178 PolarHBondContact O-N 2.97Å; T174-N178 PolarHBondContact O-ND2 3.2Å; T174-N178 VanDerWaalsContact O-ND2 3.14Å |
| 175 | D | 95 | Very high | 93.1 | Very high | 64 Ų | 64 | 100.1 Ų | 100.1 | 34% | 0.342 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.9 | -41.4 | 178.2 | -71.1 | -19.2 | 0 | 0 | 0 | 111.3 | Q171 L172 N178 Q179 | Q171-D175 PolarHBondContact NE2-OD1 3.31Å; Q171-D175 VanDerWaalsContact NE2-OD1 3.16Å; Q171-D175 WeakPolarHBondContact O-CB 3.4Å; Q171-D175 PolarHBondContact O-N 3.23Å; L172-D175 PolarHBondContact O-N 3.14Å; D175-N178 PolarHBondContact O-N 3.16Å; D175-Q179 WeakPolarHBondContact O-CB 3.26Å; D175-Q179 VanDerWaalsContact O-CG 3.26Å; D175-Q179 WeakPolarHBondContact O-CG 3.48Å; D175-Q179 PolarHBondContact O-N 2.94Å |
| 176 | H | 93.9 | Very high | 91.9 | Very high | 106 Ų | 106 | 99.2 Ų | 99.2 | 49% | 0.491 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.2 | -45.1 | 174 | -177.2 | 65.5 | 0 | 0 | 0 | 111.4 | L172 T174 N178 Q179 L180 | L172-H176 VanDerWaalsContact O-CB 3.24Å; L172-H176 WeakPolarHBondContact O-CB 3.47Å; L172-H176 PolarHBondContact O-N 2.9Å; T174-H176 PolarHBondContact O-N 3.39Å; H176-N178 VanDerWaalsContact C-N 3.33Å; H176-N178 PolarHBondContact O-N 3.48Å; H176-Q179 PolarHBondContact O-N 3.43Å; H176-L180 WeakPolarHBondContact O-CG 3.27Å; H176-L180 PolarHBondContact O-N 2.87Å |
| 177 | Q | 94.8 | Very high | 90.4 | Very high | 102 Ų | 102 | 103 Ų | 103 | 48% | 0.477 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.8 | -42.2 | 176 | -170.5 | 60.8 | 52.2 | 0 | 0 | 111.7 | Q173 T174 L180 N181 | Q173-Q177 WeakPolarHBondContact O-CB 3.23Å; Q173-Q177 PolarHBondContact O-N 3.42Å; T174-Q177 PolarHBondContact O-N 3.46Å; Q177-L180 PolarHBondContact O-N 2.88Å; Q177-N181 PolarHBondContact NE2-OD1 3.34Å; Q177-N181 PolarHBondContact O-N 3.45Å; Q177-N181 PolarHBondContact O-ND2 3.39Å; Q177-N181 PolarHBondContact O-OD1 3Å |
| 178 | N | 92.4 | Very high | 88.6 | Confident | 96 Ų | 96 | 102.1 Ų | 102.1 | 51% | 0.513 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.8 | -40.3 | 176.2 | -69.5 | -27.9 | 0 | 0 | 0 | 112 | T174 D175 H176 N181 S182 | T174-N178 WeakPolarHBondContact O-CB 3.26Å; T174-N178 PolarHBondContact O-N 2.97Å; T174-N178 PolarHBondContact O-ND2 3.2Å; T174-N178 VanDerWaalsContact O-ND2 3.14Å; D175-N178 PolarHBondContact O-N 3.16Å; H176-N178 VanDerWaalsContact C-N 3.33Å; H176-N178 PolarHBondContact O-N 3.48Å; N178-N181 PolarHBondContact O-N 2.88Å; N178-S182 WeakPolarHBondContact O-CB 3.28Å; N178-S182 PolarHBondContact O-N 3.09Å |
| 179 | Q | 92.4 | Very high | 86.4 | Confident | 115 Ų | 115 | 105.5 Ų | 105.5 | 54% | 0.537 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.4 | -45.4 | 175.2 | -76.2 | 175.6 | 15.3 | 0 | 0 | 111.5 | D175 H176 N181 S182 L183 | D175-Q179 WeakPolarHBondContact O-CB 3.26Å; D175-Q179 VanDerWaalsContact O-CG 3.26Å; D175-Q179 WeakPolarHBondContact O-CG 3.48Å; D175-Q179 PolarHBondContact O-N 2.94Å; H176-Q179 PolarHBondContact O-N 3.43Å; Q179-N181 VanDerWaalsContact C-N 3.3Å; Q179-N181 PolarHBondContact O-N 2.91Å; Q179-S182 PolarHBondContact O-N 3.06Å; Q179-S182 PolarHBondContact O-OG 3.43Å; Q179-L183 WeakPolarHBondContact O-CB 3.46Å; Q179-L183 WeakPolarHBondContact O-CG 3.4Å; Q179-L183 PolarHBondContact O-N 3.45Å |
| 180 | L | 90.9 | Very high | 84.1 | Confident | 81 Ų | 81 | 107 Ų | 107 | 42% | 0.424 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -58.1 | -43 | 174.6 | -74.3 | 177.5 | 0 | 0 | 0 | 111.8 | H176 Q177 R184 | H176-L180 WeakPolarHBondContact O-CG 3.27Å; H176-L180 PolarHBondContact O-N 2.87Å; Q177-L180 PolarHBondContact O-N 2.88Å; L180-R184 WeakPolarHBondContact O-CB 3.44Å; L180-R184 PolarHBondContact O-N 3.33Å |
| 181 | N | 89.3 | Confident | 81.8 | Confident | 77 Ų | 77 | 110.8 Ų | 110.8 | 41% | 0.412 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.3 | -45.5 | 175.1 | -65.3 | -17.8 | 0 | 0 | 0 | 111.3 | Q177 N178 Q179 L183 R184 D185 | Q177-N181 PolarHBondContact NE2-OD1 3.34Å; Q177-N181 PolarHBondContact O-N 3.45Å; Q177-N181 PolarHBondContact O-ND2 3.39Å; Q177-N181 PolarHBondContact O-OD1 3Å; N178-N181 PolarHBondContact O-N 2.88Å; Q179-N181 VanDerWaalsContact C-N 3.3Å; Q179-N181 PolarHBondContact O-N 2.91Å; N181-L183 PolarHBondContact O-N 2.92Å; N181-R184 WeakPolarHBondContact O-CB 3.44Å; N181-R184 PolarHBondContact O-N 3.36Å; N181-D185 VanDerWaalsContact O-CG 3.31Å; N181-D185 PolarHBondContact O-N 2.91Å |
| 182 | S | 86.5 | Confident | 79.1 | Confident | 44 Ų | 44 | 118.9 Ų | 118.9 | 31% | 0.308 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -68.1 | -34.6 | 179.9 | 78.3 | 0 | 0 | 0 | 0 | 113.7 | N178 Q179 D185 Q186 | N178-S182 WeakPolarHBondContact O-CB 3.28Å; N178-S182 PolarHBondContact O-N 3.09Å; Q179-S182 PolarHBondContact O-N 3.06Å; Q179-S182 PolarHBondContact O-OG 3.43Å; S182-D185 CarbonylContact O-C 3.6Å; S182-D185 PolarHBondContact O-N 3.42Å; S182-Q186 WeakPolarHBondContact O-CB 3.29Å; S182-Q186 VanDerWaalsContact O-CG 3.25Å; S182-Q186 WeakPolarHBondContact O-CG 3.35Å; S182-Q186 PolarHBondContact O-N 3.3Å |
| 183 | L | 84.3 | Confident | 76.4 | Confident | 96 Ų | 96 | 119.1 Ų | 119.1 | 50% | 0.503 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -70 | -37.8 | 174.9 | -76.5 | 173.2 | 0 | 0 | 0 | 110.4 | Q179 N181 D185 Q186 V187 | Q179-L183 WeakPolarHBondContact O-CB 3.46Å; Q179-L183 WeakPolarHBondContact O-CG 3.4Å; Q179-L183 PolarHBondContact O-N 3.45Å; N181-L183 PolarHBondContact O-N 2.92Å; L183-D185 VanDerWaalsContact C-N 3.26Å; L183-D185 PolarHBondContact O-N 2.88Å; L183-Q186 PolarHBondContact O-N 3.31Å; L183-V187 WeakPolarHBondContact O-CB 3.31Å; L183-V187 VanDerWaalsContact O-CG2 3.3Å; L183-V187 WeakPolarHBondContact O-CG2 3.44Å; L183-V187 PolarHBondContact O-N 3.4Å |
| 184 | R | 84.8 | Confident | 73.8 | Confident | 196 Ų | 196 | 124.5 Ų | 124.5 | 74% | 0.74 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -57.5 | -41.7 | 169.4 | 178.9 | 152.8 | -70.8 | -150.4 | -4.1 | 111.2 | L180 N181 S188 | L180-R184 WeakPolarHBondContact O-CB 3.44Å; L180-R184 PolarHBondContact O-N 3.33Å; N181-R184 WeakPolarHBondContact O-CB 3.44Å; N181-R184 PolarHBondContact O-N 3.36Å; R184-S188 PolarHBondContact O-OG 3.25Å |
| 185 | D | 78.6 | Confident | 71.2 | Confident | 107 Ų | 107 | 127.9 Ų | 127.9 | 57% | 0.572 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -72.9 | -31.4 | 176.3 | -63.5 | -25.7 | 0 | 0 | 0 | 113.9 | N181 S182 L183 S188 | N181-D185 VanDerWaalsContact O-CG 3.31Å; N181-D185 PolarHBondContact O-N 2.91Å; S182-D185 CarbonylContact O-C 3.6Å; S182-D185 PolarHBondContact O-N 3.42Å; L183-D185 VanDerWaalsContact C-N 3.26Å; L183-D185 PolarHBondContact O-N 2.88Å; D185-S188 WeakPolarHBondContact O-CB 3.34Å; D185-S188 PolarHBondContact O-N 3.37Å |
| 186 | Q | 73.1 | Confident | 69.1 | Low | 74 Ų | 74 | 132.1 Ų | 132.1 | 35% | 0.346 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -80.5 | -34.3 | -179.4 | -77.8 | 175.3 | 41.5 | 0 | 0 | 113.5 | S182 L183 S188 R189 | S182-Q186 WeakPolarHBondContact O-CB 3.29Å; S182-Q186 VanDerWaalsContact O-CG 3.25Å; S182-Q186 WeakPolarHBondContact O-CG 3.35Å; S182-Q186 PolarHBondContact O-N 3.3Å; L183-Q186 PolarHBondContact O-N 3.31Å; Q186-S188 PolarHBondContact O-N 3.11Å; Q186-R189 PolarHBondContact O-N 3.32Å; Q186-R189 VanDerWaalsContact O-O 3.09Å |
| 187 | V | 64.3 | Low | 67.4 | Low | 133 Ų | 133 | 130.6 Ų | 130.6 | 81% | 0.806 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -60.4 | -22.9 | 169 | 171.5 | 0 | 0 | 0 | 0 | 110.2 | L183 R189 | L183-V187 WeakPolarHBondContact O-CB 3.31Å; L183-V187 VanDerWaalsContact O-CG2 3.3Å; L183-V187 WeakPolarHBondContact O-CG2 3.44Å; L183-V187 PolarHBondContact O-N 3.4Å; V187-R189 VanDerWaalsContact C-N 3.33Å; V187-R189 PolarHBondContact O-N 3.12Å |
| 188 | S | 60.9 | Low | 66 | Low | 98 Ų | 98 | 129.7 Ų | 129.7 | 69% | 0.685 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | -1.5 | 170.3 | -52.2 | 0 | 0 | 0 | 0 | 115.4 | R184 D185 Q186 | R184-S188 PolarHBondContact O-OG 3.25Å; D185-S188 WeakPolarHBondContact O-CB 3.34Å; D185-S188 PolarHBondContact O-N 3.37Å; Q186-S188 PolarHBondContact O-N 3.11Å |
| 189 | R | 50.6 | Low | 64.8 | Low | 197 Ų | 197 | 131.3 Ų | 131.3 | 74% | 0.743 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -125 | 135.6 | 179.8 | -68.8 | -171.4 | 178.5 | -177.8 | 1.3 | 113.4 | Q186 V187 | Q186-R189 PolarHBondContact O-N 3.32Å; Q186-R189 VanDerWaalsContact O-O 3.09Å; V187-R189 VanDerWaalsContact C-N 3.33Å; V187-R189 PolarHBondContact O-N 3.12Å |
| 190 | P | 50.1 | Low | 63.6 | Low | 135 Ų | 135 | 129.8 Ų | 129.8 | 88% | 0.877 | 66% | 0.66 | S | S | * | * | trans | -78.7 | 127.9 | -179.8 | 27.2 | -25.1 | 0 | 0 | 0 | 111.8 | ||||
| 191 | R | 48.3 | Very low | 62.9 | Low | 204 Ų | 204 | 131.2 Ų | 131.2 | 77% | 0.77 | 66% | 0.664 | S | S | * | * | trans | -99.7 | 140.2 | 178.8 | -73.2 | -173.7 | 173.3 | -141.7 | 0.4 | 112.3 | ||||
| 192 | R | 39.5 | Very low | 62.2 | Low | 254 Ų | 254 | 131.6 Ų | 131.6 | 96% | 0.958 | 67% | 0.672 | S | S | * | * | trans | -111.1 | 146 | 174.7 | -146.9 | -179.4 | -168.2 | 178.8 | 3.8 | 110.8 | ||||
| 193 | S | 41.9 | Very low | 61.9 | Low | 120 Ų | 120 | 139.1 Ų | 139.1 | 84% | 0.839 | 69% | 0.694 | S | S | * | * | trans | -85.1 | 150.3 | -168.8 | 43.3 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 194 | R | 42.4 | Very low | 61.9 | Low | 248 Ų | 248 | 139.5 Ų | 139.5 | 94% | 0.936 | 69% | 0.693 | S | S | * | * | trans | -113.2 | 143 | -175.9 | -160.1 | 178.2 | -170.5 | 174.8 | 2.9 | 110.5 | ||||
| 195 | T | 41.1 | Very low | 61.9 | Low | 138 Ų | 138 | 132.5 Ų | 132.5 | 85% | 0.847 | 68% | 0.677 | S | S | * | * | trans | -101.4 | 154.4 | -168.9 | -39.3 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 196 | M | 50.2 | Low | 62.2 | Low | 154 Ų | 154 | 131 Ų | 131 | 76% | 0.759 | 68% | 0.675 | S | S | * | * | trans | -70.9 | 143.6 | -161.2 | -57 | -82.4 | -74.2 | 0 | 0 | 117.8 | D198 | M196-D198 VanDerWaalsContact CE-OD2 3.23Å; M196-D198 WeakPolarHBondContact CE-OD2 3.39Å | ||
| 197 | S | 58.7 | Low | 62.9 | Low | 74 Ų | 74 | 131.4 Ų | 131.4 | 52% | 0.517 | 68% | 0.679 | S | S | . | * | trans | -155.6 | 61.3 | 166.2 | -175.8 | 0 | 0 | 0 | 0 | 111.4 | Q201 | S197-Q201 VanDerWaalsContact O-CD 3.27Å; S197-Q201 WeakPolarHBondContact O-CG 3.42Å; S197-Q201 PolarHBondContact O-NE2 2.92Å | ||
| 198 | D | 65 | Low | 64.1 | Low | 83 Ų | 83 | 131.1 Ų | 131.1 | 44% | 0.444 | 66% | 0.663 | S | S | . | * | trans | -98.9 | -18.4 | -161.3 | -61.1 | -24.8 | 0 | 0 | 0 | 115.5 | M196 C202 | M196-D198 VanDerWaalsContact CE-OD2 3.23Å; M196-D198 WeakPolarHBondContact CE-OD2 3.39Å; D198-C202 PolarHBondContact O-N 3.36Å; D198-C202 PolarHBondContact O-SG 3.38Å | ||
| 199 | V | 68 | Low | 65.4 | Low | 129 Ų | 129 | 130.9 Ų | 130.9 | 78% | 0.782 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -82.2 | -41.1 | -166 | -177.3 | 0 | 0 | 0 | 0 | 113.8 | Q201 | V199-Q201 VanDerWaalsContact C-N 3.34Å |
| 200 | S | 67.8 | Low | 67.4 | Low | 84 Ų | 84 | 128.2 Ų | 128.2 | 59% | 0.587 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -72.3 | -29.1 | 177.2 | 54.8 | 0 | 0 | 0 | 0 | 112.6 | Q204 | S200-Q204 PolarHBondContact O-N 2.91Å |
| 201 | Q | 75.8 | Confident | 69.3 | Low | 110 Ų | 110 | 130.5 Ų | 130.5 | 51% | 0.514 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -69.3 | -38.8 | 176.9 | -62.2 | -174 | 24.3 | 0 | 0 | 111.7 | S197 V199 R203 Q204 A205 | S197-Q201 VanDerWaalsContact O-CD 3.27Å; S197-Q201 WeakPolarHBondContact O-CG 3.42Å; S197-Q201 PolarHBondContact O-NE2 2.92Å; V199-Q201 VanDerWaalsContact C-N 3.34Å; Q201-R203 PolarHBondContact O-N 3.49Å; Q201-Q204 PolarHBondContact O-N 2.99Å; Q201-A205 VanDerWaalsContact O-CB 3.28Å; Q201-A205 WeakPolarHBondContact O-CB 3.32Å; Q201-A205 PolarHBondContact O-N 3.43Å |
| 202 | C | 74.3 | Confident | 71.4 | Confident | 86 Ų | 86 | 128.9 Ų | 128.9 | 58% | 0.581 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -61.3 | -42.3 | 176.1 | -75.6 | 0 | 0 | 0 | 0 | 113 | D198 A205 S206 | D198-C202 PolarHBondContact O-N 3.36Å; D198-C202 PolarHBondContact O-SG 3.38Å; C202-A205 PolarHBondContact O-N 2.94Å; C202-S206 PolarHBondContact O-N 3.36Å; C202-S206 VanDerWaalsContact O-N 3.08Å |
| 203 | R | 79.8 | Confident | 73.9 | Confident | 201 Ų | 201 | 121.3 Ų | 121.3 | 76% | 0.758 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -67.3 | -40 | 178.6 | -164.6 | 178.1 | 179 | -164.4 | -0.1 | 111.9 | Q201 I207 | Q201-R203 PolarHBondContact O-N 3.49Å; R203-I207 PolarHBondContact O-N 2.98Å |
| 204 | Q | 85.6 | Confident | 76.3 | Confident | 104 Ų | 104 | 118.9 Ų | 118.9 | 49% | 0.486 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -69.8 | -34.2 | 176 | -167.9 | 175.3 | 19.8 | 0 | 0 | 112.4 | S200 Q201 R208 | S200-Q204 PolarHBondContact O-N 2.91Å; Q201-Q204 PolarHBondContact O-N 2.99Å; Q204-R208 VanDerWaalsContact NE2-NH2 3.14Å; Q204-R208 WeakPolarHBondContact O-CG 3.4Å; Q204-R208 PolarHBondContact O-N 3.11Å |
| 205 | A | 85.1 | Confident | 78.7 | Confident | 49 Ų | 49 | 108.8 Ų | 108.8 | 41% | 0.405 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -65.6 | -40.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q201 C202 R208 L209 | Q201-A205 VanDerWaalsContact O-CB 3.28Å; Q201-A205 WeakPolarHBondContact O-CB 3.32Å; Q201-A205 PolarHBondContact O-N 3.43Å; C202-A205 PolarHBondContact O-N 2.94Å; A205-R208 PolarHBondContact O-N 2.93Å; A205-L209 PolarHBondContact O-N 3.44Å |
| 206 | S | 84.4 | Confident | 81 | Confident | 77 Ų | 77 | 104.6 Ų | 104.6 | 54% | 0.538 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65.3 | -43.6 | -178.7 | -163.2 | 0 | 0 | 0 | 0 | 113 | C202 R208 L209 Q210 | C202-S206 PolarHBondContact O-N 3.36Å; C202-S206 VanDerWaalsContact O-N 3.08Å; S206-R208 VanDerWaalsContact C-N 3.31Å; S206-R208 PolarHBondContact O-N 3.4Å; S206-L209 WeakPolarHBondContact O-CB 3.32Å; S206-L209 PolarHBondContact O-N 3.41Å; S206-L209 VanDerWaalsContact O-N 3.14Å; S206-Q210 PolarHBondContact O-N 2.81Å |
| 207 | I | 86.9 | Confident | 83.1 | Confident | 81 Ų | 81 | 100.7 Ų | 100.7 | 42% | 0.415 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.5 | -37.8 | 176.1 | -64.4 | 170.6 | 0 | 0 | 0 | 111.5 | R203 L209 Q210 R211 | R203-I207 PolarHBondContact O-N 2.98Å; I207-L209 VanDerWaalsContact C-N 3.33Å; I207-Q210 PolarHBondContact O-N 3.25Å; I207-R211 PolarHBondContact O-N 3.44Å |
| 208 | R | 89.8 | Confident | 84.8 | Confident | 127 Ų | 127 | 101.3 Ų | 101.3 | 48% | 0.479 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67.9 | -33.7 | 175.8 | -71.6 | 173.3 | 176 | 171.1 | -1.2 | 112.1 | Q204 A205 S206 R212 | Q204-R208 VanDerWaalsContact NE2-NH2 3.14Å; Q204-R208 WeakPolarHBondContact O-CG 3.4Å; Q204-R208 PolarHBondContact O-N 3.11Å; A205-R208 PolarHBondContact O-N 2.93Å; S206-R208 VanDerWaalsContact C-N 3.31Å; S206-R208 PolarHBondContact O-N 3.4Å; R208-R212 WeakPolarHBondContact O-CG 3.27Å; R208-R212 PolarHBondContact O-N 2.91Å; R208-R212 PolarHBondContact O-NE 2.87Å |
| 209 | L | 89.4 | Confident | 86.2 | Confident | 94 Ų | 94 | 99.7 Ų | 99.7 | 49% | 0.492 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.4 | -49.6 | 173.8 | -169.5 | 85 | 0 | 0 | 0 | 110.4 | A205 S206 I207 R211 R212 L213 | A205-L209 PolarHBondContact O-N 3.44Å; S206-L209 WeakPolarHBondContact O-CB 3.32Å; S206-L209 PolarHBondContact O-N 3.41Å; S206-L209 VanDerWaalsContact O-N 3.14Å; I207-L209 VanDerWaalsContact C-N 3.33Å; L209-R211 PolarHBondContact O-N 2.93Å; L209-R212 PolarHBondContact O-N 2.63Å; L209-R212 VanDerWaalsContact O-N 3.1Å; L209-L213 HydrophobicContact CD2-CD1 4.1Å; L209-L213 HydrophobicContact CG-CD1 3.97Å; L209-L213 HydrophobicContact CG-CG 4.39Å; L209-L213 WeakPolarHBondContact O-CG 3.38Å; L209-L213 PolarHBondContact O-N 3.1Å |
| 210 | Q | 91.8 | Very high | 87.4 | Confident | 141 Ų | 141 | 97.7 Ų | 97.7 | 66% | 0.659 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -59.4 | -43 | -177.8 | -170.5 | 176.9 | -7.6 | 0 | 0 | 112.7 | S206 I207 R212 L213 S214 | S206-Q210 PolarHBondContact O-N 2.81Å; I207-Q210 PolarHBondContact O-N 3.25Å; Q210-R212 VanDerWaalsContact C-N 3.34Å; Q210-R212 PolarHBondContact O-N 2.77Å; Q210-L213 PolarHBondContact O-N 2.97Å; Q210-S214 PolarHBondContact O-N 3.38Å; Q210-S214 PolarHBondContact O-OG 3.06Å |
| 211 | R | 90.1 | Very high | 88.7 | Confident | 183 Ų | 183 | 99 Ų | 99 | 69% | 0.691 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.9 | -35.4 | 176 | -68 | -178.4 | -166.1 | 169.7 | 2.5 | 113.3 | I207 L209 S214 G215 | I207-R211 PolarHBondContact O-N 3.44Å; L209-R211 PolarHBondContact O-N 2.93Å; R211-S214 PolarHBondContact O-OG 3.34Å; R211-G215 PolarHBondContact O-N 3.23Å |
| 212 | R | 91.4 | Very high | 89.7 | Confident | 170 Ų | 170 | 95.9 Ų | 95.9 | 64% | 0.642 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -69.1 | -42.3 | 175.5 | -81.3 | -174.3 | -81.1 | -127.5 | 6.1 | 111.3 | R208 L209 Q210 G215 S216 | R208-R212 WeakPolarHBondContact O-CG 3.27Å; R208-R212 PolarHBondContact O-N 2.91Å; R208-R212 PolarHBondContact O-NE 2.87Å; L209-R212 PolarHBondContact O-N 2.63Å; L209-R212 VanDerWaalsContact O-N 3.1Å; Q210-R212 VanDerWaalsContact C-N 3.34Å; Q210-R212 PolarHBondContact O-N 2.77Å; R212-G215 PolarHBondContact O-N 3.29Å; R212-S216 WeakPolarHBondContact O-CB 3.39Å; R212-S216 PolarHBondContact O-N 3.49Å; R212-S216 PolarHBondContact O-OG 2.94Å |
| 213 | L | 93.1 | Very high | 90.6 | Very high | 95 Ų | 95 | 101.1 Ų | 101.1 | 50% | 0.497 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.1 | -45.6 | 178.7 | -69.9 | 173.8 | 0 | 0 | 0 | 111.5 | L209 Q210 G215 S216 V217 | L209-L213 HydrophobicContact CD2-CD1 4.1Å; L209-L213 HydrophobicContact CG-CD1 3.97Å; L209-L213 HydrophobicContact CG-CG 4.39Å; L209-L213 WeakPolarHBondContact O-CG 3.38Å; L209-L213 PolarHBondContact O-N 3.1Å; Q210-L213 PolarHBondContact O-N 2.97Å; L213-G215 VanDerWaalsContact C-N 3.33Å; L213-G215 PolarHBondContact O-N 3.37Å; L213-S216 WeakPolarHBondContact CA-OG 3.36Å; L213-S216 PolarHBondContact O-N 3.15Å; L213-S216 VanDerWaalsContact O-N 3.13Å; L213-S216 PolarHBondContact O-OG 3.35Å; L213-V217 WeakPolarHBondContact O-CG2 2.86Å; L213-V217 PolarHBondContact O-N 2.97Å |
| 214 | S | 92.1 | Very high | 91.4 | Very high | 68 Ų | 68 | 98.6 Ų | 98.6 | 48% | 0.476 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.5 | -41.2 | 178.1 | 59.4 | 0 | 0 | 0 | 0 | 112.8 | Q210 R211 V217 T218 | Q210-S214 PolarHBondContact O-N 3.38Å; Q210-S214 PolarHBondContact O-OG 3.06Å; R211-S214 PolarHBondContact O-OG 3.34Å; S214-V217 PolarHBondContact O-N 3.37Å; S214-T218 PolarHBondContact O-N 3.42Å; S214-T218 VanDerWaalsContact O-N 3.15Å; S214-T218 PolarHBondContact O-OG1 3.42Å |
| 215 | G | 92 | Very high | 92 | Very high | 37 Ų | 37 | 99.5 Ų | 99.5 | 38% | 0.381 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -68.9 | -33.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | R211 R212 L213 T218 A219 | R211-G215 PolarHBondContact O-N 3.23Å; R212-G215 PolarHBondContact O-N 3.29Å; L213-G215 VanDerWaalsContact C-N 3.33Å; L213-G215 PolarHBondContact O-N 3.37Å; G215-T218 PolarHBondContact O-OG1 2.96Å; G215-A219 VanDerWaalsContact O-CB 3.29Å; G215-A219 WeakPolarHBondContact O-CB 3.41Å; G215-A219 PolarHBondContact O-N 2.73Å; G215-A219 VanDerWaalsContact O-N 3.08Å |
| 216 | S | 90.6 | Very high | 92.6 | Very high | 49 Ų | 49 | 100.9 Ų | 100.9 | 34% | 0.343 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.3 | -38.4 | 174.9 | 70.4 | 0 | 0 | 0 | 0 | 112.2 | R212 L213 L220 | R212-S216 WeakPolarHBondContact O-CB 3.39Å; R212-S216 PolarHBondContact O-N 3.49Å; R212-S216 PolarHBondContact O-OG 2.94Å; L213-S216 WeakPolarHBondContact CA-OG 3.36Å; L213-S216 PolarHBondContact O-N 3.15Å; L213-S216 VanDerWaalsContact O-N 3.13Å; L213-S216 PolarHBondContact O-OG 3.35Å; S216-L220 WeakPolarHBondContact O-CB 3.37Å; S216-L220 WeakPolarHBondContact O-CD1 3.34Å; S216-L220 VanDerWaalsContact O-CG 3.31Å; S216-L220 WeakPolarHBondContact O-CG 3.22Å; S216-L220 PolarHBondContact O-N 3.39Å |
| 217 | V | 93.7 | Very high | 93.2 | Very high | 72 Ų | 72 | 105.8 Ų | 105.8 | 44% | 0.436 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -66.7 | -47.8 | 178.5 | 171.3 | 0 | 0 | 0 | 0 | 110.7 | L213 S214 A219 L220 E221 | L213-V217 WeakPolarHBondContact O-CG2 2.86Å; L213-V217 PolarHBondContact O-N 2.97Å; S214-V217 PolarHBondContact O-N 3.37Å; V217-A219 VanDerWaalsContact C-N 3.34Å; V217-A219 PolarHBondContact O-N 2.9Å; V217-L220 WeakPolarHBondContact O-CB 3.36Å; V217-L220 PolarHBondContact O-N 2.96Å; V217-E221 WeakPolarHBondContact O-CG 3.38Å; V217-E221 PolarHBondContact O-N 3Å |
| 218 | T | 93.8 | Very high | 93.6 | Very high | 88 Ų | 88 | 107.7 Ų | 107.7 | 54% | 0.54 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.7 | -35.2 | 178.7 | 55.7 | 0 | 0 | 0 | 0 | 112.6 | S214 G215 G222 | S214-T218 PolarHBondContact O-N 3.42Å; S214-T218 VanDerWaalsContact O-N 3.15Å; S214-T218 PolarHBondContact O-OG1 3.42Å; G215-T218 PolarHBondContact O-OG1 2.96Å; T218-G222 PolarHBondContact O-N 3.08Å |
| 219 | A | 94.3 | Very high | 94 | Very high | 48 Ų | 48 | 105.1 Ų | 105.1 | 40% | 0.397 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.6 | -47.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | G215 V217 E221 G222 W223 | G215-A219 VanDerWaalsContact O-CB 3.29Å; G215-A219 WeakPolarHBondContact O-CB 3.41Å; G215-A219 PolarHBondContact O-N 2.73Å; G215-A219 VanDerWaalsContact O-N 3.08Å; V217-A219 VanDerWaalsContact C-N 3.34Å; V217-A219 PolarHBondContact O-N 2.9Å; A219-E221 PolarHBondContact O-N 3.37Å; A219-G222 PolarHBondContact O-N 3.15Å; A219-W223 PolarHBondContact O-N 3.18Å |
| 220 | L | 94.3 | Very high | 94.4 | Very high | 88 Ų | 88 | 103.5 Ų | 103.5 | 46% | 0.461 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -58.1 | -47 | 176.8 | -83.1 | 158.2 | 0 | 0 | 0 | 112 | S216 V217 G222 W223 Y224 | S216-L220 WeakPolarHBondContact O-CB 3.37Å; S216-L220 WeakPolarHBondContact O-CD1 3.34Å; S216-L220 VanDerWaalsContact O-CG 3.31Å; S216-L220 WeakPolarHBondContact O-CG 3.22Å; S216-L220 PolarHBondContact O-N 3.39Å; V217-L220 WeakPolarHBondContact O-CB 3.36Å; V217-L220 PolarHBondContact O-N 2.96Å; L220-G222 VanDerWaalsContact C-N 3.32Å; L220-G222 PolarHBondContact O-N 3Å; L220-W223 PolarHBondContact O-N 3.41Å; L220-W223 VanDerWaalsContact O-N 3.13Å; L220-Y224 HydrophobicContact CD2-CD2 4.14Å; L220-Y224 HydrophobicContact CD2-CE2 3.61Å; L220-Y224 VanDerWaalsContact O-CD2 3.25Å; L220-Y224 WeakPolarHBondContact O-CD2 3.43Å; L220-Y224 PolarHBondContact O-N 3.39Å |
| 221 | E | 95.3 | Very high | 94.7 | Very high | 111 Ų | 111 | 101.5 Ų | 101.5 | 52% | 0.519 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -56.5 | -46.8 | 175.1 | -73 | 169.8 | 167.9 | 0 | 0 | 111.2 | V217 A219 W223 Y224 E225 | V217-E221 WeakPolarHBondContact O-CG 3.38Å; V217-E221 PolarHBondContact O-N 3Å; A219-E221 PolarHBondContact O-N 3.37Å; E221-W223 VanDerWaalsContact C-N 3.28Å; E221-W223 PolarHBondContact O-N 3.33Å; E221-Y224 PolarHBondContact O-N 2.89Å; E221-E225 WeakPolarHBondContact O-CB 3.37Å; E221-E225 PolarHBondContact O-N 3.47Å |
| 222 | G | 95.8 | Very high | 95.1 | Very high | 45 Ų | 45 | 97 Ų | 97 | 46% | 0.464 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.9 | -31 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | T218 A219 L220 P226 | T218-G222 PolarHBondContact O-N 3.08Å; A219-G222 PolarHBondContact O-N 3.15Å; L220-G222 VanDerWaalsContact C-N 3.32Å; L220-G222 PolarHBondContact O-N 3Å; G222-P226 WeakPolarHBondContact O-CD 3.44Å; G222-P226 WeakPolarHBondContact O-CG 3.39Å |
| 223 | W | 94.2 | Very high | 95.4 | Very high | 196 Ų | 196 | 97 Ų | 97 | 74% | 0.742 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -77.2 | -38.7 | 176.6 | -73.2 | 111.8 | 0 | 0 | 0 | 113.2 | A219 L220 E221 | A219-W223 PolarHBondContact O-N 3.18Å; L220-W223 PolarHBondContact O-N 3.41Å; L220-W223 VanDerWaalsContact O-N 3.13Å; E221-W223 VanDerWaalsContact C-N 3.28Å; E221-W223 PolarHBondContact O-N 3.33Å |
| 224 | Y | 96.4 | Very high | 95.6 | Very high | 147 Ų | 147 | 101.8 Ų | 101.8 | 58% | 0.576 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -95.4 | -31.7 | -170.4 | -74 | -70.7 | 0 | 0 | 0 | 114 | L220 E221 R227 M228 | L220-Y224 HydrophobicContact CD2-CD2 4.14Å; L220-Y224 HydrophobicContact CD2-CE2 3.61Å; L220-Y224 VanDerWaalsContact O-CD2 3.25Å; L220-Y224 WeakPolarHBondContact O-CD2 3.43Å; L220-Y224 PolarHBondContact O-N 3.39Å; E221-Y224 PolarHBondContact O-N 2.89Å; Y224-R227 PolarHBondContact O-N 3.14Å; Y224-M228 WeakPolarHBondContact O-CB 3.44Å; Y224-M228 PolarHBondContact O-N 2.89Å |
| 225 | E | 97.3 | Very high | 95.9 | Very high | 123 Ų | 123 | 105.4 Ų | 105.4 | 58% | 0.575 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -59 | -50.7 | -179.4 | 179.8 | -177.4 | -172.4 | 0 | 0 | 112.5 | E221 R227 M228 V229 | E221-E225 WeakPolarHBondContact O-CB 3.37Å; E221-E225 PolarHBondContact O-N 3.47Å; E225-R227 VanDerWaalsContact C-N 3.27Å; E225-R227 PolarHBondContact O-N 2.72Å; E225-M228 PolarHBondContact O-N 3.17Å; E225-V229 WeakPolarHBondContact O-CG2 3.38Å; E225-V229 PolarHBondContact O-N 3.04Å |
| 226 | P | 97.1 | Very high | 96.2 | Very high | 79 Ų | 79 | 107.9 Ų | 107.9 | 51% | 0.513 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.3 | -35.7 | 179.7 | -20.9 | 33.8 | 0 | 0 | 0 | 112.3 | G222 V229 A230 | G222-P226 WeakPolarHBondContact O-CD 3.44Å; G222-P226 WeakPolarHBondContact O-CG 3.39Å; P226-V229 PolarHBondContact O-N 3.5Å; P226-A230 WeakPolarHBondContact O-CB 3.36Å; P226-A230 PolarHBondContact O-N 3.35Å |
| 227 | R | 97 | Very high | 96.5 | Very high | 180 Ų | 180 | 108.1 Ų | 108.1 | 68% | 0.679 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -68.5 | -40.7 | 179.8 | -159.8 | 171.1 | -173.3 | 170.5 | 1.5 | 111.1 | Y224 E225 A230 L231 | Y224-R227 PolarHBondContact O-N 3.14Å; E225-R227 VanDerWaalsContact C-N 3.27Å; E225-R227 PolarHBondContact O-N 2.72Å; R227-A230 PolarHBondContact O-N 3.42Å; R227-L231 VanDerWaalsContact O-CG 3.28Å; R227-L231 WeakPolarHBondContact O-CG 3.28Å; R227-L231 PolarHBondContact O-N 2.95Å |
| 228 | M | 96.7 | Very high | 96.8 | Very high | 121 Ų | 121 | 106.7 Ų | 106.7 | 60% | 0.596 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -66.6 | -43.2 | 174.9 | -172.6 | 159.1 | 56.5 | 0 | 0 | 111.5 | Y224 E225 A230 L231 L232 | Y224-M228 WeakPolarHBondContact O-CB 3.44Å; Y224-M228 PolarHBondContact O-N 2.89Å; E225-M228 PolarHBondContact O-N 3.17Å; M228-A230 PolarHBondContact O-N 3.28Å; M228-L231 PolarHBondContact O-N 3.32Å; M228-L232 HydrophobicContact CG-CD1 4.5Å; M228-L232 WeakPolarHBondContact O-CG 3.41Å; M228-L232 PolarHBondContact O-N 2.97Å |
| 229 | V | 97.7 | Very high | 97 | Very high | 73 Ų | 73 | 106.6 Ų | 106.6 | 44% | 0.442 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.8 | -43.7 | 175.3 | 173 | 0 | 0 | 0 | 0 | 111.6 | E225 P226 L231 L232 R233 | E225-V229 WeakPolarHBondContact O-CG2 3.38Å; E225-V229 PolarHBondContact O-N 3.04Å; P226-V229 PolarHBondContact O-N 3.5Å; V229-L231 VanDerWaalsContact C-N 3.34Å; V229-L231 PolarHBondContact O-N 3.31Å; V229-L232 PolarHBondContact O-N 2.91Å; V229-R233 HydrophobicContact CG1-CG 4.41Å; V229-R233 WeakPolarHBondContact O-CG 2.96Å; V229-R233 PolarHBondContact O-N 2.85Å |
| 230 | A | 97.8 | Very high | 97.1 | Very high | 59 Ų | 59 | 108.2 Ų | 108.2 | 49% | 0.488 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62 | -40.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | P226 R227 M228 R233 R234 | P226-A230 WeakPolarHBondContact O-CB 3.36Å; P226-A230 PolarHBondContact O-N 3.35Å; R227-A230 PolarHBondContact O-N 3.42Å; M228-A230 PolarHBondContact O-N 3.28Å; A230-R233 PolarHBondContact O-N 3.34Å; A230-R234 WeakPolarHBondContact O-CB 3.47Å; A230-R234 PolarHBondContact O-N 3.41Å |
| 231 | L | 97.9 | Very high | 97.3 | Very high | 99 Ų | 99 | 106.4 Ų | 106.4 | 52% | 0.518 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.5 | -42.3 | 175.3 | -73.1 | 172 | 0 | 0 | 0 | 112 | R227 M228 V229 R234 R235 | R227-L231 VanDerWaalsContact O-CG 3.28Å; R227-L231 WeakPolarHBondContact O-CG 3.28Å; R227-L231 PolarHBondContact O-N 2.95Å; M228-L231 PolarHBondContact O-N 3.32Å; V229-L231 VanDerWaalsContact C-N 3.34Å; V229-L231 PolarHBondContact O-N 3.31Å; L231-R234 PolarHBondContact O-N 3.01Å; L231-R235 PolarHBondContact O-N 2.88Å |
| 232 | L | 97.9 | Very high | 97.5 | Very high | 88 Ų | 88 | 105.8 Ų | 105.8 | 46% | 0.461 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 176.2 | -70.7 | 172.8 | 0 | 0 | 0 | 111.9 | M228 V229 R234 R235 Q236 | M228-L232 HydrophobicContact CG-CD1 4.5Å; M228-L232 WeakPolarHBondContact O-CG 3.41Å; M228-L232 PolarHBondContact O-N 2.97Å; V229-L232 PolarHBondContact O-N 2.91Å; L232-R234 PolarHBondContact O-N 3.16Å; L232-R235 WeakPolarHBondContact O-CB 3.29Å; L232-R235 PolarHBondContact O-N 3.5Å; L232-Q236 PolarHBondContact O-N 2.95Å |
| 233 | R | 98.3 | Very high | 97.6 | Very high | 172 Ų | 172 | 109.6 Ų | 109.6 | 65% | 0.649 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -61.3 | -43.7 | 175.5 | -72.5 | -69.9 | -175 | 159.7 | 0.8 | 111.9 | V229 A230 R235 Q236 A237 | V229-R233 HydrophobicContact CG1-CG 4.41Å; V229-R233 WeakPolarHBondContact O-CG 2.96Å; V229-R233 PolarHBondContact O-N 2.85Å; A230-R233 PolarHBondContact O-N 3.34Å; R233-R235 VanDerWaalsContact C-N 3.34Å; R233-R235 PolarHBondContact O-N 3.14Å; R233-Q236 PolarHBondContact O-N 3.32Å; R233-A237 PolarHBondContact O-N 2.89Å |
| 234 | R | 97.9 | Very high | 97.8 | Very high | 194 Ų | 194 | 104.1 Ų | 104.1 | 73% | 0.732 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.5 | -42.5 | 175.6 | -168.2 | -178.9 | 80.7 | 159 | 4.3 | 111.6 | A230 L231 L232 A237 G238 | A230-R234 WeakPolarHBondContact O-CB 3.47Å; A230-R234 PolarHBondContact O-N 3.41Å; L231-R234 PolarHBondContact O-N 3.01Å; L232-R234 PolarHBondContact O-N 3.16Å; R234-A237 PolarHBondContact O-N 3.48Å; R234-G238 PolarHBondContact O-N 2.99Å |
| 235 | R | 97.9 | Very high | 97.8 | Very high | 144 Ų | 144 | 100.7 Ų | 100.7 | 54% | 0.543 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.2 | -48.3 | 176.5 | -165.8 | -165.7 | 83.1 | -143.2 | -1.5 | 110.9 | L231 L232 R233 G238 E239 | L231-R235 PolarHBondContact O-N 2.88Å; L232-R235 WeakPolarHBondContact O-CB 3.29Å; L232-R235 PolarHBondContact O-N 3.5Å; R233-R235 VanDerWaalsContact C-N 3.34Å; R233-R235 PolarHBondContact O-N 3.14Å; R235-G238 PolarHBondContact O-N 2.98Å; R235-E239 IonicContact CZ-OE1 3.72Å; R235-E239 IonicContact NE-OE1 2.82Å; R235-E239 PolarHBondContact NE-OE1 3.19Å; R235-E239 IonicContact NH2-OE1 3.78Å; R235-E239 WeakPolarHBondContact O-CG 3.26Å; R235-E239 PolarHBondContact O-N 2.89Å |
| 236 | Q | 98.2 | Very high | 97.9 | Very high | 89 Ų | 89 | 100.7 Ų | 100.7 | 42% | 0.416 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.5 | -45.9 | 179.5 | -177 | 175.1 | -5.1 | 0 | 0 | 112.2 | L232 R233 G238 E239 E240 | L232-Q236 PolarHBondContact O-N 2.95Å; R233-Q236 PolarHBondContact O-N 3.32Å; Q236-G238 VanDerWaalsContact C-N 3.27Å; Q236-G238 PolarHBondContact O-N 3.35Å; Q236-E239 PolarHBondContact O-N 2.83Å; Q236-E239 VanDerWaalsContact O-N 3.17Å; Q236-E240 WeakPolarHBondContact CG-OE1 3.22Å; Q236-E240 PolarHBondContact NE2-OE1 3.5Å; Q236-E240 WeakPolarHBondContact O-CG 3.47Å; Q236-E240 PolarHBondContact O-N 3.48Å |
| 237 | A | 97.9 | Very high | 97.9 | Very high | 55 Ų | 55 | 101.3 Ų | 101.3 | 46% | 0.455 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.5 | -37.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | R233 R234 E240 A241 | R233-A237 PolarHBondContact O-N 2.89Å; R234-A237 PolarHBondContact O-N 3.48Å; A237-E240 PolarHBondContact O-N 3.33Å; A237-A241 WeakPolarHBondContact O-CB 3.33Å; A237-A241 PolarHBondContact O-N 2.89Å |
| 238 | G | 98 | Very high | 98 | Very high | 41 Ų | 41 | 98.4 Ų | 98.4 | 42% | 0.423 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.7 | -41 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | R234 R235 Q236 L242 | R234-G238 PolarHBondContact O-N 2.99Å; R235-G238 PolarHBondContact O-N 2.98Å; Q236-G238 VanDerWaalsContact C-N 3.27Å; Q236-G238 PolarHBondContact O-N 3.35Å; G238-L242 WeakPolarHBondContact O-CB 3.46Å; G238-L242 PolarHBondContact O-N 3.12Å |
| 239 | E | 98.2 | Very high | 98 | Very high | 86 Ų | 86 | 94.6 Ų | 94.6 | 40% | 0.402 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65 | -41.1 | 175.1 | -71.9 | 169.8 | -157.6 | 0 | 0 | 112 | R235 Q236 L242 R243 | R235-E239 IonicContact CZ-OE1 3.72Å; R235-E239 IonicContact NE-OE1 2.82Å; R235-E239 PolarHBondContact NE-OE1 3.19Å; R235-E239 IonicContact NH2-OE1 3.78Å; R235-E239 WeakPolarHBondContact O-CG 3.26Å; R235-E239 PolarHBondContact O-N 2.89Å; Q236-E239 PolarHBondContact O-N 2.83Å; Q236-E239 VanDerWaalsContact O-N 3.17Å; E239-L242 PolarHBondContact O-N 3.45Å; E239-R243 PolarHBondContact O-N 3.33Å |
| 240 | E | 98.1 | Very high | 98 | Very high | 82 Ų | 82 | 96.4 Ų | 96.4 | 38% | 0.383 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65.1 | -46.3 | 175.6 | -72.5 | 169 | -167.5 | 0 | 0 | 111.7 | Q236 A237 L242 R243 N244 | Q236-E240 WeakPolarHBondContact CG-OE1 3.22Å; Q236-E240 PolarHBondContact NE2-OE1 3.5Å; Q236-E240 WeakPolarHBondContact O-CG 3.47Å; Q236-E240 PolarHBondContact O-N 3.48Å; A237-E240 PolarHBondContact O-N 3.33Å; E240-L242 VanDerWaalsContact C-N 3.31Å; E240-L242 PolarHBondContact O-N 2.89Å; E240-R243 WeakPolarHBondContact O-CB 3.27Å; E240-R243 PolarHBondContact O-N 3.37Å; E240-R243 VanDerWaalsContact O-N 3.16Å; E240-N244 VanDerWaalsContact O-CG 3.28Å; E240-N244 PolarHBondContact O-N 2.94Å; E240-N244 PolarHBondContact O-OD1 2.99Å |
| 241 | A | 98.1 | Very high | 98 | Very high | 50 Ų | 50 | 99 Ų | 99 | 41% | 0.413 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.1 | -42.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | A237 R243 N244 C245 | A237-A241 WeakPolarHBondContact O-CB 3.33Å; A237-A241 PolarHBondContact O-N 2.89Å; A241-R243 VanDerWaalsContact C-N 3.32Å; A241-R243 PolarHBondContact O-N 2.99Å; A241-N244 PolarHBondContact O-N 2.93Å; A241-C245 PolarHBondContact O-N 3.3Å; A241-C245 PolarHBondContact O-SG 2.99Å |
| 242 | L | 98 | Very high | 97.9 | Very high | 98 Ų | 98 | 99.7 Ų | 99.7 | 51% | 0.513 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.6 | -39.2 | 176.5 | -178.3 | 65.2 | 0 | 0 | 0 | 112 | G238 E239 E240 K246 | G238-L242 WeakPolarHBondContact O-CB 3.46Å; G238-L242 PolarHBondContact O-N 3.12Å; E239-L242 PolarHBondContact O-N 3.45Å; E240-L242 VanDerWaalsContact C-N 3.31Å; E240-L242 PolarHBondContact O-N 2.89Å; L242-K246 HydrophobicContact CG-CD 4.5Å; L242-K246 WeakPolarHBondContact O-CG 3.29Å; L242-K246 PolarHBondContact O-N 3.27Å; L242-K246 VanDerWaalsContact O-N 3.08Å |
| 243 | R | 98.4 | Very high | 97.9 | Very high | 125 Ų | 125 | 104.3 Ų | 104.3 | 47% | 0.472 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.6 | -48.5 | 175.9 | -165.6 | -175.1 | -56.6 | 107.4 | 3.7 | 110.8 | E239 E240 A241 C245 K246 E247 | E239-R243 PolarHBondContact O-N 3.33Å; E240-R243 WeakPolarHBondContact O-CB 3.27Å; E240-R243 PolarHBondContact O-N 3.37Å; E240-R243 VanDerWaalsContact O-N 3.16Å; A241-R243 VanDerWaalsContact C-N 3.32Å; A241-R243 PolarHBondContact O-N 2.99Å; R243-C245 PolarHBondContact O-N 3.46Å; R243-K246 WeakPolarHBondContact O-CB 3.38Å; R243-K246 PolarHBondContact O-N 3.41Å; R243-K246 VanDerWaalsContact O-N 3.1Å; R243-E247 PolarHBondContact O-N 2.71Å |
| 244 | N | 98.3 | Very high | 97.8 | Very high | 81 Ų | 81 | 99.5 Ų | 99.5 | 43% | 0.433 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.1 | -43.3 | 178.5 | -63.8 | -9.5 | 0 | 0 | 0 | 111.9 | E240 A241 K246 E247 Q248 | E240-N244 VanDerWaalsContact O-CG 3.28Å; E240-N244 PolarHBondContact O-N 2.94Å; E240-N244 PolarHBondContact O-OD1 2.99Å; A241-N244 PolarHBondContact O-N 2.93Å; N244-K246 VanDerWaalsContact C-N 3.31Å; N244-K246 PolarHBondContact O-N 3.38Å; N244-E247 PolarHBondContact O-N 3.21Å; N244-Q248 WeakPolarHBondContact O-CG 3.41Å; N244-Q248 PolarHBondContact O-N 3.42Å |
| 245 | C | 97.8 | Very high | 97.7 | Very high | 75 Ų | 75 | 93.4 Ų | 93.4 | 51% | 0.507 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.4 | -36.9 | 176.2 | -68.2 | 0 | 0 | 0 | 0 | 112.5 | A241 R243 A249 | A241-C245 PolarHBondContact O-N 3.3Å; A241-C245 PolarHBondContact O-SG 2.99Å; R243-C245 PolarHBondContact O-N 3.46Å; C245-A249 WeakPolarHBondContact O-CB 3.44Å; C245-A249 PolarHBondContact O-N 3.5Å |
| 246 | K | 98.2 | Very high | 97.7 | Very high | 124 Ų | 124 | 90.2 Ų | 90.2 | 54% | 0.539 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66.6 | -42.3 | 176 | -75.3 | 174.5 | 178.9 | 178.7 | 0 | 111.6 | L242 R243 N244 A249 M250 | L242-K246 HydrophobicContact CG-CD 4.5Å; L242-K246 WeakPolarHBondContact O-CG 3.29Å; L242-K246 PolarHBondContact O-N 3.27Å; L242-K246 VanDerWaalsContact O-N 3.08Å; R243-K246 WeakPolarHBondContact O-CB 3.38Å; R243-K246 PolarHBondContact O-N 3.41Å; R243-K246 VanDerWaalsContact O-N 3.1Å; N244-K246 VanDerWaalsContact C-N 3.31Å; N244-K246 PolarHBondContact O-N 3.38Å; K246-A249 PolarHBondContact O-N 3.31Å; K246-M250 WeakPolarHBondContact O-CG 3.27Å; K246-M250 PolarHBondContact O-N 3.12Å |
| 247 | E | 98.2 | Very high | 97.6 | Very high | 92 Ų | 92 | 87.3 Ų | 87.3 | 43% | 0.43 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60.7 | -50.9 | 175.5 | -72.1 | 169.4 | -168.2 | 0 | 0 | 110.8 | R243 N244 A249 M250 D251 | R243-E247 PolarHBondContact O-N 2.71Å; N244-E247 PolarHBondContact O-N 3.21Å; E247-A249 VanDerWaalsContact C-N 3.29Å; E247-A249 PolarHBondContact O-N 3.38Å; E247-M250 HydrophobicContact CG-CE 4.39Å; E247-M250 CarbonylContact O-C 3.6Å; E247-M250 WeakPolarHBondContact O-CA 3.21Å; E247-M250 WeakPolarHBondContact O-CB 3.4Å; E247-M250 PolarHBondContact O-N 2.93Å; E247-D251 PolarHBondContact O-N 3.29Å |
| 248 | Q | 97.9 | Very high | 97.6 | Very high | 118 Ų | 118 | 88.1 Ų | 88.1 | 55% | 0.551 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -57.3 | -40.9 | 175.5 | -70.3 | 173.3 | -0.2 | 0 | 0 | 112.6 | N244 M250 D251 L252 | N244-Q248 WeakPolarHBondContact O-CG 3.41Å; N244-Q248 PolarHBondContact O-N 3.42Å; Q248-M250 VanDerWaalsContact C-N 3.3Å; Q248-M250 PolarHBondContact O-N 3.38Å; Q248-D251 PolarHBondContact O-N 3.41Å; Q248-L252 WeakPolarHBondContact O-CB 3.46Å; Q248-L252 VanDerWaalsContact O-CG 3.3Å; Q248-L252 WeakPolarHBondContact O-CG 3.3Å; Q248-L252 PolarHBondContact O-N 2.92Å |
| 249 | A | 96.9 | Very high | 97.6 | Very high | 41 Ų | 41 | 90.8 Ų | 90.8 | 34% | 0.339 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.4 | -34.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | C245 K246 E247 R253 | C245-A249 WeakPolarHBondContact O-CB 3.44Å; C245-A249 PolarHBondContact O-N 3.5Å; K246-A249 PolarHBondContact O-N 3.31Å; E247-A249 VanDerWaalsContact C-N 3.29Å; E247-A249 PolarHBondContact O-N 3.38Å; A249-R253 WeakPolarHBondContact O-CB 3.37Å; A249-R253 WeakPolarHBondContact O-CG 3.45Å; A249-R253 PolarHBondContact O-N 2.85Å; A249-R253 VanDerWaalsContact O-N 3.08Å |
| 250 | M | 97.8 | Very high | 97.6 | Very high | 112 Ų | 112 | 93.9 Ų | 93.9 | 55% | 0.552 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -71 | -42.7 | 174.5 | -71.4 | -171.2 | -66.9 | 0 | 0 | 111.6 | K246 E247 Q248 R253 A254 | K246-M250 WeakPolarHBondContact O-CG 3.27Å; K246-M250 PolarHBondContact O-N 3.12Å; E247-M250 HydrophobicContact CG-CE 4.39Å; E247-M250 CarbonylContact O-C 3.6Å; E247-M250 WeakPolarHBondContact O-CA 3.21Å; E247-M250 WeakPolarHBondContact O-CB 3.4Å; E247-M250 PolarHBondContact O-N 2.93Å; Q248-M250 VanDerWaalsContact C-N 3.3Å; Q248-M250 PolarHBondContact O-N 3.38Å; M250-R253 WeakPolarHBondContact O-CB 3.44Å; M250-R253 PolarHBondContact O-N 2.91Å; M250-A254 WeakPolarHBondContact O-CB 3.36Å; M250-A254 PolarHBondContact O-N 3.43Å |
| 251 | D | 97.6 | Very high | 97.6 | Very high | 112 Ų | 112 | 95.5 Ų | 95.5 | 60% | 0.599 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.9 | -45.4 | 177 | -66.8 | -22.1 | 0 | 0 | 0 | 111.5 | E247 Q248 R253 A254 S255 | E247-D251 PolarHBondContact O-N 3.29Å; Q248-D251 PolarHBondContact O-N 3.41Å; D251-R253 VanDerWaalsContact C-N 3.34Å; D251-R253 PolarHBondContact O-N 2.91Å; D251-A254 PolarHBondContact O-N 3.49Å; D251-S255 PolarHBondContact O-N 2.89Å |
| 252 | L | 96.8 | Very high | 97.6 | Very high | 115 Ų | 115 | 96 Ų | 96 | 60% | 0.602 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -60.6 | -44.6 | 174.1 | -71.6 | 175.4 | 0 | 0 | 0 | 110.9 | Q248 A254 S255 L256 | Q248-L252 WeakPolarHBondContact O-CB 3.46Å; Q248-L252 VanDerWaalsContact O-CG 3.3Å; Q248-L252 WeakPolarHBondContact O-CG 3.3Å; Q248-L252 PolarHBondContact O-N 2.92Å; L252-A254 VanDerWaalsContact C-N 3.32Å; L252-A254 PolarHBondContact O-N 2.99Å; L252-S255 PolarHBondContact O-N 3.28Å; L252-S255 PolarHBondContact O-OG 2.98Å; L252-L256 WeakPolarHBondContact O-CG 3.41Å; L252-L256 PolarHBondContact O-N 2.89Å; L252-L256 VanDerWaalsContact O-N 3.14Å |
| 253 | R | 97.4 | Very high | 97.6 | Very high | 185 Ų | 185 | 95.3 Ų | 95.3 | 70% | 0.698 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -61.1 | -39.5 | 175.6 | -78.2 | 173.4 | -177.1 | 177.7 | 2.2 | 112.7 | A249 M250 D251 L256 | A249-R253 WeakPolarHBondContact O-CB 3.37Å; A249-R253 WeakPolarHBondContact O-CG 3.45Å; A249-R253 PolarHBondContact O-N 2.85Å; A249-R253 VanDerWaalsContact O-N 3.08Å; M250-R253 WeakPolarHBondContact O-CB 3.44Å; M250-R253 PolarHBondContact O-N 2.91Å; D251-R253 VanDerWaalsContact C-N 3.34Å; D251-R253 PolarHBondContact O-N 2.91Å; R253-L256 PolarHBondContact O-N 3.5Å |
| 254 | A | 96.5 | Very high | 97.5 | Very high | 70 Ų | 70 | 96.8 Ų | 96.8 | 58% | 0.579 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.8 | -42.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | M250 D251 L252 L256 G257 P258 | M250-A254 WeakPolarHBondContact O-CB 3.36Å; M250-A254 PolarHBondContact O-N 3.43Å; D251-A254 PolarHBondContact O-N 3.49Å; L252-A254 VanDerWaalsContact C-N 3.32Å; L252-A254 PolarHBondContact O-N 2.99Å; A254-L256 VanDerWaalsContact C-N 3.27Å; A254-L256 PolarHBondContact O-N 2.92Å; A254-G257 PolarHBondContact O-N 3.27Å; A254-P258 WeakPolarHBondContact O-CD 3.24Å |
| 255 | S | 96 | Very high | 97.6 | Very high | 66 Ų | 66 | 98.6 Ų | 98.6 | 46% | 0.462 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.8 | -26 | 178.4 | 76.8 | 0 | 0 | 0 | 0 | 114.3 | D251 L252 G257 P258 | D251-S255 PolarHBondContact O-N 2.89Å; L252-S255 PolarHBondContact O-N 3.28Å; L252-S255 PolarHBondContact O-OG 2.98Å; S255-G257 VanDerWaalsContact C-N 3.28Å; S255-G257 PolarHBondContact O-N 3.33Å; S255-P258 WeakPolarHBondContact O-CD 3.26Å |
| 256 | L | 97.2 | Very high | 97.6 | Very high | 77 Ų | 77 | 99.8 Ų | 99.8 | 40% | 0.403 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -68.1 | -26.5 | 177.7 | -72.9 | 173.8 | 0 | 0 | 0 | 113 | L252 R253 A254 R260 | L252-L256 WeakPolarHBondContact O-CG 3.41Å; L252-L256 PolarHBondContact O-N 2.89Å; L252-L256 VanDerWaalsContact O-N 3.14Å; R253-L256 PolarHBondContact O-N 3.5Å; A254-L256 VanDerWaalsContact C-N 3.27Å; A254-L256 PolarHBondContact O-N 2.92Å; L256-R260 WeakPolarHBondContact O-CB 3.47Å; L256-R260 WeakPolarHBondContact O-CG 3.46Å; L256-R260 PolarHBondContact O-N 3.29Å |
| 257 | G | 96.6 | Very high | 97.6 | Very high | 29 Ų | 29 | 99.6 Ų | 99.6 | 30% | 0.299 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.3 | -62.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | A254 S255 L259 R260 E261 | A254-G257 PolarHBondContact O-N 3.27Å; S255-G257 VanDerWaalsContact C-N 3.28Å; S255-G257 PolarHBondContact O-N 3.33Å; G257-L259 VanDerWaalsContact C-N 3.28Å; G257-L259 PolarHBondContact O-N 2.92Å; G257-R260 WeakPolarHBondContact O-CB 3.49Å; G257-R260 PolarHBondContact O-N 2.88Å; G257-R260 VanDerWaalsContact O-N 3.09Å; G257-E261 PolarHBondContact O-N 3.3Å; G257-E261 VanDerWaalsContact O-N 3.12Å |
| 258 | P | 97.9 | Very high | 97.6 | Very high | 72 Ų | 72 | 99.5 Ų | 99.5 | 47% | 0.468 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -54 | -42.5 | 176 | -27.4 | 34.5 | 0 | 0 | 0 | 113 | A254 S255 R260 E261 D262 | A254-P258 WeakPolarHBondContact O-CD 3.24Å; S255-P258 WeakPolarHBondContact O-CD 3.26Å; P258-R260 VanDerWaalsContact C-N 3.31Å; P258-R260 PolarHBondContact O-N 3.5Å; P258-E261 WeakPolarHBondContact O-CB 3.37Å; P258-E261 PolarHBondContact O-N 3.44Å; P258-E261 VanDerWaalsContact O-N 3.1Å; P258-D262 VanDerWaalsContact O-CG 3.25Å; P258-D262 PolarHBondContact O-N 3.01Å |
| 259 | L | 97.6 | Very high | 97.6 | Very high | 97 Ų | 97 | 98.7 Ų | 98.7 | 51% | 0.508 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.8 | -37.6 | 179.6 | -171.9 | 63.8 | 0 | 0 | 0 | 112.4 | G257 D262 I263 | G257-L259 VanDerWaalsContact C-N 3.28Å; G257-L259 PolarHBondContact O-N 2.92Å; L259-D262 PolarHBondContact O-N 3.16Å; L259-I263 HydrophobicContact CG-CD1 4.43Å; L259-I263 VanDerWaalsContact O-CG1 3.26Å; L259-I263 WeakPolarHBondContact O-CG1 3.35Å; L259-I263 PolarHBondContact O-N 3.34Å |
| 260 | R | 97.9 | Very high | 97.7 | Very high | 150 Ų | 150 | 105.1 Ų | 105.1 | 57% | 0.566 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -67.6 | -36.6 | 174.6 | -73.5 | 170.3 | 179.7 | -171 | 0.5 | 112 | L256 G257 P258 R264 | L256-R260 WeakPolarHBondContact O-CB 3.47Å; L256-R260 WeakPolarHBondContact O-CG 3.46Å; L256-R260 PolarHBondContact O-N 3.29Å; G257-R260 WeakPolarHBondContact O-CB 3.49Å; G257-R260 PolarHBondContact O-N 2.88Å; G257-R260 VanDerWaalsContact O-N 3.09Å; P258-R260 VanDerWaalsContact C-N 3.31Å; P258-R260 PolarHBondContact O-N 3.5Å; R260-R264 WeakPolarHBondContact O-CG 3.48Å; R260-R264 PolarHBondContact O-N 3.47Å; R260-R264 VanDerWaalsContact O-N 3.11Å |
| 261 | E | 98.1 | Very high | 97.7 | Very high | 116 Ų | 116 | 102.2 Ų | 102.2 | 54% | 0.542 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.9 | -40.2 | 175.1 | -68.5 | 172.5 | -170.7 | 0 | 0 | 111.3 | G257 P258 R264 R265 | G257-E261 PolarHBondContact O-N 3.3Å; G257-E261 VanDerWaalsContact O-N 3.12Å; P258-E261 WeakPolarHBondContact O-CB 3.37Å; P258-E261 PolarHBondContact O-N 3.44Å; P258-E261 VanDerWaalsContact O-N 3.1Å; E261-R264 PolarHBondContact O-N 3.43Å; E261-R265 WeakPolarHBondContact O-CB 3.48Å; E261-R265 PolarHBondContact O-N 3Å |
| 262 | D | 97.8 | Very high | 97.7 | Very high | 61 Ų | 61 | 100.2 Ų | 100.2 | 33% | 0.326 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.9 | -45 | 175.1 | -69.7 | -2.8 | 0 | 0 | 0 | 111.9 | P258 L259 R264 R265 L266 | P258-D262 VanDerWaalsContact O-CG 3.25Å; P258-D262 PolarHBondContact O-N 3.01Å; L259-D262 PolarHBondContact O-N 3.16Å; D262-R264 PolarHBondContact O-N 2.9Å; D262-R265 PolarHBondContact O-N 3.29Å; D262-R265 IonicContact OD1-CZ 3.79Å; D262-R265 IonicContact OD1-NH1 2.63Å; D262-R265 PolarHBondContact OD1-NH1 3.02Å; D262-R265 IonicContact OD1-NH2 3.69Å; D262-R265 PolarHBondContact OD1-NH2 3.28Å; D262-R265 IonicContact OD2-NH2 3.14Å; D262-L266 WeakPolarHBondContact O-CB 3.45Å; D262-L266 VanDerWaalsContact O-CG 3.31Å; D262-L266 WeakPolarHBondContact O-CG 3.26Å; D262-L266 PolarHBondContact O-N 3.38Å |
| 263 | I | 98 | Very high | 97.8 | Very high | 83 Ų | 83 | 99.5 Ų | 99.5 | 43% | 0.426 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -57.4 | -50.7 | 174.3 | -70.4 | 164.5 | 0 | 0 | 0 | 110.4 | L259 R265 L266 E267 | L259-I263 HydrophobicContact CG-CD1 4.43Å; L259-I263 VanDerWaalsContact O-CG1 3.26Å; L259-I263 WeakPolarHBondContact O-CG1 3.35Å; L259-I263 PolarHBondContact O-N 3.34Å; I263-R265 VanDerWaalsContact C-N 3.32Å; I263-R265 PolarHBondContact O-N 3.01Å; I263-L266 PolarHBondContact O-N 3.14Å; I263-E267 HydrophobicContact CG2-CG 4.4Å; I263-E267 VanDerWaalsContact O-CG 3.31Å; I263-E267 WeakPolarHBondContact O-CG 3.39Å; I263-E267 PolarHBondContact O-N 2.86Å |
| 264 | R | 98 | Very high | 97.8 | Very high | 156 Ų | 156 | 94.4 Ų | 94.4 | 59% | 0.589 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -60.4 | -41 | 179.1 | -70.7 | 171.5 | -174.3 | 158.3 | -0.5 | 112.3 | R260 E261 D262 E267 V268 | R260-R264 WeakPolarHBondContact O-CG 3.48Å; R260-R264 PolarHBondContact O-N 3.47Å; R260-R264 VanDerWaalsContact O-N 3.11Å; E261-R264 PolarHBondContact O-N 3.43Å; D262-R264 PolarHBondContact O-N 2.9Å; R264-E267 PolarHBondContact O-N 3.42Å; R264-V268 WeakPolarHBondContact O-CG2 3.42Å; R264-V268 PolarHBondContact O-N 2.91Å; R264-V268 VanDerWaalsContact O-N 3.08Å |
| 265 | R | 98.5 | Very high | 97.9 | Very high | 120 Ų | 120 | 97.7 Ų | 97.7 | 45% | 0.453 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.7 | -45.2 | 177.5 | -178.3 | 175.9 | 61.8 | -104.7 | 2.4 | 111.4 | E261 D262 I263 V268 Q269 | E261-R265 WeakPolarHBondContact O-CB 3.48Å; E261-R265 PolarHBondContact O-N 3Å; D262-R265 PolarHBondContact O-N 3.29Å; D262-R265 IonicContact OD1-CZ 3.79Å; D262-R265 IonicContact OD1-NH1 2.63Å; D262-R265 PolarHBondContact OD1-NH1 3.02Å; D262-R265 IonicContact OD1-NH2 3.69Å; D262-R265 PolarHBondContact OD1-NH2 3.28Å; D262-R265 IonicContact OD2-NH2 3.14Å; I263-R265 VanDerWaalsContact C-N 3.32Å; I263-R265 PolarHBondContact O-N 3.01Å; R265-V268 PolarHBondContact O-N 2.95Å; R265-Q269 WeakPolarHBondContact O-CG 3.41Å; R265-Q269 PolarHBondContact O-N 3.04Å |
| 266 | L | 98.4 | Very high | 98 | Very high | 100 Ų | 100 | 102.3 Ų | 102.3 | 52% | 0.524 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.1 | -38.4 | 177.3 | -72.2 | 172 | 0 | 0 | 0 | 111.9 | D262 I263 Q269 R270 | D262-L266 WeakPolarHBondContact O-CB 3.45Å; D262-L266 VanDerWaalsContact O-CG 3.31Å; D262-L266 WeakPolarHBondContact O-CG 3.26Å; D262-L266 PolarHBondContact O-N 3.38Å; I263-L266 PolarHBondContact O-N 3.14Å; L266-Q269 PolarHBondContact O-N 2.93Å; L266-R270 VanDerWaalsContact O-CB 3.29Å; L266-R270 WeakPolarHBondContact O-CB 3.48Å; L266-R270 PolarHBondContact O-N 3.49Å |
| 267 | E | 98.4 | Very high | 98.1 | Very high | 120 Ų | 120 | 102.3 Ų | 102.3 | 56% | 0.561 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.4 | -45.7 | 174.6 | -75.6 | 171.2 | 169.4 | 0 | 0 | 111.8 | I263 R264 R270 S271 | I263-E267 HydrophobicContact CG2-CG 4.4Å; I263-E267 VanDerWaalsContact O-CG 3.31Å; I263-E267 WeakPolarHBondContact O-CG 3.39Å; I263-E267 PolarHBondContact O-N 2.86Å; R264-E267 PolarHBondContact O-N 3.42Å; E267-R270 PolarHBondContact O-N 2.99Å; E267-S271 PolarHBondContact O-N 3.31Å |
| 268 | V | 98.3 | Very high | 98.2 | Very high | 89 Ų | 89 | 105 Ų | 105 | 54% | 0.539 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.9 | -48.7 | 175.5 | 173.6 | 0 | 0 | 0 | 0 | 110.4 | R264 R265 R270 S271 C272 | R264-V268 WeakPolarHBondContact O-CG2 3.42Å; R264-V268 PolarHBondContact O-N 2.91Å; R264-V268 VanDerWaalsContact O-N 3.08Å; R265-V268 PolarHBondContact O-N 2.95Å; V268-R270 VanDerWaalsContact C-N 3.35Å; V268-R270 PolarHBondContact O-N 3.36Å; V268-S271 PolarHBondContact O-N 3.41Å; V268-S271 VanDerWaalsContact O-N 3.15Å; V268-S271 PolarHBondContact O-OG 3.13Å; V268-C272 PolarHBondContact O-N 3.39Å; V268-C272 PolarHBondContact O-SG 3.27Å; V268-C272 VanDerWaalsContact O-SG 3.35Å |
| 269 | Q | 98.2 | Very high | 98.2 | Very high | 101 Ų | 101 | 106.7 Ų | 106.7 | 47% | 0.472 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58 | -45.4 | 177.5 | -74.7 | 179.6 | -16.9 | 0 | 0 | 112.2 | R265 L266 S271 C272 L273 | R265-Q269 WeakPolarHBondContact O-CG 3.41Å; R265-Q269 PolarHBondContact O-N 3.04Å; L266-Q269 PolarHBondContact O-N 2.93Å; Q269-S271 VanDerWaalsContact C-N 3.34Å; Q269-S271 PolarHBondContact O-N 2.99Å; Q269-C272 PolarHBondContact O-N 2.98Å; Q269-L273 WeakPolarHBondContact O-CG 3.49Å; Q269-L273 PolarHBondContact O-N 3.19Å |
| 270 | R | 98 | Very high | 98.2 | Very high | 176 Ų | 176 | 105.4 Ų | 105.4 | 66% | 0.664 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -57.7 | -46.7 | 175.3 | -178.5 | 178.8 | -178 | -102.5 | -0.8 | 111 | L266 E267 V268 C272 L273 L274 | L266-R270 VanDerWaalsContact O-CB 3.29Å; L266-R270 WeakPolarHBondContact O-CB 3.48Å; L266-R270 PolarHBondContact O-N 3.49Å; E267-R270 PolarHBondContact O-N 2.99Å; V268-R270 VanDerWaalsContact C-N 3.35Å; V268-R270 PolarHBondContact O-N 3.36Å; R270-C272 VanDerWaalsContact C-N 3.34Å; R270-C272 PolarHBondContact O-N 2.77Å; R270-L273 PolarHBondContact O-N 2.97Å; R270-L274 HydrophobicContact CG-CD1 4.01Å; R270-L274 HydrophobicContact CG-CG 4.47Å; R270-L274 WeakPolarHBondContact O-CB 3.28Å; R270-L274 VanDerWaalsContact O-CG 3.27Å; R270-L274 WeakPolarHBondContact O-CG 3.34Å; R270-L274 PolarHBondContact O-N 3.38Å |
| 271 | S | 98.2 | Very high | 98.3 | Very high | 51 Ų | 51 | 102.2 Ų | 102.2 | 36% | 0.357 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63 | -39 | 179 | 79.8 | 0 | 0 | 0 | 0 | 112.6 | E267 V268 Q269 K275 | E267-S271 PolarHBondContact O-N 3.31Å; V268-S271 PolarHBondContact O-N 3.41Å; V268-S271 VanDerWaalsContact O-N 3.15Å; V268-S271 PolarHBondContact O-OG 3.13Å; Q269-S271 VanDerWaalsContact C-N 3.34Å; Q269-S271 PolarHBondContact O-N 2.99Å; S271-K275 WeakPolarHBondContact O-CG 3.47Å; S271-K275 PolarHBondContact O-N 2.74Å |
| 272 | C | 98.1 | Very high | 98.3 | Very high | 71 Ų | 71 | 100.6 Ų | 100.6 | 48% | 0.48 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -66.7 | -44.1 | 176.6 | -69.3 | 0 | 0 | 0 | 0 | 111.7 | V268 Q269 R270 K275 R276 | V268-C272 PolarHBondContact O-N 3.39Å; V268-C272 PolarHBondContact O-SG 3.27Å; V268-C272 VanDerWaalsContact O-SG 3.35Å; Q269-C272 PolarHBondContact O-N 2.98Å; R270-C272 VanDerWaalsContact C-N 3.34Å; R270-C272 PolarHBondContact O-N 2.77Å; C272-K275 PolarHBondContact O-N 2.96Å; C272-R276 PolarHBondContact O-N 3.22Å |
| 273 | L | 98.6 | Very high | 98.3 | Very high | 100 Ų | 100 | 101.6 Ų | 101.6 | 52% | 0.524 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.6 | -42.4 | 177.4 | -70.8 | 174.2 | 0 | 0 | 0 | 111.7 | Q269 R270 K275 R276 I277 | Q269-L273 WeakPolarHBondContact O-CG 3.49Å; Q269-L273 PolarHBondContact O-N 3.19Å; R270-L273 PolarHBondContact O-N 2.97Å; L273-K275 PolarHBondContact O-N 2.86Å; L273-R276 PolarHBondContact O-N 2.93Å; L273-R276 VanDerWaalsContact O-N 3.16Å; L273-I277 WeakPolarHBondContact O-CG1 3.46Å; L273-I277 PolarHBondContact O-N 2.91Å |
| 274 | L | 98.5 | Very high | 98.3 | Very high | 77 Ų | 77 | 105.3 Ų | 105.3 | 40% | 0.403 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.1 | -45 | 175.4 | -74.5 | 170.9 | 0 | 0 | 0 | 111.8 | R270 R276 I277 N278 | R270-L274 HydrophobicContact CG-CD1 4.01Å; R270-L274 HydrophobicContact CG-CG 4.47Å; R270-L274 WeakPolarHBondContact O-CB 3.28Å; R270-L274 VanDerWaalsContact O-CG 3.27Å; R270-L274 WeakPolarHBondContact O-CG 3.34Å; R270-L274 PolarHBondContact O-N 3.38Å; L274-R276 VanDerWaalsContact C-N 3.31Å; L274-R276 PolarHBondContact O-N 3.32Å; L274-I277 PolarHBondContact O-N 3.37Å; L274-N278 PolarHBondContact O-N 3.49Å |
| 275 | K | 98.3 | Very high | 98.3 | Very high | 140 Ų | 140 | 104.4 Ų | 104.4 | 61% | 0.609 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -59.2 | -42.9 | 174.1 | -73.5 | 173.2 | -177.6 | 178.1 | 0 | 111.5 | S271 C272 L273 N278 L279 | S271-K275 WeakPolarHBondContact O-CG 3.47Å; S271-K275 PolarHBondContact O-N 2.74Å; C272-K275 PolarHBondContact O-N 2.96Å; L273-K275 PolarHBondContact O-N 2.86Å; K275-N278 PolarHBondContact O-N 2.91Å; K275-L279 WeakPolarHBondContact O-CG 3.25Å; K275-L279 PolarHBondContact O-N 3.35Å |
| 276 | R | 98.1 | Very high | 98.3 | Very high | 162 Ų | 162 | 104.1 Ų | 104.1 | 61% | 0.611 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.2 | -41.9 | 178.2 | -169.7 | 166 | 97.5 | 140 | 1.2 | 112.5 | C272 L273 L274 L279 M280 | C272-R276 PolarHBondContact O-N 3.22Å; L273-R276 PolarHBondContact O-N 2.93Å; L273-R276 VanDerWaalsContact O-N 3.16Å; L274-R276 VanDerWaalsContact C-N 3.31Å; L274-R276 PolarHBondContact O-N 3.32Å; R276-L279 PolarHBondContact O-N 3.31Å; R276-M280 WeakPolarHBondContact O-CG 3.49Å; R276-M280 PolarHBondContact O-N 2.92Å |
| 277 | I | 98.3 | Very high | 98.3 | Very high | 77 Ų | 77 | 106.5 Ų | 106.5 | 40% | 0.395 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.9 | -48.4 | 175.8 | -69.4 | 167.1 | 0 | 0 | 0 | 110.1 | L273 L274 L279 M280 E281 | L273-I277 WeakPolarHBondContact O-CG1 3.46Å; L273-I277 PolarHBondContact O-N 2.91Å; L274-I277 PolarHBondContact O-N 3.37Å; I277-L279 VanDerWaalsContact C-N 3.31Å; I277-L279 PolarHBondContact O-N 3.39Å; I277-M280 HydrophobicContact CG1-CE 4.31Å; I277-M280 PolarHBondContact O-N 2.9Å; I277-M280 VanDerWaalsContact O-N 3.14Å; I277-E281 HydrophobicContact CG2-CG 4.33Å; I277-E281 WeakPolarHBondContact CG2-OE1 3.29Å; I277-E281 WeakPolarHBondContact O-CG 3.27Å; I277-E281 PolarHBondContact O-N 3.41Å |
| 278 | N | 98.4 | Very high | 98.3 | Very high | 87 Ų | 87 | 105.2 Ų | 105.2 | 47% | 0.465 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -58.1 | -42.5 | 178 | -73.2 | -15.5 | 0 | 0 | 0 | 112.3 | L274 K275 E281 I282 | L274-N278 PolarHBondContact O-N 3.49Å; K275-N278 PolarHBondContact O-N 2.91Å; N278-E281 PolarHBondContact O-N 2.91Å; N278-I282 VanDerWaalsContact O-CG1 3.28Å; N278-I282 WeakPolarHBondContact O-CG1 3.33Å; N278-I282 PolarHBondContact O-N 2.9Å |
| 279 | L | 98.7 | Very high | 98.3 | Very high | 106 Ų | 106 | 103.1 Ų | 103.1 | 56% | 0.555 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61.9 | -47.5 | 175.4 | -71.4 | 173 | 0 | 0 | 0 | 111.6 | K275 R276 I277 E281 I282 E283 | K275-L279 WeakPolarHBondContact O-CG 3.25Å; K275-L279 PolarHBondContact O-N 3.35Å; R276-L279 PolarHBondContact O-N 3.31Å; I277-L279 VanDerWaalsContact C-N 3.31Å; I277-L279 PolarHBondContact O-N 3.39Å; L279-E281 VanDerWaalsContact C-N 3.26Å; L279-E281 PolarHBondContact O-N 3.32Å; L279-I282 PolarHBondContact O-N 2.9Å; L279-E283 WeakPolarHBondContact O-CG 3.5Å; L279-E283 PolarHBondContact O-N 3.03Å |
| 280 | M | 98.4 | Very high | 98.3 | Very high | 70 Ų | 70 | 104.3 Ų | 104.3 | 35% | 0.345 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.7 | -34.7 | 176.6 | -70.5 | -169.7 | -58.2 | 0 | 0 | 112.5 | R276 I277 R284 | R276-M280 WeakPolarHBondContact O-CG 3.49Å; R276-M280 PolarHBondContact O-N 2.92Å; I277-M280 HydrophobicContact CG1-CE 4.31Å; I277-M280 PolarHBondContact O-N 2.9Å; I277-M280 VanDerWaalsContact O-N 3.14Å; M280-R284 WeakPolarHBondContact O-CB 3.48Å; M280-R284 VanDerWaalsContact O-CG 3.22Å; M280-R284 WeakPolarHBondContact O-CG 3.32Å; M280-R284 PolarHBondContact O-N 3.35Å |
| 281 | E | 98.4 | Very high | 98.3 | Very high | 84 Ų | 84 | 102 Ų | 102 | 39% | 0.393 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -67.8 | -41.9 | 175.1 | -74.8 | 179 | -174.5 | 0 | 0 | 112.2 | I277 N278 L279 R284 K285 | I277-E281 HydrophobicContact CG2-CG 4.33Å; I277-E281 WeakPolarHBondContact CG2-OE1 3.29Å; I277-E281 WeakPolarHBondContact O-CG 3.27Å; I277-E281 PolarHBondContact O-N 3.41Å; N278-E281 PolarHBondContact O-N 2.91Å; L279-E281 VanDerWaalsContact C-N 3.26Å; L279-E281 PolarHBondContact O-N 3.32Å; E281-R284 PolarHBondContact O-N 3.18Å; E281-K285 VanDerWaalsContact O-CG 3.28Å; E281-K285 WeakPolarHBondContact O-CG 3.47Å; E281-K285 PolarHBondContact O-N 3.14Å |
| 282 | I | 98.3 | Very high | 98.3 | Very high | 82 Ų | 82 | 105.6 Ų | 105.6 | 42% | 0.421 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.4 | -50.9 | 174.9 | -68.2 | 164.1 | 0 | 0 | 0 | 109.7 | N278 L279 R284 K285 E286 | N278-I282 VanDerWaalsContact O-CG1 3.28Å; N278-I282 WeakPolarHBondContact O-CG1 3.33Å; N278-I282 PolarHBondContact O-N 2.9Å; L279-I282 PolarHBondContact O-N 2.9Å; I282-R284 VanDerWaalsContact C-N 3.28Å; I282-R284 PolarHBondContact O-N 3.47Å; I282-K285 WeakPolarHBondContact O-CB 3.29Å; I282-K285 PolarHBondContact O-N 2.92Å; I282-E286 HydrophobicContact CG2-CG 4.39Å; I282-E286 WeakPolarHBondContact CG2-OE1 3.45Å; I282-E286 WeakPolarHBondContact O-CG 3.35Å; I282-E286 PolarHBondContact O-N 3.37Å |
| 283 | E | 98.3 | Very high | 98.3 | Very high | 81 Ų | 81 | 107.8 Ų | 107.8 | 38% | 0.379 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.5 | -39.6 | 177.8 | -72.1 | 177.7 | -166.2 | 0 | 0 | 112.2 | L279 E286 R287 | L279-E283 WeakPolarHBondContact O-CG 3.5Å; L279-E283 PolarHBondContact O-N 3.03Å; E283-E286 PolarHBondContact O-N 2.83Å; E283-R287 WeakPolarHBondContact O-CB 3.39Å; E283-R287 WeakPolarHBondContact O-CG 3.37Å; E283-R287 PolarHBondContact O-N 3.38Å; E283-R287 IonicContact OE2-CZ 2.77Å; E283-R287 IonicContact OE2-NH1 3.49Å; E283-R287 PolarHBondContact OE2-NH1 2.91Å; E283-R287 IonicContact OE2-NH2 3.6Å; E283-R287 PolarHBondContact OE2-NH2 2.94Å |
| 284 | R | 98.1 | Very high | 98.2 | Very high | 162 Ų | 162 | 106.8 Ų | 106.8 | 61% | 0.611 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.3 | -45.3 | 175 | -80.4 | 174.7 | 180 | 171.5 | 0.6 | 111.2 | M280 E281 I282 E286 R287 T288 | M280-R284 WeakPolarHBondContact O-CB 3.48Å; M280-R284 VanDerWaalsContact O-CG 3.22Å; M280-R284 WeakPolarHBondContact O-CG 3.32Å; M280-R284 PolarHBondContact O-N 3.35Å; E281-R284 PolarHBondContact O-N 3.18Å; I282-R284 VanDerWaalsContact C-N 3.28Å; I282-R284 PolarHBondContact O-N 3.47Å; R284-E286 VanDerWaalsContact C-N 3.34Å; R284-E286 PolarHBondContact O-N 2.89Å; R284-R287 PolarHBondContact O-N 3.49Å; R284-T288 WeakPolarHBondContact O-CG2 3.4Å; R284-T288 PolarHBondContact O-N 3.47Å; R284-T288 PolarHBondContact O-OG1 2.69Å |
| 285 | K | 98.3 | Very high | 98.2 | Very high | 137 Ų | 137 | 105.6 Ų | 105.6 | 60% | 0.596 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.1 | -45.3 | 177.4 | -73.4 | 168.5 | -176.7 | 171.6 | 0 | 111.2 | E281 I282 T288 A289 | E281-K285 VanDerWaalsContact O-CG 3.28Å; E281-K285 WeakPolarHBondContact O-CG 3.47Å; E281-K285 PolarHBondContact O-N 3.14Å; I282-K285 WeakPolarHBondContact O-CB 3.29Å; I282-K285 PolarHBondContact O-N 2.92Å; K285-T288 WeakPolarHBondContact CA-OG1 3.45Å; K285-T288 PolarHBondContact O-N 2.91Å; K285-T288 PolarHBondContact O-OG1 3.38Å; K285-A289 WeakPolarHBondContact O-CB 3.26Å; K285-A289 PolarHBondContact O-N 3.12Å |
| 286 | E | 98.4 | Very high | 98.2 | Very high | 113 Ų | 113 | 102.9 Ų | 102.9 | 53% | 0.528 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.6 | -47.3 | 176.6 | -71.2 | 172.1 | 177.7 | 0 | 0 | 111.8 | I282 E283 R284 T288 A289 H290 | I282-E286 HydrophobicContact CG2-CG 4.39Å; I282-E286 WeakPolarHBondContact CG2-OE1 3.45Å; I282-E286 WeakPolarHBondContact O-CG 3.35Å; I282-E286 PolarHBondContact O-N 3.37Å; E283-E286 PolarHBondContact O-N 2.83Å; R284-E286 VanDerWaalsContact C-N 3.34Å; R284-E286 PolarHBondContact O-N 2.89Å; E286-T288 VanDerWaalsContact C-N 3.31Å; E286-T288 PolarHBondContact O-N 3.36Å; E286-A289 PolarHBondContact O-N 3.4Å; E286-A289 VanDerWaalsContact O-N 3.14Å; E286-H290 PolarHBondContact O-N 2.84Å |
| 287 | R | 98.2 | Very high | 98.2 | Very high | 150 Ų | 150 | 96.6 Ų | 96.6 | 57% | 0.566 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -59.1 | -41.9 | 175.4 | -72.5 | 174.2 | -167.1 | 124.6 | 6 | 112 | E283 R284 A289 H291 | E283-R287 WeakPolarHBondContact O-CB 3.39Å; E283-R287 WeakPolarHBondContact O-CG 3.37Å; E283-R287 PolarHBondContact O-N 3.38Å; E283-R287 IonicContact OE2-CZ 2.77Å; E283-R287 IonicContact OE2-NH1 3.49Å; E283-R287 PolarHBondContact OE2-NH1 2.91Å; E283-R287 IonicContact OE2-NH2 3.6Å; E283-R287 PolarHBondContact OE2-NH2 2.94Å; R284-R287 PolarHBondContact O-N 3.49Å; R287-A289 VanDerWaalsContact C-N 3.35Å; R287-H291 WeakPolarHBondContact O-CB 3.44Å; R287-H291 PolarHBondContact O-N 3.17Å |
| 288 | T | 98.2 | Very high | 98.2 | Very high | 94 Ų | 94 | 98.6 Ų | 98.6 | 58% | 0.577 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -67.3 | -35.6 | 176.5 | 54.7 | 0 | 0 | 0 | 0 | 112.5 | R284 K285 E286 K292 | R284-T288 WeakPolarHBondContact O-CG2 3.4Å; R284-T288 PolarHBondContact O-N 3.47Å; R284-T288 PolarHBondContact O-OG1 2.69Å; K285-T288 WeakPolarHBondContact CA-OG1 3.45Å; K285-T288 PolarHBondContact O-N 2.91Å; K285-T288 PolarHBondContact O-OG1 3.38Å; E286-T288 VanDerWaalsContact C-N 3.31Å; E286-T288 PolarHBondContact O-N 3.36Å; T288-K292 WeakPolarHBondContact O-CB 3.4Å; T288-K292 PolarHBondContact O-N 2.89Å |
| 289 | A | 97.9 | Very high | 98.2 | Very high | 44 Ų | 44 | 98.6 Ų | 98.6 | 36% | 0.364 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -67.7 | -49.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | K285 E286 R287 H291 K292 E293 | K285-A289 WeakPolarHBondContact O-CB 3.26Å; K285-A289 PolarHBondContact O-N 3.12Å; E286-A289 PolarHBondContact O-N 3.4Å; E286-A289 VanDerWaalsContact O-N 3.14Å; R287-A289 VanDerWaalsContact C-N 3.35Å; A289-H291 VanDerWaalsContact C-N 3.33Å; A289-H291 PolarHBondContact O-N 3.47Å; A289-K292 WeakPolarHBondContact O-CB 3.36Å; A289-K292 PolarHBondContact O-N 3.47Å; A289-K292 VanDerWaalsContact O-N 3.12Å; A289-E293 WeakPolarHBondContact O-CG 3.47Å; A289-E293 PolarHBondContact O-N 3.2Å |
| 290 | H | 97.9 | Very high | 98.1 | Very high | 127 Ų | 127 | 98.8 Ų | 98.8 | 59% | 0.588 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -56.2 | -46.5 | 173.8 | -99.9 | 55.7 | 0 | 0 | 0 | 111.8 | E286 K292 E293 T294 | E286-H290 PolarHBondContact O-N 2.84Å; H290-K292 VanDerWaalsContact C-N 3.31Å; H290-K292 PolarHBondContact O-N 3.44Å; H290-E293 PolarHBondContact O-N 3.41Å; H290-T294 WeakPolarHBondContact O-CG2 3.35Å; H290-T294 PolarHBondContact O-N 2.87Å; H290-T294 PolarHBondContact O-OG1 2.91Å |
| 291 | H | 98.2 | Very high | 98.1 | Very high | 126 Ų | 126 | 99 Ų | 99 | 58% | 0.583 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -60.6 | -43.6 | 177.7 | -178 | 57.4 | 0 | 0 | 0 | 111.4 | R287 A289 E293 T294 V295 | R287-H291 WeakPolarHBondContact O-CB 3.44Å; R287-H291 PolarHBondContact O-N 3.17Å; A289-H291 VanDerWaalsContact C-N 3.33Å; A289-H291 PolarHBondContact O-N 3.47Å; H291-E293 PolarHBondContact O-N 2.85Å; H291-T294 WeakPolarHBondContact CA-OG1 3.32Å; H291-T294 PolarHBondContact O-N 3.34Å; H291-T294 PolarHBondContact O-OG1 3.41Å; H291-V295 WeakPolarHBondContact O-CG2 3.42Å; H291-V295 PolarHBondContact O-N 3.45Å |
| 292 | K | 98.3 | Very high | 98 | Very high | 128 Ų | 128 | 99.4 Ų | 99.4 | 56% | 0.557 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -59.6 | -47.2 | 176 | -177.4 | -179.8 | 168.4 | -174.6 | 0 | 111.8 | T288 A289 H290 T294 V295 E296 | T288-K292 WeakPolarHBondContact O-CB 3.4Å; T288-K292 PolarHBondContact O-N 2.89Å; A289-K292 WeakPolarHBondContact O-CB 3.36Å; A289-K292 PolarHBondContact O-N 3.47Å; A289-K292 VanDerWaalsContact O-N 3.12Å; H290-K292 VanDerWaalsContact C-N 3.31Å; H290-K292 PolarHBondContact O-N 3.44Å; K292-T294 PolarHBondContact O-N 2.74Å; K292-V295 PolarHBondContact O-N 3.31Å; K292-E296 WeakPolarHBondContact CE-OE1 3.29Å; K292-E296 IonicContact NZ-OE1 3.05Å; K292-E296 WeakPolarHBondContact O-CG 3.45Å; K292-E296 PolarHBondContact O-N 2.98Å |
| 293 | E | 98.1 | Very high | 98 | Very high | 116 Ų | 116 | 102 Ų | 102 | 54% | 0.542 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60 | -43.5 | 176.9 | -71.8 | 168.5 | -170.5 | 0 | 0 | 111.7 | A289 H290 H291 V295 E296 G297 | A289-E293 WeakPolarHBondContact O-CG 3.47Å; A289-E293 PolarHBondContact O-N 3.2Å; H290-E293 PolarHBondContact O-N 3.41Å; H291-E293 PolarHBondContact O-N 2.85Å; E293-V295 VanDerWaalsContact C-N 3.32Å; E293-V295 PolarHBondContact O-N 2.86Å; E293-E296 PolarHBondContact O-N 2.92Å; E293-G297 PolarHBondContact O-N 3.02Å |
| 294 | T | 98.1 | Very high | 98 | Very high | 79 Ų | 79 | 103.7 Ų | 103.7 | 49% | 0.485 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.1 | -39 | 176.6 | 58.6 | 0 | 0 | 0 | 0 | 112.3 | H290 H291 K292 L298 | H290-T294 WeakPolarHBondContact O-CG2 3.35Å; H290-T294 PolarHBondContact O-N 2.87Å; H290-T294 PolarHBondContact O-OG1 2.91Å; H291-T294 WeakPolarHBondContact CA-OG1 3.32Å; H291-T294 PolarHBondContact O-N 3.34Å; H291-T294 PolarHBondContact O-OG1 3.41Å; K292-T294 PolarHBondContact O-N 2.74Å; T294-L298 WeakPolarHBondContact O-CB 3.38Å; T294-L298 VanDerWaalsContact O-CG 3.28Å; T294-L298 WeakPolarHBondContact O-CG 3.33Å; T294-L298 PolarHBondContact O-N 3.36Å |
| 295 | V | 98.1 | Very high | 98 | Very high | 53 Ų | 53 | 101.5 Ų | 101.5 | 32% | 0.321 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.6 | -41.9 | 176.6 | 170.7 | 0 | 0 | 0 | 0 | 110.6 | H291 K292 E293 L298 Q299 | H291-V295 WeakPolarHBondContact O-CG2 3.42Å; H291-V295 PolarHBondContact O-N 3.45Å; K292-V295 PolarHBondContact O-N 3.31Å; E293-V295 VanDerWaalsContact C-N 3.32Å; E293-V295 PolarHBondContact O-N 2.86Å; V295-L298 PolarHBondContact O-N 2.84Å; V295-Q299 VanDerWaalsContact O-CG 3.27Å; V295-Q299 WeakPolarHBondContact O-CG 3.28Å; V295-Q299 PolarHBondContact O-N 3.24Å |
| 296 | E | 97.7 | Very high | 97.9 | Very high | 83 Ų | 83 | 101 Ų | 101 | 39% | 0.388 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.7 | -46.1 | 176.1 | -74 | 172.9 | 172.4 | 0 | 0 | 111.3 | K292 E293 L298 Q299 E300 | K292-E296 WeakPolarHBondContact CE-OE1 3.29Å; K292-E296 IonicContact NZ-OE1 3.05Å; K292-E296 WeakPolarHBondContact O-CG 3.45Å; K292-E296 PolarHBondContact O-N 2.98Å; E293-E296 PolarHBondContact O-N 2.92Å; E296-L298 PolarHBondContact O-N 3.29Å; E296-Q299 WeakPolarHBondContact O-CB 3.45Å; E296-Q299 PolarHBondContact O-N 2.91Å; E296-Q299 VanDerWaalsContact O-N 3.12Å; E296-E300 WeakPolarHBondContact O-CG 3.48Å; E296-E300 PolarHBondContact O-N 3.05Å |
| 297 | G | 98.1 | Very high | 97.9 | Very high | 29 Ų | 29 | 100.9 Ų | 100.9 | 30% | 0.299 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63 | -38.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | E293 Q299 E300 T301 | E293-G297 PolarHBondContact O-N 3.02Å; G297-Q299 VanDerWaalsContact C-N 3.33Å; G297-Q299 PolarHBondContact O-N 3.09Å; G297-E300 PolarHBondContact O-N 2.87Å; G297-T301 WeakPolarHBondContact O-CG2 3.29Å; G297-T301 PolarHBondContact O-N 3.49Å; G297-T301 PolarHBondContact O-OG1 2.84Å |
| 298 | L | 98 | Very high | 97.9 | Very high | 119 Ų | 119 | 98.8 Ų | 98.8 | 62% | 0.623 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -66.7 | -34.6 | 173.1 | -72.2 | 175.2 | 0 | 0 | 0 | 112.3 | T294 V295 E296 T301 L302 | T294-L298 WeakPolarHBondContact O-CB 3.38Å; T294-L298 VanDerWaalsContact O-CG 3.28Å; T294-L298 WeakPolarHBondContact O-CG 3.33Å; T294-L298 PolarHBondContact O-N 3.36Å; V295-L298 PolarHBondContact O-N 2.84Å; E296-L298 PolarHBondContact O-N 3.29Å; L298-T301 WeakPolarHBondContact CA-OG1 3.38Å; L298-T301 PolarHBondContact O-OG1 3.11Å; L298-L302 VanDerWaalsContact O-CB 3.26Å; L298-L302 WeakPolarHBondContact O-CB 3.4Å; L298-L302 PolarHBondContact O-N 3Å |
| 299 | Q | 97.9 | Very high | 97.8 | Very high | 88 Ų | 88 | 99.9 Ų | 99.9 | 41% | 0.411 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -68.3 | -37 | 173.8 | -72.5 | 175 | 9.9 | 0 | 0 | 111.9 | V295 E296 G297 R303 | V295-Q299 VanDerWaalsContact O-CG 3.27Å; V295-Q299 WeakPolarHBondContact O-CG 3.28Å; V295-Q299 PolarHBondContact O-N 3.24Å; E296-Q299 WeakPolarHBondContact O-CB 3.45Å; E296-Q299 PolarHBondContact O-N 2.91Å; E296-Q299 VanDerWaalsContact O-N 3.12Å; G297-Q299 VanDerWaalsContact C-N 3.33Å; G297-Q299 PolarHBondContact O-N 3.09Å; Q299-R303 VanDerWaalsContact O-CG 3.29Å; Q299-R303 WeakPolarHBondContact O-CG 3.37Å; Q299-R303 PolarHBondContact O-N 3.31Å |
| 300 | E | 97.9 | Very high | 97.8 | Very high | 110 Ų | 110 | 102.1 Ų | 102.1 | 51% | 0.514 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64 | -51.3 | 175.2 | -72.7 | 173 | 178.2 | 0 | 0 | 111.5 | E296 G297 L302 R303 E304 | E296-E300 WeakPolarHBondContact O-CG 3.48Å; E296-E300 PolarHBondContact O-N 3.05Å; G297-E300 PolarHBondContact O-N 2.87Å; E300-L302 VanDerWaalsContact C-N 3.26Å; E300-L302 PolarHBondContact O-N 3.41Å; E300-R303 WeakPolarHBondContact O-CA 3.13Å; E300-R303 WeakPolarHBondContact O-CB 3.39Å; E300-R303 PolarHBondContact O-N 3.12Å; E300-E304 WeakPolarHBondContact O-CG 3.46Å; E300-E304 PolarHBondContact O-N 2.75Å |
| 301 | T | 97.7 | Very high | 97.7 | Very high | 75 Ų | 75 | 100.8 Ų | 100.8 | 46% | 0.46 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.8 | -36.2 | 176.2 | 53.4 | 0 | 0 | 0 | 0 | 112.5 | G297 L298 E304 L305 | G297-T301 WeakPolarHBondContact O-CG2 3.29Å; G297-T301 PolarHBondContact O-N 3.49Å; G297-T301 PolarHBondContact O-OG1 2.84Å; L298-T301 WeakPolarHBondContact CA-OG1 3.38Å; L298-T301 PolarHBondContact O-OG1 3.11Å; T301-E304 PolarHBondContact O-N 2.91Å; T301-L305 WeakPolarHBondContact O-CB 3.4Å; T301-L305 PolarHBondContact O-N 3.4Å |
| 302 | L | 97.3 | Very high | 97.7 | Very high | 91 Ų | 91 | 100.9 Ų | 100.9 | 48% | 0.476 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -67 | -34.7 | 173 | -179.5 | 147.7 | 0 | 0 | 0 | 112.8 | L298 E300 K306 | L298-L302 VanDerWaalsContact O-CB 3.26Å; L298-L302 WeakPolarHBondContact O-CB 3.4Å; L298-L302 PolarHBondContact O-N 3Å; E300-L302 VanDerWaalsContact C-N 3.26Å; E300-L302 PolarHBondContact O-N 3.41Å; L302-K306 HydrophobicContact CD2-CD 3.87Å; L302-K306 VanDerWaalsContact CD2-CE 3.4Å; L302-K306 WeakPolarHBondContact O-CB 3.18Å; L302-K306 VanDerWaalsContact O-CG 3.26Å; L302-K306 WeakPolarHBondContact O-CG 3.32Å; L302-K306 PolarHBondContact O-N 3.23Å; L302-K306 VanDerWaalsContact O-N 3.14Å |
| 303 | R | 97.7 | Very high | 97.6 | Very high | 136 Ų | 136 | 99.2 Ų | 99.2 | 51% | 0.513 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -68.4 | -43.1 | 173.6 | -72.8 | 175 | -161.3 | 107.1 | 2.9 | 111 | Q299 E300 K306 L307 | Q299-R303 VanDerWaalsContact O-CG 3.29Å; Q299-R303 WeakPolarHBondContact O-CG 3.37Å; Q299-R303 PolarHBondContact O-N 3.31Å; E300-R303 WeakPolarHBondContact O-CA 3.13Å; E300-R303 WeakPolarHBondContact O-CB 3.39Å; E300-R303 PolarHBondContact O-N 3.12Å; R303-K306 PolarHBondContact O-N 3.34Å; R303-L307 PolarHBondContact O-N 3.22Å |
| 304 | E | 97.6 | Very high | 97.5 | Very high | 117 Ų | 117 | 97.1 Ų | 97.1 | 55% | 0.547 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.5 | -51.2 | 176 | -70 | 172.4 | 170.9 | 0 | 0 | 110.9 | E300 T301 K306 L307 E308 | E300-E304 WeakPolarHBondContact O-CG 3.46Å; E300-E304 PolarHBondContact O-N 2.75Å; T301-E304 PolarHBondContact O-N 2.91Å; E304-K306 VanDerWaalsContact C-N 3.28Å; E304-K306 PolarHBondContact O-N 2.83Å; E304-L307 WeakPolarHBondContact O-CA 3.48Å; E304-L307 WeakPolarHBondContact O-CB 3.29Å; E304-L307 PolarHBondContact O-N 2.87Å; E304-E308 WeakPolarHBondContact O-CG 3.5Å; E304-E308 PolarHBondContact O-N 2.88Å |
| 305 | L | 97.8 | Very high | 97.4 | Very high | 117 Ų | 117 | 99.4 Ų | 99.4 | 61% | 0.613 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61.4 | -36.3 | 179.6 | -169.8 | 68.2 | 0 | 0 | 0 | 112.5 | T301 F309 | T301-L305 WeakPolarHBondContact O-CB 3.4Å; T301-L305 PolarHBondContact O-N 3.4Å; L305-F309 VanDerWaalsContact O-CB 3.29Å; L305-F309 WeakPolarHBondContact O-CB 3.35Å; L305-F309 PolarHBondContact O-N 2.88Å |
| 306 | K | 97.7 | Very high | 97.3 | Very high | 127 Ų | 127 | 104 Ų | 104 | 55% | 0.552 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.3 | -41.5 | 172.9 | -79.8 | 175.9 | 178.3 | 179.7 | 0 | 112.1 | L302 R303 E304 F309 E310 | L302-K306 HydrophobicContact CD2-CD 3.87Å; L302-K306 VanDerWaalsContact CD2-CE 3.4Å; L302-K306 WeakPolarHBondContact O-CB 3.18Å; L302-K306 VanDerWaalsContact O-CG 3.26Å; L302-K306 WeakPolarHBondContact O-CG 3.32Å; L302-K306 PolarHBondContact O-N 3.23Å; L302-K306 VanDerWaalsContact O-N 3.14Å; R303-K306 PolarHBondContact O-N 3.34Å; E304-K306 VanDerWaalsContact C-N 3.28Å; E304-K306 PolarHBondContact O-N 2.83Å; K306-F309 PolarHBondContact O-N 3.22Å; K306-E310 PolarHBondContact O-N 2.86Å |
| 307 | L | 97.8 | Very high | 97.3 | Very high | 110 Ų | 110 | 102.3 Ų | 102.3 | 58% | 0.576 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -66.3 | -44.5 | 178 | -175.8 | 145.9 | 0 | 0 | 0 | 110.6 | R303 E304 F309 E310 I311 | R303-L307 PolarHBondContact O-N 3.22Å; E304-L307 WeakPolarHBondContact O-CA 3.48Å; E304-L307 WeakPolarHBondContact O-CB 3.29Å; E304-L307 PolarHBondContact O-N 2.87Å; L307-F309 VanDerWaalsContact C-N 3.34Å; L307-F309 PolarHBondContact O-N 3.47Å; L307-E310 PolarHBondContact O-N 3.35Å; L307-I311 HydrophobicContact CD2-CD1 3.53Å; L307-I311 HydrophobicContact CD2-CG1 4.43Å; L307-I311 HydrophobicContact CG-CD1 4.45Å; L307-I311 WeakPolarHBondContact O-CG1 3.31Å; L307-I311 PolarHBondContact O-N 2.92Å |
| 308 | E | 97.6 | Very high | 97.1 | Very high | 105 Ų | 105 | 105.2 Ų | 105.2 | 49% | 0.491 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.2 | -43.8 | 173.5 | -70.6 | 180 | 172.3 | 0 | 0 | 112 | E304 I311 Q312 | E304-E308 WeakPolarHBondContact O-CG 3.5Å; E304-E308 PolarHBondContact O-N 2.88Å; E308-I311 PolarHBondContact O-N 3.22Å; E308-Q312 WeakPolarHBondContact O-CG 3.4Å; E308-Q312 PolarHBondContact O-N 3.37Å |
| 309 | F | 97.3 | Very high | 97 | Very high | 118 Ų | 118 | 103.3 Ų | 103.3 | 52% | 0.518 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.3 | -45.2 | 177 | 176.7 | -98.9 | 0 | 0 | 0 | 112.4 | L305 K306 L307 I311 Q312 K313 | L305-F309 VanDerWaalsContact O-CB 3.29Å; L305-F309 WeakPolarHBondContact O-CB 3.35Å; L305-F309 PolarHBondContact O-N 2.88Å; K306-F309 PolarHBondContact O-N 3.22Å; L307-F309 VanDerWaalsContact C-N 3.34Å; L307-F309 PolarHBondContact O-N 3.47Å; F309-I311 VanDerWaalsContact C-N 3.35Å; F309-I311 PolarHBondContact O-N 3.26Å; F309-Q312 PolarHBondContact O-N 2.87Å; F309-K313 HydrophobicContact CE1-CD 4.31Å; F309-K313 WeakPolarHBondContact O-CB 3.19Å; F309-K313 PolarHBondContact O-N 3.4Å |
| 310 | E | 97.1 | Very high | 96.9 | Very high | 91 Ų | 91 | 103 Ų | 103 | 43% | 0.425 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.9 | -38.4 | 176.6 | -71.1 | -60.2 | 147.5 | 0 | 0 | 111.7 | K306 L307 K313 T314 | K306-E310 PolarHBondContact O-N 2.86Å; L307-E310 PolarHBondContact O-N 3.35Å; E310-K313 WeakPolarHBondContact O-CB 3.42Å; E310-K313 PolarHBondContact O-N 2.91Å; E310-K313 IonicContact OE1-NZ 3.16Å; E310-K313 IonicContact OE2-NZ 3.41Å; E310-K313 PolarHBondContact OE2-NZ 2.82Å; E310-K313 VanDerWaalsContact OE2-NZ 3.16Å; E310-T314 WeakPolarHBondContact O-CG2 3.33Å; E310-T314 PolarHBondContact O-N 3.34Å; E310-T314 PolarHBondContact O-OG1 2.75Å |
| 311 | I | 97 | Very high | 96.7 | Very high | 98 Ų | 98 | 103.5 Ų | 103.5 | 50% | 0.503 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.9 | -45.7 | 173.7 | -68.3 | 170.8 | 0 | 0 | 0 | 111.3 | L307 E308 F309 K313 T314 F315 | L307-I311 HydrophobicContact CD2-CD1 3.53Å; L307-I311 HydrophobicContact CD2-CG1 4.43Å; L307-I311 HydrophobicContact CG-CD1 4.45Å; L307-I311 WeakPolarHBondContact O-CG1 3.31Å; L307-I311 PolarHBondContact O-N 2.92Å; E308-I311 PolarHBondContact O-N 3.22Å; F309-I311 VanDerWaalsContact C-N 3.35Å; F309-I311 PolarHBondContact O-N 3.26Å; I311-K313 VanDerWaalsContact C-N 3.28Å; I311-K313 PolarHBondContact O-N 3.41Å; I311-T314 WeakPolarHBondContact CA-OG1 3.49Å; I311-T314 PolarHBondContact O-N 2.84Å; I311-T314 PolarHBondContact O-OG1 2.95Å; I311-F315 WeakPolarHBondContact O-CB 3.45Å; I311-F315 PolarHBondContact O-N 2.83Å |
| 312 | Q | 96.2 | Very high | 96.6 | Very high | 129 Ų | 129 | 105 Ų | 105 | 60% | 0.603 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.8 | -39.6 | 177.5 | -74.9 | -179.1 | 6.6 | 0 | 0 | 111.5 | E308 F309 F315 R316 | E308-Q312 WeakPolarHBondContact O-CG 3.4Å; E308-Q312 PolarHBondContact O-N 3.37Å; F309-Q312 PolarHBondContact O-N 2.87Å; Q312-F315 PolarHBondContact O-N 3.38Å; Q312-R316 WeakPolarHBondContact O-CB 3.48Å; Q312-R316 PolarHBondContact O-N 3.43Å |
| 313 | K | 96.1 | Very high | 96.4 | Very high | 93 Ų | 93 | 103.7 Ų | 103.7 | 40% | 0.404 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.9 | -46 | 176.8 | -179.6 | -178.5 | 164.1 | -157.2 | 0 | 111.8 | F309 E310 I311 R316 T317 | F309-K313 HydrophobicContact CE1-CD 4.31Å; F309-K313 WeakPolarHBondContact O-CB 3.19Å; F309-K313 PolarHBondContact O-N 3.4Å; E310-K313 WeakPolarHBondContact O-CB 3.42Å; E310-K313 PolarHBondContact O-N 2.91Å; E310-K313 IonicContact OE1-NZ 3.16Å; E310-K313 IonicContact OE2-NZ 3.41Å; E310-K313 PolarHBondContact OE2-NZ 2.82Å; E310-K313 VanDerWaalsContact OE2-NZ 3.16Å; I311-K313 VanDerWaalsContact C-N 3.28Å; I311-K313 PolarHBondContact O-N 3.41Å; K313-R316 PolarHBondContact O-N 3.5Å; K313-T317 WeakPolarHBondContact O-CG2 3.47Å; K313-T317 PolarHBondContact O-N 2.91Å; K313-T317 PolarHBondContact O-OG1 3.16Å |
| 314 | T | 96.4 | Very high | 96.2 | Very high | 72 Ų | 72 | 103 Ų | 103 | 44% | 0.442 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.5 | -42.9 | 175.8 | 53.7 | 0 | 0 | 0 | 0 | 111.6 | E310 I311 R316 T317 D318 | E310-T314 WeakPolarHBondContact O-CG2 3.33Å; E310-T314 PolarHBondContact O-N 3.34Å; E310-T314 PolarHBondContact O-OG1 2.75Å; I311-T314 WeakPolarHBondContact CA-OG1 3.49Å; I311-T314 PolarHBondContact O-N 2.84Å; I311-T314 PolarHBondContact O-OG1 2.95Å; T314-R316 VanDerWaalsContact C-N 3.31Å; T314-R316 PolarHBondContact O-N 2.96Å; T314-T317 WeakPolarHBondContact CA-OG1 3.47Å; T314-T317 PolarHBondContact O-N 3.33Å; T314-T317 PolarHBondContact O-OG1 3.03Å; T314-D318 PolarHBondContact O-N 2.76Å |
| 315 | F | 97.3 | Very high | 96 | Very high | 126 Ų | 126 | 98.9 Ų | 98.9 | 55% | 0.553 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.5 | -40.7 | 176.4 | 179.8 | -103.6 | 0 | 0 | 0 | 111.9 | I311 Q312 D318 L319 | I311-F315 WeakPolarHBondContact O-CB 3.45Å; I311-F315 PolarHBondContact O-N 2.83Å; Q312-F315 PolarHBondContact O-N 3.38Å; F315-D318 PolarHBondContact O-N 2.82Å; F315-L319 HydrophobicContact CD1-CD1 3.95Å; F315-L319 HydrophobicContact CD1-CG 4.45Å; F315-L319 HydrophobicContact CE1-CD1 3.38Å; F315-L319 HydrophobicContact CE1-CG 4.04Å; F315-L319 HydrophobicContact CZ-CD1 3.78Å; F315-L319 HydrophobicContact CZ-CD2 4.34Å; F315-L319 HydrophobicContact CZ-CG 4.07Å; F315-L319 WeakPolarHBondContact O-CG 3.1Å; F315-L319 PolarHBondContact O-N 3.02Å |
| 316 | R | 96.2 | Very high | 95.7 | Very high | 149 Ų | 149 | 97.5 Ų | 97.5 | 56% | 0.562 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -64 | -43.9 | 175.2 | -163.4 | -173.2 | 78.1 | -162.4 | -4.3 | 111.7 | Q312 K313 T314 D318 L319 E320 | Q312-R316 WeakPolarHBondContact O-CB 3.48Å; Q312-R316 PolarHBondContact O-N 3.43Å; K313-R316 PolarHBondContact O-N 3.5Å; T314-R316 VanDerWaalsContact C-N 3.31Å; T314-R316 PolarHBondContact O-N 2.96Å; R316-D318 VanDerWaalsContact C-N 3.31Å; R316-D318 PolarHBondContact O-N 3.39Å; R316-L319 PolarHBondContact O-N 3.41Å; R316-E320 WeakPolarHBondContact CG-OE1 3.27Å; R316-E320 IonicContact CZ-OE1 3.78Å; R316-E320 IonicContact NE-OE1 2.91Å; R316-E320 PolarHBondContact NE-OE1 3.16Å; R316-E320 IonicContact NH2-OE1 2.77Å; R316-E320 WeakPolarHBondContact O-CB 3.03Å; R316-E320 VanDerWaalsContact O-CG 3.29Å; R316-E320 WeakPolarHBondContact O-CG 3.47Å; R316-E320 PolarHBondContact O-N 3.2Å |
| 317 | T | 96 | Very high | 95.3 | Very high | 49 Ų | 49 | 98 Ų | 98 | 30% | 0.301 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.7 | -37.3 | 176.7 | 52.5 | 0 | 0 | 0 | 0 | 112.1 | K313 T314 E320 Q321 | K313-T317 WeakPolarHBondContact O-CG2 3.47Å; K313-T317 PolarHBondContact O-N 2.91Å; K313-T317 PolarHBondContact O-OG1 3.16Å; T314-T317 WeakPolarHBondContact CA-OG1 3.47Å; T314-T317 PolarHBondContact O-N 3.33Å; T314-T317 PolarHBondContact O-OG1 3.03Å; T317-E320 PolarHBondContact O-N 3.02Å; T317-Q321 VanDerWaalsContact O-CG 3.29Å; T317-Q321 WeakPolarHBondContact O-CG 3.37Å; T317-Q321 PolarHBondContact O-N 3.39Å |
| 318 | D | 95.5 | Very high | 94.8 | Very high | 90 Ų | 90 | 97 Ų | 97 | 48% | 0.481 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -67.2 | -40 | 176.9 | -64.9 | -14.7 | 0 | 0 | 0 | 111.3 | T314 F315 R316 Q321 L322 | T314-D318 PolarHBondContact O-N 2.76Å; F315-D318 PolarHBondContact O-N 2.82Å; R316-D318 VanDerWaalsContact C-N 3.31Å; R316-D318 PolarHBondContact O-N 3.39Å; D318-Q321 PolarHBondContact O-N 3.26Å; D318-L322 WeakPolarHBondContact O-CB 3.3Å; D318-L322 PolarHBondContact O-N 2.9Å |
| 319 | L | 95.9 | Very high | 94.3 | Very high | 78 Ų | 78 | 97.7 Ų | 97.7 | 41% | 0.408 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.1 | -44.7 | 172.5 | -76.5 | -179.7 | 0 | 0 | 0 | 112 | F315 R316 Q321 L322 T323 | F315-L319 HydrophobicContact CD1-CD1 3.95Å; F315-L319 HydrophobicContact CD1-CG 4.45Å; F315-L319 HydrophobicContact CE1-CD1 3.38Å; F315-L319 HydrophobicContact CE1-CG 4.04Å; F315-L319 HydrophobicContact CZ-CD1 3.78Å; F315-L319 HydrophobicContact CZ-CD2 4.34Å; F315-L319 HydrophobicContact CZ-CG 4.07Å; F315-L319 WeakPolarHBondContact O-CG 3.1Å; F315-L319 PolarHBondContact O-N 3.02Å; R316-L319 PolarHBondContact O-N 3.41Å; L319-Q321 VanDerWaalsContact C-N 3.33Å; L319-Q321 PolarHBondContact O-N 3.1Å; L319-L322 PolarHBondContact O-N 3.33Å; L319-T323 VanDerWaalsContact O-CG2 3.28Å; L319-T323 WeakPolarHBondContact O-CG2 3.49Å; L319-T323 PolarHBondContact O-N 2.65Å; L319-T323 PolarHBondContact O-OG1 2.9Å |
| 320 | E | 94.8 | Very high | 93.6 | Very high | 81 Ų | 81 | 97.1 Ų | 97.1 | 38% | 0.379 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -56 | -49.5 | 175.2 | -74.3 | 164.3 | -166.9 | 0 | 0 | 109.9 | R316 T317 L322 T323 E324 | R316-E320 WeakPolarHBondContact CG-OE1 3.27Å; R316-E320 IonicContact CZ-OE1 3.78Å; R316-E320 IonicContact NE-OE1 2.91Å; R316-E320 PolarHBondContact NE-OE1 3.16Å; R316-E320 IonicContact NH2-OE1 2.77Å; R316-E320 WeakPolarHBondContact O-CB 3.03Å; R316-E320 VanDerWaalsContact O-CG 3.29Å; R316-E320 WeakPolarHBondContact O-CG 3.47Å; R316-E320 PolarHBondContact O-N 3.2Å; T317-E320 PolarHBondContact O-N 3.02Å; E320-L322 PolarHBondContact O-N 3.46Å; E320-T323 PolarHBondContact O-N 3.15Å; E320-T323 PolarHBondContact O-OG1 3.28Å; E320-E324 WeakPolarHBondContact O-CG 3.42Å; E320-E324 PolarHBondContact O-N 3.2Å |
| 321 | Q | 94.1 | Very high | 92.7 | Very high | 122 Ų | 122 | 97.2 Ų | 97.2 | 57% | 0.57 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -59 | -43.1 | 175.6 | -72.5 | 173.1 | 22.6 | 0 | 0 | 113 | T317 D318 L319 E324 G325 | T317-Q321 VanDerWaalsContact O-CG 3.29Å; T317-Q321 WeakPolarHBondContact O-CG 3.37Å; T317-Q321 PolarHBondContact O-N 3.39Å; D318-Q321 PolarHBondContact O-N 3.26Å; L319-Q321 VanDerWaalsContact C-N 3.33Å; L319-Q321 PolarHBondContact O-N 3.1Å; Q321-E324 PolarHBondContact O-N 2.7Å; Q321-G325 PolarHBondContact O-N 2.86Å |
| 322 | L | 94.9 | Very high | 91.8 | Very high | 105 Ų | 105 | 99.4 Ų | 99.4 | 55% | 0.55 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65 | -41.9 | 176.8 | -176.4 | 65.3 | 0 | 0 | 0 | 111.4 | D318 L319 E320 E324 G325 L326 | D318-L322 WeakPolarHBondContact O-CB 3.3Å; D318-L322 PolarHBondContact O-N 2.9Å; L319-L322 PolarHBondContact O-N 3.33Å; E320-L322 PolarHBondContact O-N 3.46Å; L322-E324 VanDerWaalsContact C-N 3.35Å; L322-G325 PolarHBondContact O-N 3.09Å; L322-L326 HydrophobicContact CG-CD1 4.3Å; L322-L326 WeakPolarHBondContact O-CB 3.47Å; L322-L326 WeakPolarHBondContact O-CG 3.25Å; L322-L326 PolarHBondContact O-N 3.3Å |
| 323 | T | 94.5 | Very high | 90.8 | Very high | 65 Ų | 65 | 98.3 Ų | 98.3 | 40% | 0.399 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -66.4 | -37 | 177.3 | 63.2 | 0 | 0 | 0 | 0 | 112.2 | L319 E320 K327 | L319-T323 VanDerWaalsContact O-CG2 3.28Å; L319-T323 WeakPolarHBondContact O-CG2 3.49Å; L319-T323 PolarHBondContact O-N 2.65Å; L319-T323 PolarHBondContact O-OG1 2.9Å; E320-T323 PolarHBondContact O-N 3.15Å; E320-T323 PolarHBondContact O-OG1 3.28Å; T323-K327 WeakPolarHBondContact O-CB 2.87Å; T323-K327 WeakPolarHBondContact O-CD 3.22Å; T323-K327 WeakPolarHBondContact O-CG 3.44Å; T323-K327 PolarHBondContact O-N 3.21Å |
| 324 | E | 93.2 | Very high | 89.5 | Confident | 122 Ų | 122 | 103.1 Ų | 103.1 | 57% | 0.57 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.7 | -46.1 | 172.5 | -73.5 | -179.9 | 176.8 | 0 | 0 | 111 | E320 Q321 L322 L326 K327 T328 | E320-E324 WeakPolarHBondContact O-CG 3.42Å; E320-E324 PolarHBondContact O-N 3.2Å; Q321-E324 PolarHBondContact O-N 2.7Å; L322-E324 VanDerWaalsContact C-N 3.35Å; E324-L326 PolarHBondContact O-N 3.29Å; E324-K327 WeakPolarHBondContact O-CB 3.42Å; E324-K327 PolarHBondContact O-N 2.75Å; E324-K327 VanDerWaalsContact O-N 3.17Å; E324-T328 WeakPolarHBondContact O-CG2 3.1Å; E324-T328 PolarHBondContact O-N 2.93Å; E324-T328 PolarHBondContact O-OG1 3.33Å |
| 325 | G | 92.1 | Very high | 87.5 | Confident | 29 Ų | 29 | 102.8 Ų | 102.8 | 30% | 0.299 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -54.2 | -52.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112 | Q321 L322 K327 T328 E329 | Q321-G325 PolarHBondContact O-N 2.86Å; L322-G325 PolarHBondContact O-N 3.09Å; G325-K327 VanDerWaalsContact C-N 3.35Å; G325-K327 PolarHBondContact O-N 3.03Å; G325-T328 PolarHBondContact O-N 2.96Å; G325-T328 VanDerWaalsContact O-N 3.12Å; G325-T328 PolarHBondContact O-OG1 2.85Å; G325-E329 PolarHBondContact O-N 3.45Å |
| 326 | L | 92.5 | Very high | 85.3 | Confident | 89 Ų | 89 | 102.2 Ų | 102.2 | 47% | 0.466 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.6 | -40.5 | 176 | -72.1 | 173.2 | 0 | 0 | 0 | 112.5 | L322 E324 T328 E329 L330 | L322-L326 HydrophobicContact CG-CD1 4.3Å; L322-L326 WeakPolarHBondContact O-CB 3.47Å; L322-L326 WeakPolarHBondContact O-CG 3.25Å; L322-L326 PolarHBondContact O-N 3.3Å; E324-L326 PolarHBondContact O-N 3.29Å; L326-T328 VanDerWaalsContact C-N 3.35Å; L326-E329 PolarHBondContact O-N 2.74Å; L326-L330 WeakPolarHBondContact O-CB 3.33Å; L326-L330 VanDerWaalsContact O-CG 3.29Å; L326-L330 WeakPolarHBondContact O-CG 3.4Å; L326-L330 PolarHBondContact O-N 3.39Å |
| 327 | K | 89.8 | Confident | 83 | Confident | 136 Ų | 136 | 101.5 Ų | 101.5 | 59% | 0.591 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61.8 | -42.6 | 174.2 | -77.1 | 167.6 | -175.4 | 170.9 | 0 | 111.3 | T323 E324 G325 L330 T331 | T323-K327 WeakPolarHBondContact O-CB 2.87Å; T323-K327 WeakPolarHBondContact O-CD 3.22Å; T323-K327 WeakPolarHBondContact O-CG 3.44Å; T323-K327 PolarHBondContact O-N 3.21Å; E324-K327 WeakPolarHBondContact O-CB 3.42Å; E324-K327 PolarHBondContact O-N 2.75Å; E324-K327 VanDerWaalsContact O-N 3.17Å; G325-K327 VanDerWaalsContact C-N 3.35Å; G325-K327 PolarHBondContact O-N 3.03Å; K327-L330 PolarHBondContact O-N 2.94Å; K327-T331 WeakPolarHBondContact O-CG2 3.15Å; K327-T331 PolarHBondContact O-N 3.39Å; K327-T331 PolarHBondContact O-OG1 3.32Å |
| 328 | T | 86.1 | Confident | 80.4 | Confident | 90 Ų | 90 | 108.2 Ų | 108.2 | 55% | 0.552 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -66.9 | -35.6 | 177 | 59.6 | 0 | 0 | 0 | 0 | 112.9 | E324 G325 L326 T331 F332 | E324-T328 WeakPolarHBondContact O-CG2 3.1Å; E324-T328 PolarHBondContact O-N 2.93Å; E324-T328 PolarHBondContact O-OG1 3.33Å; G325-T328 PolarHBondContact O-N 2.96Å; G325-T328 VanDerWaalsContact O-N 3.12Å; G325-T328 PolarHBondContact O-OG1 2.85Å; L326-T328 VanDerWaalsContact C-N 3.35Å; T328-T331 WeakPolarHBondContact CA-OG1 3.5Å; T328-T331 PolarHBondContact O-OG1 3.41Å; T328-F332 VanDerWaalsContact O-CB 3.32Å; T328-F332 WeakPolarHBondContact O-CB 3.43Å; T328-F332 PolarHBondContact O-N 2.81Å |
| 329 | E | 86.9 | Confident | 78.2 | Confident | 120 Ų | 120 | 108.5 Ų | 108.5 | 56% | 0.561 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -67.5 | -42.7 | 172.2 | -73 | -177.3 | 174.6 | 0 | 0 | 111.4 | G325 L326 T331 F332 L333 | G325-E329 PolarHBondContact O-N 3.45Å; L326-E329 PolarHBondContact O-N 2.74Å; E329-T331 VanDerWaalsContact C-N 3.35Å; E329-T331 PolarHBondContact O-N 2.95Å; E329-F332 WeakPolarHBondContact O-CB 3.22Å; E329-F332 PolarHBondContact O-N 3.15Å; E329-L333 WeakPolarHBondContact O-CB 3.2Å; E329-L333 WeakPolarHBondContact O-CG 3.39Å; E329-L333 PolarHBondContact O-N 3.36Å |
| 330 | L | 83.8 | Confident | 75.3 | Confident | 106 Ų | 106 | 114 Ų | 114 | 56% | 0.555 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -64.2 | -37.4 | 175.5 | -74.3 | 175.2 | 0 | 0 | 0 | 112.3 | L326 K327 R334 | L326-L330 WeakPolarHBondContact O-CB 3.33Å; L326-L330 VanDerWaalsContact O-CG 3.29Å; L326-L330 WeakPolarHBondContact O-CG 3.4Å; L326-L330 PolarHBondContact O-N 3.39Å; K327-L330 PolarHBondContact O-N 2.94Å; L330-R334 WeakPolarHBondContact O-CB 3.02Å; L330-R334 PolarHBondContact O-N 2.73Å |
| 331 | T | 77.6 | Confident | 72.5 | Confident | 93 Ų | 93 | 117 Ų | 117 | 57% | 0.571 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -71.3 | -33.9 | 173.4 | 55.1 | 0 | 0 | 0 | 0 | 112 | K327 T328 E329 G335 | K327-T331 WeakPolarHBondContact O-CG2 3.15Å; K327-T331 PolarHBondContact O-N 3.39Å; K327-T331 PolarHBondContact O-OG1 3.32Å; T328-T331 WeakPolarHBondContact CA-OG1 3.5Å; T328-T331 PolarHBondContact O-OG1 3.41Å; E329-T331 VanDerWaalsContact C-N 3.35Å; E329-T331 PolarHBondContact O-N 2.95Å; T331-G335 PolarHBondContact O-N 2.83Å |
| 332 | F | 77.6 | Confident | 69.9 | Low | 143 Ų | 143 | 118.6 Ų | 118.6 | 63% | 0.627 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -63.7 | -45.6 | 171.8 | 177.6 | -96.4 | 0 | 0 | 0 | 112 | T328 E329 G335 | T328-F332 VanDerWaalsContact O-CB 3.32Å; T328-F332 WeakPolarHBondContact O-CB 3.43Å; T328-F332 PolarHBondContact O-N 2.81Å; E329-F332 WeakPolarHBondContact O-CB 3.22Å; E329-F332 PolarHBondContact O-N 3.15Å; F332-G335 PolarHBondContact O-N 3.42Å |
| 333 | L | 76.2 | Confident | 67.7 | Low | 107 Ų | 107 | 119 Ų | 119 | 56% | 0.56 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -67.2 | -40.8 | 176.7 | -68.9 | 173.6 | 0 | 0 | 0 | 111.6 | E329 G335 N336 | E329-L333 WeakPolarHBondContact O-CB 3.2Å; E329-L333 WeakPolarHBondContact O-CG 3.39Å; E329-L333 PolarHBondContact O-N 3.36Å; L333-G335 VanDerWaalsContact C-N 3.3Å; L333-G335 PolarHBondContact O-N 3.46Å; L333-N336 PolarHBondContact O-N 3.44Å |
| 334 | R | 67.5 | Low | 65.5 | Low | 194 Ų | 194 | 124.6 Ų | 124.6 | 73% | 0.732 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -67.3 | -28 | 174.8 | -169.9 | -178 | -62 | -142 | -1.4 | 113 | L330 N336 D337 | L330-R334 WeakPolarHBondContact O-CB 3.02Å; L330-R334 PolarHBondContact O-N 2.73Å; R334-N336 PolarHBondContact O-N 3.21Å; R334-D337 PolarHBondContact O-N 2.85Å |
| 335 | G | 55.8 | Low | 63.1 | Low | 65 Ų | 65 | 128.1 Ų | 128.1 | 67% | 0.67 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.6 | -11.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | T331 F332 L333 | T331-G335 PolarHBondContact O-N 2.83Å; F332-G335 PolarHBondContact O-N 3.42Å; L333-G335 VanDerWaalsContact C-N 3.3Å; L333-G335 PolarHBondContact O-N 3.46Å |
| 336 | N | 51.4 | Low | 60.8 | Low | 114 Ų | 114 | 134.2 Ų | 134.2 | 61% | 0.61 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.3 | -3 | 174 | -75.8 | -41.8 | 0 | 0 | 0 | 113.7 | L333 R334 | L333-N336 PolarHBondContact O-N 3.44Å; R334-N336 PolarHBondContact O-N 3.21Å |
| 337 | D | 46.4 | Very low | 58.6 | Low | 134 Ų | 134 | 138.9 Ų | 138.9 | 72% | 0.717 | 71% | 0.711 | S | S | * | * | trans | -124.5 | 112.3 | 176.4 | -71.6 | -35.8 | 0 | 0 | 0 | 110.7 | R334 | R334-D337 PolarHBondContact O-N 2.85Š| ||
| 338 | E | 41.1 | Very low | 56.6 | Low | 190 Ų | 190 | 140.8 Ų | 140.8 | 89% | 0.888 | 72% | 0.722 | S | S | * | * | trans | -127.8 | 149.1 | 156.4 | -129.7 | -170 | -148.8 | 0 | 0 | 107.7 | ||||
| 339 | P | 50.2 | Low | 54.6 | Low | 95 Ų | 95 | 144.1 Ų | 144.1 | 62% | 0.617 | 74% | 0.736 | S | S | * | * | -122.2 | 158.6 | -69.1 | 36 | -25.8 | 0 | 0 | 0 | 111 | |||||
| 340 | H | 34.1 | Very low | 52.8 | Low | 195 Ų | 195 | 143.8 Ų | 143.8 | 90% | 0.903 | 75% | 0.747 | S | S | * | * | trans | -133.9 | 116.5 | 154.4 | -106.9 | 39.7 | 0 | 0 | 0 | 110.7 | ||||
| 341 | N | 36.8 | Very low | 50.9 | Low | 143 Ų | 143 | 146.8 Ų | 146.8 | 77% | 0.765 | 76% | 0.762 | S | S | * | * | trans | -50.8 | 159.6 | 158.5 | -58.9 | -56.6 | 0 | 0 | 0 | 109.2 | ||||
| 342 | I | 40.4 | Very low | 49.4 | Very low | 155 Ų | 155 | 147.7 Ų | 147.7 | 80% | 0.795 | 77% | 0.772 | S | S | * | * | -175.8 | -175.2 | 52.3 | -45.5 | 171.6 | 0 | 0 | 0 | 105.4 | |||||
| 343 | P | 47.4 | Very low | 47.7 | Very low | 115 Ų | 115 | 153 Ų | 153 | 75% | 0.747 | 79% | 0.788 | S | S | * | * | -104.9 | 177.3 | -86.5 | 33.3 | -15.3 | 0 | 0 | 0 | 115.3 | |||||
| 344 | E | 49.7 | Very low | 46.1 | Very low | 182 Ų | 182 | 155.2 Ų | 155.2 | 85% | 0.85 | 84% | 0.836 | S | S | * | * | trans | -34.2 | 144.5 | 164 | -55.7 | 171.8 | 169.3 | 0 | 0 | 117.1 | ||||
| 345 | E | 41.6 | Very low | 45 | Very low | 196 Ų | 196 | 153.3 Ų | 153.3 | 92% | 0.916 | 84% | 0.841 | S | S | * | * | -150.1 | 139.9 | 128 | -73.4 | -157.3 | 161.1 | 0 | 0 | 110.5 | |||||
| 346 | D | 44.9 | Very low | 44.4 | Very low | 156 Ų | 156 | 157.9 Ų | 157.9 | 83% | 0.834 | 85% | 0.85 | S | S | * | * | trans | -64 | 145.9 | -179.6 | -69.5 | -58.5 | 0 | 0 | 0 | 114 | ||||
| 347 | E | 45.2 | Very low | 44 | Very low | 188 Ų | 188 | 160.3 Ų | 160.3 | 88% | 0.879 | 86% | 0.863 | S | S | * | * | trans | -155.5 | 109.9 | 138.7 | -120.8 | 175.6 | -171.7 | 0 | 0 | 111.6 | ||||
| 348 | Q | 47.3 | Very low | 43.9 | Very low | 176 Ų | 176 | 161.9 Ų | 161.9 | 82% | 0.822 | 87% | 0.872 | S | S | * | * | trans | -61 | 135.7 | 165.4 | -61.7 | 168.2 | -2.2 | 0 | 0 | 109.2 | ||||
| 349 | L | 45.4 | Very low | 44.1 | Very low | 159 Ų | 159 | 160.1 Ų | 160.1 | 83% | 0.832 | 87% | 0.871 | S | S | * | * | trans | -159.1 | 103.1 | 149.8 | -104.4 | 158.6 | 0 | 0 | 0 | 111.1 | ||||
| 350 | S | 48.1 | Very low | 43.7 | Very low | 114 Ų | 114 | 164.5 Ų | 164.5 | 80% | 0.797 | 89% | 0.888 | S | S | * | * | trans | -46.7 | 131.2 | 163.3 | -40.4 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 351 | I | 44.5 | Very low | 44.3 | Very low | 169 Ų | 169 | 162.3 Ų | 162.3 | 87% | 0.867 | 89% | 0.887 | S | S | * | * | trans | -137.2 | 129.3 | 153.5 | -60 | -176.1 | 0 | 0 | 0 | 110.4 | ||||
| 352 | S | 46.4 | Very low | 44.9 | Very low | 112 Ų | 112 | 163.8 Ų | 163.8 | 78% | 0.783 | 90% | 0.896 | S | S | * | * | trans | -61.7 | 154.5 | -173.6 | -77.1 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 353 | R | 42 | Very low | 45.3 | Very low | 255 Ų | 255 | 164.5 Ų | 164.5 | 96% | 0.962 | 91% | 0.905 | S | S | * | * | trans | -29.6 | 135.5 | 146.5 | -78.7 | 175.3 | 167.6 | 176.1 | -4.7 | 114.4 | ||||
| 354 | G | 41.3 | Very low | 45.1 | Very low | 152 Ų | 152 | 169 Ų | 169 | 100% | 1.567 | 92% | 0.919 | S | S | * | * | trans | -125.3 | 0 | 140.8 | 0 | 0 | 0 | 0 | 0 | 107.4 |
Retrieved 354 of 354 residues in 393.7 ms
(Link to these results)