| 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 | W | 35.9 | Very low | 41.7 | Very low | 302 Ų | 302 | 139.2 Ų | 139.2 | 100% | 1.144 | 76% | 0.764 | S | S | * | * | 0 | 105.2 | 0 | -34.5 | 92.8 | 0 | 0 | 0 | 106.2 | |||||
| 2 | D | 34.4 | Very low | 41.5 | Very low | 137 Ų | 137 | 140.1 Ų | 140.1 | 73% | 0.733 | 76% | 0.762 | S | S | * | * | cis | -165.3 | 163.6 | 3.7 | -148.3 | -33.9 | 0 | 0 | 0 | 106.6 | ||||
| 3 | L | 43.5 | Very low | 41.7 | Very low | 151 Ų | 151 | 136.6 Ų | 136.6 | 79% | 0.791 | 76% | 0.755 | S | S | * | * | trans | -59.5 | 148.3 | -170.1 | -69.7 | 91.3 | 0 | 0 | 0 | 114.7 | ||||
| 4 | S | 43 | Very low | 41.5 | Very low | 114 Ų | 114 | 135.6 Ų | 135.6 | 80% | 0.797 | 76% | 0.76 | S | S | * | * | -173.4 | 72.2 | 127.6 | -80.6 | 0 | 0 | 0 | 0 | 109.5 | V6 | S4-V6 PolarHBondContact O-N 3.26Š| |||
| 5 | G | 41.8 | Very low | 41.3 | Very low | 72 Ų | 72 | 133.4 Ų | 133.4 | 74% | 0.742 | 76% | 0.757 | S | S | * | * | trans | -68.4 | 107.2 | 156.3 | 0 | 0 | 0 | 0 | 0 | 108 | C7 | G5-C7 PolarHBondContact O-N 3.12Å; G5-C7 VanDerWaalsContact O-N 3.12Å | ||
| 6 | V | 45.2 | Very low | 41.2 | Very low | 121 Ų | 121 | 131.6 Ų | 131.6 | 73% | 0.733 | 76% | 0.756 | S | S | * | * | trans | -81.6 | 84 | 161.7 | -176 | 0 | 0 | 0 | 0 | 106.1 | S4 I8 | S4-V6 PolarHBondContact O-N 3.26Å; V6-I8 VanDerWaalsContact C-N 3.29Å; V6-I8 HydrophobicContact CG1-CG1 3.77Å; V6-I8 PolarHBondContact O-N 2.82Å | ||
| 7 | C | 42.8 | Very low | 41.4 | Very low | 101 Ų | 101 | 131.9 Ų | 131.9 | 68% | 0.682 | 76% | 0.76 | S | S | * | * | trans | -64.2 | 100.1 | 155.4 | -66.6 | 0 | 0 | 0 | 0 | 105.7 | G5 I9 | G5-C7 PolarHBondContact O-N 3.12Å; G5-C7 VanDerWaalsContact O-N 3.12Å; C7-I9 HydrophobicContact CB-CD1 4.35Å; C7-I9 HydrophobicContact CB-CG1 3.86Å; C7-I9 PolarHBondContact O-N 3.05Å | ||
| 8 | I | 43.6 | Very low | 41.3 | Very low | 139 Ų | 139 | 130.9 Ų | 130.9 | 71% | 0.713 | 76% | 0.756 | S | S | * | * | trans | -69.6 | 82.9 | 158.8 | -59.1 | -167 | 0 | 0 | 0 | 105.3 | V6 E10 | V6-I8 VanDerWaalsContact C-N 3.29Å; V6-I8 HydrophobicContact CG1-CG1 3.77Å; V6-I8 PolarHBondContact O-N 2.82Å; I8-E10 HydrophobicContact CG2-CB 4.33Å; I8-E10 PolarHBondContact O-N 2.89Å | ||
| 9 | I | 43.2 | Very low | 41.5 | Very low | 135 Ų | 135 | 128.3 Ų | 128.3 | 69% | 0.692 | 76% | 0.76 | S | S | * | * | trans | -72.9 | 87.1 | 159 | -51.3 | 173.1 | 0 | 0 | 0 | 103.1 | C7 T11 | C7-I9 HydrophobicContact CB-CD1 4.35Å; C7-I9 HydrophobicContact CB-CG1 3.86Å; C7-I9 PolarHBondContact O-N 3.05Å; I9-T11 HydrophobicContact CG2-CG2 4.48Å; I9-T11 PolarHBondContact O-N 3.06Å | ||
| 10 | E | 39.8 | Very low | 41.4 | Very low | 144 Ų | 144 | 126.3 Ų | 126.3 | 67% | 0.673 | 75% | 0.753 | S | S | * | * | trans | -66.7 | 97 | 165.5 | -160.3 | 167.7 | 165.6 | 0 | 0 | 105.5 | I8 M12 | I8-E10 HydrophobicContact CG2-CB 4.33Å; I8-E10 PolarHBondContact O-N 2.89Å; E10-M12 HydrophobicContact CG-CE 4.43Å; E10-M12 PolarHBondContact O-N 3.08Å | ||
| 11 | T | 45.2 | Very low | 41.2 | Very low | 115 Ų | 115 | 128 Ų | 128 | 71% | 0.706 | 75% | 0.754 | S | S | * | * | trans | -58.1 | 93.1 | 168.9 | 49.3 | 0 | 0 | 0 | 0 | 106.6 | I9 S13 | I9-T11 HydrophobicContact CG2-CG2 4.48Å; I9-T11 PolarHBondContact O-N 3.06Å; T11-S13 PolarHBondContact O-N 2.75Å | ||
| 12 | M | 40.1 | Very low | 40.9 | Very low | 150 Ų | 150 | 122.9 Ų | 122.9 | 74% | 0.739 | 74% | 0.74 | S | S | * | * | trans | -61.9 | 93.5 | 163.1 | -77.5 | -84.2 | 101.2 | 0 | 0 | 106.1 | E10 C14 | E10-M12 HydrophobicContact CG-CE 4.43Å; E10-M12 PolarHBondContact O-N 3.08Å; M12-C14 PolarHBondContact O-N 2.8Å; M12-C14 VanDerWaalsContact O-N 3.08Å | ||
| 13 | S | 43.8 | Very low | 41 | Very low | 95 Ų | 95 | 119.5 Ų | 119.5 | 66% | 0.664 | 73% | 0.727 | S | S | * | * | trans | -46.1 | 113 | 168.9 | -176.9 | 0 | 0 | 0 | 0 | 108.1 | T11 S15 | T11-S13 PolarHBondContact O-N 2.75Å; S13-S15 PolarHBondContact O-N 2.79Å | ||
| 14 | C | 39.3 | Very low | 40.7 | Very low | 122 Ų | 122 | 121.1 Ų | 121.1 | 82% | 0.824 | 73% | 0.731 | S | S | * | * | trans | -61.6 | 84.5 | 166.9 | -51.2 | 0 | 0 | 0 | 0 | 107.1 | M12 S16 | M12-C14 PolarHBondContact O-N 2.8Å; M12-C14 VanDerWaalsContact O-N 3.08Å; C14-S16 VanDerWaalsContact C-N 3.32Å; C14-S16 PolarHBondContact O-N 3.11Å | ||
| 15 | S | 37.9 | Very low | 40.5 | Very low | 103 Ų | 103 | 123 Ų | 123 | 72% | 0.72 | 73% | 0.727 | S | S | * | * | trans | -71.7 | 98.3 | 170.1 | -62.5 | 0 | 0 | 0 | 0 | 106.1 | S13 V17 | S13-S15 PolarHBondContact O-N 2.79Å; S15-V17 PolarHBondContact O-N 3.38Å | ||
| 16 | S | 40.1 | Very low | 40.5 | Very low | 105 Ų | 105 | 128.6 Ų | 128.6 | 73% | 0.734 | 73% | 0.733 | S | S | * | * | trans | -46.7 | 103.7 | 163.5 | -46.8 | 0 | 0 | 0 | 0 | 108 | C14 T18 | C14-S16 VanDerWaalsContact C-N 3.32Å; C14-S16 PolarHBondContact O-N 3.11Å; S16-T18 PolarHBondContact O-N 2.96Å | ||
| 17 | V | 44.1 | Very low | 40.5 | Very low | 136 Ų | 136 | 130.2 Ų | 130.2 | 82% | 0.824 | 74% | 0.737 | S | S | * | * | trans | -69.7 | 91.2 | 161.2 | 64.8 | 0 | 0 | 0 | 0 | 105.4 | S15 G19 | S15-V17 PolarHBondContact O-N 3.38Å; V17-G19 PolarHBondContact O-N 2.88Å | ||
| 18 | T | 39.6 | Very low | 40.3 | Very low | 114 Ų | 114 | 134.3 Ų | 134.3 | 70% | 0.699 | 75% | 0.746 | S | S | * | * | trans | -47.1 | 126.6 | 158.8 | 50.3 | 0 | 0 | 0 | 0 | 106.3 | S16 S20 | S16-T18 PolarHBondContact O-N 2.96Å; T18-S20 VanDerWaalsContact C-N 3.33Å; T18-S20 PolarHBondContact O-N 2.93Å | ||
| 19 | G | 44.6 | Very low | 40.6 | Very low | 81 Ų | 81 | 136 Ų | 136 | 84% | 0.835 | 76% | 0.755 | S | S | * | * | trans | -51.4 | 101.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 109 | V17 E21 | V17-G19 PolarHBondContact O-N 2.88Å; G19-E21 PolarHBondContact O-N 2.98Å | ||
| 20 | S | 40.4 | Very low | 40.5 | Very low | 89 Ų | 89 | 133 Ų | 133 | 62% | 0.622 | 76% | 0.758 | S | S | * | * | trans | -79 | 111 | 168.2 | -176.7 | 0 | 0 | 0 | 0 | 105.1 | T18 F22 | T18-S20 VanDerWaalsContact C-N 3.33Å; T18-S20 PolarHBondContact O-N 2.93Å; S20-F22 PolarHBondContact O-N 3.05Å | ||
| 21 | E | 37.6 | Very low | 40.8 | Very low | 162 Ų | 162 | 132.2 Ų | 132.2 | 76% | 0.757 | 76% | 0.762 | S | S | * | * | trans | -1.3 | 102.2 | 158 | 58.5 | -121 | 99.6 | 0 | 0 | 114.8 | G19 S23 | G19-E21 PolarHBondContact O-N 2.98Å; E21-S23 VanDerWaalsContact C-N 3.28Å; E21-S23 PolarHBondContact O-N 3.15Å | ||
| 22 | F | 29.3 | Very low | 40.7 | Very low | 194 Ų | 194 | 135.4 Ų | 135.4 | 85% | 0.851 | 77% | 0.774 | S | S | * | * | trans | -62.6 | 99.3 | 156.5 | 178.6 | -96.6 | 0 | 0 | 0 | 106.3 | S20 E24 | S20-F22 PolarHBondContact O-N 3.05Å; F22-E24 PolarHBondContact O-N 3.05Å; F22-E24 VanDerWaalsContact O-N 3.12Å | ||
| 23 | S | 36.4 | Very low | 41 | Very low | 67 Ų | 67 | 131.5 Ų | 131.5 | 47% | 0.469 | 77% | 0.772 | S | S | . | * | trans | -40.6 | 117.7 | 175.1 | -167.1 | 0 | 0 | 0 | 0 | 109.7 | E21 E25 | E21-S23 VanDerWaalsContact C-N 3.28Å; E21-S23 PolarHBondContact O-N 3.15Å; S23-E25 VanDerWaalsContact CB-OE1 3.28Å; S23-E25 WeakPolarHBondContact CB-OE1 3.11Å; S23-E25 PolarHBondContact O-N 3.16Å; S23-E25 PolarHBondContact OG-OE1 3.4Å | ||
| 24 | E | 37.4 | Very low | 40.9 | Very low | 185 Ų | 185 | 136.3 Ų | 136.3 | 86% | 0.864 | 78% | 0.784 | S | S | * | * | trans | -76.2 | 26.2 | -170.3 | 52 | -171 | 116.1 | 0 | 0 | 113.7 | F22 | F22-E24 PolarHBondContact O-N 3.05Å; F22-E24 VanDerWaalsContact O-N 3.12Å | ||
| 25 | E | 39.4 | Very low | 40.7 | Very low | 154 Ų | 154 | 133.4 Ų | 133.4 | 72% | 0.72 | 78% | 0.775 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.4 | 9.2 | -166.6 | 69.6 | -160.7 | 136.6 | 0 | 0 | 116.2 | S23 | S23-E25 VanDerWaalsContact CB-OE1 3.28Å; S23-E25 WeakPolarHBondContact CB-OE1 3.11Å; S23-E25 PolarHBondContact O-N 3.16Å; S23-E25 PolarHBondContact OG-OE1 3.4Å |
| 26 | E | 40.9 | Very low | 40.6 | Very low | 188 Ų | 188 | 136.8 Ų | 136.8 | 88% | 0.879 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.6 | 22.5 | 174 | -78.2 | -136 | 133.7 | 0 | 0 | 114.6 | ||
| 27 | L | 44.4 | Very low | 40.7 | Very low | 156 Ų | 156 | 139.8 Ų | 139.8 | 82% | 0.817 | 79% | 0.792 | S | S | * | * | trans | -102.3 | 4.2 | 174.2 | -144.5 | 130.4 | 0 | 0 | 0 | 114.9 | ||||
| 28 | E | 39.8 | Very low | 40.9 | Very low | 187 Ų | 187 | 140.5 Ų | 140.5 | 87% | 0.874 | 79% | 0.792 | S | S | * | * | trans | -104 | 53.1 | 176.9 | -73.9 | -168.9 | 156.1 | 0 | 0 | 113.6 | ||||
| 29 | I | 48.5 | Very low | 40.9 | Very low | 175 Ų | 175 | 138.6 Ų | 138.6 | 90% | 0.897 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -128.4 | 74.7 | 157.9 | -65.2 | -178.8 | 0 | 0 | 0 | 107.2 | ||
| 30 | G | 42.6 | Very low | 40.4 | Very low | 72 Ų | 72 | 137.9 Ų | 137.9 | 74% | 0.742 | 79% | 0.787 | S | S | * | * | S | Bend | trans | 176.9 | 1.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||
| 31 | V | 45.3 | Very low | 40.3 | Very low | 126 Ų | 126 | 140.3 Ų | 140.3 | 76% | 0.764 | 80% | 0.798 | S | S | * | * | trans | -131.5 | 63 | -176.7 | -168.4 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 32 | L | 43.7 | Very low | 40.5 | Very low | 183 Ų | 183 | 142.1 Ų | 142.1 | 96% | 0.958 | 80% | 0.803 | S | S | * | * | trans | -117.9 | 78.4 | 154.7 | -71.3 | -178.7 | 0 | 0 | 0 | 107.5 | ||||
| 33 | G | 46.8 | Very low | 40.9 | Very low | 67 Ų | 67 | 142.4 Ų | 142.4 | 69% | 0.691 | 81% | 0.807 | S | S | * | * | trans | -136.1 | 65.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 34 | Q | 41.4 | Very low | 41 | Very low | 197 Ų | 197 | 143.8 Ų | 143.8 | 92% | 0.921 | 82% | 0.816 | S | S | * | * | trans | -168.7 | 123.6 | 173.8 | -144.7 | 116.1 | 45.6 | 0 | 0 | 105.3 | ||||
| 35 | G | 33.8 | Very low | 41 | Very low | 61 Ų | 61 | 145.2 Ų | 145.2 | 63% | 0.629 | 82% | 0.82 | S | S | * | * | cis | 168.3 | 138.6 | 0.2 | 0 | 0 | 0 | 0 | 0 | 104.3 | ||||
| 36 | D | 35.6 | Very low | 41.3 | Very low | 173 Ų | 173 | 147.1 Ų | 147.1 | 93% | 0.925 | 83% | 0.829 | S | S | * | * | trans | -146.5 | 93.1 | 162.8 | -75.8 | -50.6 | 0 | 0 | 0 | 107.1 | ||||
| 37 | D | 44.2 | Very low | 40.8 | Very low | 168 Ų | 168 | 142 Ų | 142 | 90% | 0.898 | 83% | 0.827 | S | S | * | * | trans | -89 | 102 | 158.8 | 178.9 | -113.9 | 0 | 0 | 0 | 105.7 | ||||
| 38 | D | 46.5 | Very low | 40.4 | Very low | 152 Ų | 152 | 140.2 Ų | 140.2 | 81% | 0.813 | 83% | 0.828 | S | S | * | * | trans | -128.7 | 108.3 | 166.6 | -171.8 | -109.5 | 0 | 0 | 0 | 108.7 | ||||
| 39 | G | 41.2 | Very low | 40.6 | Very low | 74 Ų | 74 | 136.8 Ų | 136.8 | 76% | 0.763 | 82% | 0.821 | S | S | * | * | trans | -84.7 | 123.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 40 | G | 33.8 | Very low | 39.7 | Very low | 65 Ų | 65 | 134 Ų | 134 | 67% | 0.67 | 82% | 0.818 | S | S | * | * | trans | -158.7 | 85 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 41 | V | 38.7 | Very low | 39.7 | Very low | 140 Ų | 140 | 138 Ų | 138 | 85% | 0.848 | 82% | 0.822 | S | S | * | * | trans | 61.6 | 98 | 146.8 | -164.5 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 42 | K | 40.2 | Very low | 39.8 | Very low | 200 Ų | 200 | 136.7 Ų | 136.7 | 87% | 0.87 | 82% | 0.816 | S | S | * | * | trans | 16.5 | 111.4 | 131.5 | -59.9 | -179.5 | 178.1 | 178.8 | 0 | 118.2 | ||||
| 43 | Q | 38.8 | Very low | 39.6 | Very low | 201 Ų | 201 | 137.3 Ų | 137.3 | 94% | 0.939 | 81% | 0.814 | S | S | * | * | trans | -127.3 | 127.2 | 134.6 | -78.5 | -170.4 | -12.5 | 0 | 0 | 110 | ||||
| 44 | S | 38.1 | Very low | 39.8 | Very low | 95 Ų | 95 | 143.5 Ų | 143.5 | 66% | 0.664 | 83% | 0.825 | S | S | * | * | trans | -91.4 | 123.4 | -174.6 | 159.8 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 45 | F | 37.2 | Very low | 40.2 | Very low | 216 Ų | 216 | 137.1 Ų | 137.1 | 95% | 0.947 | 81% | 0.812 | S | S | * | * | trans | -145.3 | 119.8 | 141.9 | -95.2 | -78.3 | 0 | 0 | 0 | 109.4 | ||||
| 46 | Q | 45 | Very low | 40.9 | Very low | 193 Ų | 193 | 142.9 Ų | 142.9 | 90% | 0.902 | 82% | 0.823 | S | S | * | * | trans | -75.3 | 144.9 | 177.6 | -78.3 | 173.9 | -3.7 | 0 | 0 | 111.4 | ||||
| 47 | G | 31.3 | Very low | 41.4 | Very low | 81 Ų | 81 | 141 Ų | 141 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | trans | 172 | 74.7 | 163.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 48 | S | 36.7 | Very low | 41.9 | Very low | 119 Ų | 119 | 142.3 Ų | 142.3 | 83% | 0.832 | 81% | 0.81 | S | S | * | * | trans | -87.4 | 163.2 | 157.2 | -110.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 49 | P | 43.7 | Very low | 42.5 | Very low | 114 Ų | 114 | 144.1 Ų | 144.1 | 74% | 0.74 | 81% | 0.811 | S | S | * | * | cis | -148.4 | 174 | 32.3 | 38.6 | -16.2 | 0 | 0 | 0 | 118.4 | ||||
| 50 | S | 30.4 | Very low | 43.5 | Very low | 117 Ų | 117 | 151.4 Ų | 151.4 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | trans | 95.4 | 105.5 | 146.9 | -64.7 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 51 | D | 41.2 | Very low | 44.7 | Very low | 155 Ų | 155 | 155.1 Ų | 155.1 | 83% | 0.829 | 82% | 0.82 | S | S | * | * | trans | -23.2 | -174.9 | 143.2 | -116.5 | -37.1 | 0 | 0 | 0 | 120 | ||||
| 52 | P | 46.8 | Very low | 45.8 | Very low | 100 Ų | 100 | 157.8 Ų | 157.8 | 65% | 0.649 | 82% | 0.815 | S | S | * | * | cis | -129.6 | 146.9 | -32.6 | 25.3 | -6 | 0 | 0 | 0 | 112.3 | ||||
| 53 | E | 40.1 | Very low | 46.8 | Very low | 195 Ų | 195 | 152.2 Ų | 152.2 | 91% | 0.911 | 80% | 0.799 | S | S | * | * | trans | -129 | 130.7 | 163.7 | -81.2 | -82.8 | 119.5 | 0 | 0 | 111.1 | G55 | E53-G55 PolarHBondContact O-N 2.9Š| ||
| 54 | E | 50.7 | Low | 47.8 | Very low | 198 Ų | 198 | 148.5 Ų | 148.5 | 93% | 0.925 | 79% | 0.79 | S | S | * | * | trans | -53.1 | 114 | -169.6 | -77 | 175.2 | 88.1 | 0 | 0 | 114.6 | ||||
| 55 | G | 49.8 | Very low | 49.1 | Very low | 63 Ų | 63 | 153 Ų | 153 | 65% | 0.649 | 79% | 0.793 | S | S | * | * | trans | -140.8 | 27 | 164.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | E53 N57 | E53-G55 PolarHBondContact O-N 2.9Å; G55-N57 PolarHBondContact O-N 3.25Å | ||
| 56 | Q | 49.2 | Very low | 51.2 | Low | 181 Ų | 181 | 143.6 Ų | 143.6 | 85% | 0.846 | 75% | 0.753 | S | S | * | * | trans | -78.1 | 60.8 | 175.4 | -70.7 | -169.4 | -12.4 | 0 | 0 | 111.2 | K58 | Q56-K58 PolarHBondContact O-N 2.04Š| ||
| 57 | N | 45 | Very low | 53.2 | Low | 135 Ų | 135 | 141.5 Ų | 141.5 | 72% | 0.722 | 74% | 0.741 | S | S | * | * | trans | -55.5 | 104 | 144.4 | -78.7 | -42.7 | 0 | 0 | 0 | 105.4 | G55 K59 | G55-N57 PolarHBondContact O-N 3.25Å; N57-K59 PolarHBondContact O-N 2.77Å | ||
| 58 | K | 55.8 | Low | 56.1 | Low | 194 Ų | 194 | 140.5 Ų | 140.5 | 84% | 0.843 | 73% | 0.725 | S | S | * | * | trans | -56.4 | 75.5 | 170.5 | -74 | 166.4 | 175.5 | 166.4 | 0 | 108.2 | Q56 R60 | Q56-K58 PolarHBondContact O-N 2.04Å; K58-R60 PolarHBondContact O-N 3.36Å | ||
| 59 | K | 59.6 | Low | 58.8 | Low | 190 Ų | 190 | 143 Ų | 143 | 83% | 0.826 | 72% | 0.716 | S | S | * | * | trans | -67.4 | 77.8 | 161.8 | -71.9 | 173 | -179.9 | 173.2 | 0 | 103.8 | N57 N61 | N57-K59 PolarHBondContact O-N 2.77Å; K59-N61 VanDerWaalsContact C-N 3.33Å; K59-N61 PolarHBondContact O-N 3.26Å | ||
| 60 | R | 60.6 | Low | 61.3 | Low | 227 Ų | 227 | 144.9 Ų | 144.9 | 86% | 0.857 | 71% | 0.709 | S | S | * | * | trans | -44.4 | 105.3 | 172.5 | -163.3 | 177 | -173.7 | -175.2 | 3.5 | 104.5 | K58 R62 | K58-R60 PolarHBondContact O-N 3.36Å; R60-R62 PolarHBondContact O-N 3.05Å | ||
| 61 | N | 59.1 | Low | 64.3 | Low | 144 Ų | 144 | 144.1 Ų | 144.1 | 77% | 0.77 | 69% | 0.693 | S | S | * | * | trans | -56.2 | 88.2 | 174.2 | 174.4 | 4 | 0 | 0 | 0 | 105.2 | K59 P63 | K59-N61 VanDerWaalsContact C-N 3.33Å; K59-N61 PolarHBondContact O-N 3.26Å; N61-P63 WeakPolarHBondContact O-CD 2.88Å; N61-P63 VanDerWaalsContact O-N 3.15Å | ||
| 62 | R | 61.8 | Low | 66.9 | Low | 196 Ų | 196 | 139.2 Ų | 139.2 | 74% | 0.74 | 67% | 0.674 | S | S | * | * | trans | -78.2 | 105.4 | -177.7 | -159.7 | 173.1 | -175.2 | 176.8 | 2.5 | 102.7 | R60 | R60-R62 PolarHBondContact O-N 3.05Š| ||
| 63 | P | 62.3 | Low | 69.3 | Low | 83 Ų | 83 | 136.2 Ų | 136.2 | 54% | 0.539 | 66% | 0.658 | S | S | . | * | trans | -57.6 | 153.8 | -165.4 | -22.6 | 34.1 | 0 | 0 | 0 | 109.8 | N61 R65 S66 | N61-P63 WeakPolarHBondContact O-CD 2.88Å; N61-P63 VanDerWaalsContact O-N 3.15Å; P63-R65 HydrophobicContact CB-CB 4.48Å; P63-R65 CarbonylContact O-C 3.51Å; P63-R65 WeakPolarHBondContact O-CA 3.43Å; P63-R65 PolarHBondContact O-N 3.21Å; P63-S66 PolarHBondContact O-N 2.99Å | ||
| 64 | V | 60.6 | Low | 72.1 | Confident | 123 Ų | 123 | 131 Ų | 131 | 75% | 0.745 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -39.7 | -26.9 | 177.1 | 175.8 | 0 | 0 | 0 | 0 | 113.9 | S66 K67 A68 | V64-S66 PolarHBondContact O-N 3.49Å; V64-K67 PolarHBondContact O-N 3.38Å; V64-A68 PolarHBondContact O-N 2.88Å |
| 65 | R | 64.9 | Low | 74.4 | Confident | 190 Ų | 190 | 125.9 Ų | 125.9 | 72% | 0.717 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -44.1 | -27.1 | 164.2 | -164.1 | 170.1 | -174.4 | 170.2 | 1.8 | 114.7 | P63 R69 | P63-R65 HydrophobicContact CB-CB 4.48Å; P63-R65 CarbonylContact O-C 3.51Å; P63-R65 WeakPolarHBondContact O-CA 3.43Å; P63-R65 PolarHBondContact O-N 3.21Å; R65-R69 HydrophobicContact CG-CG 4.37Å; R65-R69 WeakPolarHBondContact O-CB 3.39Å; R65-R69 WeakPolarHBondContact O-CD 3.29Å; R65-R69 WeakPolarHBondContact O-CG 3.43Å; R65-R69 PolarHBondContact O-N 3.16Å |
| 66 | S | 81 | Confident | 76.7 | Confident | 18 Ų | 18 | 131.3 Ų | 131.3 | 13% | 0.126 | 62% | 0.62 | C | S | . | * | H | α-helix | trans | -77.6 | -36.3 | 176.2 | 177.4 | 0 | 0 | 0 | 0 | 113.7 | P63 V64 R70 | P63-S66 PolarHBondContact O-N 2.99Å; V64-S66 PolarHBondContact O-N 3.49Å; S66-R70 WeakPolarHBondContact O-CB 3.45Å; S66-R70 VanDerWaalsContact O-CG 3.22Å; S66-R70 WeakPolarHBondContact O-CG 3.47Å; S66-R70 PolarHBondContact O-N 3.45Å; S66-R70 PolarHBondContact O-NE 3.43Å; S66-R70 PolarHBondContact OG-NH2 3.26Å |
| 67 | K | 87.7 | Confident | 79 | Confident | 148 Ų | 148 | 125.9 Ų | 125.9 | 64% | 0.643 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -78.7 | -49.4 | -179.7 | -169 | 179 | 178.7 | -175 | 0 | 110.3 | V64 R69 R70 M71 | V64-K67 PolarHBondContact O-N 3.38Å; K67-R69 PolarHBondContact O-N 2.89Å; K67-R70 PolarHBondContact O-N 3.17Å; K67-R70 VanDerWaalsContact O-N 3.15Å; K67-M71 WeakPolarHBondContact O-CG 3.28Å; K67-M71 PolarHBondContact O-N 2.95Å |
| 68 | A | 90.3 | Very high | 81.6 | Confident | 60 Ų | 60 | 128.5 Ų | 128.5 | 50% | 0.496 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -58.8 | -44.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | V64 R70 M71 A72 | V64-A68 PolarHBondContact O-N 2.88Å; A68-R70 PolarHBondContact O-N 2.93Å; A68-M71 PolarHBondContact O-N 3.49Å; A68-A72 PolarHBondContact O-N 3.09Å |
| 69 | R | 93.5 | Very high | 83.6 | Confident | 172 Ų | 172 | 125.5 Ų | 125.5 | 65% | 0.649 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -64.1 | -37.6 | 176.2 | -73.1 | 173.8 | 67.1 | -162.4 | 2.4 | 113.2 | R65 K67 A73 | R65-R69 HydrophobicContact CG-CG 4.37Å; R65-R69 WeakPolarHBondContact O-CB 3.39Å; R65-R69 WeakPolarHBondContact O-CD 3.29Å; R65-R69 WeakPolarHBondContact O-CG 3.43Å; R65-R69 PolarHBondContact O-N 3.16Å; K67-R69 PolarHBondContact O-N 2.89Å; R69-A73 WeakPolarHBondContact O-CB 3.39Å; R69-A73 PolarHBondContact O-N 2.97Å |
| 70 | R | 96 | Very high | 85.5 | Confident | 153 Ų | 153 | 123.5 Ų | 123.5 | 58% | 0.577 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -64.5 | -44 | 175.3 | -81.7 | -176.3 | -74.7 | 162.8 | -3.1 | 110.8 | S66 K67 A68 A73 N74 | S66-R70 WeakPolarHBondContact O-CB 3.45Å; S66-R70 VanDerWaalsContact O-CG 3.22Å; S66-R70 WeakPolarHBondContact O-CG 3.47Å; S66-R70 PolarHBondContact O-N 3.45Å; S66-R70 PolarHBondContact O-NE 3.43Å; S66-R70 PolarHBondContact OG-NH2 3.26Å; K67-R70 PolarHBondContact O-N 3.17Å; K67-R70 VanDerWaalsContact O-N 3.15Å; A68-R70 PolarHBondContact O-N 2.93Å; R70-A73 PolarHBondContact O-N 2.9Å; R70-N74 VanDerWaalsContact O-CG 3.28Å; R70-N74 PolarHBondContact O-N 2.99Å |
| 71 | M | 95.1 | Very high | 87.3 | Confident | 101 Ų | 101 | 116 Ų | 116 | 50% | 0.498 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -60.6 | -49.2 | 176 | -68.8 | -52.1 | -55.4 | 0 | 0 | 111.8 | K67 A68 A73 N74 V75 | K67-M71 WeakPolarHBondContact O-CG 3.28Å; K67-M71 PolarHBondContact O-N 2.95Å; A68-M71 PolarHBondContact O-N 3.49Å; M71-A73 VanDerWaalsContact C-N 3.3Å; M71-A73 PolarHBondContact O-N 3.3Å; M71-N74 WeakPolarHBondContact O-CB 3.44Å; M71-N74 PolarHBondContact O-N 3.15Å; M71-N74 VanDerWaalsContact O-N 3.11Å; M71-V75 WeakPolarHBondContact O-CG2 3.48Å; M71-V75 PolarHBondContact O-N 3.41Å |
| 72 | A | 96 | Very high | 89.2 | Confident | 52 Ų | 52 | 113.7 Ų | 113.7 | 43% | 0.43 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59.4 | -39.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | A68 V75 R76 | A68-A72 PolarHBondContact O-N 3.09Å; A72-V75 PolarHBondContact O-N 3.47Å; A72-R76 WeakPolarHBondContact O-CG 3.28Å; A72-R76 PolarHBondContact O-N 3.17Å; A72-R76 VanDerWaalsContact O-N 3.12Å |
| 73 | A | 96.9 | Very high | 90.9 | Very high | 38 Ų | 38 | 107.9 Ų | 107.9 | 31% | 0.314 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.3 | -43.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | R69 R70 M71 V75 R76 E77 | R69-A73 WeakPolarHBondContact O-CB 3.39Å; R69-A73 PolarHBondContact O-N 2.97Å; R70-A73 PolarHBondContact O-N 2.9Å; M71-A73 VanDerWaalsContact C-N 3.3Å; M71-A73 PolarHBondContact O-N 3.3Å; A73-V75 PolarHBondContact O-N 3.26Å; A73-R76 PolarHBondContact O-N 2.95Å; A73-E77 WeakPolarHBondContact O-CB 3.38Å; A73-E77 PolarHBondContact O-N 2.87Å |
| 74 | N | 97.9 | Very high | 92.7 | Very high | 86 Ų | 86 | 109 Ų | 109 | 46% | 0.46 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.2 | -38.8 | 177.7 | -72.4 | -10.8 | 0 | 0 | 0 | 112.4 | R70 M71 E77 R78 | R70-N74 VanDerWaalsContact O-CG 3.28Å; R70-N74 PolarHBondContact O-N 2.99Å; M71-N74 WeakPolarHBondContact O-CB 3.44Å; M71-N74 PolarHBondContact O-N 3.15Å; M71-N74 VanDerWaalsContact O-N 3.11Å; N74-E77 PolarHBondContact O-N 3.15Å; N74-R78 WeakPolarHBondContact O-CG 3.49Å; N74-R78 PolarHBondContact O-N 3.46Å |
| 75 | V | 98.4 | Very high | 94.5 | Very high | 90 Ų | 90 | 106 Ų | 106 | 55% | 0.545 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.3 | -47.7 | 175.4 | 170.6 | 0 | 0 | 0 | 0 | 110.5 | M71 A72 A73 E77 R78 K79 | M71-V75 WeakPolarHBondContact O-CG2 3.48Å; M71-V75 PolarHBondContact O-N 3.41Å; A72-V75 PolarHBondContact O-N 3.47Å; A73-V75 PolarHBondContact O-N 3.26Å; V75-E77 VanDerWaalsContact C-N 3.29Å; V75-E77 PolarHBondContact O-N 2.83Å; V75-R78 PolarHBondContact O-N 3.25Å; V75-K79 PolarHBondContact O-N 3.35Å |
| 76 | R | 98.6 | Very high | 96 | Very high | 177 Ų | 177 | 102.2 Ų | 102.2 | 67% | 0.668 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -60.9 | -39.7 | 175.9 | -68.9 | -173.5 | -56.2 | -156.8 | 5.4 | 112.2 | A72 A73 K79 R80 | A72-R76 WeakPolarHBondContact O-CG 3.28Å; A72-R76 PolarHBondContact O-N 3.17Å; A72-R76 VanDerWaalsContact O-N 3.12Å; A73-R76 PolarHBondContact O-N 2.95Å; R76-K79 PolarHBondContact O-N 2.77Å; R76-R80 PolarHBondContact O-N 3.03Å |
| 77 | E | 98.6 | Very high | 96.9 | Very high | 67 Ų | 67 | 104.4 Ų | 104.4 | 31% | 0.313 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.5 | -48 | 177.1 | -179.1 | 56.8 | -150.5 | 0 | 0 | 111.7 | A73 N74 V75 K79 R80 I81 | A73-E77 WeakPolarHBondContact O-CB 3.38Å; A73-E77 PolarHBondContact O-N 2.87Å; N74-E77 PolarHBondContact O-N 3.15Å; V75-E77 VanDerWaalsContact C-N 3.29Å; V75-E77 PolarHBondContact O-N 2.83Å; E77-K79 VanDerWaalsContact C-N 3.28Å; E77-K79 PolarHBondContact O-N 2.72Å; E77-R80 WeakPolarHBondContact O-CB 3.47Å; E77-R80 PolarHBondContact O-N 2.86Å; E77-R80 VanDerWaalsContact O-N 3.14Å; E77-R80 IonicContact OE1-CZ 3.1Å; E77-R80 IonicContact OE1-NE 3.65Å; E77-R80 IonicContact OE1-NH1 3.69Å; E77-R80 IonicContact OE1-NH2 2.58Å; E77-R80 PolarHBondContact OE1-NH2 3.23Å; E77-R80 IonicContact OE2-CZ 2.87Å; E77-R80 IonicContact OE2-NE 3.64Å; E77-R80 IonicContact OE2-NH1 2.62Å; E77-R80 PolarHBondContact OE2-NH1 3.43Å; E77-R80 IonicContact OE2-NH2 3.06Å; E77-R80 PolarHBondContact OE2-NH2 3.36Å; E77-I81 WeakPolarHBondContact O-CG1 3.41Å; E77-I81 PolarHBondContact O-N 3.49Å; E77-I81 WeakPolarHBondContact OE1-CD1 3.4Å; E77-I81 WeakPolarHBondContact OE1-CG1 3.42Å |
| 78 | R | 98.7 | Very high | 97.4 | Very high | 190 Ų | 190 | 98 Ų | 98 | 72% | 0.717 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -57.2 | -43.3 | 175.6 | -75.4 | 178.5 | 179.5 | 176.7 | -0.9 | 111.4 | N74 V75 I81 M82 | N74-R78 WeakPolarHBondContact O-CG 3.49Å; N74-R78 PolarHBondContact O-N 3.46Å; V75-R78 PolarHBondContact O-N 3.25Å; R78-I81 PolarHBondContact O-N 3.1Å; R78-M82 WeakPolarHBondContact O-CB 3.21Å; R78-M82 PolarHBondContact O-N 3.42Å |
| 79 | K | 98.8 | Very high | 97.7 | Very high | 131 Ų | 131 | 97.2 Ų | 97.2 | 57% | 0.57 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -59.8 | -49 | 174.5 | -179 | 166.6 | -178.2 | 153.9 | 0 | 111.6 | V75 R76 E77 I81 M82 D83 | V75-K79 PolarHBondContact O-N 3.35Å; R76-K79 PolarHBondContact O-N 2.77Å; E77-K79 VanDerWaalsContact C-N 3.28Å; E77-K79 PolarHBondContact O-N 2.72Å; K79-I81 VanDerWaalsContact C-N 3.3Å; K79-I81 PolarHBondContact O-N 3.01Å; K79-M82 WeakPolarHBondContact O-CB 3.42Å; K79-M82 PolarHBondContact O-N 3.12Å; K79-M82 VanDerWaalsContact O-N 3.12Å; K79-D83 VanDerWaalsContact O-CG 3.27Å; K79-D83 PolarHBondContact O-N 2.92Å |
| 80 | R | 98.8 | Very high | 97.9 | Very high | 148 Ų | 148 | 92 Ų | 92 | 56% | 0.558 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -56.5 | -44.5 | 177 | -169.4 | -171.6 | 78 | -151.8 | 7.1 | 112.2 | R76 E77 D83 Y84 | R76-R80 PolarHBondContact O-N 3.03Å; E77-R80 WeakPolarHBondContact O-CB 3.47Å; E77-R80 PolarHBondContact O-N 2.86Å; E77-R80 VanDerWaalsContact O-N 3.14Å; E77-R80 IonicContact OE1-CZ 3.1Å; E77-R80 IonicContact OE1-NE 3.65Å; E77-R80 IonicContact OE1-NH1 3.69Å; E77-R80 IonicContact OE1-NH2 2.58Å; E77-R80 PolarHBondContact OE1-NH2 3.23Å; E77-R80 IonicContact OE2-CZ 2.87Å; E77-R80 IonicContact OE2-NE 3.64Å; E77-R80 IonicContact OE2-NH1 2.62Å; E77-R80 PolarHBondContact OE2-NH1 3.43Å; E77-R80 IonicContact OE2-NH2 3.06Å; E77-R80 PolarHBondContact OE2-NH2 3.36Å; R80-D83 PolarHBondContact O-N 3.32Å; R80-Y84 WeakPolarHBondContact O-CB 3.47Å; R80-Y84 PolarHBondContact O-N 3.45Å |
| 81 | I | 98.6 | Very high | 98 | Very high | 70 Ų | 70 | 87.3 Ų | 87.3 | 36% | 0.359 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -69.2 | -35.5 | 179.6 | -63.4 | -57.1 | 0 | 0 | 0 | 111.5 | E77 R78 K79 N85 | E77-I81 WeakPolarHBondContact O-CG1 3.41Å; E77-I81 PolarHBondContact O-N 3.49Å; E77-I81 WeakPolarHBondContact OE1-CD1 3.4Å; E77-I81 WeakPolarHBondContact OE1-CG1 3.42Å; R78-I81 PolarHBondContact O-N 3.1Å; K79-I81 VanDerWaalsContact C-N 3.3Å; K79-I81 PolarHBondContact O-N 3.01Å; I81-N85 WeakPolarHBondContact O-CB 3.45Å; I81-N85 VanDerWaalsContact O-CG 3.23Å; I81-N85 PolarHBondContact O-N 3.45Å; I81-N85 PolarHBondContact O-ND2 3.04Å; I81-N85 VanDerWaalsContact O-ND2 3.12Å |
| 82 | M | 98.6 | Very high | 98.1 | Very high | 95 Ų | 95 | 83.3 Ų | 83.3 | 47% | 0.468 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -61.9 | -50.9 | 173.2 | -177.5 | 179.7 | 67.9 | 0 | 0 | 111.1 | R78 K79 Y84 N85 Q86 | R78-M82 WeakPolarHBondContact O-CB 3.21Å; R78-M82 PolarHBondContact O-N 3.42Å; K79-M82 WeakPolarHBondContact O-CB 3.42Å; K79-M82 PolarHBondContact O-N 3.12Å; K79-M82 VanDerWaalsContact O-N 3.12Å; M82-Y84 VanDerWaalsContact C-N 3.31Å; M82-Y84 PolarHBondContact O-N 3.26Å; M82-N85 PolarHBondContact O-N 3.42Å; M82-Q86 WeakPolarHBondContact O-CG 3.4Å; M82-Q86 PolarHBondContact O-N 2.68Å |
| 83 | D | 98.6 | Very high | 98.1 | Very high | 73 Ų | 73 | 84.4 Ų | 84.4 | 39% | 0.39 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -59.6 | -42.9 | 179 | -61.8 | -14.9 | 0 | 0 | 0 | 110.8 | K79 R80 N85 Q86 A87 | K79-D83 VanDerWaalsContact O-CG 3.27Å; K79-D83 PolarHBondContact O-N 2.92Å; R80-D83 PolarHBondContact O-N 3.32Å; D83-N85 VanDerWaalsContact C-N 3.34Å; D83-N85 PolarHBondContact O-N 3.03Å; D83-Q86 PolarHBondContact O-N 2.99Å; D83-A87 PolarHBondContact O-N 3.46Å |
| 84 | Y | 98.5 | Very high | 98.1 | Very high | 107 Ų | 107 | 85.3 Ų | 85.3 | 42% | 0.42 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -56.8 | -46 | 172.8 | 169.8 | -86.7 | 0 | 0 | 0 | 112.1 | R80 M82 Q86 A87 F88 K106 | R80-Y84 WeakPolarHBondContact O-CB 3.47Å; R80-Y84 PolarHBondContact O-N 3.45Å; M82-Y84 VanDerWaalsContact C-N 3.31Å; M82-Y84 PolarHBondContact O-N 3.26Å; Y84-Q86 VanDerWaalsContact C-N 3.34Å; Y84-A87 PolarHBondContact O-N 3.36Å; Y84-F88 HydrophobicContact CE1-CD2 4.41Å; Y84-F88 WeakPolarHBondContact O-CB 3.47Å; Y84-F88 PolarHBondContact O-N 2.94Å; Y84-K106 HydrophobicContact CE1-CD 4.34Å |
| 85 | N | 98.1 | Very high | 98 | Very high | 60 Ų | 60 | 81.8 Ų | 81.8 | 32% | 0.321 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -69.3 | -33 | -179.7 | -73 | -34 | 0 | 0 | 0 | 112.2 | I81 M82 D83 F88 N89 | I81-N85 WeakPolarHBondContact O-CB 3.45Å; I81-N85 VanDerWaalsContact O-CG 3.23Å; I81-N85 PolarHBondContact O-N 3.45Å; I81-N85 PolarHBondContact O-ND2 3.04Å; I81-N85 VanDerWaalsContact O-ND2 3.12Å; M82-N85 PolarHBondContact O-N 3.42Å; D83-N85 VanDerWaalsContact C-N 3.34Å; D83-N85 PolarHBondContact O-N 3.03Å; N85-F88 WeakPolarHBondContact O-CB 3.46Å; N85-F88 PolarHBondContact O-N 3.29Å; N85-N89 PolarHBondContact O-N 3.05Å |
| 86 | Q | 98.1 | Very high | 97.8 | Very high | 110 Ų | 110 | 83.5 Ų | 83.5 | 51% | 0.514 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -64.7 | -48.2 | 173.8 | -72.3 | 177.1 | 2.5 | 0 | 0 | 111.2 | M82 D83 Y84 F88 N89 A90 | M82-Q86 WeakPolarHBondContact O-CG 3.4Å; M82-Q86 PolarHBondContact O-N 2.68Å; D83-Q86 PolarHBondContact O-N 2.99Å; Y84-Q86 VanDerWaalsContact C-N 3.34Å; Q86-F88 PolarHBondContact O-N 3.19Å; Q86-N89 WeakPolarHBondContact O-CB 3.32Å; Q86-N89 PolarHBondContact O-N 3.44Å; Q86-A90 PolarHBondContact O-N 3.24Å |
| 87 | A | 98.4 | Very high | 97.5 | Very high | 65 Ų | 65 | 76.9 Ų | 76.9 | 54% | 0.537 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -56.8 | -39.1 | 174 | 0 | 0 | 0 | 0 | 0 | 111.6 | D83 Y84 N89 A90 L91 | D83-A87 PolarHBondContact O-N 3.46Å; Y84-A87 PolarHBondContact O-N 3.36Å; A87-N89 VanDerWaalsContact C-N 3.35Å; A87-N89 PolarHBondContact O-N 2.98Å; A87-A90 PolarHBondContact O-N 2.98Å; A87-L91 PolarHBondContact O-N 3.26Å |
| 88 | F | 98.3 | Very high | 96.8 | Very high | 14 Ų | 14 | 78.8 Ų | 78.8 | 6% | 0.061 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -66.8 | -34.4 | 177.2 | -146.4 | -81.6 | 0 | 0 | 0 | 113.2 | Y84 N85 Q86 R92 K106 T109 L110 | Y84-F88 HydrophobicContact CE1-CD2 4.41Å; Y84-F88 WeakPolarHBondContact O-CB 3.47Å; Y84-F88 PolarHBondContact O-N 2.94Å; N85-F88 WeakPolarHBondContact O-CB 3.46Å; N85-F88 PolarHBondContact O-N 3.29Å; Q86-F88 PolarHBondContact O-N 3.19Å; F88-R92 VanDerWaalsContact CD1-CZ 3.44Å; F88-R92 WeakPolarHBondContact O-CG 3.36Å; F88-R92 PolarHBondContact O-N 2.73Å; F88-K106 HydrophobicContact CD1-CG 4.44Å; F88-K106 HydrophobicContact CE1-CB 4.13Å; F88-K106 HydrophobicContact CE1-CG 4Å; F88-K106 HydrophobicContact CE2-CB 4.22Å; F88-K106 HydrophobicContact CE2-CG 4.25Å; F88-K106 HydrophobicContact CZ-CB 3.73Å; F88-K106 HydrophobicContact CZ-CG 3.94Å; F88-K106 VanDerWaalsContact CZ-O 3.25Å; F88-K106 WeakPolarHBondContact CZ-O 3.39Å; F88-T109 HydrophobicContact CD1-CG2 4.26Å; F88-T109 HydrophobicContact CE1-CG2 3.56Å; F88-T109 WeakPolarHBondContact CE1-OG1 3.29Å; F88-T109 HydrophobicContact CZ-CG2 3.91Å; F88-L110 HydrophobicContact CE2-CD2 4.08Å; F88-L110 HydrophobicContact CE2-CG 4.21Å; F88-L110 HydrophobicContact CZ-CD2 4.37Å; F88-L110 HydrophobicContact CZ-CG 4.17Å |
| 89 | N | 97 | Very high | 96.3 | Very high | 42 Ų | 42 | 73 Ų | 73 | 23% | 0.225 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -69.1 | -43.7 | 172.2 | -78.8 | -21.4 | 0 | 0 | 0 | 111.9 | N85 Q86 A87 L91 R92 V93 L99 R103 | N85-N89 PolarHBondContact O-N 3.05Å; Q86-N89 WeakPolarHBondContact O-CB 3.32Å; Q86-N89 PolarHBondContact O-N 3.44Å; A87-N89 VanDerWaalsContact C-N 3.35Å; A87-N89 PolarHBondContact O-N 2.98Å; N89-L91 PolarHBondContact O-N 2.97Å; N89-R92 WeakPolarHBondContact O-CB 3.39Å; N89-R92 PolarHBondContact O-N 3.1Å; N89-R92 PolarHBondContact OD1-NH1 2.95Å; N89-V93 PolarHBondContact O-N 3.44Å; N89-L99 HydrophobicContact CB-CD1 3.98Å; N89-R103 PolarHBondContact OD1-NH2 2.95Å |
| 90 | A | 97.3 | Very high | 95.4 | Very high | 62 Ų | 62 | 72.3 Ų | 72.3 | 51% | 0.512 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -57.6 | -41.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111 | Q86 A87 R92 V93 A94 | Q86-A90 PolarHBondContact O-N 3.24Å; A87-A90 PolarHBondContact O-N 2.98Å; A90-R92 PolarHBondContact O-N 3.16Å; A90-V93 PolarHBondContact O-N 3.33Å; A90-A94 WeakPolarHBondContact O-CB 3.47Å; A90-A94 PolarHBondContact O-N 2.99Å |
| 91 | L | 98.1 | Very high | 94.8 | Very high | 56 Ų | 56 | 67.5 Ų | 67.5 | 29% | 0.293 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -60 | -43 | 173.4 | -179.3 | 60.2 | 0 | 0 | 0 | 112.2 | A87 N89 V93 A94 L95 T109 A113 | A87-L91 PolarHBondContact O-N 3.26Å; N89-L91 PolarHBondContact O-N 2.97Å; L91-V93 VanDerWaalsContact C-N 3.33Å; L91-V93 PolarHBondContact O-N 2.73Å; L91-A94 PolarHBondContact O-N 3.39Å; L91-L95 HydrophobicContact CD1-CD1 4.19Å; L91-L95 HydrophobicContact CD1-CG 4.22Å; L91-L95 HydrophobicContact CG-CD1 4.08Å; L91-L95 WeakPolarHBondContact O-CG 3.49Å; L91-L95 PolarHBondContact O-N 3.12Å; L91-T109 HydrophobicContact CD2-CG2 3.9Å; L91-T109 HydrophobicContact CG-CG2 3.97Å; L91-A113 HydrophobicContact CD1-CB 4.21Å; L91-A113 HydrophobicContact CD2-CB 4.37Å |
| 92 | R | 97.3 | Very high | 94.4 | Very high | 16 Ų | 16 | 73.5 Ų | 73.5 | 6% | 0.06 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -60.1 | -44.2 | 177 | -70.9 | -179.8 | -174.6 | 101.7 | 0.6 | 112 | F88 N89 A90 L95 N96 H97 L99 L104 T109 | F88-R92 VanDerWaalsContact CD1-CZ 3.44Å; F88-R92 WeakPolarHBondContact O-CG 3.36Å; F88-R92 PolarHBondContact O-N 2.73Å; N89-R92 WeakPolarHBondContact O-CB 3.39Å; N89-R92 PolarHBondContact O-N 3.1Å; N89-R92 PolarHBondContact OD1-NH1 2.95Å; A90-R92 PolarHBondContact O-N 3.16Å; R92-L95 CarbonylContact O-C 3.51Å; R92-L95 WeakPolarHBondContact O-CA 3.48Å; R92-L95 PolarHBondContact O-N 3.24Å; R92-L95 VanDerWaalsContact O-N 3.15Å; R92-N96 PolarHBondContact O-N 2.97Å; R92-H97 CarbonylContact C-O 3.58Å; R92-H97 WeakPolarHBondContact O-CB 3.46Å; R92-H97 PolarHBondContact O-N 3.04Å; R92-L99 HydrophobicContact CB-CD2 4.05Å; R92-L104 PolarHBondContact NE-O 2.96Å; R92-L104 PolarHBondContact NH2-O 3.15Å; R92-T109 HydrophobicContact CG-CG2 3.75Å |
| 93 | V | 96.6 | Very high | 94.2 | Very high | 75 Ų | 75 | 75.3 Ų | 75.3 | 46% | 0.455 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -62.8 | -46.2 | 177.1 | 174.9 | 0 | 0 | 0 | 0 | 110.4 | N89 A90 L91 L95 N96 L99 | N89-V93 PolarHBondContact O-N 3.44Å; A90-V93 PolarHBondContact O-N 3.33Å; L91-V93 VanDerWaalsContact C-N 3.33Å; L91-V93 PolarHBondContact O-N 2.73Å; V93-L95 PolarHBondContact O-N 3.41Å; V93-L95 VanDerWaalsContact O-N 3.15Å; V93-N96 WeakPolarHBondContact O-CA 3.36Å; V93-N96 PolarHBondContact O-N 2.89Å; V93-L99 HydrophobicContact CG2-CG 4.48Å |
| 94 | A | 96.5 | Very high | 94 | Very high | 58 Ų | 58 | 73.8 Ų | 73.8 | 48% | 0.479 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -59.5 | -28 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | A90 L91 N96 R116 | A90-A94 WeakPolarHBondContact O-CB 3.47Å; A90-A94 PolarHBondContact O-N 2.99Å; L91-A94 PolarHBondContact O-N 3.39Å; A94-N96 PolarHBondContact O-N 2.92Å; A94-R116 PolarHBondContact O-NH1 3.48Å; A94-R116 PolarHBondContact O-NH2 3.31Å |
| 95 | L | 96.3 | Very high | 93.9 | Very high | 12 Ų | 12 | 72.1 Ų | 72.1 | 6% | 0.063 | 41% | 0.413 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | 13.7 | 173.8 | -63.2 | 173.6 | 0 | 0 | 0 | 114 | L91 R92 V93 H97 T109 R112 A113 R116 | L91-L95 HydrophobicContact CD1-CD1 4.19Å; L91-L95 HydrophobicContact CD1-CG 4.22Å; L91-L95 HydrophobicContact CG-CD1 4.08Å; L91-L95 WeakPolarHBondContact O-CG 3.49Å; L91-L95 PolarHBondContact O-N 3.12Å; R92-L95 CarbonylContact O-C 3.51Å; R92-L95 WeakPolarHBondContact O-CA 3.48Å; R92-L95 PolarHBondContact O-N 3.24Å; R92-L95 VanDerWaalsContact O-N 3.15Å; V93-L95 PolarHBondContact O-N 3.41Å; V93-L95 VanDerWaalsContact O-N 3.15Å; L95-H97 PolarHBondContact O-N 3.36Å; L95-T109 HydrophobicContact CD1-CG2 3.88Å; L95-T109 WeakPolarHBondContact CD1-O 3.46Å; L95-R112 HydrophobicContact CD1-CB 4.14Å; L95-R112 HydrophobicContact CD1-CG 4.24Å; L95-A113 HydrophobicContact CD1-CB 4.07Å; L95-A113 HydrophobicContact CD2-CB 4.29Å; L95-R116 HydrophobicContact CD2-CB 4.09Å; L95-R116 HydrophobicContact CD2-CG 4.45Å |
| 96 | N | 93.5 | Very high | 93.9 | Very high | 126 Ų | 126 | 73.9 Ų | 73.9 | 67% | 0.674 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.9 | 39.6 | -175.6 | -54.9 | -35.5 | 0 | 0 | 0 | 112.2 | R92 V93 A94 R116 | R92-N96 PolarHBondContact O-N 2.97Å; V93-N96 WeakPolarHBondContact O-CA 3.36Å; V93-N96 PolarHBondContact O-N 2.89Å; A94-N96 PolarHBondContact O-N 2.92Å; N96-R116 PolarHBondContact ND2-NH1 3.38Å |
| 97 | H | 93.4 | Very high | 93.9 | Very high | 38 Ų | 38 | 74.3 Ų | 74.3 | 18% | 0.176 | 42% | 0.422 | C | S | . | . | trans | -115.6 | 96.3 | 172.2 | -168.4 | -60.9 | 0 | 0 | 0 | 109.6 | R92 L95 K102 L104 | R92-H97 CarbonylContact C-O 3.58Å; R92-H97 WeakPolarHBondContact O-CB 3.46Å; R92-H97 PolarHBondContact O-N 3.04Å; L95-H97 PolarHBondContact O-N 3.36Å; H97-K102 PolarHBondContact CE1-O 3.05Å; H97-L104 HydrophobicContact CB-CD1 4.08Å; H97-L104 VanDerWaalsContact CD2-CD1 3.46Å; H97-L104 WeakPolarHBondContact CD2-CD1 3.4Å; H97-L104 WeakPolarHBondContact CD2-CG 2.97Å | ||
| 98 | D | 83.8 | Confident | 93.8 | Very high | 107 Ų | 107 | 72.6 Ų | 72.6 | 57% | 0.572 | 41% | 0.408 | S | S | * | . | trans | -61.8 | 146.6 | 177.8 | -61.4 | -29.6 | 0 | 0 | 0 | 111.2 | S100 | D98-S100 PolarHBondContact O-N 3Š| ||
| 99 | L | 87.4 | Confident | 93.8 | Very high | 68 Ų | 68 | 71.9 Ų | 71.9 | 36% | 0.356 | 41% | 0.405 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | 3.7 | -179.7 | -55 | 179.1 | 0 | 0 | 0 | 112.4 | N89 R92 V93 G101 R103 | N89-L99 HydrophobicContact CB-CD1 3.98Å; R92-L99 HydrophobicContact CB-CD2 4.05Å; V93-L99 HydrophobicContact CG2-CG 4.48Å; L99-G101 VanDerWaalsContact C-N 3.26Å; L99-G101 PolarHBondContact O-N 2.98Å; L99-R103 HydrophobicContact CD2-CG 4.43Å |
| 100 | S | 80.8 | Confident | 93.9 | Very high | 116 Ų | 116 | 74 Ų | 74 | 81% | 0.811 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.6 | -19.7 | -179.2 | 56.3 | 0 | 0 | 0 | 0 | 113.4 | D98 | D98-S100 PolarHBondContact O-N 3Š|
| 101 | G | 85.7 | Confident | 93.9 | Very high | 48 Ų | 48 | 74.4 Ų | 74.4 | 50% | 0.495 | 41% | 0.407 | S | S | . | . | S | Bend | trans | -119.5 | -150.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | L99 R103 | L99-G101 VanDerWaalsContact C-N 3.26Å; L99-G101 PolarHBondContact O-N 2.98Å; G101-R103 PolarHBondContact O-N 3.41Å; G101-R103 VanDerWaalsContact O-N 3.16Å |
| 102 | K | 91.3 | Very high | 93.9 | Very high | 195 Ų | 195 | 77 Ų | 77 | 85% | 0.848 | 41% | 0.413 | S | S | * | . | S | Bend | trans | -66.2 | 114.1 | 178.9 | -175.2 | 176.3 | -179 | 177.8 | 0 | 110.7 | H97 | H97-K102 PolarHBondContact CE1-O 3.05Š|
| 103 | R | 93.4 | Very high | 94 | Very high | 134 Ų | 134 | 77 Ų | 77 | 51% | 0.506 | 42% | 0.416 | S | S | . | . | P | Polyproline II helix | trans | -65 | 138.4 | 179.8 | -63.7 | 173 | 72.3 | -170.2 | 3.4 | 111.5 | N89 L99 G101 | N89-R103 PolarHBondContact OD1-NH2 2.95Å; L99-R103 HydrophobicContact CD2-CG 4.43Å; G101-R103 PolarHBondContact O-N 3.41Å; G101-R103 VanDerWaalsContact O-N 3.16Å |
| 104 | L | 94.6 | Very high | 94.1 | Very high | 41 Ų | 41 | 76.3 Ų | 76.3 | 22% | 0.215 | 41% | 0.409 | C | S | . | . | P | Polyproline II helix | trans | -63.2 | 140.4 | 168.5 | -66.9 | 176.4 | 0 | 0 | 0 | 111.2 | R92 H97 A108 T109 | R92-L104 PolarHBondContact NE-O 2.96Å; R92-L104 PolarHBondContact NH2-O 3.15Å; H97-L104 HydrophobicContact CB-CD1 4.08Å; H97-L104 VanDerWaalsContact CD2-CD1 3.46Å; H97-L104 WeakPolarHBondContact CD2-CD1 3.4Å; H97-L104 WeakPolarHBondContact CD2-CG 2.97Å; L104-A108 HydrophobicContact CB-CB 4.43Å; L104-A108 HydrophobicContact CD2-CB 4.4Å; L104-T109 VanDerWaalsContact CB-OG1 3.27Å; L104-T109 WeakPolarHBondContact CB-OG1 3.39Å |
| 105 | S | 97.1 | Very high | 94.1 | Very high | 72 Ų | 72 | 77.7 Ų | 77.7 | 50% | 0.503 | 41% | 0.409 | S | S | . | . | P | Polyproline II helix | trans | -61.9 | 163.7 | 169.9 | 77.2 | 0 | 0 | 0 | 0 | 110.8 | I107 A108 T109 | S105-I107 VanDerWaalsContact C-N 3.35Å; S105-I107 PolarHBondContact O-N 3.45Å; S105-A108 PolarHBondContact O-N 3.2Å; S105-A108 VanDerWaalsContact OG-CB 3.29Å; S105-A108 WeakPolarHBondContact OG-CB 3.25Å; S105-A108 PolarHBondContact OG-N 2.94Å; S105-A108 VanDerWaalsContact OG-N 3.12Å; S105-T109 WeakPolarHBondContact O-CB 3.27Å; S105-T109 PolarHBondContact O-N 3.49Å; S105-T109 PolarHBondContact O-OG1 3.39Å |
| 106 | K | 97.4 | Very high | 94.2 | Very high | 97 Ų | 97 | 81.7 Ų | 81.7 | 42% | 0.422 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -58.9 | -48.7 | 177.6 | -69.1 | -177.8 | -178.3 | -178.7 | 0 | 111.1 | Y84 F88 A108 T109 L110 | Y84-K106 HydrophobicContact CE1-CD 4.34Å; F88-K106 HydrophobicContact CD1-CG 4.44Å; F88-K106 HydrophobicContact CE1-CB 4.13Å; F88-K106 HydrophobicContact CE1-CG 4Å; F88-K106 HydrophobicContact CE2-CB 4.22Å; F88-K106 HydrophobicContact CE2-CG 4.25Å; F88-K106 HydrophobicContact CZ-CB 3.73Å; F88-K106 HydrophobicContact CZ-CG 3.94Å; F88-K106 VanDerWaalsContact CZ-O 3.25Å; F88-K106 WeakPolarHBondContact CZ-O 3.39Å; K106-A108 PolarHBondContact O-N 3.41Å; K106-T109 PolarHBondContact O-N 3.04Å; K106-L110 WeakPolarHBondContact O-CG 3.41Å; K106-L110 PolarHBondContact O-N 3.48Å |
| 107 | I | 98.1 | Very high | 94.4 | Very high | 118 Ų | 118 | 81 Ų | 81 | 61% | 0.605 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -61.5 | -46 | 179.6 | -63.6 | 171.8 | 0 | 0 | 0 | 111.2 | S105 T109 L110 Q111 | S105-I107 VanDerWaalsContact C-N 3.35Å; S105-I107 PolarHBondContact O-N 3.45Å; I107-T109 VanDerWaalsContact C-N 3.3Å; I107-T109 PolarHBondContact O-N 3.46Å; I107-L110 PolarHBondContact O-N 2.99Å; I107-Q111 HydrophobicContact CG2-CG 4.37Å; I107-Q111 WeakPolarHBondContact O-CG 3.47Å; I107-Q111 PolarHBondContact O-N 3.06Å |
| 108 | A | 96.9 | Very high | 94.6 | Very high | 29 Ų | 29 | 81.1 Ų | 81.1 | 24% | 0.24 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -62.9 | -37 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L104 S105 K106 R112 | L104-A108 HydrophobicContact CB-CB 4.43Å; L104-A108 HydrophobicContact CD2-CB 4.4Å; S105-A108 PolarHBondContact O-N 3.2Å; S105-A108 VanDerWaalsContact OG-CB 3.29Å; S105-A108 WeakPolarHBondContact OG-CB 3.25Å; S105-A108 PolarHBondContact OG-N 2.94Å; S105-A108 VanDerWaalsContact OG-N 3.12Å; K106-A108 PolarHBondContact O-N 3.41Å; A108-R112 WeakPolarHBondContact O-CB 3.35Å; A108-R112 PolarHBondContact O-N 3.17Å |
| 109 | T | 98 | Very high | 95.2 | Very high | 0 Ų | 0 | 79 Ų | 79 | 0% | 0 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -67.1 | -42.6 | 177.1 | -52.7 | 0 | 0 | 0 | 0 | 111 | F88 L91 R92 L95 L104 S105 K106 I107 R112 A113 | F88-T109 HydrophobicContact CD1-CG2 4.26Å; F88-T109 HydrophobicContact CE1-CG2 3.56Å; F88-T109 WeakPolarHBondContact CE1-OG1 3.29Å; F88-T109 HydrophobicContact CZ-CG2 3.91Å; L91-T109 HydrophobicContact CD2-CG2 3.9Å; L91-T109 HydrophobicContact CG-CG2 3.97Å; R92-T109 HydrophobicContact CG-CG2 3.75Å; L95-T109 HydrophobicContact CD1-CG2 3.88Å; L95-T109 WeakPolarHBondContact CD1-O 3.46Å; L104-T109 VanDerWaalsContact CB-OG1 3.27Å; L104-T109 WeakPolarHBondContact CB-OG1 3.39Å; S105-T109 WeakPolarHBondContact O-CB 3.27Å; S105-T109 PolarHBondContact O-N 3.49Å; S105-T109 PolarHBondContact O-OG1 3.39Å; K106-T109 PolarHBondContact O-N 3.04Å; I107-T109 VanDerWaalsContact C-N 3.3Å; I107-T109 PolarHBondContact O-N 3.46Å; T109-R112 PolarHBondContact O-N 2.78Å; T109-A113 WeakPolarHBondContact O-CB 3.36Å; T109-A113 PolarHBondContact O-N 3.07Å |
| 110 | L | 98.6 | Very high | 95.6 | Very high | 87 Ų | 87 | 79.9 Ų | 79.9 | 46% | 0.455 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -64.5 | -45.3 | 177 | -66.7 | 176.9 | 0 | 0 | 0 | 111.8 | F88 K106 I107 R112 A113 I114 | F88-L110 HydrophobicContact CE2-CD2 4.08Å; F88-L110 HydrophobicContact CE2-CG 4.21Å; F88-L110 HydrophobicContact CZ-CD2 4.37Å; F88-L110 HydrophobicContact CZ-CG 4.17Å; K106-L110 WeakPolarHBondContact O-CG 3.41Å; K106-L110 PolarHBondContact O-N 3.48Å; I107-L110 PolarHBondContact O-N 2.99Å; L110-R112 VanDerWaalsContact C-N 3.32Å; L110-R112 PolarHBondContact O-N 2.86Å; L110-A113 WeakPolarHBondContact O-CB 3.45Å; L110-A113 PolarHBondContact O-N 3.37Å; L110-I114 WeakPolarHBondContact O-CG1 3.4Å; L110-I114 PolarHBondContact O-N 2.99Å |
| 111 | Q | 98.2 | Very high | 96.2 | Very high | 69 Ų | 69 | 77.2 Ų | 77.2 | 32% | 0.322 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -58.7 | -43.8 | 175.5 | -73.2 | 174 | -21.9 | 0 | 0 | 111.6 | I107 A113 I114 N115 | I107-Q111 HydrophobicContact CG2-CG 4.37Å; I107-Q111 WeakPolarHBondContact O-CG 3.47Å; I107-Q111 PolarHBondContact O-N 3.06Å; Q111-A113 PolarHBondContact O-N 3.34Å; Q111-I114 PolarHBondContact O-N 3.44Å; Q111-N115 VanDerWaalsContact O-CG 3.29Å; Q111-N115 PolarHBondContact O-N 2.94Å; Q111-N115 PolarHBondContact O-ND2 3.21Å |
| 112 | R | 97.6 | Very high | 96.6 | Very high | 111 Ų | 111 | 79.3 Ų | 79.3 | 42% | 0.419 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -65 | -38.4 | 177 | -170 | 175.7 | -135 | -169.9 | 6.8 | 112.5 | L95 A108 T109 L110 N115 R116 | L95-R112 HydrophobicContact CD1-CB 4.14Å; L95-R112 HydrophobicContact CD1-CG 4.24Å; A108-R112 WeakPolarHBondContact O-CB 3.35Å; A108-R112 PolarHBondContact O-N 3.17Å; T109-R112 PolarHBondContact O-N 2.78Å; L110-R112 VanDerWaalsContact C-N 3.32Å; L110-R112 PolarHBondContact O-N 2.86Å; R112-N115 PolarHBondContact O-N 3.33Å; R112-R116 WeakPolarHBondContact O-CB 3.24Å; R112-R116 PolarHBondContact O-N 3.24Å |
| 113 | A | 98.6 | Very high | 96.8 | Very high | 15 Ų | 15 | 75.7 Ų | 75.7 | 12% | 0.124 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -61.5 | -48.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | L91 L95 T109 L110 Q111 N115 R116 I117 | L91-A113 HydrophobicContact CD1-CB 4.21Å; L91-A113 HydrophobicContact CD2-CB 4.37Å; L95-A113 HydrophobicContact CD1-CB 4.07Å; L95-A113 HydrophobicContact CD2-CB 4.29Å; T109-A113 WeakPolarHBondContact O-CB 3.36Å; T109-A113 PolarHBondContact O-N 3.07Å; L110-A113 WeakPolarHBondContact O-CB 3.45Å; L110-A113 PolarHBondContact O-N 3.37Å; Q111-A113 PolarHBondContact O-N 3.34Å; A113-N115 PolarHBondContact O-N 3.27Å; A113-R116 PolarHBondContact O-N 3.36Å; A113-I117 WeakPolarHBondContact O-CG1 3.45Å; A113-I117 PolarHBondContact O-N 3Å |
| 114 | I | 98.3 | Very high | 96.6 | Very high | 61 Ų | 61 | 74.7 Ų | 74.7 | 31% | 0.313 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -55.6 | -52.4 | 176.6 | -70.8 | 166.6 | 0 | 0 | 0 | 110.2 | L110 Q111 R116 I117 S118 Y151 | L110-I114 WeakPolarHBondContact O-CG1 3.4Å; L110-I114 PolarHBondContact O-N 2.99Å; Q111-I114 PolarHBondContact O-N 3.44Å; I114-R116 VanDerWaalsContact C-N 3.31Å; I114-R116 PolarHBondContact O-N 3.33Å; I114-I117 PolarHBondContact O-N 3.31Å; I114-S118 PolarHBondContact O-N 3.35Å; I114-S118 PolarHBondContact O-OG 3.38Å; I114-Y151 WeakPolarHBondContact CG2-OH 3.42Å |
| 115 | N | 97.8 | Very high | 96.3 | Very high | 88 Ų | 88 | 77.3 Ų | 77.3 | 47% | 0.471 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -61.6 | -38.8 | -178.6 | -68 | -15 | 0 | 0 | 0 | 112.4 | Q111 R112 A113 A119 | Q111-N115 VanDerWaalsContact O-CG 3.29Å; Q111-N115 PolarHBondContact O-N 2.94Å; Q111-N115 PolarHBondContact O-ND2 3.21Å; R112-N115 PolarHBondContact O-N 3.33Å; A113-N115 PolarHBondContact O-N 3.27Å; N115-A119 WeakPolarHBondContact O-CB 3.38Å; N115-A119 PolarHBondContact O-N 2.9Å |
| 116 | R | 97.9 | Very high | 95.9 | Very high | 95 Ų | 95 | 77.7 Ų | 77.7 | 36% | 0.358 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.5 | -44.7 | 177.3 | -175 | 178.4 | 178 | 147.2 | -15.5 | 111.6 | A94 L95 N96 R112 A113 I114 A119 L120 | A94-R116 PolarHBondContact O-NH1 3.48Å; A94-R116 PolarHBondContact O-NH2 3.31Å; L95-R116 HydrophobicContact CD2-CB 4.09Å; L95-R116 HydrophobicContact CD2-CG 4.45Å; N96-R116 PolarHBondContact ND2-NH1 3.38Å; R112-R116 WeakPolarHBondContact O-CB 3.24Å; R112-R116 PolarHBondContact O-N 3.24Å; A113-R116 PolarHBondContact O-N 3.36Å; I114-R116 VanDerWaalsContact C-N 3.31Å; I114-R116 PolarHBondContact O-N 3.33Å; R116-A119 PolarHBondContact O-N 2.91Å; R116-L120 HydrophobicContact CG-CD1 3.95Å; R116-L120 HydrophobicContact CG-CG 4.41Å; R116-L120 WeakPolarHBondContact O-CB 3.49Å; R116-L120 VanDerWaalsContact O-CG 3.28Å; R116-L120 WeakPolarHBondContact O-CG 3.42Å; R116-L120 PolarHBondContact O-N 3.34Å |
| 117 | I | 97.9 | Very high | 95.2 | Very high | 111 Ų | 111 | 77 Ų | 77 | 57% | 0.569 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -61.3 | -50 | 177 | -66.6 | 167.4 | 0 | 0 | 0 | 109.5 | A113 I114 A119 L120 S121 | A113-I117 WeakPolarHBondContact O-CG1 3.45Å; A113-I117 PolarHBondContact O-N 3Å; I114-I117 PolarHBondContact O-N 3.31Å; I117-A119 VanDerWaalsContact C-N 3.34Å; I117-A119 PolarHBondContact O-N 3.14Å; I117-L120 PolarHBondContact O-N 2.92Å; I117-S121 WeakPolarHBondContact O-CB 3.4Å; I117-S121 PolarHBondContact O-N 3.12Å; I117-S121 PolarHBondContact O-OG 3.12Å |
| 118 | S | 97.5 | Very high | 94.2 | Very high | 42 Ų | 42 | 75.7 Ų | 75.7 | 29% | 0.294 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -57.3 | -44.9 | 178.6 | -61.1 | 0 | 0 | 0 | 0 | 112.6 | I114 S121 V122 | I114-S118 PolarHBondContact O-N 3.35Å; I114-S118 PolarHBondContact O-OG 3.38Å; S118-S121 PolarHBondContact O-N 3.42Å; S118-V122 WeakPolarHBondContact O-CG2 3.33Å; S118-V122 PolarHBondContact O-N 3.17Å; S118-V122 VanDerWaalsContact O-N 3.1Å |
| 119 | A | 96.4 | Very high | 92.9 | Very high | 62 Ų | 62 | 79.2 Ų | 79.2 | 51% | 0.512 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -64 | -43.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | N115 R116 I117 V122 F123 | N115-A119 WeakPolarHBondContact O-CB 3.38Å; N115-A119 PolarHBondContact O-N 2.9Å; R116-A119 PolarHBondContact O-N 2.91Å; I117-A119 VanDerWaalsContact C-N 3.34Å; I117-A119 PolarHBondContact O-N 3.14Å; A119-V122 PolarHBondContact O-N 3.27Å; A119-F123 WeakPolarHBondContact O-CB 3.47Å; A119-F123 PolarHBondContact O-N 3.43Å |
| 120 | L | 95.5 | Very high | 91.5 | Very high | 86 Ų | 86 | 87.3 Ų | 87.3 | 45% | 0.45 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.8 | -39.5 | 177.7 | -70.4 | 174.4 | 0 | 0 | 0 | 111.9 | R116 I117 V122 F123 L124 | R116-L120 HydrophobicContact CG-CD1 3.95Å; R116-L120 HydrophobicContact CG-CG 4.41Å; R116-L120 WeakPolarHBondContact O-CB 3.49Å; R116-L120 VanDerWaalsContact O-CG 3.28Å; R116-L120 WeakPolarHBondContact O-CG 3.42Å; R116-L120 PolarHBondContact O-N 3.34Å; I117-L120 PolarHBondContact O-N 2.92Å; L120-V122 VanDerWaalsContact C-N 3.35Å; L120-V122 PolarHBondContact O-N 2.88Å; L120-F123 PolarHBondContact O-N 2.94Å; L120-L124 WeakPolarHBondContact O-CB 3.46Å; L120-L124 VanDerWaalsContact O-CG 3.29Å; L120-L124 WeakPolarHBondContact O-CG 3.33Å; L120-L124 PolarHBondContact O-N 3.33Å |
| 121 | S | 94.3 | Very high | 90.2 | Very high | 60 Ų | 60 | 91.4 Ų | 91.4 | 42% | 0.42 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.3 | -43.6 | 175.5 | -63.8 | 0 | 0 | 0 | 0 | 112.1 | I117 S118 S125 | I117-S121 WeakPolarHBondContact O-CB 3.4Å; I117-S121 PolarHBondContact O-N 3.12Å; I117-S121 PolarHBondContact O-OG 3.12Å; S118-S121 PolarHBondContact O-N 3.42Å; S121-S125 WeakPolarHBondContact O-CB 3.44Å; S121-S125 PolarHBondContact O-N 3.12Å; S121-S125 VanDerWaalsContact O-N 3.09Å; S121-S125 PolarHBondContact O-OG 3.34Å |
| 122 | V | 94.4 | Very high | 88.8 | Confident | 93 Ų | 93 | 93.6 Ų | 93.6 | 56% | 0.564 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -65 | -45.2 | 175 | 173.4 | 0 | 0 | 0 | 0 | 110.7 | S118 A119 L120 L124 S125 S126 | S118-V122 WeakPolarHBondContact O-CG2 3.33Å; S118-V122 PolarHBondContact O-N 3.17Å; S118-V122 VanDerWaalsContact O-N 3.1Å; A119-V122 PolarHBondContact O-N 3.27Å; L120-V122 VanDerWaalsContact C-N 3.35Å; L120-V122 PolarHBondContact O-N 2.88Å; V122-L124 PolarHBondContact O-N 3.47Å; V122-S125 PolarHBondContact O-N 2.92Å; V122-S125 VanDerWaalsContact O-N 3.16Å; V122-S126 PolarHBondContact O-N 3.11Å; V122-S126 PolarHBondContact O-OG 2.91Å |
| 123 | F | 93.7 | Very high | 87.8 | Confident | 119 Ų | 119 | 90 Ų | 90 | 52% | 0.522 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.6 | -44.8 | 179.8 | 178.2 | -96.2 | 0 | 0 | 0 | 112.7 | A119 L120 S125 S126 N127 | A119-F123 WeakPolarHBondContact O-CB 3.47Å; A119-F123 PolarHBondContact O-N 3.43Å; L120-F123 PolarHBondContact O-N 2.94Å; F123-S125 VanDerWaalsContact C-N 3.3Å; F123-S125 PolarHBondContact O-N 3.49Å; F123-S126 PolarHBondContact O-N 2.96Å; F123-S126 PolarHBondContact O-OG 3.28Å; F123-N127 WeakPolarHBondContact O-CB 3.41Å; F123-N127 PolarHBondContact O-N 2.91Å; F123-N127 PolarHBondContact O-ND2 3.06Å |
| 124 | L | 90.1 | Very high | 86.6 | Confident | 112 Ų | 112 | 94.6 Ų | 94.6 | 59% | 0.586 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -68.5 | -30.2 | 177.1 | -68.1 | 173.8 | 0 | 0 | 0 | 112.4 | L120 V122 N127 | L120-L124 WeakPolarHBondContact O-CB 3.46Å; L120-L124 VanDerWaalsContact O-CG 3.29Å; L120-L124 WeakPolarHBondContact O-CG 3.33Å; L120-L124 PolarHBondContact O-N 3.33Å; V122-L124 PolarHBondContact O-N 3.47Å; L124-N127 CarbonylContact O-C 3.54Å |
| 125 | S | 87.3 | Confident | 85.6 | Confident | 96 Ų | 96 | 97.4 Ų | 97.4 | 67% | 0.671 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -73.8 | -35.1 | 176.5 | -57 | 0 | 0 | 0 | 0 | 112.5 | S121 V122 F123 | S121-S125 WeakPolarHBondContact O-CB 3.44Å; S121-S125 PolarHBondContact O-N 3.12Å; S121-S125 VanDerWaalsContact O-N 3.09Å; S121-S125 PolarHBondContact O-OG 3.34Å; V122-S125 PolarHBondContact O-N 2.92Å; V122-S125 VanDerWaalsContact O-N 3.16Å; F123-S125 VanDerWaalsContact C-N 3.3Å; F123-S125 PolarHBondContact O-N 3.49Å |
| 126 | S | 89.1 | Confident | 84.5 | Confident | 80 Ų | 80 | 104.2 Ų | 104.2 | 56% | 0.559 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -85.1 | -19 | 178.1 | 60.5 | 0 | 0 | 0 | 0 | 113.9 | V122 F123 P128 | V122-S126 PolarHBondContact O-N 3.11Å; V122-S126 PolarHBondContact O-OG 2.91Å; F123-S126 PolarHBondContact O-N 2.96Å; F123-S126 PolarHBondContact O-OG 3.28Å; S126-P128 WeakPolarHBondContact O-CD 3.45Å |
| 127 | N | 84 | Confident | 83.2 | Confident | 84 Ų | 84 | 108 Ų | 108 | 45% | 0.449 | 60% | 0.596 | S | S | . | * | S | Bend | trans | -122.4 | 73.7 | 177.7 | -61.4 | -89 | 0 | 0 | 0 | 109.6 | F123 L124 | F123-N127 WeakPolarHBondContact O-CB 3.41Å; F123-N127 PolarHBondContact O-N 2.91Å; F123-N127 PolarHBondContact O-ND2 3.06Å; L124-N127 CarbonylContact O-C 3.54Å |
| 128 | P | 76.7 | Confident | 81.8 | Confident | 89 Ų | 89 | 106.5 Ų | 106.5 | 58% | 0.578 | 59% | 0.594 | S | S | * | * | trans | -60.1 | 135 | 178.8 | 25.5 | -33.3 | 0 | 0 | 0 | 109.5 | S126 N130 | S126-P128 WeakPolarHBondContact O-CD 3.45Å; P128-N130 PolarHBondContact O-N 2.58Å; P128-N130 VanDerWaalsContact O-N 3.15Å | ||
| 129 | P | 69.5 | Low | 80 | Confident | 104 Ų | 104 | 110.2 Ų | 110.2 | 68% | 0.675 | 61% | 0.607 | S | S | * | * | trans | -61 | 121.9 | -179.7 | 21.7 | -30.4 | 0 | 0 | 0 | 110.1 | K131 | P129-K131 PolarHBondContact O-N 2.62Š| ||
| 130 | N | 67.4 | Low | 78.4 | Confident | 169 Ų | 169 | 117.7 Ų | 117.7 | 90% | 0.904 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -63.4 | -4.3 | -179 | -72.8 | -37.2 | 0 | 0 | 0 | 114.3 | P128 | P128-N130 PolarHBondContact O-N 2.58Å; P128-N130 VanDerWaalsContact O-N 3.15Å |
| 131 | K | 72 | Confident | 76.6 | Confident | 174 Ų | 174 | 118.1 Ų | 118.1 | 76% | 0.757 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -124.2 | 128.8 | 175.7 | -71.1 | 176.4 | 179.3 | 179.2 | 0 | 108.8 | P129 C133 | P129-K131 PolarHBondContact O-N 2.62Å; K131-C133 PolarHBondContact O-N 2.92Å; K131-C133 VanDerWaalsContact O-N 3.11Å |
| 132 | P | 69 | Low | 74.9 | Confident | 114 Ų | 114 | 121.3 Ų | 121.3 | 74% | 0.74 | 65% | 0.651 | S | S | * | * | trans | -59.9 | 120.3 | 172.8 | 24.7 | -31 | 0 | 0 | 0 | 108.5 | S134 | P132-S134 PolarHBondContact O-N 2.91Š| ||
| 133 | C | 76.1 | Confident | 72.6 | Confident | 37 Ų | 37 | 122 Ų | 122 | 25% | 0.25 | 67% | 0.667 | C | S | . | * | trans | -60.1 | 124.8 | 174.2 | 156.6 | 0 | 0 | 0 | 0 | 109.2 | K131 H135 C138 H139 | K131-C133 PolarHBondContact O-N 2.92Å; K131-C133 VanDerWaalsContact O-N 3.11Å; C133-H135 PolarHBondContact O-N 3.5Å; C133-H135 VanDerWaalsContact O-N 3.16Å; C133-H135 VanDerWaalsContact SG-CB 3.52Å; C133-H135 PolarHBondContact SG-N 3.44Å; C133-H135 VanDerWaalsContact SG-N 3.4Å; C133-C138 HydrophobicContact CB-CB 3.45Å; C133-C138 VanDerWaalsContact CB-CB 3.45Å; C133-C138 WeakPolarHBondContact CB-SG 3.03Å; C133-C138 WeakPolarHBondContact SG-CB 3.13Å; C133-C138 CovalentContact SG-SG 2.04Å; C133-C138 PolarHBondContact SG-SG 3.45Å; C133-H139 PolarHBondContact O-CD2 2.89Å; C133-H139 VanDerWaalsContact O-CD2 3.25Å; C133-H139 PolarHBondContact O-NE2 2.83Å | ||
| 134 | S | 73.8 | Confident | 70.3 | Confident | 110 Ų | 110 | 118.8 Ų | 118.8 | 77% | 0.769 | 67% | 0.667 | S | S | * | * | trans | -73.6 | 0.6 | -179.7 | 56.2 | 0 | 0 | 0 | 0 | 114.5 | P132 | P132-S134 PolarHBondContact O-N 2.91Š| ||
| 135 | H | 77.4 | Confident | 68.1 | Low | 121 Ų | 121 | 119.8 Ų | 119.8 | 56% | 0.56 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -86.2 | 130.8 | -178.4 | -58.4 | -154.4 | 0 | 0 | 0 | 109 | C133 E137 C138 | C133-H135 PolarHBondContact O-N 3.5Å; C133-H135 VanDerWaalsContact O-N 3.16Å; C133-H135 VanDerWaalsContact SG-CB 3.52Å; C133-H135 PolarHBondContact SG-N 3.44Å; C133-H135 VanDerWaalsContact SG-N 3.4Å; H135-E137 PolarHBondContact O-N 3.13Å; H135-C138 PolarHBondContact O-N 3.35Å |
| 136 | R | 74.1 | Confident | 66.4 | Low | 231 Ų | 231 | 118.8 Ų | 118.8 | 87% | 0.872 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.5 | -26 | 178.8 | -61.8 | -154.8 | 82.2 | -131.5 | 3.7 | 113 | H139 | R136-H139 PolarHBondContact O-N 3.5Š|
| 137 | E | 72.1 | Confident | 64.4 | Low | 175 Ų | 175 | 121.4 Ų | 121.4 | 82% | 0.818 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.4 | -31.7 | 179.6 | -59.6 | 174.3 | -164.7 | 0 | 0 | 112.8 | H135 | H135-E137 PolarHBondContact O-N 3.13Š|
| 138 | C | 68.5 | Low | 62.7 | Low | 79 Ų | 79 | 125.6 Ų | 125.6 | 53% | 0.534 | 71% | 0.707 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -75.4 | -30.2 | 176.4 | -64.4 | 0 | 0 | 0 | 0 | 113 | C133 H135 R140 | C133-C138 HydrophobicContact CB-CB 3.45Å; C133-C138 VanDerWaalsContact CB-CB 3.45Å; C133-C138 WeakPolarHBondContact CB-SG 3.03Å; C133-C138 WeakPolarHBondContact SG-CB 3.13Å; C133-C138 CovalentContact SG-SG 2.04Å; C133-C138 PolarHBondContact SG-SG 3.45Å; H135-C138 PolarHBondContact O-N 3.35Å; C138-R140 PolarHBondContact O-N 2.97Å |
| 139 | H | 59.7 | Low | 60.9 | Low | 119 Ų | 119 | 129.1 Ų | 129.1 | 55% | 0.551 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.8 | -3.5 | -177.2 | -79.2 | -69.4 | 0 | 0 | 0 | 113.6 | C133 R136 S141 | C133-H139 PolarHBondContact O-CD2 2.89Å; C133-H139 VanDerWaalsContact O-CD2 3.25Å; C133-H139 PolarHBondContact O-NE2 2.83Å; R136-H139 PolarHBondContact O-N 3.5Å; H139-S141 PolarHBondContact O-N 2.99Å |
| 140 | R | 62.9 | Low | 59.6 | Low | 219 Ų | 219 | 130.4 Ų | 130.4 | 83% | 0.826 | 72% | 0.717 | S | S | * | * | trans | -74.1 | 83.1 | 170.6 | -172.9 | -179.3 | -86.7 | -114.4 | 2.7 | 108.3 | C138 | C138-R140 PolarHBondContact O-N 2.97Š| ||
| 141 | S | 57.1 | Low | 58.8 | Low | 95 Ų | 95 | 128.6 Ų | 128.6 | 66% | 0.664 | 70% | 0.698 | S | S | * | * | trans | -52.4 | 134.8 | 164.6 | -65.4 | 0 | 0 | 0 | 0 | 108.6 | H139 A143 | H139-S141 PolarHBondContact O-N 2.99Å; S141-A143 PolarHBondContact O-N 3.22Å | ||
| 142 | P | 57.8 | Low | 57.9 | Low | 128 Ų | 128 | 124.6 Ų | 124.6 | 83% | 0.831 | 69% | 0.688 | S | S | * | * | trans | -71 | 78.6 | 170.1 | 27.9 | -29.7 | 0 | 0 | 0 | 108.2 | G144 | P142-G144 PolarHBondContact O-N 3.37Š| ||
| 143 | A | 46.2 | Very low | 57.3 | Low | 108 Ų | 108 | 122.6 Ų | 122.6 | 89% | 0.893 | 68% | 0.675 | S | S | * | * | trans | -73.7 | 82.3 | 168.2 | 0 | 0 | 0 | 0 | 0 | 108 | S141 | S141-A143 PolarHBondContact O-N 3.22Š| ||
| 144 | G | 45.3 | Very low | 56 | Low | 51 Ų | 51 | 129.3 Ų | 129.3 | 53% | 0.526 | 70% | 0.695 | S | S | . | * | S | Bend | trans | -172 | 138.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | P142 A146 | P142-G144 PolarHBondContact O-N 3.37Å; G144-A146 PolarHBondContact O-N 3.4Å; G144-A146 VanDerWaalsContact O-N 3.15Å |
| 145 | P | 44.8 | Very low | 55.1 | Low | 132 Ų | 132 | 127.5 Ų | 127.5 | 86% | 0.857 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -64.3 | 120.5 | -174.4 | 27.4 | -32.1 | 0 | 0 | 0 | 109.9 | V147 | P145-V147 PolarHBondContact O-N 2.95Š|
| 146 | A | 51.8 | Low | 53.9 | Low | 75 Ų | 75 | 124.1 Ų | 124.1 | 62% | 0.62 | 67% | 0.668 | S | S | * | * | trans | 23.9 | 88 | 154.5 | 0 | 0 | 0 | 0 | 0 | 117.4 | G144 | G144-A146 PolarHBondContact O-N 3.4Å; G144-A146 VanDerWaalsContact O-N 3.15Å | ||
| 147 | V | 47.1 | Very low | 53 | Low | 135 Ų | 135 | 116.1 Ų | 116.1 | 82% | 0.818 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -93.1 | 35 | 150.9 | -160.7 | 0 | 0 | 0 | 0 | 109.9 | P145 | P145-V147 PolarHBondContact O-N 2.95Š|
| 148 | H | 46.5 | Very low | 52.2 | Low | 172 Ų | 172 | 112.6 Ų | 112.6 | 80% | 0.796 | 63% | 0.633 | S | S | * | * | trans | -104.9 | 13.7 | 172.9 | -146.6 | -89.9 | 0 | 0 | 0 | 112.1 | ||||
| 149 | Q | 40.7 | Very low | 51.4 | Low | 163 Ų | 163 | 112.9 Ų | 112.9 | 76% | 0.762 | 64% | 0.636 | S | S | * | * | S | Bend | trans | -100.8 | -15 | 175 | -80.1 | -96.4 | 31.7 | 0 | 0 | 113.2 | ||
| 150 | N | 41.8 | Very low | 51 | Low | 132 Ų | 132 | 114.4 Ų | 114.4 | 71% | 0.706 | 64% | 0.643 | S | S | * | * | trans | -123.7 | 26.4 | -171.8 | -80.1 | 21.6 | 0 | 0 | 0 | 114.7 | V152 | N150-V152 PolarHBondContact O-N 3.15Š| ||
| 151 | Y | 49.4 | Very low | 50.5 | Low | 130 Ų | 130 | 112.5 Ų | 112.5 | 51% | 0.51 | 64% | 0.644 | S | S | . | * | trans | -75.6 | 77.4 | 157.9 | -168.1 | -99.3 | 0 | 0 | 0 | 108 | I114 P153 | I114-Y151 WeakPolarHBondContact CG2-OH 3.42Å; Y151-P153 VanDerWaalsContact O-CD 3.24Å; Y151-P153 WeakPolarHBondContact O-CD 3.18Å | ||
| 152 | V | 54.2 | Low | 49.9 | Very low | 91 Ų | 91 | 115.5 Ų | 115.5 | 55% | 0.552 | 65% | 0.651 | S | S | * | * | trans | -60.5 | 120.7 | 166 | -178.1 | 0 | 0 | 0 | 0 | 105.8 | N150 W154 | N150-V152 PolarHBondContact O-N 3.15Å; V152-W154 PolarHBondContact O-N 3.4Å | ||
| 153 | P | 55.2 | Low | 49.5 | Very low | 72 Ų | 72 | 116.5 Ų | 116.5 | 47% | 0.468 | 65% | 0.645 | S | S | . | * | trans | -60.1 | 108.1 | 173.8 | -21 | 33 | 0 | 0 | 0 | 107.7 | Y151 H155 A156 | Y151-P153 VanDerWaalsContact O-CD 3.24Å; Y151-P153 WeakPolarHBondContact O-CD 3.18Å; P153-H155 PolarHBondContact O-N 3.35Å; P153-A156 WeakPolarHBondContact O-CB 3.36Å; P153-A156 PolarHBondContact O-N 3.05Å | ||
| 154 | W | 50.4 | Low | 49.5 | Very low | 177 Ų | 177 | 116 Ų | 116 | 67% | 0.67 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -51.9 | -20.3 | 172.5 | -80.1 | 97.6 | 0 | 0 | 0 | 112.5 | V152 A156 S157 I158 | V152-W154 PolarHBondContact O-N 3.4Å; W154-A156 VanDerWaalsContact C-N 3.33Å; W154-A156 PolarHBondContact O-N 3.48Å; W154-S157 PolarHBondContact O-N 3.37Å; W154-I158 WeakPolarHBondContact O-CD1 3.46Å; W154-I158 WeakPolarHBondContact O-CG1 3.39Å; W154-I158 PolarHBondContact O-N 3.43Å |
| 155 | H | 53.8 | Low | 49.6 | Very low | 73 Ų | 73 | 122.5 Ų | 122.5 | 34% | 0.338 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -59.8 | -33.1 | 170.2 | -85.9 | -87.1 | 0 | 0 | 0 | 114.4 | P153 S157 S159 | P153-H155 PolarHBondContact O-N 3.35Å; H155-S157 PolarHBondContact O-N 3.48Å; H155-S159 WeakPolarHBondContact O-CB 3.22Å; H155-S159 PolarHBondContact O-N 2.75Å; H155-S159 VanDerWaalsContact O-N 3.13Å; H155-S159 PolarHBondContact O-OG 2.76Å |
| 156 | A | 53.4 | Low | 49.6 | Very low | 50 Ų | 50 | 124.6 Ų | 124.6 | 41% | 0.413 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -70.3 | -32.3 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | P153 W154 Q160 | P153-A156 WeakPolarHBondContact O-CB 3.36Å; P153-A156 PolarHBondContact O-N 3.05Å; W154-A156 VanDerWaalsContact C-N 3.33Å; W154-A156 PolarHBondContact O-N 3.48Å; A156-Q160 PolarHBondContact O-NE2 2.93Å |
| 157 | S | 54.5 | Low | 48.8 | Very low | 63 Ų | 63 | 124 Ų | 124 | 44% | 0.441 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -80.7 | -35.6 | 179.8 | -37.8 | 0 | 0 | 0 | 0 | 112 | W154 H155 | W154-S157 PolarHBondContact O-N 3.37Å; H155-S157 PolarHBondContact O-N 3.48Å |
| 158 | I | 54 | Low | 49 | Very low | 100 Ų | 100 | 124.1 Ų | 124.1 | 51% | 0.513 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -81.9 | -35.4 | -175.3 | -60.4 | 167.7 | 0 | 0 | 0 | 111.5 | W154 Q160 Q161 | W154-I158 WeakPolarHBondContact O-CD1 3.46Å; W154-I158 WeakPolarHBondContact O-CG1 3.39Å; W154-I158 PolarHBondContact O-N 3.43Å; I158-Q160 VanDerWaalsContact C-N 3.31Å; I158-Q160 PolarHBondContact O-N 3.42Å; I158-Q161 PolarHBondContact O-N 3.15Å |
| 159 | S | 51.8 | Low | 49.1 | Very low | 86 Ų | 86 | 123.6 Ų | 123.6 | 60% | 0.601 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -68.2 | -27.2 | 176.2 | -77.3 | 0 | 0 | 0 | 0 | 113.5 | H155 Q161 | H155-S159 WeakPolarHBondContact O-CB 3.22Å; H155-S159 PolarHBondContact O-N 2.75Å; H155-S159 VanDerWaalsContact O-N 3.13Å; H155-S159 PolarHBondContact O-OG 2.76Å; S159-Q161 VanDerWaalsContact C-N 3.32Å; S159-Q161 PolarHBondContact O-N 2.86Å |
| 160 | Q | 52.5 | Low | 49.1 | Very low | 151 Ų | 151 | 123.1 Ų | 123.1 | 71% | 0.706 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -70.7 | -25 | 176.6 | -88.5 | 176.4 | 77.1 | 0 | 0 | 113.5 | A156 I158 L162 | A156-Q160 PolarHBondContact O-NE2 2.93Å; I158-Q160 VanDerWaalsContact C-N 3.31Å; I158-Q160 PolarHBondContact O-N 3.42Å; Q160-L162 VanDerWaalsContact C-N 3.28Å; Q160-L162 PolarHBondContact O-N 2.65Å |
| 161 | Q | 53 | Low | 48.9 | Very low | 179 Ų | 179 | 124.2 Ų | 124.2 | 84% | 0.836 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.1 | -8.6 | -177.4 | -164.3 | 173.4 | -7.7 | 0 | 0 | 113.6 | I158 S159 | I158-Q161 PolarHBondContact O-N 3.15Å; S159-Q161 VanDerWaalsContact C-N 3.32Å; S159-Q161 PolarHBondContact O-N 2.86Å |
| 162 | L | 43.8 | Very low | 48.9 | Very low | 157 Ų | 157 | 128.9 Ų | 128.9 | 82% | 0.822 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.5 | 24.5 | -177.6 | -126.1 | 154.9 | 0 | 0 | 0 | 112.8 | Q160 | Q160-L162 VanDerWaalsContact C-N 3.28Å; Q160-L162 PolarHBondContact O-N 2.65Å |
| 163 | Q | 48.7 | Very low | 48 | Very low | 149 Ų | 149 | 131.8 Ų | 131.8 | 70% | 0.696 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -91.1 | 127.7 | 168.5 | -159.3 | 173.9 | 87.5 | 0 | 0 | 108.6 | Q165 | Q163-Q165 PolarHBondContact O-N 3.42Å; Q163-Q165 VanDerWaalsContact O-N 3.15Å |
| 164 | P | 47.7 | Very low | 46.9 | Very low | 97 Ų | 97 | 133.7 Ų | 133.7 | 63% | 0.63 | 70% | 0.696 | S | S | * | * | trans | -59.5 | 121.2 | 168.5 | -15.9 | 29 | 0 | 0 | 0 | 107.7 | Q166 | P164-Q166 WeakPolarHBondContact O-CG 3.49Å; P164-Q166 PolarHBondContact O-N 3.45Å | ||
| 165 | Q | 46.1 | Very low | 46.4 | Very low | 188 Ų | 188 | 130 Ų | 130 | 88% | 0.879 | 70% | 0.703 | S | S | * | * | trans | -56.3 | 97.4 | 175.2 | -79 | -86.7 | 51.5 | 0 | 0 | 109.7 | Q163 G167 | Q163-Q165 PolarHBondContact O-N 3.42Å; Q163-Q165 VanDerWaalsContact O-N 3.15Å; Q165-G167 PolarHBondContact O-N 2.79Å | ||
| 166 | Q | 44.7 | Very low | 45.6 | Very low | 177 Ų | 177 | 133.2 Ų | 133.2 | 83% | 0.827 | 72% | 0.723 | S | S | * | * | trans | -89.3 | 97.8 | 165.7 | -51.2 | -162.5 | 26.5 | 0 | 0 | 106.3 | P164 | P164-Q166 WeakPolarHBondContact O-CG 3.49Å; P164-Q166 PolarHBondContact O-N 3.45Å | ||
| 167 | G | 36.1 | Very low | 45.3 | Very low | 63 Ų | 63 | 135.7 Ų | 135.7 | 65% | 0.649 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 162.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q165 | Q165-G167 PolarHBondContact O-N 2.79Š|
| 168 | P | 51.7 | Low | 44.6 | Very low | 136 Ų | 136 | 141.1 Ų | 141.1 | 88% | 0.883 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 147.3 | -150.7 | 33.4 | -35.6 | 0 | 0 | 0 | 114.9 | ||
| 169 | H | 47.6 | Very low | 43.8 | Very low | 162 Ų | 162 | 140.8 Ų | 140.8 | 75% | 0.75 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 127.8 | 177.3 | 175 | -89.8 | 0 | 0 | 0 | 114.6 | ||
| 170 | L | 41.7 | Very low | 43.1 | Very low | 153 Ų | 153 | 146.2 Ų | 146.2 | 80% | 0.801 | 77% | 0.774 | S | S | * | * | trans | -143.5 | 135.9 | 151.2 | -79.9 | -178.4 | 0 | 0 | 0 | 111.9 | ||||
| 171 | H | 35.8 | Very low | 42.9 | Very low | 155 Ų | 155 | 146.3 Ų | 146.3 | 72% | 0.718 | 78% | 0.776 | S | S | * | * | trans | 77.3 | 86.7 | 166.7 | -67.9 | -74 | 0 | 0 | 0 | 120.2 | ||||
| 172 | R | 49.6 | Very low | 42.2 | Very low | 227 Ų | 227 | 143.9 Ų | 143.9 | 86% | 0.857 | 77% | 0.769 | S | S | * | * | trans | -54.2 | 117.2 | 143.7 | -176.9 | -176.1 | -157.7 | -173 | 5.2 | 110.8 | ||||
| 173 | L | 36.1 | Very low | 42 | Very low | 153 Ų | 153 | 144.2 Ų | 144.2 | 80% | 0.801 | 77% | 0.771 | S | S | * | * | trans | -138.7 | 103.6 | 158.1 | -67.6 | 176.6 | 0 | 0 | 0 | 106.6 | ||||
| 174 | S | 31.6 | Very low | 41.7 | Very low | 111 Ų | 111 | 140.5 Ų | 140.5 | 78% | 0.776 | 77% | 0.773 | S | S | * | * | 66.8 | 104.3 | 101.1 | -154.9 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 175 | A | 41.2 | Very low | 41.4 | Very low | 100 Ų | 100 | 140.1 Ų | 140.1 | 83% | 0.826 | 78% | 0.778 | S | S | * | * | trans | -69.9 | 130.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 176 | D | 36.3 | Very low | 41.6 | Very low | 141 Ų | 141 | 138 Ų | 138 | 75% | 0.754 | 78% | 0.778 | S | S | * | * | trans | -153.4 | 143.3 | 146.5 | -139.7 | 6.2 | 0 | 0 | 0 | 109.7 | ||||
| 177 | P | 47.2 | Very low | 41.2 | Very low | 101 Ų | 101 | 135 Ų | 135 | 66% | 0.656 | 78% | 0.777 | S | S | * | * | trans | -101.6 | 117.4 | -167.7 | 34.8 | -24.2 | 0 | 0 | 0 | 111.9 | ||||
| 178 | H | 39.3 | Very low | 41.7 | Very low | 177 Ų | 177 | 137.5 Ų | 137.5 | 82% | 0.819 | 78% | 0.783 | S | S | * | * | trans | -136.6 | 117.5 | 166.1 | -76.5 | -69.7 | 0 | 0 | 0 | 113.6 | ||||
| 179 | A | 36.8 | Very low | 41.7 | Very low | 94 Ų | 94 | 136.6 Ų | 136.6 | 78% | 0.777 | 78% | 0.777 | S | S | * | * | trans | -11.5 | 130.3 | 163.5 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 180 | Y | 37.8 | Very low | 41.8 | Very low | 199 Ų | 199 | 135.1 Ų | 135.1 | 78% | 0.78 | 78% | 0.782 | S | S | * | * | 39.3 | 103.3 | 125.7 | -166.4 | -117.8 | 0 | 0 | 0 | 117.4 | |||||
| 181 | M | 49.3 | Very low | 41.8 | Very low | 153 Ų | 153 | 133.2 Ų | 133.2 | 75% | 0.754 | 78% | 0.781 | S | S | * | * | -153 | 135.3 | 129.5 | -89.5 | -59.2 | 98.5 | 0 | 0 | 110.7 | |||||
| 182 | D | 37.9 | Very low | 42.4 | Very low | 129 Ų | 129 | 131.8 Ų | 131.8 | 69% | 0.69 | 79% | 0.786 | S | S | * | * | trans | -63.6 | 137.5 | 172.2 | 176.3 | 38.5 | 0 | 0 | 0 | 111.8 | ||||
| 183 | N | 38.2 | Very low | 42.2 | Very low | 163 Ų | 163 | 129.7 Ų | 129.7 | 87% | 0.872 | 79% | 0.786 | S | S | * | * | trans | -162.5 | 118.2 | 151.6 | -131.2 | 14.5 | 0 | 0 | 0 | 111 | ||||
| 184 | G | 44.2 | Very low | 42.5 | Very low | 72 Ų | 72 | 132.1 Ų | 132.1 | 74% | 0.742 | 79% | 0.786 | S | S | * | * | trans | -70.3 | 137 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 185 | A | 40.8 | Very low | 43.4 | Very low | 88 Ų | 88 | 132.3 Ų | 132.3 | 73% | 0.727 | 78% | 0.784 | S | S | * | * | trans | -177.9 | 111.1 | 142.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | S187 | A185-S187 PolarHBondContact O-N 2.75Š| ||
| 186 | T | 49.1 | Very low | 43.6 | Very low | 143 Ų | 143 | 133.4 Ų | 133.4 | 88% | 0.877 | 78% | 0.784 | S | S | * | * | trans | -49.9 | 117.5 | 161.9 | 29.6 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 187 | S | 37.9 | Very low | 43.8 | Very low | 114 Ų | 114 | 137.1 Ų | 137.1 | 80% | 0.797 | 79% | 0.789 | S | S | * | * | trans | -120.9 | 97.6 | 167.3 | -70.1 | 0 | 0 | 0 | 0 | 109.5 | A185 | A185-S187 PolarHBondContact O-N 2.75Š| ||
| 188 | C | 46.6 | Very low | 43.9 | Very low | 116 Ų | 116 | 137.3 Ų | 137.3 | 78% | 0.784 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 143.1 | 163.8 | -61.2 | 0 | 0 | 0 | 0 | 109.1 | ||
| 189 | P | 51.7 | Low | 44 | Very low | 117 Ų | 117 | 135.9 Ų | 135.9 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 146.7 | 173 | 29.3 | -32.8 | 0 | 0 | 0 | 111.5 | ||
| 190 | P | 48.2 | Very low | 44.2 | Very low | 131 Ų | 131 | 139.9 Ų | 139.9 | 85% | 0.851 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 134.3 | -179.4 | 29.7 | -32.2 | 0 | 0 | 0 | 111.7 | ||
| 191 | S | 42.5 | Very low | 44.3 | Very low | 113 Ų | 113 | 133.9 Ų | 133.9 | 79% | 0.79 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 153.7 | 171.1 | -84.3 | 0 | 0 | 0 | 0 | 112.2 | ||
| 192 | P | 48.8 | Very low | 43.9 | Very low | 126 Ų | 126 | 134.7 Ų | 134.7 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -76 | 127.6 | -173.2 | -6.8 | 24.4 | 0 | 0 | 0 | 111.7 | ||
| 193 | H | 44.2 | Very low | 43.8 | Very low | 183 Ų | 183 | 138.6 Ų | 138.6 | 85% | 0.847 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 122.3 | 178.6 | -140.4 | -78.6 | 0 | 0 | 0 | 110.7 | ||
| 194 | Y | 43.7 | Very low | 43.8 | Very low | 204 Ų | 204 | 140.8 Ų | 140.8 | 80% | 0.8 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 138 | 163.1 | -114.1 | -92.3 | 0 | 0 | 0 | 109 | C196 | Y194-C196 PolarHBondContact O-N 2.61Š|
| 195 | P | 50 | Low | 43.4 | Very low | 115 Ų | 115 | 142.3 Ų | 142.3 | 75% | 0.747 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 117.3 | 174.8 | -11.6 | 27.5 | 0 | 0 | 0 | 110.9 | ||
| 196 | C | 45.2 | Very low | 43.2 | Very low | 123 Ų | 123 | 142.8 Ų | 142.8 | 83% | 0.831 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -94.4 | 132.3 | 164.1 | -67.6 | 0 | 0 | 0 | 0 | 109 | Y194 | Y194-C196 PolarHBondContact O-N 2.61Š|
| 197 | Y | 40.9 | Very low | 42.5 | Very low | 218 Ų | 218 | 148 Ų | 148 | 86% | 0.855 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 146.8 | 174.6 | -85.8 | -95 | 0 | 0 | 0 | 111.7 | ||
| 198 | P | 49.2 | Very low | 42.3 | Very low | 106 Ų | 106 | 145.4 Ų | 145.4 | 69% | 0.688 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 138.3 | -180 | 30.2 | -29.9 | 0 | 0 | 0 | 111.4 | ||
| 199 | T | 41.4 | Very low | 41.7 | Very low | 146 Ų | 146 | 148.9 Ų | 148.9 | 90% | 0.896 | 81% | 0.808 | S | S | * | * | trans | -100.1 | 113.1 | 160.5 | -47 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 200 | E | 40.3 | Very low | 41.1 | Very low | 179 Ų | 179 | 148.4 Ų | 148.4 | 84% | 0.836 | 81% | 0.806 | S | S | * | * | trans | -77.3 | 139 | 175.7 | 38.7 | -130.9 | 132.1 | 0 | 0 | 112.1 | ||||
| 201 | G | 39.8 | Very low | 40.3 | Very low | 72 Ų | 72 | 150.2 Ų | 150.2 | 74% | 0.742 | 81% | 0.809 | S | S | * | * | trans | 128.6 | 76.8 | 163.1 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 202 | H | 41.7 | Very low | 40 | Very low | 170 Ų | 170 | 150.4 Ų | 150.4 | 79% | 0.787 | 81% | 0.81 | S | S | * | * | trans | -53.7 | 152.3 | 171.1 | -63.2 | -100.5 | 0 | 0 | 0 | 113.6 | ||||
| 203 | F | 36 | Very low | 40.1 | Very low | 212 Ų | 212 | 149.1 Ų | 149.1 | 93% | 0.93 | 80% | 0.802 | S | S | * | * | -172.8 | 140.1 | 108.5 | -88.2 | -67.3 | 0 | 0 | 0 | 111.6 | |||||
| 204 | Y | 37.9 | Very low | 39.6 | Very low | 209 Ų | 209 | 147 Ų | 147 | 82% | 0.82 | 80% | 0.797 | S | S | * | * | trans | -67.3 | 139.9 | -171.9 | -116.3 | -108.6 | 0 | 0 | 0 | 114 | ||||
| 205 | A | 34.9 | Very low | 39.2 | Very low | 103 Ų | 103 | 143.8 Ų | 143.8 | 85% | 0.851 | 79% | 0.793 | S | S | * | * | trans | -152.8 | 115.9 | 138.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 206 | S | 37.2 | Very low | 38.5 | Very low | 98 Ų | 98 | 145.7 Ų | 145.7 | 69% | 0.685 | 80% | 0.797 | S | S | * | * | trans | -67.2 | 157.7 | 177.8 | -56 | 0 | 0 | 0 | 0 | 113 | ||||
| 207 | R | 33.8 | Very low | 39.1 | Very low | 254 Ų | 254 | 145 Ų | 145 | 96% | 0.958 | 79% | 0.79 | S | S | * | * | trans | 114.1 | 110.5 | 138.1 | -147.1 | 174.8 | -161.1 | -150.1 | 3.4 | 116.8 | ||||
| 208 | G | 33.6 | Very low | 39.2 | Very low | 58 Ų | 58 | 140.4 Ų | 140.4 | 60% | 0.598 | 79% | 0.787 | S | S | * | * | 92.3 | 113 | 126.7 | 0 | 0 | 0 | 0 | 0 | 120 | |||||
| 209 | H | 35.2 | Very low | 38.8 | Very low | 190 Ų | 190 | 140.7 Ų | 140.7 | 88% | 0.88 | 79% | 0.792 | S | S | * | * | trans | 69.4 | 125.9 | 137.3 | -58.2 | -68.5 | 0 | 0 | 0 | 121.9 | ||||
| 210 | C | 39.2 | Very low | 39.1 | Very low | 107 Ų | 107 | 138.8 Ų | 138.8 | 72% | 0.723 | 78% | 0.782 | S | S | * | * | trans | -53.9 | 134.6 | 160.6 | 27.7 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 211 | N | 31.1 | Very low | 38.9 | Very low | 169 Ų | 169 | 137.6 Ų | 137.6 | 90% | 0.904 | 78% | 0.78 | S | S | * | * | trans | 176.9 | 141.4 | 134.3 | -80.6 | -34.7 | 0 | 0 | 0 | 109.4 | ||||
| 212 | S | 35.2 | Very low | 38.6 | Very low | 116 Ų | 116 | 145.6 Ų | 145.6 | 81% | 0.811 | 79% | 0.788 | S | S | * | * | trans | -88.9 | 174.9 | 166.7 | -144.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 213 | P | 51.8 | Low | 38.5 | Very low | 100 Ų | 100 | 146.1 Ų | 146.1 | 65% | 0.649 | 78% | 0.784 | S | S | * | * | cis | -137.6 | -165.9 | 3.5 | 32.7 | -6.9 | 0 | 0 | 0 | 114.5 | ||||
| 214 | D | 34.1 | Very low | 38.9 | Very low | 139 Ų | 139 | 141.1 Ų | 141.1 | 74% | 0.743 | 77% | 0.774 | S | S | * | * | trans | 98.9 | 134.1 | 157.7 | -63.1 | -48.9 | 0 | 0 | 0 | 122.4 | ||||
| 215 | D | 33.8 | Very low | 38.9 | Very low | 135 Ų | 135 | 139.2 Ų | 139.2 | 72% | 0.722 | 77% | 0.772 | S | S | * | * | trans | 58.5 | 113.5 | 149.7 | -84.9 | -67.3 | 0 | 0 | 0 | 123.8 | ||||
| 216 | L | 36.6 | Very low | 38.8 | Very low | 156 Ų | 156 | 141.3 Ų | 141.3 | 82% | 0.817 | 77% | 0.766 | S | S | * | * | trans | 40.6 | 154.2 | 134.8 | -69.8 | 174.7 | 0 | 0 | 0 | 123 | ||||
| 217 | P | 57.7 | Low | 38.6 | Very low | 108 Ų | 108 | 140.3 Ų | 140.3 | 70% | 0.701 | 77% | 0.771 | S | S | * | * | trans | -96.6 | 175.9 | -153.4 | 40 | -35.4 | 0 | 0 | 0 | 114.1 | ||||
| 218 | P | 41.7 | Very low | 39 | Very low | 122 Ų | 122 | 136.1 Ų | 136.1 | 79% | 0.792 | 77% | 0.768 | S | S | * | * | -142.5 | 137.8 | 121.7 | 33.4 | -17.5 | 0 | 0 | 0 | 114.1 | |||||
| 219 | S | 41.8 | Very low | 39.2 | Very low | 111 Ų | 111 | 137 Ų | 137 | 78% | 0.776 | 78% | 0.777 | S | S | * | * | trans | -64.1 | 157.9 | 150.8 | -50.9 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 220 | P | 47.6 | Very low | 39.6 | Very low | 106 Ų | 106 | 136.7 Ų | 136.7 | 69% | 0.688 | 78% | 0.781 | S | S | * | * | -156.8 | 154.6 | 90.2 | 34.5 | -13 | 0 | 0 | 0 | 117.8 | |||||
| 221 | L | 35.2 | Very low | 39.4 | Very low | 155 Ų | 155 | 135.2 Ų | 135.2 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | trans | 66.7 | 127.8 | 139.8 | -65.8 | 165.1 | 0 | 0 | 0 | 119.1 | ||||
| 222 | R | 34.8 | Very low | 40.1 | Very low | 240 Ų | 240 | 138.7 Ų | 138.7 | 91% | 0.906 | 79% | 0.786 | S | S | * | * | -163.7 | 124 | 105 | -77.9 | -116.7 | 172.8 | 103.7 | 4.9 | 111.2 | |||||
| 223 | Y | 38.5 | Very low | 40.4 | Very low | 180 Ų | 180 | 142.6 Ų | 142.6 | 71% | 0.706 | 79% | 0.792 | S | S | * | * | trans | -66.3 | 150.8 | 154.4 | -118 | -96.9 | 0 | 0 | 0 | 108.6 | M226 | Y223-M226 HydrophobicContact CE1-SD 4.48Š| ||
| 224 | P | 45.5 | Very low | 39.7 | Very low | 108 Ų | 108 | 142.7 Ų | 142.7 | 70% | 0.701 | 80% | 0.801 | S | S | * | * | -140.4 | 174.1 | 88 | 17.3 | 7.9 | 0 | 0 | 0 | 110.4 | |||||
| 225 | Q | 36.7 | Very low | 39.9 | Very low | 168 Ų | 168 | 139.3 Ų | 139.3 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | cis | 178.7 | 139.3 | 2.3 | 160.8 | 167.4 | 5.1 | 0 | 0 | 105.7 | ||||
| 226 | M | 34.5 | Very low | 40.2 | Very low | 148 Ų | 148 | 141.5 Ų | 141.5 | 73% | 0.729 | 81% | 0.807 | S | S | * | * | trans | -59.8 | 146 | 176.1 | -88.3 | 66 | -177.5 | 0 | 0 | 112.4 | Y223 | Y223-M226 HydrophobicContact CE1-SD 4.48Š| ||
| 227 | G | 32.9 | Very low | 40.5 | Very low | 77 Ų | 77 | 146.2 Ų | 146.2 | 79% | 0.794 | 82% | 0.815 | S | S | * | * | trans | -150.3 | 93.7 | 163 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 228 | D | 42 | Very low | 39.6 | Very low | 165 Ų | 165 | 147.3 Ų | 147.3 | 88% | 0.882 | 82% | 0.819 | S | S | * | * | trans | -65.6 | 144.9 | 169.4 | -71.1 | -51.8 | 0 | 0 | 0 | 111.1 | ||||
| 229 | G | 37.7 | Very low | 40.4 | Very low | 78 Ų | 78 | 147.5 Ų | 147.5 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | trans | -178.5 | 93.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 230 | L | 43.5 | Very low | 40.6 | Very low | 182 Ų | 182 | 148 Ų | 148 | 95% | 0.953 | 82% | 0.823 | S | S | * | * | trans | -47.6 | 145.7 | 177.9 | -60.5 | 160.4 | 0 | 0 | 0 | 115.5 | ||||
| 231 | G | 35.3 | Very low | 40.9 | Very low | 77 Ų | 77 | 148.7 Ų | 148.7 | 79% | 0.794 | 83% | 0.827 | S | S | * | * | trans | 170 | 93.5 | 160.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 232 | Y | 45.5 | Very low | 41.5 | Very low | 241 Ų | 241 | 150.7 Ų | 150.7 | 95% | 0.945 | 83% | 0.832 | S | S | * | * | trans | -81.7 | 139 | 165.6 | -76.8 | -93.3 | 0 | 0 | 0 | 110.4 | ||||
| 233 | Q | 40.8 | Very low | 41.6 | Very low | 198 Ų | 198 | 142.7 Ų | 142.7 | 93% | 0.925 | 83% | 0.825 | S | S | * | * | trans | -149.2 | 131.2 | 144.3 | -159.8 | 174.5 | 23.1 | 0 | 0 | 111.3 | ||||
| 234 | A | 37.5 | Very low | 41.5 | Very low | 102 Ų | 102 | 144.7 Ų | 144.7 | 84% | 0.843 | 83% | 0.832 | S | S | * | * | trans | -97.5 | 160.9 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 235 | G | 38 | Very low | 41.7 | Very low | 69 Ų | 69 | 145 Ų | 145 | 71% | 0.711 | 83% | 0.832 | S | S | * | * | trans | 126.7 | 142.7 | 159.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 236 | M | 40.4 | Very low | 42 | Very low | 180 Ų | 180 | 143.5 Ų | 143.5 | 89% | 0.887 | 83% | 0.829 | S | S | * | * | cis | -162.3 | 135.7 | 3.5 | -81.6 | 143.9 | 78.3 | 0 | 0 | 105.2 | ||||
| 237 | W | 43.2 | Very low | 42.4 | Very low | 256 Ų | 256 | 141 Ų | 141 | 97% | 0.97 | 83% | 0.827 | S | S | * | * | trans | -109.3 | 123.8 | 168.7 | -71.8 | 91.2 | 0 | 0 | 0 | 109.5 | ||||
| 238 | T | 39.5 | Very low | 42.8 | Very low | 130 Ų | 130 | 146.4 Ų | 146.4 | 80% | 0.798 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -89.5 | 139.1 | 172.1 | 49.4 | 0 | 0 | 0 | 0 | 110.9 | ||
| 239 | P | 56.9 | Low | 42.8 | Very low | 126 Ų | 126 | 145.1 Ų | 145.1 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 152.9 | -179.8 | 2.3 | 17.2 | 0 | 0 | 0 | 113.8 | ||
| 240 | C | 47.2 | Very low | 43 | Very low | 122 Ų | 122 | 149.9 Ų | 149.9 | 82% | 0.824 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 145.8 | 171.6 | -161.3 | 0 | 0 | 0 | 0 | 112.1 | ||
| 241 | P | 53.9 | Low | 43.4 | Very low | 121 Ų | 121 | 146.5 Ų | 146.5 | 79% | 0.786 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -90.4 | 123.4 | 167.7 | 32.1 | -27.1 | 0 | 0 | 0 | 112.1 | ||
| 242 | Q | 47.6 | Very low | 44.1 | Very low | 197 Ų | 197 | 147.7 Ų | 147.7 | 92% | 0.921 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -66 | 140.7 | 157.9 | -173.7 | 92.9 | 9.4 | 0 | 0 | 110.3 | ||
| 243 | G | 37.6 | Very low | 44.3 | Very low | 72 Ų | 72 | 142.4 Ų | 142.4 | 74% | 0.742 | 81% | 0.806 | S | S | * | * | trans | 145.2 | 100.9 | 150.4 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 244 | Y | 35.3 | Very low | 44.3 | Very low | 221 Ų | 221 | 138.6 Ų | 138.6 | 87% | 0.867 | 80% | 0.796 | S | S | * | * | trans | -147.8 | 128.2 | 141.6 | -164.5 | -104.7 | 0 | 0 | 0 | 109.7 | ||||
| 245 | V | 50.1 | Low | 44.7 | Very low | 115 Ų | 115 | 141.5 Ų | 141.5 | 70% | 0.697 | 80% | 0.796 | S | S | * | * | trans | -85.7 | 150 | -172.7 | -70.8 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 246 | D | 42.3 | Very low | 44.7 | Very low | 136 Ų | 136 | 141.8 Ų | 141.8 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | trans | -59.7 | 142.2 | 172.6 | -155.2 | -28.3 | 0 | 0 | 0 | 111.2 | ||||
| 247 | S | 42.6 | Very low | 44.9 | Very low | 97 Ų | 97 | 141.3 Ų | 141.3 | 68% | 0.678 | 80% | 0.8 | S | S | * | * | trans | -143.2 | 104.9 | 171.1 | -78.3 | 0 | 0 | 0 | 0 | 109.2 | V249 | S247-V249 PolarHBondContact O-N 2.87Š| ||
| 248 | F | 41 | Very low | 45.1 | Very low | 190 Ų | 190 | 134.2 Ų | 134.2 | 83% | 0.833 | 79% | 0.787 | S | S | * | * | trans | -57.7 | 117.8 | 165.8 | -79.5 | -103.6 | 0 | 0 | 0 | 111 | ||||
| 249 | V | 42.1 | Very low | 45 | Very low | 137 Ų | 137 | 138.6 Ų | 138.6 | 83% | 0.83 | 79% | 0.789 | S | S | * | * | trans | -145.7 | 121.1 | 150.2 | 170.6 | 0 | 0 | 0 | 0 | 108.9 | S247 | S247-V249 PolarHBondContact O-N 2.87Š| ||
| 250 | E | 43.5 | Very low | 44.5 | Very low | 178 Ų | 178 | 141.1 Ų | 141.1 | 83% | 0.832 | 79% | 0.79 | S | S | * | * | trans | -64.3 | 137.3 | 172.3 | -179.8 | -175 | 127.3 | 0 | 0 | 112.5 | ||||
| 251 | P | 50.9 | Low | 44.3 | Very low | 112 Ų | 112 | 139.4 Ų | 139.4 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | trans | -104.6 | 140.1 | 162.5 | 33.6 | -26.6 | 0 | 0 | 0 | 112.5 | ||||
| 252 | P | 49.8 | Very low | 43.6 | Very low | 101 Ų | 101 | 138.4 Ų | 138.4 | 66% | 0.656 | 77% | 0.771 | S | S | * | * | trans | -77 | 164.3 | -179.5 | 32.2 | -34.2 | 0 | 0 | 0 | 112.9 | T254 | P252-T254 PolarHBondContact O-N 3.23Š| ||
| 253 | P | 50.8 | Low | 43.3 | Very low | 130 Ų | 130 | 138.3 Ų | 138.3 | 84% | 0.844 | 76% | 0.764 | S | S | * | * | trans | -84.8 | 118.1 | -168.3 | 32.9 | -31.2 | 0 | 0 | 0 | 111.3 | ||||
| 254 | T | 41.2 | Very low | 43.8 | Very low | 119 Ų | 119 | 143.2 Ų | 143.2 | 73% | 0.73 | 77% | 0.77 | S | S | * | * | trans | -119.8 | 112.2 | 171.1 | 52.2 | 0 | 0 | 0 | 0 | 111.6 | P252 | P252-T254 PolarHBondContact O-N 3.23Š| ||
| 255 | L | 44.8 | Very low | 44.3 | Very low | 162 Ų | 162 | 140.9 Ų | 140.9 | 85% | 0.848 | 77% | 0.767 | S | S | * | * | trans | 69.9 | 96.2 | 141.2 | -56.6 | 173.6 | 0 | 0 | 0 | 116.9 | ||||
| 256 | G | 36.9 | Very low | 43.8 | Very low | 76 Ų | 76 | 148.1 Ų | 148.1 | 78% | 0.784 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 132.4 | 159.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | P258 | G256-P258 WeakPolarHBondContact O-CD 3.08Š|
| 257 | L | 45.2 | Very low | 43.9 | Very low | 170 Ų | 170 | 148.7 Ų | 148.7 | 89% | 0.89 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -83.2 | 120.2 | 166.5 | -70.3 | 166.8 | 0 | 0 | 0 | 108.6 | ||
| 258 | P | 48 | Very low | 43.9 | Very low | 107 Ų | 107 | 151.4 Ų | 151.4 | 70% | 0.695 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 126.9 | 175.8 | 31.3 | -30.5 | 0 | 0 | 0 | 110.5 | G256 Q260 | G256-P258 WeakPolarHBondContact O-CD 3.08Å; P258-Q260 PolarHBondContact O-N 2.86Å |
| 259 | W | 38.2 | Very low | 44.1 | Very low | 221 Ų | 221 | 149.3 Ų | 149.3 | 84% | 0.837 | 80% | 0.801 | S | S | * | * | trans | -67.8 | 107.1 | 163.6 | 55 | -78.6 | 0 | 0 | 0 | 107.3 | V261 | W259-V261 HydrophobicContact CE3-CG2 3.43Å; W259-V261 VanDerWaalsContact CE3-CG2 3.43Å; W259-V261 HydrophobicContact CH2-CG2 3.69Å; W259-V261 HydrophobicContact CZ3-CB 4.44Å; W259-V261 HydrophobicContact CZ3-CG2 2.94Å; W259-V261 PolarHBondContact O-N 3.3Å | ||
| 260 | Q | 44.9 | Very low | 44.2 | Very low | 179 Ų | 179 | 150 Ų | 150 | 84% | 0.836 | 80% | 0.799 | S | S | * | * | trans | -72.1 | 120 | 176.9 | -77.8 | -162.9 | -42.7 | 0 | 0 | 110.3 | P258 | P258-Q260 PolarHBondContact O-N 2.86Š| ||
| 261 | V | 43.5 | Very low | 44.3 | Very low | 87 Ų | 87 | 148.3 Ų | 148.3 | 53% | 0.527 | 80% | 0.797 | S | S | . | * | trans | -85.3 | 107.9 | 159.9 | 179.8 | 0 | 0 | 0 | 0 | 107.3 | W259 Y263 | W259-V261 HydrophobicContact CE3-CG2 3.43Å; W259-V261 VanDerWaalsContact CE3-CG2 3.43Å; W259-V261 HydrophobicContact CH2-CG2 3.69Å; W259-V261 HydrophobicContact CZ3-CB 4.44Å; W259-V261 HydrophobicContact CZ3-CG2 2.94Å; W259-V261 PolarHBondContact O-N 3.3Å; V261-Y263 HydrophobicContact CG1-CD2 4Å; V261-Y263 PolarHBondContact O-N 3.42Å | ||
| 262 | S | 38.7 | Very low | 43.8 | Very low | 100 Ų | 100 | 150.7 Ų | 150.7 | 70% | 0.699 | 80% | 0.801 | S | S | * | * | trans | -78.9 | 99 | 162.6 | -84 | 0 | 0 | 0 | 0 | 109 | ||||
| 263 | Y | 42.2 | Very low | 43.4 | Very low | 195 Ų | 195 | 154.2 Ų | 154.2 | 77% | 0.765 | 81% | 0.812 | S | S | * | * | trans | -73.8 | 118.4 | 148.9 | -108 | -95.1 | 0 | 0 | 0 | 107.1 | V261 | V261-Y263 HydrophobicContact CG1-CD2 4Å; V261-Y263 PolarHBondContact O-N 3.42Å | ||
| 264 | M | 48.7 | Very low | 42.8 | Very low | 174 Ų | 174 | 156.1 Ų | 156.1 | 86% | 0.857 | 81% | 0.809 | S | S | * | * | trans | -105.4 | 107.8 | 162.8 | -76.5 | -77.3 | 97.3 | 0 | 0 | 107.8 | ||||
| 265 | Q | 44.6 | Very low | 43 | Very low | 172 Ų | 172 | 159.2 Ų | 159.2 | 80% | 0.804 | 82% | 0.816 | S | S | * | * | trans | -132.3 | 99.7 | 165.5 | 178.5 | 168.6 | 43.2 | 0 | 0 | 106.4 | ||||
| 266 | E | 39.7 | Very low | 42.8 | Very low | 267 Ų | 267 | 158.9 Ų | 158.9 | 100% | 1.248 | 81% | 0.813 | S | S | * | * | -164.9 | 0 | 128.9 | -131 | 171.4 | 110.5 | 0 | 0 | 109.3 |
Retrieved 266 of 266 residues in 133 ms
(Link to these results)