| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 39.6 | Very low | 35.2 | Very low | 242 Ų | 242 | 147.8 Ų | 147.8 | 100% | 1.192 | 87% | 0.865 | S | S | * | * | 0 | 122.1 | 0 | -68.4 | 172 | -158.6 | 0 | 0 | 106.4 | |||||
| 2 | V | 34.1 | Very low | 35.2 | Very low | 149 Ų | 149 | 148.2 Ų | 148.2 | 90% | 0.903 | 87% | 0.869 | S | S | * | * | trans | -119.9 | 113.6 | 169.7 | 174.8 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 3 | E | 41.8 | Very low | 35.3 | Very low | 172 Ų | 172 | 141.8 Ų | 141.8 | 80% | 0.804 | 85% | 0.854 | S | S | * | * | trans | -152.8 | 144.1 | 168.3 | -68.1 | -176.6 | 174.8 | 0 | 0 | 103.7 | ||||
| 4 | D | 38.9 | Very low | 35.4 | Very low | 149 Ų | 149 | 147.9 Ų | 147.9 | 80% | 0.797 | 85% | 0.854 | S | S | * | * | cis | -159.7 | 154.3 | -12.4 | -112.9 | -30.8 | 0 | 0 | 0 | 107.4 | ||||
| 5 | N | 31.3 | Very low | 35.4 | Very low | 150 Ų | 150 | 148.7 Ų | 148.7 | 80% | 0.802 | 85% | 0.847 | S | S | * | * | trans | -85.6 | 130.5 | 170.3 | -80.1 | -65.1 | 0 | 0 | 0 | 110.7 | ||||
| 6 | Q | 38.3 | Very low | 35.4 | Very low | 205 Ų | 205 | 152.6 Ų | 152.6 | 96% | 0.958 | 85% | 0.846 | S | S | * | * | trans | 171 | 138.6 | 148.1 | -100.6 | 164.4 | 83.2 | 0 | 0 | 106.6 | ||||
| 7 | G | 30.3 | Very low | 35.6 | Very low | 63 Ų | 63 | 154.8 Ų | 154.8 | 65% | 0.649 | 85% | 0.845 | S | S | * | * | cis | 155.6 | 123.9 | 14.4 | 0 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 8 | F | 30.8 | Very low | 35.7 | Very low | 221 Ų | 221 | 149.4 Ų | 149.4 | 97% | 0.969 | 83% | 0.832 | S | S | * | * | trans | 19.5 | 108.6 | 151.6 | -68.7 | -92.4 | 0 | 0 | 0 | 119.2 | ||||
| 9 | G | 33.6 | Very low | 35.9 | Very low | 80 Ų | 80 | 149.8 Ų | 149.8 | 83% | 0.825 | 83% | 0.832 | S | S | * | * | trans | -121 | 106.2 | 154.9 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 10 | G | 29.1 | Very low | 36.1 | Very low | 75 Ų | 75 | 147.3 Ų | 147.3 | 77% | 0.773 | 83% | 0.825 | S | S | * | * | trans | -70.1 | 154.1 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 11 | S | 39.9 | Very low | 36.5 | Very low | 120 Ų | 120 | 145.7 Ų | 145.7 | 84% | 0.839 | 82% | 0.819 | S | S | * | * | trans | -149.2 | 97.8 | 155.1 | -87.8 | 0 | 0 | 0 | 0 | 109.9 | G13 | S11-G13 PolarHBondContact O-N 3.27Š| ||
| 12 | V | 34.7 | Very low | 36.8 | Very low | 152 Ų | 152 | 139.5 Ų | 139.5 | 92% | 0.921 | 79% | 0.794 | S | S | * | * | trans | 17 | 85.9 | 143 | -163.3 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 13 | G | 36.2 | Very low | 37.2 | Very low | 65 Ų | 65 | 139.2 Ų | 139.2 | 67% | 0.67 | 79% | 0.788 | S | S | * | * | trans | -104.1 | 122.8 | 159.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | S11 Q15 | S11-G13 PolarHBondContact O-N 3.27Å; G13-Q15 PolarHBondContact O-N 3.09Å | ||
| 14 | R | 37 | Very low | 37.5 | Very low | 227 Ų | 227 | 135.1 Ų | 135.1 | 86% | 0.857 | 78% | 0.778 | S | S | * | * | trans | -51.3 | 117.4 | 179.6 | -70.9 | 175.3 | 176.6 | -111.1 | -0.2 | 110.8 | Y16 | R14-Y16 PolarHBondContact O-N 3.17Å; R14-Y16 VanDerWaalsContact O-N 3.09Å | ||
| 15 | Q | 35.6 | Very low | 37.8 | Very low | 161 Ų | 161 | 131.1 Ų | 131.1 | 75% | 0.752 | 76% | 0.762 | S | S | * | * | trans | -68.7 | 99.9 | 168.9 | -70.1 | 176.4 | -9.8 | 0 | 0 | 108.3 | G13 F17 | G13-Q15 PolarHBondContact O-N 3.09Å; Q15-F17 PolarHBondContact O-N 2.77Å | ||
| 16 | Y | 35.5 | Very low | 39 | Very low | 210 Ų | 210 | 131.8 Ų | 131.8 | 82% | 0.824 | 76% | 0.758 | S | S | * | * | trans | -70.5 | 117.3 | 146.4 | -68.5 | -87.7 | 0 | 0 | 0 | 104.8 | R14 G18 | R14-Y16 PolarHBondContact O-N 3.17Å; R14-Y16 VanDerWaalsContact O-N 3.09Å; Y16-G18 PolarHBondContact O-N 3.49Å | ||
| 17 | F | 38.7 | Very low | 39.3 | Very low | 191 Ų | 191 | 131.1 Ų | 131.1 | 84% | 0.838 | 75% | 0.748 | S | S | * | * | trans | -65.2 | 85.6 | 164.5 | -78.2 | -85.8 | 0 | 0 | 0 | 106.3 | Q15 D19 | Q15-F17 PolarHBondContact O-N 2.77Å; F17-D19 PolarHBondContact O-N 3.12Å | ||
| 18 | G | 37.9 | Very low | 40.1 | Very low | 58 Ų | 58 | 132.4 Ų | 132.4 | 60% | 0.598 | 75% | 0.747 | S | S | * | * | trans | -67.1 | 125.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | Y16 S20 | Y16-G18 PolarHBondContact O-N 3.49Å; G18-S20 PolarHBondContact O-N 2.79Å | ||
| 19 | D | 38.2 | Very low | 40.9 | Very low | 156 Ų | 156 | 127.3 Ų | 127.3 | 83% | 0.834 | 73% | 0.73 | S | S | * | * | trans | 11.1 | 79.8 | 140.5 | -58.4 | -28.2 | 0 | 0 | 0 | 113.9 | F17 V21 | F17-D19 PolarHBondContact O-N 3.12Å; D19-V21 PolarHBondContact O-N 2.95Å | ||
| 20 | S | 41.2 | Very low | 41.4 | Very low | 99 Ų | 99 | 128.7 Ų | 128.7 | 69% | 0.692 | 72% | 0.719 | S | S | * | * | trans | -71.5 | 96.4 | 155.6 | 66.7 | 0 | 0 | 0 | 0 | 105.1 | G18 V22 | G18-S20 PolarHBondContact O-N 2.79Å; S20-V22 PolarHBondContact O-N 3.46Å | ||
| 21 | V | 43.5 | Very low | 42.3 | Very low | 115 Ų | 115 | 132.3 Ų | 132.3 | 70% | 0.697 | 72% | 0.718 | S | S | * | * | trans | -56.7 | 88.8 | 155.7 | -179.3 | 0 | 0 | 0 | 0 | 104.9 | D19 D23 | D19-V21 PolarHBondContact O-N 2.95Å; V21-D23 PolarHBondContact O-N 3.24Å | ||
| 22 | V | 46.7 | Very low | 42.9 | Very low | 112 Ų | 112 | 135.9 Ų | 135.9 | 68% | 0.679 | 72% | 0.719 | S | S | * | * | trans | -67.5 | 97.7 | 163.7 | -177.6 | 0 | 0 | 0 | 0 | 102.5 | S20 S24 | S20-V22 PolarHBondContact O-N 3.46Å; V22-S24 PolarHBondContact O-N 2.91Å | ||
| 23 | D | 42.3 | Very low | 43.7 | Very low | 142 Ų | 142 | 133 Ų | 133 | 76% | 0.759 | 70% | 0.701 | S | S | * | * | trans | -52.9 | 91.2 | 163.2 | -81.3 | -30.4 | 0 | 0 | 0 | 106.2 | V21 S25 | V21-D23 PolarHBondContact O-N 3.24Å; D23-S25 VanDerWaalsContact C-N 3.33Å; D23-S25 PolarHBondContact O-N 3.18Å | ||
| 24 | S | 48.1 | Very low | 43.9 | Very low | 87 Ų | 87 | 135.3 Ų | 135.3 | 61% | 0.608 | 70% | 0.699 | S | S | * | * | trans | -66 | 97.7 | -179.1 | 170.2 | 0 | 0 | 0 | 0 | 106.6 | V22 F26 | V22-S24 PolarHBondContact O-N 2.91Å; S24-F26 PolarHBondContact O-N 3.38Å; S24-F26 WeakPolarHBondContact OG-CB 3.39Å | ||
| 25 | S | 46 | Very low | 44.4 | Very low | 65 Ų | 65 | 129.6 Ų | 129.6 | 46% | 0.455 | 69% | 0.689 | S | S | . | * | G | 310 helix | trans | -66.9 | 15.7 | 174.9 | 63.3 | 0 | 0 | 0 | 0 | 113.1 | D23 Y27 S28 | D23-S25 VanDerWaalsContact C-N 3.33Å; D23-S25 PolarHBondContact O-N 3.18Å; S25-Y27 PolarHBondContact O-N 3.02Å; S25-S28 PolarHBondContact O-N 3.12Å |
| 26 | F | 54.8 | Low | 45 | Very low | 163 Ų | 163 | 130.1 Ų | 130.1 | 72% | 0.715 | 69% | 0.689 | S | S | * | * | G | 310 helix | trans | -51.6 | -28 | 177.5 | -167.2 | -95.4 | 0 | 0 | 0 | 112.8 | S24 | S24-F26 PolarHBondContact O-N 3.38Å; S24-F26 WeakPolarHBondContact OG-CB 3.39Å |
| 27 | Y | 46.2 | Very low | 45.3 | Very low | 191 Ų | 191 | 125 Ų | 125 | 75% | 0.749 | 68% | 0.676 | S | S | * | * | G | 310 helix | trans | -104.3 | -10 | 177 | -68.5 | -75.6 | 0 | 0 | 0 | 115.1 | S25 | S25-Y27 PolarHBondContact O-N 3.02Š|
| 28 | S | 47.1 | Very low | 45.8 | Very low | 91 Ų | 91 | 125.3 Ų | 125.3 | 64% | 0.636 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.4 | -23.3 | -167.2 | -58.7 | 0 | 0 | 0 | 0 | 114.3 | S25 N30 | S25-S28 PolarHBondContact O-N 3.12Å; S28-N30 PolarHBondContact O-N 2.99Å |
| 29 | D | 46.6 | Very low | 46.1 | Very low | 113 Ų | 113 | 129.4 Ų | 129.4 | 60% | 0.604 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -97.9 | 94.4 | -176.9 | -69.4 | -27.9 | 0 | 0 | 0 | 111.9 | ||
| 30 | N | 43.6 | Very low | 46.4 | Very low | 110 Ų | 110 | 125.9 Ų | 125.9 | 59% | 0.588 | 68% | 0.683 | S | S | * | * | trans | 52.2 | 74.7 | 154.3 | -69.9 | -43.1 | 0 | 0 | 0 | 116.2 | S28 K32 T33 | S28-N30 PolarHBondContact O-N 2.99Å; N30-K32 PolarHBondContact O-N 3.29Å; N30-T33 PolarHBondContact O-N 3.25Å; N30-T33 PolarHBondContact O-OG1 2.96Å | ||
| 31 | I | 49 | Very low | 46.4 | Very low | 150 Ų | 150 | 128.6 Ų | 128.6 | 77% | 0.769 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49 | -20.7 | 166.6 | -50.8 | 160.8 | 0 | 0 | 0 | 112.3 | ||
| 32 | K | 52.9 | Low | 46.3 | Very low | 196 Ų | 196 | 131.3 Ų | 131.3 | 85% | 0.852 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.5 | -19.2 | 178.5 | -67.7 | -177.1 | -179.9 | 179 | 0 | 115.2 | N30 | N30-K32 PolarHBondContact O-N 3.29Š|
| 33 | T | 51.4 | Low | 46.2 | Very low | 90 Ų | 90 | 133.6 Ų | 133.6 | 55% | 0.552 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.6 | -5.4 | -177.9 | 48.4 | 0 | 0 | 0 | 0 | 114.2 | N30 V35 | N30-T33 PolarHBondContact O-N 3.25Å; N30-T33 PolarHBondContact O-OG1 2.96Å; T33-V35 PolarHBondContact O-N 2.98Å |
| 34 | N | 40.1 | Very low | 46.2 | Very low | 114 Ų | 114 | 131.9 Ų | 131.9 | 61% | 0.61 | 69% | 0.692 | S | S | * | * | trans | -83.7 | 61 | 172.3 | -69.3 | -9.4 | 0 | 0 | 0 | 110.1 | F36 | N34-F36 VanDerWaalsContact C-N 3.33Å; N34-F36 PolarHBondContact O-N 3.48Å; N34-F36 VanDerWaalsContact O-N 3.09Å | ||
| 35 | V | 46.5 | Very low | 45.5 | Very low | 108 Ų | 108 | 134 Ų | 134 | 66% | 0.655 | 70% | 0.697 | S | S | * | * | trans | -66.6 | 104.2 | 153.9 | 179.1 | 0 | 0 | 0 | 0 | 104.9 | T33 N37 | T33-V35 PolarHBondContact O-N 2.98Å; V35-N37 PolarHBondContact O-N 2.73Å | ||
| 36 | F | 49 | Very low | 45.3 | Very low | 171 Ų | 171 | 137.9 Ų | 137.9 | 75% | 0.75 | 71% | 0.711 | S | S | * | * | trans | -56.2 | 102 | 170.3 | -102.2 | -100.6 | 0 | 0 | 0 | 107.9 | N34 F38 | N34-F36 VanDerWaalsContact C-N 3.33Å; N34-F36 PolarHBondContact O-N 3.48Å; N34-F36 VanDerWaalsContact O-N 3.09Å; F36-F38 PolarHBondContact O-N 2.94Å; F36-F38 VanDerWaalsContact O-N 3.15Å | ||
| 37 | N | 42.6 | Very low | 44.3 | Very low | 104 Ų | 104 | 137.8 Ų | 137.8 | 56% | 0.556 | 71% | 0.712 | S | S | * | * | trans | -72.3 | 105.7 | 166.7 | -85.3 | -1.1 | 0 | 0 | 0 | 107.1 | V35 M39 | V35-N37 PolarHBondContact O-N 2.73Å; N37-M39 PolarHBondContact O-N 2.91Å | ||
| 38 | F | 48.9 | Very low | 43.6 | Very low | 196 Ų | 196 | 131.9 Ų | 131.9 | 86% | 0.86 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -71 | -19.3 | 175.1 | -101.8 | -90.2 | 0 | 0 | 0 | 113.1 | F36 | F36-F38 PolarHBondContact O-N 2.94Å; F36-F38 VanDerWaalsContact O-N 3.15Å |
| 39 | M | 44.6 | Very low | 43 | Very low | 144 Ų | 144 | 134.8 Ų | 134.8 | 71% | 0.709 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -84.2 | 111.4 | 165.7 | -77.6 | 151.7 | 56.9 | 0 | 0 | 106.9 | N37 E41 | N37-M39 PolarHBondContact O-N 2.91Å; M39-E41 PolarHBondContact O-N 2.81Å |
| 40 | G | 44.1 | Very low | 42.3 | Very low | 83 Ų | 83 | 134.3 Ų | 134.3 | 86% | 0.856 | 72% | 0.722 | S | S | * | * | trans | -65.4 | 45.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 41 | E | 39.7 | Very low | 41.7 | Very low | 156 Ų | 156 | 135.5 Ų | 135.5 | 73% | 0.729 | 73% | 0.728 | S | S | * | * | trans | -82.4 | 116.4 | 170.9 | -64.7 | -122.4 | 161.3 | 0 | 0 | 108.6 | M39 K43 | M39-E41 PolarHBondContact O-N 2.81Å; E41-K43 PolarHBondContact O-N 2.91Å | ||
| 42 | L | 43.4 | Very low | 41.2 | Very low | 172 Ų | 172 | 134.5 Ų | 134.5 | 90% | 0.901 | 73% | 0.731 | S | S | * | * | trans | -51.2 | 110.7 | 174 | -69.9 | 161.1 | 0 | 0 | 0 | 109.1 | P44 | L42-P44 WeakPolarHBondContact O-CD 3.09Å; L42-P44 VanDerWaalsContact O-N 3.15Å | ||
| 43 | K | 44.2 | Very low | 40.4 | Very low | 159 Ų | 159 | 131.4 Ų | 131.4 | 69% | 0.691 | 73% | 0.728 | S | S | * | * | trans | -52.6 | 123.4 | 172.2 | -95.1 | -176.8 | 175 | 172.1 | 0 | 108.6 | E41 N45 | E41-K43 PolarHBondContact O-N 2.91Å; K43-N45 PolarHBondContact O-N 2.92Å | ||
| 44 | P | 41.8 | Very low | 39.5 | Very low | 107 Ų | 107 | 135.6 Ų | 135.6 | 70% | 0.695 | 74% | 0.739 | S | S | * | * | trans | -64.8 | 135.2 | 174.6 | 24.4 | -30.2 | 0 | 0 | 0 | 109 | L42 I46 | L42-P44 WeakPolarHBondContact O-CD 3.09Å; L42-P44 VanDerWaalsContact O-N 3.15Å; P44-I46 PolarHBondContact O-N 2.71Å | ||
| 45 | N | 32.9 | Very low | 39.5 | Very low | 132 Ų | 132 | 135.2 Ų | 135.2 | 71% | 0.706 | 74% | 0.743 | S | S | * | * | trans | -64.5 | 88.9 | 178.4 | -173.7 | 1.4 | 0 | 0 | 0 | 109.8 | K43 H47 | K43-N45 PolarHBondContact O-N 2.92Å; N45-H47 PolarHBondContact O-N 2.86Å; N45-H47 PolarHBondContact OD1-ND1 2.87Å | ||
| 46 | I | 41.3 | Very low | 39.1 | Very low | 145 Ų | 145 | 135.6 Ų | 135.6 | 74% | 0.744 | 75% | 0.748 | S | S | * | * | trans | -77.8 | 74.8 | 172.3 | -50.1 | 168.9 | 0 | 0 | 0 | 107.6 | P44 G48 | P44-I46 PolarHBondContact O-N 2.71Å; I46-G48 PolarHBondContact O-N 2.91Å | ||
| 47 | H | 34.5 | Very low | 38.5 | Very low | 162 Ų | 162 | 136.1 Ų | 136.1 | 75% | 0.75 | 75% | 0.752 | S | S | * | * | trans | -65.8 | 105.9 | 155.8 | -98 | 61.4 | 0 | 0 | 0 | 107.9 | N45 | N45-H47 PolarHBondContact O-N 2.86Å; N45-H47 PolarHBondContact OD1-ND1 2.87Å | ||
| 48 | G | 31.8 | Very low | 38.4 | Very low | 66 Ų | 66 | 137 Ų | 137 | 68% | 0.68 | 76% | 0.762 | S | S | * | * | trans | 77.7 | 88.4 | 151.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | I46 | I46-G48 PolarHBondContact O-N 2.91Š| ||
| 49 | I | 34.5 | Very low | 38 | Very low | 153 Ų | 153 | 132.2 Ų | 132.2 | 79% | 0.785 | 75% | 0.752 | S | S | * | * | -140.7 | 98.8 | 129.8 | -40.6 | 171.8 | 0 | 0 | 0 | 107.6 | N51 | I49-N51 PolarHBondContact O-N 3.24Š| |||
| 50 | S | 30.9 | Very low | 37.9 | Very low | 103 Ų | 103 | 134.1 Ų | 134.1 | 72% | 0.72 | 76% | 0.759 | S | S | * | * | trans | -54.7 | 114.9 | 160.1 | 50.7 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 51 | N | 31.1 | Very low | 37.8 | Very low | 134 Ų | 134 | 138.8 Ų | 138.8 | 72% | 0.717 | 76% | 0.756 | S | S | * | * | trans | -165.4 | 116.7 | 137.1 | -90.7 | -35.9 | 0 | 0 | 0 | 108.1 | I49 V53 | I49-N51 PolarHBondContact O-N 3.24Å; N51-V53 VanDerWaalsContact C-N 3.28Å; N51-V53 PolarHBondContact O-N 3.28Å | ||
| 52 | P | 38.6 | Very low | 37.9 | Very low | 130 Ų | 130 | 142.6 Ų | 142.6 | 84% | 0.844 | 76% | 0.764 | S | S | * | * | trans | -72.5 | 87 | 178.1 | 30.3 | -32.5 | 0 | 0 | 0 | 108.9 | K54 | P52-K54 VanDerWaalsContact C-N 3.29Å; P52-K54 PolarHBondContact O-N 2.8Å | ||
| 53 | V | 35.6 | Very low | 37.8 | Very low | 130 Ų | 130 | 145.2 Ų | 145.2 | 79% | 0.788 | 76% | 0.762 | S | S | * | * | trans | -71.5 | 96.8 | 163.9 | -178 | 0 | 0 | 0 | 0 | 106.1 | N51 P55 | N51-V53 VanDerWaalsContact C-N 3.28Å; N51-V53 PolarHBondContact O-N 3.28Å; V53-P55 WeakPolarHBondContact O-CD 2.86Å; V53-P55 VanDerWaalsContact O-N 3.16Å | ||
| 54 | K | 32.5 | Very low | 37.9 | Very low | 178 Ų | 178 | 149.2 Ų | 149.2 | 77% | 0.774 | 77% | 0.772 | S | S | * | * | trans | -45.4 | 118.3 | 172.7 | -123.9 | 173.2 | -179.3 | 174.6 | 0 | 108.7 | P52 | P52-K54 VanDerWaalsContact C-N 3.29Å; P52-K54 PolarHBondContact O-N 2.8Å | ||
| 55 | P | 41.5 | Very low | 37.9 | Very low | 106 Ų | 106 | 152.4 Ų | 152.4 | 69% | 0.688 | 78% | 0.78 | S | S | * | * | trans | -63.1 | 140.4 | 171.9 | -8.9 | 20.1 | 0 | 0 | 0 | 108.7 | V53 H57 | V53-P55 WeakPolarHBondContact O-CD 2.86Å; V53-P55 VanDerWaalsContact O-N 3.16Å; P55-H57 PolarHBondContact O-N 3.49Å | ||
| 56 | P | 37.9 | Very low | 38.4 | Very low | 117 Ų | 117 | 150.4 Ų | 150.4 | 76% | 0.76 | 78% | 0.776 | S | S | * | * | trans | -59.6 | 124.5 | 175.9 | 23 | -30.7 | 0 | 0 | 0 | 109.6 | T58 | P56-T58 VanDerWaalsContact C-N 3.32Å; P56-T58 PolarHBondContact O-N 2.73Å | ||
| 57 | H | 36.3 | Very low | 38.8 | Very low | 182 Ų | 182 | 149.2 Ų | 149.2 | 84% | 0.843 | 78% | 0.778 | S | S | * | * | trans | -60 | 88.4 | 172.9 | -101.5 | -79.8 | 0 | 0 | 0 | 110 | P55 S59 | P55-H57 PolarHBondContact O-N 3.49Å; H57-S59 PolarHBondContact O-N 3.11Å | ||
| 58 | T | 39.7 | Very low | 39.4 | Very low | 123 Ų | 123 | 146.1 Ų | 146.1 | 76% | 0.755 | 77% | 0.77 | S | S | * | * | trans | -84.2 | 99.8 | 155.8 | 51.4 | 0 | 0 | 0 | 0 | 107 | P56 E60 | P56-T58 VanDerWaalsContact C-N 3.32Å; P56-T58 PolarHBondContact O-N 2.73Å; T58-E60 PolarHBondContact O-N 3.14Å | ||
| 59 | S | 40.8 | Very low | 40.1 | Very low | 95 Ų | 95 | 149.4 Ų | 149.4 | 66% | 0.664 | 77% | 0.772 | S | S | * | * | trans | -69.1 | 85.2 | 167 | 47 | 0 | 0 | 0 | 0 | 108.4 | H57 K61 | H57-S59 PolarHBondContact O-N 3.11Å; S59-K61 PolarHBondContact O-N 3.38Å | ||
| 60 | E | 43.3 | Very low | 41.1 | Very low | 184 Ų | 184 | 150 Ų | 150 | 86% | 0.86 | 78% | 0.776 | S | S | * | * | trans | -67 | 90.7 | 161.4 | -92.3 | -169.4 | 150 | 0 | 0 | 107.8 | T58 R62 | T58-E60 PolarHBondContact O-N 3.14Å; E60-R62 VanDerWaalsContact C-N 3.35Å; E60-R62 PolarHBondContact O-N 3.18Å | ||
| 61 | K | 41.2 | Very low | 42.3 | Very low | 180 Ų | 180 | 151.5 Ų | 151.5 | 78% | 0.783 | 78% | 0.777 | S | S | * | * | trans | -53.9 | 105.4 | 162.7 | -70.2 | 175.8 | -179.4 | 175.4 | 0 | 106.1 | S59 R63 | S59-K61 PolarHBondContact O-N 3.38Å; K61-R63 PolarHBondContact O-N 3.14Å | ||
| 62 | R | 42.6 | Very low | 43.5 | Very low | 236 Ų | 236 | 148.9 Ų | 148.9 | 89% | 0.891 | 77% | 0.765 | S | S | * | * | trans | -47 | 92.5 | 167.6 | -154.1 | -175.5 | -52.5 | 124.4 | 3.8 | 107.5 | E60 R64 | E60-R62 VanDerWaalsContact C-N 3.35Å; E60-R62 PolarHBondContact O-N 3.18Å; R62-R64 PolarHBondContact O-N 2.99Å; R62-R64 VanDerWaalsContact O-N 3.14Å | ||
| 63 | R | 40.8 | Very low | 44.5 | Very low | 228 Ų | 228 | 149.4 Ų | 149.4 | 86% | 0.86 | 76% | 0.76 | S | S | * | * | trans | -59.5 | 122.1 | 169.3 | -85.3 | -170.6 | 179.6 | -177.4 | 1.7 | 103.9 | K61 M65 | K61-R63 PolarHBondContact O-N 3.14Å; R63-M65 PolarHBondContact O-N 3.11Å | ||
| 64 | R | 45.2 | Very low | 45.7 | Very low | 242 Ų | 242 | 148.1 Ų | 148.1 | 91% | 0.913 | 75% | 0.754 | S | S | * | * | trans | -51 | 110.6 | 169.9 | -69.8 | -158.8 | 176.7 | -167.1 | 1 | 106.4 | R62 S66 | R62-R64 PolarHBondContact O-N 2.99Å; R62-R64 VanDerWaalsContact O-N 3.14Å; R64-S66 PolarHBondContact O-N 2.6Å | ||
| 65 | M | 43.1 | Very low | 47 | Very low | 174 Ų | 174 | 146.2 Ų | 146.2 | 86% | 0.857 | 75% | 0.747 | S | S | * | * | trans | -62.5 | 112.3 | 168.8 | -74.6 | 157.5 | 86 | 0 | 0 | 104.7 | R63 | R63-M65 PolarHBondContact O-N 3.11Š| ||
| 66 | S | 43.8 | Very low | 48.3 | Very low | 90 Ų | 90 | 149 Ų | 149 | 63% | 0.629 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 151.7 | 168.3 | 48.1 | 0 | 0 | 0 | 0 | 109.2 | R64 V68 | R64-S66 PolarHBondContact O-N 2.6Å; S66-V68 PolarHBondContact O-N 2.81Å |
| 67 | P | 49.3 | Very low | 49.9 | Very low | 120 Ų | 120 | 152.7 Ų | 152.7 | 78% | 0.779 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -50.5 | 120.3 | 176.2 | 21.1 | -31.2 | 0 | 0 | 0 | 108.6 | L69 | P67-L69 PolarHBondContact O-N 3.16Š|
| 68 | V | 47 | Very low | 51.3 | Low | 97 Ų | 97 | 153.4 Ų | 153.4 | 59% | 0.588 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 121.2 | -179.4 | 175.8 | 0 | 0 | 0 | 0 | 106.6 | S66 D70 V72 | S66-V68 PolarHBondContact O-N 2.81Å; V68-D70 PolarHBondContact O-N 3.02Å; V68-V72 HydrophobicContact CG1-CG2 3.18Å |
| 69 | L | 47 | Very low | 52.7 | Low | 135 Ų | 135 | 153.5 Ų | 153.5 | 71% | 0.707 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 138.9 | 174 | -86.6 | 92.4 | 0 | 0 | 0 | 108.8 | P67 N71 V72 | P67-L69 PolarHBondContact O-N 3.16Å; L69-N71 PolarHBondContact O-N 2.88Å; L69-V72 PolarHBondContact O-N 3.25Å |
| 70 | D | 55.7 | Low | 54.2 | Low | 165 Ų | 165 | 152.6 Ų | 152.6 | 88% | 0.882 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -60 | 9.2 | 179 | -68.4 | -38.1 | 0 | 0 | 0 | 115 | V68 V72 | V68-D70 PolarHBondContact O-N 3.02Å; D70-V72 VanDerWaalsContact C-N 3.32Å |
| 71 | N | 55.4 | Low | 55.6 | Low | 136 Ų | 136 | 151.4 Ų | 151.4 | 73% | 0.727 | 73% | 0.728 | S | S | * | * | trans | -95.8 | 24.6 | 176 | -64.5 | -0.2 | 0 | 0 | 0 | 112.3 | L69 I73 | L69-N71 PolarHBondContact O-N 2.88Å; N71-I73 VanDerWaalsContact C-N 3.31Å; N71-I73 PolarHBondContact O-N 3.21Å | ||
| 72 | V | 56.8 | Low | 57.2 | Low | 79 Ų | 79 | 147.3 Ų | 147.3 | 48% | 0.479 | 72% | 0.718 | S | S | . | * | trans | -68.4 | 96.7 | 170.1 | -174.9 | 0 | 0 | 0 | 0 | 107.6 | V68 L69 D70 P74 | V68-V72 HydrophobicContact CG1-CG2 3.18Å; L69-V72 PolarHBondContact O-N 3.25Å; D70-V72 VanDerWaalsContact C-N 3.32Å; V72-P74 WeakPolarHBondContact O-CD 3.43Å; V72-P74 VanDerWaalsContact O-N 3.1Å | ||
| 73 | I | 58.3 | Low | 58.7 | Low | 141 Ų | 141 | 138 Ų | 138 | 72% | 0.723 | 69% | 0.692 | S | S | * | * | trans | -51.1 | 119.3 | 163.2 | -59.9 | 169.7 | 0 | 0 | 0 | 105.3 | N71 H75 | N71-I73 VanDerWaalsContact C-N 3.31Å; N71-I73 PolarHBondContact O-N 3.21Å; I73-H75 PolarHBondContact O-N 3.13Å | ||
| 74 | P | 60.8 | Low | 60.4 | Low | 103 Ų | 103 | 131.2 Ų | 131.2 | 67% | 0.669 | 67% | 0.671 | S | S | * | * | trans | -55.3 | 117.2 | -179.5 | 18.3 | -28.5 | 0 | 0 | 0 | 107.3 | V72 K76 | V72-P74 WeakPolarHBondContact O-CD 3.43Å; V72-P74 VanDerWaalsContact O-N 3.1Å; P74-K76 PolarHBondContact O-N 2.98Å | ||
| 75 | H | 61.2 | Low | 61.7 | Low | 138 Ų | 138 | 122.2 Ų | 122.2 | 64% | 0.639 | 65% | 0.648 | S | S | * | * | trans | -58.1 | 107.2 | 173 | -75.1 | -82 | 0 | 0 | 0 | 105.8 | I73 Y77 | I73-H75 PolarHBondContact O-N 3.13Å; H75-Y77 HydrophobicContact CB-CD2 4.29Å; H75-Y77 HydrophobicContact CB-CE2 3.81Å; H75-Y77 WeakPolarHBondContact O-CD2 3.27Å; H75-Y77 PolarHBondContact O-N 2.89Å | ||
| 76 | K | 69 | Low | 63.1 | Low | 164 Ų | 164 | 118.2 Ų | 118.2 | 71% | 0.713 | 63% | 0.63 | S | S | * | * | trans | -67.2 | 91.6 | 171.7 | -66.9 | -175 | -173.4 | -177.1 | 0 | 105.6 | P74 Y78 | P74-K76 PolarHBondContact O-N 2.98Å; K76-Y78 VanDerWaalsContact C-N 3.32Å; K76-Y78 HydrophobicContact CB-CE2 4.11Å; K76-Y78 WeakPolarHBondContact O-CD2 3.4Å; K76-Y78 PolarHBondContact O-N 2.94Å | ||
| 77 | Y | 70 | Confident | 64.6 | Low | 194 Ų | 194 | 119 Ų | 119 | 76% | 0.761 | 62% | 0.624 | S | S | * | * | trans | -67.5 | 99.7 | 167.4 | -64.5 | -81.8 | 0 | 0 | 0 | 105.9 | H75 L79 | H75-Y77 HydrophobicContact CB-CD2 4.29Å; H75-Y77 HydrophobicContact CB-CE2 3.81Å; H75-Y77 WeakPolarHBondContact O-CD2 3.27Å; H75-Y77 PolarHBondContact O-N 2.89Å; Y77-L79 PolarHBondContact O-N 3.18Å | ||
| 78 | Y | 67.3 | Low | 65.7 | Low | 198 Ų | 198 | 119.5 Ų | 119.5 | 78% | 0.776 | 61% | 0.614 | S | S | * | * | trans | -67.9 | 103.6 | 167.5 | -66.2 | -83.8 | 0 | 0 | 0 | 106.4 | K76 C80 | K76-Y78 VanDerWaalsContact C-N 3.32Å; K76-Y78 HydrophobicContact CB-CE2 4.11Å; K76-Y78 WeakPolarHBondContact O-CD2 3.4Å; K76-Y78 PolarHBondContact O-N 2.94Å; Y78-C80 PolarHBondContact O-N 3.42Å | ||
| 79 | L | 67.6 | Low | 66.8 | Low | 124 Ų | 124 | 118.6 Ų | 118.6 | 65% | 0.649 | 62% | 0.616 | S | S | * | * | trans | -62.8 | 118.5 | 163.6 | -79.7 | 137 | 0 | 0 | 0 | 106.3 | Y77 M84 | Y77-L79 PolarHBondContact O-N 3.18Å; L79-M84 HydrophobicContact CB-CG 4.15Å | ||
| 80 | C | 73.8 | Confident | 67.9 | Low | 77 Ų | 77 | 119.2 Ų | 119.2 | 52% | 0.52 | 62% | 0.616 | S | S | . | * | trans | -61.2 | 142.6 | 174.3 | 61 | 0 | 0 | 0 | 0 | 109 | Y78 T82 A83 M84 | Y78-C80 PolarHBondContact O-N 3.42Å; C80-T82 PolarHBondContact O-N 3.16Å; C80-T82 VanDerWaalsContact O-N 3.1Å; C80-A83 WeakPolarHBondContact O-CB 3.42Å; C80-A83 PolarHBondContact O-N 3.04Å; C80-A83 VanDerWaalsContact SG-CB 3.53Å; C80-M84 PolarHBondContact O-N 3.48Å | ||
| 81 | E | 72.6 | Confident | 68.5 | Low | 158 Ų | 158 | 114.9 Ų | 114.9 | 74% | 0.738 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -50.9 | -38.1 | 180 | -174.9 | 178.5 | 173.1 | 0 | 0 | 111.8 | A83 M84 A85 | E81-A83 VanDerWaalsContact C-N 3.35Å; E81-A83 PolarHBondContact O-N 3.27Å; E81-M84 WeakPolarHBondContact O-CB 3.48Å; E81-M84 PolarHBondContact O-N 3.24Å; E81-M84 VanDerWaalsContact O-N 3.14Å; E81-A85 WeakPolarHBondContact O-CB 3.15Å; E81-A85 PolarHBondContact O-N 2.91Å |
| 82 | T | 73.7 | Confident | 68.7 | Low | 94 Ų | 94 | 113.1 Ų | 113.1 | 58% | 0.577 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -60.5 | -39.2 | 175.9 | -42.1 | 0 | 0 | 0 | 0 | 113.2 | C80 M84 A85 N86 | C80-T82 PolarHBondContact O-N 3.16Å; C80-T82 VanDerWaalsContact O-N 3.1Å; T82-M84 VanDerWaalsContact C-N 3.33Å; T82-A85 PolarHBondContact O-N 3.37Å; T82-N86 WeakPolarHBondContact O-CB 3.3Å; T82-N86 PolarHBondContact O-N 2.77Å |
| 83 | A | 74.3 | Confident | 69 | Low | 41 Ų | 41 | 116.1 Ų | 116.1 | 34% | 0.339 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -67.2 | -37.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | C80 E81 H87 | C80-A83 WeakPolarHBondContact O-CB 3.42Å; C80-A83 PolarHBondContact O-N 3.04Å; C80-A83 VanDerWaalsContact SG-CB 3.53Å; E81-A83 VanDerWaalsContact C-N 3.35Å; E81-A83 PolarHBondContact O-N 3.27Å; A83-H87 WeakPolarHBondContact O-CB 3.48Å; A83-H87 PolarHBondContact O-N 2.83Å |
| 84 | M | 76.9 | Confident | 69.1 | Low | 86 Ų | 86 | 113.7 Ų | 113.7 | 42% | 0.424 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -68 | -47.1 | 175 | -64 | -168 | -64.7 | 0 | 0 | 111.4 | L79 C80 E81 T82 N86 H87 F88 | L79-M84 HydrophobicContact CB-CG 4.15Å; C80-M84 PolarHBondContact O-N 3.48Å; E81-M84 WeakPolarHBondContact O-CB 3.48Å; E81-M84 PolarHBondContact O-N 3.24Å; E81-M84 VanDerWaalsContact O-N 3.14Å; T82-M84 VanDerWaalsContact C-N 3.33Å; M84-N86 VanDerWaalsContact C-N 3.33Å; M84-N86 PolarHBondContact O-N 3.44Å; M84-H87 WeakPolarHBondContact O-CB 3.17Å; M84-H87 PolarHBondContact O-N 2.71Å; M84-H87 VanDerWaalsContact O-N 3.13Å; M84-F88 HydrophobicContact CB-CE2 4.4Å; M84-F88 WeakPolarHBondContact O-CD2 3.47Å; M84-F88 PolarHBondContact O-N 2.74Å |
| 85 | A | 72.5 | Confident | 68.8 | Low | 53 Ų | 53 | 116.1 Ų | 116.1 | 44% | 0.438 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -59 | -43.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | E81 T82 F88 A89 | E81-A85 WeakPolarHBondContact O-CB 3.15Å; E81-A85 PolarHBondContact O-N 2.91Å; T82-A85 PolarHBondContact O-N 3.37Å; A85-F88 PolarHBondContact O-N 3.05Å; A85-A89 VanDerWaalsContact O-CB 3.28Å; A85-A89 WeakPolarHBondContact O-CB 3.33Å; A85-A89 PolarHBondContact O-N 3.03Å |
| 86 | N | 72.1 | Confident | 68.5 | Low | 90 Ų | 90 | 114.7 Ų | 114.7 | 48% | 0.481 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -65 | -39.1 | 174.9 | -79.7 | -15 | 0 | 0 | 0 | 112.5 | T82 M84 A89 Q90 | T82-N86 WeakPolarHBondContact O-CB 3.3Å; T82-N86 PolarHBondContact O-N 2.77Å; M84-N86 VanDerWaalsContact C-N 3.33Å; M84-N86 PolarHBondContact O-N 3.44Å; N86-A89 PolarHBondContact O-N 3.43Å; N86-Q90 WeakPolarHBondContact O-CB 3.45Å; N86-Q90 VanDerWaalsContact O-CG 3.23Å; N86-Q90 WeakPolarHBondContact O-CG 3.39Å; N86-Q90 PolarHBondContact O-N 2.82Å |
| 87 | H | 75 | Confident | 68 | Low | 107 Ų | 107 | 112.3 Ų | 112.3 | 50% | 0.495 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -60.4 | -47.5 | 175.1 | -177.3 | 66.1 | 0 | 0 | 0 | 111.1 | A83 M84 Q90 M91 | A83-H87 WeakPolarHBondContact O-CB 3.48Å; A83-H87 PolarHBondContact O-N 2.83Å; M84-H87 WeakPolarHBondContact O-CB 3.17Å; M84-H87 PolarHBondContact O-N 2.71Å; M84-H87 VanDerWaalsContact O-N 3.13Å; H87-Q90 PolarHBondContact O-N 3.44Å; H87-M91 WeakPolarHBondContact O-CG 3.23Å; H87-M91 PolarHBondContact O-N 2.94Å |
| 88 | F | 72.5 | Confident | 67 | Low | 130 Ų | 130 | 108.6 Ų | 108.6 | 57% | 0.57 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -70.6 | -33.7 | 178.4 | -69.2 | -65 | 0 | 0 | 0 | 113.6 | M84 A85 Q90 M91 | M84-F88 HydrophobicContact CB-CE2 4.4Å; M84-F88 WeakPolarHBondContact O-CD2 3.47Å; M84-F88 PolarHBondContact O-N 2.74Å; A85-F88 PolarHBondContact O-N 3.05Å; F88-Q90 VanDerWaalsContact C-N 3.3Å; F88-Q90 PolarHBondContact O-N 3.16Å; F88-M91 WeakPolarHBondContact O-CB 3.46Å; F88-M91 PolarHBondContact O-N 2.83Å; F88-M91 VanDerWaalsContact O-O 3.07Å |
| 89 | A | 70.5 | Confident | 66.4 | Low | 77 Ų | 77 | 103.1 Ų | 103.1 | 64% | 0.636 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -67.7 | -31.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | A85 N86 M91 | A85-A89 VanDerWaalsContact O-CB 3.28Å; A85-A89 WeakPolarHBondContact O-CB 3.33Å; A85-A89 PolarHBondContact O-N 3.03Å; N86-A89 PolarHBondContact O-N 3.43Å; A89-M91 VanDerWaalsContact C-N 3.31Å |
| 90 | Q | 69.6 | Low | 65.7 | Low | 148 Ų | 148 | 101.4 Ų | 101.4 | 69% | 0.692 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -73.9 | -24.4 | 172.5 | -71.7 | 171.3 | 22.8 | 0 | 0 | 112.6 | N86 H87 F88 N92 | N86-Q90 WeakPolarHBondContact O-CB 3.45Å; N86-Q90 VanDerWaalsContact O-CG 3.23Å; N86-Q90 WeakPolarHBondContact O-CG 3.39Å; N86-Q90 PolarHBondContact O-N 2.82Å; H87-Q90 PolarHBondContact O-N 3.44Å; F88-Q90 VanDerWaalsContact C-N 3.3Å; F88-Q90 PolarHBondContact O-N 3.16Å; Q90-N92 PolarHBondContact O-N 3.4Å |
| 91 | M | 69.5 | Low | 64.5 | Low | 75 Ų | 75 | 106.2 Ų | 106.2 | 37% | 0.369 | 59% | 0.594 | S | S | . | * | S | Bend | trans | -72.2 | 100.1 | 169.5 | -61.9 | -68 | -76 | 0 | 0 | 107.1 | H87 F88 A89 L93 L196 | H87-M91 WeakPolarHBondContact O-CG 3.23Å; H87-M91 PolarHBondContact O-N 2.94Å; F88-M91 WeakPolarHBondContact O-CB 3.46Å; F88-M91 PolarHBondContact O-N 2.83Å; F88-M91 VanDerWaalsContact O-O 3.07Å; A89-M91 VanDerWaalsContact C-N 3.31Å; M91-L93 HydrophobicContact CB-CD2 4.4Å; M91-L93 PolarHBondContact O-N 3.44Å; M91-L196 HydrophobicContact CE-CD2 4.14Å |
| 92 | N | 59.5 | Low | 63.5 | Low | 98 Ų | 98 | 104.7 Ų | 104.7 | 52% | 0.524 | 59% | 0.59 | S | S | . | * | trans | -62.7 | 87.8 | 169.3 | -77.2 | -53.6 | 0 | 0 | 0 | 108.9 | Q90 T94 V199 | Q90-N92 PolarHBondContact O-N 3.4Å; N92-T94 PolarHBondContact O-N 2.95Å; N92-V199 HydrophobicContact CB-CG2 4.32Å | ||
| 93 | L | 62.2 | Low | 62 | Low | 142 Ų | 142 | 109 Ų | 109 | 74% | 0.743 | 60% | 0.603 | S | S | * | * | trans | -73.6 | 71.5 | 172.7 | -61.8 | 177 | 0 | 0 | 0 | 108.1 | M91 L95 | M91-L93 HydrophobicContact CB-CD2 4.4Å; M91-L93 PolarHBondContact O-N 3.44Å; L93-L95 PolarHBondContact O-N 3.27Å | ||
| 94 | T | 61.3 | Low | 60.6 | Low | 91 Ų | 91 | 111 Ų | 111 | 56% | 0.558 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 128.6 | 167.4 | 51.4 | 0 | 0 | 0 | 0 | 107.9 | N92 | N92-T94 PolarHBondContact O-N 2.95Š|
| 95 | L | 54.8 | Low | 58.9 | Low | 153 Ų | 153 | 114 Ų | 114 | 80% | 0.801 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 140.9 | 171.2 | -68.8 | 167.3 | 0 | 0 | 0 | 108 | L93 V97 | L93-L95 PolarHBondContact O-N 3.27Å; L95-V97 PolarHBondContact O-N 3.04Å |
| 96 | P | 54.2 | Low | 57.4 | Low | 109 Ų | 109 | 117.4 Ų | 117.4 | 71% | 0.708 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 120.4 | 178.6 | 20.4 | -31.1 | 0 | 0 | 0 | 108.4 | D98 | P96-D98 PolarHBondContact O-N 3.16Å; P96-D98 VanDerWaalsContact O-N 3.14Å |
| 97 | V | 59.1 | Low | 55.9 | Low | 113 Ų | 113 | 120.8 Ų | 120.8 | 69% | 0.685 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 124.1 | 178.5 | 172 | 0 | 0 | 0 | 0 | 107.2 | L95 A99 | L95-V97 PolarHBondContact O-N 3.04Å; V97-A99 PolarHBondContact O-N 3.46Å |
| 98 | D | 47.2 | Very low | 54.1 | Low | 116 Ų | 116 | 120.3 Ų | 120.3 | 62% | 0.62 | 68% | 0.679 | S | S | * | * | trans | -48.8 | 109.3 | 176.3 | -106.7 | -34.2 | 0 | 0 | 0 | 109.3 | P96 S100 K101 | P96-D98 PolarHBondContact O-N 3.16Å; P96-D98 VanDerWaalsContact O-N 3.14Å; D98-S100 PolarHBondContact O-N 3.47Å; D98-K101 PolarHBondContact O-N 2.73Å | ||
| 99 | A | 56.2 | Low | 52.6 | Low | 83 Ų | 83 | 118.7 Ų | 118.7 | 69% | 0.686 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -58.1 | -14.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | V97 K101 | V97-A99 PolarHBondContact O-N 3.46Å; A99-K101 VanDerWaalsContact C-N 3.32Å; A99-K101 PolarHBondContact O-N 3.2Å |
| 100 | S | 51.9 | Low | 51.4 | Low | 88 Ų | 88 | 121.4 Ų | 121.4 | 62% | 0.615 | 69% | 0.693 | S | S | * | * | G | 310 helix | trans | -70.8 | -19.4 | 174.9 | 64.1 | 0 | 0 | 0 | 0 | 114.4 | D98 | D98-S100 PolarHBondContact O-N 3.47Š|
| 101 | K | 49 | Very low | 49.9 | Very low | 179 Ų | 179 | 123.1 Ų | 123.1 | 78% | 0.778 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -90.6 | -8.4 | 178.5 | -82 | -172.2 | 179.5 | -175 | 0 | 114.7 | D98 A99 Q103 | D98-K101 PolarHBondContact O-N 2.73Å; A99-K101 VanDerWaalsContact C-N 3.32Å; A99-K101 PolarHBondContact O-N 3.2Å; K101-Q103 PolarHBondContact O-N 3.37Å |
| 102 | I | 51.2 | Low | 48.4 | Very low | 126 Ų | 126 | 124.1 Ų | 124.1 | 65% | 0.646 | 71% | 0.712 | S | S | * | * | trans | -83.6 | 62.8 | 173.2 | -43.6 | 174.5 | 0 | 0 | 0 | 108.4 | ||||
| 103 | Q | 42 | Very low | 47.5 | Very low | 183 Ų | 183 | 127.5 Ų | 127.5 | 86% | 0.855 | 73% | 0.73 | S | S | * | * | trans | -90.7 | 92.4 | 156.7 | -75.3 | -171 | 7 | 0 | 0 | 106.4 | K101 | K101-Q103 PolarHBondContact O-N 3.37Š| ||
| 104 | S | 45.8 | Very low | 46.3 | Very low | 84 Ų | 84 | 126.2 Ų | 126.2 | 59% | 0.587 | 73% | 0.733 | S | S | * | * | trans | -149.9 | 94 | 163.7 | 69.6 | 0 | 0 | 0 | 0 | 110.4 | C106 | S104-C106 PolarHBondContact O-N 3.15Š| ||
| 105 | D | 41.5 | Very low | 45.1 | Very low | 149 Ų | 149 | 127.2 Ų | 127.2 | 80% | 0.797 | 74% | 0.744 | S | S | * | * | trans | 39.1 | 79.2 | 135.8 | -55.2 | -29.8 | 0 | 0 | 0 | 116 | N107 | D105-N107 PolarHBondContact O-N 3.28Š| ||
| 106 | C | 40.6 | Very low | 44.5 | Very low | 125 Ų | 125 | 124.4 Ų | 124.4 | 85% | 0.845 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -64.7 | 70 | 165.1 | -60.6 | 0 | 0 | 0 | 0 | 111.1 | S104 | S104-C106 PolarHBondContact O-N 3.15Š|
| 107 | N | 41.1 | Very low | 44 | Very low | 160 Ų | 160 | 127.3 Ų | 127.3 | 86% | 0.856 | 74% | 0.738 | S | S | * | * | trans | -143.2 | 32.5 | 172.2 | -83.3 | -37.3 | 0 | 0 | 0 | 113.6 | D105 | D105-N107 PolarHBondContact O-N 3.28Š| ||
| 108 | S | 36 | Very low | 43.1 | Very low | 98 Ų | 98 | 127.2 Ų | 127.2 | 69% | 0.685 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -148.2 | 121.6 | 160.5 | 47.5 | 0 | 0 | 0 | 0 | 110.3 | ||
| 109 | P | 41.4 | Very low | 42.9 | Very low | 96 Ų | 96 | 126.7 Ų | 126.7 | 62% | 0.623 | 74% | 0.736 | S | S | * | * | trans | -65.5 | 134.8 | 176.3 | 26.6 | -30.9 | 0 | 0 | 0 | 109.1 | F111 | P109-F111 HydrophobicContact CG-CD2 4.24Å; P109-F111 HydrophobicContact CG-CE2 4.02Å; P109-F111 PolarHBondContact O-N 3.3Å | ||
| 110 | P | 44.6 | Very low | 42.6 | Very low | 134 Ų | 134 | 127 Ų | 127 | 87% | 0.87 | 73% | 0.726 | S | S | * | * | trans | -66.3 | 103.6 | 174.7 | 27.2 | -32 | 0 | 0 | 0 | 108.2 | ||||
| 111 | F | 38.8 | Very low | 42.9 | Very low | 184 Ų | 184 | 127.7 Ų | 127.7 | 81% | 0.807 | 73% | 0.731 | S | S | * | * | trans | -79.2 | 139.7 | 168.7 | -93.7 | -84 | 0 | 0 | 0 | 110.2 | P109 | P109-F111 HydrophobicContact CG-CD2 4.24Å; P109-F111 HydrophobicContact CG-CE2 4.02Å; P109-F111 PolarHBondContact O-N 3.3Å | ||
| 112 | S | 37.7 | Very low | 43.1 | Very low | 95 Ų | 95 | 122.8 Ų | 122.8 | 66% | 0.664 | 72% | 0.72 | S | S | * | * | trans | 87.6 | 79.2 | 157.2 | -54.1 | 0 | 0 | 0 | 0 | 117.6 | S114 | S112-S114 PolarHBondContact O-N 3.43Š| ||
| 113 | D | 41.3 | Very low | 43.2 | Very low | 170 Ų | 170 | 121.3 Ų | 121.3 | 91% | 0.909 | 71% | 0.71 | S | S | * | * | 27.7 | 69.3 | 111.9 | -58.3 | -29.4 | 0 | 0 | 0 | 116.1 | |||||
| 114 | S | 37.7 | Very low | 43.7 | Very low | 115 Ų | 115 | 117.1 Ų | 117.1 | 80% | 0.804 | 69% | 0.692 | S | S | * | * | trans | -94 | 99.1 | 152.1 | -175.6 | 0 | 0 | 0 | 0 | 107.7 | S112 C116 | S112-S114 PolarHBondContact O-N 3.43Å; S114-C116 PolarHBondContact O-N 3.39Å | ||
| 115 | S | 35.7 | Very low | 44 | Very low | 111 Ų | 111 | 115.8 Ų | 115.8 | 78% | 0.776 | 69% | 0.686 | S | S | * | * | trans | -67.6 | 86.3 | -178.5 | 60.6 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 116 | C | 42.6 | Very low | 44.4 | Very low | 94 Ų | 94 | 112.3 Ų | 112.3 | 64% | 0.635 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -96.8 | -25.9 | 162.1 | -157.5 | 0 | 0 | 0 | 0 | 112.1 | S114 | S114-C116 PolarHBondContact O-N 3.39Š|
| 117 | F | 42 | Very low | 44.8 | Very low | 170 Ų | 170 | 108.5 Ų | 108.5 | 75% | 0.746 | 65% | 0.651 | S | S | * | * | trans | -143.8 | 101.9 | 175.4 | -66.3 | -79 | 0 | 0 | 0 | 110.5 | L119 | F117-L119 PolarHBondContact O-N 3.06Š| ||
| 118 | P | 41.3 | Very low | 45.2 | Very low | 112 Ų | 112 | 106.9 Ų | 106.9 | 73% | 0.727 | 64% | 0.638 | S | S | * | * | trans | -79.2 | 64.4 | 174.5 | 35.6 | -32.9 | 0 | 0 | 0 | 108.5 | N120 Q123 | P118-N120 PolarHBondContact O-N 2.86Å; P118-Q123 PolarHBondContact O-OE1 3.42Å | ||
| 119 | L | 43.2 | Very low | 45.8 | Very low | 105 Ų | 105 | 107.5 Ų | 107.5 | 55% | 0.55 | 63% | 0.63 | S | S | . | * | trans | -84.9 | 94.9 | 164.5 | -61.4 | -179.7 | 0 | 0 | 0 | 106.4 | F117 Q123 I124 | F117-L119 PolarHBondContact O-N 3.06Å; L119-Q123 HydrophobicContact CB-CB 4.48Å; L119-Q123 HydrophobicContact CD2-CB 4.21Å; L119-I124 HydrophobicContact CB-CG1 4.46Å | ||
| 120 | N | 49.9 | Very low | 46.2 | Very low | 88 Ų | 88 | 109.3 Ų | 109.3 | 47% | 0.471 | 63% | 0.634 | S | S | . | * | trans | -60.5 | 151.7 | 167.8 | 58.8 | 19.5 | 0 | 0 | 0 | 109.2 | P118 S122 Q123 | P118-N120 PolarHBondContact O-N 2.86Å; N120-S122 PolarHBondContact O-N 3.28Å; N120-S122 PolarHBondContact OD1-OG 3.05Å; N120-Q123 PolarHBondContact O-N 2.96Å; N120-Q123 WeakPolarHBondContact OD1-CG 3.43Å; N120-Q123 PolarHBondContact OD1-N 3.18Å | ||
| 121 | S | 58.3 | Low | 46.4 | Very low | 103 Ų | 103 | 111.4 Ų | 111.4 | 72% | 0.72 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -52.1 | -23.2 | -175.6 | 31.7 | 0 | 0 | 0 | 0 | 114.4 | A125 | S121-A125 PolarHBondContact O-N 2.68Å |
| 122 | S | 53.5 | Low | 47 | Very low | 77 Ų | 77 | 109.1 Ų | 109.1 | 54% | 0.538 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -67 | -31.9 | 171.1 | 39.8 | 0 | 0 | 0 | 0 | 114.9 | N120 S126 | N120-S122 PolarHBondContact O-N 3.28Å; N120-S122 PolarHBondContact OD1-OG 3.05Å; S122-S126 PolarHBondContact O-N 3.38Å |
| 123 | Q | 52.2 | Low | 47.2 | Very low | 94 Ų | 94 | 110.6 Ų | 110.6 | 44% | 0.439 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -76.3 | -33.8 | 177.9 | -74.8 | 174.7 | -3.6 | 0 | 0 | 112.1 | P118 L119 N120 S126 A127 | P118-Q123 PolarHBondContact O-OE1 3.42Å; L119-Q123 HydrophobicContact CB-CB 4.48Å; L119-Q123 HydrophobicContact CD2-CB 4.21Å; N120-Q123 PolarHBondContact O-N 2.96Å; N120-Q123 WeakPolarHBondContact OD1-CG 3.43Å; N120-Q123 PolarHBondContact OD1-N 3.18Å; Q123-S126 PolarHBondContact O-N 3.04Å; Q123-A127 PolarHBondContact O-N 3.22Å |
| 124 | I | 52.8 | Low | 47.2 | Very low | 95 Ų | 95 | 109.1 Ų | 109.1 | 49% | 0.487 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -65.6 | -41 | 172.9 | -59.4 | 168 | 0 | 0 | 0 | 110.4 | L119 S126 A127 H128 | L119-I124 HydrophobicContact CB-CG1 4.46Å; I124-S126 VanDerWaalsContact C-N 3.3Å; I124-S126 PolarHBondContact O-N 2.9Å; I124-A127 PolarHBondContact O-N 3.48Å; I124-H128 PolarHBondContact O-N 3.02Å; I124-H128 VanDerWaalsContact O-N 3.16Å |
| 125 | A | 52 | Low | 47.2 | Very low | 56 Ų | 56 | 107.9 Ų | 107.9 | 46% | 0.463 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -62.5 | -36.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | S121 H128 H129 | S121-A125 PolarHBondContact O-N 2.68Å; A125-H128 PolarHBondContact O-N 3.16Å; A125-H129 PolarHBondContact O-CD2 3.38Å |
| 126 | S | 50.5 | Low | 47.5 | Very low | 77 Ų | 77 | 110 Ų | 110 | 54% | 0.538 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -67.6 | -37.3 | 175 | -160.7 | 0 | 0 | 0 | 0 | 112.6 | S122 Q123 I124 H128 H129 | S122-S126 PolarHBondContact O-N 3.38Å; Q123-S126 PolarHBondContact O-N 3.04Å; I124-S126 VanDerWaalsContact C-N 3.3Å; I124-S126 PolarHBondContact O-N 2.9Å; S126-H128 VanDerWaalsContact C-N 3.32Å; S126-H128 PolarHBondContact O-N 3.24Å; S126-H129 WeakPolarHBondContact O-CB 3.39Å; S126-H129 PolarHBondContact O-N 2.97Å; S126-H129 VanDerWaalsContact O-N 3.15Å |
| 127 | A | 48.7 | Very low | 47.1 | Very low | 44 Ų | 44 | 116.4 Ų | 116.4 | 36% | 0.364 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -65 | -33.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q123 I124 H129 L130 Y131 | Q123-A127 PolarHBondContact O-N 3.22Å; I124-A127 PolarHBondContact O-N 3.48Å; A127-H129 PolarHBondContact O-N 3.16Å; A127-L130 WeakPolarHBondContact O-CB 3.35Å; A127-L130 PolarHBondContact O-N 2.89Å; A127-Y131 WeakPolarHBondContact O-CD2 3.03Å |
| 128 | H | 48.6 | Very low | 46.9 | Very low | 126 Ų | 126 | 113.2 Ų | 113.2 | 58% | 0.583 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -61.9 | -26.7 | 173.5 | -99.4 | -82.4 | 0 | 0 | 0 | 113.6 | I124 A125 S126 L130 Q132 | I124-H128 PolarHBondContact O-N 3.02Å; I124-H128 VanDerWaalsContact O-N 3.16Å; A125-H128 PolarHBondContact O-N 3.16Å; S126-H128 VanDerWaalsContact C-N 3.32Å; S126-H128 PolarHBondContact O-N 3.24Å; H128-L130 VanDerWaalsContact C-N 3.35Å; H128-Q132 PolarHBondContact O-N 2.85Å |
| 129 | H | 49.2 | Very low | 46.6 | Very low | 112 Ų | 112 | 114.4 Ų | 114.4 | 52% | 0.519 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -72.1 | -25.8 | 173.2 | -75 | -67.6 | 0 | 0 | 0 | 113.4 | A125 S126 A127 Y131 N133 | A125-H129 PolarHBondContact O-CD2 3.38Å; S126-H129 WeakPolarHBondContact O-CB 3.39Å; S126-H129 PolarHBondContact O-N 2.97Å; S126-H129 VanDerWaalsContact O-N 3.15Å; A127-H129 PolarHBondContact O-N 3.16Å; H129-Y131 VanDerWaalsContact C-N 3.34Å; H129-N133 PolarHBondContact O-N 2.98Å; H129-N133 PolarHBondContact O-ND2 3.46Å |
| 130 | L | 50.5 | Low | 46.6 | Very low | 133 Ų | 133 | 118.3 Ų | 118.3 | 70% | 0.696 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -69.3 | -34.9 | 176.1 | -67.2 | 174.2 | 0 | 0 | 0 | 111.5 | A127 H128 | A127-L130 WeakPolarHBondContact O-CB 3.35Å; A127-L130 PolarHBondContact O-N 2.89Å; H128-L130 VanDerWaalsContact C-N 3.35Å |
| 131 | Y | 48.9 | Very low | 46.3 | Very low | 178 Ų | 178 | 123.2 Ų | 123.2 | 70% | 0.698 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -78.4 | -29.6 | 177.6 | -68.5 | -77.3 | 0 | 0 | 0 | 113.6 | A127 H129 N133 L134 | A127-Y131 WeakPolarHBondContact O-CD2 3.03Å; H129-Y131 VanDerWaalsContact C-N 3.34Å; Y131-N133 VanDerWaalsContact C-N 3.28Å; Y131-N133 PolarHBondContact O-N 3.42Å; Y131-L134 PolarHBondContact O-N 3.48Å |
| 132 | Q | 50.9 | Low | 45.8 | Very low | 136 Ų | 136 | 123 Ų | 123 | 64% | 0.636 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -69.1 | -24.4 | 175 | -82.9 | -174.2 | -4 | 0 | 0 | 113.5 | H128 L134 | H128-Q132 PolarHBondContact O-N 2.85Å; Q132-L134 VanDerWaalsContact C-N 3.29Å; Q132-L134 PolarHBondContact O-N 3.44Å |
| 133 | N | 41.7 | Very low | 44.9 | Very low | 126 Ų | 126 | 122.3 Ų | 122.3 | 67% | 0.674 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83 | -0.2 | -179.7 | -72.6 | -45.2 | 0 | 0 | 0 | 114.3 | H129 Y131 S135 | H129-N133 PolarHBondContact O-N 2.98Å; H129-N133 PolarHBondContact O-ND2 3.46Å; Y131-N133 VanDerWaalsContact C-N 3.28Å; Y131-N133 PolarHBondContact O-N 3.42Å; N133-S135 PolarHBondContact O-N 3.02Å |
| 134 | L | 41.9 | Very low | 44.2 | Very low | 140 Ų | 140 | 123.7 Ų | 123.7 | 73% | 0.733 | 67% | 0.666 | S | S | * | * | trans | -75.8 | 52.6 | 158.4 | -63.6 | 175 | 0 | 0 | 0 | 109.5 | Y131 Q132 L136 | Y131-L134 PolarHBondContact O-N 3.48Å; Q132-L134 VanDerWaalsContact C-N 3.29Å; Q132-L134 PolarHBondContact O-N 3.44Å; L134-L136 VanDerWaalsContact C-N 3.28Å; L134-L136 PolarHBondContact O-N 2.79Å | ||
| 135 | S | 37.4 | Very low | 43.6 | Very low | 88 Ų | 88 | 126.1 Ų | 126.1 | 62% | 0.615 | 68% | 0.679 | S | S | * | * | trans | -65.4 | 98.5 | 162.1 | -69.3 | 0 | 0 | 0 | 0 | 106 | N133 Y137 | N133-S135 PolarHBondContact O-N 3.02Å; S135-Y137 PolarHBondContact O-N 3.16Å | ||
| 136 | L | 41.2 | Very low | 42.7 | Very low | 155 Ų | 155 | 128 Ų | 128 | 81% | 0.812 | 68% | 0.684 | S | S | * | * | trans | -46.5 | 110 | 163.7 | -69.6 | 166.2 | 0 | 0 | 0 | 106.1 | L134 T138 | L134-L136 VanDerWaalsContact C-N 3.28Å; L134-L136 PolarHBondContact O-N 2.79Å; L136-T138 PolarHBondContact O-N 3.44Å | ||
| 137 | Y | 34.6 | Very low | 42.5 | Very low | 229 Ų | 229 | 130 Ų | 130 | 90% | 0.898 | 69% | 0.688 | S | S | * | * | trans | -63.3 | 82.2 | 172.8 | -112 | -96.2 | 0 | 0 | 0 | 106.9 | S135 N139 | S135-Y137 PolarHBondContact O-N 3.16Å; Y137-N139 VanDerWaalsContact C-N 3.3Å; Y137-N139 PolarHBondContact O-N 3.37Å | ||
| 138 | T | 38.7 | Very low | 41.8 | Very low | 104 Ų | 104 | 133.3 Ų | 133.3 | 64% | 0.638 | 70% | 0.7 | S | S | * | * | trans | -75.4 | 94.3 | 165.9 | 58.8 | 0 | 0 | 0 | 0 | 104.8 | L136 K140 | L136-T138 PolarHBondContact O-N 3.44Å; T138-K140 WeakPolarHBondContact O-CG 3.09Å; T138-K140 PolarHBondContact O-N 2.83Å | ||
| 139 | N | 34.9 | Very low | 41.9 | Very low | 136 Ų | 136 | 134 Ų | 134 | 73% | 0.727 | 71% | 0.708 | S | S | * | * | trans | -59.7 | 110.6 | 173.8 | -141.5 | -20 | 0 | 0 | 0 | 106.8 | Y137 E141 | Y137-N139 VanDerWaalsContact C-N 3.3Å; Y137-N139 PolarHBondContact O-N 3.37Å; N139-E141 PolarHBondContact O-N 2.95Å | ||
| 140 | K | 42.3 | Very low | 41.8 | Very low | 188 Ų | 188 | 135.1 Ų | 135.1 | 82% | 0.817 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.6 | 67.3 | -171.1 | -63.8 | -169.2 | 179.5 | -175.9 | 0 | 109.8 | T138 | T138-K140 WeakPolarHBondContact O-CG 3.09Å; T138-K140 PolarHBondContact O-N 2.83Å |
| 141 | E | 43.4 | Very low | 41.5 | Very low | 191 Ų | 191 | 136.3 Ų | 136.3 | 89% | 0.893 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -163.8 | -16.5 | 162.8 | -146.5 | 105.8 | -149.5 | 0 | 0 | 114 | N139 | N139-E141 PolarHBondContact O-N 2.95Š|
| 142 | A | 48.4 | Very low | 41.3 | Very low | 98 Ų | 98 | 135.4 Ų | 135.4 | 81% | 0.81 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -155.5 | 95 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||
| 143 | G | 33.3 | Very low | 41.1 | Very low | 63 Ų | 63 | 136 Ų | 136 | 65% | 0.649 | 73% | 0.733 | S | S | * | * | trans | -166.2 | 26.3 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | I145 | G143-I145 VanDerWaalsContact C-N 3.26Å; G143-I145 PolarHBondContact O-N 3.4Å; G143-I145 VanDerWaalsContact O-N 3.16Å | ||
| 144 | V | 38.7 | Very low | 41.1 | Very low | 122 Ų | 122 | 136.5 Ų | 136.5 | 74% | 0.739 | 74% | 0.735 | S | S | * | * | trans | -68.3 | 103.3 | 145.7 | -177.4 | 0 | 0 | 0 | 0 | 103.2 | T146 | V144-T146 HydrophobicContact CG1-CG2 3.76Å; V144-T146 PolarHBondContact O-N 3.13Å; V144-T146 PolarHBondContact O-OG1 2.72Å | ||
| 145 | I | 40.5 | Very low | 41.6 | Very low | 147 Ų | 147 | 138.3 Ų | 138.3 | 75% | 0.754 | 74% | 0.74 | S | S | * | * | trans | -72.6 | 72.7 | 165.6 | -49.5 | 175.9 | 0 | 0 | 0 | 105.2 | G143 I147 | G143-I145 VanDerWaalsContact C-N 3.26Å; G143-I145 PolarHBondContact O-N 3.4Å; G143-I145 VanDerWaalsContact O-N 3.16Å; I145-I147 HydrophobicContact CG2-CD1 4.49Å; I145-I147 HydrophobicContact CG2-CG1 3.65Å; I145-I147 PolarHBondContact O-N 2.95Å | ||
| 146 | T | 32.7 | Very low | 41.7 | Very low | 94 Ų | 94 | 140.8 Ų | 140.8 | 58% | 0.577 | 75% | 0.746 | S | S | * | * | trans | -64.6 | 92.8 | 153.1 | 32 | 0 | 0 | 0 | 0 | 104.2 | V144 N148 | V144-T146 HydrophobicContact CG1-CG2 3.76Å; V144-T146 PolarHBondContact O-N 3.13Å; V144-T146 PolarHBondContact O-OG1 2.72Å; T146-N148 PolarHBondContact O-N 3.01Å | ||
| 147 | I | 46.5 | Very low | 42.1 | Very low | 119 Ų | 119 | 142.2 Ų | 142.2 | 61% | 0.61 | 75% | 0.749 | S | S | * | * | trans | -69.7 | 90.7 | 155 | -34.6 | 170.8 | 0 | 0 | 0 | 102 | I145 D149 | I145-I147 HydrophobicContact CG2-CD1 4.49Å; I145-I147 HydrophobicContact CG2-CG1 3.65Å; I145-I147 PolarHBondContact O-N 2.95Å; I147-D149 PolarHBondContact O-N 3.15Å | ||
| 148 | N | 34.5 | Very low | 42.7 | Very low | 115 Ų | 115 | 140.1 Ų | 140.1 | 62% | 0.615 | 75% | 0.747 | S | S | * | * | trans | -57.4 | 113.9 | 167.5 | -74 | -17.8 | 0 | 0 | 0 | 104.9 | T146 D150 | T146-N148 PolarHBondContact O-N 3.01Å; N148-D150 PolarHBondContact O-N 2.95Å | ||
| 149 | D | 50 | Low | 43 | Very low | 140 Ų | 140 | 141 Ų | 141 | 75% | 0.749 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -73 | 9.1 | 172 | -76.6 | -37.3 | 0 | 0 | 0 | 111.5 | I147 | I147-D149 PolarHBondContact O-N 3.15Š|
| 150 | D | 47.7 | Very low | 43.7 | Very low | 136 Ų | 136 | 143.7 Ų | 143.7 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | trans | -126.2 | 79.6 | 178.9 | -64.5 | -39.5 | 0 | 0 | 0 | 109.1 | N148 | N148-D150 PolarHBondContact O-N 2.95Š| ||
| 151 | E | 43.8 | Very low | 44 | Very low | 157 Ų | 157 | 145.6 Ų | 145.6 | 73% | 0.734 | 76% | 0.763 | S | S | * | * | trans | -152 | 107.2 | 143.5 | -74.6 | -51.9 | 157.7 | 0 | 0 | 105.6 | I153 | E151-I153 PolarHBondContact O-N 3.09Š| ||
| 152 | D | 44.7 | Very low | 44.6 | Very low | 159 Ų | 159 | 141 Ų | 141 | 85% | 0.85 | 75% | 0.752 | S | S | * | * | trans | -57.2 | 90.9 | 159.7 | -70.4 | -49.6 | 0 | 0 | 0 | 106.7 | D154 | D152-D154 PolarHBondContact O-N 2.97Š| ||
| 153 | I | 45.9 | Very low | 45.3 | Very low | 150 Ų | 150 | 141.9 Ų | 141.9 | 77% | 0.769 | 75% | 0.749 | S | S | * | * | trans | -65.8 | 106 | 175.1 | -63.7 | 172.9 | 0 | 0 | 0 | 106.1 | E151 E155 | E151-I153 PolarHBondContact O-N 3.09Å; I153-E155 PolarHBondContact O-N 2.84Å; I153-E155 VanDerWaalsContact O-N 3.16Å | ||
| 154 | D | 42.6 | Very low | 46.8 | Very low | 136 Ų | 136 | 145.2 Ų | 145.2 | 73% | 0.727 | 75% | 0.751 | S | S | * | * | trans | -46.5 | 118.1 | 172.7 | -68.9 | -48.9 | 0 | 0 | 0 | 109.2 | D152 D156 | D152-D154 PolarHBondContact O-N 2.97Å; D154-D156 PolarHBondContact O-N 2.93Å | ||
| 155 | E | 51.4 | Low | 48.3 | Very low | 177 Ų | 177 | 149.6 Ų | 149.6 | 83% | 0.827 | 76% | 0.755 | S | S | * | * | trans | -70.5 | 67.5 | 177.7 | -77 | -108.1 | 175.2 | 0 | 0 | 110 | I153 | I153-E155 PolarHBondContact O-N 2.84Å; I153-E155 VanDerWaalsContact O-N 3.16Å | ||
| 156 | D | 39 | Very low | 50.1 | Low | 140 Ų | 140 | 148.2 Ų | 148.2 | 75% | 0.749 | 74% | 0.743 | S | S | * | * | trans | -127.6 | 119.3 | 169.1 | -74.3 | -42.3 | 0 | 0 | 0 | 109.9 | D154 | D154-D156 PolarHBondContact O-N 2.93Š| ||
| 157 | E | 49.9 | Very low | 52.3 | Low | 185 Ų | 185 | 147 Ų | 147 | 86% | 0.864 | 74% | 0.739 | S | S | * | * | trans | 68.5 | 72.3 | 162.9 | -57.8 | -171.9 | 149.6 | 0 | 0 | 118.6 | ||||
| 158 | Q | 47.3 | Very low | 53.9 | Low | 186 Ų | 186 | 147.1 Ų | 147.1 | 87% | 0.869 | 74% | 0.741 | S | S | * | * | trans | -145 | 97.6 | 137.4 | -75.5 | -154.6 | -15.6 | 0 | 0 | 112.7 | ||||
| 159 | T | 44.4 | Very low | 56 | Low | 122 Ų | 122 | 147.1 Ų | 147.1 | 75% | 0.748 | 74% | 0.741 | S | S | * | * | trans | 38.4 | 101.9 | 132.4 | 34.2 | 0 | 0 | 0 | 0 | 118 | ||||
| 160 | E | 51 | Low | 57.4 | Low | 192 Ų | 192 | 143.8 Ų | 143.8 | 90% | 0.897 | 72% | 0.722 | S | S | * | * | S | Bend | trans | 23.9 | 110.2 | 137.5 | -56.7 | -164.7 | 179.9 | 0 | 0 | 117.7 | ||
| 161 | R | 47.2 | Very low | 58.9 | Low | 229 Ų | 229 | 141.9 Ų | 141.9 | 86% | 0.864 | 71% | 0.708 | S | S | * | * | trans | 83.8 | 62.2 | 154.9 | -147.4 | 177.7 | -167.8 | 170 | 4.8 | 116.1 | P163 | R161-P163 WeakPolarHBondContact O-CD 3.28Š| ||
| 162 | S | 56.5 | Low | 60.5 | Low | 94 Ų | 94 | 138.3 Ų | 138.3 | 66% | 0.657 | 69% | 0.693 | S | S | * | * | trans | -63.9 | 110.5 | 147.9 | -75.5 | 0 | 0 | 0 | 0 | 108.6 | L164 | S162-L164 PolarHBondContact O-N 2.98Å; S162-L164 VanDerWaalsContact O-N 3.14Å | ||
| 163 | P | 62.8 | Low | 61.8 | Low | 116 Ų | 116 | 137 Ų | 137 | 75% | 0.753 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -72.3 | -9.8 | -164.6 | -18.7 | 32.8 | 0 | 0 | 0 | 115.3 | R161 | R161-P163 WeakPolarHBondContact O-CD 3.28Š|
| 164 | L | 65.5 | Low | 62.9 | Low | 133 Ų | 133 | 135.2 Ų | 135.2 | 70% | 0.696 | 67% | 0.674 | S | S | * | * | trans | -128.6 | 84.5 | 175.3 | -78.6 | 100.1 | 0 | 0 | 0 | 108.9 | S162 F166 | S162-L164 PolarHBondContact O-N 2.98Å; S162-L164 VanDerWaalsContact O-N 3.14Å; L164-F166 HydrophobicContact CD2-CE1 4.44Å; L164-F166 PolarHBondContact O-N 2.89Å | ||
| 165 | R | 71.4 | Confident | 64.4 | Low | 215 Ų | 215 | 135.9 Ų | 135.9 | 81% | 0.811 | 67% | 0.666 | S | S | * | * | trans | -78.9 | 106.2 | 160.8 | -79.2 | -166.7 | 139.2 | -172.9 | -4.7 | 107.5 | ||||
| 166 | F | 76.7 | Confident | 64.7 | Low | 117 Ų | 117 | 133.8 Ų | 133.8 | 51% | 0.513 | 66% | 0.66 | S | S | . | * | trans | -62.4 | 145.3 | 165.5 | -62.5 | -59.5 | 0 | 0 | 0 | 109 | L164 L170 | L164-F166 HydrophobicContact CD2-CE1 4.44Å; L164-F166 PolarHBondContact O-N 2.89Å; F166-L170 HydrophobicContact CB-CB 4.29Å; F166-L170 HydrophobicContact CB-CD2 4Å; F166-L170 HydrophobicContact CB-CG 4.17Å; F166-L170 HydrophobicContact CD1-CD2 3.31Å; F166-L170 HydrophobicContact CD1-CG 4.14Å; F166-L170 HydrophobicContact CE1-CD2 4.06Å; F166-L170 HydrophobicContact CG-CD2 3.96Å; F166-L170 HydrophobicContact CG-CG 4.36Å | ||
| 167 | S | 80.5 | Confident | 65.7 | Low | 69 Ų | 69 | 135.5 Ų | 135.5 | 48% | 0.483 | 66% | 0.66 | S | S | . | * | trans | -56.9 | 149.4 | 168.5 | 58.2 | 0 | 0 | 0 | 0 | 109.4 | D169 L170 K171 | S167-D169 PolarHBondContact O-N 2.94Å; S167-L170 PolarHBondContact O-N 2.68Å; S167-L170 WeakPolarHBondContact OG-CB 3.44Å; S167-L170 PolarHBondContact OG-N 2.83Å; S167-L170 VanDerWaalsContact OG-N 3.13Å; S167-K171 PolarHBondContact O-N 3.4Å | ||
| 168 | N | 79.4 | Confident | 66.1 | Low | 121 Ų | 121 | 136.4 Ų | 136.4 | 65% | 0.647 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -54.8 | -39 | 175 | -71.1 | -24.3 | 0 | 0 | 0 | 110.6 | L170 K171 D172 | N168-L170 PolarHBondContact O-N 3.5Å; N168-K171 WeakPolarHBondContact O-CB 3.4Å; N168-K171 PolarHBondContact O-N 2.88Å; N168-D172 WeakPolarHBondContact O-CB 3.46Å; N168-D172 PolarHBondContact O-N 3.1Å |
| 169 | D | 79 | Confident | 66.9 | Low | 116 Ų | 116 | 134.8 Ų | 134.8 | 62% | 0.62 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -58.5 | -46.9 | 174.2 | -62.1 | -5.3 | 0 | 0 | 0 | 112.1 | S167 K171 D172 H173 | S167-D169 PolarHBondContact O-N 2.94Å; D169-K171 VanDerWaalsContact C-N 3.35Å; D169-D172 PolarHBondContact O-N 2.94Å; D169-H173 WeakPolarHBondContact O-CB 3.47Å; D169-H173 PolarHBondContact O-N 2.88Å; D169-H173 PolarHBondContact O-ND1 3.27Å |
| 170 | L | 78.4 | Confident | 67.9 | Low | 69 Ų | 69 | 136 Ų | 136 | 36% | 0.361 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -67.3 | -38 | 177.8 | 177.8 | 58 | 0 | 0 | 0 | 111.4 | F166 S167 N168 D172 H173 L174 | F166-L170 HydrophobicContact CB-CB 4.29Å; F166-L170 HydrophobicContact CB-CD2 4Å; F166-L170 HydrophobicContact CB-CG 4.17Å; F166-L170 HydrophobicContact CD1-CD2 3.31Å; F166-L170 HydrophobicContact CD1-CG 4.14Å; F166-L170 HydrophobicContact CE1-CD2 4.06Å; F166-L170 HydrophobicContact CG-CD2 3.96Å; F166-L170 HydrophobicContact CG-CG 4.36Å; S167-L170 PolarHBondContact O-N 2.68Å; S167-L170 WeakPolarHBondContact OG-CB 3.44Å; S167-L170 PolarHBondContact OG-N 2.83Å; S167-L170 VanDerWaalsContact OG-N 3.13Å; N168-L170 PolarHBondContact O-N 3.5Å; L170-D172 VanDerWaalsContact C-N 3.3Å; L170-D172 PolarHBondContact O-N 3.14Å; L170-H173 PolarHBondContact O-N 3.5Å; L170-L174 HydrophobicContact CD1-CD1 4.05Å; L170-L174 HydrophobicContact CD1-CG 3.97Å; L170-L174 HydrophobicContact CG-CD1 4.03Å; L170-L174 HydrophobicContact CG-CG 4.38Å; L170-L174 WeakPolarHBondContact O-CB 3.36Å; L170-L174 VanDerWaalsContact O-CG 3.24Å; L170-L174 WeakPolarHBondContact O-CG 3.42Å; L170-L174 PolarHBondContact O-N 2.7Å |
| 171 | K | 79.5 | Confident | 68.8 | Low | 97 Ų | 97 | 129.6 Ų | 129.6 | 42% | 0.422 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -59.7 | -43.8 | 174.3 | -168.1 | -177.9 | -173.9 | -176.7 | 0 | 110.6 | S167 N168 D169 L174 R175 | S167-K171 PolarHBondContact O-N 3.4Å; N168-K171 WeakPolarHBondContact O-CB 3.4Å; N168-K171 PolarHBondContact O-N 2.88Å; D169-K171 VanDerWaalsContact C-N 3.35Å; K171-L174 PolarHBondContact O-N 2.91Å; K171-R175 VanDerWaalsContact CE-NH2 3.3Å; K171-R175 WeakPolarHBondContact O-CB 3.49Å; K171-R175 WeakPolarHBondContact O-CD 3.42Å; K171-R175 WeakPolarHBondContact O-CG 3.42Å; K171-R175 PolarHBondContact O-N 3.2Å |
| 172 | D | 76.9 | Confident | 70.2 | Confident | 81 Ų | 81 | 123.2 Ų | 123.2 | 43% | 0.433 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -72.7 | -35.6 | 179.6 | -69.5 | -15.7 | 0 | 0 | 0 | 112.3 | N168 D169 L170 R175 L176 | N168-D172 WeakPolarHBondContact O-CB 3.46Å; N168-D172 PolarHBondContact O-N 3.1Å; D169-D172 PolarHBondContact O-N 2.94Å; L170-D172 VanDerWaalsContact C-N 3.3Å; L170-D172 PolarHBondContact O-N 3.14Å; D172-R175 CarbonylContact O-C 3.6Å; D172-R175 PolarHBondContact O-N 2.96Å; D172-R175 IonicContact OD1-CZ 3.99Å; D172-R175 IonicContact OD1-NH1 2.93Å; D172-R175 PolarHBondContact OD1-NH1 2.92Å; D172-L176 WeakPolarHBondContact O-CB 3.46Å; D172-L176 PolarHBondContact O-N 2.99Å |
| 173 | H | 72.2 | Confident | 71.2 | Confident | 131 Ų | 131 | 124.8 Ų | 124.8 | 61% | 0.606 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -65.9 | -38.7 | 171.5 | -79 | 77.2 | 0 | 0 | 0 | 112.5 | D169 L170 L176 | D169-H173 WeakPolarHBondContact O-CB 3.47Å; D169-H173 PolarHBondContact O-N 2.88Å; D169-H173 PolarHBondContact O-ND1 3.27Å; L170-H173 PolarHBondContact O-N 3.5Å; H173-L176 WeakPolarHBondContact O-CB 3.41Å; H173-L176 PolarHBondContact O-N 2.74Å |
| 174 | L | 70.2 | Confident | 72 | Confident | 114 Ų | 114 | 124.4 Ų | 124.4 | 60% | 0.597 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -73.3 | -29.9 | 175.6 | -69.8 | 173.7 | 0 | 0 | 0 | 112.2 | L170 K171 L176 | L170-L174 HydrophobicContact CD1-CD1 4.05Å; L170-L174 HydrophobicContact CD1-CG 3.97Å; L170-L174 HydrophobicContact CG-CD1 4.03Å; L170-L174 HydrophobicContact CG-CG 4.38Å; L170-L174 WeakPolarHBondContact O-CB 3.36Å; L170-L174 VanDerWaalsContact O-CG 3.24Å; L170-L174 WeakPolarHBondContact O-CG 3.42Å; L170-L174 PolarHBondContact O-N 2.7Å; K171-L174 PolarHBondContact O-N 2.91Å; L174-L176 VanDerWaalsContact C-N 3.25Å |
| 175 | R | 72.8 | Confident | 72.5 | Confident | 150 Ų | 150 | 123.7 Ų | 123.7 | 57% | 0.566 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -69.3 | -26.2 | 168.1 | -74.7 | 164.3 | 167.3 | 174.1 | -13.5 | 111.8 | K171 D172 K177 | K171-R175 VanDerWaalsContact CE-NH2 3.3Å; K171-R175 WeakPolarHBondContact O-CB 3.49Å; K171-R175 WeakPolarHBondContact O-CD 3.42Å; K171-R175 WeakPolarHBondContact O-CG 3.42Å; K171-R175 PolarHBondContact O-N 3.2Å; D172-R175 CarbonylContact O-C 3.6Å; D172-R175 PolarHBondContact O-N 2.96Å; D172-R175 IonicContact OD1-CZ 3.99Å; D172-R175 IonicContact OD1-NH1 2.93Å; D172-R175 PolarHBondContact OD1-NH1 2.92Å; R175-K177 PolarHBondContact O-N 3.17Å |
| 176 | L | 58.6 | Low | 72.9 | Confident | 132 Ų | 132 | 116.9 Ų | 116.9 | 69% | 0.691 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.4 | 101.6 | -176.3 | -160.3 | 75 | 0 | 0 | 0 | 110 | D172 H173 L174 | D172-L176 WeakPolarHBondContact O-CB 3.46Å; D172-L176 PolarHBondContact O-N 2.99Å; H173-L176 WeakPolarHBondContact O-CB 3.41Å; H173-L176 PolarHBondContact O-N 2.74Å; L174-L176 VanDerWaalsContact C-N 3.25Å |
| 177 | K | 59.7 | Low | 73 | Confident | 176 Ų | 176 | 119.9 Ų | 119.9 | 77% | 0.765 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 55.1 | 92.5 | 179.6 | -67.1 | -160.9 | 174.8 | -174 | 0 | 113.7 | R175 M179 | R175-K177 PolarHBondContact O-N 3.17Å; K177-M179 PolarHBondContact O-N 2.89Å |
| 178 | R | 59.1 | Low | 72.8 | Confident | 205 Ų | 205 | 118.3 Ų | 118.3 | 77% | 0.774 | 58% | 0.584 | S | S | * | * | trans | -53.3 | 76.7 | 136.6 | -67 | -176.5 | 172.5 | 118.7 | -3.1 | 108.6 | N180 | R178-N180 PolarHBondContact O-N 3.36Å; R178-N180 VanDerWaalsContact O-N 3.16Å | ||
| 179 | M | 63.2 | Low | 72.3 | Confident | 151 Ų | 151 | 117.5 Ų | 117.5 | 74% | 0.744 | 58% | 0.579 | S | S | * | * | trans | -70.1 | 108.8 | 164.6 | -152.5 | 156.2 | 93.7 | 0 | 0 | 103 | K177 P181 | K177-M179 PolarHBondContact O-N 2.89Å; M179-P181 WeakPolarHBondContact O-CD 3.1Å | ||
| 180 | N | 66.5 | Low | 72 | Confident | 147 Ų | 147 | 119.3 Ų | 119.3 | 79% | 0.786 | 59% | 0.588 | S | S | * | * | trans | -54.2 | 108.2 | 168.5 | -76.4 | -41.7 | 0 | 0 | 0 | 105.2 | R178 T182 | R178-N180 PolarHBondContact O-N 3.36Å; R178-N180 VanDerWaalsContact O-N 3.16Å; N180-T182 PolarHBondContact O-N 2.9Å | ||
| 181 | P | 68.5 | Low | 71.7 | Confident | 59 Ų | 59 | 120.1 Ų | 120.1 | 38% | 0.383 | 60% | 0.6 | S | S | . | * | trans | -60.4 | 123.3 | -178 | 23.8 | -30.3 | 0 | 0 | 0 | 106.3 | M179 F185 L186 | M179-P181 WeakPolarHBondContact O-CD 3.1Å; P181-F185 HydrophobicContact CB-CD1 3.52Å; P181-F185 HydrophobicContact CB-CE1 4.12Å; P181-F185 HydrophobicContact CB-CG 4.36Å; P181-L186 HydrophobicContact CB-CD2 3.89Å; P181-L186 HydrophobicContact CB-CG 3.92Å; P181-L186 HydrophobicContact CG-CD1 4.08Å; P181-L186 HydrophobicContact CG-CD2 3.65Å; P181-L186 HydrophobicContact CG-CG 3.86Å | ||
| 182 | T | 76.7 | Confident | 71.1 | Confident | 94 Ų | 94 | 118.5 Ų | 118.5 | 58% | 0.577 | 60% | 0.6 | S | S | * | * | trans | -55.1 | 145.1 | 175.6 | 22.8 | 0 | 0 | 0 | 0 | 108.9 | N180 T184 F185 L186 | N180-T182 PolarHBondContact O-N 2.9Å; T182-T184 WeakPolarHBondContact CB-OG1 3.46Å; T182-T184 PolarHBondContact O-N 3.45Å; T182-F185 WeakPolarHBondContact O-CA 3.4Å; T182-F185 WeakPolarHBondContact O-CB 3.24Å; T182-F185 PolarHBondContact O-N 3.24Å; T182-L186 PolarHBondContact O-N 2.85Å; T182-L186 VanDerWaalsContact O-N 3.16Å | ||
| 183 | D | 78.5 | Confident | 70.7 | Confident | 128 Ų | 128 | 123 Ų | 123 | 68% | 0.684 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -51.1 | -34.3 | 179.2 | -174.8 | 56.5 | 0 | 0 | 0 | 112.1 | F185 L186 R187 | D183-F185 PolarHBondContact O-N 2.99Å; D183-L186 PolarHBondContact O-N 3.43Å; D183-R187 WeakPolarHBondContact O-CB 3.19Å; D183-R187 PolarHBondContact O-N 3.36Å |
| 184 | T | 78.8 | Confident | 70.4 | Confident | 108 Ų | 108 | 122 Ų | 122 | 66% | 0.663 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -60.7 | -38.1 | 172 | 45 | 0 | 0 | 0 | 0 | 114.4 | T182 G188 | T182-T184 WeakPolarHBondContact CB-OG1 3.46Å; T182-T184 PolarHBondContact O-N 3.45Å; T184-G188 PolarHBondContact O-N 3.36Å |
| 185 | F | 77.1 | Confident | 70.2 | Confident | 117 Ų | 117 | 121.6 Ų | 121.6 | 51% | 0.513 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -70.6 | -47.6 | 176.8 | 175.4 | -92.5 | 0 | 0 | 0 | 111 | P181 T182 D183 R187 G188 L189 | P181-F185 HydrophobicContact CB-CD1 3.52Å; P181-F185 HydrophobicContact CB-CE1 4.12Å; P181-F185 HydrophobicContact CB-CG 4.36Å; T182-F185 WeakPolarHBondContact O-CA 3.4Å; T182-F185 WeakPolarHBondContact O-CB 3.24Å; T182-F185 PolarHBondContact O-N 3.24Å; D183-F185 PolarHBondContact O-N 2.99Å; F185-R187 VanDerWaalsContact C-N 3.31Å; F185-R187 PolarHBondContact O-N 3.06Å; F185-G188 PolarHBondContact O-N 3.14Å; F185-G188 VanDerWaalsContact O-N 3.16Å; F185-L189 HydrophobicContact CD1-CD1 3.95Å; F185-L189 HydrophobicContact CE1-CD1 3.34Å; F185-L189 HydrophobicContact CE1-CG 4.16Å; F185-L189 HydrophobicContact CZ-CD1 3.73Å; F185-L189 HydrophobicContact CZ-CG 4.27Å; F185-L189 PolarHBondContact O-N 3.04Å |
| 186 | L | 79.4 | Confident | 69.5 | Low | 73 Ų | 73 | 120.6 Ų | 120.6 | 38% | 0.382 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -60.3 | -44.1 | 175.9 | -68.6 | 178.9 | 0 | 0 | 0 | 111.2 | P181 T182 D183 G188 L189 L190 | P181-L186 HydrophobicContact CB-CD2 3.89Å; P181-L186 HydrophobicContact CB-CG 3.92Å; P181-L186 HydrophobicContact CG-CD1 4.08Å; P181-L186 HydrophobicContact CG-CD2 3.65Å; P181-L186 HydrophobicContact CG-CG 3.86Å; T182-L186 PolarHBondContact O-N 2.85Å; T182-L186 VanDerWaalsContact O-N 3.16Å; D183-L186 PolarHBondContact O-N 3.43Å; L186-G188 VanDerWaalsContact C-N 3.31Å; L186-G188 PolarHBondContact O-N 2.91Å; L186-L189 PolarHBondContact O-N 3.16Å; L186-L190 WeakPolarHBondContact O-CB 3.38Å; L186-L190 VanDerWaalsContact O-CG 3.3Å; L186-L190 WeakPolarHBondContact O-CG 3.12Å; L186-L190 PolarHBondContact O-N 2.85Å |
| 187 | R | 77.1 | Confident | 70.2 | Confident | 180 Ų | 180 | 117.1 Ų | 117.1 | 68% | 0.679 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -63.2 | -38.3 | 176.2 | -165.3 | 174.4 | -174.5 | -114.6 | -0.1 | 111.4 | D183 F185 L190 S191 | D183-R187 WeakPolarHBondContact O-CB 3.19Å; D183-R187 PolarHBondContact O-N 3.36Å; F185-R187 VanDerWaalsContact C-N 3.31Å; F185-R187 PolarHBondContact O-N 3.06Å; R187-L190 PolarHBondContact O-N 2.84Å; R187-S191 WeakPolarHBondContact O-CB 3.45Å; R187-S191 PolarHBondContact O-N 2.92Å; R187-S191 PolarHBondContact O-OG 2.86Å |
| 188 | G | 76.4 | Confident | 70.6 | Confident | 36 Ų | 36 | 116.4 Ų | 116.4 | 37% | 0.371 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -57.4 | -49.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | T184 F185 L186 L190 S191 S192 | T184-G188 PolarHBondContact O-N 3.36Å; F185-G188 PolarHBondContact O-N 3.14Å; F185-G188 VanDerWaalsContact O-N 3.16Å; L186-G188 VanDerWaalsContact C-N 3.31Å; L186-G188 PolarHBondContact O-N 2.91Å; G188-L190 PolarHBondContact O-N 2.9Å; G188-S191 PolarHBondContact O-N 2.83Å; G188-S192 PolarHBondContact O-N 3.24Å; G188-S192 VanDerWaalsContact O-N 3.11Å; G188-S192 PolarHBondContact O-OG 3.03Å |
| 189 | L | 70.5 | Confident | 71.2 | Confident | 104 Ų | 104 | 110.3 Ų | 110.3 | 55% | 0.545 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -63.9 | -37.9 | 178.2 | -68.3 | 177.2 | 0 | 0 | 0 | 113.5 | F185 L186 | F185-L189 HydrophobicContact CD1-CD1 3.95Å; F185-L189 HydrophobicContact CE1-CD1 3.34Å; F185-L189 HydrophobicContact CE1-CG 4.16Å; F185-L189 HydrophobicContact CZ-CD1 3.73Å; F185-L189 HydrophobicContact CZ-CG 4.27Å; F185-L189 PolarHBondContact O-N 3.04Å; L186-L189 PolarHBondContact O-N 3.16Å |
| 190 | L | 72.9 | Confident | 71.8 | Confident | 153 Ų | 153 | 108.2 Ų | 108.2 | 80% | 0.801 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -84.2 | -22.2 | -177.8 | -65.9 | 175 | 0 | 0 | 0 | 113.5 | L186 R187 G188 | L186-L190 WeakPolarHBondContact O-CB 3.38Å; L186-L190 VanDerWaalsContact O-CG 3.3Å; L186-L190 WeakPolarHBondContact O-CG 3.12Å; L186-L190 PolarHBondContact O-N 2.85Å; R187-L190 PolarHBondContact O-N 2.84Å; G188-L190 PolarHBondContact O-N 2.9Å |
| 191 | S | 70.2 | Confident | 71.8 | Confident | 87 Ų | 87 | 109.8 Ų | 109.8 | 61% | 0.608 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -94.4 | -20.9 | -179.6 | 60.8 | 0 | 0 | 0 | 0 | 113.6 | R187 G188 E193 | R187-S191 WeakPolarHBondContact O-CB 3.45Å; R187-S191 PolarHBondContact O-N 2.92Å; R187-S191 PolarHBondContact O-OG 2.86Å; G188-S191 PolarHBondContact O-N 2.83Å; S191-E193 PolarHBondContact O-N 3.31Å; S191-E193 VanDerWaalsContact O-N 3.13Å |
| 192 | S | 68.3 | Low | 71.9 | Confident | 63 Ų | 63 | 112.1 Ų | 112.1 | 44% | 0.441 | 62% | 0.622 | S | S | . | * | S | Bend | trans | -76.4 | 98 | 167.8 | 61.1 | 0 | 0 | 0 | 0 | 108.8 | G188 P194 | G188-S192 PolarHBondContact O-N 3.24Å; G188-S192 VanDerWaalsContact O-N 3.11Å; G188-S192 PolarHBondContact O-OG 3.03Å; S192-P194 WeakPolarHBondContact O-CD 3.49Å |
| 193 | E | 69.2 | Low | 71.6 | Confident | 175 Ų | 175 | 112 Ų | 112 | 82% | 0.818 | 62% | 0.622 | S | S | * | * | trans | -53.9 | 124.3 | 162.1 | -171 | 174.5 | -172.9 | 0 | 0 | 107.4 | S191 S195 | S191-E193 PolarHBondContact O-N 3.31Å; S191-E193 VanDerWaalsContact O-N 3.13Å; E193-S195 VanDerWaalsContact C-N 3.33Å; E193-S195 PolarHBondContact O-N 2.93Å | ||
| 194 | P | 64.4 | Low | 71.2 | Confident | 110 Ų | 110 | 110.7 Ų | 110.7 | 71% | 0.714 | 62% | 0.615 | S | S | * | * | trans | -64.7 | 98.8 | 177.3 | 25.9 | -32.5 | 0 | 0 | 0 | 108 | S192 L196 | S192-P194 WeakPolarHBondContact O-CD 3.49Å; P194-L196 PolarHBondContact O-N 3.21Å | ||
| 195 | S | 66.8 | Low | 70.5 | Confident | 105 Ų | 105 | 110 Ų | 110 | 73% | 0.734 | 61% | 0.613 | S | S | * | * | trans | -75.3 | 97.9 | 176.3 | -169.5 | 0 | 0 | 0 | 0 | 108.3 | E193 A197 | E193-S195 VanDerWaalsContact C-N 3.33Å; E193-S195 PolarHBondContact O-N 2.93Å; S195-A197 PolarHBondContact O-N 2.86Å; S195-A197 VanDerWaalsContact O-N 3.16Å | ||
| 196 | L | 58.8 | Low | 69.9 | Low | 129 Ų | 129 | 110.9 Ų | 110.9 | 68% | 0.675 | 62% | 0.622 | S | S | * | * | trans | -76.4 | 95 | 166.7 | -64.8 | 174.9 | 0 | 0 | 0 | 107.4 | M91 P194 I198 | M91-L196 HydrophobicContact CE-CD2 4.14Å; P194-L196 PolarHBondContact O-N 3.21Å; L196-I198 PolarHBondContact O-N 3.45Å | ||
| 197 | A | 71.7 | Confident | 68.8 | Low | 60 Ų | 60 | 115.3 Ų | 115.3 | 50% | 0.496 | 64% | 0.638 | S | S | . | * | trans | -67.7 | 116.3 | 166.5 | 0 | 0 | 0 | 0 | 0 | 108.1 | S195 V199 | S195-A197 PolarHBondContact O-N 2.86Å; S195-A197 VanDerWaalsContact O-N 3.16Å; A197-V199 HydrophobicContact CB-CG2 4.34Å; A197-V199 PolarHBondContact O-N 2.86Å | ||
| 198 | I | 69 | Low | 68 | Low | 161 Ų | 161 | 110.2 Ų | 110.2 | 83% | 0.826 | 64% | 0.641 | S | S | * | * | trans | -68 | 91.9 | 163.6 | -58 | 171.9 | 0 | 0 | 0 | 105.6 | L196 P200 | L196-I198 PolarHBondContact O-N 3.45Å; I198-P200 VanDerWaalsContact O-CD 3.27Å; I198-P200 WeakPolarHBondContact O-CD 3.46Å | ||
| 199 | V | 70.9 | Confident | 66.9 | Low | 76 Ų | 76 | 115.2 Ų | 115.2 | 46% | 0.461 | 66% | 0.659 | S | S | . | * | P | Polyproline II helix | trans | -75.7 | 116.1 | 170.3 | -179.1 | 0 | 0 | 0 | 0 | 106.5 | N92 A197 F201 | N92-V199 HydrophobicContact CB-CG2 4.32Å; A197-V199 HydrophobicContact CB-CG2 4.34Å; A197-V199 PolarHBondContact O-N 2.86Å; V199-F201 PolarHBondContact O-N 3.02Å |
| 200 | P | 75.3 | Confident | 65.9 | Low | 107 Ų | 107 | 116.2 Ų | 116.2 | 70% | 0.695 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 129.5 | 174.6 | -22.2 | 34.2 | 0 | 0 | 0 | 109.4 | I198 N202 | I198-P200 VanDerWaalsContact O-CD 3.27Å; I198-P200 WeakPolarHBondContact O-CD 3.46Å; P200-N202 PolarHBondContact O-N 3.13Å; P200-N202 VanDerWaalsContact O-N 3.14Å |
| 201 | F | 66.8 | Low | 64.4 | Low | 181 Ų | 181 | 113.4 Ų | 113.4 | 79% | 0.794 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 118.7 | 173.8 | 176.6 | -105.1 | 0 | 0 | 0 | 109.2 | V199 P203 | V199-F201 PolarHBondContact O-N 3.02Å; F201-P203 HydrophobicContact CD1-CB 4.31Å; F201-P203 HydrophobicContact CE1-CB 3.73Å; F201-P203 HydrophobicContact CZ-CB 4.45Å; F201-P203 WeakPolarHBondContact O-CD 3.18Å |
| 202 | N | 72.3 | Confident | 63.5 | Low | 108 Ų | 108 | 115.2 Ų | 115.2 | 58% | 0.578 | 66% | 0.664 | S | S | * | * | trans | -96.7 | 109.8 | 171 | -170.1 | 1.4 | 0 | 0 | 0 | 108.6 | P200 D204 | P200-N202 PolarHBondContact O-N 3.13Å; P200-N202 VanDerWaalsContact O-N 3.14Å; N202-D204 PolarHBondContact O-N 3.04Å; N202-D204 PolarHBondContact OD1-N 3Å | ||
| 203 | P | 68.5 | Low | 62 | Low | 90 Ų | 90 | 118.1 Ų | 118.1 | 58% | 0.584 | 68% | 0.675 | S | S | * | * | trans | -72.9 | 1.4 | -178.5 | 30.5 | -36.2 | 0 | 0 | 0 | 114.1 | F201 P205 | F201-P203 HydrophobicContact CD1-CB 4.31Å; F201-P203 HydrophobicContact CE1-CB 3.73Å; F201-P203 HydrophobicContact CZ-CB 4.45Å; F201-P203 WeakPolarHBondContact O-CD 3.18Å; P203-P205 VanDerWaalsContact C-CD 3.46Å; P203-P205 WeakPolarHBondContact O-CD 3.42Å | ||
| 204 | D | 71.9 | Confident | 60.5 | Low | 102 Ų | 102 | 117.5 Ų | 117.5 | 55% | 0.545 | 67% | 0.67 | S | S | . | * | trans | -90.8 | 89.9 | 173.2 | -90.1 | -23.5 | 0 | 0 | 0 | 111.1 | N202 L206 | N202-D204 PolarHBondContact O-N 3.04Å; N202-D204 PolarHBondContact OD1-N 3Å; D204-L206 PolarHBondContact O-N 3.49Å; D204-L206 VanDerWaalsContact O-N 3.11Å | ||
| 205 | P | 63 | Low | 59.3 | Low | 93 Ų | 93 | 118 Ų | 118 | 60% | 0.604 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.5 | -18.8 | -178.1 | 23.1 | -34.3 | 0 | 0 | 0 | 113.9 | P203 | P203-P205 VanDerWaalsContact C-CD 3.46Å; P203-P205 WeakPolarHBondContact O-CD 3.42Å |
| 206 | L | 63.8 | Low | 58 | Low | 136 Ų | 136 | 119.1 Ų | 119.1 | 71% | 0.712 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | -13.1 | -169.2 | -63.1 | 177.3 | 0 | 0 | 0 | 114.8 | D204 | D204-L206 PolarHBondContact O-N 3.49Å; D204-L206 VanDerWaalsContact O-N 3.11Å |
| 207 | K | 57.8 | Low | 56.8 | Low | 165 Ų | 165 | 122 Ų | 122 | 72% | 0.717 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.8 | -20.6 | 179.2 | -72.6 | -162.6 | 178.3 | -172.1 | 0 | 114.6 | ||
| 208 | G | 59.5 | Low | 55.1 | Low | 73 Ų | 73 | 127.7 Ų | 127.7 | 75% | 0.753 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -82 | -18.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 209 | L | 53.7 | Low | 53.5 | Low | 141 Ų | 141 | 125.8 Ų | 125.8 | 74% | 0.738 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -96.9 | -3.2 | -174.9 | -69.1 | 174.1 | 0 | 0 | 0 | 114.3 | P211 | L209-P211 WeakPolarHBondContact O-CD 3.39Š|
| 210 | I | 48.8 | Very low | 51.8 | Low | 126 Ų | 126 | 128 Ų | 128 | 65% | 0.646 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -94.5 | 101 | 173.3 | -52.5 | 176.3 | 0 | 0 | 0 | 106.7 | ||
| 211 | P | 42.7 | Very low | 50 | Low | 94 Ų | 94 | 132.6 Ų | 132.6 | 61% | 0.61 | 72% | 0.724 | S | S | * | * | trans | -54.3 | 137.9 | 168.8 | 22.7 | -31.8 | 0 | 0 | 0 | 108.6 | L209 N213 | L209-P211 WeakPolarHBondContact O-CD 3.39Å; P211-N213 VanDerWaalsContact C-N 3.32Å; P211-N213 PolarHBondContact O-N 2.81Å | ||
| 212 | P | 51 | Low | 48.5 | Very low | 125 Ų | 125 | 131.7 Ų | 131.7 | 81% | 0.812 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -70.1 | 93.8 | -178.5 | 28.9 | -32.7 | 0 | 0 | 0 | 108.1 | ||
| 213 | N | 36.9 | Very low | 46.6 | Very low | 123 Ų | 123 | 132.5 Ų | 132.5 | 66% | 0.658 | 73% | 0.726 | S | S | * | * | trans | -155.5 | 128.7 | 170 | -105.9 | -33.3 | 0 | 0 | 0 | 110.2 | P211 | P211-N213 VanDerWaalsContact C-N 3.32Å; P211-N213 PolarHBondContact O-N 2.81Å | ||
| 214 | F | 37.9 | Very low | 45.1 | Very low | 163 Ų | 163 | 133.9 Ų | 133.9 | 72% | 0.715 | 74% | 0.738 | S | S | * | * | trans | 76.7 | 67.1 | 171.4 | -45.4 | -69.7 | 0 | 0 | 0 | 116.5 | D216 | F214-D216 PolarHBondContact O-N 3Š| ||
| 215 | S | 38.5 | Very low | 43.4 | Very low | 120 Ų | 120 | 137.3 Ų | 137.3 | 84% | 0.839 | 76% | 0.756 | S | S | * | * | trans | -73.5 | 90.7 | 137.3 | 160 | 0 | 0 | 0 | 0 | 106.5 | Q217 | S215-Q217 PolarHBondContact O-N 2.82Š| ||
| 216 | D | 39.6 | Very low | 42.4 | Very low | 129 Ų | 129 | 137.8 Ų | 137.8 | 69% | 0.69 | 76% | 0.762 | S | S | * | * | trans | -54.2 | 119.4 | 166.6 | -69.8 | -40.8 | 0 | 0 | 0 | 109 | F214 E218 | F214-D216 PolarHBondContact O-N 3Å; D216-E218 PolarHBondContact O-N 2.86Å; D216-E218 VanDerWaalsContact O-N 3.12Å | ||
| 217 | Q | 33.5 | Very low | 40.7 | Very low | 190 Ų | 190 | 139.3 Ų | 139.3 | 89% | 0.888 | 77% | 0.771 | S | S | * | * | trans | -60.9 | 105.5 | 157.3 | -78.7 | -178.9 | -8.7 | 0 | 0 | 107.1 | S215 | S215-Q217 PolarHBondContact O-N 2.82Š| ||
| 218 | E | 36.7 | Very low | 39.7 | Very low | 178 Ų | 178 | 137.4 Ų | 137.4 | 83% | 0.832 | 77% | 0.773 | S | S | * | * | trans | -148.4 | 94.6 | 151 | -118.3 | 175.1 | -179.4 | 0 | 0 | 111.3 | D216 | D216-E218 PolarHBondContact O-N 2.86Å; D216-E218 VanDerWaalsContact O-N 3.12Å | ||
| 219 | T | 34 | Very low | 38.2 | Very low | 121 Ų | 121 | 139.1 Ų | 139.1 | 74% | 0.742 | 77% | 0.773 | S | S | * | * | trans | 16.7 | 117.5 | 147.1 | 53.8 | 0 | 0 | 0 | 0 | 118.3 | K221 | T219-K221 PolarHBondContact O-N 2.92Å; T219-K221 VanDerWaalsContact O-N 3.12Å | ||
| 220 | S | 35.8 | Very low | 37.4 | Very low | 122 Ų | 122 | 137.3 Ų | 137.3 | 85% | 0.853 | 77% | 0.77 | S | S | * | * | trans | -32 | 110.4 | 148 | 54.6 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 221 | K | 38.6 | Very low | 36.6 | Very low | 205 Ų | 205 | 140 Ų | 140 | 89% | 0.891 | 78% | 0.78 | S | S | * | * | trans | -128.4 | 95.5 | 151.9 | -139.6 | 172.5 | -174.6 | 176.9 | 0 | 108.9 | T219 | T219-K221 PolarHBondContact O-N 2.92Å; T219-K221 VanDerWaalsContact O-N 3.12Å | ||
| 222 | E | 33.6 | Very low | 36.2 | Very low | 162 Ų | 162 | 140.7 Ų | 140.7 | 76% | 0.757 | 79% | 0.787 | S | S | * | * | trans | -46.7 | 141.7 | 164.3 | -138.2 | -173 | 122.9 | 0 | 0 | 111.3 | ||||
| 223 | N | 32.3 | Very low | 35.4 | Very low | 125 Ų | 125 | 142.3 Ų | 142.3 | 67% | 0.668 | 78% | 0.784 | S | S | * | * | trans | 76 | 101.3 | 157 | -52.7 | -32 | 0 | 0 | 0 | 117.8 | ||||
| 224 | S | 37.3 | Very low | 35.3 | Very low | 118 Ų | 118 | 142.3 Ų | 142.3 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | -168.6 | 108.5 | 127.1 | -74.8 | 0 | 0 | 0 | 0 | 110.5 | S226 | S224-S226 PolarHBondContact O-N 3.5Š| |||
| 225 | D | 35.7 | Very low | 35.4 | Very low | 174 Ų | 174 | 141.2 Ų | 141.2 | 93% | 0.93 | 79% | 0.789 | S | S | * | * | trans | -57.7 | 110.6 | 160.1 | -86 | -47.2 | 0 | 0 | 0 | 109.9 | ||||
| 226 | S | 42 | Very low | 35.2 | Very low | 104 Ų | 104 | 142.2 Ų | 142.2 | 73% | 0.727 | 79% | 0.785 | S | S | * | * | trans | -156.6 | 107.7 | 154.1 | 59.4 | 0 | 0 | 0 | 0 | 110.7 | S224 V228 | S224-S226 PolarHBondContact O-N 3.5Å; S226-V228 PolarHBondContact O-N 3Å | ||
| 227 | N | 30 | Very low | 35.1 | Very low | 168 Ų | 168 | 140.6 Ų | 140.6 | 90% | 0.898 | 78% | 0.783 | S | S | * | * | trans | -49.1 | 116.6 | 163.2 | -73.8 | -55.8 | 0 | 0 | 0 | 111.4 | ||||
| 228 | V | 36.2 | Very low | 35.3 | Very low | 125 Ų | 125 | 136.5 Ų | 136.5 | 76% | 0.758 | 78% | 0.775 | S | S | * | * | trans | -149.9 | 104.1 | 147.7 | 178.6 | 0 | 0 | 0 | 0 | 108.4 | S226 | S226-V228 PolarHBondContact O-N 3Š| ||
| 229 | S | 27.2 | Very low | 35.4 | Very low | 108 Ų | 108 | 133.7 Ų | 133.7 | 76% | 0.755 | 77% | 0.771 | S | S | * | * | trans | -72 | 135.3 | 149.2 | -179.9 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 230 | P | 37.2 | Very low | 35.5 | Very low | 104 Ų | 104 | 133.5 Ų | 133.5 | 68% | 0.675 | 77% | 0.769 | S | S | * | * | -135.3 | 132.8 | 95.8 | 36.1 | -23.2 | 0 | 0 | 0 | 113.1 | |||||
| 231 | E | 32 | Very low | 35.5 | Very low | 181 Ų | 181 | 134.9 Ų | 134.9 | 85% | 0.846 | 77% | 0.766 | S | S | * | * | 25.9 | 133.2 | 118.1 | -122 | 168.9 | -179.3 | 0 | 0 | 118.9 | |||||
| 232 | S | 33.8 | Very low | 35.4 | Very low | 109 Ų | 109 | 129.3 Ų | 129.3 | 76% | 0.762 | 75% | 0.751 | S | S | * | * | trans | 89.5 | 106.4 | 174.3 | -153 | 0 | 0 | 0 | 0 | 113 | ||||
| 233 | Q | 35.8 | Very low | 35.3 | Very low | 160 Ų | 160 | 126.7 Ų | 126.7 | 75% | 0.748 | 75% | 0.746 | S | S | * | * | -142.2 | 124.6 | 54.7 | -60.5 | -168.8 | -3.8 | 0 | 0 | 111.2 | L235 | Q233-L235 PolarHBondContact O-N 3.05Š| |||
| 234 | V | 34.6 | Very low | 35.9 | Very low | 122 Ų | 122 | 128.7 Ų | 128.7 | 74% | 0.739 | 75% | 0.749 | S | S | * | * | trans | -56.9 | 96.4 | 153 | 178.8 | 0 | 0 | 0 | 0 | 105.6 | D236 | V234-D236 PolarHBondContact O-N 2.71Š| ||
| 235 | L | 39.6 | Very low | 36 | Very low | 141 Ų | 141 | 129.5 Ų | 129.5 | 74% | 0.738 | 74% | 0.744 | S | S | * | * | trans | -69.8 | 94.6 | 158.9 | -77 | 171.8 | 0 | 0 | 0 | 104.9 | Q233 S237 | Q233-L235 PolarHBondContact O-N 3.05Å; L235-S237 PolarHBondContact O-N 2.89Å | ||
| 236 | D | 32.9 | Very low | 36.2 | Very low | 141 Ų | 141 | 128.1 Ų | 128.1 | 75% | 0.754 | 74% | 0.737 | S | S | * | * | trans | -52.4 | 79.9 | 157.7 | -80.1 | -33 | 0 | 0 | 0 | 107.7 | V234 S238 | V234-D236 PolarHBondContact O-N 2.71Å; D236-S238 PolarHBondContact O-N 2.85Å | ||
| 237 | S | 38.6 | Very low | 36.1 | Very low | 95 Ų | 95 | 128.5 Ų | 128.5 | 66% | 0.664 | 73% | 0.734 | S | S | * | * | trans | -72.8 | 80.4 | 159.5 | -66.9 | 0 | 0 | 0 | 0 | 105.2 | L235 T239 | L235-S237 PolarHBondContact O-N 2.89Å; S237-T239 PolarHBondContact O-N 3.18Å; S237-T239 PolarHBondContact O-OG1 3.12Å | ||
| 238 | S | 37.5 | Very low | 36.7 | Very low | 103 Ų | 103 | 127.5 Ų | 127.5 | 72% | 0.72 | 73% | 0.729 | S | S | * | * | trans | -57 | 73.9 | 160.6 | -176 | 0 | 0 | 0 | 0 | 107.5 | D236 V240 | D236-S238 PolarHBondContact O-N 2.85Å; S238-V240 VanDerWaalsContact C-N 3.29Å; S238-V240 PolarHBondContact O-N 3.36Å | ||
| 239 | T | 38 | Very low | 36.7 | Very low | 120 Ų | 120 | 126 Ų | 126 | 74% | 0.736 | 72% | 0.722 | S | S | * | * | trans | -72.1 | 99.9 | 167.3 | -45 | 0 | 0 | 0 | 0 | 103.2 | S237 L241 | S237-T239 PolarHBondContact O-N 3.18Å; S237-T239 PolarHBondContact O-OG1 3.12Å; T239-L241 VanDerWaalsContact C-N 3.32Å; T239-L241 PolarHBondContact O-N 3.14Å | ||
| 240 | V | 37.4 | Very low | 37.5 | Very low | 117 Ų | 117 | 129 Ų | 129 | 71% | 0.709 | 73% | 0.726 | S | S | * | * | trans | -49.6 | 98.9 | 176.9 | 178.7 | 0 | 0 | 0 | 0 | 107.3 | S238 | S238-V240 VanDerWaalsContact C-N 3.29Å; S238-V240 PolarHBondContact O-N 3.36Å | ||
| 241 | L | 34.8 | Very low | 37.6 | Very low | 151 Ų | 151 | 130.7 Ų | 130.7 | 79% | 0.791 | 73% | 0.73 | S | S | * | * | trans | -57.7 | 123.3 | 161 | -83.9 | 156.8 | 0 | 0 | 0 | 104.9 | T239 T243 | T239-L241 VanDerWaalsContact C-N 3.32Å; T239-L241 PolarHBondContact O-N 3.14Å; L241-T243 PolarHBondContact O-N 3.48Å | ||
| 242 | P | 37.7 | Very low | 38.3 | Very low | 88 Ų | 88 | 129 Ų | 129 | 57% | 0.571 | 73% | 0.725 | S | S | * | * | trans | -58.4 | 114.6 | 176.5 | 22.9 | -30.7 | 0 | 0 | 0 | 107.3 | F244 | P242-F244 HydrophobicContact CG-CE2 4.06Å; P242-F244 HydrophobicContact CG-CZ 4.46Å; P242-F244 WeakPolarHBondContact O-CD2 3.21Å; P242-F244 PolarHBondContact O-N 2.89Å | ||
| 243 | T | 31.3 | Very low | 38.7 | Very low | 106 Ų | 106 | 131.3 Ų | 131.3 | 65% | 0.65 | 73% | 0.729 | S | S | * | * | trans | -60.5 | 103.6 | 169.4 | -42.5 | 0 | 0 | 0 | 0 | 106.5 | L241 D245 | L241-T243 PolarHBondContact O-N 3.48Å; T243-D245 HydrophobicContact CG2-CB 4.46Å; T243-D245 WeakPolarHBondContact CG2-OD1 3.36Å; T243-D245 WeakPolarHBondContact CG2-OD2 3.14Å; T243-D245 PolarHBondContact O-N 2.75Å | ||
| 244 | F | 43.4 | Very low | 39.2 | Very low | 168 Ų | 168 | 127.8 Ų | 127.8 | 74% | 0.737 | 72% | 0.722 | S | S | * | * | trans | -74.2 | 76.7 | 165.6 | -71.1 | -83 | 0 | 0 | 0 | 107.4 | P242 N246 | P242-F244 HydrophobicContact CG-CE2 4.06Å; P242-F244 HydrophobicContact CG-CZ 4.46Å; P242-F244 WeakPolarHBondContact O-CD2 3.21Å; P242-F244 PolarHBondContact O-N 2.89Å; F244-N246 PolarHBondContact O-N 3.23Å | ||
| 245 | D | 39.9 | Very low | 39.6 | Very low | 134 Ų | 134 | 128.8 Ų | 128.8 | 72% | 0.717 | 72% | 0.723 | S | S | * | * | trans | -71.1 | 17.8 | 172 | -79 | -31 | 0 | 0 | 0 | 112.9 | T243 | T243-D245 HydrophobicContact CG2-CB 4.46Å; T243-D245 WeakPolarHBondContact CG2-OD1 3.36Å; T243-D245 WeakPolarHBondContact CG2-OD2 3.14Å; T243-D245 PolarHBondContact O-N 2.75Å | ||
| 246 | N | 40.9 | Very low | 39.6 | Very low | 146 Ų | 146 | 130.5 Ų | 130.5 | 78% | 0.781 | 73% | 0.725 | S | S | * | * | trans | -119.7 | 50.6 | 170.3 | -73 | -14.1 | 0 | 0 | 0 | 110.5 | F244 L248 | F244-N246 PolarHBondContact O-N 3.23Å; N246-L248 PolarHBondContact O-N 3.15Å | ||
| 247 | V | 40 | Very low | 40 | Very low | 111 Ų | 111 | 129.6 Ų | 129.6 | 67% | 0.673 | 72% | 0.724 | S | S | * | * | trans | -74.2 | 77.6 | 149.9 | -175.5 | 0 | 0 | 0 | 0 | 106.3 | C249 | V247-C249 HydrophobicContact CG1-CB 4.19Å; V247-C249 WeakPolarHBondContact CG1-SG 3.41Å; V247-C249 PolarHBondContact O-N 3Å | ||
| 248 | L | 40.9 | Very low | 40.1 | Very low | 148 Ų | 148 | 132.3 Ų | 132.3 | 78% | 0.775 | 77% | 0.767 | S | S | * | * | trans | -69 | 80.6 | 150.2 | -77.4 | 167.3 | 0 | 0 | 0 | 105.5 | N246 M250 | N246-L248 PolarHBondContact O-N 3.15Å; L248-M250 PolarHBondContact O-N 2.84Å | ||
| 249 | C | 37.9 | Very low | 40.2 | Very low | 93 Ų | 93 | 133.8 Ų | 133.8 | 63% | 0.628 | 77% | 0.77 | S | S | * | * | trans | -57.5 | 90.5 | 150.4 | -89.2 | 0 | 0 | 0 | 0 | 105.3 | V247 D251 | V247-C249 HydrophobicContact CG1-CB 4.19Å; V247-C249 WeakPolarHBondContact CG1-SG 3.41Å; V247-C249 PolarHBondContact O-N 3Å; C249-D251 VanDerWaalsContact C-N 3.26Å; C249-D251 PolarHBondContact O-N 2.95Å; C249-D251 VanDerWaalsContact O-N 3.12Å | ||
| 250 | M | 43.5 | Very low | 40.4 | Very low | 170 Ų | 170 | 134.5 Ų | 134.5 | 84% | 0.837 | 77% | 0.772 | S | S | * | * | trans | -71.7 | 99.7 | 155.4 | -76.2 | -173.6 | 64.8 | 0 | 0 | 105.2 | L248 | L248-M250 PolarHBondContact O-N 2.84Š| ||
| 251 | D | 39.8 | Very low | 40.5 | Very low | 141 Ų | 141 | 135.4 Ų | 135.4 | 75% | 0.754 | 78% | 0.775 | S | S | * | * | trans | -51.2 | 137.8 | 168.8 | -79.3 | -44.2 | 0 | 0 | 0 | 109.7 | C249 D253 | C249-D251 VanDerWaalsContact C-N 3.26Å; C249-D251 PolarHBondContact O-N 2.95Å; C249-D251 VanDerWaalsContact O-N 3.12Å; D251-D253 PolarHBondContact O-N 3.16Å; D251-D253 VanDerWaalsContact O-N 3.15Å | ||
| 252 | I | 45.8 | Very low | 40.9 | Very low | 146 Ų | 146 | 134.5 Ų | 134.5 | 75% | 0.749 | 77% | 0.774 | S | S | * | * | trans | -74.2 | 99 | 173.8 | -60 | 156 | 0 | 0 | 0 | 106.3 | S254 | I252-S254 WeakPolarHBondContact CG2-OG 3.5Å; I252-S254 PolarHBondContact O-N 2.82Å | ||
| 253 | D | 43.2 | Very low | 41.1 | Very low | 157 Ų | 157 | 137.4 Ų | 137.4 | 84% | 0.84 | 79% | 0.787 | S | S | * | * | trans | -74.6 | 86.1 | 152.4 | -73.9 | -22.3 | 0 | 0 | 0 | 107 | D251 | D251-D253 PolarHBondContact O-N 3.16Å; D251-D253 VanDerWaalsContact O-N 3.15Å | ||
| 254 | S | 45.5 | Very low | 41.7 | Very low | 85 Ų | 85 | 139.5 Ų | 139.5 | 59% | 0.594 | 80% | 0.796 | S | S | * | * | trans | -57.6 | 143.3 | 145.3 | -68.9 | 0 | 0 | 0 | 0 | 107.4 | I252 | I252-S254 WeakPolarHBondContact CG2-OG 3.5Å; I252-S254 PolarHBondContact O-N 2.82Å | ||
| 255 | D | 42 | Very low | 41.6 | Very low | 143 Ų | 143 | 137.5 Ų | 137.5 | 77% | 0.765 | 80% | 0.8 | S | S | * | * | trans | 118 | 129.3 | 172.4 | -60.9 | -15.8 | 0 | 0 | 0 | 110.5 | ||||
| 256 | F | 40.1 | Very low | 41.7 | Very low | 178 Ų | 178 | 137.8 Ų | 137.8 | 78% | 0.781 | 81% | 0.807 | S | S | * | * | cis | -163 | 154.1 | 20.1 | -150.1 | -115.1 | 0 | 0 | 0 | 109.6 | ||||
| 257 | T | 41.2 | Very low | 41.8 | Very low | 121 Ų | 121 | 137.1 Ų | 137.1 | 74% | 0.742 | 81% | 0.809 | S | S | * | * | trans | -39.5 | 136.7 | 170.3 | 49.3 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 258 | G | 41.5 | Very low | 42 | Very low | 152 Ų | 152 | 139.5 Ų | 139.5 | 100% | 1.567 | 82% | 0.821 | S | S | * | * | trans | -156.2 | 0 | 154.8 | 0 | 0 | 0 | 0 | 0 | 108.7 |
Retrieved 258 of 258 residues in 373.3 ms
(Link to these results)