| 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 | 43.2 | Very low | 41.4 | Very low | 244 Ų | 244 | 138.9 Ų | 138.9 | 100% | 1.202 | 80% | 0.803 | S | S | * | * | 0 | 117.9 | 0 | -68.4 | 174.4 | 94.2 | 0 | 0 | 106.6 | |||||
| 2 | S | 42.6 | Very low | 42.1 | Very low | 103 Ų | 103 | 134.6 Ų | 134.6 | 72% | 0.72 | 79% | 0.787 | S | S | * | * | trans | -74.5 | 139.8 | -178.4 | 172.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 3 | Y | 42.5 | Very low | 42.6 | Very low | 235 Ų | 235 | 137.5 Ų | 137.5 | 92% | 0.922 | 78% | 0.779 | S | S | * | * | trans | -153.1 | 102.5 | 139.3 | -81.2 | -67.7 | 0 | 0 | 0 | 109 | ||||
| 4 | G | 38 | Very low | 43.3 | Very low | 69 Ų | 69 | 141.6 Ų | 141.6 | 71% | 0.711 | 78% | 0.775 | S | S | * | * | trans | -80.3 | 147 | 164.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 5 | S | 41.8 | Very low | 44.1 | Very low | 112 Ų | 112 | 146.1 Ų | 146.1 | 78% | 0.783 | 78% | 0.776 | S | S | * | * | trans | -124 | 86.3 | 170.7 | 36 | 0 | 0 | 0 | 0 | 108.4 | V7 | S5-V7 PolarHBondContact O-N 3.03Š| ||
| 6 | D | 38.3 | Very low | 44.5 | Very low | 144 Ų | 144 | 145.2 Ų | 145.2 | 77% | 0.77 | 77% | 0.77 | S | S | * | * | trans | -79.7 | 101.7 | 167.4 | -69.7 | -46.9 | 0 | 0 | 0 | 108.6 | F8 | D6-F8 HydrophobicContact CB-CD2 4.46Å; D6-F8 HydrophobicContact CB-CE2 4.32Å | ||
| 7 | V | 44.3 | Very low | 44.9 | Very low | 135 Ų | 135 | 144.9 Ų | 144.9 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | trans | -95.5 | 96 | 164.6 | -177.8 | 0 | 0 | 0 | 0 | 107 | S5 S9 | S5-V7 PolarHBondContact O-N 3.03Å; V7-S9 PolarHBondContact O-N 3.25Å; V7-S9 VanDerWaalsContact O-N 3.11Å | ||
| 8 | F | 40 | Very low | 44.8 | Very low | 188 Ų | 188 | 140.5 Ų | 140.5 | 83% | 0.825 | 76% | 0.756 | S | S | * | * | trans | -60.8 | 110.9 | 168.8 | -82.5 | -89.2 | 0 | 0 | 0 | 109.4 | D6 S10 | D6-F8 HydrophobicContact CB-CD2 4.46Å; D6-F8 HydrophobicContact CB-CE2 4.32Å; F8-S10 PolarHBondContact O-N 3.08Å | ||
| 9 | S | 41.2 | Very low | 44.7 | Very low | 123 Ų | 123 | 141.6 Ų | 141.6 | 86% | 0.86 | 76% | 0.756 | S | S | * | * | trans | -72 | 97.9 | 169.3 | -157.8 | 0 | 0 | 0 | 0 | 108.8 | V7 S11 | V7-S9 PolarHBondContact O-N 3.25Å; V7-S9 VanDerWaalsContact O-N 3.11Å; S9-S11 PolarHBondContact O-N 3.22Å | ||
| 10 | S | 43.2 | Very low | 44.6 | Very low | 89 Ų | 89 | 139.6 Ų | 139.6 | 62% | 0.622 | 75% | 0.754 | S | S | * | * | trans | -68.1 | 117.5 | 173.3 | 175 | 0 | 0 | 0 | 0 | 109.7 | F8 S12 | F8-S10 PolarHBondContact O-N 3.08Å; S10-S12 PolarHBondContact O-N 2.86Å | ||
| 11 | S | 40.8 | Very low | 44.9 | Very low | 86 Ų | 86 | 138.5 Ų | 138.5 | 60% | 0.601 | 75% | 0.754 | S | S | * | * | trans | -57 | 121.9 | 177.9 | 173.4 | 0 | 0 | 0 | 0 | 111.9 | S9 Y13 R14 | S9-S11 PolarHBondContact O-N 3.22Å; S11-Y13 PolarHBondContact O-N 3.4Å; S11-R14 PolarHBondContact O-N 2.94Å | ||
| 12 | S | 49.1 | Very low | 44.8 | Very low | 87 Ų | 87 | 138 Ų | 138 | 61% | 0.608 | 74% | 0.739 | S | S | * | * | G | 310 helix | trans | -61.9 | -5.1 | 178.6 | -61.2 | 0 | 0 | 0 | 0 | 114.8 | S10 | S10-S12 PolarHBondContact O-N 2.86Š|
| 13 | Y | 49.2 | Very low | 44.4 | Very low | 173 Ų | 173 | 142.8 Ų | 142.8 | 68% | 0.678 | 75% | 0.747 | S | S | * | * | G | 310 helix | trans | -74.2 | -25 | 178.5 | -151 | -96 | 0 | 0 | 0 | 113.1 | S11 R15 F17 | S11-Y13 PolarHBondContact O-N 3.4Å; Y13-R15 VanDerWaalsContact C-N 3.33Å; Y13-R15 PolarHBondContact O-N 3.29Å; Y13-F17 HydrophobicContact CE1-CD2 4.4Å |
| 14 | R | 52.5 | Low | 44.1 | Very low | 194 Ų | 194 | 137.1 Ų | 137.1 | 73% | 0.732 | 74% | 0.742 | S | S | * | * | G | 310 helix | trans | -76.1 | -12.5 | -179.1 | -106.1 | -173.9 | -165.9 | -107.7 | 1.9 | 115.2 | S11 E19 | S11-R14 PolarHBondContact O-N 2.94Å; R14-E19 IonicContact NH1-OE1 3.02Å; R14-E19 PolarHBondContact NH1-OE1 2.89Å |
| 15 | R | 54.4 | Low | 44 | Very low | 210 Ų | 210 | 138.9 Ų | 138.9 | 79% | 0.792 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -94.1 | -16.6 | -175.2 | -96 | -167.8 | -87.9 | -174.1 | -5.1 | 114.5 | Y13 | Y13-R15 VanDerWaalsContact C-N 3.33Å; Y13-R15 PolarHBondContact O-N 3.29Å |
| 16 | I | 50.6 | Low | 43.8 | Very low | 131 Ų | 131 | 139 Ų | 139 | 67% | 0.672 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.7 | -35.2 | -172.3 | -61.4 | 174.9 | 0 | 0 | 0 | 111.5 | ||
| 17 | F | 52.4 | Low | 44.1 | Very low | 141 Ų | 141 | 137.4 Ų | 137.4 | 62% | 0.618 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -114.7 | 100.7 | 177.4 | -58.8 | -74.5 | 0 | 0 | 0 | 108.7 | Y13 | Y13-F17 HydrophobicContact CE1-CD2 4.4Š|
| 18 | G | 42.7 | Very low | 43.7 | Very low | 65 Ų | 65 | 136 Ų | 136 | 67% | 0.67 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 155.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | S20 | G18-S20 PolarHBondContact O-N 3.16Š|
| 19 | E | 42.2 | Very low | 43.4 | Very low | 161 Ų | 161 | 139 Ų | 139 | 75% | 0.752 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 119.3 | 176.8 | -149.9 | 154.5 | -143.6 | 0 | 0 | 109.8 | R14 | R14-E19 IonicContact NH1-OE1 3.02Å; R14-E19 PolarHBondContact NH1-OE1 2.89Å |
| 20 | S | 42.2 | Very low | 43.3 | Very low | 102 Ų | 102 | 139.8 Ų | 139.8 | 71% | 0.713 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 139.9 | 174.2 | -69.2 | 0 | 0 | 0 | 0 | 110.2 | G18 R22 | G18-S20 PolarHBondContact O-N 3.16Å; S20-R22 PolarHBondContact O-N 3.35Å; S20-R22 VanDerWaalsContact O-N 3.16Å |
| 21 | P | 51.3 | Low | 43 | Very low | 117 Ų | 117 | 141 Ų | 141 | 76% | 0.76 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 121.1 | -176.3 | -14.9 | 28.1 | 0 | 0 | 0 | 110.5 | F23 | P21-F23 PolarHBondContact O-N 2.85Å; P21-F23 VanDerWaalsContact O-N 3.14Å |
| 22 | R | 40.7 | Very low | 42.8 | Very low | 234 Ų | 234 | 141.7 Ų | 141.7 | 88% | 0.883 | 76% | 0.756 | S | S | * | * | trans | -64.7 | 108.9 | 166.4 | -67.9 | -179.7 | 173.7 | -167.8 | -3.5 | 108.4 | S20 S24 | S20-R22 PolarHBondContact O-N 3.35Å; S20-R22 VanDerWaalsContact O-N 3.16Å; R22-S24 PolarHBondContact O-N 3.29Å | ||
| 23 | F | 35.4 | Very low | 42.2 | Very low | 202 Ų | 202 | 149.6 Ų | 149.6 | 89% | 0.886 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 121 | 163.1 | -94.8 | -89.7 | 0 | 0 | 0 | 108.9 | P21 | P21-F23 PolarHBondContact O-N 2.85Å; P21-F23 VanDerWaalsContact O-N 3.14Å |
| 24 | S | 35.1 | Very low | 41.5 | Very low | 117 Ų | 117 | 145 Ų | 145 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 127.8 | 164.1 | 46.6 | 0 | 0 | 0 | 0 | 108.2 | R22 | R22-S24 PolarHBondContact O-N 3.29Š|
| 25 | S | 37 | Very low | 40.6 | Very low | 106 Ų | 106 | 139.9 Ų | 139.9 | 74% | 0.741 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -94.2 | 146.2 | 176.6 | 42.7 | 0 | 0 | 0 | 0 | 111.1 | ||
| 26 | S | 36.5 | Very low | 39.6 | Very low | 113 Ų | 113 | 132.6 Ų | 132.6 | 79% | 0.79 | 78% | 0.776 | S | S | * | * | trans | 106.3 | 153.8 | 154.1 | -52.6 | 0 | 0 | 0 | 0 | 118 | ||||
| 27 | P | 45.6 | Very low | 39 | Very low | 111 Ų | 111 | 137.6 Ų | 137.6 | 72% | 0.721 | 79% | 0.788 | S | S | * | * | cis | -137.5 | 166.5 | -33.5 | 36.3 | -18.4 | 0 | 0 | 0 | 114.7 | ||||
| 28 | S | 35.2 | Very low | 38.3 | Very low | 105 Ų | 105 | 142.3 Ų | 142.3 | 73% | 0.734 | 80% | 0.801 | S | S | * | * | trans | 24.6 | 122.5 | 149 | 62.7 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 29 | R | 34.8 | Very low | 38 | Very low | 252 Ų | 252 | 145 Ų | 145 | 95% | 0.951 | 81% | 0.81 | S | S | * | * | trans | -137.3 | 123.6 | 140.3 | -75.6 | -163.9 | 177 | -151.2 | -1 | 112.3 | ||||
| 30 | V | 39.1 | Very low | 37.7 | Very low | 139 Ų | 139 | 142.3 Ų | 142.3 | 84% | 0.842 | 81% | 0.809 | S | S | * | * | trans | -66.2 | 134.8 | 165.7 | 165.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 31 | S | 35.3 | Very low | 37.4 | Very low | 116 Ų | 116 | 142 Ų | 142 | 81% | 0.811 | 81% | 0.806 | S | S | * | * | trans | -160.4 | 118.5 | 136.5 | 68.4 | 0 | 0 | 0 | 0 | 112 | ||||
| 32 | S | 38 | Very low | 36.6 | Very low | 99 Ų | 99 | 142.3 Ų | 142.3 | 69% | 0.692 | 80% | 0.801 | S | S | * | * | trans | -59.7 | 156.3 | 164.3 | 53.3 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 33 | R | 37 | Very low | 36.3 | Very low | 253 Ų | 253 | 136.2 Ų | 136.2 | 96% | 0.955 | 80% | 0.795 | S | S | * | * | trans | 118.7 | 126 | 161.7 | -78.8 | 168.2 | 138.1 | 167.1 | -7.1 | 109.8 | ||||
| 34 | G | 33.2 | Very low | 36.4 | Very low | 77 Ų | 77 | 135 Ų | 135 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | cis | 149.6 | 143.4 | 12.8 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 35 | G | 33.8 | Very low | 36.4 | Very low | 87 Ų | 87 | 136.7 Ų | 136.7 | 90% | 0.897 | 79% | 0.789 | S | S | * | * | trans | 83 | 124.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 36 | G | 34.5 | Very low | 36.2 | Very low | 57 Ų | 57 | 135.4 Ų | 135.4 | 59% | 0.588 | 79% | 0.793 | S | S | * | * | cis | 116.9 | 105.6 | 27.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 37 | Y | 37.7 | Very low | 36.1 | Very low | 235 Ų | 235 | 137.6 Ų | 137.6 | 92% | 0.922 | 80% | 0.795 | S | S | * | * | trans | 80.4 | 106.5 | 152.4 | -43.6 | -69.6 | 0 | 0 | 0 | 119.6 | ||||
| 38 | R | 36.2 | Very low | 35.5 | Very low | 240 Ų | 240 | 137.4 Ų | 137.4 | 91% | 0.906 | 80% | 0.796 | S | S | * | * | trans | -63 | 143.5 | 143.3 | -60.6 | 171.8 | 168.9 | -132.3 | -3.1 | 109.3 | ||||
| 39 | S | 36.5 | Very low | 35.3 | Very low | 121 Ų | 121 | 138.1 Ų | 138.1 | 85% | 0.846 | 80% | 0.801 | S | S | * | * | 173.7 | 150.9 | 107.5 | 57.6 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 40 | S | 36.1 | Very low | 35.5 | Very low | 106 Ų | 106 | 132.9 Ų | 132.9 | 74% | 0.741 | 80% | 0.797 | S | S | * | * | trans | -71.3 | 156.4 | -178.7 | 47.1 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 41 | S | 35.5 | Very low | 35.1 | Very low | 94 Ų | 94 | 129.2 Ų | 129.2 | 66% | 0.657 | 79% | 0.787 | S | S | * | * | trans | -6 | 144.8 | 149.7 | 58.5 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 42 | L | 36.1 | Very low | 35.2 | Very low | 125 Ų | 125 | 128.5 Ų | 128.5 | 65% | 0.654 | 78% | 0.782 | S | S | * | * | 165.3 | 141.4 | 106.2 | -88.7 | 156.3 | 0 | 0 | 0 | 113.4 | |||||
| 43 | S | 34 | Very low | 34.9 | Very low | 106 Ų | 106 | 134.4 Ų | 134.4 | 74% | 0.741 | 79% | 0.791 | S | S | * | * | trans | 68.7 | 127.3 | 134.1 | -54.1 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 44 | R | 38.3 | Very low | 34.5 | Very low | 177 Ų | 177 | 126 Ų | 126 | 67% | 0.668 | 77% | 0.77 | S | S | * | * | trans | -49.5 | 155.8 | 162.7 | -61.9 | 169.3 | 168.4 | -142.2 | -4.2 | 116.4 | N112 | R44-N112 VanDerWaalsContact NH1-CG 3.34Å; R44-N112 PolarHBondContact NH1-ND2 2.85Å; R44-N112 PolarHBondContact NH1-OD1 3.12Å; R44-N112 PolarHBondContact NH2-ND2 3.03Å; R44-N112 PolarHBondContact NH2-OD1 2.72Å | ||
| 45 | T | 33.4 | Very low | 34.4 | Very low | 151 Ų | 151 | 132.3 Ų | 132.3 | 93% | 0.926 | 77% | 0.77 | S | S | * | * | -156.9 | 149 | 129.6 | 37.2 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 46 | G | 34 | Very low | 34.3 | Very low | 80 Ų | 80 | 136.5 Ų | 136.5 | 83% | 0.825 | 76% | 0.764 | S | S | * | * | trans | 168.4 | 100.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 47 | I | 34.9 | Very low | 34.2 | Very low | 159 Ų | 159 | 139.3 Ų | 139.3 | 82% | 0.815 | 77% | 0.774 | S | S | * | * | trans | -106.5 | 140.1 | -165.5 | 1.8 | 169.4 | 0 | 0 | 0 | 111.5 | ||||
| 48 | S | 31.6 | Very low | 34.1 | Very low | 107 Ų | 107 | 131.9 Ų | 131.9 | 75% | 0.748 | 76% | 0.761 | S | S | * | * | trans | 27.2 | 138.4 | 142.8 | 62.4 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 49 | S | 32.1 | Very low | 34 | Very low | 119 Ų | 119 | 131.9 Ų | 131.9 | 83% | 0.832 | 76% | 0.761 | S | S | * | * | trans | -146.5 | 122.7 | 132.6 | 68.2 | 0 | 0 | 0 | 0 | 113 | ||||
| 50 | V | 37.6 | Very low | 33.8 | Very low | 143 Ų | 143 | 130.6 Ų | 130.6 | 87% | 0.867 | 75% | 0.753 | S | S | * | * | trans | -65.6 | 159.7 | 152.1 | -54.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 51 | G | 31.7 | Very low | 33.6 | Very low | 62 Ų | 62 | 136 Ų | 136 | 64% | 0.639 | 76% | 0.763 | S | S | * | * | cis | 136.5 | 113.7 | 24 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 52 | S | 36.1 | Very low | 33.6 | Very low | 101 Ų | 101 | 136.8 Ų | 136.8 | 71% | 0.706 | 77% | 0.769 | S | S | * | * | trans | 87.8 | 131.5 | 136.2 | -39.5 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 53 | Y | 31.8 | Very low | 33.8 | Very low | 223 Ų | 223 | 135.1 Ų | 135.1 | 88% | 0.875 | 77% | 0.773 | S | S | * | * | trans | 63.9 | 150.9 | 139.9 | 81.4 | -113.9 | 0 | 0 | 0 | 118.8 | ||||
| 54 | S | 29.7 | Very low | 34.3 | Very low | 76 Ų | 76 | 136 Ų | 136 | 53% | 0.531 | 78% | 0.776 | S | S | . | * | cis | -173.8 | 145.9 | 16.9 | -172.5 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 55 | R | 30.1 | Very low | 34.8 | Very low | 210 Ų | 210 | 135.3 Ų | 135.3 | 79% | 0.792 | 79% | 0.785 | S | S | * | * | trans | 49.2 | 140.9 | 135.5 | -70.6 | -175.9 | -126.9 | -165 | 5.2 | 120 | ||||
| 56 | K | 33 | Very low | 34.8 | Very low | 175 Ų | 175 | 137.3 Ų | 137.3 | 76% | 0.761 | 78% | 0.784 | S | S | * | * | cis | 174.1 | 152.5 | 43 | -123 | 164.6 | -168.6 | -168.3 | 0 | 109.7 | ||||
| 57 | S | 31.6 | Very low | 35.4 | Very low | 115 Ų | 115 | 137.3 Ų | 137.3 | 80% | 0.804 | 78% | 0.776 | S | S | * | * | trans | 66.4 | 141.7 | 130.8 | -159.8 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 58 | A | 35.8 | Very low | 35.7 | Very low | 79 Ų | 79 | 139.6 Ų | 139.6 | 65% | 0.653 | 78% | 0.78 | S | S | * | * | cis | -178.3 | 179.3 | -5.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 59 | R | 34 | Very low | 36.4 | Very low | 240 Ų | 240 | 138.9 Ų | 138.9 | 91% | 0.906 | 77% | 0.768 | S | S | * | * | trans | 95.7 | 144.2 | 157.3 | -58.5 | 179.8 | 177.5 | 177.6 | -1.1 | 115.3 | ||||
| 60 | S | 32.6 | Very low | 37.4 | Very low | 95 Ų | 95 | 141 Ų | 141 | 66% | 0.664 | 77% | 0.769 | S | S | * | * | cis | 171.6 | 140.8 | -15.3 | -88.9 | 0 | 0 | 0 | 0 | 103.2 | ||||
| 61 | F | 32.2 | Very low | 38.3 | Very low | 218 Ų | 218 | 138.7 Ų | 138.7 | 96% | 0.956 | 76% | 0.755 | S | S | * | * | trans | -165.5 | 158.1 | 147 | -91.5 | -62.2 | 0 | 0 | 0 | 111.7 | ||||
| 62 | S | 34.8 | Very low | 39.3 | Very low | 112 Ų | 112 | 142.1 Ų | 142.1 | 78% | 0.783 | 76% | 0.755 | S | S | * | * | trans | -88.8 | 164.4 | -157 | 50.1 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 63 | A | 41 | Very low | 40.2 | Very low | 89 Ų | 89 | 141 Ų | 141 | 74% | 0.736 | 75% | 0.747 | S | S | * | * | trans | -62.5 | 174.2 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 64 | P | 44.2 | Very low | 41.5 | Very low | 125 Ų | 125 | 133.7 Ų | 133.7 | 81% | 0.812 | 73% | 0.729 | S | S | * | * | -141.8 | 153.4 | 75.3 | 33.9 | -14.3 | 0 | 0 | 0 | 117 | |||||
| 65 | L | 47.6 | Very low | 43 | Very low | 162 Ų | 162 | 135 Ų | 135 | 85% | 0.848 | 73% | 0.729 | S | S | * | * | trans | 0.1 | 124.7 | 146.5 | -157.9 | 82.5 | 0 | 0 | 0 | 118.1 | ||||
| 66 | E | 34.6 | Very low | 44.4 | Very low | 193 Ų | 193 | 129.8 Ų | 129.8 | 90% | 0.902 | 72% | 0.716 | S | S | * | * | -159.6 | 143.1 | 128.5 | -84.7 | -135.5 | 146.8 | 0 | 0 | 110 | |||||
| 67 | A | 45.8 | Very low | 45.9 | Very low | 80 Ų | 80 | 125.9 Ų | 125.9 | 66% | 0.661 | 70% | 0.703 | S | S | * | * | trans | -71.1 | 142.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 68 | F | 42.1 | Very low | 47.6 | Very low | 208 Ų | 208 | 125.1 Ų | 125.1 | 91% | 0.912 | 69% | 0.691 | S | S | * | * | 163.5 | 145.6 | 126.9 | -102.7 | -96.2 | 0 | 0 | 0 | 111.6 | |||||
| 69 | D | 46.9 | Very low | 49.2 | Very low | 91 Ų | 91 | 126.4 Ų | 126.4 | 49% | 0.487 | 68% | 0.683 | S | S | . | * | trans | 80 | 88.4 | 162.7 | -151.4 | -0.1 | 0 | 0 | 0 | 120 | T71 | D69-T71 PolarHBondContact O-N 2.92Å; D69-T71 PolarHBondContact OD1-N 3.26Å; D69-T71 PolarHBondContact OD1-OG1 3.43Å | ||
| 70 | L | 52.1 | Low | 51.1 | Low | 163 Ų | 163 | 122.5 Ų | 122.5 | 85% | 0.853 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | 3.8 | 178.6 | -136.8 | 70.2 | 0 | 0 | 0 | 114.2 | ||
| 71 | T | 56.4 | Low | 53.2 | Low | 95 Ų | 95 | 124 Ų | 124 | 58% | 0.583 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.2 | -20.1 | -178.4 | 60.1 | 0 | 0 | 0 | 0 | 114.8 | D69 S74 | D69-T71 PolarHBondContact O-N 2.92Å; D69-T71 PolarHBondContact OD1-N 3.26Å; D69-T71 PolarHBondContact OD1-OG1 3.43Å; T71-S74 PolarHBondContact O-OG 3.45Å |
| 72 | Q | 53.1 | Low | 55.3 | Low | 134 Ų | 134 | 118.6 Ų | 118.6 | 63% | 0.626 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.2 | -29.2 | 172.2 | -93.2 | -171.2 | 45.2 | 0 | 0 | 114.2 | S74 I75 L76 | Q72-S74 PolarHBondContact O-N 3.49Å; Q72-I75 PolarHBondContact O-N 2.88Å; Q72-L76 PolarHBondContact O-N 3.36Å |
| 73 | S | 53.9 | Low | 57.4 | Low | 77 Ų | 77 | 117.9 Ų | 117.9 | 54% | 0.538 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -71.3 | -28.9 | -176.9 | -171.8 | 0 | 0 | 0 | 0 | 113.6 | N77 | S73-N77 VanDerWaalsContact O-CB 3.28Å; S73-N77 WeakPolarHBondContact O-CB 3.18Å; S73-N77 PolarHBondContact O-N 2.89Å; S73-N77 VanDerWaalsContact O-N 3.1Å |
| 74 | S | 59 | Low | 59.3 | Low | 71 Ų | 71 | 122 Ų | 122 | 50% | 0.497 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -69.5 | -34.9 | 176.7 | 59.6 | 0 | 0 | 0 | 0 | 112.4 | T71 Q72 N78 | T71-S74 PolarHBondContact O-OG 3.45Å; Q72-S74 PolarHBondContact O-N 3.49Å; S74-N78 WeakPolarHBondContact O-CB 3.24Å; S74-N78 PolarHBondContact O-N 3.49Å; S74-N78 VanDerWaalsContact O-N 3.1Å |
| 75 | I | 61.3 | Low | 61.1 | Low | 103 Ų | 103 | 120 Ų | 120 | 53% | 0.528 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -70.5 | -48.1 | 178.6 | -60.5 | 174.5 | 0 | 0 | 0 | 110.1 | Q72 N77 N78 E79 | Q72-I75 PolarHBondContact O-N 2.88Å; I75-N77 VanDerWaalsContact C-N 3.35Å; I75-N77 PolarHBondContact O-N 3.4Å; I75-N78 PolarHBondContact O-N 2.82Å; I75-E79 PolarHBondContact O-N 3.49Å |
| 76 | L | 60.5 | Low | 62.7 | Low | 101 Ų | 101 | 116.1 Ų | 116.1 | 53% | 0.529 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -64.7 | -34.3 | 177.8 | -65.7 | 173.9 | 0 | 0 | 0 | 113.2 | Q72 Y80 | Q72-L76 PolarHBondContact O-N 3.36Å; L76-Y80 WeakPolarHBondContact O-CB 3.11Å; L76-Y80 PolarHBondContact O-N 2.8Å |
| 77 | N | 64.8 | Low | 65.1 | Low | 92 Ų | 92 | 112.3 Ų | 112.3 | 49% | 0.492 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -72.3 | -34.6 | 175.9 | -164.6 | -23.4 | 0 | 0 | 0 | 112 | S73 I75 Y80 K81 | S73-N77 VanDerWaalsContact O-CB 3.28Å; S73-N77 WeakPolarHBondContact O-CB 3.18Å; S73-N77 PolarHBondContact O-N 2.89Å; S73-N77 VanDerWaalsContact O-N 3.1Å; I75-N77 VanDerWaalsContact C-N 3.35Å; I75-N77 PolarHBondContact O-N 3.4Å; N77-Y80 PolarHBondContact O-N 3.2Å; N77-K81 WeakPolarHBondContact O-CG 3.28Å; N77-K81 PolarHBondContact O-N 3.28Å |
| 78 | N | 66.6 | Low | 67 | Low | 100 Ų | 100 | 115.6 Ų | 115.6 | 54% | 0.535 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -69 | -41.8 | 173.8 | -127.8 | 17.1 | 0 | 0 | 0 | 111.5 | S74 I75 Y80 K81 I82 | S74-N78 WeakPolarHBondContact O-CB 3.24Å; S74-N78 PolarHBondContact O-N 3.49Å; S74-N78 VanDerWaalsContact O-N 3.1Å; I75-N78 PolarHBondContact O-N 2.82Å; N78-Y80 PolarHBondContact O-N 2.9Å; N78-K81 PolarHBondContact O-N 3.28Å; N78-I82 VanDerWaalsContact O-CG1 3.3Å; N78-I82 WeakPolarHBondContact O-CG1 3.48Å; N78-I82 PolarHBondContact O-N 3.26Å |
| 79 | E | 70 | Confident | 69 | Low | 105 Ų | 105 | 112.2 Ų | 112.2 | 49% | 0.491 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -60.3 | -42.7 | 172.3 | -74 | -174.9 | 163.6 | 0 | 0 | 111.9 | I75 K81 I82 I83 | I75-E79 PolarHBondContact O-N 3.49Å; E79-K81 VanDerWaalsContact C-N 3.33Å; E79-K81 PolarHBondContact O-N 3.33Å; E79-I82 PolarHBondContact O-N 2.93Å; E79-I83 VanDerWaalsContact O-CG1 3.27Å; E79-I83 WeakPolarHBondContact O-CG1 3.39Å; E79-I83 PolarHBondContact O-N 2.78Å |
| 80 | Y | 73.6 | Confident | 70.8 | Confident | 158 Ų | 158 | 113.4 Ų | 113.4 | 62% | 0.62 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -63.4 | -35.6 | 175.5 | -117.6 | -85.7 | 0 | 0 | 0 | 113.6 | L76 N77 N78 R84 | L76-Y80 WeakPolarHBondContact O-CB 3.11Å; L76-Y80 PolarHBondContact O-N 2.8Å; N77-Y80 PolarHBondContact O-N 3.2Å; N78-Y80 PolarHBondContact O-N 2.9Å; Y80-R84 WeakPolarHBondContact O-CB 3.12Å; Y80-R84 PolarHBondContact O-N 2.95Å |
| 81 | K | 76.5 | Confident | 72.5 | Confident | 126 Ų | 126 | 111.1 Ų | 111.1 | 55% | 0.548 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -66.7 | -43.1 | 173.9 | -78.2 | 177.8 | -177.3 | 177.5 | 0 | 111.3 | N77 N78 E79 R84 T85 | N77-K81 WeakPolarHBondContact O-CG 3.28Å; N77-K81 PolarHBondContact O-N 3.28Å; N78-K81 PolarHBondContact O-N 3.28Å; E79-K81 VanDerWaalsContact C-N 3.33Å; E79-K81 PolarHBondContact O-N 3.33Å; K81-R84 PolarHBondContact O-N 2.9Å; K81-T85 WeakPolarHBondContact O-CG2 3.34Å; K81-T85 PolarHBondContact O-N 3.5Å; K81-T85 PolarHBondContact O-OG1 2.96Å; K81-T85 VanDerWaalsContact O-OG1 3.05Å |
| 82 | I | 76.3 | Confident | 73.9 | Confident | 105 Ų | 105 | 111.9 Ų | 111.9 | 54% | 0.538 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63 | -43.6 | 177.1 | -66.5 | 164.4 | 0 | 0 | 0 | 110.7 | N78 E79 T85 N86 | N78-I82 VanDerWaalsContact O-CG1 3.3Å; N78-I82 WeakPolarHBondContact O-CG1 3.48Å; N78-I82 PolarHBondContact O-N 3.26Å; E79-I82 PolarHBondContact O-N 2.93Å; I82-T85 VanDerWaalsContact CA-OG1 3.31Å; I82-T85 WeakPolarHBondContact CA-OG1 3.24Å; I82-T85 PolarHBondContact O-N 2.82Å; I82-T85 PolarHBondContact O-OG1 3.05Å; I82-N86 VanDerWaalsContact O-CB 3.28Å; I82-N86 WeakPolarHBondContact O-CB 3.24Å; I82-N86 PolarHBondContact O-N 3.31Å |
| 83 | I | 78.8 | Confident | 75.6 | Confident | 98 Ų | 98 | 106.9 Ų | 106.9 | 50% | 0.503 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63 | -44.7 | 176 | -66.7 | 164.1 | 0 | 0 | 0 | 110.6 | E79 T85 N86 E87 | E79-I83 VanDerWaalsContact O-CG1 3.27Å; E79-I83 WeakPolarHBondContact O-CG1 3.39Å; E79-I83 PolarHBondContact O-N 2.78Å; I83-T85 PolarHBondContact O-N 3.45Å; I83-N86 PolarHBondContact O-N 3.31Å; I83-E87 VanDerWaalsContact O-CB 3.31Å; I83-E87 WeakPolarHBondContact O-CB 3.35Å; I83-E87 PolarHBondContact O-N 3.44Å |
| 84 | R | 81.1 | Confident | 77.3 | Confident | 174 Ų | 174 | 107.1 Ų | 107.1 | 66% | 0.657 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.4 | -38 | 175.6 | -102.4 | -164.9 | -173.2 | 125.8 | 0.4 | 113.5 | Y80 K81 K88 | Y80-R84 WeakPolarHBondContact O-CB 3.12Å; Y80-R84 PolarHBondContact O-N 2.95Å; K81-R84 PolarHBondContact O-N 2.9Å; R84-K88 WeakPolarHBondContact O-CB 3.03Å; R84-K88 PolarHBondContact O-N 2.88Å |
| 85 | T | 81.7 | Confident | 78.8 | Confident | 85 Ų | 85 | 108.8 Ų | 108.8 | 52% | 0.521 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -68.8 | -39.5 | 177 | 47.9 | 0 | 0 | 0 | 0 | 110.9 | K81 I82 I83 K88 E89 | K81-T85 WeakPolarHBondContact O-CG2 3.34Å; K81-T85 PolarHBondContact O-N 3.5Å; K81-T85 PolarHBondContact O-OG1 2.96Å; K81-T85 VanDerWaalsContact O-OG1 3.05Å; I82-T85 VanDerWaalsContact CA-OG1 3.31Å; I82-T85 WeakPolarHBondContact CA-OG1 3.24Å; I82-T85 PolarHBondContact O-N 2.82Å; I82-T85 PolarHBondContact O-OG1 3.05Å; I83-T85 PolarHBondContact O-N 3.45Å; T85-K88 PolarHBondContact O-N 2.87Å; T85-E89 WeakPolarHBondContact O-CB 3.41Å; T85-E89 PolarHBondContact O-N 3.36Å |
| 86 | N | 82.7 | Confident | 80.2 | Confident | 79 Ų | 79 | 108 Ų | 108 | 42% | 0.422 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.6 | -43.7 | 174.7 | -173 | 13.7 | 0 | 0 | 0 | 111.5 | I82 I83 K88 E89 Q90 | I82-N86 VanDerWaalsContact O-CB 3.28Å; I82-N86 WeakPolarHBondContact O-CB 3.24Å; I82-N86 PolarHBondContact O-N 3.31Å; I83-N86 PolarHBondContact O-N 3.31Å; N86-K88 VanDerWaalsContact C-N 3.33Å; N86-K88 PolarHBondContact O-N 3.41Å; N86-E89 PolarHBondContact O-N 2.85Å; N86-Q90 WeakPolarHBondContact O-CB 3.49Å; N86-Q90 VanDerWaalsContact O-CG 3.29Å; N86-Q90 WeakPolarHBondContact O-CG 3.21Å; N86-Q90 PolarHBondContact O-N 3.5Å; N86-Q90 PolarHBondContact OD1-NE2 3.11Å; N86-Q90 VanDerWaalsContact OD1-NE2 3.14Å |
| 87 | E | 83.1 | Confident | 81.7 | Confident | 113 Ų | 113 | 111.6 Ų | 111.6 | 53% | 0.528 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62 | -40.5 | 173.6 | -172.3 | -176.4 | -173.3 | 0 | 0 | 111.2 | I83 Q90 M91 | I83-E87 VanDerWaalsContact O-CB 3.31Å; I83-E87 WeakPolarHBondContact O-CB 3.35Å; I83-E87 PolarHBondContact O-N 3.44Å; E87-Q90 PolarHBondContact O-N 3.46Å; E87-M91 WeakPolarHBondContact O-CB 3.44Å; E87-M91 VanDerWaalsContact O-CG 3.23Å; E87-M91 WeakPolarHBondContact O-CG 3.2Å; E87-M91 PolarHBondContact O-N 3.43Å |
| 88 | K | 85.7 | Confident | 83 | Confident | 150 Ų | 150 | 113.3 Ų | 113.3 | 65% | 0.652 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -64.4 | -40.9 | 174.9 | -175.2 | -177.9 | 177.3 | -172 | 0 | 112 | R84 T85 N86 M91 Q92 | R84-K88 WeakPolarHBondContact O-CB 3.03Å; R84-K88 PolarHBondContact O-N 2.88Å; T85-K88 PolarHBondContact O-N 2.87Å; N86-K88 VanDerWaalsContact C-N 3.33Å; N86-K88 PolarHBondContact O-N 3.41Å; K88-M91 PolarHBondContact O-N 3.42Å; K88-Q92 VanDerWaalsContact O-CB 3.31Å; K88-Q92 WeakPolarHBondContact O-CB 3.34Å; K88-Q92 PolarHBondContact O-N 3.01Å |
| 89 | E | 85.9 | Confident | 84.2 | Confident | 137 Ų | 137 | 111 Ų | 111 | 64% | 0.64 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -67 | -40.3 | 176.1 | -173.2 | 174.5 | -172.9 | 0 | 0 | 111.5 | T85 N86 Q92 G93 | T85-E89 WeakPolarHBondContact O-CB 3.41Å; T85-E89 PolarHBondContact O-N 3.36Å; N86-E89 PolarHBondContact O-N 2.85Å; E89-Q92 PolarHBondContact O-N 3.18Å; E89-G93 PolarHBondContact O-N 2.86Å |
| 90 | Q | 84.4 | Confident | 85.4 | Confident | 116 Ų | 116 | 112.2 Ų | 112.2 | 54% | 0.542 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.8 | -43.6 | 172.5 | -71.5 | 175.7 | 22 | 0 | 0 | 111.9 | N86 E87 Q92 G93 L94 | N86-Q90 WeakPolarHBondContact O-CB 3.49Å; N86-Q90 VanDerWaalsContact O-CG 3.29Å; N86-Q90 WeakPolarHBondContact O-CG 3.21Å; N86-Q90 PolarHBondContact O-N 3.5Å; N86-Q90 PolarHBondContact OD1-NE2 3.11Å; N86-Q90 VanDerWaalsContact OD1-NE2 3.14Å; E87-Q90 PolarHBondContact O-N 3.46Å; Q90-Q92 VanDerWaalsContact C-N 3.31Å; Q90-Q92 PolarHBondContact O-N 3.38Å; Q90-G93 PolarHBondContact O-N 2.83Å; Q90-L94 WeakPolarHBondContact O-CB 3.27Å; Q90-L94 WeakPolarHBondContact O-CG 3.45Å; Q90-L94 PolarHBondContact O-N 3.2Å |
| 91 | M | 86.4 | Confident | 86.4 | Confident | 115 Ų | 115 | 110.9 Ų | 110.9 | 57% | 0.567 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -64.7 | -36 | 175 | -74.5 | -60.4 | -63.7 | 0 | 0 | 112 | E87 K88 L94 N95 | E87-M91 WeakPolarHBondContact O-CB 3.44Å; E87-M91 VanDerWaalsContact O-CG 3.23Å; E87-M91 WeakPolarHBondContact O-CG 3.2Å; E87-M91 PolarHBondContact O-N 3.43Å; K88-M91 PolarHBondContact O-N 3.42Å; M91-L94 HydrophobicContact SD-CD1 4.3Å; M91-N95 VanDerWaalsContact O-CB 3.26Å; M91-N95 WeakPolarHBondContact O-CB 3.46Å; M91-N95 PolarHBondContact O-N 2.89Å |
| 92 | Q | 86.5 | Confident | 87.2 | Confident | 111 Ų | 111 | 110.4 Ų | 110.4 | 52% | 0.519 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -67.1 | -46.4 | 173.7 | -173.8 | 171.5 | -10.4 | 0 | 0 | 111.1 | K88 E89 Q90 L94 N95 D96 | K88-Q92 VanDerWaalsContact O-CB 3.31Å; K88-Q92 WeakPolarHBondContact O-CB 3.34Å; K88-Q92 PolarHBondContact O-N 3.01Å; E89-Q92 PolarHBondContact O-N 3.18Å; Q90-Q92 VanDerWaalsContact C-N 3.31Å; Q90-Q92 PolarHBondContact O-N 3.38Å; Q92-L94 VanDerWaalsContact C-N 3.31Å; Q92-L94 PolarHBondContact O-N 3.42Å; Q92-N95 CarbonylContact O-C 3.58Å; Q92-N95 WeakPolarHBondContact O-CB 3.47Å; Q92-N95 PolarHBondContact O-N 3.34Å; Q92-N95 VanDerWaalsContact O-N 3.08Å; Q92-D96 VanDerWaalsContact O-CG 3.26Å; Q92-D96 PolarHBondContact O-N 2.89Å |
| 93 | G | 89.1 | Confident | 88.1 | Confident | 29 Ų | 29 | 111.2 Ų | 111.2 | 30% | 0.299 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.3 | -34.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | E89 Q90 R97 | E89-G93 PolarHBondContact O-N 2.86Å; Q90-G93 PolarHBondContact O-N 2.83Å; G93-R97 VanDerWaalsContact O-CG 3.24Å; G93-R97 WeakPolarHBondContact O-CG 3.26Å; G93-R97 PolarHBondContact O-N 2.84Å; G93-R97 VanDerWaalsContact O-N 3.14Å |
| 94 | L | 88.9 | Confident | 88.9 | Confident | 81 Ų | 81 | 113 Ų | 113 | 42% | 0.424 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -67.5 | -42.9 | 170.3 | -74 | 173 | 0 | 0 | 0 | 111.4 | Q90 M91 Q92 R97 F98 | Q90-L94 WeakPolarHBondContact O-CB 3.27Å; Q90-L94 WeakPolarHBondContact O-CG 3.45Å; Q90-L94 PolarHBondContact O-N 3.2Å; M91-L94 HydrophobicContact SD-CD1 4.3Å; Q92-L94 VanDerWaalsContact C-N 3.31Å; Q92-L94 PolarHBondContact O-N 3.42Å; L94-R97 PolarHBondContact O-N 2.84Å; L94-F98 HydrophobicContact CB-CE2 4.49Å; L94-F98 WeakPolarHBondContact O-CD2 3.31Å; L94-F98 PolarHBondContact O-N 3.4Å |
| 95 | N | 90.5 | Very high | 89.6 | Confident | 106 Ų | 106 | 107 Ų | 107 | 57% | 0.567 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -65.9 | -39.2 | 178.7 | -159.5 | 8.5 | 0 | 0 | 0 | 112.1 | M91 Q92 R97 F98 A99 | M91-N95 VanDerWaalsContact O-CB 3.26Å; M91-N95 WeakPolarHBondContact O-CB 3.46Å; M91-N95 PolarHBondContact O-N 2.89Å; Q92-N95 CarbonylContact O-C 3.58Å; Q92-N95 WeakPolarHBondContact O-CB 3.47Å; Q92-N95 PolarHBondContact O-N 3.34Å; Q92-N95 VanDerWaalsContact O-N 3.08Å; N95-R97 VanDerWaalsContact C-N 3.35Å; N95-R97 PolarHBondContact O-N 3.4Å; N95-F98 CarbonylContact O-C 3.58Å; N95-F98 PolarHBondContact O-N 3.42Å; N95-A99 WeakPolarHBondContact O-CB 3.37Å; N95-A99 PolarHBondContact O-N 3.43Å |
| 96 | D | 91.4 | Very high | 90.2 | Very high | 88 Ų | 88 | 111.3 Ų | 111.3 | 47% | 0.471 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.2 | -40.8 | 174.7 | -67.1 | -22.4 | 0 | 0 | 0 | 111 | Q92 A99 M100 | Q92-D96 VanDerWaalsContact O-CG 3.26Å; Q92-D96 PolarHBondContact O-N 2.89Å; D96-A99 PolarHBondContact O-N 2.8Å; D96-M100 WeakPolarHBondContact O-CG 3.39Å; D96-M100 PolarHBondContact O-N 2.95Å |
| 97 | R | 91.5 | Very high | 90.9 | Very high | 176 Ų | 176 | 111.1 Ų | 111.1 | 66% | 0.664 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.9 | -37.9 | 171.9 | -71.5 | 173.3 | -171.5 | -174.7 | 4.5 | 112.3 | G93 L94 N95 M100 F101 | G93-R97 VanDerWaalsContact O-CG 3.24Å; G93-R97 WeakPolarHBondContact O-CG 3.26Å; G93-R97 PolarHBondContact O-N 2.84Å; G93-R97 VanDerWaalsContact O-N 3.14Å; L94-R97 PolarHBondContact O-N 2.84Å; N95-R97 VanDerWaalsContact C-N 3.35Å; N95-R97 PolarHBondContact O-N 3.4Å; R97-M100 PolarHBondContact O-N 3.44Å; R97-F101 WeakPolarHBondContact O-CB 3.4Å; R97-F101 PolarHBondContact O-N 3.47Å |
| 98 | F | 92.4 | Very high | 91.4 | Very high | 127 Ų | 127 | 110 Ų | 110 | 56% | 0.557 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -66.6 | -40.8 | 174.1 | -80.7 | -58.6 | 0 | 0 | 0 | 111.9 | L94 N95 F101 I102 | L94-F98 HydrophobicContact CB-CE2 4.49Å; L94-F98 WeakPolarHBondContact O-CD2 3.31Å; L94-F98 PolarHBondContact O-N 3.4Å; N95-F98 CarbonylContact O-C 3.58Å; N95-F98 PolarHBondContact O-N 3.42Å; F98-F101 PolarHBondContact O-N 2.91Å; F98-I102 VanDerWaalsContact O-CG1 3.29Å; F98-I102 WeakPolarHBondContact O-CG1 3.25Å; F98-I102 PolarHBondContact O-N 2.85Å |
| 99 | A | 92.3 | Very high | 91.9 | Very high | 52 Ų | 52 | 108.6 Ų | 108.6 | 43% | 0.43 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.5 | -45.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | N95 D96 F101 I102 E103 | N95-A99 WeakPolarHBondContact O-CB 3.37Å; N95-A99 PolarHBondContact O-N 3.43Å; D96-A99 PolarHBondContact O-N 2.8Å; A99-F101 VanDerWaalsContact C-N 3.31Å; A99-F101 PolarHBondContact O-N 3.5Å; A99-I102 PolarHBondContact O-N 2.87Å; A99-E103 WeakPolarHBondContact O-CB 3.37Å; A99-E103 PolarHBondContact O-N 3.47Å |
| 100 | M | 93.5 | Very high | 92.4 | Very high | 131 Ų | 131 | 108 Ų | 108 | 65% | 0.645 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -60.5 | -38.7 | 172.5 | -74.3 | 175.6 | 47.8 | 0 | 0 | 112.6 | D96 R97 K104 | D96-M100 WeakPolarHBondContact O-CG 3.39Å; D96-M100 PolarHBondContact O-N 2.95Å; R97-M100 PolarHBondContact O-N 3.44Å; M100-K104 WeakPolarHBondContact O-CB 3.23Å; M100-K104 PolarHBondContact O-N 3.01Å |
| 101 | F | 95.6 | Very high | 92.9 | Very high | 129 Ų | 129 | 108.4 Ų | 108.4 | 57% | 0.566 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -67.1 | -42.4 | 176.4 | -174.3 | -98.1 | 0 | 0 | 0 | 111.6 | R97 F98 A99 K104 V105 | R97-F101 WeakPolarHBondContact O-CB 3.4Å; R97-F101 PolarHBondContact O-N 3.47Å; F98-F101 PolarHBondContact O-N 2.91Å; A99-F101 VanDerWaalsContact C-N 3.31Å; A99-F101 PolarHBondContact O-N 3.5Å; F101-K104 PolarHBondContact O-N 2.76Å; F101-V105 HydrophobicContact CD1-CG2 3.99Å; F101-V105 HydrophobicContact CE1-CG2 3.62Å; F101-V105 HydrophobicContact CZ-CG2 3.92Å; F101-V105 VanDerWaalsContact O-CG2 3.31Å; F101-V105 WeakPolarHBondContact O-CG2 3.15Å; F101-V105 PolarHBondContact O-N 3.32Å |
| 102 | I | 93.5 | Very high | 93.3 | Very high | 117 Ų | 117 | 104.7 Ų | 104.7 | 60% | 0.6 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.3 | -43.9 | 175.2 | -69.4 | 167.8 | 0 | 0 | 0 | 110.5 | F98 A99 K104 V105 R106 | F98-I102 VanDerWaalsContact O-CG1 3.29Å; F98-I102 WeakPolarHBondContact O-CG1 3.25Å; F98-I102 PolarHBondContact O-N 2.85Å; A99-I102 PolarHBondContact O-N 2.87Å; I102-K104 VanDerWaalsContact C-N 3.34Å; I102-K104 PolarHBondContact O-N 2.71Å; I102-V105 PolarHBondContact O-N 3.19Å; I102-R106 WeakPolarHBondContact O-CB 3.18Å; I102-R106 PolarHBondContact O-N 3.43Å |
| 103 | E | 94.7 | Very high | 93.8 | Very high | 122 Ų | 122 | 106.3 Ų | 106.3 | 57% | 0.57 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.5 | -41.9 | 176 | -171.9 | 171.1 | -160.5 | 0 | 0 | 111.3 | A99 R106 N107 | A99-E103 WeakPolarHBondContact O-CB 3.37Å; A99-E103 PolarHBondContact O-N 3.47Å; E103-R106 PolarHBondContact O-N 2.83Å; E103-N107 WeakPolarHBondContact O-CB 3.06Å; E103-N107 PolarHBondContact O-N 3.14Å; E103-N107 PolarHBondContact O-ND2 3.22Å |
| 104 | K | 95.7 | Very high | 94.1 | Very high | 134 Ų | 134 | 108.7 Ų | 108.7 | 58% | 0.583 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.6 | -42.9 | 174.3 | -173 | 173.4 | -177.3 | 177.1 | 0 | 112.5 | M100 F101 I102 N107 L108 | M100-K104 WeakPolarHBondContact O-CB 3.23Å; M100-K104 PolarHBondContact O-N 3.01Å; F101-K104 PolarHBondContact O-N 2.76Å; I102-K104 VanDerWaalsContact C-N 3.34Å; I102-K104 PolarHBondContact O-N 2.71Å; K104-N107 PolarHBondContact O-N 2.9Å; K104-L108 HydrophobicContact CG-CD1 4.12Å; K104-L108 WeakPolarHBondContact O-CB 3.32Å; K104-L108 VanDerWaalsContact O-CG 3.26Å; K104-L108 WeakPolarHBondContact O-CG 3.27Å; K104-L108 PolarHBondContact O-N 3.38Å |
| 105 | V | 95.9 | Very high | 94.4 | Very high | 48 Ų | 48 | 109.5 Ų | 109.5 | 29% | 0.291 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.9 | -45.8 | 175.8 | 169.5 | 0 | 0 | 0 | 0 | 110.2 | F101 I102 N107 L108 E109 | F101-V105 HydrophobicContact CD1-CG2 3.99Å; F101-V105 HydrophobicContact CE1-CG2 3.62Å; F101-V105 HydrophobicContact CZ-CG2 3.92Å; F101-V105 VanDerWaalsContact O-CG2 3.31Å; F101-V105 WeakPolarHBondContact O-CG2 3.15Å; F101-V105 PolarHBondContact O-N 3.32Å; I102-V105 PolarHBondContact O-N 3.19Å; V105-N107 VanDerWaalsContact C-N 3.34Å; V105-N107 PolarHBondContact O-N 2.95Å; V105-L108 CarbonylContact O-C 3.57Å; V105-L108 PolarHBondContact O-N 3.47Å; V105-L108 VanDerWaalsContact O-N 3.14Å; V105-E109 HydrophobicContact CG1-CG 4.25Å; V105-E109 WeakPolarHBondContact O-CB 3.41Å; V105-E109 WeakPolarHBondContact O-CG 3.25Å; V105-E109 PolarHBondContact O-N 2.84Å |
| 106 | R | 94.7 | Very high | 94.6 | Very high | 176 Ų | 176 | 110.1 Ų | 110.1 | 66% | 0.664 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.4 | -41.8 | 176.9 | -173.7 | 178 | 176.8 | 160.6 | -0.3 | 112.2 | I102 E103 E109 Q110 | I102-R106 WeakPolarHBondContact O-CB 3.18Å; I102-R106 PolarHBondContact O-N 3.43Å; E103-R106 PolarHBondContact O-N 2.83Å; R106-E109 PolarHBondContact O-N 3.37Å; R106-Q110 WeakPolarHBondContact O-CB 3.17Å; R106-Q110 PolarHBondContact O-N 2.9Å |
| 107 | N | 96.1 | Very high | 94.8 | Very high | 75 Ų | 75 | 110 Ų | 110 | 40% | 0.401 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63 | -43.5 | 174.2 | -71.5 | -17.7 | 0 | 0 | 0 | 111 | E103 K104 V105 Q110 H111 | E103-N107 WeakPolarHBondContact O-CB 3.06Å; E103-N107 PolarHBondContact O-N 3.14Å; E103-N107 PolarHBondContact O-ND2 3.22Å; K104-N107 PolarHBondContact O-N 2.9Å; V105-N107 VanDerWaalsContact C-N 3.34Å; V105-N107 PolarHBondContact O-N 2.95Å; N107-Q110 PolarHBondContact O-N 3.44Å; N107-H111 WeakPolarHBondContact O-CB 3.35Å; N107-H111 PolarHBondContact O-CD2 3.33Å; N107-H111 PolarHBondContact O-N 3.46Å |
| 108 | L | 95.6 | Very high | 94.9 | Very high | 89 Ų | 89 | 106.7 Ų | 106.7 | 47% | 0.466 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.3 | -36.9 | 176.2 | -73.4 | 167.7 | 0 | 0 | 0 | 112.7 | K104 V105 N112 | K104-L108 HydrophobicContact CG-CD1 4.12Å; K104-L108 WeakPolarHBondContact O-CB 3.32Å; K104-L108 VanDerWaalsContact O-CG 3.26Å; K104-L108 WeakPolarHBondContact O-CG 3.27Å; K104-L108 PolarHBondContact O-N 3.38Å; V105-L108 CarbonylContact O-C 3.57Å; V105-L108 PolarHBondContact O-N 3.47Å; V105-L108 VanDerWaalsContact O-N 3.14Å; L108-N112 VanDerWaalsContact O-CB 3.29Å; L108-N112 WeakPolarHBondContact O-CB 3.43Å; L108-N112 PolarHBondContact O-N 2.86Å; L108-N112 PolarHBondContact O-ND2 3.16Å |
| 109 | E | 94.6 | Very high | 94.9 | Very high | 122 Ų | 122 | 104.4 Ų | 104.4 | 57% | 0.57 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -65 | -43.9 | 173.6 | -75.7 | 174.7 | 170.6 | 0 | 0 | 111 | V105 R106 N112 K113 | V105-E109 HydrophobicContact CG1-CG 4.25Å; V105-E109 WeakPolarHBondContact O-CB 3.41Å; V105-E109 WeakPolarHBondContact O-CG 3.25Å; V105-E109 PolarHBondContact O-N 2.84Å; R106-E109 PolarHBondContact O-N 3.37Å; E109-N112 PolarHBondContact O-N 2.83Å; E109-K113 WeakPolarHBondContact O-CB 3.37Å; E109-K113 PolarHBondContact O-N 2.92Å |
| 110 | Q | 96.2 | Very high | 94.9 | Very high | 124 Ų | 124 | 106.2 Ų | 106.2 | 58% | 0.579 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64 | -44.4 | 175.6 | -174.3 | 172.8 | -6.4 | 0 | 0 | 111.4 | R106 N107 K113 V114 | R106-Q110 WeakPolarHBondContact O-CB 3.17Å; R106-Q110 PolarHBondContact O-N 2.9Å; N107-Q110 PolarHBondContact O-N 3.44Å; Q110-K113 PolarHBondContact O-N 3.38Å; Q110-V114 WeakPolarHBondContact O-CG2 3.4Å; Q110-V114 PolarHBondContact O-N 3.15Å |
| 111 | H | 95.5 | Very high | 94.7 | Very high | 125 Ų | 125 | 102.5 Ų | 102.5 | 58% | 0.579 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62 | -43.4 | 174.2 | -82.5 | -66.4 | 0 | 0 | 0 | 112.1 | N107 K113 V114 L115 | N107-H111 WeakPolarHBondContact O-CB 3.35Å; N107-H111 PolarHBondContact O-CD2 3.33Å; N107-H111 PolarHBondContact O-N 3.46Å; H111-K113 VanDerWaalsContact C-N 3.31Å; H111-K113 PolarHBondContact O-N 2.91Å; H111-V114 PolarHBondContact O-N 2.87Å; H111-L115 WeakPolarHBondContact O-CG 3.42Å; H111-L115 PolarHBondContact O-N 3.34Å |
| 112 | N | 95.1 | Very high | 94.3 | Very high | 37 Ų | 37 | 100.4 Ų | 100.4 | 20% | 0.198 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -61 | -41.8 | 175.5 | -76 | -28.1 | 0 | 0 | 0 | 111.5 | R44 L108 E109 V114 L115 E116 | R44-N112 VanDerWaalsContact NH1-CG 3.34Å; R44-N112 PolarHBondContact NH1-ND2 2.85Å; R44-N112 PolarHBondContact NH1-OD1 3.12Å; R44-N112 PolarHBondContact NH2-ND2 3.03Å; R44-N112 PolarHBondContact NH2-OD1 2.72Å; L108-N112 VanDerWaalsContact O-CB 3.29Å; L108-N112 WeakPolarHBondContact O-CB 3.43Å; L108-N112 PolarHBondContact O-N 2.86Å; L108-N112 PolarHBondContact O-ND2 3.16Å; E109-N112 PolarHBondContact O-N 2.83Å; N112-V114 VanDerWaalsContact C-N 3.35Å; N112-V114 PolarHBondContact O-N 2.83Å; N112-L115 PolarHBondContact O-N 2.96Å; N112-E116 WeakPolarHBondContact O-CB 3.35Å; N112-E116 VanDerWaalsContact O-CG 3.29Å; N112-E116 WeakPolarHBondContact O-CG 3.5Å; N112-E116 PolarHBondContact O-N 2.89Å |
| 113 | K | 96.4 | Very high | 93.9 | Very high | 145 Ų | 145 | 101.5 Ų | 101.5 | 63% | 0.63 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.3 | -41.9 | 177.4 | -171.9 | 174.9 | -178 | 177.7 | 0 | 111.9 | E109 Q110 H111 E116 T117 | E109-K113 WeakPolarHBondContact O-CB 3.37Å; E109-K113 PolarHBondContact O-N 2.92Å; Q110-K113 PolarHBondContact O-N 3.38Å; H111-K113 VanDerWaalsContact C-N 3.31Å; H111-K113 PolarHBondContact O-N 2.91Å; K113-E116 PolarHBondContact O-N 3.33Å; K113-T117 WeakPolarHBondContact O-CG2 3.22Å; K113-T117 PolarHBondContact O-N 3.45Å; K113-T117 PolarHBondContact O-OG1 2.66Å |
| 114 | V | 96.4 | Very high | 93.4 | Very high | 79 Ų | 79 | 102 Ų | 102 | 48% | 0.479 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.6 | -47.9 | 174.6 | 173.8 | 0 | 0 | 0 | 0 | 110.6 | Q110 H111 N112 E116 T117 E118 | Q110-V114 WeakPolarHBondContact O-CG2 3.4Å; Q110-V114 PolarHBondContact O-N 3.15Å; H111-V114 PolarHBondContact O-N 2.87Å; N112-V114 VanDerWaalsContact C-N 3.35Å; N112-V114 PolarHBondContact O-N 2.83Å; V114-E116 VanDerWaalsContact C-N 3.3Å; V114-E116 PolarHBondContact O-N 2.96Å; V114-T117 WeakPolarHBondContact CA-OG1 3.43Å; V114-T117 PolarHBondContact O-N 3.01Å; V114-T117 VanDerWaalsContact O-N 3.16Å; V114-T117 PolarHBondContact O-OG1 2.91Å; V114-E118 WeakPolarHBondContact O-CB 3.34Å; V114-E118 PolarHBondContact O-N 3.39Å |
| 115 | L | 95.4 | Very high | 92.7 | Very high | 98 Ų | 98 | 105.3 Ų | 105.3 | 51% | 0.513 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.1 | -37.8 | 177.8 | -71.4 | 171.3 | 0 | 0 | 0 | 112.6 | H111 N112 E118 L119 | H111-L115 WeakPolarHBondContact O-CG 3.42Å; H111-L115 PolarHBondContact O-N 3.34Å; N112-L115 PolarHBondContact O-N 2.96Å; L115-E118 PolarHBondContact O-N 3.48Å; L115-L119 WeakPolarHBondContact O-CB 3.19Å; L115-L119 PolarHBondContact O-N 2.89Å |
| 116 | E | 94.6 | Very high | 91.7 | Very high | 118 Ų | 118 | 110.9 Ų | 110.9 | 55% | 0.551 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64 | -44.7 | 174.7 | -77.5 | 171.2 | -175 | 0 | 0 | 111.4 | N112 K113 V114 L119 V120 | N112-E116 WeakPolarHBondContact O-CB 3.35Å; N112-E116 VanDerWaalsContact O-CG 3.29Å; N112-E116 WeakPolarHBondContact O-CG 3.5Å; N112-E116 PolarHBondContact O-N 2.89Å; K113-E116 PolarHBondContact O-N 3.33Å; V114-E116 VanDerWaalsContact C-N 3.3Å; V114-E116 PolarHBondContact O-N 2.96Å; E116-L119 PolarHBondContact O-N 2.82Å; E116-V120 WeakPolarHBondContact O-CG2 3.43Å; E116-V120 PolarHBondContact O-N 3.37Å |
| 117 | T | 94.4 | Very high | 90.7 | Very high | 86 Ų | 86 | 106.3 Ų | 106.3 | 53% | 0.528 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -65.2 | -40.3 | 176.7 | 55.7 | 0 | 0 | 0 | 0 | 112.6 | K113 V114 V120 A121 | K113-T117 WeakPolarHBondContact O-CG2 3.22Å; K113-T117 PolarHBondContact O-N 3.45Å; K113-T117 PolarHBondContact O-OG1 2.66Å; V114-T117 WeakPolarHBondContact CA-OG1 3.43Å; V114-T117 PolarHBondContact O-N 3.01Å; V114-T117 VanDerWaalsContact O-N 3.16Å; V114-T117 PolarHBondContact O-OG1 2.91Å; T117-V120 PolarHBondContact O-N 2.89Å; T117-A121 WeakPolarHBondContact O-CB 3.31Å; T117-A121 PolarHBondContact O-N 2.85Å |
| 118 | E | 94.3 | Very high | 89.6 | Confident | 107 Ų | 107 | 109.6 Ų | 109.6 | 50% | 0.5 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -65 | -42 | 176.3 | -173.3 | 177.6 | -177.3 | 0 | 0 | 111.1 | V114 L115 V120 A121 L122 | V114-E118 WeakPolarHBondContact O-CB 3.34Å; V114-E118 PolarHBondContact O-N 3.39Å; L115-E118 PolarHBondContact O-N 3.48Å; E118-V120 PolarHBondContact O-N 2.71Å; E118-A121 PolarHBondContact O-N 2.92Å; E118-L122 HydrophobicContact CG-CD1 4.22Å; E118-L122 WeakPolarHBondContact O-CB 3.48Å; E118-L122 WeakPolarHBondContact O-CG 3.31Å; E118-L122 PolarHBondContact O-N 3.31Å |
| 119 | L | 91.9 | Very high | 88.3 | Confident | 78 Ų | 78 | 109.7 Ų | 109.7 | 41% | 0.408 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64.6 | -39.6 | 177.3 | -178.7 | 153 | 0 | 0 | 0 | 112.1 | L115 E116 R123 | L115-L119 WeakPolarHBondContact O-CB 3.19Å; L115-L119 PolarHBondContact O-N 2.89Å; E116-L119 PolarHBondContact O-N 2.82Å; L119-R123 VanDerWaalsContact CD2-CZ 3.43Å; L119-R123 VanDerWaalsContact CD2-NH1 3.29Å; L119-R123 WeakPolarHBondContact O-CB 3.36Å; L119-R123 WeakPolarHBondContact O-CG 3.4Å; L119-R123 PolarHBondContact O-N 3.3Å |
| 120 | V | 92.3 | Very high | 87.5 | Confident | 90 Ų | 90 | 107.4 Ų | 107.4 | 55% | 0.545 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -64.7 | -44.9 | 173.7 | 171.2 | 0 | 0 | 0 | 0 | 110.8 | E116 T117 E118 L122 R123 Q124 | E116-V120 WeakPolarHBondContact O-CG2 3.43Å; E116-V120 PolarHBondContact O-N 3.37Å; T117-V120 PolarHBondContact O-N 2.89Å; E118-V120 PolarHBondContact O-N 2.71Å; V120-L122 PolarHBondContact O-N 3.43Å; V120-R123 PolarHBondContact O-N 3.44Å; V120-Q124 PolarHBondContact O-N 3.18Å |
| 121 | A | 89.5 | Confident | 86.8 | Confident | 54 Ų | 54 | 111 Ų | 111 | 45% | 0.446 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -62.7 | -41 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | T117 E118 Q124 R125 | T117-A121 WeakPolarHBondContact O-CB 3.31Å; T117-A121 PolarHBondContact O-N 2.85Å; E118-A121 PolarHBondContact O-N 2.92Å; A121-Q124 PolarHBondContact O-N 3.38Å; A121-R125 PolarHBondContact O-N 3.41Å |
| 122 | L | 87.4 | Confident | 86.3 | Confident | 85 Ų | 85 | 109.5 Ų | 109.5 | 45% | 0.445 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -65.5 | -41.3 | 175.7 | -74.3 | 173.3 | 0 | 0 | 0 | 112.1 | E118 V120 Q124 R125 Q126 | E118-L122 HydrophobicContact CG-CD1 4.22Å; E118-L122 WeakPolarHBondContact O-CB 3.48Å; E118-L122 WeakPolarHBondContact O-CG 3.31Å; E118-L122 PolarHBondContact O-N 3.31Å; V120-L122 PolarHBondContact O-N 3.43Å; L122-Q124 VanDerWaalsContact C-N 3.34Å; L122-R125 PolarHBondContact O-N 2.91Å; L122-Q126 WeakPolarHBondContact O-CG 3.49Å; L122-Q126 PolarHBondContact O-N 2.95Å |
| 123 | R | 85.9 | Confident | 85.9 | Confident | 139 Ų | 139 | 110.3 Ų | 110.3 | 53% | 0.525 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63.5 | -40.1 | 174.4 | -79 | -175.3 | 177.6 | 153.4 | 2 | 112.2 | L119 V120 Q126 A127 | L119-R123 VanDerWaalsContact CD2-CZ 3.43Å; L119-R123 VanDerWaalsContact CD2-NH1 3.29Å; L119-R123 WeakPolarHBondContact O-CB 3.36Å; L119-R123 WeakPolarHBondContact O-CG 3.4Å; L119-R123 PolarHBondContact O-N 3.3Å; V120-R123 PolarHBondContact O-N 3.44Å; R123-Q126 PolarHBondContact O-N 3.49Å; R123-A127 WeakPolarHBondContact O-CB 3.46Å; R123-A127 PolarHBondContact O-N 2.9Å |
| 124 | Q | 83.7 | Confident | 85.5 | Confident | 134 Ų | 134 | 108.3 Ų | 108.3 | 63% | 0.626 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -64.5 | -42.9 | 177 | -169.3 | 171.5 | 8 | 0 | 0 | 111.4 | V120 A121 L122 Q126 A127 E128 | V120-Q124 PolarHBondContact O-N 3.18Å; A121-Q124 PolarHBondContact O-N 3.38Å; L122-Q124 VanDerWaalsContact C-N 3.34Å; Q124-Q126 VanDerWaalsContact C-N 3.32Å; Q124-Q126 PolarHBondContact O-N 2.95Å; Q124-A127 PolarHBondContact O-N 3.03Å; Q124-E128 PolarHBondContact O-N 3.46Å |
| 125 | R | 80.2 | Confident | 85.3 | Confident | 203 Ų | 203 | 109 Ų | 109 | 77% | 0.766 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -65 | -31.8 | 175.6 | -174 | 177.2 | 173.7 | -173.4 | -1.3 | 113.5 | A121 L122 | A121-R125 PolarHBondContact O-N 3.41Å; L122-R125 PolarHBondContact O-N 2.91Å |
| 126 | Q | 75.9 | Confident | 85.2 | Confident | 165 Ų | 165 | 111.2 Ų | 111.2 | 77% | 0.771 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -80.2 | -22.7 | 174.8 | -74 | -179.7 | -2.1 | 0 | 0 | 113.3 | L122 R123 Q124 | L122-Q126 WeakPolarHBondContact O-CG 3.49Å; L122-Q126 PolarHBondContact O-N 2.95Å; R123-Q126 PolarHBondContact O-N 3.49Å; Q124-Q126 VanDerWaalsContact C-N 3.32Å; Q124-Q126 PolarHBondContact O-N 2.95Å |
| 127 | A | 73.5 | Confident | 85.2 | Confident | 80 Ų | 80 | 111.4 Ų | 111.4 | 66% | 0.661 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -79.6 | -20.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | R123 Q124 | R123-A127 WeakPolarHBondContact O-CB 3.46Å; R123-A127 PolarHBondContact O-N 2.9Å; Q124-A127 PolarHBondContact O-N 3.03Å |
| 128 | E | 72.6 | Confident | 85.2 | Confident | 144 Ų | 144 | 111.6 Ų | 111.6 | 67% | 0.673 | 56% | 0.556 | S | S | * | * | S | Bend | trans | -68.1 | 124.9 | 170.7 | -66 | -151.8 | 156 | 0 | 0 | 109.7 | Q124 S130 | Q124-E128 PolarHBondContact O-N 3.46Å; E128-S130 PolarHBondContact O-N 3.38Å |
| 129 | P | 67.4 | Low | 85.3 | Confident | 90 Ų | 90 | 111.2 Ų | 111.2 | 58% | 0.584 | 56% | 0.555 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 131.6 | 174.2 | 21.9 | -29.9 | 0 | 0 | 0 | 108.5 | R131 | P129-R131 PolarHBondContact O-N 2.93Š|
| 130 | S | 77.8 | Confident | 85.6 | Confident | 74 Ų | 74 | 111.5 Ų | 111.5 | 52% | 0.517 | 56% | 0.556 | S | S | . | * | P | Polyproline II helix | trans | -57.5 | 117.8 | 178.6 | 178.9 | 0 | 0 | 0 | 0 | 108.3 | E128 L132 A133 E134 | E128-S130 PolarHBondContact O-N 3.38Å; S130-L132 PolarHBondContact O-N 3.1Å; S130-A133 WeakPolarHBondContact O-CA 3.39Å; S130-A133 VanDerWaalsContact O-CB 3.28Å; S130-A133 WeakPolarHBondContact O-CB 3.34Å; S130-A133 PolarHBondContact O-N 3.34Å; S130-E134 PolarHBondContact O-N 2.94Å |
| 131 | R | 81.9 | Confident | 85.8 | Confident | 200 Ų | 200 | 114.4 Ų | 114.4 | 76% | 0.755 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -46.9 | -31.2 | 174.7 | -179.8 | 178.6 | 174 | -173.8 | -1.1 | 112.4 | P129 E134 L135 | P129-R131 PolarHBondContact O-N 2.93Å; R131-E134 PolarHBondContact O-N 3.14Å; R131-L135 WeakPolarHBondContact O-CG 3.48Å; R131-L135 PolarHBondContact O-N 2.83Å; R131-L135 VanDerWaalsContact O-N 3.1Å |
| 132 | L | 85.1 | Confident | 86.2 | Confident | 94 Ų | 94 | 115.8 Ų | 115.8 | 49% | 0.492 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -66.4 | -39.6 | 175 | -175.8 | 61.9 | 0 | 0 | 0 | 112.8 | S130 E134 L135 Y136 | S130-L132 PolarHBondContact O-N 3.1Å; L132-E134 VanDerWaalsContact C-N 3.34Å; L132-L135 PolarHBondContact O-N 3.02Å; L132-Y136 HydrophobicContact CD1-CD2 4.03Å; L132-Y136 HydrophobicContact CD1-CE2 3.47Å; L132-Y136 VanDerWaalsContact CD1-CE2 3.47Å; L132-Y136 HydrophobicContact CD2-CE2 4.01Å; L132-Y136 HydrophobicContact CG-CD2 3.87Å; L132-Y136 HydrophobicContact CG-CE2 3.49Å; L132-Y136 VanDerWaalsContact CG-CE2 3.49Å; L132-Y136 WeakPolarHBondContact O-CD2 3.38Å; L132-Y136 PolarHBondContact O-N 3.2Å |
| 133 | A | 87.1 | Confident | 86.7 | Confident | 54 Ų | 54 | 116 Ų | 116 | 45% | 0.446 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -65.1 | -38.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | S130 Y136 Q137 | S130-A133 WeakPolarHBondContact O-CA 3.39Å; S130-A133 VanDerWaalsContact O-CB 3.28Å; S130-A133 WeakPolarHBondContact O-CB 3.34Å; S130-A133 PolarHBondContact O-N 3.34Å; A133-Y136 PolarHBondContact O-N 3.44Å; A133-Q137 VanDerWaalsContact O-CB 3.26Å; A133-Q137 WeakPolarHBondContact O-CB 3.42Å; A133-Q137 PolarHBondContact O-N 2.93Å |
| 134 | E | 89 | Confident | 87.3 | Confident | 102 Ų | 102 | 118 Ų | 118 | 48% | 0.477 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64.9 | -42.3 | 175 | -67.7 | -177 | 166.8 | 0 | 0 | 112.2 | S130 R131 L132 Q137 Q138 | S130-E134 PolarHBondContact O-N 2.94Å; R131-E134 PolarHBondContact O-N 3.14Å; L132-E134 VanDerWaalsContact C-N 3.34Å; E134-Q137 PolarHBondContact O-N 2.85Å; E134-Q138 WeakPolarHBondContact O-CB 3.49Å; E134-Q138 PolarHBondContact O-N 3.36Å |
| 135 | L | 92.1 | Very high | 88 | Confident | 93 Ų | 93 | 115.3 Ų | 115.3 | 49% | 0.487 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -61.2 | -47 | 175.1 | -71.2 | 170.8 | 0 | 0 | 0 | 111.5 | R131 L132 Q137 Q138 E139 | R131-L135 WeakPolarHBondContact O-CG 3.48Å; R131-L135 PolarHBondContact O-N 2.83Å; R131-L135 VanDerWaalsContact O-N 3.1Å; L132-L135 PolarHBondContact O-N 3.02Å; L135-Q137 VanDerWaalsContact C-N 3.32Å; L135-Q137 PolarHBondContact O-N 2.9Å; L135-Q138 WeakPolarHBondContact O-CB 3.35Å; L135-Q138 PolarHBondContact O-N 2.76Å; L135-E139 PolarHBondContact O-N 3.22Å |
| 136 | Y | 92.6 | Very high | 88.9 | Confident | 145 Ų | 145 | 110.6 Ų | 110.6 | 57% | 0.569 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -64.5 | -36.5 | 175.3 | -74.5 | -53.8 | 0 | 0 | 0 | 112.6 | L132 A133 Q138 E139 I140 | L132-Y136 HydrophobicContact CD1-CD2 4.03Å; L132-Y136 HydrophobicContact CD1-CE2 3.47Å; L132-Y136 VanDerWaalsContact CD1-CE2 3.47Å; L132-Y136 HydrophobicContact CD2-CE2 4.01Å; L132-Y136 HydrophobicContact CG-CD2 3.87Å; L132-Y136 HydrophobicContact CG-CE2 3.49Å; L132-Y136 VanDerWaalsContact CG-CE2 3.49Å; L132-Y136 WeakPolarHBondContact O-CD2 3.38Å; L132-Y136 PolarHBondContact O-N 3.2Å; A133-Y136 PolarHBondContact O-N 3.44Å; Y136-Q138 VanDerWaalsContact C-N 3.31Å; Y136-E139 PolarHBondContact O-N 3.29Å; Y136-I140 WeakPolarHBondContact O-CB 3.21Å; Y136-I140 WeakPolarHBondContact O-CD1 3.42Å; Y136-I140 WeakPolarHBondContact O-CG1 3.29Å; Y136-I140 PolarHBondContact O-N 3.43Å |
| 137 | Q | 93.8 | Very high | 89.9 | Confident | 122 Ų | 122 | 108.6 Ų | 108.6 | 57% | 0.57 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -70 | -30 | 176.7 | -170.2 | 174.6 | 6.5 | 0 | 0 | 112.3 | A133 E134 L135 R141 | A133-Q137 VanDerWaalsContact O-CB 3.26Å; A133-Q137 WeakPolarHBondContact O-CB 3.42Å; A133-Q137 PolarHBondContact O-N 2.93Å; E134-Q137 PolarHBondContact O-N 2.85Å; L135-Q137 VanDerWaalsContact C-N 3.32Å; L135-Q137 PolarHBondContact O-N 2.9Å; Q137-R141 WeakPolarHBondContact O-CG 3.31Å; Q137-R141 PolarHBondContact O-N 2.93Å; Q137-R141 PolarHBondContact O-NE 3.04Å; Q137-R141 VanDerWaalsContact O-NE 3.09Å |
| 138 | Q | 96 | Very high | 91.1 | Very high | 90 Ų | 90 | 110.8 Ų | 110.8 | 42% | 0.421 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -68 | -50.5 | 169.9 | -179.7 | 174.2 | -9.8 | 0 | 0 | 110.8 | E134 L135 Y136 I140 R141 E142 | E134-Q138 WeakPolarHBondContact O-CB 3.49Å; E134-Q138 PolarHBondContact O-N 3.36Å; L135-Q138 WeakPolarHBondContact O-CB 3.35Å; L135-Q138 PolarHBondContact O-N 2.76Å; Y136-Q138 VanDerWaalsContact C-N 3.31Å; Q138-I140 VanDerWaalsContact C-N 3.3Å; Q138-I140 PolarHBondContact O-N 2.96Å; Q138-R141 WeakPolarHBondContact O-CA 3.32Å; Q138-R141 WeakPolarHBondContact O-CB 3.36Å; Q138-R141 PolarHBondContact O-N 3.11Å; Q138-E142 HydrophobicContact CG-CG 4.48Å; Q138-E142 VanDerWaalsContact CG-OE1 3.24Å; Q138-E142 WeakPolarHBondContact CG-OE1 3.47Å; Q138-E142 PolarHBondContact NE2-OE1 3.35Å; Q138-E142 PolarHBondContact O-N 3.01Å |
| 139 | E | 96.8 | Very high | 92.3 | Very high | 100 Ų | 100 | 109.6 Ų | 109.6 | 47% | 0.467 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -55.2 | -45.1 | 177.3 | -170.7 | 68.4 | -155.8 | 0 | 0 | 111.8 | L135 Y136 R141 E142 L143 | L135-E139 PolarHBondContact O-N 3.22Å; Y136-E139 PolarHBondContact O-N 3.29Å; E139-R141 VanDerWaalsContact C-N 3.28Å; E139-R141 PolarHBondContact O-N 3.5Å; E139-E142 PolarHBondContact O-N 2.76Å; E139-L143 HydrophobicContact CG-CD1 4.14Å; E139-L143 WeakPolarHBondContact O-CB 3.45Å; E139-L143 WeakPolarHBondContact O-CG 3.32Å; E139-L143 PolarHBondContact O-N 3.2Å |
| 140 | I | 96.9 | Very high | 93.8 | Very high | 84 Ų | 84 | 110.5 Ų | 110.5 | 43% | 0.431 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.8 | -36.8 | 177 | -70.2 | 164.6 | 0 | 0 | 0 | 111.5 | Y136 Q138 R144 | Y136-I140 WeakPolarHBondContact O-CB 3.21Å; Y136-I140 WeakPolarHBondContact O-CD1 3.42Å; Y136-I140 WeakPolarHBondContact O-CG1 3.29Å; Y136-I140 PolarHBondContact O-N 3.43Å; Q138-I140 VanDerWaalsContact C-N 3.3Å; Q138-I140 PolarHBondContact O-N 2.96Å; I140-R144 WeakPolarHBondContact O-CB 3.49Å; I140-R144 WeakPolarHBondContact O-CG 3.48Å; I140-R144 PolarHBondContact O-N 3.3Å; I140-R144 VanDerWaalsContact O-N 3.07Å |
| 141 | R | 97.7 | Very high | 94.7 | Very high | 151 Ų | 151 | 111.1 Ų | 111.1 | 57% | 0.57 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -69.5 | -42.2 | 176.9 | -78.9 | 180 | -72.5 | 148.1 | -5.6 | 111.2 | Q137 Q138 E139 R144 S145 | Q137-R141 WeakPolarHBondContact O-CG 3.31Å; Q137-R141 PolarHBondContact O-N 2.93Å; Q137-R141 PolarHBondContact O-NE 3.04Å; Q137-R141 VanDerWaalsContact O-NE 3.09Å; Q138-R141 WeakPolarHBondContact O-CA 3.32Å; Q138-R141 WeakPolarHBondContact O-CB 3.36Å; Q138-R141 PolarHBondContact O-N 3.11Å; E139-R141 VanDerWaalsContact C-N 3.28Å; E139-R141 PolarHBondContact O-N 3.5Å; R141-R144 PolarHBondContact O-N 3.34Å; R141-S145 PolarHBondContact O-N 3.48Å |
| 142 | E | 97.9 | Very high | 95.5 | Very high | 83 Ų | 83 | 103.1 Ų | 103.1 | 39% | 0.388 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.5 | -47.6 | 177.6 | -70.2 | 176 | -164.8 | 0 | 0 | 111 | Q138 E139 R144 S145 Q146 | Q138-E142 HydrophobicContact CG-CG 4.48Å; Q138-E142 VanDerWaalsContact CG-OE1 3.24Å; Q138-E142 WeakPolarHBondContact CG-OE1 3.47Å; Q138-E142 PolarHBondContact NE2-OE1 3.35Å; Q138-E142 PolarHBondContact O-N 3.01Å; E139-E142 PolarHBondContact O-N 2.76Å; E142-R144 VanDerWaalsContact C-N 3.32Å; E142-R144 PolarHBondContact O-N 3.13Å; E142-S145 WeakPolarHBondContact O-CB 3.34Å; E142-S145 PolarHBondContact O-N 2.89Å; E142-S145 VanDerWaalsContact O-N 3.12Å; E142-Q146 WeakPolarHBondContact O-CG 3.43Å; E142-Q146 PolarHBondContact O-N 2.91Å |
| 143 | L | 97.8 | Very high | 96.1 | Very high | 90 Ų | 90 | 103.3 Ų | 103.3 | 47% | 0.471 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.6 | -38.8 | 175.8 | -70.9 | 172.9 | 0 | 0 | 0 | 112.8 | E139 Q146 L147 | E139-L143 HydrophobicContact CG-CD1 4.14Å; E139-L143 WeakPolarHBondContact O-CB 3.45Å; E139-L143 WeakPolarHBondContact O-CG 3.32Å; E139-L143 PolarHBondContact O-N 3.2Å; L143-Q146 PolarHBondContact O-N 2.97Å; L143-L147 WeakPolarHBondContact O-CB 3.33Å; L143-L147 PolarHBondContact O-N 3.49Å |
| 144 | R | 98.1 | Very high | 96.6 | Very high | 180 Ų | 180 | 107.2 Ų | 107.2 | 68% | 0.679 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66.4 | -39.9 | 174.6 | -77.1 | 173.9 | 179.7 | -173.8 | 0.2 | 112.1 | I140 R141 E142 L147 E148 | I140-R144 WeakPolarHBondContact O-CB 3.49Å; I140-R144 WeakPolarHBondContact O-CG 3.48Å; I140-R144 PolarHBondContact O-N 3.3Å; I140-R144 VanDerWaalsContact O-N 3.07Å; R141-R144 PolarHBondContact O-N 3.34Å; E142-R144 VanDerWaalsContact C-N 3.32Å; E142-R144 PolarHBondContact O-N 3.13Å; R144-L147 PolarHBondContact O-N 2.96Å; R144-E148 PolarHBondContact O-N 3.04Å |
| 145 | S | 98.3 | Very high | 97 | Very high | 77 Ų | 77 | 105.2 Ų | 105.2 | 54% | 0.538 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.8 | -44.9 | 176.1 | -168.1 | 0 | 0 | 0 | 0 | 111.3 | R141 E142 L147 E148 E149 | R141-S145 PolarHBondContact O-N 3.48Å; E142-S145 WeakPolarHBondContact O-CB 3.34Å; E142-S145 PolarHBondContact O-N 2.89Å; E142-S145 VanDerWaalsContact O-N 3.12Å; S145-L147 VanDerWaalsContact C-N 3.32Å; S145-L147 PolarHBondContact O-N 3.14Å; S145-E148 PolarHBondContact O-N 2.9Å; S145-E149 WeakPolarHBondContact O-CB 3.5Å; S145-E149 PolarHBondContact O-N 3.12Å |
| 146 | Q | 98.3 | Very high | 97.2 | Very high | 105 Ų | 105 | 106.1 Ų | 106.1 | 49% | 0.491 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.9 | -39 | 176.4 | -71.4 | 175 | -0.9 | 0 | 0 | 112 | E142 L143 E149 L150 | E142-Q146 WeakPolarHBondContact O-CG 3.43Å; E142-Q146 PolarHBondContact O-N 2.91Å; L143-Q146 PolarHBondContact O-N 2.97Å; Q146-E149 PolarHBondContact O-N 3.27Å; Q146-L150 WeakPolarHBondContact O-CB 3.4Å; Q146-L150 VanDerWaalsContact O-CG 3.3Å; Q146-L150 WeakPolarHBondContact O-CG 3.49Å; Q146-L150 PolarHBondContact O-N 2.91Å |
| 147 | L | 98.1 | Very high | 97.4 | Very high | 122 Ų | 122 | 104.4 Ų | 104.4 | 64% | 0.639 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.3 | -40 | 176.9 | -174.1 | 134.3 | 0 | 0 | 0 | 112 | L143 R144 S145 N151 | L143-L147 WeakPolarHBondContact O-CB 3.33Å; L143-L147 PolarHBondContact O-N 3.49Å; R144-L147 PolarHBondContact O-N 2.96Å; S145-L147 VanDerWaalsContact C-N 3.32Å; S145-L147 PolarHBondContact O-N 3.14Å; L147-N151 VanDerWaalsContact O-CB 3.23Å; L147-N151 WeakPolarHBondContact O-CB 3.33Å; L147-N151 PolarHBondContact O-N 3.44Å |
| 148 | E | 98 | Very high | 97.5 | Very high | 126 Ų | 126 | 101.6 Ų | 101.6 | 59% | 0.589 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -66.3 | -43.1 | 175.6 | -170.3 | 61.4 | -150.3 | 0 | 0 | 111.5 | R144 S145 N151 G152 | R144-E148 PolarHBondContact O-N 3.04Å; S145-E148 PolarHBondContact O-N 2.9Å; E148-N151 PolarHBondContact O-N 2.92Å; E148-G152 PolarHBondContact O-N 2.88Å |
| 149 | E | 98.3 | Very high | 97.5 | Very high | 120 Ų | 120 | 102.9 Ų | 102.9 | 56% | 0.561 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.3 | -50.6 | 176.1 | -174.7 | 172.8 | -164.1 | 0 | 0 | 111.3 | S145 Q146 N151 G152 E153 | S145-E149 WeakPolarHBondContact O-CB 3.5Å; S145-E149 PolarHBondContact O-N 3.12Å; Q146-E149 PolarHBondContact O-N 3.27Å; E149-N151 VanDerWaalsContact C-N 3.28Å; E149-N151 PolarHBondContact O-N 2.96Å; E149-G152 WeakPolarHBondContact O-CA 3.27Å; E149-G152 PolarHBondContact O-N 3.03Å; E149-G152 VanDerWaalsContact O-N 3.11Å; E149-E153 WeakPolarHBondContact O-CG 3.47Å; E149-E153 PolarHBondContact O-N 3.19Å |
| 150 | L | 98.1 | Very high | 97.4 | Very high | 109 Ų | 109 | 102.3 Ų | 102.3 | 57% | 0.571 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.3 | -35.6 | 176 | -74.5 | 171.9 | 0 | 0 | 0 | 112.6 | Q146 K154 | Q146-L150 WeakPolarHBondContact O-CB 3.4Å; Q146-L150 VanDerWaalsContact O-CG 3.3Å; Q146-L150 WeakPolarHBondContact O-CG 3.49Å; Q146-L150 PolarHBondContact O-N 2.91Å; L150-K154 WeakPolarHBondContact O-CB 3.37Å; L150-K154 PolarHBondContact O-N 2.87Å |
| 151 | N | 97.8 | Very high | 97.2 | Very high | 87 Ų | 87 | 104.7 Ų | 104.7 | 47% | 0.465 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -70.1 | -37.9 | 176.2 | -169.5 | 58.5 | 0 | 0 | 0 | 111.4 | L147 E148 E149 K154 S155 | L147-N151 VanDerWaalsContact O-CB 3.23Å; L147-N151 WeakPolarHBondContact O-CB 3.33Å; L147-N151 PolarHBondContact O-N 3.44Å; E148-N151 PolarHBondContact O-N 2.92Å; E149-N151 VanDerWaalsContact C-N 3.28Å; E149-N151 PolarHBondContact O-N 2.96Å; N151-K154 PolarHBondContact O-N 3.49Å; N151-S155 WeakPolarHBondContact O-CB 3.48Å; N151-S155 PolarHBondContact O-N 3.05Å; N151-S155 PolarHBondContact O-OG 3.33Å |
| 152 | G | 98.3 | Very high | 97.1 | Very high | 31 Ų | 31 | 100.6 Ų | 100.6 | 32% | 0.32 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.7 | -53.4 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | E148 E149 K154 S155 Q156 | E148-G152 PolarHBondContact O-N 2.88Å; E149-G152 WeakPolarHBondContact O-CA 3.27Å; E149-G152 PolarHBondContact O-N 3.03Å; E149-G152 VanDerWaalsContact O-N 3.11Å; G152-K154 VanDerWaalsContact C-N 3.34Å; G152-K154 PolarHBondContact O-N 3.22Å; G152-S155 PolarHBondContact O-N 3.01Å; G152-S155 VanDerWaalsContact O-N 3.13Å; G152-S155 PolarHBondContact O-OG 3.49Å; G152-Q156 PolarHBondContact O-N 2.93Å |
| 153 | E | 98.2 | Very high | 96.9 | Very high | 98 Ų | 98 | 99.6 Ų | 99.6 | 46% | 0.458 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -57.6 | -45.3 | 176 | -70.5 | -179.1 | 172.5 | 0 | 0 | 111.9 | E149 S155 Q156 L157 | E149-E153 WeakPolarHBondContact O-CG 3.47Å; E149-E153 PolarHBondContact O-N 3.19Å; E153-S155 VanDerWaalsContact C-N 3.33Å; E153-S155 PolarHBondContact O-N 3.3Å; E153-Q156 PolarHBondContact O-N 3.44Å; E153-L157 WeakPolarHBondContact O-CG 3.37Å; E153-L157 PolarHBondContact O-N 3.04Å |
| 154 | K | 97.5 | Very high | 96.6 | Very high | 136 Ų | 136 | 100.2 Ų | 100.2 | 59% | 0.591 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -58.5 | -45 | 175.6 | -179.1 | -176.5 | 176.6 | -175 | 0 | 111.5 | L150 N151 G152 Q156 L157 V158 | L150-K154 WeakPolarHBondContact O-CB 3.37Å; L150-K154 PolarHBondContact O-N 2.87Å; N151-K154 PolarHBondContact O-N 3.49Å; G152-K154 VanDerWaalsContact C-N 3.34Å; G152-K154 PolarHBondContact O-N 3.22Å; K154-Q156 VanDerWaalsContact C-N 3.33Å; K154-L157 PolarHBondContact O-N 3.17Å; K154-V158 VanDerWaalsContact O-CG2 3.3Å; K154-V158 WeakPolarHBondContact O-CG2 3.45Å; K154-V158 PolarHBondContact O-N 3.44Å |
| 155 | S | 96.1 | Very high | 96.2 | Very high | 61 Ų | 61 | 94.4 Ų | 94.4 | 43% | 0.427 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.9 | -39.4 | 178.8 | 73.3 | 0 | 0 | 0 | 0 | 111.9 | N151 G152 E153 V158 I159 | N151-S155 WeakPolarHBondContact O-CB 3.48Å; N151-S155 PolarHBondContact O-N 3.05Å; N151-S155 PolarHBondContact O-OG 3.33Å; G152-S155 PolarHBondContact O-N 3.01Å; G152-S155 VanDerWaalsContact O-N 3.13Å; G152-S155 PolarHBondContact O-OG 3.49Å; E153-S155 VanDerWaalsContact C-N 3.33Å; E153-S155 PolarHBondContact O-N 3.3Å; S155-V158 PolarHBondContact O-N 2.9Å; S155-I159 WeakPolarHBondContact O-CG1 3.41Å; S155-I159 PolarHBondContact O-N 2.95Å |
| 156 | Q | 97.2 | Very high | 95.9 | Very high | 112 Ų | 112 | 94.9 Ų | 94.9 | 52% | 0.523 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.7 | -46.4 | 175.6 | -175.7 | 179.1 | -18.7 | 0 | 0 | 111.6 | G152 E153 K154 V158 I159 E160 | G152-Q156 PolarHBondContact O-N 2.93Å; E153-Q156 PolarHBondContact O-N 3.44Å; K154-Q156 VanDerWaalsContact C-N 3.33Å; Q156-V158 VanDerWaalsContact C-N 3.27Å; Q156-V158 PolarHBondContact O-N 3.36Å; Q156-I159 PolarHBondContact O-N 2.89Å; Q156-I159 VanDerWaalsContact O-N 3.13Å; Q156-E160 PolarHBondContact NE2-OE1 3.16Å; Q156-E160 PolarHBondContact O-N 3.36Å |
| 157 | L | 95.6 | Very high | 95.6 | Very high | 108 Ų | 108 | 93.6 Ų | 93.6 | 57% | 0.565 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61.3 | -34.8 | 177.1 | -72.8 | 173.5 | 0 | 0 | 0 | 112.6 | E153 K154 E160 R161 | E153-L157 WeakPolarHBondContact O-CG 3.37Å; E153-L157 PolarHBondContact O-N 3.04Å; K154-L157 PolarHBondContact O-N 3.17Å; L157-E160 PolarHBondContact O-N 3.39Å; L157-R161 VanDerWaalsContact O-CB 3.28Å; L157-R161 WeakPolarHBondContact O-CB 3.48Å; L157-R161 PolarHBondContact O-N 2.96Å |
| 158 | V | 96.4 | Very high | 95 | Very high | 64 Ų | 64 | 91.7 Ų | 91.7 | 39% | 0.388 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -64.7 | -44.3 | 174.5 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | K154 S155 Q156 R161 D162 | K154-V158 VanDerWaalsContact O-CG2 3.3Å; K154-V158 WeakPolarHBondContact O-CG2 3.45Å; K154-V158 PolarHBondContact O-N 3.44Å; S155-V158 PolarHBondContact O-N 2.9Å; Q156-V158 VanDerWaalsContact C-N 3.27Å; Q156-V158 PolarHBondContact O-N 3.36Å; V158-R161 PolarHBondContact O-N 2.88Å; V158-D162 WeakPolarHBondContact O-CB 3.24Å; V158-D162 PolarHBondContact O-N 3.07Å |
| 159 | I | 95.9 | Very high | 94.6 | Very high | 116 Ų | 116 | 92 Ų | 92 | 60% | 0.595 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -63.3 | -43.8 | 177.1 | -65 | 165.2 | 0 | 0 | 0 | 110.9 | S155 Q156 R161 D162 S163 | S155-I159 WeakPolarHBondContact O-CG1 3.41Å; S155-I159 PolarHBondContact O-N 2.95Å; Q156-I159 PolarHBondContact O-N 2.89Å; Q156-I159 VanDerWaalsContact O-N 3.13Å; I159-R161 VanDerWaalsContact C-N 3.34Å; I159-D162 PolarHBondContact O-N 2.87Å; I159-S163 WeakPolarHBondContact O-CB 3.33Å; I159-S163 PolarHBondContact O-N 2.69Å |
| 160 | E | 95.1 | Very high | 94.2 | Very high | 88 Ų | 88 | 92 Ų | 92 | 41% | 0.411 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63 | -41.5 | 177 | -71.8 | 175.9 | -166.7 | 0 | 0 | 111.6 | Q156 L157 S163 I164 | Q156-E160 PolarHBondContact NE2-OE1 3.16Å; Q156-E160 PolarHBondContact O-N 3.36Å; L157-E160 PolarHBondContact O-N 3.39Å; E160-S163 PolarHBondContact O-N 3.21Å; E160-I164 VanDerWaalsContact O-CG1 3.29Å; E160-I164 WeakPolarHBondContact O-CG1 3.28Å; E160-I164 PolarHBondContact O-N 3.47Å |
| 161 | R | 93.8 | Very high | 93.6 | Very high | 134 Ų | 134 | 92 Ų | 92 | 51% | 0.506 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.6 | -49.1 | 174.1 | -172.4 | -78 | -59.9 | -166.3 | 0.4 | 111 | L157 V158 I159 S163 I164 D165 | L157-R161 VanDerWaalsContact O-CB 3.28Å; L157-R161 WeakPolarHBondContact O-CB 3.48Å; L157-R161 PolarHBondContact O-N 2.96Å; V158-R161 PolarHBondContact O-N 2.88Å; I159-R161 VanDerWaalsContact C-N 3.34Å; R161-S163 VanDerWaalsContact C-N 3.3Å; R161-S163 PolarHBondContact O-N 3.46Å; R161-I164 PolarHBondContact O-N 3.29Å; R161-D165 WeakPolarHBondContact CD-OD2 3.5Å; R161-D165 IonicContact CZ-OD2 2.71Å; R161-D165 IonicContact NE-OD2 3.71Å; R161-D165 IonicContact NH1-OD2 2.76Å; R161-D165 PolarHBondContact NH1-OD2 3.43Å; R161-D165 WeakPolarHBondContact O-CB 3.42Å; R161-D165 PolarHBondContact O-N 2.87Å |
| 162 | D | 94.8 | Very high | 93.1 | Very high | 66 Ų | 66 | 96 Ų | 96 | 35% | 0.353 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.5 | -41.5 | 178.9 | -67.6 | -11.4 | 0 | 0 | 0 | 110.9 | V158 I159 I164 D165 D166 | V158-D162 WeakPolarHBondContact O-CB 3.24Å; V158-D162 PolarHBondContact O-N 3.07Å; I159-D162 PolarHBondContact O-N 2.87Å; D162-I164 PolarHBondContact O-N 2.96Å; D162-D165 PolarHBondContact O-N 3.29Å; D162-D166 PolarHBondContact O-N 3.44Å |
| 163 | S | 93.5 | Very high | 92.4 | Very high | 62 Ų | 62 | 95.7 Ų | 95.7 | 43% | 0.434 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.1 | -42.6 | 175.3 | -174.4 | 0 | 0 | 0 | 0 | 112.6 | I159 E160 R161 D166 D167 | I159-S163 WeakPolarHBondContact O-CB 3.33Å; I159-S163 PolarHBondContact O-N 2.69Å; E160-S163 PolarHBondContact O-N 3.21Å; R161-S163 VanDerWaalsContact C-N 3.3Å; R161-S163 PolarHBondContact O-N 3.46Å; S163-D166 PolarHBondContact O-N 2.88Å; S163-D167 PolarHBondContact O-N 3.41Å; S163-D167 VanDerWaalsContact O-N 3.11Å |
| 164 | I | 91.4 | Very high | 92.1 | Very high | 102 Ų | 102 | 97.2 Ų | 97.2 | 52% | 0.523 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -67.8 | -40.1 | 177.5 | -69.5 | 166.4 | 0 | 0 | 0 | 110.4 | E160 R161 D162 D167 L168 | E160-I164 VanDerWaalsContact O-CG1 3.29Å; E160-I164 WeakPolarHBondContact O-CG1 3.28Å; E160-I164 PolarHBondContact O-N 3.47Å; R161-I164 PolarHBondContact O-N 3.29Å; D162-I164 PolarHBondContact O-N 2.96Å; I164-D167 PolarHBondContact O-N 3.04Å; I164-L168 HydrophobicContact CG2-CD1 4.13Å; I164-L168 HydrophobicContact CG2-CG 4.36Å; I164-L168 WeakPolarHBondContact O-CB 3.47Å; I164-L168 WeakPolarHBondContact O-CG 3.39Å; I164-L168 PolarHBondContact O-N 3.3Å |
| 165 | D | 88.8 | Confident | 91.7 | Very high | 59 Ų | 59 | 98.5 Ų | 98.5 | 32% | 0.316 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.3 | -43.9 | 176.2 | -81.5 | -13.5 | 0 | 0 | 0 | 111.2 | R161 D162 D167 L168 Q169 | R161-D165 WeakPolarHBondContact CD-OD2 3.5Å; R161-D165 IonicContact CZ-OD2 2.71Å; R161-D165 IonicContact NE-OD2 3.71Å; R161-D165 IonicContact NH1-OD2 2.76Å; R161-D165 PolarHBondContact NH1-OD2 3.43Å; R161-D165 WeakPolarHBondContact O-CB 3.42Å; R161-D165 PolarHBondContact O-N 2.87Å; D162-D165 PolarHBondContact O-N 3.29Å; D165-D167 PolarHBondContact O-N 3.42Å; D165-L168 PolarHBondContact O-N 2.95Å; D165-Q169 WeakPolarHBondContact O-CG 3.45Å; D165-Q169 PolarHBondContact O-N 3.45Å |
| 166 | D | 93.2 | Very high | 91.3 | Very high | 87 Ų | 87 | 101.1 Ų | 101.1 | 47% | 0.465 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61 | -42.7 | 175.4 | -79.9 | -8.3 | 0 | 0 | 0 | 112 | D162 S163 Q169 K170 | D162-D166 PolarHBondContact O-N 3.44Å; S163-D166 PolarHBondContact O-N 2.88Å; D166-Q169 PolarHBondContact O-N 2.7Å; D166-K170 VanDerWaalsContact O-CG 3.3Å; D166-K170 WeakPolarHBondContact O-CG 3.48Å; D166-K170 PolarHBondContact O-N 3.33Å |
| 167 | D | 90.8 | Very high | 90.9 | Very high | 77 Ų | 77 | 101.4 Ų | 101.4 | 41% | 0.412 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -69.8 | -36.5 | 178.4 | -73.7 | -15.4 | 0 | 0 | 0 | 112.2 | S163 I164 D165 Q169 K170 L171 | S163-D167 PolarHBondContact O-N 3.41Å; S163-D167 VanDerWaalsContact O-N 3.11Å; I164-D167 PolarHBondContact O-N 3.04Å; D165-D167 PolarHBondContact O-N 3.42Å; D167-Q169 VanDerWaalsContact C-N 3.35Å; D167-K170 PolarHBondContact O-N 2.94Å; D167-K170 IonicContact OD1-NZ 2.79Å; D167-K170 PolarHBondContact OD1-NZ 2.79Å; D167-L171 WeakPolarHBondContact O-CB 3.43Å; D167-L171 WeakPolarHBondContact O-CG 3.41Å; D167-L171 PolarHBondContact O-N 2.86Å |
| 168 | L | 87.4 | Confident | 90.7 | Very high | 82 Ų | 82 | 102.9 Ų | 102.9 | 43% | 0.429 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.2 | -41.6 | 170.9 | -77.2 | 175.4 | 0 | 0 | 0 | 111.6 | I164 D165 L171 R172 | I164-L168 HydrophobicContact CG2-CD1 4.13Å; I164-L168 HydrophobicContact CG2-CG 4.36Å; I164-L168 WeakPolarHBondContact O-CB 3.47Å; I164-L168 WeakPolarHBondContact O-CG 3.39Å; I164-L168 PolarHBondContact O-N 3.3Å; D165-L168 PolarHBondContact O-N 2.95Å; L168-L171 PolarHBondContact O-N 3.49Å; L168-R172 WeakPolarHBondContact O-CB 3.44Å; L168-R172 VanDerWaalsContact O-CG 3.29Å; L168-R172 WeakPolarHBondContact O-CG 3.38Å; L168-R172 PolarHBondContact O-N 3.19Å |
| 169 | Q | 89.3 | Confident | 90.1 | Very high | 133 Ų | 133 | 104.2 Ų | 104.2 | 62% | 0.621 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.3 | -44 | 175.7 | -73.3 | -178.4 | 12.6 | 0 | 0 | 111.7 | D165 D166 D167 L171 R172 G173 | D165-Q169 WeakPolarHBondContact O-CG 3.45Å; D165-Q169 PolarHBondContact O-N 3.45Å; D166-Q169 PolarHBondContact O-N 2.7Å; D167-Q169 VanDerWaalsContact C-N 3.35Å; Q169-L171 VanDerWaalsContact C-N 3.34Å; Q169-L171 PolarHBondContact O-N 3.21Å; Q169-R172 PolarHBondContact O-N 2.93Å; Q169-G173 PolarHBondContact O-N 3.34Å |
| 170 | K | 89.6 | Confident | 89.4 | Confident | 120 Ų | 120 | 106 Ų | 106 | 52% | 0.522 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.4 | -42.5 | 174.9 | -68.7 | 168.1 | -154.4 | 154.2 | 0 | 111.8 | D166 D167 G173 K174 | D166-K170 VanDerWaalsContact O-CG 3.3Å; D166-K170 WeakPolarHBondContact O-CG 3.48Å; D166-K170 PolarHBondContact O-N 3.33Å; D167-K170 PolarHBondContact O-N 2.94Å; D167-K170 IonicContact OD1-NZ 2.79Å; D167-K170 PolarHBondContact OD1-NZ 2.79Å; K170-G173 PolarHBondContact O-N 2.99Å; K170-K174 WeakPolarHBondContact O-CG 3.47Å; K170-K174 PolarHBondContact O-N 3.5Å |
| 171 | L | 85.8 | Confident | 89 | Confident | 109 Ų | 109 | 104.1 Ų | 104.1 | 57% | 0.571 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -66.8 | -40.9 | 178 | -77 | 168.4 | 0 | 0 | 0 | 112.1 | D167 L168 Q169 K174 Y175 | D167-L171 WeakPolarHBondContact O-CB 3.43Å; D167-L171 WeakPolarHBondContact O-CG 3.41Å; D167-L171 PolarHBondContact O-N 2.86Å; L168-L171 PolarHBondContact O-N 3.49Å; Q169-L171 VanDerWaalsContact C-N 3.34Å; Q169-L171 PolarHBondContact O-N 3.21Å; L171-K174 PolarHBondContact O-N 3.29Å; L171-Y175 WeakPolarHBondContact O-CB 3.37Å; L171-Y175 PolarHBondContact O-N 2.83Å |
| 172 | R | 85.7 | Confident | 89 | Confident | 170 Ų | 170 | 105.4 Ų | 105.4 | 64% | 0.642 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -60.4 | -46.8 | 173.2 | -76.2 | 173.1 | -177.4 | -105.6 | 3 | 111.4 | L168 Q169 K174 Y175 E176 | L168-R172 WeakPolarHBondContact O-CB 3.44Å; L168-R172 VanDerWaalsContact O-CG 3.29Å; L168-R172 WeakPolarHBondContact O-CG 3.38Å; L168-R172 PolarHBondContact O-N 3.19Å; Q169-R172 PolarHBondContact O-N 2.93Å; R172-K174 PolarHBondContact O-N 2.87Å; R172-Y175 WeakPolarHBondContact O-CB 3.48Å; R172-Y175 PolarHBondContact O-N 2.92Å; R172-E176 WeakPolarHBondContact O-CG 3.37Å; R172-E176 PolarHBondContact O-N 3.29Å |
| 173 | G | 84.7 | Confident | 88.8 | Confident | 25 Ų | 25 | 107.1 Ų | 107.1 | 26% | 0.258 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.5 | -47.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q169 K170 Y175 E176 E177 | Q169-G173 PolarHBondContact O-N 3.34Å; K170-G173 PolarHBondContact O-N 2.99Å; G173-Y175 VanDerWaalsContact C-N 3.33Å; G173-Y175 PolarHBondContact O-N 3.35Å; G173-E176 PolarHBondContact O-N 2.93Å; G173-E177 WeakPolarHBondContact O-CG 3.5Å; G173-E177 PolarHBondContact O-N 3.44Å |
| 174 | K | 91.3 | Very high | 88.7 | Confident | 131 Ų | 131 | 110.8 Ų | 110.8 | 57% | 0.57 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.2 | -41.6 | 174.8 | -73.2 | 178.4 | -179.7 | -178 | 0 | 112.5 | K170 L171 R172 E177 E178 | K170-K174 WeakPolarHBondContact O-CG 3.47Å; K170-K174 PolarHBondContact O-N 3.5Å; L171-K174 PolarHBondContact O-N 3.29Å; R172-K174 PolarHBondContact O-N 2.87Å; K174-E177 PolarHBondContact O-N 3.49Å; K174-E178 WeakPolarHBondContact O-CB 3.45Å; K174-E178 WeakPolarHBondContact O-CG 3.37Å; K174-E178 PolarHBondContact O-N 3.29Å |
| 175 | Y | 89.4 | Confident | 88.4 | Confident | 163 Ų | 163 | 108.5 Ų | 108.5 | 64% | 0.639 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.3 | -42.7 | 176.6 | 172.4 | -95.6 | 0 | 0 | 0 | 111.9 | L171 R172 G173 E178 F179 | L171-Y175 WeakPolarHBondContact O-CB 3.37Å; L171-Y175 PolarHBondContact O-N 2.83Å; R172-Y175 WeakPolarHBondContact O-CB 3.48Å; R172-Y175 PolarHBondContact O-N 2.92Å; G173-Y175 VanDerWaalsContact C-N 3.33Å; G173-Y175 PolarHBondContact O-N 3.35Å; Y175-E178 PolarHBondContact O-N 2.94Å; Y175-F179 WeakPolarHBondContact O-CB 3.37Å; Y175-F179 PolarHBondContact O-N 3.48Å |
| 176 | E | 88.6 | Confident | 88.6 | Confident | 115 Ų | 115 | 110.3 Ų | 110.3 | 54% | 0.537 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.9 | -34.6 | 176.9 | -71.5 | 173.3 | -171.2 | 0 | 0 | 112.7 | R172 G173 R180 | R172-E176 WeakPolarHBondContact O-CG 3.37Å; R172-E176 PolarHBondContact O-N 3.29Å; G173-E176 PolarHBondContact O-N 2.93Å; E176-R180 WeakPolarHBondContact O-CB 3.38Å; E176-R180 WeakPolarHBondContact O-CG 3.39Å; E176-R180 PolarHBondContact O-N 2.91Å; E176-R180 PolarHBondContact O-NE 2.82Å |
| 177 | E | 88.7 | Confident | 88.5 | Confident | 118 Ų | 118 | 109 Ų | 109 | 55% | 0.551 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.8 | -49.8 | 172.1 | -73.3 | 172.3 | -179.7 | 0 | 0 | 111.8 | G173 K174 F179 R180 A181 | G173-E177 WeakPolarHBondContact O-CG 3.5Å; G173-E177 PolarHBondContact O-N 3.44Å; K174-E177 PolarHBondContact O-N 3.49Å; E177-F179 VanDerWaalsContact C-N 3.32Å; E177-F179 PolarHBondContact O-N 3.32Å; E177-R180 PolarHBondContact O-N 3.5Å; E177-A181 WeakPolarHBondContact O-CB 3.48Å; E177-A181 PolarHBondContact O-N 3.47Å |
| 178 | E | 91.1 | Very high | 88.7 | Confident | 140 Ų | 140 | 108.5 Ų | 108.5 | 65% | 0.654 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.9 | -38 | 176.8 | -72.4 | -63.3 | 154.3 | 0 | 0 | 112.2 | K174 Y175 A181 R182 | K174-E178 WeakPolarHBondContact O-CB 3.45Å; K174-E178 WeakPolarHBondContact O-CG 3.37Å; K174-E178 PolarHBondContact O-N 3.29Å; Y175-E178 PolarHBondContact O-N 2.94Å; E178-A181 PolarHBondContact O-N 3.16Å; E178-R182 WeakPolarHBondContact O-CB 3.46Å; E178-R182 PolarHBondContact O-N 2.92Å |
| 179 | F | 82.9 | Confident | 89 | Confident | 92 Ų | 92 | 109 Ų | 109 | 40% | 0.404 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.1 | -48 | 174.8 | -179.3 | -95.1 | 0 | 0 | 0 | 111.2 | Y175 E177 R182 E183 | Y175-F179 WeakPolarHBondContact O-CB 3.37Å; Y175-F179 PolarHBondContact O-N 3.48Å; E177-F179 VanDerWaalsContact C-N 3.32Å; E177-F179 PolarHBondContact O-N 3.32Å; F179-R182 WeakPolarHBondContact O-CB 3.4Å; F179-R182 PolarHBondContact O-N 3.36Å; F179-E183 HydrophobicContact CD1-CG 4.39Å; F179-E183 HydrophobicContact CE1-CG 3.92Å; F179-E183 VanDerWaalsContact CE1-OE1 3.26Å; F179-E183 WeakPolarHBondContact CE1-OE1 3.43Å; F179-E183 WeakPolarHBondContact CE1-OE2 3.33Å; F179-E183 HydrophobicContact CZ-CG 4.07Å; F179-E183 VanDerWaalsContact CZ-OE1 3.31Å; F179-E183 WeakPolarHBondContact CZ-OE1 3.32Å; F179-E183 PolarHBondContact O-N 3.3Å |
| 180 | R | 82.4 | Confident | 89.3 | Confident | 153 Ų | 153 | 110.2 Ų | 110.2 | 58% | 0.577 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.8 | -42.8 | 176 | -77 | -175.2 | -70.2 | 165.7 | -2.2 | 112.3 | E176 E177 R182 E183 E184 | E176-R180 WeakPolarHBondContact O-CB 3.38Å; E176-R180 WeakPolarHBondContact O-CG 3.39Å; E176-R180 PolarHBondContact O-N 2.91Å; E176-R180 PolarHBondContact O-NE 2.82Å; E177-R180 PolarHBondContact O-N 3.5Å; R180-R182 VanDerWaalsContact C-N 3.3Å; R180-R182 PolarHBondContact O-N 3.45Å; R180-E183 PolarHBondContact O-N 3.39Å; R180-E184 PolarHBondContact O-N 3.29Å |
| 181 | A | 87 | Confident | 89.6 | Confident | 49 Ų | 49 | 106.8 Ų | 106.8 | 41% | 0.405 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.9 | -39.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | E177 E178 E184 A185 | E177-A181 WeakPolarHBondContact O-CB 3.48Å; E177-A181 PolarHBondContact O-N 3.47Å; E178-A181 PolarHBondContact O-N 3.16Å; A181-E184 PolarHBondContact O-N 2.91Å; A181-A185 WeakPolarHBondContact O-CB 3.44Å; A181-A185 PolarHBondContact O-N 3.07Å |
| 182 | R | 92.8 | Very high | 90.1 | Very high | 161 Ų | 161 | 108.3 Ų | 108.3 | 61% | 0.608 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.5 | -46.9 | 173.2 | -179.5 | -172.2 | 169.9 | 120.6 | 7.3 | 111.8 | E178 F179 R180 E184 A185 E186 | E178-R182 WeakPolarHBondContact O-CB 3.46Å; E178-R182 PolarHBondContact O-N 2.92Å; F179-R182 WeakPolarHBondContact O-CB 3.4Å; F179-R182 PolarHBondContact O-N 3.36Å; R180-R182 VanDerWaalsContact C-N 3.3Å; R180-R182 PolarHBondContact O-N 3.45Å; R182-E184 VanDerWaalsContact C-N 3.3Å; R182-E184 PolarHBondContact O-N 3.48Å; R182-A185 PolarHBondContact O-N 3.15Å; R182-E186 HydrophobicContact CG-CG 4.41Å; R182-E186 IonicContact CZ-OE1 3.88Å; R182-E186 IonicContact NE-OE1 3.3Å; R182-E186 PolarHBondContact NE-OE1 3.43Å; R182-E186 IonicContact NH2-OE1 3.56Å; R182-E186 PolarHBondContact NH2-OE1 2.72Å; R182-E186 WeakPolarHBondContact O-CB 3.32Å; R182-E186 WeakPolarHBondContact O-CG 3.1Å; R182-E186 PolarHBondContact O-N 3.26Å |
| 183 | E | 90.5 | Very high | 90.7 | Very high | 101 Ų | 101 | 106.4 Ų | 106.4 | 47% | 0.472 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.1 | -41.3 | 177.9 | -74.5 | -171.1 | 140.1 | 0 | 0 | 111.7 | F179 R180 E186 A187 | F179-E183 HydrophobicContact CD1-CG 4.39Å; F179-E183 HydrophobicContact CE1-CG 3.92Å; F179-E183 VanDerWaalsContact CE1-OE1 3.26Å; F179-E183 WeakPolarHBondContact CE1-OE1 3.43Å; F179-E183 WeakPolarHBondContact CE1-OE2 3.33Å; F179-E183 HydrophobicContact CZ-CG 4.07Å; F179-E183 VanDerWaalsContact CZ-OE1 3.31Å; F179-E183 WeakPolarHBondContact CZ-OE1 3.32Å; F179-E183 PolarHBondContact O-N 3.3Å; R180-E183 PolarHBondContact O-N 3.39Å; E183-E186 PolarHBondContact O-N 2.9Å; E183-A187 WeakPolarHBondContact O-CB 3.45Å; E183-A187 PolarHBondContact O-N 2.92Å |
| 184 | E | 90.9 | Very high | 91.3 | Very high | 139 Ų | 139 | 111.4 Ų | 111.4 | 65% | 0.65 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63.7 | -43.5 | 174.8 | -173.2 | 176.9 | -179.2 | 0 | 0 | 111.8 | R180 A181 R182 A187 T188 | R180-E184 PolarHBondContact O-N 3.29Å; A181-E184 PolarHBondContact O-N 2.91Å; R182-E184 VanDerWaalsContact C-N 3.3Å; R182-E184 PolarHBondContact O-N 3.48Å; E184-A187 PolarHBondContact O-N 3.41Å; E184-T188 WeakPolarHBondContact O-CG2 3.46Å; E184-T188 PolarHBondContact O-N 3.04Å; E184-T188 PolarHBondContact O-OG1 3.37Å |
| 185 | A | 86.3 | Confident | 91.6 | Very high | 54 Ų | 54 | 109.4 Ų | 109.4 | 45% | 0.446 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.6 | -39.5 | 175 | 0 | 0 | 0 | 0 | 0 | 112.5 | A181 R182 T188 L189 | A181-A185 WeakPolarHBondContact O-CB 3.44Å; A181-A185 PolarHBondContact O-N 3.07Å; R182-A185 PolarHBondContact O-N 3.15Å; A185-T188 WeakPolarHBondContact CA-OG1 3.42Å; A185-T188 PolarHBondContact O-OG1 2.92Å; A185-L189 VanDerWaalsContact O-CB 3.27Å; A185-L189 WeakPolarHBondContact O-CB 3.36Å; A185-L189 PolarHBondContact O-N 2.83Å |
| 186 | E | 92.9 | Very high | 92 | Very high | 98 Ų | 98 | 105.8 Ų | 105.8 | 46% | 0.458 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.9 | -39.5 | 175.6 | -75.3 | -176.4 | -176 | 0 | 0 | 111.8 | R182 E183 L189 K190 | R182-E186 HydrophobicContact CG-CG 4.41Å; R182-E186 IonicContact CZ-OE1 3.88Å; R182-E186 IonicContact NE-OE1 3.3Å; R182-E186 PolarHBondContact NE-OE1 3.43Å; R182-E186 IonicContact NH2-OE1 3.56Å; R182-E186 PolarHBondContact NH2-OE1 2.72Å; R182-E186 WeakPolarHBondContact O-CB 3.32Å; R182-E186 WeakPolarHBondContact O-CG 3.1Å; R182-E186 PolarHBondContact O-N 3.26Å; E183-E186 PolarHBondContact O-N 2.9Å; E186-L189 PolarHBondContact O-N 3.27Å; E186-K190 WeakPolarHBondContact O-CB 3.45Å; E186-K190 PolarHBondContact O-N 2.86Å |
| 187 | A | 91.3 | Very high | 92.5 | Very high | 60 Ų | 60 | 105 Ų | 105 | 50% | 0.496 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.6 | -45.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | E183 E184 K190 A191 | E183-A187 WeakPolarHBondContact O-CB 3.45Å; E183-A187 PolarHBondContact O-N 2.92Å; E184-A187 PolarHBondContact O-N 3.41Å; A187-K190 PolarHBondContact O-N 2.9Å; A187-A191 PolarHBondContact O-N 2.74Å |
| 188 | T | 94.4 | Very high | 93 | Very high | 66 Ų | 66 | 103.3 Ų | 103.3 | 41% | 0.405 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.1 | -41.1 | 176.4 | 51.6 | 0 | 0 | 0 | 0 | 111.9 | E184 A185 K190 A191 F192 | E184-T188 WeakPolarHBondContact O-CG2 3.46Å; E184-T188 PolarHBondContact O-N 3.04Å; E184-T188 PolarHBondContact O-OG1 3.37Å; A185-T188 WeakPolarHBondContact CA-OG1 3.42Å; A185-T188 PolarHBondContact O-OG1 2.92Å; T188-K190 VanDerWaalsContact C-N 3.33Å; T188-K190 PolarHBondContact O-N 3.36Å; T188-A191 WeakPolarHBondContact O-CB 3.38Å; T188-A191 PolarHBondContact O-N 3.22Å; T188-F192 PolarHBondContact O-N 3.1Å |
| 189 | L | 94 | Very high | 93.3 | Very high | 91 Ų | 91 | 99.5 Ų | 99.5 | 48% | 0.476 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.6 | -40.8 | 174.1 | -177 | 153.9 | 0 | 0 | 0 | 111.8 | A185 E186 A191 F192 K193 | A185-L189 VanDerWaalsContact O-CB 3.27Å; A185-L189 WeakPolarHBondContact O-CB 3.36Å; A185-L189 PolarHBondContact O-N 2.83Å; E186-L189 PolarHBondContact O-N 3.27Å; L189-A191 VanDerWaalsContact C-N 3.34Å; L189-F192 PolarHBondContact O-N 2.68Å; L189-K193 HydrophobicContact CD2-CD 3.76Å; L189-K193 HydrophobicContact CD2-CG 4.23Å; L189-K193 WeakPolarHBondContact O-CG 3.33Å; L189-K193 PolarHBondContact O-N 3.07Å |
| 190 | K | 94.7 | Very high | 94 | Very high | 160 Ų | 160 | 97.5 Ų | 97.5 | 70% | 0.696 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.8 | -39.6 | 175.1 | -174.3 | 179.6 | 178.8 | -178.6 | 0 | 111.8 | E186 A187 T188 K193 K194 | E186-K190 WeakPolarHBondContact O-CB 3.45Å; E186-K190 PolarHBondContact O-N 2.86Å; A187-K190 PolarHBondContact O-N 2.9Å; T188-K190 VanDerWaalsContact C-N 3.33Å; T188-K190 PolarHBondContact O-N 3.36Å; K190-K193 PolarHBondContact O-N 3.37Å; K190-K194 PolarHBondContact O-N 2.88Å; K190-K194 VanDerWaalsContact O-N 3.15Å |
| 191 | A | 95.4 | Very high | 94.8 | Very high | 48 Ų | 48 | 95.5 Ų | 95.5 | 40% | 0.397 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.2 | -49 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | A187 T188 L189 K193 K194 D195 | A187-A191 PolarHBondContact O-N 2.74Å; T188-A191 WeakPolarHBondContact O-CB 3.38Å; T188-A191 PolarHBondContact O-N 3.22Å; L189-A191 VanDerWaalsContact C-N 3.34Å; A191-K193 VanDerWaalsContact C-N 3.32Å; A191-K193 PolarHBondContact O-N 3.46Å; A191-K194 WeakPolarHBondContact O-CB 3.43Å; A191-K194 PolarHBondContact O-N 3.39Å; A191-D195 PolarHBondContact O-N 2.99Å |
| 192 | F | 97 | Very high | 95.3 | Very high | 140 Ų | 140 | 97.4 Ų | 97.4 | 61% | 0.614 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.9 | -36.7 | 177.3 | -70.7 | -37.5 | 0 | 0 | 0 | 113.6 | T188 L189 K194 D195 V196 | T188-F192 PolarHBondContact O-N 3.1Å; L189-F192 PolarHBondContact O-N 2.68Å; F192-K194 VanDerWaalsContact C-N 3.32Å; F192-K194 PolarHBondContact O-N 3.3Å; F192-D195 PolarHBondContact O-N 2.92Å; F192-V196 VanDerWaalsContact O-CG2 3.29Å; F192-V196 WeakPolarHBondContact O-CG2 3.37Å; F192-V196 PolarHBondContact O-N 3.34Å |
| 193 | K | 97.6 | Very high | 95.6 | Very high | 130 Ų | 130 | 96.1 Ų | 96.1 | 57% | 0.565 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -59.3 | -45.2 | 172.8 | -79.5 | -180 | 174.5 | 171.6 | 0 | 111.5 | L189 K190 A191 V196 D197 | L189-K193 HydrophobicContact CD2-CD 3.76Å; L189-K193 HydrophobicContact CD2-CG 4.23Å; L189-K193 WeakPolarHBondContact O-CG 3.33Å; L189-K193 PolarHBondContact O-N 3.07Å; K190-K193 PolarHBondContact O-N 3.37Å; A191-K193 VanDerWaalsContact C-N 3.32Å; A191-K193 PolarHBondContact O-N 3.46Å; K193-V196 PolarHBondContact O-N 3.19Å; K193-D197 VanDerWaalsContact O-CG 3.3Å; K193-D197 PolarHBondContact O-N 2.94Å |
| 194 | K | 98 | Very high | 96 | Very high | 130 Ų | 130 | 94.4 Ų | 94.4 | 57% | 0.565 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.8 | -45 | 175.7 | -175.1 | -172.3 | 170.8 | -172.8 | 0 | 111.3 | K190 A191 F192 V196 D197 D198 | K190-K194 PolarHBondContact O-N 2.88Å; K190-K194 VanDerWaalsContact O-N 3.15Å; A191-K194 WeakPolarHBondContact O-CB 3.43Å; A191-K194 PolarHBondContact O-N 3.39Å; F192-K194 VanDerWaalsContact C-N 3.32Å; F192-K194 PolarHBondContact O-N 3.3Å; K194-V196 VanDerWaalsContact C-N 3.27Å; K194-V196 PolarHBondContact O-N 3.47Å; K194-D197 PolarHBondContact O-N 3.44Å; K194-D197 VanDerWaalsContact O-N 3.16Å; K194-D198 WeakPolarHBondContact CE-OD2 3.43Å; K194-D198 WeakPolarHBondContact O-CB 3.24Å; K194-D198 PolarHBondContact O-N 3.11Å |
| 195 | D | 97.9 | Very high | 96.3 | Very high | 90 Ų | 90 | 92.4 Ų | 92.4 | 48% | 0.481 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.6 | -37.6 | 178.6 | -64.7 | -19.3 | 0 | 0 | 0 | 111.7 | A191 F192 A199 | A191-D195 PolarHBondContact O-N 2.99Å; F192-D195 PolarHBondContact O-N 2.92Å; D195-A199 VanDerWaalsContact O-CB 3.24Å; D195-A199 WeakPolarHBondContact O-CB 3.26Å; D195-A199 PolarHBondContact O-N 3.39Å |
| 196 | V | 98.6 | Very high | 96.9 | Very high | 87 Ų | 87 | 94.8 Ų | 94.8 | 53% | 0.527 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.6 | -48.2 | 173.1 | 170.2 | 0 | 0 | 0 | 0 | 110.7 | F192 K193 K194 D198 A199 T200 | F192-V196 VanDerWaalsContact O-CG2 3.29Å; F192-V196 WeakPolarHBondContact O-CG2 3.37Å; F192-V196 PolarHBondContact O-N 3.34Å; K193-V196 PolarHBondContact O-N 3.19Å; K194-V196 VanDerWaalsContact C-N 3.27Å; K194-V196 PolarHBondContact O-N 3.47Å; V196-D198 PolarHBondContact O-N 3.06Å; V196-A199 PolarHBondContact O-N 3.26Å; V196-T200 HydrophobicContact CG1-CG2 4.33Å; V196-T200 VanDerWaalsContact O-CG2 3.27Å; V196-T200 WeakPolarHBondContact O-CG2 3.38Å; V196-T200 PolarHBondContact O-N 2.94Å; V196-T200 PolarHBondContact O-OG1 3.43Å |
| 197 | D | 98.3 | Very high | 97.1 | Very high | 99 Ų | 99 | 94.4 Ų | 94.4 | 53% | 0.529 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.6 | -46.5 | 178.1 | -68.5 | -24.8 | 0 | 0 | 0 | 111 | K193 K194 A199 T200 M201 | K193-D197 VanDerWaalsContact O-CG 3.3Å; K193-D197 PolarHBondContact O-N 2.94Å; K194-D197 PolarHBondContact O-N 3.44Å; K194-D197 VanDerWaalsContact O-N 3.16Å; D197-A199 PolarHBondContact O-N 2.92Å; D197-T200 WeakPolarHBondContact CA-OG1 3.46Å; D197-T200 PolarHBondContact O-N 2.95Å; D197-T200 PolarHBondContact O-OG1 3.37Å; D197-M201 PolarHBondContact O-N 2.9Å |
| 198 | D | 98.1 | Very high | 97.5 | Very high | 81 Ų | 81 | 97.5 Ų | 97.5 | 43% | 0.433 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.5 | -44.5 | 176.8 | -72.1 | -16.4 | 0 | 0 | 0 | 110.9 | K194 V196 T200 M201 V202 | K194-D198 WeakPolarHBondContact CE-OD2 3.43Å; K194-D198 WeakPolarHBondContact O-CB 3.24Å; K194-D198 PolarHBondContact O-N 3.11Å; V196-D198 PolarHBondContact O-N 3.06Å; D198-T200 PolarHBondContact O-N 3.24Å; D198-M201 PolarHBondContact O-N 3.31Å; D198-V202 WeakPolarHBondContact O-CG2 3.48Å; D198-V202 PolarHBondContact O-N 3.44Å |
| 199 | A | 98.1 | Very high | 97.6 | Very high | 60 Ų | 60 | 100.7 Ų | 100.7 | 50% | 0.496 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.6 | -38.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | D195 V196 D197 M201 V202 R203 | D195-A199 VanDerWaalsContact O-CB 3.24Å; D195-A199 WeakPolarHBondContact O-CB 3.26Å; D195-A199 PolarHBondContact O-N 3.39Å; V196-A199 PolarHBondContact O-N 3.26Å; D197-A199 PolarHBondContact O-N 2.92Å; A199-M201 VanDerWaalsContact C-N 3.35Å; A199-V202 PolarHBondContact O-N 3.43Å; A199-R203 WeakPolarHBondContact O-CB 3.34Å; A199-R203 PolarHBondContact O-N 2.91Å |
| 200 | T | 98.4 | Very high | 97.8 | Very high | 50 Ų | 50 | 100.5 Ų | 100.5 | 31% | 0.307 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.3 | -37.2 | 175.6 | 62.4 | 0 | 0 | 0 | 0 | 111.8 | V196 D197 D198 R203 L204 | V196-T200 HydrophobicContact CG1-CG2 4.33Å; V196-T200 VanDerWaalsContact O-CG2 3.27Å; V196-T200 WeakPolarHBondContact O-CG2 3.38Å; V196-T200 PolarHBondContact O-N 2.94Å; V196-T200 PolarHBondContact O-OG1 3.43Å; D197-T200 WeakPolarHBondContact CA-OG1 3.46Å; D197-T200 PolarHBondContact O-N 2.95Å; D197-T200 PolarHBondContact O-OG1 3.37Å; D198-T200 PolarHBondContact O-N 3.24Å; T200-R203 PolarHBondContact O-N 3.46Å; T200-L204 WeakPolarHBondContact O-CG 3.27Å; T200-L204 PolarHBondContact O-N 2.86Å |
| 201 | M | 98.2 | Very high | 98 | Very high | 112 Ų | 112 | 98.7 Ų | 98.7 | 55% | 0.552 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.4 | -46 | 173.9 | -89.8 | -53.3 | -173.6 | 0 | 0 | 112.2 | D197 D198 A199 R203 L204 D205 | D197-M201 PolarHBondContact O-N 2.9Å; D198-M201 PolarHBondContact O-N 3.31Å; A199-M201 VanDerWaalsContact C-N 3.35Å; M201-R203 VanDerWaalsContact C-N 3.27Å; M201-R203 PolarHBondContact O-N 2.84Å; M201-L204 PolarHBondContact O-N 3.17Å; M201-L204 HydrophobicContact SD-CD1 4.18Å; M201-D205 PolarHBondContact O-N 3.48Å |
| 202 | V | 98.3 | Very high | 98.1 | Very high | 88 Ų | 88 | 99.5 Ų | 99.5 | 53% | 0.533 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.9 | -41.4 | 175.3 | 173.7 | 0 | 0 | 0 | 0 | 111 | D198 A199 D205 L206 | D198-V202 WeakPolarHBondContact O-CG2 3.48Å; D198-V202 PolarHBondContact O-N 3.44Å; A199-V202 PolarHBondContact O-N 3.43Å; V202-D205 PolarHBondContact O-N 3.36Å; V202-L206 HydrophobicContact CG1-CD1 4.16Å; V202-L206 WeakPolarHBondContact O-CG 3.49Å; V202-L206 PolarHBondContact O-N 3.43Å |
| 203 | R | 98.4 | Very high | 98.2 | Very high | 135 Ų | 135 | 97.4 Ų | 97.4 | 51% | 0.509 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.5 | -48.1 | 176.3 | -163.9 | -167.1 | 79.7 | -151.2 | -5.2 | 111.7 | A199 T200 M201 D205 L206 E207 | A199-R203 WeakPolarHBondContact O-CB 3.34Å; A199-R203 PolarHBondContact O-N 2.91Å; T200-R203 PolarHBondContact O-N 3.46Å; M201-R203 VanDerWaalsContact C-N 3.27Å; M201-R203 PolarHBondContact O-N 2.84Å; R203-D205 VanDerWaalsContact C-N 3.33Å; R203-D205 PolarHBondContact O-N 2.97Å; R203-L206 PolarHBondContact O-N 3.37Å; R203-E207 WeakPolarHBondContact CD-OE1 3.1Å; R203-E207 IonicContact CZ-OE1 3.73Å; R203-E207 IonicContact NE-OE1 2.78Å; R203-E207 PolarHBondContact NE-OE1 3.34Å; R203-E207 IonicContact NH2-OE1 3.26Å; R203-E207 WeakPolarHBondContact O-CG 3.42Å; R203-E207 PolarHBondContact O-N 3Å |
| 204 | L | 98.5 | Very high | 98.2 | Very high | 65 Ų | 65 | 95.7 Ų | 95.7 | 34% | 0.34 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.1 | -40 | 178.6 | -73.9 | 171.1 | 0 | 0 | 0 | 112.2 | T200 M201 E207 K208 | T200-L204 WeakPolarHBondContact O-CG 3.27Å; T200-L204 PolarHBondContact O-N 2.86Å; M201-L204 PolarHBondContact O-N 3.17Å; M201-L204 HydrophobicContact SD-CD1 4.18Å; L204-E207 PolarHBondContact O-N 2.94Å; L204-K208 WeakPolarHBondContact O-CG 3.4Å; L204-K208 PolarHBondContact O-N 2.97Å |
| 205 | D | 98.2 | Very high | 98.2 | Very high | 96 Ų | 96 | 94.2 Ų | 94.2 | 51% | 0.513 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.6 | -38.1 | 176.8 | -74.6 | -16.3 | 0 | 0 | 0 | 111.9 | M201 V202 R203 K209 | M201-D205 PolarHBondContact O-N 3.48Å; V202-D205 PolarHBondContact O-N 3.36Å; R203-D205 VanDerWaalsContact C-N 3.33Å; R203-D205 PolarHBondContact O-N 2.97Å; D205-K209 WeakPolarHBondContact O-CB 3.28Å; D205-K209 PolarHBondContact O-N 2.95Å |
| 206 | L | 98.2 | Very high | 98.2 | Very high | 105 Ų | 105 | 94.6 Ų | 94.6 | 55% | 0.55 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -67.1 | -41.8 | 172.9 | -71.1 | 173.4 | 0 | 0 | 0 | 112 | V202 R203 K209 V210 | V202-L206 HydrophobicContact CG1-CD1 4.16Å; V202-L206 WeakPolarHBondContact O-CG 3.49Å; V202-L206 PolarHBondContact O-N 3.43Å; R203-L206 PolarHBondContact O-N 3.37Å; L206-K209 WeakPolarHBondContact O-CB 3.39Å; L206-K209 PolarHBondContact O-N 2.89Å; L206-V210 WeakPolarHBondContact O-CG2 3.35Å; L206-V210 PolarHBondContact O-N 2.9Å |
| 207 | E | 98.1 | Very high | 98.1 | Very high | 90 Ų | 90 | 94.4 Ų | 94.4 | 42% | 0.421 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59 | -48.1 | 175.4 | -76.2 | 168.9 | -169.5 | 0 | 0 | 111.1 | R203 L204 K209 V210 E211 | R203-E207 WeakPolarHBondContact CD-OE1 3.1Å; R203-E207 IonicContact CZ-OE1 3.73Å; R203-E207 IonicContact NE-OE1 2.78Å; R203-E207 PolarHBondContact NE-OE1 3.34Å; R203-E207 IonicContact NH2-OE1 3.26Å; R203-E207 WeakPolarHBondContact O-CG 3.42Å; R203-E207 PolarHBondContact O-N 3Å; L204-E207 PolarHBondContact O-N 2.94Å; E207-K209 VanDerWaalsContact C-N 3.29Å; E207-K209 PolarHBondContact O-N 3.49Å; E207-V210 WeakPolarHBondContact O-CB 3.34Å; E207-V210 PolarHBondContact O-N 2.75Å; E207-V210 VanDerWaalsContact O-N 3.17Å; E207-E211 PolarHBondContact O-N 2.92Å |
| 208 | K | 98.3 | Very high | 98.1 | Very high | 125 Ų | 125 | 93.4 Ų | 93.4 | 54% | 0.543 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.2 | -39.7 | 174.1 | -72.5 | 172.1 | -174.5 | 166.3 | 0 | 112.3 | L204 E211 S212 | L204-K208 WeakPolarHBondContact O-CG 3.4Å; L204-K208 PolarHBondContact O-N 2.97Å; K208-E211 PolarHBondContact O-N 3.23Å; K208-S212 WeakPolarHBondContact O-CB 3.43Å; K208-S212 PolarHBondContact O-N 3.33Å; K208-S212 PolarHBondContact O-OG 3.14Å |
| 209 | K | 98.1 | Very high | 98.1 | Very high | 133 Ų | 133 | 95.4 Ų | 95.4 | 58% | 0.578 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66 | -41.2 | 177.5 | -168.1 | 168.6 | -175 | 173.8 | 0 | 111.2 | D205 L206 E207 S212 L213 | D205-K209 WeakPolarHBondContact O-CB 3.28Å; D205-K209 PolarHBondContact O-N 2.95Å; L206-K209 WeakPolarHBondContact O-CB 3.39Å; L206-K209 PolarHBondContact O-N 2.89Å; E207-K209 VanDerWaalsContact C-N 3.29Å; E207-K209 PolarHBondContact O-N 3.49Å; K209-S212 WeakPolarHBondContact CA-OG 3.43Å; K209-S212 PolarHBondContact O-N 2.83Å; K209-S212 PolarHBondContact O-OG 3.47Å; K209-L213 HydrophobicContact CG-CD1 4.39Å; K209-L213 VanDerWaalsContact O-CG 3.28Å; K209-L213 WeakPolarHBondContact O-CG 3.42Å; K209-L213 PolarHBondContact O-N 3.36Å |
| 210 | V | 98.3 | Very high | 98.1 | Very high | 86 Ų | 86 | 97.1 Ų | 97.1 | 52% | 0.521 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.7 | -47.7 | 173.6 | 169.5 | 0 | 0 | 0 | 0 | 110.6 | L206 E207 S212 L213 L214 | L206-V210 WeakPolarHBondContact O-CG2 3.35Å; L206-V210 PolarHBondContact O-N 2.9Å; E207-V210 WeakPolarHBondContact O-CB 3.34Å; E207-V210 PolarHBondContact O-N 2.75Å; E207-V210 VanDerWaalsContact O-N 3.17Å; V210-S212 PolarHBondContact O-N 3.38Å; V210-L213 PolarHBondContact O-N 3.38Å; V210-L214 HydrophobicContact CG1-CD1 4.05Å; V210-L214 HydrophobicContact CG1-CG 4.44Å; V210-L214 WeakPolarHBondContact O-CG 3.44Å; V210-L214 PolarHBondContact O-N 3.43Å |
| 211 | E | 98.1 | Very high | 98 | Very high | 123 Ų | 123 | 102.9 Ų | 102.9 | 58% | 0.575 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -58.6 | -47.8 | 177.2 | -170.6 | 171.9 | -158.3 | 0 | 0 | 111.4 | E207 K208 L213 L214 D215 | E207-E211 PolarHBondContact O-N 2.92Å; K208-E211 PolarHBondContact O-N 3.23Å; E211-L213 VanDerWaalsContact C-N 3.3Å; E211-L213 PolarHBondContact O-N 3.12Å; E211-L214 WeakPolarHBondContact O-CB 3.29Å; E211-L214 PolarHBondContact O-N 2.84Å; E211-L214 VanDerWaalsContact O-N 3.11Å; E211-D215 PolarHBondContact O-N 2.78Å |
| 212 | S | 98.1 | Very high | 98 | Very high | 64 Ų | 64 | 104 Ų | 104 | 45% | 0.448 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.1 | -37 | 177.1 | 72.7 | 0 | 0 | 0 | 0 | 113.5 | K208 K209 V210 E216 | K208-S212 WeakPolarHBondContact O-CB 3.43Å; K208-S212 PolarHBondContact O-N 3.33Å; K208-S212 PolarHBondContact O-OG 3.14Å; K209-S212 WeakPolarHBondContact CA-OG 3.43Å; K209-S212 PolarHBondContact O-N 2.83Å; K209-S212 PolarHBondContact O-OG 3.47Å; V210-S212 PolarHBondContact O-N 3.38Å; S212-E216 WeakPolarHBondContact O-CB 3.34Å; S212-E216 PolarHBondContact O-N 3Å |
| 213 | L | 97.9 | Very high | 97.9 | Very high | 97 Ų | 97 | 102 Ų | 102 | 51% | 0.508 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -73.1 | -34.1 | 177.2 | -71.8 | 172.2 | 0 | 0 | 0 | 111.7 | K209 V210 E211 E216 I217 | K209-L213 HydrophobicContact CG-CD1 4.39Å; K209-L213 VanDerWaalsContact O-CG 3.28Å; K209-L213 WeakPolarHBondContact O-CG 3.42Å; K209-L213 PolarHBondContact O-N 3.36Å; V210-L213 PolarHBondContact O-N 3.38Å; E211-L213 VanDerWaalsContact C-N 3.3Å; E211-L213 PolarHBondContact O-N 3.12Å; L213-E216 PolarHBondContact O-N 2.93Å; L213-I217 WeakPolarHBondContact O-CD1 3.36Å; L213-I217 VanDerWaalsContact O-CG1 3.24Å; L213-I217 WeakPolarHBondContact O-CG1 3.46Å; L213-I217 PolarHBondContact O-N 3.07Å |
| 214 | L | 98.1 | Very high | 97.8 | Very high | 93 Ų | 93 | 101 Ų | 101 | 49% | 0.487 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -66.8 | -42.2 | 173.6 | -73.1 | 172.9 | 0 | 0 | 0 | 111.3 | V210 E211 E216 I217 N218 | V210-L214 HydrophobicContact CG1-CD1 4.05Å; V210-L214 HydrophobicContact CG1-CG 4.44Å; V210-L214 WeakPolarHBondContact O-CG 3.44Å; V210-L214 PolarHBondContact O-N 3.43Å; E211-L214 WeakPolarHBondContact O-CB 3.29Å; E211-L214 PolarHBondContact O-N 2.84Å; E211-L214 VanDerWaalsContact O-N 3.11Å; L214-E216 VanDerWaalsContact C-N 3.34Å; L214-I217 PolarHBondContact O-N 3.44Å; L214-N218 WeakPolarHBondContact O-CB 3.45Å; L214-N218 VanDerWaalsContact O-CG 3.25Å; L214-N218 PolarHBondContact O-N 3.25Å; L214-N218 PolarHBondContact O-ND2 3.43Å; L214-N218 VanDerWaalsContact O-ND2 3.14Å |
| 215 | D | 97.9 | Very high | 97.7 | Very high | 99 Ų | 99 | 104.7 Ų | 104.7 | 53% | 0.529 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61 | -43.5 | 174.5 | -75 | -17.4 | 0 | 0 | 0 | 111.4 | E211 N218 F219 | E211-D215 PolarHBondContact O-N 2.78Å; D215-N218 PolarHBondContact O-N 3.46Å; D215-F219 WeakPolarHBondContact O-CB 3.27Å; D215-F219 PolarHBondContact O-N 3.25Å |
| 216 | E | 97.6 | Very high | 97.6 | Very high | 99 Ų | 99 | 106 Ų | 106 | 46% | 0.463 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.5 | -44.6 | 174.7 | -175.9 | 62.3 | -163.7 | 0 | 0 | 112 | S212 L213 L214 N218 F219 L220 | S212-E216 WeakPolarHBondContact O-CB 3.34Å; S212-E216 PolarHBondContact O-N 3Å; L213-E216 PolarHBondContact O-N 2.93Å; L214-E216 VanDerWaalsContact C-N 3.34Å; E216-N218 VanDerWaalsContact C-N 3.33Å; E216-N218 PolarHBondContact O-N 3.06Å; E216-F219 PolarHBondContact O-N 2.86Å; E216-L220 HydrophobicContact CG-CD1 4.26Å; E216-L220 WeakPolarHBondContact O-CB 3.36Å; E216-L220 WeakPolarHBondContact O-CG 3.35Å; E216-L220 PolarHBondContact O-N 3.37Å |
| 217 | I | 97.4 | Very high | 97.4 | Very high | 82 Ų | 82 | 105.9 Ų | 105.9 | 42% | 0.421 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.1 | -43 | 175.9 | -72.4 | 165.4 | 0 | 0 | 0 | 110.9 | L213 L214 L220 R221 | L213-I217 WeakPolarHBondContact O-CD1 3.36Å; L213-I217 VanDerWaalsContact O-CG1 3.24Å; L213-I217 WeakPolarHBondContact O-CG1 3.46Å; L213-I217 PolarHBondContact O-N 3.07Å; L214-I217 PolarHBondContact O-N 3.44Å; I217-L220 PolarHBondContact O-N 3.2Å; I217-R221 WeakPolarHBondContact O-CB 3.35Å; I217-R221 WeakPolarHBondContact O-CG 3.47Å; I217-R221 PolarHBondContact O-N 2.96Å |
| 218 | N | 97.8 | Very high | 97.2 | Very high | 78 Ų | 78 | 104.7 Ų | 104.7 | 42% | 0.417 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.2 | -39 | 179.1 | -73.2 | -33.5 | 0 | 0 | 0 | 111.7 | L214 D215 E216 R221 K222 | L214-N218 WeakPolarHBondContact O-CB 3.45Å; L214-N218 VanDerWaalsContact O-CG 3.25Å; L214-N218 PolarHBondContact O-N 3.25Å; L214-N218 PolarHBondContact O-ND2 3.43Å; L214-N218 VanDerWaalsContact O-ND2 3.14Å; D215-N218 PolarHBondContact O-N 3.46Å; E216-N218 VanDerWaalsContact C-N 3.33Å; E216-N218 PolarHBondContact O-N 3.06Å; N218-R221 PolarHBondContact O-N 3.28Å; N218-K222 WeakPolarHBondContact O-CG 3.35Å; N218-K222 PolarHBondContact O-N 2.88Å |
| 219 | F | 97.9 | Very high | 97 | Very high | 123 Ų | 123 | 101 Ų | 101 | 54% | 0.539 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.5 | -52.6 | 173.4 | 175.4 | -104 | 0 | 0 | 0 | 111 | D215 E216 R221 K222 V223 | D215-F219 WeakPolarHBondContact O-CB 3.27Å; D215-F219 PolarHBondContact O-N 3.25Å; E216-F219 PolarHBondContact O-N 2.86Å; F219-R221 VanDerWaalsContact C-N 3.28Å; F219-R221 PolarHBondContact O-N 2.88Å; F219-K222 PolarHBondContact O-N 3.43Å; F219-K222 VanDerWaalsContact O-N 3.14Å; F219-V223 HydrophobicContact CD1-CG2 4.37Å; F219-V223 HydrophobicContact CD2-CG2 4.32Å; F219-V223 HydrophobicContact CE1-CG2 3.94Å; F219-V223 HydrophobicContact CE2-CG2 3.89Å; F219-V223 HydrophobicContact CZ-CG2 3.68Å; F219-V223 WeakPolarHBondContact O-CG2 3.45Å; F219-V223 PolarHBondContact O-N 2.98Å |
| 220 | L | 97.8 | Very high | 96.8 | Very high | 96 Ų | 96 | 100.6 Ų | 100.6 | 50% | 0.503 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59 | -38.1 | 177.6 | -70.8 | 171.8 | 0 | 0 | 0 | 112.5 | E216 I217 H224 | E216-L220 HydrophobicContact CG-CD1 4.26Å; E216-L220 WeakPolarHBondContact O-CB 3.36Å; E216-L220 WeakPolarHBondContact O-CG 3.35Å; E216-L220 PolarHBondContact O-N 3.37Å; I217-L220 PolarHBondContact O-N 3.2Å; L220-H224 WeakPolarHBondContact O-CB 3.31Å; L220-H224 PolarHBondContact O-N 3.41Å |
| 221 | R | 97.1 | Very high | 96.4 | Very high | 171 Ų | 171 | 101.1 Ų | 101.1 | 65% | 0.645 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.5 | -45.7 | 174.8 | -81.3 | 177.7 | 163.8 | -175.2 | -4.8 | 112.6 | I217 N218 F219 H224 E225 | I217-R221 WeakPolarHBondContact O-CB 3.35Å; I217-R221 WeakPolarHBondContact O-CG 3.47Å; I217-R221 PolarHBondContact O-N 2.96Å; N218-R221 PolarHBondContact O-N 3.28Å; F219-R221 VanDerWaalsContact C-N 3.28Å; F219-R221 PolarHBondContact O-N 2.88Å; R221-H224 PolarHBondContact O-N 2.92Å; R221-E225 WeakPolarHBondContact O-CB 3.31Å; R221-E225 PolarHBondContact O-N 3.47Å |
| 222 | K | 97.4 | Very high | 95.9 | Very high | 137 Ų | 137 | 98.1 Ų | 98.1 | 60% | 0.596 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.1 | -46.3 | 177.2 | -76.9 | -178.9 | 178.5 | -179.9 | 0 | 111.7 | N218 F219 H224 E225 E226 | N218-K222 WeakPolarHBondContact O-CG 3.35Å; N218-K222 PolarHBondContact O-N 2.88Å; F219-K222 PolarHBondContact O-N 3.43Å; F219-K222 VanDerWaalsContact O-N 3.14Å; K222-H224 VanDerWaalsContact C-N 3.3Å; K222-H224 PolarHBondContact O-N 3.2Å; K222-E225 PolarHBondContact O-N 2.89Å; K222-E226 WeakPolarHBondContact O-CG 3.43Å; K222-E226 PolarHBondContact O-N 3.29Å |
| 223 | V | 97.4 | Very high | 95.4 | Very high | 46 Ų | 46 | 99.8 Ų | 99.8 | 28% | 0.279 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58 | -46.1 | 176.3 | 172.5 | 0 | 0 | 0 | 0 | 110.3 | F219 E225 E226 E227 | F219-V223 HydrophobicContact CD1-CG2 4.37Å; F219-V223 HydrophobicContact CD2-CG2 4.32Å; F219-V223 HydrophobicContact CE1-CG2 3.94Å; F219-V223 HydrophobicContact CE2-CG2 3.89Å; F219-V223 HydrophobicContact CZ-CG2 3.68Å; F219-V223 WeakPolarHBondContact O-CG2 3.45Å; F219-V223 PolarHBondContact O-N 2.98Å; V223-E225 PolarHBondContact O-N 3.46Å; V223-E226 PolarHBondContact O-N 3.3Å; V223-E227 HydrophobicContact CG1-CG 4.39Å; V223-E227 WeakPolarHBondContact O-CB 3.49Å; V223-E227 WeakPolarHBondContact O-CG 3.48Å; V223-E227 PolarHBondContact O-N 3.38Å |
| 224 | H | 96.1 | Very high | 94.8 | Very high | 113 Ų | 113 | 100.7 Ų | 100.7 | 52% | 0.523 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.1 | -39.6 | 177.6 | -174.2 | 59.1 | 0 | 0 | 0 | 112.8 | L220 R221 K222 E227 V228 | L220-H224 WeakPolarHBondContact O-CB 3.31Å; L220-H224 PolarHBondContact O-N 3.41Å; R221-H224 PolarHBondContact O-N 2.92Å; K222-H224 VanDerWaalsContact C-N 3.3Å; K222-H224 PolarHBondContact O-N 3.2Å; H224-E227 PolarHBondContact O-N 3.25Å; H224-V228 WeakPolarHBondContact O-CB 3.41Å; H224-V228 WeakPolarHBondContact O-CG2 3.26Å; H224-V228 PolarHBondContact O-N 2.9Å |
| 225 | E | 96.6 | Very high | 93.9 | Very high | 142 Ų | 142 | 101.4 Ų | 101.4 | 66% | 0.664 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.4 | -41.1 | 176.6 | -170.5 | 170.3 | -166.9 | 0 | 0 | 111.6 | R221 K222 V223 A229 | R221-E225 WeakPolarHBondContact O-CB 3.31Å; R221-E225 PolarHBondContact O-N 3.47Å; K222-E225 PolarHBondContact O-N 2.89Å; V223-E225 PolarHBondContact O-N 3.46Å; E225-A229 WeakPolarHBondContact O-CB 3.44Å; E225-A229 PolarHBondContact O-N 3.48Å |
| 226 | E | 95.5 | Very high | 93 | Very high | 124 Ų | 124 | 102 Ų | 102 | 58% | 0.579 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.9 | -48.1 | 172.9 | -72.9 | 174.7 | -179.1 | 0 | 0 | 111.7 | K222 V223 V228 A229 E230 | K222-E226 WeakPolarHBondContact O-CG 3.43Å; K222-E226 PolarHBondContact O-N 3.29Å; V223-E226 PolarHBondContact O-N 3.3Å; E226-V228 VanDerWaalsContact C-N 3.32Å; E226-V228 PolarHBondContact O-N 3.48Å; E226-A229 WeakPolarHBondContact O-CB 3.5Å; E226-A229 PolarHBondContact O-N 3.38Å; E226-A229 VanDerWaalsContact O-N 3.16Å; E226-E230 WeakPolarHBondContact O-CG 3.41Å; E226-E230 PolarHBondContact O-N 2.81Å |
| 227 | E | 94.3 | Very high | 91.7 | Very high | 103 Ų | 103 | 100.3 Ų | 100.3 | 48% | 0.481 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59 | -42.3 | 176.3 | -75.2 | 177.6 | 166.6 | 0 | 0 | 112 | V223 H224 L231 | V223-E227 HydrophobicContact CG1-CG 4.39Å; V223-E227 WeakPolarHBondContact O-CB 3.49Å; V223-E227 WeakPolarHBondContact O-CG 3.48Å; V223-E227 PolarHBondContact O-N 3.38Å; H224-E227 PolarHBondContact O-N 3.25Å; E227-L231 WeakPolarHBondContact O-CB 3.41Å; E227-L231 WeakPolarHBondContact O-CD1 3.45Å; E227-L231 WeakPolarHBondContact O-CG 3.28Å; E227-L231 PolarHBondContact O-N 2.93Å |
| 228 | V | 94.1 | Very high | 89.9 | Confident | 64 Ų | 64 | 100.7 Ų | 100.7 | 39% | 0.388 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.4 | -41.3 | 176.6 | 169.9 | 0 | 0 | 0 | 0 | 110.8 | H224 E226 L231 T232 | H224-V228 WeakPolarHBondContact O-CB 3.41Å; H224-V228 WeakPolarHBondContact O-CG2 3.26Å; H224-V228 PolarHBondContact O-N 2.9Å; E226-V228 VanDerWaalsContact C-N 3.32Å; E226-V228 PolarHBondContact O-N 3.48Å; V228-L231 PolarHBondContact O-N 3.23Å; V228-T232 VanDerWaalsContact O-CB 3.29Å; V228-T232 WeakPolarHBondContact O-CB 3.36Å; V228-T232 PolarHBondContact O-N 3.44Å; V228-T232 PolarHBondContact O-OG1 3.35Å |
| 229 | A | 93.9 | Very high | 87.5 | Confident | 47 Ų | 47 | 104.6 Ų | 104.6 | 39% | 0.388 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.1 | -48.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | E225 E226 L231 T232 D233 | E225-A229 WeakPolarHBondContact O-CB 3.44Å; E225-A229 PolarHBondContact O-N 3.48Å; E226-A229 WeakPolarHBondContact O-CB 3.5Å; E226-A229 PolarHBondContact O-N 3.38Å; E226-A229 VanDerWaalsContact O-N 3.16Å; A229-L231 PolarHBondContact O-N 3.42Å; A229-T232 WeakPolarHBondContact O-CB 3.48Å; A229-T232 PolarHBondContact O-N 3.27Å; A229-T232 VanDerWaalsContact O-N 3.15Å; A229-D233 WeakPolarHBondContact O-CB 3.35Å; A229-D233 PolarHBondContact O-N 3.46Å |
| 230 | E | 92.8 | Very high | 84.9 | Confident | 126 Ų | 126 | 103.4 Ų | 103.4 | 59% | 0.589 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -59.8 | -44.1 | 176.3 | -73.7 | -175.7 | 175 | 0 | 0 | 112.4 | E226 T232 D233 M234 | E226-E230 WeakPolarHBondContact O-CG 3.41Å; E226-E230 PolarHBondContact O-N 2.81Å; E230-T232 VanDerWaalsContact C-N 3.33Å; E230-T232 PolarHBondContact O-N 3.3Å; E230-D233 PolarHBondContact O-N 2.93Å; E230-M234 WeakPolarHBondContact O-CB 3.22Å; E230-M234 WeakPolarHBondContact O-CG 3.47Å; E230-M234 PolarHBondContact O-N 3.19Å |
| 231 | L | 89.9 | Confident | 82.3 | Confident | 97 Ų | 97 | 104.3 Ų | 104.3 | 51% | 0.508 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.7 | -39.9 | 175.3 | -74.2 | 167 | 0 | 0 | 0 | 111.6 | E227 V228 A229 M234 I235 | E227-L231 WeakPolarHBondContact O-CB 3.41Å; E227-L231 WeakPolarHBondContact O-CD1 3.45Å; E227-L231 WeakPolarHBondContact O-CG 3.28Å; E227-L231 PolarHBondContact O-N 2.93Å; V228-L231 PolarHBondContact O-N 3.23Å; A229-L231 PolarHBondContact O-N 3.42Å; L231-M234 HydrophobicContact CD2-CE 3.73Å; L231-M234 HydrophobicContact CG-CE 4.33Å; L231-M234 PolarHBondContact O-N 2.83Å; L231-I235 WeakPolarHBondContact O-CD1 3.36Å; L231-I235 WeakPolarHBondContact O-CG1 3.33Å; L231-I235 PolarHBondContact O-N 2.96Å |
| 232 | T | 87.8 | Confident | 79.3 | Confident | 59 Ų | 59 | 101.9 Ų | 101.9 | 36% | 0.362 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -66.8 | -43.3 | 177.9 | -56.3 | 0 | 0 | 0 | 0 | 110.9 | V228 A229 E230 I235 Q236 | V228-T232 VanDerWaalsContact O-CB 3.29Å; V228-T232 WeakPolarHBondContact O-CB 3.36Å; V228-T232 PolarHBondContact O-N 3.44Å; V228-T232 PolarHBondContact O-OG1 3.35Å; A229-T232 WeakPolarHBondContact O-CB 3.48Å; A229-T232 PolarHBondContact O-N 3.27Å; A229-T232 VanDerWaalsContact O-N 3.15Å; E230-T232 VanDerWaalsContact C-N 3.33Å; E230-T232 PolarHBondContact O-N 3.3Å; T232-I235 PolarHBondContact O-N 3.44Å; T232-Q236 WeakPolarHBondContact O-CG 3.38Å; T232-Q236 PolarHBondContact O-N 2.91Å |
| 233 | D | 88.6 | Confident | 76.5 | Confident | 100 Ų | 100 | 104.4 Ų | 104.4 | 54% | 0.535 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -64 | -40.9 | 175.2 | -77.1 | -6 | 0 | 0 | 0 | 111.1 | A229 E230 I235 Q236 A237 | A229-D233 WeakPolarHBondContact O-CB 3.35Å; A229-D233 PolarHBondContact O-N 3.46Å; E230-D233 PolarHBondContact O-N 2.93Å; D233-I235 VanDerWaalsContact C-N 3.34Å; D233-I235 PolarHBondContact O-N 2.93Å; D233-Q236 PolarHBondContact O-N 3.33Å; D233-A237 WeakPolarHBondContact O-CB 3.39Å; D233-A237 PolarHBondContact O-N 3.14Å |
| 234 | M | 85 | Confident | 73.8 | Confident | 116 Ų | 116 | 109.5 Ų | 109.5 | 57% | 0.571 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -62.7 | -39.2 | 172.9 | -81.3 | -168.1 | -69.8 | 0 | 0 | 112.3 | E230 L231 A238 | E230-M234 WeakPolarHBondContact O-CB 3.22Å; E230-M234 WeakPolarHBondContact O-CG 3.47Å; E230-M234 PolarHBondContact O-N 3.19Å; L231-M234 HydrophobicContact CD2-CE 3.73Å; L231-M234 HydrophobicContact CG-CE 4.33Å; L231-M234 PolarHBondContact O-N 2.83Å; M234-A238 VanDerWaalsContact O-CB 3.23Å; M234-A238 WeakPolarHBondContact O-CB 3.49Å; M234-A238 PolarHBondContact O-N 3.16Å |
| 235 | I | 78.8 | Confident | 71 | Confident | 108 Ų | 108 | 113.5 Ų | 113.5 | 55% | 0.554 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -67.5 | -41.5 | 176.3 | -69.6 | 163.1 | 0 | 0 | 0 | 110.7 | L231 T232 D233 A238 Q239 | L231-I235 WeakPolarHBondContact O-CD1 3.36Å; L231-I235 WeakPolarHBondContact O-CG1 3.33Å; L231-I235 PolarHBondContact O-N 2.96Å; T232-I235 PolarHBondContact O-N 3.44Å; D233-I235 VanDerWaalsContact C-N 3.34Å; D233-I235 PolarHBondContact O-N 2.93Å; I235-A238 PolarHBondContact O-N 3.28Å; I235-Q239 PolarHBondContact O-N 3.19Å |
| 236 | Q | 78.4 | Confident | 68.2 | Low | 112 Ų | 112 | 111 Ų | 111 | 52% | 0.523 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -67.9 | -41.8 | 176.4 | -72 | -179.3 | 24.5 | 0 | 0 | 112 | T232 D233 A238 Q239 V240 | T232-Q236 WeakPolarHBondContact O-CG 3.38Å; T232-Q236 PolarHBondContact O-N 2.91Å; D233-Q236 PolarHBondContact O-N 3.33Å; Q236-A238 VanDerWaalsContact C-N 3.29Å; Q236-A238 PolarHBondContact O-N 2.86Å; Q236-Q239 WeakPolarHBondContact O-CA 3.45Å; Q236-Q239 PolarHBondContact O-N 3.41Å; Q236-V240 PolarHBondContact O-N 2.95Å |
| 237 | A | 70.3 | Confident | 66.2 | Low | 63 Ų | 63 | 109.4 Ų | 109.4 | 52% | 0.521 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -64.6 | -33.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | D233 Q239 | D233-A237 WeakPolarHBondContact O-CB 3.39Å; D233-A237 PolarHBondContact O-N 3.14Å; A237-Q239 PolarHBondContact O-N 3.27Å |
| 238 | A | 60 | Low | 64.4 | Low | 89 Ų | 89 | 114.1 Ų | 114.1 | 74% | 0.736 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -71.3 | -16.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | M234 I235 Q236 | M234-A238 VanDerWaalsContact O-CB 3.23Å; M234-A238 WeakPolarHBondContact O-CB 3.49Å; M234-A238 PolarHBondContact O-N 3.16Å; I235-A238 PolarHBondContact O-N 3.28Å; Q236-A238 VanDerWaalsContact C-N 3.29Å; Q236-A238 PolarHBondContact O-N 2.86Å |
| 239 | Q | 48.1 | Very low | 62.8 | Low | 160 Ų | 160 | 114.9 Ų | 114.9 | 75% | 0.748 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.4 | -2.2 | 177.3 | -82.4 | -164.6 | -56 | 0 | 0 | 115.1 | I235 Q236 A237 | I235-Q239 PolarHBondContact O-N 3.19Å; Q236-Q239 WeakPolarHBondContact O-CA 3.45Å; Q236-Q239 PolarHBondContact O-N 3.41Å; A237-Q239 PolarHBondContact O-N 3.27Å |
| 240 | V | 43.8 | Very low | 61.3 | Low | 99 Ų | 99 | 117.8 Ų | 117.8 | 60% | 0.6 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -127.6 | 119.4 | 174.5 | 178.4 | 0 | 0 | 0 | 0 | 108.8 | Q236 V242 | Q236-V240 PolarHBondContact O-N 2.95Å; V240-V242 PolarHBondContact O-N 3.38Å; V240-V242 VanDerWaalsContact O-N 3.11Å |
| 241 | S | 42.9 | Very low | 60.2 | Low | 115 Ų | 115 | 117 Ų | 117 | 80% | 0.804 | 65% | 0.647 | S | S | * | * | trans | -48 | 116.8 | 172.2 | 53.7 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 242 | V | 34.5 | Very low | 59.5 | Low | 119 Ų | 119 | 117.5 Ų | 117.5 | 72% | 0.721 | 65% | 0.654 | S | S | * | * | trans | -105.6 | 98 | 170.3 | 178.9 | 0 | 0 | 0 | 0 | 108.2 | V240 M244 | V240-V242 PolarHBondContact O-N 3.38Å; V240-V242 VanDerWaalsContact O-N 3.11Å; V242-M244 PolarHBondContact O-N 3.24Å | ||
| 243 | E | 37.5 | Very low | 58.9 | Low | 190 Ų | 190 | 117.7 Ų | 117.7 | 89% | 0.888 | 66% | 0.658 | S | S | * | * | trans | -68.8 | 114.4 | 154.5 | -79.1 | -178.3 | 154.3 | 0 | 0 | 107.7 | ||||
| 244 | M | 40.3 | Very low | 58.5 | Low | 154 Ų | 154 | 115.1 Ų | 115.1 | 76% | 0.759 | 65% | 0.65 | S | S | * | * | trans | -93.8 | 94.1 | -178.3 | -171.8 | 172.3 | 63.4 | 0 | 0 | 109.4 | V242 V246 | V242-M244 PolarHBondContact O-N 3.24Å; M244-V246 HydrophobicContact CE-CG2 3.95Å; M244-V246 HydrophobicContact CG-CG2 3.64Å; M244-V246 PolarHBondContact O-N 2.94Å; M244-V246 HydrophobicContact SD-CG2 4.05Å | ||
| 245 | E | 38.8 | Very low | 58.3 | Low | 197 Ų | 197 | 114.7 Ų | 114.7 | 92% | 0.921 | 65% | 0.65 | S | S | * | * | trans | -79.9 | 97 | 163.5 | -79.9 | -152 | 156.8 | 0 | 0 | 109.9 | A247 | E245-A247 PolarHBondContact O-N 2.68Š| ||
| 246 | V | 37.1 | Very low | 58.7 | Low | 90 Ų | 90 | 117.1 Ų | 117.1 | 55% | 0.545 | 66% | 0.656 | S | S | . | * | trans | -79.2 | 96.5 | 172.9 | -176.4 | 0 | 0 | 0 | 0 | 109.1 | M244 K248 | M244-V246 HydrophobicContact CE-CG2 3.95Å; M244-V246 HydrophobicContact CG-CG2 3.64Å; M244-V246 PolarHBondContact O-N 2.94Å; M244-V246 HydrophobicContact SD-CG2 4.05Å; V246-K248 PolarHBondContact O-N 2.98Å | ||
| 247 | A | 53.5 | Low | 59.1 | Low | 90 Ų | 90 | 117.4 Ų | 117.4 | 74% | 0.744 | 66% | 0.658 | S | S | * | * | trans | -66.1 | 118.2 | 154.1 | 0 | 0 | 0 | 0 | 0 | 107.2 | E245 P249 | E245-A247 PolarHBondContact O-N 2.68Å; A247-P249 WeakPolarHBondContact O-CD 3.42Å | ||
| 248 | K | 55.8 | Low | 60 | Low | 201 Ų | 201 | 118.8 Ų | 118.8 | 87% | 0.874 | 66% | 0.656 | S | S | * | * | trans | -48.1 | 106.6 | -177.2 | -75.8 | -178.6 | 177.3 | 176 | 0 | 110.8 | V246 | V246-K248 PolarHBondContact O-N 2.98Š| ||
| 249 | P | 61.4 | Low | 61.4 | Low | 81 Ų | 81 | 123.6 Ų | 123.6 | 53% | 0.526 | 66% | 0.655 | S | S | . | * | trans | -71.7 | 148.9 | 163.9 | -1.2 | 20.4 | 0 | 0 | 0 | 106.4 | A247 L251 | A247-P249 WeakPolarHBondContact O-CD 3.42Å; P249-L251 PolarHBondContact O-N 3.45Å | ||
| 250 | D | 62.5 | Low | 63.4 | Low | 107 Ų | 107 | 119.4 Ų | 119.4 | 57% | 0.572 | 64% | 0.643 | S | S | * | * | trans | -67.8 | 84.4 | 170.7 | -177.5 | 12.2 | 0 | 0 | 0 | 109.3 | T252 S253 A254 | D250-T252 PolarHBondContact O-N 3.18Å; D250-T252 VanDerWaalsContact O-N 3.08Å; D250-T252 VanDerWaalsContact OD1-CB 3.28Å; D250-T252 WeakPolarHBondContact OD1-CB 3.42Å; D250-T252 PolarHBondContact OD1-N 2.88Å; D250-T252 PolarHBondContact OD1-OG1 2.86Å; D250-S253 PolarHBondContact O-N 2.97Å; D250-A254 PolarHBondContact O-N 3.37Å; D250-A254 VanDerWaalsContact O-N 3.12Å | ||
| 251 | L | 68.6 | Low | 65.6 | Low | 109 Ų | 109 | 119.7 Ų | 119.7 | 57% | 0.571 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -54.3 | -26.3 | 178.2 | -92 | 117.9 | 0 | 0 | 0 | 111.3 | P249 L255 | P249-L251 PolarHBondContact O-N 3.45Å; L251-L255 HydrophobicContact CD2-CD1 4.48Å; L251-L255 WeakPolarHBondContact O-CB 3.39Å; L251-L255 WeakPolarHBondContact O-CD1 3.46Å; L251-L255 WeakPolarHBondContact O-CG 3.42Å; L251-L255 PolarHBondContact O-N 3.32Å |
| 252 | T | 75.8 | Confident | 68 | Low | 108 Ų | 108 | 122.3 Ų | 122.3 | 66% | 0.663 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -69 | -43.8 | 178.6 | -39.2 | 0 | 0 | 0 | 0 | 110.8 | D250 K256 | D250-T252 PolarHBondContact O-N 3.18Å; D250-T252 VanDerWaalsContact O-N 3.08Å; D250-T252 VanDerWaalsContact OD1-CB 3.28Å; D250-T252 WeakPolarHBondContact OD1-CB 3.42Å; D250-T252 PolarHBondContact OD1-N 2.88Å; D250-T252 PolarHBondContact OD1-OG1 2.86Å; T252-K256 WeakPolarHBondContact O-CB 3.42Å; T252-K256 PolarHBondContact O-N 3.41Å |
| 253 | S | 75.1 | Confident | 70.8 | Confident | 64 Ų | 64 | 123 Ų | 123 | 45% | 0.448 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -68.7 | -45.2 | 176 | -167.9 | 0 | 0 | 0 | 0 | 111.4 | D250 K256 E257 | D250-S253 PolarHBondContact O-N 2.97Å; S253-K256 PolarHBondContact O-N 3.44Å; S253-E257 WeakPolarHBondContact O-CB 3.43Å; S253-E257 PolarHBondContact O-N 3.33Å |
| 254 | A | 79.3 | Confident | 73.5 | Confident | 45 Ų | 45 | 116.2 Ų | 116.2 | 37% | 0.372 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -64.6 | -42.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | D250 E257 I258 | D250-A254 PolarHBondContact O-N 3.37Å; D250-A254 VanDerWaalsContact O-N 3.12Å; A254-E257 PolarHBondContact O-N 2.91Å; A254-I258 WeakPolarHBondContact O-CB 3.45Å; A254-I258 WeakPolarHBondContact O-CD1 3.37Å; A254-I258 WeakPolarHBondContact O-CG1 3.4Å; A254-I258 PolarHBondContact O-N 2.92Å |
| 255 | L | 82.6 | Confident | 75.9 | Confident | 107 Ų | 107 | 114.7 Ų | 114.7 | 56% | 0.56 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67.3 | -36.1 | 175.2 | -73.2 | 168.6 | 0 | 0 | 0 | 112 | L251 R259 | L251-L255 HydrophobicContact CD2-CD1 4.48Å; L251-L255 WeakPolarHBondContact O-CB 3.39Å; L251-L255 WeakPolarHBondContact O-CD1 3.46Å; L251-L255 WeakPolarHBondContact O-CG 3.42Å; L251-L255 PolarHBondContact O-N 3.32Å; L255-R259 VanDerWaalsContact O-CB 3.24Å; L255-R259 WeakPolarHBondContact O-CB 3.49Å; L255-R259 PolarHBondContact O-N 3.43Å |
| 256 | K | 86.4 | Confident | 78.5 | Confident | 159 Ų | 159 | 108.1 Ų | 108.1 | 69% | 0.691 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -67.3 | -38.2 | 174.7 | -171.3 | 178.7 | 180 | -175.6 | 0 | 111.5 | T252 S253 S260 | T252-K256 WeakPolarHBondContact O-CB 3.42Å; T252-K256 PolarHBondContact O-N 3.41Å; S253-K256 PolarHBondContact O-N 3.44Å; K256-S260 WeakPolarHBondContact O-CB 3.39Å; K256-S260 PolarHBondContact O-N 2.89Å |
| 257 | E | 87.4 | Confident | 81.2 | Confident | 119 Ų | 119 | 106.6 Ų | 106.6 | 56% | 0.556 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -70.6 | -45 | 176.4 | -174.6 | 155.7 | -162.4 | 0 | 0 | 112.1 | S253 A254 R259 S260 Q261 | S253-E257 WeakPolarHBondContact O-CB 3.43Å; S253-E257 PolarHBondContact O-N 3.33Å; A254-E257 PolarHBondContact O-N 2.91Å; E257-R259 VanDerWaalsContact C-N 3.3Å; E257-R259 PolarHBondContact O-N 3.01Å; E257-S260 CarbonylContact O-C 3.52Å; E257-S260 WeakPolarHBondContact O-CB 3.5Å; E257-S260 PolarHBondContact O-N 3.48Å; E257-S260 VanDerWaalsContact O-N 3.16Å; E257-Q261 WeakPolarHBondContact O-CB 3.44Å; E257-Q261 VanDerWaalsContact O-CG 3.27Å; E257-Q261 WeakPolarHBondContact O-CG 3.46Å; E257-Q261 PolarHBondContact O-N 3.42Å |
| 258 | I | 88.3 | Confident | 83.1 | Confident | 92 Ų | 92 | 108.3 Ų | 108.3 | 47% | 0.472 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -58.3 | -44.8 | 172.4 | -68.9 | 164.6 | 0 | 0 | 0 | 110.3 | A254 S260 Q261 Y262 | A254-I258 WeakPolarHBondContact O-CB 3.45Å; A254-I258 WeakPolarHBondContact O-CD1 3.37Å; A254-I258 WeakPolarHBondContact O-CG1 3.4Å; A254-I258 PolarHBondContact O-N 2.92Å; I258-S260 PolarHBondContact O-N 2.9Å; I258-Q261 PolarHBondContact O-N 3.4Å; I258-Y262 HydrophobicContact CG2-CD2 3.83Å; I258-Y262 HydrophobicContact CG2-CE2 4.04Å; I258-Y262 WeakPolarHBondContact O-CD2 3.06Å; I258-Y262 PolarHBondContact O-N 2.89Å |
| 259 | R | 89.4 | Confident | 84.9 | Confident | 190 Ų | 190 | 104.3 Ų | 104.3 | 72% | 0.717 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -61.8 | -44 | 175.9 | -172.8 | 175.4 | -177 | 147.2 | 2.2 | 111.8 | L255 E257 Q261 Y262 E263 | L255-R259 VanDerWaalsContact O-CB 3.24Å; L255-R259 WeakPolarHBondContact O-CB 3.49Å; L255-R259 PolarHBondContact O-N 3.43Å; E257-R259 VanDerWaalsContact C-N 3.3Å; E257-R259 PolarHBondContact O-N 3.01Å; R259-Q261 VanDerWaalsContact C-N 3.33Å; R259-Q261 PolarHBondContact O-N 3.45Å; R259-Y262 PolarHBondContact O-N 2.92Å; R259-E263 WeakPolarHBondContact O-CB 3.24Å; R259-E263 PolarHBondContact O-N 2.86Å |
| 260 | S | 90 | Very high | 86.6 | Confident | 71 Ų | 71 | 105.7 Ų | 105.7 | 50% | 0.497 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.4 | -37.6 | 176.2 | -175 | 0 | 0 | 0 | 0 | 112.5 | K256 E257 I258 S264 | K256-S260 WeakPolarHBondContact O-CB 3.39Å; K256-S260 PolarHBondContact O-N 2.89Å; E257-S260 CarbonylContact O-C 3.52Å; E257-S260 WeakPolarHBondContact O-CB 3.5Å; E257-S260 PolarHBondContact O-N 3.48Å; E257-S260 VanDerWaalsContact O-N 3.16Å; I258-S260 PolarHBondContact O-N 2.9Å; S260-S264 WeakPolarHBondContact O-CB 3.39Å; S260-S264 PolarHBondContact O-N 3.37Å |
| 261 | Q | 91.3 | Very high | 88.1 | Confident | 106 Ų | 106 | 105.6 Ų | 105.6 | 50% | 0.495 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67.2 | -45.2 | 175.6 | -72.5 | -73.7 | -5.7 | 0 | 0 | 110.7 | E257 I258 R259 E263 S264 M265 | E257-Q261 WeakPolarHBondContact O-CB 3.44Å; E257-Q261 VanDerWaalsContact O-CG 3.27Å; E257-Q261 WeakPolarHBondContact O-CG 3.46Å; E257-Q261 PolarHBondContact O-N 3.42Å; I258-Q261 PolarHBondContact O-N 3.4Å; R259-Q261 VanDerWaalsContact C-N 3.33Å; R259-Q261 PolarHBondContact O-N 3.45Å; Q261-E263 PolarHBondContact O-N 3Å; Q261-S264 PolarHBondContact O-N 3.32Å; Q261-M265 WeakPolarHBondContact O-CB 3.36Å; Q261-M265 VanDerWaalsContact O-CG 3.31Å; Q261-M265 WeakPolarHBondContact O-CG 3.29Å; Q261-M265 PolarHBondContact O-N 3.19Å |
| 262 | Y | 92.9 | Very high | 89.3 | Confident | 169 Ų | 169 | 103.6 Ų | 103.6 | 66% | 0.663 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.9 | -41.5 | 175.3 | -95.9 | -81.4 | 0 | 0 | 0 | 112.6 | I258 R259 M265 A266 | I258-Y262 HydrophobicContact CG2-CD2 3.83Å; I258-Y262 HydrophobicContact CG2-CE2 4.04Å; I258-Y262 WeakPolarHBondContact O-CD2 3.06Å; I258-Y262 PolarHBondContact O-N 2.89Å; R259-Y262 PolarHBondContact O-N 2.92Å; Y262-M265 PolarHBondContact O-N 3.45Å; Y262-A266 VanDerWaalsContact O-CB 3.24Å; Y262-A266 WeakPolarHBondContact O-CB 3.43Å; Y262-A266 PolarHBondContact O-N 3.37Å |
| 263 | E | 92.3 | Very high | 90.2 | Very high | 135 Ų | 135 | 100.1 Ų | 100.1 | 63% | 0.631 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -67.1 | -39.3 | 177.2 | -168.3 | 166.5 | -160.3 | 0 | 0 | 111.4 | R259 Q261 S267 | R259-E263 WeakPolarHBondContact O-CB 3.24Å; R259-E263 PolarHBondContact O-N 2.86Å; Q261-E263 PolarHBondContact O-N 3Å; E263-S267 VanDerWaalsContact O-CB 3.24Å; E263-S267 WeakPolarHBondContact O-CB 3.47Å; E263-S267 PolarHBondContact O-N 3.47Å |
| 264 | S | 93.8 | Very high | 91.2 | Very high | 46 Ų | 46 | 101.6 Ų | 101.6 | 32% | 0.322 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.4 | -44.5 | 172.3 | -176.7 | 0 | 0 | 0 | 0 | 112.2 | S260 Q261 S267 K268 | S260-S264 WeakPolarHBondContact O-CB 3.39Å; S260-S264 PolarHBondContact O-N 3.37Å; Q261-S264 PolarHBondContact O-N 3.32Å; S264-S267 PolarHBondContact O-N 3.11Å; S264-K268 WeakPolarHBondContact O-CB 3.43Å; S264-K268 VanDerWaalsContact O-CG 3.25Å; S264-K268 WeakPolarHBondContact O-CG 3.33Å; S264-K268 PolarHBondContact O-N 3.3Å |
| 265 | M | 92 | Very high | 91.9 | Very high | 122 Ų | 122 | 105.4 Ų | 105.4 | 60% | 0.601 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -65.3 | -42.8 | 176.6 | -76.9 | -174.6 | 69.1 | 0 | 0 | 112 | Q261 Y262 K268 N269 | Q261-M265 WeakPolarHBondContact O-CB 3.36Å; Q261-M265 VanDerWaalsContact O-CG 3.31Å; Q261-M265 WeakPolarHBondContact O-CG 3.29Å; Q261-M265 PolarHBondContact O-N 3.19Å; Y262-M265 PolarHBondContact O-N 3.45Å; M265-K268 PolarHBondContact O-N 2.86Å; M265-N269 VanDerWaalsContact O-CB 3.26Å; M265-N269 WeakPolarHBondContact O-CB 3.37Å; M265-N269 PolarHBondContact O-N 3.3Å |
| 266 | A | 92.3 | Very high | 92.6 | Very high | 60 Ų | 60 | 107.1 Ų | 107.1 | 50% | 0.496 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.3 | -42.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y262 N269 L270 | Y262-A266 VanDerWaalsContact O-CB 3.24Å; Y262-A266 WeakPolarHBondContact O-CB 3.43Å; Y262-A266 PolarHBondContact O-N 3.37Å; A266-N269 PolarHBondContact O-N 2.78Å; A266-L270 WeakPolarHBondContact O-CB 3.28Å; A266-L270 PolarHBondContact O-N 3.49Å |
| 267 | S | 93.6 | Very high | 93.1 | Very high | 58 Ų | 58 | 106 Ų | 106 | 41% | 0.406 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.6 | -46.6 | 175.4 | -178.2 | 0 | 0 | 0 | 0 | 112 | E263 S264 N269 L270 Q271 | E263-S267 VanDerWaalsContact O-CB 3.24Å; E263-S267 WeakPolarHBondContact O-CB 3.47Å; E263-S267 PolarHBondContact O-N 3.47Å; S264-S267 PolarHBondContact O-N 3.11Å; S267-N269 PolarHBondContact O-N 2.87Å; S267-L270 PolarHBondContact O-N 3.2Å; S267-Q271 WeakPolarHBondContact O-CG 3.5Å; S267-Q271 PolarHBondContact O-N 3.05Å |
| 268 | K | 94.9 | Very high | 93.5 | Very high | 125 Ų | 125 | 106.7 Ų | 106.7 | 54% | 0.543 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.1 | -44.5 | 174.9 | -74.6 | 173.5 | -176.9 | 178.8 | 0 | 111.9 | S264 M265 L270 Q271 S272 | S264-K268 WeakPolarHBondContact O-CB 3.43Å; S264-K268 VanDerWaalsContact O-CG 3.25Å; S264-K268 WeakPolarHBondContact O-CG 3.33Å; S264-K268 PolarHBondContact O-N 3.3Å; M265-K268 PolarHBondContact O-N 2.86Å; K268-L270 VanDerWaalsContact C-N 3.33Å; K268-L270 PolarHBondContact O-N 3.46Å; K268-Q271 PolarHBondContact O-N 2.95Å; K268-S272 WeakPolarHBondContact O-CB 3.4Å; K268-S272 PolarHBondContact O-N 3.5Å; K268-S272 PolarHBondContact O-OG 2.95Å; K268-S272 VanDerWaalsContact O-OG 3.05Å |
| 269 | N | 94 | Very high | 93.9 | Very high | 118 Ų | 118 | 105.4 Ų | 105.4 | 63% | 0.631 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.8 | -41.5 | 177.8 | -173 | 29.9 | 0 | 0 | 0 | 111.7 | M265 A266 S267 S272 A273 | M265-N269 VanDerWaalsContact O-CB 3.26Å; M265-N269 WeakPolarHBondContact O-CB 3.37Å; M265-N269 PolarHBondContact O-N 3.3Å; A266-N269 PolarHBondContact O-N 2.78Å; S267-N269 PolarHBondContact O-N 2.87Å; N269-S272 PolarHBondContact O-N 2.84Å; N269-A273 WeakPolarHBondContact O-CB 3.04Å; N269-A273 PolarHBondContact O-N 2.9Å |
| 270 | L | 95.1 | Very high | 94.3 | Very high | 109 Ų | 109 | 100.9 Ų | 100.9 | 57% | 0.571 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.2 | -46.1 | 175.2 | -175.6 | 66 | 0 | 0 | 0 | 111.6 | A266 S267 K268 A273 E274 | A266-L270 WeakPolarHBondContact O-CB 3.28Å; A266-L270 PolarHBondContact O-N 3.49Å; S267-L270 PolarHBondContact O-N 3.2Å; K268-L270 VanDerWaalsContact C-N 3.33Å; K268-L270 PolarHBondContact O-N 3.46Å; L270-A273 PolarHBondContact O-N 2.83Å; L270-E274 WeakPolarHBondContact O-CG 3.34Å; L270-E274 PolarHBondContact O-N 3.26Å |
| 271 | Q | 95.6 | Very high | 94.6 | Very high | 105 Ų | 105 | 104 Ų | 104 | 49% | 0.491 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.4 | -46.1 | 176.8 | -72.8 | 175.8 | 2.8 | 0 | 0 | 111.9 | S267 K268 A273 E274 E275 | S267-Q271 WeakPolarHBondContact O-CG 3.5Å; S267-Q271 PolarHBondContact O-N 3.05Å; K268-Q271 PolarHBondContact O-N 2.95Å; Q271-A273 VanDerWaalsContact C-N 3.3Å; Q271-A273 PolarHBondContact O-N 3.37Å; Q271-E274 PolarHBondContact O-N 3.47Å; Q271-E275 WeakPolarHBondContact O-CB 3.42Å; Q271-E275 WeakPolarHBondContact O-CG 3.3Å; Q271-E275 PolarHBondContact O-N 2.94Å |
| 272 | S | 93.9 | Very high | 94.9 | Very high | 68 Ų | 68 | 101.7 Ų | 101.7 | 48% | 0.476 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.8 | -38.1 | 176.4 | -62.9 | 0 | 0 | 0 | 0 | 112 | K268 N269 W276 | K268-S272 WeakPolarHBondContact O-CB 3.4Å; K268-S272 PolarHBondContact O-N 3.5Å; K268-S272 PolarHBondContact O-OG 2.95Å; K268-S272 VanDerWaalsContact O-OG 3.05Å; N269-S272 PolarHBondContact O-N 2.84Å; S272-W276 WeakPolarHBondContact O-CB 3.35Å; S272-W276 PolarHBondContact O-N 2.9Å |
| 273 | A | 93.9 | Very high | 95.1 | Very high | 35 Ų | 35 | 97 Ų | 97 | 29% | 0.289 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.8 | -44.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | N269 L270 Q271 W276 Y277 | N269-A273 WeakPolarHBondContact O-CB 3.04Å; N269-A273 PolarHBondContact O-N 2.9Å; L270-A273 PolarHBondContact O-N 2.83Å; Q271-A273 VanDerWaalsContact C-N 3.3Å; Q271-A273 PolarHBondContact O-N 3.37Å; A273-W276 PolarHBondContact O-N 2.83Å; A273-Y277 WeakPolarHBondContact O-CD2 3.4Å; A273-Y277 PolarHBondContact O-N 2.89Å |
| 274 | E | 95.4 | Very high | 95.3 | Very high | 94 Ų | 94 | 95.7 Ų | 95.7 | 44% | 0.439 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.1 | -44.6 | 176.1 | -76.4 | -173.6 | -170.4 | 0 | 0 | 112.7 | L270 Q271 W276 Y277 K278 | L270-E274 WeakPolarHBondContact O-CG 3.34Å; L270-E274 PolarHBondContact O-N 3.26Å; Q271-E274 PolarHBondContact O-N 3.47Å; E274-W276 VanDerWaalsContact C-N 3.34Å; E274-Y277 PolarHBondContact O-N 3.42Å; E274-K278 WeakPolarHBondContact O-CB 3.4Å; E274-K278 VanDerWaalsContact O-CG 3.27Å; E274-K278 WeakPolarHBondContact O-CG 3.35Å; E274-K278 PolarHBondContact O-N 3.34Å; E274-K278 IonicContact OE2-NZ 2.75Å |
| 275 | E | 95.6 | Very high | 95.4 | Very high | 125 Ų | 125 | 97.9 Ų | 97.9 | 58% | 0.584 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.8 | -41.2 | 176 | -73.5 | 174.1 | 179.4 | 0 | 0 | 111.1 | Q271 K278 S279 | Q271-E275 WeakPolarHBondContact O-CB 3.42Å; Q271-E275 WeakPolarHBondContact O-CG 3.3Å; Q271-E275 PolarHBondContact O-N 2.94Å; E275-K278 PolarHBondContact O-N 2.89Å; E275-S279 VanDerWaalsContact O-CB 3.25Å; E275-S279 WeakPolarHBondContact O-CB 3.41Å; E275-S279 PolarHBondContact O-N 3.39Å |
| 276 | W | 95.8 | Very high | 95.7 | Very high | 143 Ų | 143 | 96.4 Ų | 96.4 | 54% | 0.542 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.8 | -46.1 | 175.1 | -175.6 | 87.6 | 0 | 0 | 0 | 111.7 | S272 A273 E274 S279 K280 | S272-W276 WeakPolarHBondContact O-CB 3.35Å; S272-W276 PolarHBondContact O-N 2.9Å; A273-W276 PolarHBondContact O-N 2.83Å; E274-W276 VanDerWaalsContact C-N 3.34Å; W276-S279 PolarHBondContact O-N 3.32Å; W276-K280 HydrophobicContact CD2-CG 4.23Å; W276-K280 HydrophobicContact CE3-CG 4.44Å; W276-K280 HydrophobicContact CH2-CG 4.28Å; W276-K280 HydrophobicContact CZ2-CG 4.06Å; W276-K280 HydrophobicContact CZ3-CG 4.46Å; W276-K280 WeakPolarHBondContact O-CB 3.36Å; W276-K280 WeakPolarHBondContact O-CG 3.49Å; W276-K280 PolarHBondContact O-N 3.5Å |
| 277 | Y | 96.8 | Very high | 95.9 | Very high | 135 Ų | 135 | 99.7 Ų | 99.7 | 53% | 0.529 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64 | -46 | 175.4 | -79.1 | -62.6 | 0 | 0 | 0 | 111.7 | A273 E274 S279 K280 F281 | A273-Y277 WeakPolarHBondContact O-CD2 3.4Å; A273-Y277 PolarHBondContact O-N 2.89Å; E274-Y277 PolarHBondContact O-N 3.42Å; Y277-S279 VanDerWaalsContact C-N 3.32Å; Y277-S279 PolarHBondContact O-N 3.36Å; Y277-K280 PolarHBondContact O-N 3.49Å; Y277-F281 WeakPolarHBondContact O-CD2 3.41Å; Y277-F281 PolarHBondContact O-N 3.32Å |
| 278 | K | 97.2 | Very high | 96 | Very high | 134 Ų | 134 | 99.2 Ų | 99.2 | 58% | 0.583 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -58.4 | -44.9 | 177.1 | -77.4 | 169 | -177.2 | 159.9 | 0 | 111.5 | E274 E275 F281 A282 | E274-K278 WeakPolarHBondContact O-CB 3.4Å; E274-K278 VanDerWaalsContact O-CG 3.27Å; E274-K278 WeakPolarHBondContact O-CG 3.35Å; E274-K278 PolarHBondContact O-N 3.34Å; E274-K278 IonicContact OE2-NZ 2.75Å; E275-K278 PolarHBondContact O-N 2.89Å; K278-F281 PolarHBondContact O-N 3.2Å; K278-A282 WeakPolarHBondContact O-CB 3.49Å; K278-A282 PolarHBondContact O-N 3.02Å |
| 279 | S | 97.1 | Very high | 96.1 | Very high | 65 Ų | 65 | 95.7 Ų | 95.7 | 46% | 0.455 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.8 | -47.3 | 175.5 | -172.6 | 0 | 0 | 0 | 0 | 111 | E275 W276 Y277 F281 A282 D283 | E275-S279 VanDerWaalsContact O-CB 3.25Å; E275-S279 WeakPolarHBondContact O-CB 3.41Å; E275-S279 PolarHBondContact O-N 3.39Å; W276-S279 PolarHBondContact O-N 3.32Å; Y277-S279 VanDerWaalsContact C-N 3.32Å; Y277-S279 PolarHBondContact O-N 3.36Å; S279-F281 PolarHBondContact O-N 2.94Å; S279-A282 WeakPolarHBondContact O-CB 3.45Å; S279-A282 PolarHBondContact O-N 3.33Å; S279-A282 VanDerWaalsContact O-N 3.14Å; S279-D283 PolarHBondContact O-N 2.87Å |
| 280 | K | 96.9 | Very high | 96.2 | Very high | 96 Ų | 96 | 96.7 Ų | 96.7 | 42% | 0.417 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.6 | -38.7 | 176.5 | -75.8 | -64.3 | 174.1 | -155.2 | 0 | 114 | W276 Y277 D283 L284 | W276-K280 HydrophobicContact CD2-CG 4.23Å; W276-K280 HydrophobicContact CE3-CG 4.44Å; W276-K280 HydrophobicContact CH2-CG 4.28Å; W276-K280 HydrophobicContact CZ2-CG 4.06Å; W276-K280 HydrophobicContact CZ3-CG 4.46Å; W276-K280 WeakPolarHBondContact O-CB 3.36Å; W276-K280 WeakPolarHBondContact O-CG 3.49Å; W276-K280 PolarHBondContact O-N 3.5Å; Y277-K280 PolarHBondContact O-N 3.49Å; K280-D283 IonicContact NZ-OD2 3.71Å; K280-L284 WeakPolarHBondContact O-CB 3.28Å; K280-L284 VanDerWaalsContact O-CG 3.31Å; K280-L284 WeakPolarHBondContact O-CG 3.29Å; K280-L284 PolarHBondContact O-N 2.91Å |
| 281 | F | 97 | Very high | 96.3 | Very high | 136 Ų | 136 | 96.2 Ų | 96.2 | 60% | 0.596 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -67 | -39.3 | 174 | -85.5 | -70.5 | 0 | 0 | 0 | 111.9 | Y277 K278 S279 T285 | Y277-F281 WeakPolarHBondContact O-CD2 3.41Å; Y277-F281 PolarHBondContact O-N 3.32Å; K278-F281 PolarHBondContact O-N 3.2Å; S279-F281 PolarHBondContact O-N 2.94Å; F281-T285 VanDerWaalsContact O-CB 3.31Å; F281-T285 WeakPolarHBondContact O-CB 3.33Å; F281-T285 PolarHBondContact O-N 2.88Å; F281-T285 PolarHBondContact O-OG1 3.08Å |
| 282 | A | 97 | Very high | 96.4 | Very high | 57 Ų | 57 | 95.6 Ų | 95.6 | 47% | 0.471 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.3 | -48.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | K278 S279 L284 T285 E286 | K278-A282 WeakPolarHBondContact O-CB 3.49Å; K278-A282 PolarHBondContact O-N 3.02Å; S279-A282 WeakPolarHBondContact O-CB 3.45Å; S279-A282 PolarHBondContact O-N 3.33Å; S279-A282 VanDerWaalsContact O-N 3.14Å; A282-L284 PolarHBondContact O-N 3.46Å; A282-T285 PolarHBondContact O-N 3.29Å; A282-E286 WeakPolarHBondContact O-CB 3.3Å; A282-E286 PolarHBondContact O-N 3.1Å |
| 283 | D | 96.6 | Very high | 96.5 | Very high | 72 Ų | 72 | 96.6 Ų | 96.6 | 39% | 0.385 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -56.3 | -48.6 | 176.3 | -71.6 | -12.6 | 0 | 0 | 0 | 111.5 | S279 K280 T285 E286 Q287 | S279-D283 PolarHBondContact O-N 2.87Å; K280-D283 IonicContact NZ-OD2 3.71Å; D283-T285 VanDerWaalsContact C-N 3.34Å; D283-T285 PolarHBondContact O-N 3Å; D283-E286 PolarHBondContact O-N 2.92Å; D283-Q287 VanDerWaalsContact O-CB 3.31Å; D283-Q287 WeakPolarHBondContact O-CB 3.35Å; D283-Q287 PolarHBondContact O-N 2.88Å |
| 284 | L | 96.4 | Very high | 96.6 | Very high | 106 Ų | 106 | 97.8 Ų | 97.8 | 56% | 0.555 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.3 | -39.5 | 178.8 | -75 | 174 | 0 | 0 | 0 | 112.1 | K280 A282 Q287 A288 | K280-L284 WeakPolarHBondContact O-CB 3.28Å; K280-L284 VanDerWaalsContact O-CG 3.31Å; K280-L284 WeakPolarHBondContact O-CG 3.29Å; K280-L284 PolarHBondContact O-N 2.91Å; A282-L284 PolarHBondContact O-N 3.46Å; L284-Q287 PolarHBondContact O-N 3.02Å; L284-A288 VanDerWaalsContact O-CB 3.32Å; L284-A288 WeakPolarHBondContact O-CB 3.4Å; L284-A288 PolarHBondContact O-N 2.92Å |
| 285 | T | 96.9 | Very high | 96.6 | Very high | 93 Ų | 93 | 96.9 Ų | 96.9 | 57% | 0.571 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -66.9 | -42.1 | 177.9 | -57.6 | 0 | 0 | 0 | 0 | 110.9 | F281 A282 D283 A288 S289 | F281-T285 VanDerWaalsContact O-CB 3.31Å; F281-T285 WeakPolarHBondContact O-CB 3.33Å; F281-T285 PolarHBondContact O-N 2.88Å; F281-T285 PolarHBondContact O-OG1 3.08Å; A282-T285 PolarHBondContact O-N 3.29Å; D283-T285 VanDerWaalsContact C-N 3.34Å; D283-T285 PolarHBondContact O-N 3Å; T285-A288 PolarHBondContact O-N 3.41Å; T285-S289 PolarHBondContact O-N 3.4Å |
| 286 | E | 97.4 | Very high | 96.7 | Very high | 91 Ų | 91 | 98.3 Ų | 98.3 | 43% | 0.425 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -68.9 | -37.7 | 177.2 | -161.6 | -168.3 | -162.2 | 0 | 0 | 111.8 | A282 D283 A288 S289 R290 | A282-E286 WeakPolarHBondContact O-CB 3.3Å; A282-E286 PolarHBondContact O-N 3.1Å; D283-E286 PolarHBondContact O-N 2.92Å; E286-A288 VanDerWaalsContact C-N 3.34Å; E286-S289 WeakPolarHBondContact CA-OG 3.48Å; E286-S289 PolarHBondContact O-N 3.13Å; E286-S289 PolarHBondContact O-OG 3.37Å; E286-R290 WeakPolarHBondContact O-CB 3.44Å; E286-R290 VanDerWaalsContact O-CG 3.32Å; E286-R290 WeakPolarHBondContact O-CG 3.47Å; E286-R290 PolarHBondContact O-N 2.88Å; E286-R290 IonicContact OE1-CZ 3.97Å; E286-R290 IonicContact OE1-NH1 3.2Å; E286-R290 IonicContact OE1-NH2 3.63Å; E286-R290 PolarHBondContact OE1-NH2 3.49Å; E286-R290 IonicContact OE2-CZ 2.78Å; E286-R290 IonicContact OE2-NH1 3.96Å; E286-R290 PolarHBondContact OE2-NH1 2.93Å; E286-R290 IonicContact OE2-NH2 3.38Å; E286-R290 PolarHBondContact OE2-NH2 3.46Å |
| 287 | Q | 96.6 | Very high | 96.6 | Very high | 128 Ų | 128 | 93.6 Ų | 93.6 | 60% | 0.598 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -66.2 | -39.2 | 173.3 | -168.9 | 174.9 | 6.5 | 0 | 0 | 111.4 | D283 L284 N291 | D283-Q287 VanDerWaalsContact O-CB 3.31Å; D283-Q287 WeakPolarHBondContact O-CB 3.35Å; D283-Q287 PolarHBondContact O-N 2.88Å; L284-Q287 PolarHBondContact O-N 3.02Å; Q287-N291 WeakPolarHBondContact O-CB 3.21Å; Q287-N291 PolarHBondContact O-N 3.13Å |
| 288 | A | 96.5 | Very high | 96.3 | Very high | 48 Ų | 48 | 90.5 Ų | 90.5 | 40% | 0.397 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.4 | -38.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L284 T285 E286 N292 | L284-A288 VanDerWaalsContact O-CB 3.32Å; L284-A288 WeakPolarHBondContact O-CB 3.4Å; L284-A288 PolarHBondContact O-N 2.92Å; T285-A288 PolarHBondContact O-N 3.41Å; E286-A288 VanDerWaalsContact C-N 3.34Å; A288-N292 PolarHBondContact O-N 3.03Å; A288-N292 PolarHBondContact O-ND2 2.89Å |
| 289 | S | 96.6 | Very high | 96.2 | Very high | 52 Ų | 52 | 92.4 Ų | 92.4 | 36% | 0.364 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -67 | -47.3 | 175.3 | 65.7 | 0 | 0 | 0 | 0 | 111.6 | T285 E286 N291 N292 D293 | T285-S289 PolarHBondContact O-N 3.4Å; E286-S289 WeakPolarHBondContact CA-OG 3.48Å; E286-S289 PolarHBondContact O-N 3.13Å; E286-S289 PolarHBondContact O-OG 3.37Å; S289-N291 VanDerWaalsContact C-N 3.3Å; S289-N291 PolarHBondContact O-N 3.17Å; S289-N292 WeakPolarHBondContact O-CB 3.47Å; S289-N292 PolarHBondContact O-N 2.99Å; S289-N292 VanDerWaalsContact O-N 3.1Å; S289-D293 PolarHBondContact O-N 3.33Å |
| 290 | R | 96.9 | Very high | 96.1 | Very high | 138 Ų | 138 | 95.6 Ų | 95.6 | 52% | 0.521 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -56.4 | -42.7 | 174.6 | -72.7 | -179.4 | -174.2 | 113.8 | -4.5 | 112.4 | E286 D293 A294 | E286-R290 WeakPolarHBondContact O-CB 3.44Å; E286-R290 VanDerWaalsContact O-CG 3.32Å; E286-R290 WeakPolarHBondContact O-CG 3.47Å; E286-R290 PolarHBondContact O-N 2.88Å; E286-R290 IonicContact OE1-CZ 3.97Å; E286-R290 IonicContact OE1-NH1 3.2Å; E286-R290 IonicContact OE1-NH2 3.63Å; E286-R290 PolarHBondContact OE1-NH2 3.49Å; E286-R290 IonicContact OE2-CZ 2.78Å; E286-R290 IonicContact OE2-NH1 3.96Å; E286-R290 PolarHBondContact OE2-NH1 2.93Å; E286-R290 IonicContact OE2-NH2 3.38Å; E286-R290 PolarHBondContact OE2-NH2 3.46Å; R290-D293 PolarHBondContact O-N 2.78Å; R290-A294 WeakPolarHBondContact O-CB 3.34Å; R290-A294 PolarHBondContact O-N 3.34Å |
| 291 | N | 96.8 | Very high | 95.8 | Very high | 100 Ų | 100 | 96.8 Ų | 96.8 | 54% | 0.535 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65 | -42.6 | 176.8 | -170.2 | 7.1 | 0 | 0 | 0 | 111.6 | Q287 S289 D293 A294 I295 | Q287-N291 WeakPolarHBondContact O-CB 3.21Å; Q287-N291 PolarHBondContact O-N 3.13Å; S289-N291 VanDerWaalsContact C-N 3.3Å; S289-N291 PolarHBondContact O-N 3.17Å; N291-D293 VanDerWaalsContact C-N 3.33Å; N291-D293 PolarHBondContact O-N 3.23Å; N291-A294 PolarHBondContact O-N 2.95Å; N291-I295 VanDerWaalsContact O-CG1 3.27Å; N291-I295 WeakPolarHBondContact O-CG1 3.2Å; N291-I295 PolarHBondContact O-N 2.88Å |
| 292 | N | 97.2 | Very high | 95.6 | Very high | 91 Ų | 91 | 93 Ų | 93 | 49% | 0.487 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.3 | -41 | 174.5 | -86.9 | -79 | 0 | 0 | 0 | 112.5 | A288 S289 I295 R296 | A288-N292 PolarHBondContact O-N 3.03Å; A288-N292 PolarHBondContact O-ND2 2.89Å; S289-N292 WeakPolarHBondContact O-CB 3.47Å; S289-N292 PolarHBondContact O-N 2.99Å; S289-N292 VanDerWaalsContact O-N 3.1Å; N292-I295 PolarHBondContact O-N 2.95Å; N292-R296 WeakPolarHBondContact O-CG 3.36Å; N292-R296 PolarHBondContact O-N 3.11Å |
| 293 | D | 96.7 | Very high | 95.4 | Very high | 90 Ų | 90 | 94.6 Ų | 94.6 | 48% | 0.481 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -68.3 | -39.8 | 177.8 | -68.8 | -23.5 | 0 | 0 | 0 | 111.5 | S289 R290 N291 I295 R296 A297 | S289-D293 PolarHBondContact O-N 3.33Å; R290-D293 PolarHBondContact O-N 2.78Å; N291-D293 VanDerWaalsContact C-N 3.33Å; N291-D293 PolarHBondContact O-N 3.23Å; D293-I295 VanDerWaalsContact C-N 3.35Å; D293-I295 PolarHBondContact O-N 3.1Å; D293-R296 PolarHBondContact O-N 2.89Å; D293-R296 IonicContact OD1-NH1 3.91Å; D293-A297 WeakPolarHBondContact O-CB 3.4Å; D293-A297 PolarHBondContact O-N 3Å |
| 294 | A | 95 | Very high | 95.3 | Very high | 60 Ų | 60 | 95.2 Ų | 95.2 | 50% | 0.496 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.5 | -41.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | R290 N291 R296 A297 S298 | R290-A294 WeakPolarHBondContact O-CB 3.34Å; R290-A294 PolarHBondContact O-N 3.34Å; N291-A294 PolarHBondContact O-N 2.95Å; A294-R296 VanDerWaalsContact C-N 3.35Å; A294-A297 PolarHBondContact O-N 3.44Å; A294-S298 WeakPolarHBondContact O-CB 3.33Å; A294-S298 PolarHBondContact O-N 3.26Å |
| 295 | I | 96.3 | Very high | 95 | Very high | 75 Ų | 75 | 96.4 Ų | 96.4 | 39% | 0.385 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.5 | -40 | 174.8 | -69 | 167.4 | 0 | 0 | 0 | 110.9 | N291 N292 D293 R299 | N291-I295 VanDerWaalsContact O-CG1 3.27Å; N291-I295 WeakPolarHBondContact O-CG1 3.2Å; N291-I295 PolarHBondContact O-N 2.88Å; N292-I295 PolarHBondContact O-N 2.95Å; D293-I295 VanDerWaalsContact C-N 3.35Å; D293-I295 PolarHBondContact O-N 3.1Å; I295-R299 WeakPolarHBondContact O-CB 3.44Å; I295-R299 WeakPolarHBondContact O-CG 3.23Å; I295-R299 PolarHBondContact O-N 3.43Å |
| 296 | R | 96.9 | Very high | 94.7 | Very high | 155 Ų | 155 | 99.7 Ų | 99.7 | 59% | 0.585 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.6 | -48.8 | 176.3 | -76.9 | 175.5 | 178.8 | 174.4 | -1.1 | 111.6 | N292 D293 A294 S298 R299 E300 | N292-R296 WeakPolarHBondContact O-CG 3.36Å; N292-R296 PolarHBondContact O-N 3.11Å; D293-R296 PolarHBondContact O-N 2.89Å; D293-R296 IonicContact OD1-NH1 3.91Å; A294-R296 VanDerWaalsContact C-N 3.35Å; R296-S298 PolarHBondContact O-N 3.43Å; R296-R299 WeakPolarHBondContact O-CB 3.48Å; R296-R299 PolarHBondContact O-N 2.91Å; R296-R299 VanDerWaalsContact O-N 3.13Å; R296-E300 WeakPolarHBondContact O-CG 3.47Å; R296-E300 PolarHBondContact O-N 3.49Å |
| 297 | A | 93.8 | Very high | 94.5 | Very high | 43 Ų | 43 | 103.4 Ų | 103.4 | 36% | 0.355 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -57.6 | -47.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | D293 A294 R299 E300 E301 | D293-A297 WeakPolarHBondContact O-CB 3.4Å; D293-A297 PolarHBondContact O-N 3Å; A294-A297 PolarHBondContact O-N 3.44Å; A297-R299 VanDerWaalsContact C-N 3.31Å; A297-R299 PolarHBondContact O-N 3.47Å; A297-E300 PolarHBondContact O-N 3.27Å; A297-E300 VanDerWaalsContact O-N 3.12Å; A297-E301 WeakPolarHBondContact O-CG 3.47Å; A297-E301 PolarHBondContact O-N 2.67Å |
| 298 | S | 90.8 | Very high | 94.3 | Very high | 71 Ų | 71 | 101.8 Ų | 101.8 | 50% | 0.497 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61 | -37.9 | 176.6 | 178.3 | 0 | 0 | 0 | 0 | 112.8 | A294 R296 A302 | A294-S298 WeakPolarHBondContact O-CB 3.33Å; A294-S298 PolarHBondContact O-N 3.26Å; R296-S298 PolarHBondContact O-N 3.43Å; S298-A302 WeakPolarHBondContact O-CB 3.5Å; S298-A302 PolarHBondContact O-N 2.99Å |
| 299 | R | 94.9 | Very high | 93.8 | Very high | 173 Ų | 173 | 105.1 Ų | 105.1 | 65% | 0.653 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -67.2 | -38.5 | 174.3 | -78.4 | 179.5 | 175.9 | -174.7 | 0.9 | 112.5 | I295 R296 A297 A302 N303 | I295-R299 WeakPolarHBondContact O-CB 3.44Å; I295-R299 WeakPolarHBondContact O-CG 3.23Å; I295-R299 PolarHBondContact O-N 3.43Å; R296-R299 WeakPolarHBondContact O-CB 3.48Å; R296-R299 PolarHBondContact O-N 2.91Å; R296-R299 VanDerWaalsContact O-N 3.13Å; A297-R299 VanDerWaalsContact C-N 3.31Å; A297-R299 PolarHBondContact O-N 3.47Å; R299-A302 PolarHBondContact O-N 3.41Å; R299-N303 WeakPolarHBondContact O-CB 3.34Å; R299-N303 VanDerWaalsContact O-CG 3.23Å; R299-N303 PolarHBondContact O-N 3.4Å; R299-N303 PolarHBondContact O-ND2 2.94Å |
| 300 | E | 94.8 | Very high | 93.6 | Very high | 133 Ų | 133 | 107.6 Ų | 107.6 | 62% | 0.621 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -65 | -45.1 | 176.2 | -73.5 | 173 | -172.7 | 0 | 0 | 111.1 | R296 A297 A302 N303 E304 | R296-E300 WeakPolarHBondContact O-CG 3.47Å; R296-E300 PolarHBondContact O-N 3.49Å; A297-E300 PolarHBondContact O-N 3.27Å; A297-E300 VanDerWaalsContact O-N 3.12Å; E300-A302 PolarHBondContact O-N 3.48Å; E300-N303 PolarHBondContact O-N 3.11Å; E300-E304 PolarHBondContact O-N 2.86Å |
| 301 | E | 90.8 | Very high | 93.1 | Very high | 120 Ų | 120 | 104.4 Ų | 104.4 | 56% | 0.561 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -59.5 | -46.5 | 173.4 | -71.3 | 177.5 | -178.9 | 0 | 0 | 111.9 | A297 N303 E304 F305 | A297-E301 WeakPolarHBondContact O-CG 3.47Å; A297-E301 PolarHBondContact O-N 2.67Å; E301-N303 VanDerWaalsContact C-N 3.29Å; E301-N303 PolarHBondContact O-N 3.49Å; E301-E304 PolarHBondContact O-N 3.33Å; E301-E304 VanDerWaalsContact O-N 3.16Å; E301-F305 HydrophobicContact CB-CE2 4.23Å; E301-F305 WeakPolarHBondContact O-CD2 3.3Å; E301-F305 WeakPolarHBondContact O-CG 3.37Å; E301-F305 PolarHBondContact O-N 3.43Å |
| 302 | A | 91.8 | Very high | 92.4 | Very high | 57 Ų | 57 | 105.3 Ų | 105.3 | 47% | 0.471 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.5 | -38.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | S298 R299 E300 R306 | S298-A302 WeakPolarHBondContact O-CB 3.5Å; S298-A302 PolarHBondContact O-N 2.99Å; R299-A302 PolarHBondContact O-N 3.41Å; E300-A302 PolarHBondContact O-N 3.48Å; A302-R306 WeakPolarHBondContact O-CB 3.47Å; A302-R306 PolarHBondContact O-N 3.37Å |
| 303 | N | 93.8 | Very high | 91.8 | Very high | 91 Ų | 91 | 103.8 Ų | 103.8 | 49% | 0.487 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -68.8 | -37.9 | 175.6 | -76.3 | -37 | 0 | 0 | 0 | 112.1 | R299 E300 E301 R306 R307 | R299-N303 WeakPolarHBondContact O-CB 3.34Å; R299-N303 VanDerWaalsContact O-CG 3.23Å; R299-N303 PolarHBondContact O-N 3.4Å; R299-N303 PolarHBondContact O-ND2 2.94Å; E300-N303 PolarHBondContact O-N 3.11Å; E301-N303 VanDerWaalsContact C-N 3.29Å; E301-N303 PolarHBondContact O-N 3.49Å; N303-R306 WeakPolarHBondContact O-CB 3.39Å; N303-R306 PolarHBondContact O-N 2.84Å; N303-R307 WeakPolarHBondContact O-CG 3.01Å; N303-R307 PolarHBondContact O-N 3.2Å |
| 304 | E | 93.8 | Very high | 91.6 | Very high | 84 Ų | 84 | 104.8 Ų | 104.8 | 39% | 0.393 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.5 | -45.8 | 176.2 | -177.1 | 52.2 | -147.5 | 0 | 0 | 111.2 | E300 E301 R306 R307 Q308 | E300-E304 PolarHBondContact O-N 2.86Å; E301-E304 PolarHBondContact O-N 3.33Å; E301-E304 VanDerWaalsContact O-N 3.16Å; E304-R306 VanDerWaalsContact C-N 3.26Å; E304-R306 PolarHBondContact O-N 2.93Å; E304-R307 WeakPolarHBondContact O-CB 3.43Å; E304-R307 PolarHBondContact O-N 3.13Å; E304-Q308 WeakPolarHBondContact O-CG 3.42Å; E304-Q308 PolarHBondContact O-N 2.91Å; E304-Q308 PolarHBondContact OE1-NE2 3.32Å |
| 305 | F | 90.1 | Very high | 91.4 | Very high | 131 Ų | 131 | 106 Ų | 106 | 58% | 0.575 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -59.2 | -38.2 | 172.5 | -67.6 | -49.4 | 0 | 0 | 0 | 112.2 | E301 Q308 L309 | E301-F305 HydrophobicContact CB-CE2 4.23Å; E301-F305 WeakPolarHBondContact O-CD2 3.3Å; E301-F305 WeakPolarHBondContact O-CG 3.37Å; E301-F305 PolarHBondContact O-N 3.43Å; F305-Q308 PolarHBondContact O-N 2.86Å; F305-L309 WeakPolarHBondContact O-CB 3.39Å; F305-L309 PolarHBondContact O-N 3.2Å |
| 306 | R | 91.9 | Very high | 90.9 | Very high | 162 Ų | 162 | 106.3 Ų | 106.3 | 61% | 0.611 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.1 | -40.3 | 174.7 | -173.2 | 177.4 | 173.3 | 94.4 | 0.1 | 112.1 | A302 N303 E304 Q310 | A302-R306 WeakPolarHBondContact O-CB 3.47Å; A302-R306 PolarHBondContact O-N 3.37Å; N303-R306 WeakPolarHBondContact O-CB 3.39Å; N303-R306 PolarHBondContact O-N 2.84Å; E304-R306 VanDerWaalsContact C-N 3.26Å; E304-R306 PolarHBondContact O-N 2.93Å; R306-Q310 WeakPolarHBondContact O-CG 3.5Å; R306-Q310 PolarHBondContact O-N 3.4Å |
| 307 | R | 92.9 | Very high | 90.6 | Very high | 170 Ų | 170 | 104.7 Ų | 104.7 | 64% | 0.642 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -66 | -43.4 | 175.1 | -73.7 | 174.9 | 178.6 | -170.2 | 0.3 | 111.8 | N303 E304 L309 Q310 S311 | N303-R307 WeakPolarHBondContact O-CG 3.01Å; N303-R307 PolarHBondContact O-N 3.2Å; E304-R307 WeakPolarHBondContact O-CB 3.43Å; E304-R307 PolarHBondContact O-N 3.13Å; R307-L309 VanDerWaalsContact C-N 3.35Å; R307-Q310 PolarHBondContact O-N 3.07Å; R307-S311 WeakPolarHBondContact O-CB 3.49Å; R307-S311 PolarHBondContact O-N 2.93Å |
| 308 | Q | 92.1 | Very high | 90.4 | Very high | 93 Ų | 93 | 105.8 Ų | 105.8 | 44% | 0.435 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.6 | -42.9 | 176.4 | -70.2 | 176.8 | 18.5 | 0 | 0 | 111.5 | E304 F305 Q310 S311 K312 | E304-Q308 WeakPolarHBondContact O-CG 3.42Å; E304-Q308 PolarHBondContact O-N 2.91Å; E304-Q308 PolarHBondContact OE1-NE2 3.32Å; F305-Q308 PolarHBondContact O-N 2.86Å; Q308-Q310 PolarHBondContact O-N 2.95Å; Q308-S311 PolarHBondContact O-N 3.36Å; Q308-K312 WeakPolarHBondContact O-CB 3.38Å; Q308-K312 WeakPolarHBondContact O-CG 3.21Å; Q308-K312 PolarHBondContact O-N 3.36Å |
| 309 | L | 86.7 | Confident | 89.8 | Confident | 118 Ų | 118 | 106.9 Ų | 106.9 | 62% | 0.618 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -59.9 | -45.3 | 175.2 | -176.7 | 67.1 | 0 | 0 | 0 | 111.4 | F305 R307 K312 T313 | F305-L309 WeakPolarHBondContact O-CB 3.39Å; F305-L309 PolarHBondContact O-N 3.2Å; R307-L309 VanDerWaalsContact C-N 3.35Å; L309-K312 PolarHBondContact O-N 3.07Å; L309-T313 WeakPolarHBondContact O-CB 3.43Å; L309-T313 PolarHBondContact O-N 2.96Å; L309-T313 PolarHBondContact O-OG1 3.46Å |
| 310 | Q | 91.2 | Very high | 89.4 | Confident | 104 Ų | 104 | 107 Ų | 107 | 49% | 0.486 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62 | -46.2 | 175.8 | -75 | 179.4 | -22.1 | 0 | 0 | 111.9 | R306 R307 Q308 K312 T313 I314 | R306-Q310 WeakPolarHBondContact O-CG 3.5Å; R306-Q310 PolarHBondContact O-N 3.4Å; R307-Q310 PolarHBondContact O-N 3.07Å; Q308-Q310 PolarHBondContact O-N 2.95Å; Q310-K312 PolarHBondContact O-N 3.12Å; Q310-T313 PolarHBondContact O-N 3.03Å; Q310-I314 WeakPolarHBondContact O-CG1 3.19Å; Q310-I314 PolarHBondContact O-N 2.92Å |
| 311 | S | 86.1 | Confident | 89 | Confident | 72 Ų | 72 | 102.4 Ų | 102.4 | 50% | 0.503 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -57.4 | -48.1 | 176.6 | -177.4 | 0 | 0 | 0 | 0 | 111.7 | R307 Q308 T313 I314 E315 | R307-S311 WeakPolarHBondContact O-CB 3.49Å; R307-S311 PolarHBondContact O-N 2.93Å; Q308-S311 PolarHBondContact O-N 3.36Å; S311-T313 VanDerWaalsContact C-N 3.34Å; S311-T313 PolarHBondContact O-N 3.5Å; S311-I314 PolarHBondContact O-N 2.87Å; S311-E315 PolarHBondContact O-N 3.37Å |
| 312 | K | 82.6 | Confident | 88.8 | Confident | 119 Ų | 119 | 100.1 Ų | 100.1 | 52% | 0.517 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.8 | -35.3 | 177.1 | -70.9 | -70.6 | 166.5 | -161.6 | 0 | 112.9 | Q308 L309 Q310 E315 I316 | Q308-K312 WeakPolarHBondContact O-CB 3.38Å; Q308-K312 WeakPolarHBondContact O-CG 3.21Å; Q308-K312 PolarHBondContact O-N 3.36Å; L309-K312 PolarHBondContact O-N 3.07Å; Q310-K312 PolarHBondContact O-N 3.12Å; K312-E315 WeakPolarHBondContact CD-OE2 3.45Å; K312-E315 IonicContact NZ-OE1 2.89Å; K312-E315 IonicContact NZ-OE2 2.83Å; K312-E315 PolarHBondContact NZ-OE2 3.21Å; K312-E315 PolarHBondContact O-N 2.99Å; K312-I316 VanDerWaalsContact O-CG1 3.26Å; K312-I316 WeakPolarHBondContact O-CG1 3.47Å; K312-I316 PolarHBondContact O-N 3.48Å |
| 313 | T | 84.8 | Confident | 88.5 | Confident | 59 Ų | 59 | 100.8 Ų | 100.8 | 36% | 0.362 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.9 | -45.2 | 175 | -56.6 | 0 | 0 | 0 | 0 | 110.8 | L309 Q310 S311 E315 I316 E317 | L309-T313 WeakPolarHBondContact O-CB 3.43Å; L309-T313 PolarHBondContact O-N 2.96Å; L309-T313 PolarHBondContact O-OG1 3.46Å; Q310-T313 PolarHBondContact O-N 3.03Å; S311-T313 VanDerWaalsContact C-N 3.34Å; S311-T313 PolarHBondContact O-N 3.5Å; T313-E315 PolarHBondContact O-N 2.97Å; T313-I316 PolarHBondContact O-N 3.3Å; T313-E317 WeakPolarHBondContact O-CG 3.39Å; T313-E317 PolarHBondContact O-N 3.17Å |
| 314 | I | 92.6 | Very high | 88.4 | Confident | 111 Ų | 111 | 102.8 Ų | 102.8 | 57% | 0.569 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64 | -41.5 | 176.3 | -65.3 | 164.2 | 0 | 0 | 0 | 110.7 | Q310 S311 I316 E317 S318 | Q310-I314 WeakPolarHBondContact O-CG1 3.19Å; Q310-I314 PolarHBondContact O-N 2.92Å; S311-I314 PolarHBondContact O-N 2.87Å; I314-I316 PolarHBondContact O-N 3.01Å; I314-E317 PolarHBondContact O-N 3.41Å; I314-S318 WeakPolarHBondContact O-CB 3.45Å; I314-S318 PolarHBondContact O-N 3.48Å; I314-S318 PolarHBondContact O-OG 2.89Å |
| 315 | E | 90.9 | Very high | 88.3 | Confident | 84 Ų | 84 | 101.5 Ų | 101.5 | 39% | 0.393 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.1 | -47.8 | 174.9 | -171.8 | 179.7 | 179 | 0 | 0 | 110.8 | S311 K312 T313 E317 S318 L319 | S311-E315 PolarHBondContact O-N 3.37Å; K312-E315 WeakPolarHBondContact CD-OE2 3.45Å; K312-E315 IonicContact NZ-OE1 2.89Å; K312-E315 IonicContact NZ-OE2 2.83Å; K312-E315 PolarHBondContact NZ-OE2 3.21Å; K312-E315 PolarHBondContact O-N 2.99Å; T313-E315 PolarHBondContact O-N 2.97Å; E315-E317 PolarHBondContact O-N 2.88Å; E315-S318 PolarHBondContact O-N 2.95Å; E315-S318 PolarHBondContact O-OG 3.44Å; E315-L319 HydrophobicContact CG-CD1 4.29Å; E315-L319 WeakPolarHBondContact O-CB 3.33Å; E315-L319 WeakPolarHBondContact O-CG 3.45Å; E315-L319 PolarHBondContact O-N 3.26Å |
| 316 | I | 85.9 | Confident | 88 | Confident | 83 Ų | 83 | 100.4 Ų | 100.4 | 43% | 0.426 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.5 | -46.4 | 176.4 | -70.5 | 165.8 | 0 | 0 | 0 | 111.6 | K312 T313 I314 S318 L319 R320 | K312-I316 VanDerWaalsContact O-CG1 3.26Å; K312-I316 WeakPolarHBondContact O-CG1 3.47Å; K312-I316 PolarHBondContact O-N 3.48Å; T313-I316 PolarHBondContact O-N 3.3Å; I314-I316 PolarHBondContact O-N 3.01Å; I316-S318 VanDerWaalsContact C-N 3.34Å; I316-S318 PolarHBondContact O-N 3.35Å; I316-L319 PolarHBondContact O-N 2.94Å; I316-R320 HydrophobicContact CG2-CG 4.42Å; I316-R320 WeakPolarHBondContact O-CB 3.47Å; I316-R320 VanDerWaalsContact O-CG 3.28Å; I316-R320 WeakPolarHBondContact O-CG 3.49Å; I316-R320 PolarHBondContact O-N 3.34Å |
| 317 | E | 90.8 | Very high | 87.8 | Confident | 121 Ų | 121 | 97.3 Ų | 97.3 | 57% | 0.565 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.1 | -40.5 | 178 | -74.5 | 174.5 | -173.5 | 0 | 0 | 111.7 | T313 I314 E315 R320 G321 | T313-E317 WeakPolarHBondContact O-CG 3.39Å; T313-E317 PolarHBondContact O-N 3.17Å; I314-E317 PolarHBondContact O-N 3.41Å; E315-E317 PolarHBondContact O-N 2.88Å; E317-R320 PolarHBondContact O-N 3.24Å; E317-G321 PolarHBondContact O-N 3.31Å |
| 318 | S | 88.3 | Confident | 87.8 | Confident | 65 Ų | 65 | 95.1 Ų | 95.1 | 46% | 0.455 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64 | -45.2 | 176.3 | 76.9 | 0 | 0 | 0 | 0 | 111.7 | I314 E315 I316 G321 T322 | I314-S318 WeakPolarHBondContact O-CB 3.45Å; I314-S318 PolarHBondContact O-N 3.48Å; I314-S318 PolarHBondContact O-OG 2.89Å; E315-S318 PolarHBondContact O-N 2.95Å; E315-S318 PolarHBondContact O-OG 3.44Å; I316-S318 VanDerWaalsContact C-N 3.34Å; I316-S318 PolarHBondContact O-N 3.35Å; S318-G321 PolarHBondContact O-N 3.27Å; S318-T322 WeakPolarHBondContact O-CG2 3.34Å; S318-T322 PolarHBondContact O-N 2.92Å |
| 319 | L | 78.7 | Confident | 87.8 | Confident | 95 Ų | 95 | 95.5 Ų | 95.5 | 50% | 0.497 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.1 | -44.4 | 177.6 | -72.7 | 174.3 | 0 | 0 | 0 | 110.8 | E315 I316 G321 T322 T323 | E315-L319 HydrophobicContact CG-CD1 4.29Å; E315-L319 WeakPolarHBondContact O-CB 3.33Å; E315-L319 WeakPolarHBondContact O-CG 3.45Å; E315-L319 PolarHBondContact O-N 3.26Å; I316-L319 PolarHBondContact O-N 2.94Å; L319-G321 VanDerWaalsContact C-N 3.31Å; L319-G321 PolarHBondContact O-N 3.31Å; L319-T322 WeakPolarHBondContact CA-OG1 3.4Å; L319-T322 PolarHBondContact O-N 2.87Å; L319-T322 VanDerWaalsContact O-N 3.07Å; L319-T322 PolarHBondContact O-OG1 3.26Å; L319-T323 PolarHBondContact O-N 3.23Å; L319-T323 PolarHBondContact O-OG1 3.43Å; L319-T323 VanDerWaalsContact O-OG1 3.1Å |
| 320 | R | 87.2 | Confident | 87.8 | Confident | 175 Ų | 175 | 94.7 Ų | 94.7 | 66% | 0.66 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -55.6 | -45.4 | 172.9 | -76.9 | 175.4 | 176.5 | 171.8 | 0.2 | 111.8 | I316 E317 T322 T323 E324 | I316-R320 HydrophobicContact CG2-CG 4.42Å; I316-R320 WeakPolarHBondContact O-CB 3.47Å; I316-R320 VanDerWaalsContact O-CG 3.28Å; I316-R320 WeakPolarHBondContact O-CG 3.49Å; I316-R320 PolarHBondContact O-N 3.34Å; E317-R320 PolarHBondContact O-N 3.24Å; R320-T322 VanDerWaalsContact C-N 3.34Å; R320-T322 PolarHBondContact O-N 2.97Å; R320-T323 PolarHBondContact O-N 3.4Å; R320-E324 PolarHBondContact O-N 2.94Å |
| 321 | G | 87.1 | Confident | 87.9 | Confident | 37 Ų | 37 | 96.1 Ų | 96.1 | 38% | 0.381 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.2 | -38.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | E317 S318 L319 S325 | E317-G321 PolarHBondContact O-N 3.31Å; S318-G321 PolarHBondContact O-N 3.27Å; L319-G321 VanDerWaalsContact C-N 3.31Å; L319-G321 PolarHBondContact O-N 3.31Å; G321-S325 WeakPolarHBondContact O-CB 3.34Å; G321-S325 PolarHBondContact O-N 2.93Å |
| 322 | T | 85.8 | Confident | 88.3 | Confident | 72 Ų | 72 | 97 Ų | 97 | 44% | 0.442 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -67.6 | -40.6 | 174.3 | 62.6 | 0 | 0 | 0 | 0 | 112.4 | S318 L319 R320 S325 L326 | S318-T322 WeakPolarHBondContact O-CG2 3.34Å; S318-T322 PolarHBondContact O-N 2.92Å; L319-T322 WeakPolarHBondContact CA-OG1 3.4Å; L319-T322 PolarHBondContact O-N 2.87Å; L319-T322 VanDerWaalsContact O-N 3.07Å; L319-T322 PolarHBondContact O-OG1 3.26Å; R320-T322 VanDerWaalsContact C-N 3.34Å; R320-T322 PolarHBondContact O-N 2.97Å; T322-S325 PolarHBondContact O-N 2.83Å; T322-L326 WeakPolarHBondContact O-CB 3.39Å; T322-L326 VanDerWaalsContact O-CG 3.31Å; T322-L326 WeakPolarHBondContact O-CG 3.24Å; T322-L326 PolarHBondContact O-N 3.49Å |
| 323 | T | 84.6 | Confident | 88.7 | Confident | 71 Ų | 71 | 94.9 Ų | 94.9 | 44% | 0.436 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.1 | -48.5 | 175.8 | -57.3 | 0 | 0 | 0 | 0 | 110.8 | L319 R320 S325 L326 E327 | L319-T323 PolarHBondContact O-N 3.23Å; L319-T323 PolarHBondContact O-OG1 3.43Å; L319-T323 VanDerWaalsContact O-OG1 3.1Å; R320-T323 PolarHBondContact O-N 3.4Å; T323-S325 VanDerWaalsContact C-N 3.31Å; T323-S325 PolarHBondContact O-N 3.03Å; T323-L326 PolarHBondContact O-N 2.98Å; T323-L326 VanDerWaalsContact O-N 3.17Å; T323-E327 HydrophobicContact CG2-CG 4.36Å; T323-E327 WeakPolarHBondContact O-CB 3.15Å; T323-E327 WeakPolarHBondContact O-CG 3.43Å; T323-E327 PolarHBondContact O-N 3.35Å |
| 324 | E | 92.7 | Very high | 89.1 | Confident | 132 Ų | 132 | 97.1 Ų | 97.1 | 62% | 0.617 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -59.3 | -41.8 | 177.4 | -175.1 | -179.4 | 179.9 | 0 | 0 | 111.9 | R320 E327 K328 | R320-E324 PolarHBondContact O-N 2.94Å; E324-E327 PolarHBondContact O-N 3.33Å; E324-K328 WeakPolarHBondContact O-CB 3.44Å; E324-K328 PolarHBondContact O-N 3.09Å |
| 325 | S | 91.5 | Very high | 89.2 | Confident | 58 Ų | 58 | 97.3 Ų | 97.3 | 41% | 0.406 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.3 | -43.2 | 175.7 | -178.3 | 0 | 0 | 0 | 0 | 112.4 | G321 T322 T323 K328 Q329 | G321-S325 WeakPolarHBondContact O-CB 3.34Å; G321-S325 PolarHBondContact O-N 2.93Å; T322-S325 PolarHBondContact O-N 2.83Å; T323-S325 VanDerWaalsContact C-N 3.31Å; T323-S325 PolarHBondContact O-N 3.03Å; S325-K328 PolarHBondContact O-N 3.39Å; S325-Q329 WeakPolarHBondContact O-CG 3.47Å; S325-Q329 PolarHBondContact O-N 3.29Å; S325-Q329 PolarHBondContact OG-NE2 3.2Å |
| 326 | L | 83.8 | Confident | 89.5 | Confident | 108 Ų | 108 | 98.7 Ų | 98.7 | 57% | 0.565 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -67.1 | -41.9 | 177.1 | -72.2 | 173.2 | 0 | 0 | 0 | 111.8 | T322 T323 K328 Q329 L330 | T322-L326 WeakPolarHBondContact O-CB 3.39Å; T322-L326 VanDerWaalsContact O-CG 3.31Å; T322-L326 WeakPolarHBondContact O-CG 3.24Å; T322-L326 PolarHBondContact O-N 3.49Å; T323-L326 PolarHBondContact O-N 2.98Å; T323-L326 VanDerWaalsContact O-N 3.17Å; L326-K328 VanDerWaalsContact C-N 3.29Å; L326-K328 PolarHBondContact O-N 2.91Å; L326-Q329 PolarHBondContact O-N 3.14Å; L326-L330 WeakPolarHBondContact O-CB 3.44Å; L326-L330 PolarHBondContact O-N 3.03Å |
| 327 | E | 88.1 | Confident | 89.8 | Confident | 97 Ų | 97 | 99.1 Ų | 99.1 | 45% | 0.453 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.8 | -36 | 174.2 | -73.8 | 177.7 | -179.9 | 0 | 0 | 112.2 | T323 E324 R331 | T323-E327 HydrophobicContact CG2-CG 4.36Å; T323-E327 WeakPolarHBondContact O-CB 3.15Å; T323-E327 WeakPolarHBondContact O-CG 3.43Å; T323-E327 PolarHBondContact O-N 3.35Å; E324-E327 PolarHBondContact O-N 3.33Å; E327-R331 WeakPolarHBondContact O-CG 3.23Å; E327-R331 PolarHBondContact O-N 3.26Å; E327-R331 PolarHBondContact O-NE 3.44Å; E327-R331 IonicContact OE2-NH2 3.37Å |
| 328 | K | 92.8 | Very high | 90 | Very high | 124 Ų | 124 | 96.1 Ų | 96.1 | 54% | 0.539 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -67 | -45.3 | 173.8 | -175.7 | 179.7 | 175.9 | -174.4 | 0 | 111.1 | E324 S325 L326 L330 R331 E332 | E324-K328 WeakPolarHBondContact O-CB 3.44Å; E324-K328 PolarHBondContact O-N 3.09Å; S325-K328 PolarHBondContact O-N 3.39Å; L326-K328 VanDerWaalsContact C-N 3.29Å; L326-K328 PolarHBondContact O-N 2.91Å; K328-L330 VanDerWaalsContact C-N 3.31Å; K328-L330 PolarHBondContact O-N 3.4Å; K328-R331 PolarHBondContact O-N 2.82Å; K328-E332 WeakPolarHBondContact CE-OE1 3.04Å; K328-E332 WeakPolarHBondContact O-CG 3.08Å; K328-E332 PolarHBondContact O-N 3.23Å |
| 329 | Q | 92.1 | Very high | 90.4 | Very high | 101 Ų | 101 | 98.7 Ų | 98.7 | 47% | 0.472 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.4 | -38.4 | 176.3 | -73.6 | 175.2 | 40.7 | 0 | 0 | 112.3 | S325 L326 E332 M333 | S325-Q329 WeakPolarHBondContact O-CG 3.47Å; S325-Q329 PolarHBondContact O-N 3.29Å; S325-Q329 PolarHBondContact OG-NE2 3.2Å; L326-Q329 PolarHBondContact O-N 3.14Å; Q329-E332 PolarHBondContact O-N 3.28Å; Q329-M333 WeakPolarHBondContact O-CB 3.28Å; Q329-M333 VanDerWaalsContact O-CG 3.28Å; Q329-M333 WeakPolarHBondContact O-CG 3.49Å; Q329-M333 PolarHBondContact O-N 3.23Å |
| 330 | L | 87.3 | Confident | 91.2 | Very high | 101 Ų | 101 | 98.5 Ų | 98.5 | 53% | 0.529 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.2 | -49.6 | 175 | -175.9 | 67.6 | 0 | 0 | 0 | 110.8 | L326 K328 E332 M333 E334 | L326-L330 WeakPolarHBondContact O-CB 3.44Å; L326-L330 PolarHBondContact O-N 3.03Å; K328-L330 VanDerWaalsContact C-N 3.31Å; K328-L330 PolarHBondContact O-N 3.4Å; L330-E332 PolarHBondContact O-N 3.46Å; L330-M333 WeakPolarHBondContact O-CB 3.29Å; L330-M333 PolarHBondContact O-N 2.74Å; L330-M333 VanDerWaalsContact O-N 3.12Å; L330-E334 WeakPolarHBondContact O-CG 3.39Å; L330-E334 PolarHBondContact O-N 2.91Å |
| 331 | R | 91.9 | Very high | 91.7 | Very high | 134 Ų | 134 | 94.5 Ų | 94.5 | 51% | 0.506 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -58.1 | -45.4 | 175.6 | -78.7 | -179.7 | -87.6 | -163.7 | -8.4 | 112.3 | E327 K328 M333 E334 D335 | E327-R331 WeakPolarHBondContact O-CG 3.23Å; E327-R331 PolarHBondContact O-N 3.26Å; E327-R331 PolarHBondContact O-NE 3.44Å; E327-R331 IonicContact OE2-NH2 3.37Å; K328-R331 PolarHBondContact O-N 2.82Å; R331-M333 VanDerWaalsContact C-N 3.3Å; R331-M333 PolarHBondContact O-N 2.95Å; R331-E334 PolarHBondContact O-N 2.59Å; R331-D335 WeakPolarHBondContact O-CB 3.3Å; R331-D335 PolarHBondContact O-N 3.09Å |
| 332 | E | 95.4 | Very high | 92.2 | Very high | 91 Ų | 91 | 95.9 Ų | 95.9 | 43% | 0.425 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63.4 | -34.1 | 176.5 | -73.3 | 175.7 | -173.9 | 0 | 0 | 112.9 | K328 Q329 L330 R336 | K328-E332 WeakPolarHBondContact CE-OE1 3.04Å; K328-E332 WeakPolarHBondContact O-CG 3.08Å; K328-E332 PolarHBondContact O-N 3.23Å; Q329-E332 PolarHBondContact O-N 3.28Å; L330-E332 PolarHBondContact O-N 3.46Å; E332-R336 WeakPolarHBondContact O-CB 3.28Å; E332-R336 WeakPolarHBondContact O-CG 3.26Å; E332-R336 PolarHBondContact O-N 3.1Å; E332-R336 VanDerWaalsContact O-N 3.14Å; E332-R336 PolarHBondContact O-NE 2.84Å |
| 333 | M | 91.4 | Very high | 92.8 | Very high | 73 Ų | 73 | 95.3 Ų | 95.3 | 36% | 0.36 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -68.8 | -45.7 | 172.7 | -76.3 | -74.5 | -41.2 | 0 | 0 | 111.5 | Q329 L330 R331 R336 H337 | Q329-M333 WeakPolarHBondContact O-CB 3.28Å; Q329-M333 VanDerWaalsContact O-CG 3.28Å; Q329-M333 WeakPolarHBondContact O-CG 3.49Å; Q329-M333 PolarHBondContact O-N 3.23Å; L330-M333 WeakPolarHBondContact O-CB 3.29Å; L330-M333 PolarHBondContact O-N 2.74Å; L330-M333 VanDerWaalsContact O-N 3.12Å; R331-M333 VanDerWaalsContact C-N 3.3Å; R331-M333 PolarHBondContact O-N 2.95Å; M333-R336 PolarHBondContact O-N 2.85Å; M333-R336 VanDerWaalsContact SD-CZ 3.53Å; M333-R336 PolarHBondContact SD-NH1 2.96Å; M333-R336 PolarHBondContact SD-NH2 3.34Å; M333-H337 WeakPolarHBondContact CE-CE1 3.47Å; M333-H337 WeakPolarHBondContact CE-NE2 3.5Å; M333-H337 PolarHBondContact O-N 2.8Å |
| 334 | E | 91.6 | Very high | 93.3 | Very high | 106 Ų | 106 | 99.2 Ų | 99.2 | 50% | 0.495 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.2 | -46.3 | 177.6 | -72.4 | 172 | 164.2 | 0 | 0 | 111.4 | L330 R331 R336 H337 S338 | L330-E334 WeakPolarHBondContact O-CG 3.39Å; L330-E334 PolarHBondContact O-N 2.91Å; R331-E334 PolarHBondContact O-N 2.59Å; E334-R336 PolarHBondContact O-N 3.19Å; E334-H337 PolarHBondContact O-N 3.47Å; E334-S338 WeakPolarHBondContact O-CB 3.34Å; E334-S338 PolarHBondContact O-N 3.11Å |
| 335 | D | 95.3 | Very high | 93.6 | Very high | 115 Ų | 115 | 98.4 Ų | 98.4 | 62% | 0.615 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -61.7 | -42.5 | 176.7 | -74.5 | -18 | 0 | 0 | 0 | 111.5 | R331 S338 M339 | R331-D335 WeakPolarHBondContact O-CB 3.3Å; R331-D335 PolarHBondContact O-N 3.09Å; D335-S338 PolarHBondContact O-N 3.41Å; D335-M339 WeakPolarHBondContact O-CB 3.4Å; D335-M339 PolarHBondContact O-N 3.38Å |
| 336 | R | 96.8 | Very high | 93.9 | Very high | 114 Ų | 114 | 102 Ų | 102 | 43% | 0.43 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.9 | -46.8 | 175.1 | -88.4 | -171.4 | -75.9 | 96 | 0.3 | 112.2 | E332 M333 E334 S338 M339 E340 | E332-R336 WeakPolarHBondContact O-CB 3.28Å; E332-R336 WeakPolarHBondContact O-CG 3.26Å; E332-R336 PolarHBondContact O-N 3.1Å; E332-R336 VanDerWaalsContact O-N 3.14Å; E332-R336 PolarHBondContact O-NE 2.84Å; M333-R336 PolarHBondContact O-N 2.85Å; M333-R336 VanDerWaalsContact SD-CZ 3.53Å; M333-R336 PolarHBondContact SD-NH1 2.96Å; M333-R336 PolarHBondContact SD-NH2 3.34Å; E334-R336 PolarHBondContact O-N 3.19Å; R336-S338 VanDerWaalsContact C-N 3.32Å; R336-S338 PolarHBondContact O-N 3.44Å; R336-M339 WeakPolarHBondContact O-CB 3.44Å; R336-M339 PolarHBondContact O-N 2.9Å; R336-E340 WeakPolarHBondContact O-CG 3.39Å; R336-E340 PolarHBondContact O-N 2.82Å |
| 337 | H | 92.8 | Very high | 94.5 | Very high | 91 Ų | 91 | 99.6 Ų | 99.6 | 42% | 0.421 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -64.4 | -38.9 | 177.1 | -68.9 | 160.1 | 0 | 0 | 0 | 111.7 | M333 E334 M339 E340 I341 | M333-H337 WeakPolarHBondContact CE-CE1 3.47Å; M333-H337 WeakPolarHBondContact CE-NE2 3.5Å; M333-H337 PolarHBondContact O-N 2.8Å; E334-H337 PolarHBondContact O-N 3.47Å; H337-M339 VanDerWaalsContact C-N 3.32Å; H337-M339 PolarHBondContact O-N 3.48Å; H337-E340 IonicContact CD2-OE2 2.78Å; H337-E340 PolarHBondContact O-N 3.42Å; H337-I341 WeakPolarHBondContact O-CB 3.31Å; H337-I341 VanDerWaalsContact O-CG1 3.24Å; H337-I341 WeakPolarHBondContact O-CG1 3.32Å; H337-I341 PolarHBondContact O-N 3.29Å |
| 338 | S | 95.6 | Very high | 95 | Very high | 59 Ų | 59 | 100.5 Ų | 100.5 | 41% | 0.413 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60 | -44.3 | 174.1 | -176.5 | 0 | 0 | 0 | 0 | 111.1 | E334 D335 R336 I341 N342 | E334-S338 WeakPolarHBondContact O-CB 3.34Å; E334-S338 PolarHBondContact O-N 3.11Å; D335-S338 PolarHBondContact O-N 3.41Å; R336-S338 VanDerWaalsContact C-N 3.32Å; R336-S338 PolarHBondContact O-N 3.44Å; S338-I341 PolarHBondContact O-N 2.91Å; S338-N342 PolarHBondContact O-N 3.42Å; S338-N342 PolarHBondContact O-ND2 2.86Å |
| 339 | M | 95.9 | Very high | 95.2 | Very high | 119 Ų | 119 | 97.2 Ų | 97.2 | 59% | 0.586 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -62 | -45.8 | 175 | -168.9 | 66 | -173.9 | 0 | 0 | 111.9 | D335 R336 H337 I341 N342 T343 | D335-M339 WeakPolarHBondContact O-CB 3.4Å; D335-M339 PolarHBondContact O-N 3.38Å; R336-M339 WeakPolarHBondContact O-CB 3.44Å; R336-M339 PolarHBondContact O-N 2.9Å; H337-M339 VanDerWaalsContact C-N 3.32Å; H337-M339 PolarHBondContact O-N 3.48Å; M339-I341 PolarHBondContact O-N 3.25Å; M339-N342 WeakPolarHBondContact O-CB 3.43Å; M339-N342 PolarHBondContact O-N 3.02Å; M339-T343 HydrophobicContact CE-CG2 4.48Å; M339-T343 WeakPolarHBondContact O-CG2 3.47Å; M339-T343 PolarHBondContact O-N 2.77Å |
| 340 | E | 96.3 | Very high | 95.5 | Very high | 90 Ų | 90 | 98.5 Ų | 98.5 | 42% | 0.421 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.9 | -45.2 | 176.5 | -73.8 | 174 | -166.9 | 0 | 0 | 111.6 | R336 H337 N342 T343 Y344 | R336-E340 WeakPolarHBondContact O-CG 3.39Å; R336-E340 PolarHBondContact O-N 2.82Å; H337-E340 IonicContact CD2-OE2 2.78Å; H337-E340 PolarHBondContact O-N 3.42Å; E340-N342 VanDerWaalsContact C-N 3.32Å; E340-N342 PolarHBondContact O-N 3.14Å; E340-T343 WeakPolarHBondContact CA-OG1 3.39Å; E340-T343 PolarHBondContact O-N 3.33Å; E340-T343 PolarHBondContact O-OG1 3.28Å; E340-Y344 HydrophobicContact CB-CE2 4.25Å; E340-Y344 WeakPolarHBondContact O-CD2 3.49Å; E340-Y344 PolarHBondContact O-N 3.24Å |
| 341 | I | 96.8 | Very high | 96 | Very high | 92 Ų | 92 | 99.1 Ų | 99.1 | 47% | 0.472 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -58 | -45.8 | 174.9 | -70.1 | 165.6 | 0 | 0 | 0 | 110.6 | H337 S338 M339 T343 Y344 Q345 | H337-I341 WeakPolarHBondContact O-CB 3.31Å; H337-I341 VanDerWaalsContact O-CG1 3.24Å; H337-I341 WeakPolarHBondContact O-CG1 3.32Å; H337-I341 PolarHBondContact O-N 3.29Å; S338-I341 PolarHBondContact O-N 2.91Å; M339-I341 PolarHBondContact O-N 3.25Å; I341-T343 VanDerWaalsContact C-N 3.34Å; I341-T343 PolarHBondContact O-N 2.99Å; I341-Y344 PolarHBondContact O-N 3.22Å; I341-Q345 HydrophobicContact CG2-CG 4.36Å; I341-Q345 WeakPolarHBondContact O-CG 3.44Å; I341-Q345 PolarHBondContact O-N 3.3Å |
| 342 | N | 97.6 | Very high | 96.3 | Very high | 65 Ų | 65 | 97.1 Ų | 97.1 | 35% | 0.348 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.8 | -43.4 | 177.1 | -67.9 | -24.1 | 0 | 0 | 0 | 111.3 | S338 M339 E340 Y344 Q345 E346 | S338-N342 PolarHBondContact O-N 3.42Å; S338-N342 PolarHBondContact O-ND2 2.86Å; M339-N342 WeakPolarHBondContact O-CB 3.43Å; M339-N342 PolarHBondContact O-N 3.02Å; E340-N342 VanDerWaalsContact C-N 3.32Å; E340-N342 PolarHBondContact O-N 3.14Å; N342-Y344 VanDerWaalsContact C-N 3.34Å; N342-Y344 PolarHBondContact O-N 3.39Å; N342-Q345 PolarHBondContact O-N 3.49Å; N342-E346 WeakPolarHBondContact O-CG 3.38Å; N342-E346 PolarHBondContact O-N 2.84Å |
| 343 | T | 98 | Very high | 96.4 | Very high | 60 Ų | 60 | 97 Ų | 97 | 37% | 0.368 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.3 | -37.7 | 176.9 | 61.7 | 0 | 0 | 0 | 0 | 112.7 | M339 E340 I341 S347 | M339-T343 HydrophobicContact CE-CG2 4.48Å; M339-T343 WeakPolarHBondContact O-CG2 3.47Å; M339-T343 PolarHBondContact O-N 2.77Å; E340-T343 WeakPolarHBondContact CA-OG1 3.39Å; E340-T343 PolarHBondContact O-N 3.33Å; E340-T343 PolarHBondContact O-OG1 3.28Å; I341-T343 VanDerWaalsContact C-N 3.34Å; I341-T343 PolarHBondContact O-N 2.99Å; T343-S347 WeakPolarHBondContact O-CB 3.41Å; T343-S347 PolarHBondContact O-N 3.1Å |
| 344 | Y | 96.3 | Very high | 96.7 | Very high | 153 Ų | 153 | 97.5 Ų | 97.5 | 60% | 0.6 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -68.2 | -39.6 | 174 | -68.5 | -54.3 | 0 | 0 | 0 | 111.8 | E340 I341 N342 S347 M348 | E340-Y344 HydrophobicContact CB-CE2 4.25Å; E340-Y344 WeakPolarHBondContact O-CD2 3.49Å; E340-Y344 PolarHBondContact O-N 3.24Å; I341-Y344 PolarHBondContact O-N 3.22Å; N342-Y344 VanDerWaalsContact C-N 3.34Å; N342-Y344 PolarHBondContact O-N 3.39Å; Y344-S347 PolarHBondContact O-N 3.4Å; Y344-M348 WeakPolarHBondContact O-CB 3.35Å; Y344-M348 VanDerWaalsContact O-CG 3.28Å; Y344-M348 WeakPolarHBondContact O-CG 3.49Å; Y344-M348 PolarHBondContact O-N 3.33Å |
| 345 | Q | 97.6 | Very high | 97 | Very high | 115 Ų | 115 | 96.8 Ų | 96.8 | 54% | 0.537 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.9 | -42.9 | 174.9 | -73.2 | 178.1 | 3.8 | 0 | 0 | 111.8 | I341 N342 M348 A349 | I341-Q345 HydrophobicContact CG2-CG 4.36Å; I341-Q345 WeakPolarHBondContact O-CG 3.44Å; I341-Q345 PolarHBondContact O-N 3.3Å; N342-Q345 PolarHBondContact O-N 3.49Å; Q345-M348 PolarHBondContact O-N 2.9Å; Q345-A349 WeakPolarHBondContact O-CB 3.33Å; Q345-A349 PolarHBondContact O-N 3.07Å |
| 346 | E | 98 | Very high | 97.1 | Very high | 133 Ų | 133 | 98.6 Ų | 98.6 | 62% | 0.621 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -60.9 | -46.9 | 174.2 | -74.4 | 176.3 | -179.1 | 0 | 0 | 111.4 | N342 M348 A349 E350 | N342-E346 WeakPolarHBondContact O-CG 3.38Å; N342-E346 PolarHBondContact O-N 2.84Å; E346-M348 PolarHBondContact O-N 3.22Å; E346-A349 PolarHBondContact O-N 2.9Å; E346-E350 PolarHBondContact O-N 3.36Å |
| 347 | S | 98.2 | Very high | 97.2 | Very high | 58 Ų | 58 | 96 Ų | 96 | 41% | 0.406 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.2 | -39.6 | 176.8 | -178.1 | 0 | 0 | 0 | 0 | 112.5 | T343 Y344 E350 L351 | T343-S347 WeakPolarHBondContact O-CB 3.41Å; T343-S347 PolarHBondContact O-N 3.1Å; Y344-S347 PolarHBondContact O-N 3.4Å; S347-E350 PolarHBondContact O-N 3.33Å; S347-L351 WeakPolarHBondContact O-CG 3.39Å; S347-L351 PolarHBondContact O-N 3.04Å |
| 348 | M | 96.7 | Very high | 97.4 | Very high | 117 Ų | 117 | 95 Ų | 95 | 58% | 0.576 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62 | -44.7 | 172.9 | -75.8 | -177.8 | 66.5 | 0 | 0 | 111.4 | Y344 Q345 E346 E350 L351 E352 | Y344-M348 WeakPolarHBondContact O-CB 3.35Å; Y344-M348 VanDerWaalsContact O-CG 3.28Å; Y344-M348 WeakPolarHBondContact O-CG 3.49Å; Y344-M348 PolarHBondContact O-N 3.33Å; Q345-M348 PolarHBondContact O-N 2.9Å; E346-M348 PolarHBondContact O-N 3.22Å; M348-E350 VanDerWaalsContact C-N 3.34Å; M348-E350 PolarHBondContact O-N 2.94Å; M348-L351 PolarHBondContact O-N 3Å; M348-E352 WeakPolarHBondContact O-CB 3.32Å; M348-E352 WeakPolarHBondContact O-CG 3.43Å; M348-E352 PolarHBondContact O-N 3.19Å |
| 349 | A | 97.8 | Very high | 97.5 | Very high | 55 Ų | 55 | 98.3 Ų | 98.3 | 46% | 0.455 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.2 | -39.8 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q345 E346 E352 N353 | Q345-A349 WeakPolarHBondContact O-CB 3.33Å; Q345-A349 PolarHBondContact O-N 3.07Å; E346-A349 PolarHBondContact O-N 2.9Å; A349-E352 PolarHBondContact O-N 2.94Å; A349-N353 WeakPolarHBondContact O-CB 3.33Å; A349-N353 PolarHBondContact O-N 3.39Å |
| 350 | E | 98.3 | Very high | 97.6 | Very high | 128 Ų | 128 | 96.5 Ų | 96.5 | 60% | 0.598 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.2 | -50.5 | 174.8 | -172.2 | 176.9 | -164.7 | 0 | 0 | 111.3 | E346 S347 M348 E352 N353 D354 | E346-E350 PolarHBondContact O-N 3.36Å; S347-E350 PolarHBondContact O-N 3.33Å; M348-E350 VanDerWaalsContact C-N 3.34Å; M348-E350 PolarHBondContact O-N 2.94Å; E350-E352 VanDerWaalsContact C-N 3.32Å; E350-E352 PolarHBondContact O-N 3.29Å; E350-N353 WeakPolarHBondContact O-CA 3.37Å; E350-N353 WeakPolarHBondContact O-CB 3.35Å; E350-N353 PolarHBondContact O-N 2.86Å; E350-D354 PolarHBondContact O-N 2.71Å |
| 351 | L | 97.7 | Very high | 97.7 | Very high | 113 Ų | 113 | 97 Ų | 97 | 59% | 0.592 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.8 | -38.4 | 177.4 | -72.7 | 172.9 | 0 | 0 | 0 | 112.7 | S347 M348 N353 D354 L355 | S347-L351 WeakPolarHBondContact O-CG 3.39Å; S347-L351 PolarHBondContact O-N 3.04Å; M348-L351 PolarHBondContact O-N 3Å; L351-N353 VanDerWaalsContact C-N 3.32Å; L351-D354 PolarHBondContact O-N 3.29Å; L351-L355 WeakPolarHBondContact O-CB 3.47Å; L351-L355 PolarHBondContact O-N 3.26Å |
| 352 | E | 97.7 | Very high | 97.7 | Very high | 92 Ų | 92 | 98.5 Ų | 98.5 | 43% | 0.43 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.2 | -38.2 | 173.1 | -78 | -170.5 | -173.7 | 0 | 0 | 112.4 | M348 A349 E350 L355 R356 | M348-E352 WeakPolarHBondContact O-CB 3.32Å; M348-E352 WeakPolarHBondContact O-CG 3.43Å; M348-E352 PolarHBondContact O-N 3.19Å; A349-E352 PolarHBondContact O-N 2.94Å; E350-E352 VanDerWaalsContact C-N 3.32Å; E350-E352 PolarHBondContact O-N 3.29Å; E352-L355 PolarHBondContact O-N 3.41Å; E352-R356 WeakPolarHBondContact O-CG 3.29Å; E352-R356 PolarHBondContact O-N 3.2Å; E352-R356 IonicContact OE2-CZ 3.64Å; E352-R356 IonicContact OE2-NH1 3.84Å; E352-R356 PolarHBondContact OE2-NH1 3Å; E352-R356 IonicContact OE2-NH2 3.77Å |
| 353 | N | 97.8 | Very high | 97.7 | Very high | 88 Ų | 88 | 97.9 Ų | 97.9 | 47% | 0.471 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.6 | -42.6 | 176.9 | -175.9 | 63.6 | 0 | 0 | 0 | 111.6 | A349 E350 L351 L355 R356 T357 | A349-N353 WeakPolarHBondContact O-CB 3.33Å; A349-N353 PolarHBondContact O-N 3.39Å; E350-N353 WeakPolarHBondContact O-CA 3.37Å; E350-N353 WeakPolarHBondContact O-CB 3.35Å; E350-N353 PolarHBondContact O-N 2.86Å; L351-N353 VanDerWaalsContact C-N 3.32Å; N353-L355 VanDerWaalsContact C-N 3.32Å; N353-L355 PolarHBondContact O-N 2.99Å; N353-R356 PolarHBondContact O-N 3.38Å; N353-T357 WeakPolarHBondContact O-CB 3.41Å; N353-T357 PolarHBondContact O-N 3.47Å; N353-T357 PolarHBondContact O-OG1 3.37Å |
| 354 | D | 98 | Very high | 97.7 | Very high | 84 Ų | 84 | 101.6 Ų | 101.6 | 45% | 0.449 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.6 | -41.7 | 173.8 | -74.8 | -6.6 | 0 | 0 | 0 | 111.3 | E350 L351 R356 T357 T358 | E350-D354 PolarHBondContact O-N 2.71Å; L351-D354 PolarHBondContact O-N 3.29Å; D354-R356 PolarHBondContact O-N 2.87Å; D354-T357 PolarHBondContact O-N 2.74Å; D354-T358 WeakPolarHBondContact O-CB 3.29Å; D354-T358 WeakPolarHBondContact O-CG2 3.5Å; D354-T358 PolarHBondContact O-N 3.41Å; D354-T358 PolarHBondContact O-OG1 2.81Å |
| 355 | L | 97.6 | Very high | 97.7 | Very high | 91 Ų | 91 | 98.4 Ų | 98.4 | 48% | 0.476 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.7 | -42 | 174.4 | -174.5 | 70 | 0 | 0 | 0 | 111.9 | L351 E352 N353 T358 K359 | L351-L355 WeakPolarHBondContact O-CB 3.47Å; L351-L355 PolarHBondContact O-N 3.26Å; E352-L355 PolarHBondContact O-N 3.41Å; N353-L355 VanDerWaalsContact C-N 3.32Å; N353-L355 PolarHBondContact O-N 2.99Å; L355-T358 WeakPolarHBondContact CA-OG1 3.41Å; L355-T358 PolarHBondContact O-OG1 2.75Å; L355-T358 VanDerWaalsContact O-OG1 3.08Å; L355-K359 HydrophobicContact CG-CD 4.35Å; L355-K359 WeakPolarHBondContact O-CB 3.15Å; L355-K359 WeakPolarHBondContact O-CG 3.47Å; L355-K359 PolarHBondContact O-N 2.89Å; L355-K359 VanDerWaalsContact O-N 3.1Å |
| 356 | R | 97.9 | Very high | 97.7 | Very high | 154 Ų | 154 | 98.5 Ų | 98.5 | 58% | 0.581 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64 | -42.7 | 174.8 | -77.8 | -178.1 | -175.1 | 98.6 | 2 | 111.2 | E352 N353 D354 K359 S360 | E352-R356 WeakPolarHBondContact O-CG 3.29Å; E352-R356 PolarHBondContact O-N 3.2Å; E352-R356 IonicContact OE2-CZ 3.64Å; E352-R356 IonicContact OE2-NH1 3.84Å; E352-R356 PolarHBondContact OE2-NH1 3Å; E352-R356 IonicContact OE2-NH2 3.77Å; N353-R356 PolarHBondContact O-N 3.38Å; D354-R356 PolarHBondContact O-N 2.87Å; R356-K359 PolarHBondContact O-N 3.48Å; R356-S360 PolarHBondContact O-N 3.29Å |
| 357 | T | 98.3 | Very high | 97.7 | Very high | 58 Ų | 58 | 100 Ų | 100 | 36% | 0.356 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.5 | -52.9 | -179.6 | -58.6 | 0 | 0 | 0 | 0 | 110.9 | N353 D354 K359 S360 E361 | N353-T357 WeakPolarHBondContact O-CB 3.41Å; N353-T357 PolarHBondContact O-N 3.47Å; N353-T357 PolarHBondContact O-OG1 3.37Å; D354-T357 PolarHBondContact O-N 2.74Å; T357-K359 VanDerWaalsContact C-N 3.32Å; T357-K359 PolarHBondContact O-N 3.48Å; T357-S360 WeakPolarHBondContact O-CA 3.41Å; T357-S360 WeakPolarHBondContact O-CB 3.26Å; T357-S360 PolarHBondContact O-N 3.49Å; T357-E361 WeakPolarHBondContact O-CG 3.43Å; T357-E361 PolarHBondContact O-N 3.47Å |
| 358 | T | 97.2 | Very high | 97.6 | Very high | 72 Ų | 72 | 101.1 Ų | 101.1 | 44% | 0.442 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61 | -36.9 | 177.9 | 52.6 | 0 | 0 | 0 | 0 | 112.9 | D354 L355 E361 M362 | D354-T358 WeakPolarHBondContact O-CB 3.29Å; D354-T358 WeakPolarHBondContact O-CG2 3.5Å; D354-T358 PolarHBondContact O-N 3.41Å; D354-T358 PolarHBondContact O-OG1 2.81Å; L355-T358 WeakPolarHBondContact CA-OG1 3.41Å; L355-T358 PolarHBondContact O-OG1 2.75Å; L355-T358 VanDerWaalsContact O-OG1 3.08Å; T358-E361 PolarHBondContact O-N 3.4Å; T358-M362 WeakPolarHBondContact O-CB 3.43Å; T358-M362 PolarHBondContact O-N 3.38Å |
| 359 | K | 98.2 | Very high | 97.7 | Very high | 127 Ų | 127 | 103.2 Ų | 103.2 | 55% | 0.552 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.4 | -42.8 | 171.5 | -78.4 | 174.4 | 179.8 | 175.3 | 0 | 112.2 | L355 R356 T357 M362 A363 | L355-K359 HydrophobicContact CG-CD 4.35Å; L355-K359 WeakPolarHBondContact O-CB 3.15Å; L355-K359 WeakPolarHBondContact O-CG 3.47Å; L355-K359 PolarHBondContact O-N 2.89Å; L355-K359 VanDerWaalsContact O-N 3.1Å; R356-K359 PolarHBondContact O-N 3.48Å; T357-K359 VanDerWaalsContact C-N 3.32Å; T357-K359 PolarHBondContact O-N 3.48Å; K359-M362 PolarHBondContact O-N 3.27Å; K359-A363 WeakPolarHBondContact O-CB 3.49Å; K359-A363 PolarHBondContact O-N 2.9Å |
| 360 | S | 97.6 | Very high | 97.7 | Very high | 82 Ų | 82 | 105.3 Ų | 105.3 | 57% | 0.573 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.3 | -44.6 | 177 | -174.4 | 0 | 0 | 0 | 0 | 111.6 | R356 T357 A363 R364 | R356-S360 PolarHBondContact O-N 3.29Å; T357-S360 WeakPolarHBondContact O-CA 3.41Å; T357-S360 WeakPolarHBondContact O-CB 3.26Å; T357-S360 PolarHBondContact O-N 3.49Å; S360-A363 PolarHBondContact O-N 2.99Å; S360-R364 PolarHBondContact O-N 3Å |
| 361 | E | 97.9 | Very high | 97.6 | Very high | 99 Ų | 99 | 103.2 Ų | 103.2 | 46% | 0.463 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.1 | -44.7 | 175.2 | -70.3 | 176.1 | 165.2 | 0 | 0 | 111.9 | T357 T358 A363 R364 H365 | T357-E361 WeakPolarHBondContact O-CG 3.43Å; T357-E361 PolarHBondContact O-N 3.47Å; T358-E361 PolarHBondContact O-N 3.4Å; E361-A363 VanDerWaalsContact C-N 3.34Å; E361-A363 PolarHBondContact O-N 3.46Å; E361-R364 WeakPolarHBondContact O-CA 3.31Å; E361-R364 WeakPolarHBondContact O-CB 3.32Å; E361-R364 PolarHBondContact O-N 3.18Å; E361-R364 VanDerWaalsContact O-N 3.11Å; E361-H365 PolarHBondContact O-CD2 2.97Å; E361-H365 PolarHBondContact O-N 3.47Å |
| 362 | M | 97.4 | Very high | 97.6 | Very high | 125 Ų | 125 | 103.3 Ų | 103.3 | 62% | 0.616 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -59.7 | -44.4 | 175.1 | -175.1 | -178.2 | -61.5 | 0 | 0 | 111.7 | T358 K359 R364 H365 L366 | T358-M362 WeakPolarHBondContact O-CB 3.43Å; T358-M362 PolarHBondContact O-N 3.38Å; K359-M362 PolarHBondContact O-N 3.27Å; M362-R364 VanDerWaalsContact C-N 3.28Å; M362-R364 PolarHBondContact O-N 2.82Å; M362-H365 PolarHBondContact O-N 3.28Å; M362-L366 WeakPolarHBondContact O-CG 3.43Å; M362-L366 PolarHBondContact O-N 3.03Å |
| 363 | A | 97.3 | Very high | 97.6 | Very high | 51 Ų | 51 | 103 Ų | 103 | 42% | 0.421 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.8 | -36.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | K359 S360 E361 R367 | K359-A363 WeakPolarHBondContact O-CB 3.49Å; K359-A363 PolarHBondContact O-N 2.9Å; S360-A363 PolarHBondContact O-N 2.99Å; E361-A363 VanDerWaalsContact C-N 3.34Å; E361-A363 PolarHBondContact O-N 3.46Å; A363-R367 PolarHBondContact O-N 3.03Å |
| 364 | R | 97.8 | Very high | 97.5 | Very high | 139 Ų | 139 | 102.4 Ų | 102.4 | 53% | 0.525 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.1 | -48.9 | 174.3 | -160.5 | -171.9 | 97.1 | -180 | 4.4 | 111.4 | S360 E361 M362 L366 R367 E368 | S360-R364 PolarHBondContact O-N 3Å; E361-R364 WeakPolarHBondContact O-CA 3.31Å; E361-R364 WeakPolarHBondContact O-CB 3.32Å; E361-R364 PolarHBondContact O-N 3.18Å; E361-R364 VanDerWaalsContact O-N 3.11Å; M362-R364 VanDerWaalsContact C-N 3.28Å; M362-R364 PolarHBondContact O-N 2.82Å; R364-L366 VanDerWaalsContact C-N 3.34Å; R364-L366 PolarHBondContact O-N 3.35Å; R364-R367 WeakPolarHBondContact O-CB 3.4Å; R364-R367 PolarHBondContact O-N 3.27Å; R364-R367 VanDerWaalsContact O-N 3.1Å; R364-E368 IonicContact CZ-OE1 2.74Å; R364-E368 VanDerWaalsContact CZ-OE1 3.3Å; R364-E368 IonicContact NE-OE1 3.67Å; R364-E368 PolarHBondContact NE-OE1 2.71Å; R364-E368 IonicContact NH2-OE1 3.97Å; R364-E368 PolarHBondContact NH2-OE1 3.16Å; R364-E368 WeakPolarHBondContact O-CG 3.39Å; R364-E368 PolarHBondContact O-N 2.95Å |
| 365 | H | 97.3 | Very high | 97.5 | Very high | 86 Ų | 86 | 102.4 Ų | 102.4 | 40% | 0.398 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.5 | -42.1 | 177.2 | -71.8 | -39.4 | 0 | 0 | 0 | 112.3 | E361 M362 R367 E368 Y369 | E361-H365 PolarHBondContact O-CD2 2.97Å; E361-H365 PolarHBondContact O-N 3.47Å; M362-H365 PolarHBondContact O-N 3.28Å; H365-R367 PolarHBondContact O-N 3.44Å; H365-E368 IonicContact CE1-OE2 3Å; H365-E368 IonicContact ND1-OE2 3.26Å; H365-E368 PolarHBondContact ND1-OE2 3.27Å; H365-E368 PolarHBondContact O-N 3.09Å; H365-Y369 HydrophobicContact CB-CD2 4.35Å; H365-Y369 HydrophobicContact CB-CE2 4.19Å; H365-Y369 WeakPolarHBondContact O-CD2 3.46Å; H365-Y369 PolarHBondContact O-N 2.84Å |
| 366 | L | 97.4 | Very high | 97.5 | Very high | 116 Ų | 116 | 103.2 Ų | 103.2 | 61% | 0.607 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -58 | -38.7 | 174.9 | -75 | 171.7 | 0 | 0 | 0 | 112.2 | M362 R364 Q370 | M362-L366 WeakPolarHBondContact O-CG 3.43Å; M362-L366 PolarHBondContact O-N 3.03Å; R364-L366 VanDerWaalsContact C-N 3.34Å; R364-L366 PolarHBondContact O-N 3.35Å; L366-Q370 PolarHBondContact O-N 3.31Å; L366-Q370 VanDerWaalsContact O-N 3.07Å |
| 367 | R | 97.4 | Very high | 97.4 | Very high | 164 Ų | 164 | 100.8 Ų | 100.8 | 62% | 0.619 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -66.8 | -48 | 174.6 | -167.7 | -178.3 | -65.2 | 125.9 | -0.2 | 111.6 | A363 R364 H365 Y369 Q370 D371 | A363-R367 PolarHBondContact O-N 3.03Å; R364-R367 WeakPolarHBondContact O-CB 3.4Å; R364-R367 PolarHBondContact O-N 3.27Å; R364-R367 VanDerWaalsContact O-N 3.1Å; H365-R367 PolarHBondContact O-N 3.44Å; R367-Y369 VanDerWaalsContact C-N 3.31Å; R367-Y369 PolarHBondContact O-N 3.37Å; R367-Q370 WeakPolarHBondContact O-CB 3.34Å; R367-Q370 PolarHBondContact O-N 3.29Å; R367-Q370 VanDerWaalsContact O-N 3.13Å; R367-D371 PolarHBondContact O-N 2.88Å |
| 368 | E | 97.3 | Very high | 97.4 | Very high | 82 Ų | 82 | 100.1 Ų | 100.1 | 38% | 0.383 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -58 | -40.9 | 176.7 | -68.8 | 167 | 178.3 | 0 | 0 | 112 | R364 H365 D371 L372 | R364-E368 IonicContact CZ-OE1 2.74Å; R364-E368 VanDerWaalsContact CZ-OE1 3.3Å; R364-E368 IonicContact NE-OE1 3.67Å; R364-E368 PolarHBondContact NE-OE1 2.71Å; R364-E368 IonicContact NH2-OE1 3.97Å; R364-E368 PolarHBondContact NH2-OE1 3.16Å; R364-E368 WeakPolarHBondContact O-CG 3.39Å; R364-E368 PolarHBondContact O-N 2.95Å; H365-E368 IonicContact CE1-OE2 3Å; H365-E368 IonicContact ND1-OE2 3.26Å; H365-E368 PolarHBondContact ND1-OE2 3.27Å; H365-E368 PolarHBondContact O-N 3.09Å; E368-D371 PolarHBondContact O-N 2.87Å; E368-L372 WeakPolarHBondContact O-CB 3.32Å; E368-L372 PolarHBondContact O-N 2.82Å |
| 369 | Y | 97.5 | Very high | 97.3 | Very high | 161 Ų | 161 | 100.7 Ų | 100.7 | 63% | 0.631 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.4 | -40.8 | 175.1 | -79.1 | -62.6 | 0 | 0 | 0 | 112.5 | H365 R367 D371 L372 L373 | H365-Y369 HydrophobicContact CB-CD2 4.35Å; H365-Y369 HydrophobicContact CB-CE2 4.19Å; H365-Y369 WeakPolarHBondContact O-CD2 3.46Å; H365-Y369 PolarHBondContact O-N 2.84Å; R367-Y369 VanDerWaalsContact C-N 3.31Å; R367-Y369 PolarHBondContact O-N 3.37Å; Y369-D371 VanDerWaalsContact C-N 3.34Å; Y369-L372 PolarHBondContact O-N 2.89Å; Y369-L373 WeakPolarHBondContact O-CB 3.09Å; Y369-L373 PolarHBondContact O-N 3.36Å |
| 370 | Q | 97.2 | Very high | 97.2 | Very high | 99 Ų | 99 | 97.8 Ų | 97.8 | 46% | 0.463 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.8 | -42 | 175.7 | -176 | 61 | 51.7 | 0 | 0 | 111.1 | L366 R367 L373 N374 | L366-Q370 PolarHBondContact O-N 3.31Å; L366-Q370 VanDerWaalsContact O-N 3.07Å; R367-Q370 WeakPolarHBondContact O-CB 3.34Å; R367-Q370 PolarHBondContact O-N 3.29Å; R367-Q370 VanDerWaalsContact O-N 3.13Å; Q370-L373 WeakPolarHBondContact O-CB 3.29Å; Q370-L373 PolarHBondContact O-N 3.37Å; Q370-N374 PolarHBondContact NE2-OD1 3.49Å; Q370-N374 VanDerWaalsContact NE2-OD1 3.09Å; Q370-N374 PolarHBondContact O-N 3.18Å; Q370-N374 PolarHBondContact O-ND2 3.3Å; Q370-N374 PolarHBondContact O-OD1 2.91Å |
| 371 | D | 97.1 | Very high | 97.1 | Very high | 85 Ų | 85 | 99.7 Ų | 99.7 | 46% | 0.455 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.8 | -42.8 | 177.1 | -68.2 | -23.4 | 0 | 0 | 0 | 111.4 | R367 E368 Y369 L373 N374 V375 | R367-D371 PolarHBondContact O-N 2.88Å; E368-D371 PolarHBondContact O-N 2.87Å; Y369-D371 VanDerWaalsContact C-N 3.34Å; D371-L373 VanDerWaalsContact C-N 3.35Å; D371-L373 PolarHBondContact O-N 3.14Å; D371-N374 WeakPolarHBondContact O-CB 3.4Å; D371-N374 PolarHBondContact O-N 3.42Å; D371-V375 WeakPolarHBondContact O-CG2 3.24Å; D371-V375 PolarHBondContact O-N 2.76Å |
| 372 | L | 97.6 | Very high | 97 | Very high | 114 Ų | 114 | 99.5 Ų | 99.5 | 60% | 0.597 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.4 | -39.2 | 175.4 | -175.3 | 62.8 | 0 | 0 | 0 | 112.1 | E368 Y369 N374 V375 K376 | E368-L372 WeakPolarHBondContact O-CB 3.32Å; E368-L372 PolarHBondContact O-N 2.82Å; Y369-L372 PolarHBondContact O-N 2.89Å; L372-N374 VanDerWaalsContact C-N 3.32Å; L372-V375 PolarHBondContact O-N 2.9Å; L372-K376 WeakPolarHBondContact O-CB 3.45Å; L372-K376 PolarHBondContact O-N 3.14Å |
| 373 | L | 96.8 | Very high | 96.9 | Very high | 85 Ų | 85 | 97.5 Ų | 97.5 | 45% | 0.445 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.1 | -43 | 173.6 | 179.4 | 64.8 | 0 | 0 | 0 | 110.9 | Y369 Q370 D371 V375 K376 M377 | Y369-L373 WeakPolarHBondContact O-CB 3.09Å; Y369-L373 PolarHBondContact O-N 3.36Å; Q370-L373 WeakPolarHBondContact O-CB 3.29Å; Q370-L373 PolarHBondContact O-N 3.37Å; D371-L373 VanDerWaalsContact C-N 3.35Å; D371-L373 PolarHBondContact O-N 3.14Å; L373-V375 VanDerWaalsContact C-N 3.35Å; L373-V375 PolarHBondContact O-N 3.41Å; L373-K376 PolarHBondContact O-N 3.5Å; L373-M377 WeakPolarHBondContact O-CG 3.47Å; L373-M377 PolarHBondContact O-N 2.84Å |
| 374 | N | 96.8 | Very high | 96.7 | Very high | 77 Ų | 77 | 97.7 Ų | 97.7 | 41% | 0.412 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -60.1 | -44.6 | 176.2 | -64.1 | -23.2 | 0 | 0 | 0 | 111.1 | Q370 D371 L372 M377 A378 | Q370-N374 PolarHBondContact NE2-OD1 3.49Å; Q370-N374 VanDerWaalsContact NE2-OD1 3.09Å; Q370-N374 PolarHBondContact O-N 3.18Å; Q370-N374 PolarHBondContact O-ND2 3.3Å; Q370-N374 PolarHBondContact O-OD1 2.91Å; D371-N374 WeakPolarHBondContact O-CB 3.4Å; D371-N374 PolarHBondContact O-N 3.42Å; L372-N374 VanDerWaalsContact C-N 3.32Å; N374-M377 PolarHBondContact O-N 2.9Å; N374-A378 PolarHBondContact O-N 3.41Å |
| 375 | V | 97.5 | Very high | 96.5 | Very high | 83 Ų | 83 | 93.4 Ų | 93.4 | 50% | 0.503 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.1 | -44.2 | 175 | 174.1 | 0 | 0 | 0 | 0 | 111.3 | D371 L372 L373 M377 A378 L379 | D371-V375 WeakPolarHBondContact O-CG2 3.24Å; D371-V375 PolarHBondContact O-N 2.76Å; L372-V375 PolarHBondContact O-N 2.9Å; L373-V375 VanDerWaalsContact C-N 3.35Å; L373-V375 PolarHBondContact O-N 3.41Å; V375-M377 VanDerWaalsContact C-N 3.33Å; V375-M377 PolarHBondContact O-N 2.86Å; V375-A378 WeakPolarHBondContact O-CB 3.35Å; V375-A378 PolarHBondContact O-N 3.36Å; V375-L379 HydrophobicContact CG1-CD1 4.23Å; V375-L379 HydrophobicContact CG1-CG 4.48Å; V375-L379 WeakPolarHBondContact O-CG 3.28Å; V375-L379 PolarHBondContact O-N 3.31Å |
| 376 | K | 97.3 | Very high | 96.4 | Very high | 108 Ų | 108 | 96.2 Ų | 96.2 | 47% | 0.47 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.9 | -43.3 | 177.3 | -173.4 | -90.9 | 173.5 | 179.8 | 0 | 111.7 | L372 L373 A378 L379 D380 | L372-K376 WeakPolarHBondContact O-CB 3.45Å; L372-K376 PolarHBondContact O-N 3.14Å; L373-K376 PolarHBondContact O-N 3.5Å; K376-A378 VanDerWaalsContact C-N 3.33Å; K376-L379 PolarHBondContact O-N 3.35Å; K376-D380 VanDerWaalsContact CD-OD2 3.3Å; K376-D380 WeakPolarHBondContact CD-OD2 3.48Å; K376-D380 VanDerWaalsContact CE-OD1 3.23Å; K376-D380 WeakPolarHBondContact CE-OD1 3.29Å; K376-D380 WeakPolarHBondContact CE-OD2 3.34Å; K376-D380 VanDerWaalsContact NZ-CG 3.31Å; K376-D380 IonicContact NZ-OD1 2.59Å; K376-D380 PolarHBondContact NZ-OD1 3.14Å; K376-D380 IonicContact NZ-OD2 2.77Å; K376-D380 PolarHBondContact NZ-OD2 2.8Å; K376-D380 PolarHBondContact O-N 2.88Å |
| 377 | M | 97.3 | Very high | 96.1 | Very high | 103 Ų | 103 | 98.6 Ų | 98.6 | 51% | 0.507 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.8 | -40.3 | 176.2 | -72.8 | -176.5 | 64.3 | 0 | 0 | 111.8 | L373 N374 V375 D380 I381 | L373-M377 WeakPolarHBondContact O-CG 3.47Å; L373-M377 PolarHBondContact O-N 2.84Å; N374-M377 PolarHBondContact O-N 2.9Å; V375-M377 VanDerWaalsContact C-N 3.33Å; V375-M377 PolarHBondContact O-N 2.86Å; M377-D380 PolarHBondContact O-N 3.26Å; M377-I381 VanDerWaalsContact O-CG1 3.29Å; M377-I381 WeakPolarHBondContact O-CG1 3.38Å; M377-I381 PolarHBondContact O-N 3.37Å; M377-I381 VanDerWaalsContact O-N 3.14Å |
| 378 | A | 96.8 | Very high | 95.8 | Very high | 45 Ų | 45 | 98.3 Ų | 98.3 | 37% | 0.372 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.3 | -45.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | N374 V375 K376 D380 I381 E382 | N374-A378 PolarHBondContact O-N 3.41Å; V375-A378 WeakPolarHBondContact O-CB 3.35Å; V375-A378 PolarHBondContact O-N 3.36Å; K376-A378 VanDerWaalsContact C-N 3.33Å; A378-D380 PolarHBondContact O-N 2.87Å; A378-I381 WeakPolarHBondContact O-CB 3.23Å; A378-I381 PolarHBondContact O-N 3.49Å; A378-E382 PolarHBondContact O-N 2.94Å |
| 379 | L | 96.6 | Very high | 95.4 | Very high | 84 Ų | 84 | 99.9 Ų | 99.9 | 44% | 0.44 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.6 | -39.5 | 176.3 | -69.7 | 174.5 | 0 | 0 | 0 | 112.9 | V375 K376 I381 E382 I383 | V375-L379 HydrophobicContact CG1-CD1 4.23Å; V375-L379 HydrophobicContact CG1-CG 4.48Å; V375-L379 WeakPolarHBondContact O-CG 3.28Å; V375-L379 PolarHBondContact O-N 3.31Å; K376-L379 PolarHBondContact O-N 3.35Å; L379-I381 VanDerWaalsContact C-N 3.27Å; L379-I381 PolarHBondContact O-N 2.79Å; L379-E382 PolarHBondContact O-N 2.85Å; L379-I383 WeakPolarHBondContact O-CB 3.49Å; L379-I383 VanDerWaalsContact O-CG1 3.28Å; L379-I383 WeakPolarHBondContact O-CG1 3.4Å; L379-I383 PolarHBondContact O-N 3.17Å |
| 380 | D | 96.2 | Very high | 94.7 | Very high | 66 Ų | 66 | 97.4 Ų | 97.4 | 35% | 0.353 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.6 | -39.6 | 174.6 | -70.3 | -32.4 | 0 | 0 | 0 | 111.7 | K376 M377 A378 I383 A384 | K376-D380 VanDerWaalsContact CD-OD2 3.3Å; K376-D380 WeakPolarHBondContact CD-OD2 3.48Å; K376-D380 VanDerWaalsContact CE-OD1 3.23Å; K376-D380 WeakPolarHBondContact CE-OD1 3.29Å; K376-D380 WeakPolarHBondContact CE-OD2 3.34Å; K376-D380 VanDerWaalsContact NZ-CG 3.31Å; K376-D380 IonicContact NZ-OD1 2.59Å; K376-D380 PolarHBondContact NZ-OD1 3.14Å; K376-D380 IonicContact NZ-OD2 2.77Å; K376-D380 PolarHBondContact NZ-OD2 2.8Å; K376-D380 PolarHBondContact O-N 2.88Å; M377-D380 PolarHBondContact O-N 3.26Å; A378-D380 PolarHBondContact O-N 2.87Å; D380-I383 PolarHBondContact O-N 3.45Å; D380-A384 VanDerWaalsContact O-CB 3.31Å; D380-A384 WeakPolarHBondContact O-CB 3.27Å; D380-A384 PolarHBondContact O-N 3.25Å |
| 381 | I | 95.1 | Very high | 93.8 | Very high | 121 Ų | 121 | 98.7 Ų | 98.7 | 62% | 0.621 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -64.6 | -44.5 | 176.3 | -66.6 | 164.7 | 0 | 0 | 0 | 109.9 | M377 A378 L379 A384 A385 | M377-I381 VanDerWaalsContact O-CG1 3.29Å; M377-I381 WeakPolarHBondContact O-CG1 3.38Å; M377-I381 PolarHBondContact O-N 3.37Å; M377-I381 VanDerWaalsContact O-N 3.14Å; A378-I381 WeakPolarHBondContact O-CB 3.23Å; A378-I381 PolarHBondContact O-N 3.49Å; L379-I381 VanDerWaalsContact C-N 3.27Å; L379-I381 PolarHBondContact O-N 2.79Å; I381-A384 PolarHBondContact O-N 2.85Å; I381-A385 WeakPolarHBondContact O-CB 3.18Å; I381-A385 PolarHBondContact O-N 2.83Å |
| 382 | E | 96.3 | Very high | 92.4 | Very high | 96 Ų | 96 | 96 Ų | 96 | 45% | 0.449 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.3 | -47 | 175.2 | -71.4 | 177.6 | -168.1 | 0 | 0 | 111.9 | A378 L379 A384 A385 Y386 | A378-E382 PolarHBondContact O-N 2.94Å; L379-E382 PolarHBondContact O-N 2.85Å; E382-A384 VanDerWaalsContact C-N 3.33Å; E382-A384 PolarHBondContact O-N 3.34Å; E382-A385 CarbonylContact O-C 3.55Å; E382-A385 WeakPolarHBondContact O-CA 3.31Å; E382-A385 WeakPolarHBondContact O-CB 3.31Å; E382-A385 PolarHBondContact O-N 3.47Å; E382-A385 VanDerWaalsContact O-N 3.11Å; E382-Y386 HydrophobicContact CB-CD2 4.35Å; E382-Y386 HydrophobicContact CB-CE2 4.07Å; E382-Y386 WeakPolarHBondContact O-CD2 3.31Å; E382-Y386 PolarHBondContact O-N 3.3Å |
| 383 | I | 94.2 | Very high | 90.8 | Very high | 82 Ų | 82 | 94.5 Ų | 94.5 | 42% | 0.421 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.5 | -43.5 | 177 | -69.2 | 166.6 | 0 | 0 | 0 | 110.6 | L379 D380 A385 Y386 R387 | L379-I383 WeakPolarHBondContact O-CB 3.49Å; L379-I383 VanDerWaalsContact O-CG1 3.28Å; L379-I383 WeakPolarHBondContact O-CG1 3.4Å; L379-I383 PolarHBondContact O-N 3.17Å; D380-I383 PolarHBondContact O-N 3.45Å; I383-A385 VanDerWaalsContact C-N 3.3Å; I383-A385 PolarHBondContact O-N 2.83Å; I383-Y386 PolarHBondContact O-N 2.83Å; I383-R387 HydrophobicContact CG2-CG 4.39Å; I383-R387 WeakPolarHBondContact O-CB 3.26Å; I383-R387 VanDerWaalsContact O-CG 3.32Å; I383-R387 WeakPolarHBondContact O-CG 3.47Å; I383-R387 PolarHBondContact O-N 3.08Å |
| 384 | A | 93.9 | Very high | 89 | Confident | 56 Ų | 56 | 97.3 Ų | 97.3 | 46% | 0.463 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.2 | -39.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | D380 I381 E382 K388 | D380-A384 VanDerWaalsContact O-CB 3.31Å; D380-A384 WeakPolarHBondContact O-CB 3.27Å; D380-A384 PolarHBondContact O-N 3.25Å; I381-A384 PolarHBondContact O-N 2.85Å; E382-A384 VanDerWaalsContact C-N 3.33Å; E382-A384 PolarHBondContact O-N 3.34Å; A384-K388 WeakPolarHBondContact O-CB 3.48Å; A384-K388 PolarHBondContact O-N 3.4Å; A384-K388 VanDerWaalsContact O-N 3.07Å |
| 385 | A | 92.3 | Very high | 87 | Confident | 49 Ų | 49 | 98.1 Ų | 98.1 | 41% | 0.405 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.4 | -45.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | I381 E382 I383 K388 L389 | I381-A385 WeakPolarHBondContact O-CB 3.18Å; I381-A385 PolarHBondContact O-N 2.83Å; E382-A385 CarbonylContact O-C 3.55Å; E382-A385 WeakPolarHBondContact O-CA 3.31Å; E382-A385 WeakPolarHBondContact O-CB 3.31Å; E382-A385 PolarHBondContact O-N 3.47Å; E382-A385 VanDerWaalsContact O-N 3.11Å; I383-A385 VanDerWaalsContact C-N 3.3Å; I383-A385 PolarHBondContact O-N 2.83Å; A385-K388 PolarHBondContact O-N 3.22Å; A385-L389 PolarHBondContact O-N 2.89Å |
| 386 | Y | 95 | Very high | 85 | Confident | 145 Ų | 145 | 101.9 Ų | 101.9 | 57% | 0.569 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.9 | -43.3 | 175.9 | -71.1 | -56.4 | 0 | 0 | 0 | 112.2 | E382 I383 K388 L389 L390 | E382-Y386 HydrophobicContact CB-CD2 4.35Å; E382-Y386 HydrophobicContact CB-CE2 4.07Å; E382-Y386 WeakPolarHBondContact O-CD2 3.31Å; E382-Y386 PolarHBondContact O-N 3.3Å; I383-Y386 PolarHBondContact O-N 2.83Å; Y386-K388 VanDerWaalsContact C-N 3.33Å; Y386-K388 PolarHBondContact O-N 3.43Å; Y386-L389 WeakPolarHBondContact O-CB 3.44Å; Y386-L389 PolarHBondContact O-N 3.4Å; Y386-L390 PolarHBondContact O-N 2.8Å |
| 387 | R | 92.4 | Very high | 82.9 | Confident | 165 Ų | 165 | 103.3 Ų | 103.3 | 62% | 0.623 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -57.9 | -45.4 | 174.4 | -76.7 | 177.6 | 179.9 | 177.9 | 1 | 111.7 | I383 L389 L390 E391 | I383-R387 HydrophobicContact CG2-CG 4.39Å; I383-R387 WeakPolarHBondContact O-CB 3.26Å; I383-R387 VanDerWaalsContact O-CG 3.32Å; I383-R387 WeakPolarHBondContact O-CG 3.47Å; I383-R387 PolarHBondContact O-N 3.08Å; R387-L389 VanDerWaalsContact C-N 3.32Å; R387-L389 PolarHBondContact O-N 3.33Å; R387-L390 PolarHBondContact O-N 2.97Å; R387-E391 WeakPolarHBondContact O-CG 3.3Å; R387-E391 PolarHBondContact O-N 2.9Å |
| 388 | K | 91.1 | Very high | 80.6 | Confident | 159 Ų | 159 | 101.7 Ų | 101.7 | 69% | 0.691 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.1 | -36.6 | 176.9 | -172.8 | 178.3 | -179.8 | -179.5 | 0 | 112.9 | A384 A385 Y386 G392 | A384-K388 WeakPolarHBondContact O-CB 3.48Å; A384-K388 PolarHBondContact O-N 3.4Å; A384-K388 VanDerWaalsContact O-N 3.07Å; A385-K388 PolarHBondContact O-N 3.22Å; Y386-K388 VanDerWaalsContact C-N 3.33Å; Y386-K388 PolarHBondContact O-N 3.43Å; K388-G392 PolarHBondContact O-N 3.49Å |
| 389 | L | 89 | Confident | 78 | Confident | 115 Ų | 115 | 104.7 Ų | 104.7 | 60% | 0.602 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -67.3 | -42.6 | 174.3 | -86.2 | 152.5 | 0 | 0 | 0 | 112.1 | A385 Y386 R387 G392 E393 | A385-L389 PolarHBondContact O-N 2.89Å; Y386-L389 WeakPolarHBondContact O-CB 3.44Å; Y386-L389 PolarHBondContact O-N 3.4Å; R387-L389 VanDerWaalsContact C-N 3.32Å; R387-L389 PolarHBondContact O-N 3.33Å; L389-G392 PolarHBondContact O-N 2.87Å; L389-E393 PolarHBondContact O-N 2.87Å; L389-E393 VanDerWaalsContact O-N 3.1Å |
| 390 | L | 83.1 | Confident | 75.5 | Confident | 109 Ų | 109 | 103.5 Ų | 103.5 | 57% | 0.571 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -66.3 | -43.9 | 177.7 | -80 | 155.3 | 0 | 0 | 0 | 112.3 | Y386 R387 G392 E393 E394 | Y386-L390 PolarHBondContact O-N 2.8Å; R387-L390 PolarHBondContact O-N 2.97Å; L390-G392 PolarHBondContact O-N 3.37Å; L390-E393 WeakPolarHBondContact O-CB 3.38Å; L390-E393 PolarHBondContact O-N 3.35Å; L390-E394 PolarHBondContact O-N 3.34Å |
| 391 | E | 77.8 | Confident | 72.7 | Confident | 126 Ų | 126 | 108.4 Ų | 108.4 | 59% | 0.589 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -59.6 | -32.2 | 172.6 | -72.2 | 169.7 | -169.6 | 0 | 0 | 111.8 | R387 T395 | R387-E391 WeakPolarHBondContact O-CG 3.3Å; R387-E391 PolarHBondContact O-N 2.9Å; E391-T395 PolarHBondContact O-N 2.96Å; E391-T395 PolarHBondContact O-OG1 3.4Å |
| 392 | G | 67.9 | Low | 70.1 | Confident | 28 Ų | 28 | 106.7 Ų | 106.7 | 29% | 0.289 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -73.2 | -22.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | K388 L389 L390 T395 | K388-G392 PolarHBondContact O-N 3.49Å; L389-G392 PolarHBondContact O-N 2.87Å; L390-G392 PolarHBondContact O-N 3.37Å; G392-T395 WeakPolarHBondContact CA-OG1 3.28Å; G392-T395 PolarHBondContact O-OG1 3.48Å |
| 393 | E | 64 | Low | 67.2 | Low | 82 Ų | 82 | 112.3 Ų | 112.3 | 38% | 0.383 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -86.7 | -36.7 | 173.1 | -84.8 | -76.3 | 122.7 | 0 | 0 | 111.7 | L389 L390 T395 R396 I397 | L389-E393 PolarHBondContact O-N 2.87Å; L389-E393 VanDerWaalsContact O-N 3.1Å; L390-E393 WeakPolarHBondContact O-CB 3.38Å; L390-E393 PolarHBondContact O-N 3.35Å; E393-T395 PolarHBondContact O-N 2.88Å; E393-R396 CarbonylContact O-C 3.59Å; E393-R396 WeakPolarHBondContact O-CA 3.45Å; E393-R396 WeakPolarHBondContact O-CB 3.45Å; E393-R396 PolarHBondContact O-N 2.84Å; E393-R396 IonicContact OE1-CZ 3.22Å; E393-R396 IonicContact OE1-NE 2.82Å; E393-R396 PolarHBondContact OE1-NE 3.39Å; E393-R396 IonicContact OE1-NH2 3.17Å; E393-R396 PolarHBondContact OE1-NH2 3.49Å; E393-I397 PolarHBondContact O-N 2.91Å |
| 394 | E | 57.6 | Low | 64.2 | Low | 144 Ų | 144 | 113.8 Ų | 113.8 | 67% | 0.673 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -63.5 | -29.6 | 172.6 | -73.8 | -176 | 168.3 | 0 | 0 | 111.8 | L390 R396 G398 | L390-E394 PolarHBondContact O-N 3.34Å; E394-R396 VanDerWaalsContact C-N 3.29Å; E394-R396 PolarHBondContact O-N 2.99Å; E394-G398 PolarHBondContact O-N 3.1Å |
| 395 | T | 54.5 | Low | 61.2 | Low | 94 Ų | 94 | 118.4 Ų | 118.4 | 58% | 0.577 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -70.3 | -21.4 | 168.2 | 14.2 | 0 | 0 | 0 | 0 | 113.5 | E391 G392 E393 T399 | E391-T395 PolarHBondContact O-N 2.96Å; E391-T395 PolarHBondContact O-OG1 3.4Å; G392-T395 WeakPolarHBondContact CA-OG1 3.28Å; G392-T395 PolarHBondContact O-OG1 3.48Å; E393-T395 PolarHBondContact O-N 2.88Å; T395-T399 PolarHBondContact O-OG1 3.22Å |
| 396 | R | 56.8 | Low | 59.2 | Low | 162 Ų | 162 | 120.9 Ų | 120.9 | 61% | 0.611 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -85.7 | -37.3 | 171.5 | -77.6 | -168.2 | -83.8 | -100.8 | 0.8 | 112.8 | E393 E394 | E393-R396 CarbonylContact O-C 3.59Å; E393-R396 WeakPolarHBondContact O-CA 3.45Å; E393-R396 WeakPolarHBondContact O-CB 3.45Å; E393-R396 PolarHBondContact O-N 2.84Å; E393-R396 IonicContact OE1-CZ 3.22Å; E393-R396 IonicContact OE1-NE 2.82Å; E393-R396 PolarHBondContact OE1-NE 3.39Å; E393-R396 IonicContact OE1-NH2 3.17Å; E393-R396 PolarHBondContact OE1-NH2 3.49Å; E394-R396 VanDerWaalsContact C-N 3.29Å; E394-R396 PolarHBondContact O-N 2.99Å |
| 397 | I | 53.8 | Low | 56.3 | Low | 138 Ų | 138 | 118.9 Ų | 118.9 | 71% | 0.708 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -83.4 | -33 | -177.6 | -64.4 | 175.9 | 0 | 0 | 0 | 112.2 | E393 T399 | E393-I397 PolarHBondContact O-N 2.91Å; I397-T399 PolarHBondContact O-N 3.05Å |
| 398 | G | 47.3 | Very low | 53.6 | Low | 69 Ų | 69 | 118.4 Ų | 118.4 | 71% | 0.711 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -70.4 | -4.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | E394 | E394-G398 PolarHBondContact O-N 3.1Š|
| 399 | T | 43.4 | Very low | 50.8 | Low | 109 Ų | 109 | 116.3 Ų | 116.3 | 67% | 0.669 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -135 | 63 | -174.3 | -9.5 | 0 | 0 | 0 | 0 | 111.8 | T395 I397 | T395-T399 PolarHBondContact O-OG1 3.22Å; I397-T399 PolarHBondContact O-N 3.05Å |
| 400 | G | 43.2 | Very low | 48.2 | Very low | 58 Ų | 58 | 115.3 Ų | 115.3 | 60% | 0.598 | 67% | 0.673 | S | S | * | * | trans | 101.4 | 108.8 | 133.9 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 401 | I | 37.6 | Very low | 45.9 | Very low | 170 Ų | 170 | 113 Ų | 113 | 87% | 0.872 | 68% | 0.676 | S | S | * | * | -77.6 | 108.3 | 119 | -64.6 | 176.5 | 0 | 0 | 0 | 105.2 | |||||
| 402 | A | 40.9 | Very low | 43.9 | Very low | 85 Ų | 85 | 115.4 Ų | 115.4 | 70% | 0.702 | 69% | 0.691 | S | S | * | * | trans | -112.8 | 134.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 403 | Y | 35.4 | Very low | 42.3 | Very low | 214 Ų | 214 | 117.1 Ų | 117.1 | 84% | 0.839 | 71% | 0.708 | S | S | * | * | trans | -120.4 | 128.5 | 148.6 | -63.6 | -71.8 | 0 | 0 | 0 | 104.3 | ||||
| 404 | S | 31.4 | Very low | 41 | Very low | 112 Ų | 112 | 121.6 Ų | 121.6 | 78% | 0.783 | 73% | 0.729 | S | S | * | * | cis | -161.2 | 150 | 7 | -73.1 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 405 | N | 31.1 | Very low | 39.7 | Very low | 154 Ų | 154 | 117.5 Ų | 117.5 | 82% | 0.824 | 73% | 0.725 | S | S | * | * | trans | -42.8 | 179.7 | 174.4 | -110.1 | 2.3 | 0 | 0 | 0 | 120.1 | ||||
| 406 | P | 49.8 | Very low | 38.6 | Very low | 100 Ų | 100 | 122.6 Ų | 122.6 | 65% | 0.649 | 74% | 0.736 | S | S | * | * | cis | -142.8 | 178.7 | -8.2 | 31.7 | -9.4 | 0 | 0 | 0 | 118.3 | ||||
| 407 | S | 33.1 | Very low | 37.3 | Very low | 103 Ų | 103 | 120.3 Ų | 120.3 | 72% | 0.72 | 75% | 0.745 | S | S | * | * | trans | 98.4 | 135.8 | 144.4 | 80.9 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 408 | I | 36.2 | Very low | 36.4 | Very low | 155 Ų | 155 | 124.4 Ų | 124.4 | 80% | 0.795 | 75% | 0.753 | S | S | * | * | cis | -162.1 | 140.9 | -1.2 | -106.2 | 161.4 | 0 | 0 | 0 | 107 | ||||
| 409 | S | 33.5 | Very low | 35.6 | Very low | 116 Ų | 116 | 130.2 Ų | 130.2 | 81% | 0.811 | 76% | 0.761 | S | S | * | * | trans | 40.2 | 140.3 | 135.8 | -155.8 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 410 | A | 34 | Very low | 35.2 | Very low | 93 Ų | 93 | 130.6 Ų | 130.6 | 77% | 0.769 | 76% | 0.764 | S | S | * | * | cis | -174.8 | 164.5 | 8.5 | 0 | 0 | 0 | 0 | 0 | 103.5 | ||||
| 411 | G | 35.2 | Very low | 34.6 | Very low | 60 Ų | 60 | 139.7 Ų | 139.7 | 62% | 0.619 | 78% | 0.78 | S | S | * | * | cis | 161.7 | 163.8 | 10.7 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 412 | I | 36 | Very low | 34.4 | Very low | 178 Ų | 178 | 138.6 Ų | 138.6 | 91% | 0.913 | 77% | 0.774 | S | S | * | * | trans | 68.1 | 123.7 | 143.2 | -50.4 | 162 | 0 | 0 | 0 | 116.2 | ||||
| 413 | G | 34.1 | Very low | 34 | Very low | 63 Ų | 63 | 145.4 Ų | 145.4 | 65% | 0.649 | 78% | 0.783 | S | S | * | * | cis | 161.4 | 178.2 | 6.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 414 | Q | 37 | Very low | 33.9 | Very low | 177 Ų | 177 | 140.6 Ų | 140.6 | 83% | 0.827 | 78% | 0.781 | S | S | * | * | trans | 58.1 | 137.6 | 152.6 | -58.3 | -160.8 | -10.7 | 0 | 0 | 118.9 | ||||
| 415 | G | 29.7 | Very low | 34.1 | Very low | 57 Ų | 57 | 138.7 Ų | 138.7 | 59% | 0.588 | 78% | 0.779 | S | S | * | * | cis | 164.8 | 166.2 | 7.2 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 416 | Y | 30.9 | Very low | 34.1 | Very low | 202 Ų | 202 | 136.5 Ų | 136.5 | 79% | 0.792 | 78% | 0.776 | S | S | * | * | trans | 54.2 | 128.3 | 154.9 | -49.1 | -79.1 | 0 | 0 | 0 | 117.8 | ||||
| 417 | S | 30.2 | Very low | 33.5 | Very low | 114 Ų | 114 | 135.1 Ų | 135.1 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | 176.2 | 151.3 | 62.7 | 43.1 | 0 | 0 | 0 | 0 | 110 | |||||
| 418 | Y | 34 | Very low | 33.4 | Very low | 224 Ų | 224 | 139.1 Ų | 139.1 | 88% | 0.878 | 78% | 0.784 | S | S | * | * | trans | -68.5 | 143.9 | 164.1 | -72.9 | -98.8 | 0 | 0 | 0 | 110.3 | ||||
| 419 | Q | 30.1 | Very low | 33.1 | Very low | 191 Ų | 191 | 137.9 Ų | 137.9 | 89% | 0.893 | 78% | 0.784 | S | S | * | * | trans | -161.3 | 129.8 | 136.1 | -87.3 | -133.8 | -23.2 | 0 | 0 | 114.1 | ||||
| 420 | T | 35 | Very low | 33 | Very low | 117 Ų | 117 | 138.1 Ų | 138.1 | 72% | 0.718 | 79% | 0.786 | S | S | * | * | trans | -46.6 | 142.5 | 160 | -53.6 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 421 | R | 31.3 | Very low | 32.8 | Very low | 249 Ų | 249 | 143 Ų | 143 | 94% | 0.94 | 79% | 0.789 | S | S | * | * | trans | -134 | 132.4 | 151.3 | -93.7 | -163.3 | -163.9 | -168.7 | 6.4 | 113.3 | ||||
| 422 | I | 32.7 | Very low | 32.7 | Very low | 147 Ų | 147 | 149.3 Ų | 149.3 | 75% | 0.754 | 80% | 0.8 | S | S | * | * | trans | -73 | 141.4 | -177.7 | -68.5 | 179.7 | 0 | 0 | 0 | 110.5 | S424 | I422-S424 PolarHBondContact O-N 3.1Š| ||
| 423 | Y | 34.4 | Very low | 32.5 | Very low | 228 Ų | 228 | 148.9 Ų | 148.9 | 89% | 0.894 | 79% | 0.794 | S | S | * | * | trans | -70.1 | 111.9 | 165.6 | -115.9 | -97.8 | 0 | 0 | 0 | 109.4 | G425 | Y423-G425 PolarHBondContact O-N 3.05Š| ||
| 424 | S | 32.6 | Very low | 32.3 | Very low | 112 Ų | 112 | 149.5 Ų | 149.5 | 78% | 0.783 | 80% | 0.8 | S | S | * | * | trans | -89 | 92.4 | 167.2 | 56.8 | 0 | 0 | 0 | 0 | 109.5 | I422 S426 | I422-S424 PolarHBondContact O-N 3.1Å; S424-S426 PolarHBondContact O-N 3.25Å | ||
| 425 | G | 34.9 | Very low | 32 | Very low | 72 Ų | 72 | 150.5 Ų | 150.5 | 74% | 0.742 | 80% | 0.802 | S | S | * | * | trans | -68.6 | 109.3 | 165.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | Y423 G427 | Y423-G425 PolarHBondContact O-N 3.05Å; G425-G427 PolarHBondContact O-N 3.02Å; G425-G427 VanDerWaalsContact O-N 3.14Å | ||
| 426 | S | 32.5 | Very low | 32 | Very low | 109 Ų | 109 | 157 Ų | 157 | 76% | 0.762 | 82% | 0.817 | S | S | * | * | trans | -77.3 | 93.9 | 172.6 | -164.7 | 0 | 0 | 0 | 0 | 108.9 | S424 K428 | S424-S426 PolarHBondContact O-N 3.25Å; S426-K428 PolarHBondContact O-N 3.44Å | ||
| 427 | G | 35.4 | Very low | 32 | Very low | 71 Ų | 71 | 155.4 Ų | 155.4 | 73% | 0.732 | 82% | 0.817 | S | S | * | * | trans | -73.1 | 104.6 | 166.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | G425 T429 | G425-G427 PolarHBondContact O-N 3.02Å; G425-G427 VanDerWaalsContact O-N 3.14Å; G427-T429 PolarHBondContact O-N 3.48Å | ||
| 428 | K | 32.5 | Very low | 32.1 | Very low | 187 Ų | 187 | 159.1 Ų | 159.1 | 81% | 0.813 | 82% | 0.822 | S | S | * | * | trans | -87.8 | 97.2 | 163.2 | -81.4 | -171.5 | 176.5 | -179.6 | 0 | 109.2 | S426 S430 | S426-K428 PolarHBondContact O-N 3.44Å; K428-S430 PolarHBondContact O-N 3.26Å | ||
| 429 | T | 29.9 | Very low | 31.9 | Very low | 128 Ų | 128 | 157 Ų | 157 | 79% | 0.785 | 82% | 0.82 | S | S | * | * | trans | -50 | 124.1 | 151.1 | 50.7 | 0 | 0 | 0 | 0 | 110.1 | G427 | G427-T429 PolarHBondContact O-N 3.48Š| ||
| 430 | S | 30.6 | Very low | 32 | Very low | 122 Ų | 122 | 156.7 Ų | 156.7 | 85% | 0.853 | 82% | 0.818 | S | S | * | * | trans | -124.3 | 90 | 156.2 | -72.3 | 0 | 0 | 0 | 0 | 107.6 | K428 | K428-S430 PolarHBondContact O-N 3.26Š| ||
| 431 | K | 30.9 | Very low | 32.1 | Very low | 194 Ų | 194 | 156.9 Ų | 156.9 | 84% | 0.843 | 82% | 0.822 | S | S | * | * | trans | -81.2 | 118.2 | 166.1 | -171.4 | -179.7 | -175.1 | -178.1 | 0 | 106.3 | ||||
| 432 | K | 32.3 | Very low | 32 | Very low | 193 Ų | 193 | 153.9 Ų | 153.9 | 84% | 0.839 | 82% | 0.818 | S | S | * | * | trans | -151.6 | 79.3 | 160.4 | -146.4 | 175.3 | -175.3 | -178.7 | 0 | 106.2 | ||||
| 433 | E | 32 | Very low | 32 | Very low | 169 Ų | 169 | 152 Ų | 152 | 79% | 0.79 | 82% | 0.818 | S | S | * | * | 66 | 93.2 | 105.7 | -76.5 | -171.6 | 168.3 | 0 | 0 | 111.2 | |||||
| 434 | G | 28.8 | Very low | 31.9 | Very low | 76 Ų | 76 | 150.3 Ų | 150.3 | 78% | 0.784 | 82% | 0.815 | S | S | * | * | trans | -68 | 142.5 | 157.2 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 435 | K | 32.2 | Very low | 32.2 | Very low | 198 Ų | 198 | 150.6 Ų | 150.6 | 86% | 0.861 | 82% | 0.815 | S | S | * | * | trans | -121.4 | 97.8 | 150.3 | -83.8 | -169.9 | 173 | -169.3 | 0 | 106.2 | ||||
| 436 | E | 29.8 | Very low | 31.9 | Very low | 193 Ų | 193 | 154 Ų | 154 | 90% | 0.902 | 82% | 0.821 | S | S | * | * | trans | -76.8 | 117.9 | 151.3 | -72.6 | 171.2 | 166.8 | 0 | 0 | 106 | ||||
| 437 | E | 31 | Very low | 32 | Very low | 169 Ų | 169 | 152.1 Ų | 152.1 | 79% | 0.79 | 82% | 0.819 | S | S | * | * | trans | -119.1 | 98.7 | 153.5 | -94 | -177.3 | 177.9 | 0 | 0 | 106.6 | ||||
| 438 | E | 31 | Very low | 31.9 | Very low | 193 Ų | 193 | 158.8 Ų | 158.8 | 90% | 0.902 | 83% | 0.828 | S | S | * | * | trans | -74.8 | 120.9 | 161.1 | -151.8 | 178.5 | -164.1 | 0 | 0 | 107 | ||||
| 439 | Q | 30.5 | Very low | 32 | Very low | 180 Ų | 180 | 157 Ų | 157 | 84% | 0.841 | 83% | 0.832 | S | S | * | * | trans | -144.3 | 128 | 159.7 | -113.4 | 171.5 | 76.9 | 0 | 0 | 110.7 | ||||
| 440 | Q | 32.8 | Very low | 32.3 | Very low | 184 Ų | 184 | 156.2 Ų | 156.2 | 86% | 0.86 | 83% | 0.832 | S | S | * | * | trans | -56.9 | 166.3 | -170.9 | -91.7 | 176 | 12.5 | 0 | 0 | 116.8 | ||||
| 441 | P | 35.5 | Very low | 32.5 | Very low | 121 Ų | 121 | 159.7 Ų | 159.7 | 79% | 0.786 | 84% | 0.835 | S | S | * | * | trans | -76.8 | 132.4 | -173.3 | 32.3 | -33.5 | 0 | 0 | 0 | 111.3 | ||||
| 442 | Q | 30.3 | Very low | 33 | Very low | 186 Ų | 186 | 162.2 Ų | 162.2 | 87% | 0.869 | 84% | 0.839 | S | S | * | * | trans | -110.2 | 113.7 | 165.1 | -101.6 | -167.7 | 1.4 | 0 | 0 | 111.3 | ||||
| 443 | S | 32.2 | Very low | 33.3 | Very low | 106 Ų | 106 | 162 Ų | 162 | 74% | 0.741 | 84% | 0.841 | S | S | * | * | trans | -40.1 | 136.9 | 152.8 | 53.2 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 444 | K | 32.4 | Very low | 33.8 | Very low | 193 Ų | 193 | 160.1 Ų | 160.1 | 84% | 0.839 | 84% | 0.841 | S | S | * | * | trans | -157 | 140.3 | 135.4 | -109.5 | 170.5 | -170.9 | 179.2 | 0 | 111.4 | ||||
| 445 | P | 38.9 | Very low | 34.2 | Very low | 119 Ų | 119 | 167 Ų | 167 | 77% | 0.773 | 85% | 0.845 | S | S | * | * | trans | -87.3 | 138.8 | -178.6 | 35 | -30.1 | 0 | 0 | 0 | 110 | ||||
| 446 | T | 29.4 | Very low | 34.5 | Very low | 142 Ų | 142 | 166.1 Ų | 166.1 | 87% | 0.871 | 84% | 0.844 | S | S | * | * | trans | -117.1 | 93.3 | 163.5 | 50.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 447 | G | 33.9 | Very low | 35 | Very low | 71 Ų | 71 | 165.5 Ų | 165.5 | 73% | 0.732 | 84% | 0.841 | S | S | * | * | trans | -74.7 | 128.5 | 155.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 448 | K | 32.2 | Very low | 35.6 | Very low | 211 Ų | 211 | 162.6 Ų | 162.6 | 92% | 0.917 | 84% | 0.835 | S | S | * | * | trans | -137.6 | 101.5 | 145.1 | -85.9 | -167.2 | 178.2 | 179.2 | 0 | 108.6 | ||||
| 449 | V | 36.2 | Very low | 36.1 | Very low | 148 Ų | 148 | 158.5 Ų | 158.5 | 90% | 0.897 | 82% | 0.823 | S | S | * | * | trans | -51.5 | 122.4 | 152.4 | 172.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 450 | S | 34.6 | Very low | 36.7 | Very low | 113 Ų | 113 | 155.3 Ų | 155.3 | 79% | 0.79 | 82% | 0.815 | S | S | * | * | trans | -175.1 | 95.2 | 143.6 | -163.4 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 451 | Q | 34.7 | Very low | 37.1 | Very low | 195 Ų | 195 | 151.2 Ų | 151.2 | 91% | 0.911 | 80% | 0.803 | S | S | * | * | trans | -174.6 | 86.6 | 145.8 | -107.4 | 178 | 6.6 | 0 | 0 | 107.4 | ||||
| 452 | R | 41.3 | Very low | 37.5 | Very low | 246 Ų | 246 | 150.2 Ų | 150.2 | 93% | 0.928 | 80% | 0.795 | S | S | * | * | trans | -146.2 | 74.5 | 169.2 | -154.6 | -177.7 | -156.3 | 176.3 | 6 | 107.3 | ||||
| 453 | E | 40.3 | Very low | 38.1 | Very low | 189 Ų | 189 | 149.5 Ų | 149.5 | 88% | 0.883 | 79% | 0.789 | S | S | * | * | trans | -167.1 | 54.1 | 175.1 | -119.1 | 173.5 | -143.3 | 0 | 0 | 111.7 | ||||
| 454 | V | 41.6 | Very low | 38.5 | Very low | 130 Ų | 130 | 152.2 Ų | 152.2 | 79% | 0.788 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -151.7 | 53.6 | 163.3 | -162.8 | 0 | 0 | 0 | 0 | 111 | ||
| 455 | Y | 36.7 | Very low | 39 | Very low | 220 Ų | 220 | 150.4 Ų | 150.4 | 86% | 0.863 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -153.3 | 53.8 | 167.6 | -71 | -71.5 | 0 | 0 | 0 | 111.6 | ||
| 456 | E | 39.1 | Very low | 39.3 | Very low | 179 Ų | 179 | 152.2 Ų | 152.2 | 84% | 0.836 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -129.6 | -0.6 | 167.2 | -82.4 | -167.4 | 162.2 | 0 | 0 | 114.6 | ||
| 457 | E | 41.2 | Very low | 39.9 | Very low | 181 Ų | 181 | 154.4 Ų | 154.4 | 85% | 0.846 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -94.2 | -6 | -174.2 | -121.9 | 179.8 | 176.3 | 0 | 0 | 115.7 | ||
| 458 | T | 41.7 | Very low | 40.2 | Very low | 108 Ų | 108 | 159.2 Ų | 159.2 | 66% | 0.663 | 78% | 0.783 | S | S | * | * | S | Bend | trans | -97.8 | -7.9 | -178.1 | 27.8 | 0 | 0 | 0 | 0 | 115.4 | ||
| 459 | V | 42.5 | Very low | 40.7 | Very low | 107 Ų | 107 | 157.4 Ų | 157.4 | 65% | 0.648 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -92.3 | -15.9 | -178.4 | -175.1 | 0 | 0 | 0 | 0 | 112.8 | ||
| 460 | V | 43.1 | Very low | 41 | Very low | 112 Ų | 112 | 158.8 Ų | 158.8 | 68% | 0.679 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.3 | -21.3 | -178.5 | -177.2 | 0 | 0 | 0 | 0 | 112.5 | ||
| 461 | T | 41.3 | Very low | 41.7 | Very low | 99 Ų | 99 | 161.1 Ų | 161.1 | 61% | 0.607 | 78% | 0.778 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | -26.7 | -174.3 | -22.6 | 0 | 0 | 0 | 0 | 113.5 | ||
| 462 | T | 42.9 | Very low | 42.4 | Very low | 100 Ų | 100 | 158.9 Ų | 158.9 | 61% | 0.613 | 77% | 0.771 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.7 | -30.4 | 179.1 | 51.4 | 0 | 0 | 0 | 0 | 112.8 | K464 | T462-K464 VanDerWaalsContact C-N 3.25Å; T462-K464 PolarHBondContact O-N 2.69Å |
| 463 | K | 43.7 | Very low | 42.9 | Very low | 170 Ų | 170 | 153 Ų | 153 | 74% | 0.739 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72 | -13.4 | 175.9 | -110.8 | 178.3 | -179.3 | 173.4 | 0 | 114.8 | ||
| 464 | K | 40.8 | Very low | 43.1 | Very low | 163 Ų | 163 | 150.8 Ų | 150.8 | 71% | 0.709 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94 | -13.9 | -179.4 | -149.7 | 175.6 | -177.4 | 180 | 0 | 113.6 | T462 | T462-K464 VanDerWaalsContact C-N 3.25Å; T462-K464 PolarHBondContact O-N 2.69Å |
| 465 | M | 43.5 | Very low | 43.4 | Very low | 155 Ų | 155 | 151.4 Ų | 151.4 | 76% | 0.764 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | -23.1 | 174.6 | -68.5 | -158.6 | 71.2 | 0 | 0 | 113.2 | ||
| 466 | E | 43.6 | Very low | 44.1 | Very low | 158 Ų | 158 | 148.7 Ų | 148.7 | 74% | 0.738 | 76% | 0.758 | S | S | * | * | G | 310 helix | trans | -81 | -15.6 | -178.4 | -152.3 | 168.7 | -163.9 | 0 | 0 | 113.4 | ||
| 467 | K | 42.5 | Very low | 44.7 | Very low | 187 Ų | 187 | 148.7 Ų | 148.7 | 81% | 0.813 | 76% | 0.755 | S | S | * | * | G | 310 helix | trans | -95.1 | 7.5 | -179.1 | -144.9 | 178.7 | -176.9 | -179.9 | 0 | 115 | ||
| 468 | Q | 40.9 | Very low | 44.9 | Very low | 172 Ų | 172 | 151.2 Ų | 151.2 | 80% | 0.804 | 78% | 0.775 | S | S | * | * | G | 310 helix | trans | -111.6 | 6.8 | 176.8 | -74 | -171.1 | 8.4 | 0 | 0 | 113.8 | ||
| 469 | Q | 42.5 | Very low | 45.1 | Very low | 173 Ų | 173 | 153.4 Ų | 153.4 | 81% | 0.808 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -115.4 | 14.2 | -173.8 | -144.3 | 155.3 | 24 | 0 | 0 | 114.7 | ||
| 470 | E | 43 | Very low | 45.2 | Very low | 178 Ų | 178 | 155.8 Ų | 155.8 | 83% | 0.832 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -107.7 | 3.3 | 179.8 | -88.5 | -169.1 | 158 | 0 | 0 | 116.1 | ||
| 471 | D | 48 | Very low | 45.3 | Very low | 162 Ų | 162 | 158.3 Ų | 158.3 | 87% | 0.866 | 79% | 0.793 | S | S | * | * | trans | -112.4 | 84.2 | 176 | -82.1 | -33.3 | 0 | 0 | 0 | 112.1 | ||||
| 472 | I | 49.3 | Very low | 45.6 | Very low | 148 Ų | 148 | 161.8 Ų | 161.8 | 76% | 0.759 | 80% | 0.804 | S | S | * | * | trans | -132.7 | 112.1 | 158.5 | -55.2 | 178 | 0 | 0 | 0 | 108.5 | T474 | I472-T474 PolarHBondContact O-N 3.25Š| ||
| 473 | P | 53 | Low | 45.7 | Very low | 121 Ų | 121 | 165.6 Ų | 165.6 | 79% | 0.786 | 82% | 0.816 | S | S | * | * | trans | -83.2 | 116.2 | 174.2 | 31.7 | -28.1 | 0 | 0 | 0 | 109.4 | N475 | P473-N475 PolarHBondContact O-N 3.22Š| ||
| 474 | T | 43.6 | Very low | 45.9 | Very low | 143 Ų | 143 | 165.3 Ų | 165.3 | 88% | 0.877 | 82% | 0.821 | S | S | * | * | trans | -80.9 | 105.1 | 171.3 | -29.7 | 0 | 0 | 0 | 0 | 109 | I472 | I472-T474 PolarHBondContact O-N 3.25Š| ||
| 475 | N | 48.6 | Very low | 46.2 | Very low | 144 Ų | 144 | 165.5 Ų | 165.5 | 77% | 0.77 | 83% | 0.829 | S | S | * | * | trans | -94.3 | 153.1 | 173.1 | -148.8 | -14.5 | 0 | 0 | 0 | 110.7 | P473 | P473-N475 PolarHBondContact O-N 3.22Š| ||
| 476 | Q | 51.6 | Low | 46.4 | Very low | 162 Ų | 162 | 166.3 Ų | 166.3 | 76% | 0.757 | 83% | 0.834 | S | S | * | * | trans | -61.7 | 166.1 | -164.7 | -63 | 169.3 | -16.3 | 0 | 0 | 117.9 | ||||
| 477 | K | 51.4 | Low | 46.7 | Very low | 180 Ų | 180 | 167 Ų | 167 | 78% | 0.783 | 84% | 0.842 | S | S | * | * | trans | 107.9 | 102.2 | 147.8 | -65.5 | -175.5 | 176.9 | 179 | 0 | 117 | ||||
| 478 | N | 45.9 | Very low | 47.1 | Very low | 234 Ų | 234 | 165.2 Ų | 165.2 | 100% | 1.251 | 85% | 0.845 | S | S | * | * | -170.4 | 0 | 92.3 | -103.2 | -7.4 | 0 | 0 | 0 | 110.5 |
Retrieved 478 of 478 residues in 570.6 ms
(Link to these results)