| 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 | 36.7 | Very low | 47.9 | Very low | 240 Ų | 240 | 141.5 Ų | 141.5 | 100% | 1.182 | 86% | 0.857 | S | S | * | * | 0 | 125.6 | 0 | -74 | 169.4 | 143.6 | 0 | 0 | 107.8 | |||||
| 2 | C | 43.1 | Very low | 47.3 | Very low | 115 Ų | 115 | 138.3 Ų | 138.3 | 78% | 0.777 | 86% | 0.856 | S | S | * | * | trans | 63.3 | 102.9 | 167.4 | -51.3 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 3 | L | 42.2 | Very low | 47.6 | Very low | 169 Ų | 169 | 135.3 Ų | 135.3 | 89% | 0.885 | 85% | 0.854 | S | S | * | * | 61.5 | 134.5 | 68.4 | -59.2 | 173.5 | 0 | 0 | 0 | 111.3 | |||||
| 4 | A | 46 | Very low | 47.9 | Very low | 95 Ų | 95 | 135.1 Ų | 135.1 | 79% | 0.785 | 86% | 0.855 | S | S | * | * | cis | -173.9 | 167.7 | 3.3 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 5 | G | 43 | Very low | 47.5 | Very low | 70 Ų | 70 | 130.5 Ų | 130.5 | 72% | 0.722 | 84% | 0.843 | S | S | * | * | trans | 96.6 | 72.9 | 132.9 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 6 | C | 50.2 | Low | 47.4 | Very low | 138 Ų | 138 | 138.6 Ų | 138.6 | 93% | 0.932 | 85% | 0.852 | S | S | * | * | trans | -93.6 | 108.7 | 149.3 | -77.6 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 7 | T | 63.1 | Low | 47.2 | Very low | 131 Ų | 131 | 135.2 Ų | 135.2 | 80% | 0.804 | 85% | 0.85 | S | S | * | * | trans | -100.8 | 133.1 | 165.1 | 48.6 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 8 | P | 59 | Low | 47 | Very low | 131 Ų | 131 | 133.3 Ų | 133.3 | 85% | 0.851 | 85% | 0.85 | S | S | * | * | trans | -92.9 | 133.5 | 164.8 | 32.1 | -27.2 | 0 | 0 | 0 | 110.1 | ||||
| 9 | R | 42.3 | Very low | 47.4 | Very low | 240 Ų | 240 | 135.2 Ų | 135.2 | 91% | 0.906 | 85% | 0.851 | S | S | * | * | trans | -132.8 | 101.3 | 176.6 | -177.2 | -178.5 | 174.8 | -138.4 | -0.2 | 109.1 | ||||
| 10 | T | 52.5 | Low | 47.6 | Very low | 139 Ų | 139 | 134 Ų | 134 | 85% | 0.853 | 85% | 0.845 | S | S | * | * | trans | -149.1 | 126.3 | 163.3 | -63.6 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 11 | A | 48.8 | Very low | 47.6 | Very low | 88 Ų | 88 | 138.3 Ų | 138.3 | 73% | 0.727 | 85% | 0.845 | S | S | * | * | trans | 52.2 | 114 | 155.8 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 12 | A | 41.2 | Very low | 47.8 | Very low | 103 Ų | 103 | 132.2 Ų | 132.2 | 85% | 0.851 | 83% | 0.833 | S | S | * | * | 62.8 | 97.3 | 59.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 13 | A | 51.1 | Low | 48 | Very low | 100 Ų | 100 | 136.8 Ų | 136.8 | 83% | 0.826 | 83% | 0.834 | S | S | * | * | trans | -174.8 | 129.8 | 132.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 14 | P | 51.9 | Low | 48.3 | Very low | 133 Ų | 133 | 136.5 Ų | 136.5 | 86% | 0.864 | 83% | 0.832 | S | S | * | * | trans | -101.8 | 152.8 | 169.4 | 36.1 | -27.7 | 0 | 0 | 0 | 111.6 | ||||
| 15 | G | 40.8 | Very low | 48.5 | Very low | 66 Ų | 66 | 136.9 Ų | 136.9 | 68% | 0.68 | 83% | 0.827 | S | S | * | * | trans | 142.2 | 118.4 | 148.1 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 16 | R | 46.7 | Very low | 48.7 | Very low | 260 Ų | 260 | 145.7 Ų | 145.7 | 98% | 0.981 | 84% | 0.838 | S | S | * | * | trans | 81.3 | 122.4 | 135.5 | -59.5 | -178.6 | 171.8 | -135.8 | -3 | 118.6 | ||||
| 17 | G | 43.2 | Very low | 48.8 | Very low | 80 Ų | 80 | 145.5 Ų | 145.5 | 83% | 0.825 | 83% | 0.833 | S | S | * | * | trans | 157.6 | 42.3 | 158.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 18 | A | 43.9 | Very low | 48 | Very low | 102 Ų | 102 | 143.6 Ų | 143.6 | 84% | 0.843 | 83% | 0.831 | S | S | * | * | trans | -76 | 122.1 | 164.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 19 | L | 54.6 | Low | 47.7 | Very low | 168 Ų | 168 | 143.3 Ų | 143.3 | 88% | 0.88 | 83% | 0.829 | S | S | * | * | trans | -132.9 | 145.3 | 160.9 | -82.9 | 174.1 | 0 | 0 | 0 | 110.2 | ||||
| 20 | P | 51.4 | Low | 47.6 | Very low | 111 Ų | 111 | 136.7 Ų | 136.7 | 72% | 0.721 | 83% | 0.825 | S | S | * | * | trans | -97.6 | 153.1 | -161.3 | 37.4 | -34.3 | 0 | 0 | 0 | 114.8 | ||||
| 21 | R | 47.5 | Very low | 47 | Very low | 225 Ų | 225 | 134.4 Ų | 134.4 | 85% | 0.849 | 82% | 0.821 | S | S | * | * | trans | 26.7 | 109 | 143.9 | -72.3 | -175.9 | 158.2 | -170.1 | -2.7 | 118 | ||||
| 22 | A | 41.1 | Very low | 46.6 | Very low | 112 Ų | 112 | 134.8 Ų | 134.8 | 93% | 0.926 | 82% | 0.824 | S | S | * | * | trans | -110.9 | 110.8 | 141.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 23 | R | 47.9 | Very low | 47.1 | Very low | 211 Ų | 211 | 136.4 Ų | 136.4 | 80% | 0.796 | 82% | 0.823 | S | S | * | * | trans | -103.4 | 145.1 | 171 | -152.4 | -178.4 | -152.5 | -117.3 | 4.4 | 105.9 | ||||
| 24 | L | 48.6 | Very low | 46.9 | Very low | 163 Ų | 163 | 139 Ų | 139 | 85% | 0.853 | 82% | 0.82 | S | S | * | * | trans | 134.8 | 152.9 | 153.2 | -72.9 | 164.5 | 0 | 0 | 0 | 111.3 | ||||
| 25 | P | 50.2 | Low | 46.5 | Very low | 104 Ų | 104 | 141.9 Ų | 141.9 | 68% | 0.675 | 82% | 0.82 | S | S | * | * | cis | -125.7 | 158.4 | -33.2 | 30.5 | -13.3 | 0 | 0 | 0 | 112.8 | T27 | P25-T27 PolarHBondContact O-N 3.43Š| ||
| 26 | R | 47.4 | Very low | 47.1 | Very low | 254 Ų | 254 | 145.9 Ų | 145.9 | 96% | 0.958 | 82% | 0.82 | S | S | * | * | trans | -67.9 | 121.6 | 166.1 | -71.1 | 162.5 | 90.4 | -173.2 | 8.8 | 108.8 | ||||
| 27 | T | 52.1 | Low | 46.9 | Very low | 134 Ų | 134 | 138.8 Ų | 138.8 | 82% | 0.822 | 81% | 0.808 | S | S | * | * | trans | -120.3 | 114.2 | 155.9 | 53.8 | 0 | 0 | 0 | 0 | 107.8 | P25 | P25-T27 PolarHBondContact O-N 3.43Š| ||
| 28 | A | 45.2 | Very low | 47.3 | Very low | 92 Ų | 92 | 139.1 Ų | 139.1 | 76% | 0.76 | 80% | 0.803 | S | S | * | * | trans | -111.8 | 176.2 | 159.8 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 29 | P | 53.5 | Low | 47.4 | Very low | 125 Ų | 125 | 138.4 Ų | 138.4 | 81% | 0.812 | 80% | 0.797 | S | S | * | * | cis | -123.9 | -177.8 | -30.1 | 31.3 | -12.5 | 0 | 0 | 0 | 110.4 | ||||
| 30 | A | 39.5 | Very low | 47.4 | Very low | 100 Ų | 100 | 140.1 Ų | 140.1 | 83% | 0.826 | 80% | 0.798 | S | S | * | * | trans | 129.6 | 99.2 | 149.8 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 31 | A | 41.2 | Very low | 47.9 | Very low | 92 Ų | 92 | 146.1 Ų | 146.1 | 76% | 0.76 | 81% | 0.806 | S | S | * | * | trans | 171.7 | 68.9 | 131.7 | 0 | 0 | 0 | 0 | 0 | 107 | T33 | A31-T33 VanDerWaalsContact C-N 3.29Å; A31-T33 PolarHBondContact O-N 3.04Å | ||
| 32 | A | 40.4 | Very low | 48.3 | Very low | 95 Ų | 95 | 137.9 Ų | 137.9 | 79% | 0.785 | 79% | 0.791 | S | S | * | * | trans | -69.8 | 96.4 | 161.1 | 0 | 0 | 0 | 0 | 0 | 106.4 | M34 | A32-M34 VanDerWaalsContact C-N 3.3Å; A32-M34 PolarHBondContact O-N 3.18Å | ||
| 33 | T | 50.2 | Low | 48.9 | Very low | 138 Ų | 138 | 141.3 Ų | 141.3 | 85% | 0.847 | 79% | 0.785 | S | S | * | * | trans | -60.4 | 101.7 | 163.4 | -13.7 | 0 | 0 | 0 | 0 | 105.9 | A31 F35 | A31-T33 VanDerWaalsContact C-N 3.29Å; A31-T33 PolarHBondContact O-N 3.04Å; T33-F35 VanDerWaalsContact C-N 3.29Å; T33-F35 PolarHBondContact O-N 3.16Å | ||
| 34 | M | 46.3 | Very low | 49.8 | Very low | 154 Ų | 154 | 135.2 Ų | 135.2 | 76% | 0.759 | 77% | 0.771 | S | S | * | * | trans | -61 | 93 | 173.6 | -75.3 | -148.4 | -76.4 | 0 | 0 | 108.6 | A32 Q36 | A32-M34 VanDerWaalsContact C-N 3.3Å; A32-M34 PolarHBondContact O-N 3.18Å; M34-Q36 PolarHBondContact O-N 3.49Å | ||
| 35 | F | 44.3 | Very low | 50.3 | Low | 194 Ų | 194 | 134.2 Ų | 134.2 | 85% | 0.851 | 77% | 0.766 | S | S | * | * | trans | -75.1 | 86.6 | 158.3 | -156 | -95.4 | 0 | 0 | 0 | 106.4 | T33 P37 | T33-F35 VanDerWaalsContact C-N 3.29Å; T33-F35 PolarHBondContact O-N 3.16Å; F35-P37 WeakPolarHBondContact O-CD 3.37Å | ||
| 36 | Q | 52.9 | Low | 50.6 | Low | 149 Ų | 149 | 137 Ų | 137 | 70% | 0.696 | 77% | 0.769 | S | S | * | * | trans | -57.8 | 121.7 | 169.5 | -68.4 | -170.6 | 11.3 | 0 | 0 | 107.5 | M34 A38 | M34-Q36 PolarHBondContact O-N 3.49Å; Q36-A38 PolarHBondContact O-N 3.18Å | ||
| 37 | P | 44.1 | Very low | 51.2 | Low | 112 Ų | 112 | 129 Ų | 129 | 73% | 0.727 | 75% | 0.753 | S | S | * | * | trans | -65.3 | 109.5 | 165.6 | 27.1 | -30.2 | 0 | 0 | 0 | 106.1 | F35 A39 | F35-P37 WeakPolarHBondContact O-CD 3.37Å; P37-A39 PolarHBondContact O-N 3.24Å | ||
| 38 | A | 50 | Low | 51.6 | Low | 87 Ų | 87 | 128.5 Ų | 128.5 | 72% | 0.719 | 75% | 0.745 | S | S | * | * | trans | -47.5 | 114.2 | 169.7 | 0 | 0 | 0 | 0 | 0 | 107.5 | Q36 K40 | Q36-A38 PolarHBondContact O-N 3.18Å; A38-K40 PolarHBondContact O-N 2.87Å | ||
| 39 | A | 46.5 | Very low | 52.1 | Low | 87 Ų | 87 | 130 Ų | 130 | 72% | 0.719 | 74% | 0.744 | S | S | * | * | trans | -52 | 113 | 178.3 | 0 | 0 | 0 | 0 | 0 | 106.8 | P37 R41 | P37-A39 PolarHBondContact O-N 3.24Å; A39-R41 PolarHBondContact O-N 3.33Å | ||
| 40 | K | 55.8 | Low | 51.9 | Low | 204 Ų | 204 | 128.3 Ų | 128.3 | 89% | 0.887 | 74% | 0.741 | S | S | * | * | trans | -67.4 | 92.4 | 175.4 | -55.1 | -169.7 | -172.7 | -167.5 | 0 | 105 | A38 G42 | A38-K40 PolarHBondContact O-N 2.87Å; K40-G42 PolarHBondContact O-N 3.39Å | ||
| 41 | R | 61.1 | Low | 52.6 | Low | 237 Ų | 237 | 132.1 Ų | 132.1 | 89% | 0.894 | 74% | 0.739 | S | S | * | * | trans | -49.3 | 109.5 | 174.6 | -75.8 | -172.7 | -92 | -134.6 | -1.3 | 105.8 | A39 F43 | A39-R41 PolarHBondContact O-N 3.33Å; R41-F43 PolarHBondContact O-N 2.97Å | ||
| 42 | G | 55.4 | Low | 52.7 | Low | 52 Ų | 52 | 135.8 Ų | 135.8 | 54% | 0.536 | 75% | 0.745 | S | S | . | * | trans | -54.8 | 137 | 175.1 | 0 | 0 | 0 | 0 | 0 | 107.3 | K40 T44 | K40-G42 PolarHBondContact O-N 3.39Å; G42-T44 PolarHBondContact O-N 3.5Å; G42-T44 PolarHBondContact O-OG1 3.43Å | ||
| 43 | F | 53.6 | Low | 52.6 | Low | 183 Ų | 183 | 135.2 Ų | 135.2 | 80% | 0.803 | 75% | 0.748 | S | S | * | * | trans | -70.5 | 84.7 | 173 | -161.8 | -92 | 0 | 0 | 0 | 107.5 | R41 L48 | R41-F43 PolarHBondContact O-N 2.97Å; F43-L48 HydrophobicContact CE1-CD1 4.02Å; F43-L48 HydrophobicContact CE2-CD1 4.33Å; F43-L48 HydrophobicContact CZ-CD1 3.57Å | ||
| 44 | T | 67.3 | Low | 52 | Low | 83 Ų | 83 | 132.1 Ų | 132.1 | 51% | 0.509 | 74% | 0.744 | S | S | . | * | trans | -90.7 | 136.1 | 173.9 | -18.7 | 0 | 0 | 0 | 0 | 107.6 | G42 E46 S47 | G42-T44 PolarHBondContact O-N 3.5Å; G42-T44 PolarHBondContact O-OG1 3.43Å; T44-E46 PolarHBondContact O-N 3.04Å; T44-S47 PolarHBondContact O-N 2.95Å | ||
| 45 | I | 58.8 | Low | 51.6 | Low | 143 Ų | 143 | 131.7 Ų | 131.7 | 73% | 0.733 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -56.3 | -25.6 | -176.9 | -62.6 | 166.7 | 0 | 0 | 0 | 111.6 | S47 L48 | I45-S47 VanDerWaalsContact C-N 3.31Å; I45-S47 PolarHBondContact O-N 2.99Å; I45-L48 WeakPolarHBondContact O-CB 3.49Å; I45-L48 PolarHBondContact O-N 3.18Å; I45-L48 VanDerWaalsContact O-N 3.13Å |
| 46 | E | 57.7 | Low | 51.2 | Low | 161 Ų | 161 | 126.6 Ų | 126.6 | 75% | 0.752 | 75% | 0.752 | S | S | * | * | G | 310 helix | trans | -68.4 | -23 | 177.2 | -57.4 | -168.8 | 150.9 | 0 | 0 | 114.1 | T44 L48 V49 | T44-E46 PolarHBondContact O-N 3.04Å; E46-L48 PolarHBondContact O-N 2.99Å; E46-V49 PolarHBondContact O-N 3.49Å |
| 47 | S | 58.4 | Low | 50.3 | Low | 88 Ų | 88 | 123.5 Ų | 123.5 | 62% | 0.615 | 76% | 0.761 | S | S | * | * | G | 310 helix | trans | -72 | -14.6 | 172 | -83.4 | 0 | 0 | 0 | 0 | 113.6 | T44 I45 V49 | T44-S47 PolarHBondContact O-N 2.95Å; I45-S47 VanDerWaalsContact C-N 3.31Å; I45-S47 PolarHBondContact O-N 2.99Å; S47-V49 VanDerWaalsContact C-N 3.33Å |
| 48 | L | 61.8 | Low | 49.8 | Very low | 123 Ų | 123 | 121.4 Ų | 121.4 | 64% | 0.644 | 76% | 0.759 | S | S | * | * | G | 310 helix | trans | -78.8 | -17.5 | 174.6 | -116.5 | 84.1 | 0 | 0 | 0 | 112.9 | F43 I45 E46 | F43-L48 HydrophobicContact CE1-CD1 4.02Å; F43-L48 HydrophobicContact CE2-CD1 4.33Å; F43-L48 HydrophobicContact CZ-CD1 3.57Å; I45-L48 WeakPolarHBondContact O-CB 3.49Å; I45-L48 PolarHBondContact O-N 3.18Å; I45-L48 VanDerWaalsContact O-N 3.13Å; E46-L48 PolarHBondContact O-N 2.99Å |
| 49 | V | 56.2 | Low | 49.1 | Very low | 123 Ų | 123 | 124.6 Ų | 124.6 | 75% | 0.745 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.6 | -14.1 | -175.3 | 174.3 | 0 | 0 | 0 | 0 | 112.3 | E46 S47 K51 | E46-V49 PolarHBondContact O-N 3.49Å; S47-V49 VanDerWaalsContact C-N 3.33Å; V49-K51 VanDerWaalsContact C-N 3.26Å; V49-K51 PolarHBondContact O-N 2.92Å |
| 50 | A | 47.8 | Very low | 48.4 | Very low | 90 Ų | 90 | 124.3 Ų | 124.3 | 74% | 0.744 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -85.8 | 22.7 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 51 | K | 54.1 | Low | 47.3 | Very low | 180 Ų | 180 | 118.5 Ų | 118.5 | 78% | 0.783 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -128.6 | 69.8 | 177.3 | -173.2 | 80 | 174.9 | -177.4 | 0 | 109.1 | V49 | V49-K51 VanDerWaalsContact C-N 3.26Å; V49-K51 PolarHBondContact O-N 2.92Å |
| 52 | D | 43.7 | Very low | 45.9 | Very low | 169 Ų | 169 | 111.4 Ų | 111.4 | 90% | 0.904 | 77% | 0.774 | S | S | * | * | trans | -173.9 | 117.6 | 148.3 | -84.1 | -38.2 | 0 | 0 | 0 | 108.5 | ||||
| 53 | G | 39.7 | Very low | 44.7 | Very low | 82 Ų | 82 | 113 Ų | 113 | 85% | 0.845 | 79% | 0.791 | S | S | * | * | trans | 155.9 | 50.9 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 54 | G | 36.3 | Very low | 43.8 | Very low | 73 Ų | 73 | 109.6 Ų | 109.6 | 75% | 0.753 | 80% | 0.796 | S | S | * | * | trans | -91.2 | 124.8 | 167.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 55 | T | 37.8 | Very low | 42.1 | Very low | 146 Ų | 146 | 109.1 Ų | 109.1 | 90% | 0.896 | 81% | 0.808 | S | S | * | * | trans | -153.6 | 113.4 | 156.3 | -12.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 56 | G | 36.1 | Very low | 41.1 | Very low | 87 Ų | 87 | 108.5 Ų | 108.5 | 90% | 0.897 | 82% | 0.816 | S | S | * | * | trans | 80.2 | 113.5 | 142 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 57 | G | 33.5 | Very low | 40.1 | Very low | 84 Ų | 84 | 108.9 Ų | 108.9 | 87% | 0.866 | 82% | 0.818 | S | S | * | * | trans | 163.7 | 90.5 | 158 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 58 | G | 34.8 | Very low | 39.2 | Very low | 67 Ų | 67 | 110.8 Ų | 110.8 | 69% | 0.691 | 82% | 0.82 | S | S | * | * | trans | -83.5 | -166.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 59 | T | 35.3 | Very low | 37.9 | Very low | 154 Ų | 154 | 112.1 Ų | 112.1 | 95% | 0.945 | 83% | 0.827 | S | S | * | * | trans | 80.6 | 128.1 | -177.7 | 76.8 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 60 | G | 31.4 | Very low | 36.7 | Very low | 81 Ų | 81 | 110.4 Ų | 110.4 | 84% | 0.835 | 83% | 0.826 | S | S | * | * | cis | 140.5 | 121.4 | 15.3 | 0 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 61 | G | 32.5 | Very low | 35.9 | Very low | 83 Ų | 83 | 111 Ų | 111 | 86% | 0.856 | 83% | 0.831 | S | S | * | * | trans | 169.4 | 87.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 62 | G | 31.4 | Very low | 34.9 | Very low | 88 Ų | 88 | 107.4 Ų | 107.4 | 91% | 0.907 | 84% | 0.835 | S | S | * | * | trans | -77.5 | 154.6 | 170.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 63 | G | 31.1 | Very low | 34.5 | Very low | 86 Ų | 86 | 103.6 Ų | 103.6 | 89% | 0.887 | 83% | 0.827 | S | S | * | * | trans | -160.7 | 109 | 168.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 64 | A | 34.4 | Very low | 34.3 | Very low | 111 Ų | 111 | 104.8 Ų | 104.8 | 92% | 0.917 | 82% | 0.822 | S | S | * | * | trans | -93.8 | 157.4 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 65 | G | 31.9 | Very low | 34.2 | Very low | 73 Ų | 73 | 110.3 Ų | 110.3 | 75% | 0.753 | 83% | 0.828 | S | S | * | * | trans | 108.2 | 122.6 | 170.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 66 | S | 38 | Very low | 34.6 | Very low | 130 Ų | 130 | 110.9 Ų | 110.9 | 91% | 0.909 | 82% | 0.821 | S | S | * | * | cis | -160.9 | 152 | 33.8 | -59.8 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 67 | H | 37 | Very low | 35 | Very low | 168 Ų | 168 | 112.7 Ų | 112.7 | 78% | 0.778 | 82% | 0.817 | S | S | * | * | trans | -93.4 | 165 | -169.8 | 173.9 | -109.5 | 0 | 0 | 0 | 113.9 | ||||
| 68 | L | 37.9 | Very low | 35.3 | Very low | 128 Ų | 128 | 115.6 Ų | 115.6 | 67% | 0.67 | 81% | 0.812 | S | S | * | * | trans | 104.4 | 125.8 | 168.8 | -60.3 | 169.2 | 0 | 0 | 0 | 114 | ||||
| 69 | L | 35.5 | Very low | 35.8 | Very low | 152 Ų | 152 | 123.1 Ų | 123.1 | 80% | 0.796 | 82% | 0.819 | S | S | * | * | cis | -167.1 | 155.3 | 15.1 | -130 | 150.5 | 0 | 0 | 0 | 109.2 | ||||
| 70 | A | 30.9 | Very low | 36.2 | Very low | 87 Ų | 87 | 121.9 Ų | 121.9 | 72% | 0.719 | 81% | 0.814 | S | S | * | * | trans | 96.7 | 103.4 | 149.7 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 71 | A | 30.2 | Very low | 36.7 | Very low | 102 Ų | 102 | 124.5 Ų | 124.5 | 84% | 0.843 | 81% | 0.814 | S | S | * | * | 115.3 | 123 | 113.8 | 0 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 72 | A | 33.7 | Very low | 36.9 | Very low | 105 Ų | 105 | 124.9 Ų | 124.9 | 87% | 0.868 | 81% | 0.809 | S | S | * | * | trans | 77.5 | 106.8 | 150.3 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 73 | A | 35 | Very low | 37.3 | Very low | 89 Ų | 89 | 127.6 Ų | 127.6 | 74% | 0.736 | 80% | 0.802 | S | S | * | * | trans | -76.7 | 155.3 | 166.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 74 | S | 35 | Very low | 37.7 | Very low | 107 Ų | 107 | 130.4 Ų | 130.4 | 75% | 0.748 | 80% | 0.797 | S | S | * | * | trans | 58.2 | 116 | 150.6 | 43.4 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 75 | E | 34.7 | Very low | 37.8 | Very low | 189 Ų | 189 | 134.4 Ų | 134.4 | 88% | 0.883 | 79% | 0.789 | S | S | * | * | 175.8 | 133.7 | 121.3 | -85.5 | -84 | 107.8 | 0 | 0 | 109.3 | |||||
| 76 | E | 46.2 | Very low | 38.5 | Very low | 158 Ų | 158 | 136.1 Ų | 136.1 | 74% | 0.738 | 79% | 0.787 | S | S | * | * | trans | -75.9 | 138.9 | -175.5 | 179 | -178.3 | 141.6 | 0 | 0 | 112.4 | ||||
| 77 | P | 43.9 | Very low | 38.7 | Very low | 124 Ų | 124 | 138 Ų | 138 | 81% | 0.805 | 78% | 0.781 | S | S | * | * | trans | -110.5 | 90.1 | 162 | 32.5 | -22.2 | 0 | 0 | 0 | 111.9 | ||||
| 78 | L | 40.7 | Very low | 39.4 | Very low | 146 Ų | 146 | 135.4 Ų | 135.4 | 76% | 0.764 | 78% | 0.78 | S | S | * | * | trans | 17.2 | 123.2 | 132.3 | -63.7 | 161.9 | 0 | 0 | 0 | 117.7 | ||||
| 79 | R | 44.3 | Very low | 39.3 | Very low | 224 Ų | 224 | 134.4 Ų | 134.4 | 85% | 0.845 | 78% | 0.783 | S | S | * | * | trans | -67 | 146.5 | 167.8 | -56.3 | -110.9 | 86.4 | 165.8 | 7.3 | 110.5 | T81 | R79-T81 PolarHBondContact O-N 3.28Š| ||
| 80 | P | 44.3 | Very low | 39.4 | Very low | 128 Ų | 128 | 131.8 Ų | 131.8 | 83% | 0.831 | 78% | 0.784 | S | S | * | * | trans | -73.7 | 112.2 | 173.5 | 27.8 | -30.4 | 0 | 0 | 0 | 111.1 | ||||
| 81 | T | 43 | Very low | 39.7 | Very low | 137 Ų | 137 | 132 Ų | 132 | 84% | 0.84 | 79% | 0.785 | S | S | * | * | trans | -57.5 | 131 | 168.7 | -56.7 | 0 | 0 | 0 | 0 | 111.2 | R79 L83 | R79-T81 PolarHBondContact O-N 3.28Å; T81-L83 PolarHBondContact O-N 3.02Å | ||
| 82 | A | 35.8 | Very low | 39.8 | Very low | 91 Ų | 91 | 136.3 Ų | 136.3 | 75% | 0.752 | 79% | 0.788 | S | S | * | * | trans | -64.7 | 127.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | N84 | A82-N84 PolarHBondContact O-N 3.23Š| ||
| 83 | L | 40.1 | Very low | 39.9 | Very low | 145 Ų | 145 | 135.5 Ų | 135.5 | 76% | 0.759 | 78% | 0.781 | S | S | * | * | trans | -71.8 | 111.1 | 174.7 | -115.8 | 168 | 0 | 0 | 0 | 109.7 | T81 Y85 | T81-L83 PolarHBondContact O-N 3.02Å; L83-Y85 HydrophobicContact CD2-CE2 4.43Å | ||
| 84 | N | 38.9 | Very low | 39.8 | Very low | 145 Ų | 145 | 136 Ų | 136 | 78% | 0.775 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -77 | 118.7 | 169.2 | -164.6 | 31.2 | 0 | 0 | 0 | 108.3 | A82 | A82-N84 PolarHBondContact O-N 3.23Š|
| 85 | Y | 37.3 | Very low | 39.7 | Very low | 195 Ų | 195 | 139.9 Ų | 139.9 | 77% | 0.765 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -104 | 118.6 | 170 | -92.2 | -82.9 | 0 | 0 | 0 | 109.3 | L83 | L83-Y85 HydrophobicContact CD2-CE2 4.43Š|
| 86 | P | 46.1 | Very low | 39.8 | Very low | 109 Ų | 109 | 136.2 Ų | 136.2 | 71% | 0.708 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -80.2 | 139.4 | 172.9 | 31.3 | -30.1 | 0 | 0 | 0 | 110.9 | ||
| 87 | H | 42.3 | Very low | 39.5 | Very low | 168 Ų | 168 | 134.2 Ų | 134.2 | 78% | 0.778 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 131.4 | 171.8 | -178 | -77.3 | 0 | 0 | 0 | 110.7 | S89 | H87-S89 PolarHBondContact ND1-N 3.17Š|
| 88 | P | 51.2 | Low | 38.7 | Very low | 115 Ų | 115 | 131.6 Ų | 131.6 | 75% | 0.747 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -93.5 | 118.3 | 161.2 | 30.3 | -25.5 | 0 | 0 | 0 | 111.1 | ||
| 89 | S | 35.9 | Very low | 38.6 | Very low | 107 Ų | 107 | 134.7 Ų | 134.7 | 75% | 0.748 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 153.9 | 162.6 | 171.2 | 0 | 0 | 0 | 0 | 111.2 | H87 | H87-S89 PolarHBondContact ND1-N 3.17Š|
| 90 | A | 39.1 | Very low | 38.8 | Very low | 97 Ų | 97 | 128.9 Ų | 128.9 | 80% | 0.802 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 143.1 | -175.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||
| 91 | A | 36.2 | Very low | 38.4 | Very low | 91 Ų | 91 | 127.5 Ų | 127.5 | 75% | 0.752 | 78% | 0.777 | S | S | * | * | trans | -168.1 | 106.9 | 151.2 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 92 | E | 32.3 | Very low | 38 | Very low | 192 Ų | 192 | 125.6 Ų | 125.6 | 90% | 0.897 | 78% | 0.775 | S | S | * | * | 83.8 | 145.3 | 92.4 | -84.5 | -71.2 | 163 | 0 | 0 | 114.4 | |||||
| 93 | A | 36.1 | Very low | 37.7 | Very low | 89 Ų | 89 | 126.1 Ų | 126.1 | 74% | 0.736 | 78% | 0.779 | S | S | * | * | trans | 77.4 | 97.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 94 | A | 32.3 | Very low | 37.5 | Very low | 98 Ų | 98 | 124.5 Ų | 124.5 | 81% | 0.81 | 79% | 0.787 | S | S | * | * | 89.8 | 110.9 | 68.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 95 | F | 33.6 | Very low | 37.2 | Very low | 190 Ų | 190 | 122.8 Ų | 122.8 | 83% | 0.833 | 79% | 0.793 | S | S | * | * | trans | -166 | 100.4 | 133.4 | -151 | -101.1 | 0 | 0 | 0 | 113 | ||||
| 96 | V | 36.8 | Very low | 36.9 | Very low | 111 Ų | 111 | 116.9 Ų | 116.9 | 67% | 0.673 | 79% | 0.791 | S | S | * | * | 40.5 | 136.4 | 129.2 | 137.3 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 97 | S | 39.2 | Very low | 36.2 | Very low | 116 Ų | 116 | 117 Ų | 117 | 81% | 0.811 | 80% | 0.802 | S | S | * | * | trans | 106.3 | 118.5 | 157 | -37.5 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 98 | G | 28.3 | Very low | 35.7 | Very low | 70 Ų | 70 | 112.3 Ų | 112.3 | 72% | 0.722 | 80% | 0.798 | S | S | * | * | cis | 169.4 | 143.7 | 0.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 99 | F | 38.8 | Very low | 35 | Very low | 210 Ų | 210 | 118.3 Ų | 118.3 | 92% | 0.921 | 81% | 0.806 | S | S | * | * | trans | 79.5 | 151.9 | 149.7 | -89.6 | -90.3 | 0 | 0 | 0 | 121.5 | ||||
| 100 | P | 48.1 | Very low | 35.2 | Very low | 103 Ų | 103 | 118.1 Ų | 118.1 | 67% | 0.669 | 81% | 0.805 | S | S | * | * | -135.9 | 169.7 | -91 | 46.9 | -32 | 0 | 0 | 0 | 117.3 | |||||
| 101 | A | 35 | Very low | 35.1 | Very low | 99 Ų | 99 | 120.9 Ų | 120.9 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | 37.2 | 131.5 | 135.8 | 0 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 102 | A | 33.9 | Very low | 35.2 | Very low | 96 Ų | 96 | 127.9 Ų | 127.9 | 79% | 0.793 | 81% | 0.813 | S | S | * | * | -175.4 | 106.5 | 120 | 0 | 0 | 0 | 0 | 0 | 107.9 | |||||
| 103 | A | 30.1 | Very low | 35.3 | Very low | 103 Ų | 103 | 121.6 Ų | 121.6 | 85% | 0.851 | 80% | 0.801 | S | S | * | * | 58.2 | 103.7 | 76.1 | 0 | 0 | 0 | 0 | 0 | 115 | |||||
| 104 | A | 36.4 | Very low | 35.2 | Very low | 110 Ų | 110 | 120.9 Ų | 120.9 | 91% | 0.909 | 80% | 0.802 | S | S | * | * | trans | -170.4 | 131.9 | 134.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 105 | A | 31.8 | Very low | 36 | Very low | 110 Ų | 110 | 122.2 Ų | 122.2 | 91% | 0.909 | 80% | 0.802 | S | S | * | * | trans | -89.5 | 169 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 106 | G | 31.3 | Very low | 36 | Very low | 70 Ų | 70 | 120.2 Ų | 120.2 | 72% | 0.722 | 80% | 0.795 | S | S | * | * | trans | 148.1 | 98.5 | 164.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 107 | A | 31.4 | Very low | 36.2 | Very low | 113 Ų | 113 | 122.7 Ų | 122.7 | 93% | 0.934 | 80% | 0.804 | S | S | * | * | 57.8 | 119.5 | 73.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 108 | G | 31.7 | Very low | 36 | Very low | 68 Ų | 68 | 122.3 Ų | 122.3 | 70% | 0.701 | 80% | 0.797 | S | S | * | * | trans | 136.2 | 90.5 | 168.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 109 | R | 37.6 | Very low | 36.5 | Very low | 242 Ų | 242 | 128.5 Ų | 128.5 | 91% | 0.913 | 80% | 0.804 | S | S | * | * | 100.4 | 120.8 | 85 | -88 | 178.1 | 118.3 | -104.8 | 0.1 | 112.3 | |||||
| 110 | S | 38.9 | Very low | 36.9 | Very low | 103 Ų | 103 | 124.1 Ų | 124.1 | 72% | 0.72 | 80% | 0.796 | S | S | * | * | trans | -72.4 | 173.2 | 169.5 | -170.1 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 111 | L | 37.8 | Very low | 36 | Very low | 154 Ų | 154 | 126.6 Ų | 126.6 | 81% | 0.806 | 80% | 0.799 | S | S | * | * | trans | 100.3 | 104.9 | 159.4 | -64.2 | 144.2 | 0 | 0 | 0 | 117.7 | ||||
| 112 | Y | 38.2 | Very low | 36.2 | Very low | 238 Ų | 238 | 126.7 Ų | 126.7 | 93% | 0.933 | 80% | 0.8 | S | S | * | * | 177.8 | 143.8 | 110.8 | -144.9 | -101.5 | 0 | 0 | 0 | 107.1 | |||||
| 113 | G | 33.7 | Very low | 36.6 | Very low | 61 Ų | 61 | 128.7 Ų | 128.7 | 63% | 0.629 | 79% | 0.794 | S | S | * | * | cis | 164.8 | 135.3 | 6.7 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 114 | G | 34.3 | Very low | 36.7 | Very low | 74 Ų | 74 | 129.7 Ų | 129.7 | 76% | 0.763 | 79% | 0.786 | S | S | * | * | trans | -74 | 170.5 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 115 | P | 50.1 | Low | 36.8 | Very low | 125 Ų | 125 | 131.7 Ų | 131.7 | 81% | 0.812 | 78% | 0.776 | S | S | * | * | -139.5 | 133.9 | 96.7 | 27.8 | -8.9 | 0 | 0 | 0 | 112.6 | |||||
| 116 | E | 31.8 | Very low | 37.6 | Very low | 148 Ų | 148 | 132.2 Ų | 132.2 | 69% | 0.692 | 77% | 0.77 | S | S | * | * | 66.2 | 102.3 | 86.6 | -144.8 | -82.1 | 109.4 | 0 | 0 | 113.8 | V118 | E116-V118 PolarHBondContact OE1-N 3.48Š| |||
| 117 | L | 41.6 | Very low | 38.2 | Very low | 164 Ų | 164 | 132.8 Ų | 132.8 | 86% | 0.859 | 77% | 0.768 | S | S | * | * | trans | -151.7 | 97.7 | 150.1 | -75.7 | -173.2 | 0 | 0 | 0 | 110.1 | ||||
| 118 | V | 35.6 | Very low | 38.5 | Very low | 108 Ų | 108 | 136 Ų | 136 | 66% | 0.655 | 77% | 0.769 | S | S | * | * | 51.1 | 116.7 | 129 | -176.2 | 0 | 0 | 0 | 0 | 120 | E116 | E116-V118 PolarHBondContact OE1-N 3.48Š| |||
| 119 | F | 37.6 | Very low | 39.3 | Very low | 200 Ų | 200 | 138.2 Ų | 138.2 | 88% | 0.877 | 77% | 0.769 | S | S | * | * | trans | -88.4 | 157.1 | 157.5 | -80.9 | -89.8 | 0 | 0 | 0 | 111.6 | ||||
| 120 | P | 48 | Very low | 39.4 | Very low | 117 Ų | 117 | 133.5 Ų | 133.5 | 76% | 0.76 | 77% | 0.766 | S | S | * | * | -139.8 | 127.1 | 115.6 | 29.2 | -11.8 | 0 | 0 | 0 | 112.3 | |||||
| 121 | E | 30.4 | Very low | 39.8 | Very low | 156 Ų | 156 | 136.3 Ų | 136.3 | 73% | 0.729 | 77% | 0.767 | S | S | * | * | 80.5 | 117 | 95.8 | -170.2 | 151.6 | 115.5 | 0 | 0 | 115.3 | M123 | E121-M123 HydrophobicContact CG-SD 3.96Š| |||
| 122 | A | 38.7 | Very low | 40.8 | Very low | 100 Ų | 100 | 134.8 Ų | 134.8 | 83% | 0.826 | 77% | 0.767 | S | S | * | * | -169.4 | 119.4 | 129.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 123 | M | 41.4 | Very low | 40.8 | Very low | 139 Ų | 139 | 128.3 Ų | 128.3 | 69% | 0.685 | 76% | 0.763 | S | S | * | * | trans | -58.7 | 145.4 | 173 | -77.2 | 50.7 | 172.2 | 0 | 0 | 114.2 | E121 | E121-M123 HydrophobicContact CG-SD 3.96Š| ||
| 124 | N | 33.2 | Very low | 41.5 | Very low | 124 Ų | 124 | 133.9 Ų | 133.9 | 66% | 0.663 | 77% | 0.772 | S | S | * | * | 166.5 | 107.2 | 114.1 | -95.7 | -11.6 | 0 | 0 | 0 | 113.9 | |||||
| 125 | H | 37.9 | Very low | 41.9 | Very low | 151 Ų | 151 | 138.5 Ų | 138.5 | 70% | 0.699 | 77% | 0.774 | S | S | * | * | trans | 21.8 | 168.7 | 137.3 | 54.4 | -118.8 | 0 | 0 | 0 | 123.9 | ||||
| 126 | P | 48.3 | Very low | 41.3 | Very low | 121 Ų | 121 | 139.9 Ų | 139.9 | 79% | 0.786 | 77% | 0.773 | S | S | * | * | cis | -131 | 169.8 | -21.9 | 24 | -1 | 0 | 0 | 0 | 114.7 | ||||
| 127 | A | 45 | Very low | 41.6 | Very low | 83 Ų | 83 | 136.7 Ų | 136.7 | 69% | 0.686 | 78% | 0.781 | S | S | * | * | trans | -76.9 | 158.2 | 169.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 128 | L | 37 | Very low | 41.4 | Very low | 181 Ų | 181 | 134 Ų | 134 | 95% | 0.948 | 78% | 0.782 | S | S | * | * | trans | -137.2 | 114.3 | 147.8 | -74.5 | -178.1 | 0 | 0 | 0 | 111.6 | ||||
| 129 | T | 48 | Very low | 42 | Very low | 114 Ų | 114 | 134.6 Ų | 134.6 | 70% | 0.699 | 79% | 0.791 | S | S | * | * | trans | -68.3 | 144.9 | 160.4 | -43.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 130 | V | 39.2 | Very low | 42.9 | Very low | 142 Ų | 142 | 130.5 Ų | 130.5 | 86% | 0.861 | 78% | 0.784 | S | S | * | * | trans | -158.9 | 142.2 | 143.3 | 150.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 131 | H | 47.7 | Very low | 42.6 | Very low | 162 Ų | 162 | 133 Ų | 133 | 75% | 0.75 | 79% | 0.79 | S | S | * | * | trans | -71.1 | 169.5 | -167.4 | -67.4 | -102.9 | 0 | 0 | 0 | 117.2 | ||||
| 132 | P | 60.1 | Low | 43.6 | Very low | 123 Ų | 123 | 134.1 Ų | 134.1 | 80% | 0.799 | 80% | 0.795 | S | S | * | * | trans | -95 | 135.8 | 167.7 | 35.7 | -26.9 | 0 | 0 | 0 | 111.9 | ||||
| 133 | A | 37.9 | Very low | 44 | Very low | 102 Ų | 102 | 134.9 Ų | 134.9 | 84% | 0.843 | 79% | 0.792 | S | S | * | * | trans | -157.2 | 146.1 | 165.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 134 | H | 47.6 | Very low | 44.5 | Very low | 178 Ų | 178 | 133.3 Ų | 133.3 | 82% | 0.824 | 79% | 0.792 | S | S | * | * | trans | -49.5 | 152.1 | 179.2 | -76.2 | -113 | 0 | 0 | 0 | 116.2 | ||||
| 135 | Q | 42.6 | Very low | 45.4 | Very low | 171 Ų | 171 | 135.1 Ų | 135.1 | 80% | 0.799 | 80% | 0.797 | S | S | * | * | 167.4 | 134.3 | 111.8 | -89.1 | 174.4 | 100 | 0 | 0 | 115 | |||||
| 136 | L | 37.8 | Very low | 46.1 | Very low | 153 Ų | 153 | 134 Ų | 134 | 80% | 0.801 | 81% | 0.806 | S | S | * | * | trans | 56.7 | 115.6 | 134.5 | -53.8 | 173.2 | 0 | 0 | 0 | 122.8 | ||||
| 137 | G | 37.7 | Very low | 46.1 | Very low | 82 Ų | 82 | 137 Ų | 137 | 85% | 0.845 | 81% | 0.807 | S | S | * | * | 76.7 | 100.9 | 120.5 | 0 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 138 | A | 38.8 | Very low | 46.1 | Very low | 107 Ų | 107 | 142.7 Ų | 142.7 | 88% | 0.884 | 82% | 0.816 | S | S | * | * | trans | -177.3 | 130.5 | 135.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 139 | S | 47.1 | Very low | 46.3 | Very low | 120 Ų | 120 | 137.4 Ų | 137.4 | 84% | 0.839 | 81% | 0.805 | S | S | * | * | trans | -79.2 | 174.2 | 173.1 | -74 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 140 | P | 57.7 | Low | 46.4 | Very low | 115 Ų | 115 | 137 Ų | 137 | 75% | 0.747 | 81% | 0.814 | S | S | * | * | cis | -146.6 | 179.3 | 24.6 | 39.9 | -17.3 | 0 | 0 | 0 | 118.2 | ||||
| 141 | L | 40 | Very low | 46.7 | Very low | 169 Ų | 169 | 138.4 Ų | 138.4 | 89% | 0.885 | 81% | 0.811 | S | S | * | * | trans | 113.8 | 103.4 | 161.5 | -66.3 | 158.2 | 0 | 0 | 0 | 115.7 | ||||
| 142 | Q | 52.1 | Low | 46.7 | Very low | 179 Ų | 179 | 138.3 Ų | 138.3 | 84% | 0.836 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 148 | 167.8 | -68.9 | -155.3 | -37 | 0 | 0 | 112.1 | ||
| 143 | P | 47.4 | Very low | 46.1 | Very low | 117 Ų | 117 | 142.6 Ų | 142.6 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -99.8 | 142.4 | 143.5 | 26.1 | -13.5 | 0 | 0 | 0 | 111 | ||
| 144 | P | 52 | Low | 46.5 | Very low | 106 Ų | 106 | 142 Ų | 142 | 69% | 0.688 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 138.3 | -170.2 | 31.8 | -32.9 | 0 | 0 | 0 | 112.8 | ||
| 145 | H | 50.7 | Low | 47 | Very low | 162 Ų | 162 | 138.8 Ų | 138.8 | 75% | 0.75 | 79% | 0.788 | S | S | * | * | trans | 44.3 | 96.3 | 151.6 | -52 | -63.1 | 0 | 0 | 0 | 118.8 | F147 | H145-F147 VanDerWaalsContact C-N 3.32Å; H145-F147 PolarHBondContact O-N 2.89Å | ||
| 146 | S | 52.8 | Low | 47.6 | Very low | 127 Ų | 127 | 136 Ų | 136 | 89% | 0.888 | 78% | 0.778 | S | S | * | * | trans | -57.8 | 90.5 | 151.3 | -60 | 0 | 0 | 0 | 0 | 110.5 | F148 | S146-F148 VanDerWaalsContact C-N 3.33Å; S146-F148 PolarHBondContact O-N 2.85Å | ||
| 147 | F | 48.8 | Very low | 48.7 | Very low | 184 Ų | 184 | 136.7 Ų | 136.7 | 81% | 0.807 | 78% | 0.777 | S | S | * | * | trans | -94.4 | 33.4 | 178.1 | -158.1 | -97.7 | 0 | 0 | 0 | 113.2 | H145 | H145-F147 VanDerWaalsContact C-N 3.32Å; H145-F147 PolarHBondContact O-N 2.89Å | ||
| 148 | F | 45.6 | Very low | 49.8 | Very low | 203 Ų | 203 | 139.5 Ų | 139.5 | 89% | 0.89 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -132.2 | 101 | 161.7 | -88.1 | -82.6 | 0 | 0 | 0 | 108.7 | S146 | S146-F148 VanDerWaalsContact C-N 3.33Å; S146-F148 PolarHBondContact O-N 2.85Å |
| 149 | G | 40.9 | Very low | 50.7 | Low | 69 Ų | 69 | 139.5 Ų | 139.5 | 71% | 0.711 | 74% | 0.744 | S | S | * | * | trans | -55 | 145.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q151 | G149-Q151 VanDerWaalsContact C-N 3.26Å; G149-Q151 PolarHBondContact O-N 3.49Å | ||
| 150 | A | 49.1 | Very low | 51.4 | Low | 106 Ų | 106 | 138.5 Ų | 138.5 | 88% | 0.876 | 73% | 0.734 | S | S | * | * | trans | -59.9 | 87.5 | 169.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 151 | Q | 46.2 | Very low | 51.6 | Low | 171 Ų | 171 | 141.1 Ų | 141.1 | 80% | 0.799 | 73% | 0.73 | S | S | * | * | trans | -84.3 | 108.6 | 154.5 | -72.1 | -69.5 | 20.9 | 0 | 0 | 106.9 | G149 R153 | G149-Q151 VanDerWaalsContact C-N 3.26Å; G149-Q151 PolarHBondContact O-N 3.49Å; Q151-R153 PolarHBondContact O-N 3.11Å | ||
| 152 | H | 48.3 | Very low | 53 | Low | 161 Ų | 161 | 135.8 Ų | 135.8 | 75% | 0.745 | 70% | 0.704 | S | S | * | * | trans | -49.3 | 84.9 | 171.1 | -176.6 | -91.9 | 0 | 0 | 0 | 110.2 | D154 | H152-D154 IonicContact CE1-OD2 3.93Å; H152-D154 PolarHBondContact O-N 2.9Å | ||
| 153 | R | 46.6 | Very low | 53.4 | Low | 212 Ų | 212 | 130.5 Ų | 130.5 | 80% | 0.8 | 68% | 0.681 | S | S | * | * | trans | -86.5 | 99.9 | 169.6 | -79.3 | -139.4 | 172.7 | 176.7 | -0 | 107.1 | Q151 P155 | Q151-R153 PolarHBondContact O-N 3.11Å; R153-P155 WeakPolarHBondContact O-CD 3.47Å | ||
| 154 | D | 46.5 | Very low | 53.8 | Low | 91 Ų | 91 | 132 Ų | 132 | 49% | 0.487 | 67% | 0.672 | S | S | . | * | trans | -41.1 | 110.6 | 167.3 | -110.2 | -52.4 | 0 | 0 | 0 | 109.9 | H152 L156 H157 | H152-D154 IonicContact CE1-OD2 3.93Å; H152-D154 PolarHBondContact O-N 2.9Å; D154-L156 PolarHBondContact O-N 3.32Å; D154-H157 PolarHBondContact O-N 3.4Å | ||
| 155 | P | 58 | Low | 53.7 | Low | 109 Ų | 109 | 133.8 Ų | 133.8 | 71% | 0.708 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.4 | -9.1 | -175.2 | -26.1 | 36 | 0 | 0 | 0 | 113.9 | R153 | R153-P155 WeakPolarHBondContact O-CD 3.47Š|
| 156 | L | 56 | Low | 54 | Low | 113 Ų | 113 | 135.6 Ų | 135.6 | 59% | 0.592 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.6 | -15.2 | -173.9 | -59.1 | -178.1 | 0 | 0 | 0 | 114.2 | D154 L163 | D154-L156 PolarHBondContact O-N 3.32Å; L156-L163 WeakPolarHBondContact O-CD1 3.49Å |
| 157 | H | 59.4 | Low | 54.1 | Low | 167 Ų | 167 | 137 Ų | 137 | 77% | 0.773 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -91 | -11.4 | -177.4 | -84.5 | -148.4 | 0 | 0 | 0 | 114.4 | D154 Y159 | D154-H157 PolarHBondContact O-N 3.4Å; H157-Y159 VanDerWaalsContact C-N 3.33Å; H157-Y159 PolarHBondContact O-N 3.33Å |
| 158 | F | 62.3 | Low | 54.3 | Low | 142 Ų | 142 | 134.9 Ų | 134.9 | 62% | 0.623 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -81.6 | -11.2 | -175.4 | -166.1 | -124.8 | 0 | 0 | 0 | 113.8 | ||
| 159 | Y | 57.8 | Low | 54.3 | Low | 106 Ų | 106 | 127.9 Ų | 127.9 | 42% | 0.416 | 64% | 0.642 | S | S | . | * | trans | -142.1 | 67.8 | -176.2 | -62.8 | -66.3 | 0 | 0 | 0 | 114.6 | H157 W161 V162 L163 | H157-Y159 VanDerWaalsContact C-N 3.33Å; H157-Y159 PolarHBondContact O-N 3.33Å; Y159-W161 AromaticContact CD1-CE2 3.73Å; Y159-W161 AromaticContact CD1-CZ2 3.76Å; Y159-W161 HydrophobicContact CD1-CZ2 3.76Å; Y159-W161 AromaticContact CD1-NE1 3.43Å; Y159-W161 HydrophobicContact CE1-CZ2 4.06Å; Y159-W161 PolarHBondContact O-N 3.28Å; Y159-W161 VanDerWaalsContact O-N 3.09Å; Y159-V162 VanDerWaalsContact CB-CG2 3.49Å; Y159-V162 HydrophobicContact CD1-CG2 4.1Å; Y159-V162 HydrophobicContact CG-CG2 3.85Å; Y159-V162 PolarHBondContact O-N 2.96Å; Y159-L163 PolarHBondContact O-N 3.35Å | ||
| 160 | P | 61.7 | Low | 54.8 | Low | 99 Ų | 99 | 133.2 Ų | 133.2 | 64% | 0.643 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -56.7 | -26.4 | 173.4 | 19.8 | -30.3 | 0 | 0 | 0 | 113.3 | R164 | P160-R164 WeakPolarHBondContact O-CB 3.46Å; P160-R164 PolarHBondContact O-N 3.29Å |
| 161 | W | 61.3 | Low | 54.6 | Low | 170 Ų | 170 | 138.6 Ų | 138.6 | 64% | 0.644 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -77.5 | -32.5 | 176.4 | 64.8 | -95.4 | 0 | 0 | 0 | 113.9 | Y159 R164 N165 | Y159-W161 AromaticContact CD1-CE2 3.73Å; Y159-W161 AromaticContact CD1-CZ2 3.76Å; Y159-W161 HydrophobicContact CD1-CZ2 3.76Å; Y159-W161 AromaticContact CD1-NE1 3.43Å; Y159-W161 HydrophobicContact CE1-CZ2 4.06Å; Y159-W161 PolarHBondContact O-N 3.28Å; Y159-W161 VanDerWaalsContact O-N 3.09Å; W161-R164 PolarHBondContact O-N 2.85Å; W161-N165 PolarHBondContact O-N 3.45Å |
| 162 | V | 69 | Low | 54.3 | Low | 58 Ų | 58 | 140.6 Ų | 140.6 | 35% | 0.352 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -69.8 | -39.9 | 178.8 | 178.9 | 0 | 0 | 0 | 0 | 110 | Y159 R166 | Y159-V162 VanDerWaalsContact CB-CG2 3.49Å; Y159-V162 HydrophobicContact CD1-CG2 4.1Å; Y159-V162 HydrophobicContact CG-CG2 3.85Å; Y159-V162 PolarHBondContact O-N 2.96Å; V162-R166 WeakPolarHBondContact O-CB 3.18Å; V162-R166 PolarHBondContact O-N 3.45Å |
| 163 | L | 61.5 | Low | 53.9 | Low | 68 Ų | 68 | 140.8 Ų | 140.8 | 36% | 0.356 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -70.3 | -37.4 | 177.2 | -70.8 | 162 | 0 | 0 | 0 | 112 | L156 Y159 N165 R166 F167 | L156-L163 WeakPolarHBondContact O-CD1 3.49Å; Y159-L163 PolarHBondContact O-N 3.35Å; L163-N165 VanDerWaalsContact C-N 3.34Å; L163-N165 PolarHBondContact O-N 3.05Å; L163-R166 PolarHBondContact O-N 3.48Å; L163-F167 HydrophobicContact CD2-CD2 4.28Å; L163-F167 HydrophobicContact CD2-CE2 4.33Å; L163-F167 PolarHBondContact O-N 2.94Å |
| 164 | R | 54.8 | Low | 53.8 | Low | 148 Ų | 148 | 135.5 Ų | 135.5 | 56% | 0.558 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -61 | -40.8 | 176.4 | -177.7 | 67.9 | 100.9 | -159.4 | 1.3 | 112.4 | P160 W161 F168 | P160-R164 WeakPolarHBondContact O-CB 3.46Å; P160-R164 PolarHBondContact O-N 3.29Å; W161-R164 PolarHBondContact O-N 2.85Å; R164-F168 WeakPolarHBondContact O-CB 3.41Å; R164-F168 PolarHBondContact O-N 3.26Å |
| 165 | N | 51.1 | Low | 53.6 | Low | 143 Ų | 143 | 134 Ų | 134 | 77% | 0.765 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -74.6 | -25.4 | 178.2 | -96.1 | 31.5 | 0 | 0 | 0 | 113.4 | W161 L163 | W161-N165 PolarHBondContact O-N 3.45Å; L163-N165 VanDerWaalsContact C-N 3.34Å; L163-N165 PolarHBondContact O-N 3.05Å |
| 166 | R | 55.5 | Low | 53.1 | Low | 200 Ų | 200 | 136.6 Ų | 136.6 | 76% | 0.755 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -88.9 | -33 | -178.1 | -166.9 | 165.1 | 179.4 | 171.4 | -2.4 | 113.6 | V162 L163 | V162-R166 WeakPolarHBondContact O-CB 3.18Å; V162-R166 PolarHBondContact O-N 3.45Å; L163-R166 PolarHBondContact O-N 3.48Å |
| 167 | F | 55.3 | Low | 52.8 | Low | 156 Ų | 156 | 136.9 Ų | 136.9 | 68% | 0.684 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -106.4 | -20.6 | -175 | -83.5 | -86.8 | 0 | 0 | 0 | 115.6 | L163 | L163-F167 HydrophobicContact CD2-CD2 4.28Å; L163-F167 HydrophobicContact CD2-CE2 4.33Å; L163-F167 PolarHBondContact O-N 2.94Å |
| 168 | F | 52.9 | Low | 52.1 | Low | 140 Ų | 140 | 134.3 Ų | 134.3 | 61% | 0.614 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -99.2 | 3.2 | 179 | -79.6 | -89.8 | 0 | 0 | 0 | 114.7 | R164 H170 | R164-F168 WeakPolarHBondContact O-CB 3.41Å; R164-F168 PolarHBondContact O-N 3.26Å; F168-H170 PolarHBondContact O-N 3.4Å |
| 169 | G | 45.9 | Very low | 51.4 | Low | 57 Ų | 57 | 134.6 Ų | 134.6 | 59% | 0.588 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | -8.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 170 | H | 51.8 | Low | 50.7 | Low | 180 Ų | 180 | 137.1 Ų | 137.1 | 83% | 0.833 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.4 | 26.8 | -167.8 | -84.3 | -78.1 | 0 | 0 | 0 | 115.7 | F168 | F168-H170 PolarHBondContact O-N 3.4Š|
| 171 | R | 44.7 | Very low | 50.3 | Low | 220 Ų | 220 | 135.6 Ų | 135.6 | 83% | 0.83 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -100.1 | 7.2 | 175.2 | -152.7 | 175.2 | 174.5 | 96.7 | 2 | 116.2 | ||
| 172 | F | 39.8 | Very low | 50.1 | Low | 212 Ų | 212 | 133.3 Ų | 133.3 | 93% | 0.93 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -154.5 | 76.4 | 168.2 | -111.5 | -82.9 | 0 | 0 | 0 | 111 | ||
| 173 | Q | 40.6 | Very low | 49.3 | Very low | 165 Ų | 165 | 138.6 Ų | 138.6 | 77% | 0.771 | 72% | 0.716 | S | S | * | * | trans | -155.8 | 86.8 | 143.8 | -146.4 | -171.4 | 102.6 | 0 | 0 | 108.3 | ||||
| 174 | A | 44.3 | Very low | 48.9 | Very low | 101 Ų | 101 | 143.5 Ų | 143.5 | 84% | 0.835 | 74% | 0.741 | S | S | * | * | trans | -87.4 | 111.6 | 154.4 | 0 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 175 | S | 42.3 | Very low | 48.8 | Very low | 61 Ų | 61 | 143.8 Ų | 143.8 | 43% | 0.427 | 75% | 0.749 | S | S | . | * | trans | -179.5 | 82.7 | 159.7 | 53.9 | 0 | 0 | 0 | 0 | 107.5 | V177 | S175-V177 PolarHBondContact O-N 3.43Š| ||
| 176 | D | 47.2 | Very low | 48.5 | Very low | 162 Ų | 162 | 139.2 Ų | 139.2 | 87% | 0.866 | 74% | 0.735 | S | S | * | * | trans | 22.6 | 90.9 | 134.1 | -5.1 | -60.3 | 0 | 0 | 0 | 115.4 | ||||
| 177 | V | 49.8 | Very low | 48.6 | Very low | 119 Ų | 119 | 135.9 Ų | 135.9 | 72% | 0.721 | 74% | 0.739 | S | S | * | * | trans | -125.8 | 119.4 | 160.2 | -179.7 | 0 | 0 | 0 | 0 | 107.1 | S175 Q179 | S175-V177 PolarHBondContact O-N 3.43Å; V177-Q179 PolarHBondContact O-N 3.06Å | ||
| 178 | P | 43.6 | Very low | 48.5 | Very low | 114 Ų | 114 | 137.2 Ų | 137.2 | 74% | 0.74 | 75% | 0.745 | S | S | * | * | trans | -57.8 | 129.9 | 179 | -25.2 | 34.5 | 0 | 0 | 0 | 111.7 | D180 | P178-D180 VanDerWaalsContact C-N 3.28Å; P178-D180 PolarHBondContact O-N 3.02Å | ||
| 179 | Q | 48.6 | Very low | 48.9 | Very low | 147 Ų | 147 | 132.3 Ų | 132.3 | 69% | 0.687 | 73% | 0.731 | S | S | * | * | trans | -92.6 | 50 | -169.5 | -164.4 | 161.7 | -13.3 | 0 | 0 | 110.9 | V177 G181 L182 | V177-Q179 PolarHBondContact O-N 3.06Å; Q179-G181 PolarHBondContact O-N 3.11Å; Q179-L182 HydrophobicContact CG-CD1 3.64Å; Q179-L182 HydrophobicContact CG-CG 3.99Å | ||
| 180 | D | 43.7 | Very low | 49.9 | Very low | 159 Ų | 159 | 140.9 Ų | 140.9 | 85% | 0.85 | 75% | 0.745 | S | S | * | * | trans | -101.7 | 79.3 | 178.8 | -65 | -28.7 | 0 | 0 | 0 | 109.9 | P178 | P178-D180 VanDerWaalsContact C-N 3.28Å; P178-D180 PolarHBondContact O-N 3.02Å | ||
| 181 | G | 52.3 | Low | 50.8 | Low | 67 Ų | 67 | 141.2 Ų | 141.2 | 69% | 0.691 | 74% | 0.744 | S | S | * | * | trans | -178.3 | 12.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | Q179 L183 | Q179-G181 PolarHBondContact O-N 3.11Å; G181-L183 PolarHBondContact O-N 3.37Å | ||
| 182 | L | 56.8 | Low | 52.1 | Low | 122 Ų | 122 | 136.9 Ų | 136.9 | 64% | 0.639 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.1 | 21 | -166.1 | -78.8 | -165.8 | 0 | 0 | 0 | 116.8 | Q179 | Q179-L182 HydrophobicContact CG-CD1 3.64Å; Q179-L182 HydrophobicContact CG-CG 3.99Å |
| 183 | L | 53.7 | Low | 53.8 | Low | 170 Ų | 170 | 136.2 Ų | 136.2 | 89% | 0.89 | 74% | 0.742 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.8 | 14.8 | 179.7 | -57 | -156.4 | 0 | 0 | 0 | 115.5 | G181 | G181-L183 PolarHBondContact O-N 3.37Š|
| 184 | L | 52.8 | Low | 55.5 | Low | 170 Ų | 170 | 139.4 Ų | 139.4 | 89% | 0.89 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -146.7 | 50.5 | 174.8 | -149.7 | 74.2 | 0 | 0 | 0 | 115.2 | ||
| 185 | H | 51.2 | Low | 57.1 | Low | 155 Ų | 155 | 142.3 Ų | 142.3 | 72% | 0.718 | 75% | 0.746 | S | S | * | * | trans | -129.5 | 100 | 166.1 | -131.9 | -56.3 | 0 | 0 | 0 | 110.5 | A189 | H185-A189 HydrophobicContact CB-CB 4.12Å; H185-A189 VanDerWaalsContact CE1-CB 3.46Å; H185-A189 WeakPolarHBondContact CE1-CB 3.46Å; H185-A189 WeakPolarHBondContact ND1-CA 3.33Å; H185-A189 WeakPolarHBondContact ND1-CB 3.31Å | ||
| 186 | G | 45.8 | Very low | 59.1 | Low | 47 Ų | 47 | 150.9 Ų | 150.9 | 49% | 0.485 | 77% | 0.769 | S | S | . | * | trans | -59 | 172 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | F188 A189 | G186-F188 PolarHBondContact O-N 2.87Å; G186-A189 PolarHBondContact O-N 3.16Å; G186-A189 VanDerWaalsContact O-N 3.08Å | ||
| 187 | P | 56.7 | Low | 60.9 | Low | 129 Ų | 129 | 148 Ų | 148 | 84% | 0.838 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.1 | 2.9 | -170.7 | 23.1 | -32.4 | 0 | 0 | 0 | 115.9 | ||
| 188 | F | 54.8 | Low | 63 | Low | 184 Ų | 184 | 146.9 Ų | 146.9 | 81% | 0.807 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.1 | 13.1 | 176.5 | -58.2 | -73.1 | 0 | 0 | 0 | 114.2 | G186 R190 | G186-F188 PolarHBondContact O-N 2.87Å; F188-R190 PolarHBondContact O-N 3.01Å |
| 189 | A | 60.4 | Low | 65.5 | Low | 38 Ų | 38 | 144 Ų | 144 | 31% | 0.314 | 74% | 0.737 | S | S | . | * | trans | -61.6 | 78.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112 | H185 G186 K191 | H185-A189 HydrophobicContact CB-CB 4.12Å; H185-A189 VanDerWaalsContact CE1-CB 3.46Å; H185-A189 WeakPolarHBondContact CE1-CB 3.46Å; H185-A189 WeakPolarHBondContact ND1-CA 3.33Å; H185-A189 WeakPolarHBondContact ND1-CB 3.31Å; G186-A189 PolarHBondContact O-N 3.16Å; G186-A189 VanDerWaalsContact O-N 3.08Å; A189-K191 PolarHBondContact O-N 3.16Å | ||
| 190 | R | 66.7 | Low | 67.8 | Low | 237 Ų | 237 | 139.4 Ų | 139.4 | 89% | 0.894 | 72% | 0.721 | S | S | * | * | trans | -63.6 | 110.3 | 174.7 | -67.2 | -163 | -76.1 | -136.8 | 0.2 | 107.6 | F188 | F188-R190 PolarHBondContact O-N 3.01Š| ||
| 191 | K | 71.4 | Confident | 70.4 | Confident | 186 Ų | 186 | 136.7 Ų | 136.7 | 81% | 0.809 | 71% | 0.713 | S | S | * | * | trans | -43 | 133.4 | 176.6 | -77 | 82.7 | 171.2 | 177.1 | 0 | 109.7 | A189 K193 | A189-K191 PolarHBondContact O-N 3.16Å; K191-K193 PolarHBondContact O-N 2.83Å; K191-K193 VanDerWaalsContact O-N 3.13Å | ||
| 192 | P | 71.3 | Confident | 72.5 | Confident | 129 Ų | 129 | 136.8 Ų | 136.8 | 84% | 0.838 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 121.5 | 179.6 | -28.9 | 35.1 | 0 | 0 | 0 | 111.5 | R194 | P192-R194 PolarHBondContact O-N 3.33Š|
| 193 | K | 76.8 | Confident | 74.5 | Confident | 199 Ų | 199 | 132.5 Ų | 132.5 | 87% | 0.865 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 122.4 | -179.6 | -163.3 | 157.9 | -176.8 | 175.5 | 0 | 107.8 | K191 I195 | K191-K193 PolarHBondContact O-N 2.83Å; K191-K193 VanDerWaalsContact O-N 3.13Å; K193-I195 PolarHBondContact O-N 3.25Å |
| 194 | R | 74.9 | Confident | 76.6 | Confident | 232 Ų | 232 | 127 Ų | 127 | 88% | 0.875 | 65% | 0.65 | S | S | * | * | P | Polyproline II helix | trans | -49.2 | 120.1 | 177.6 | -73.5 | -171.3 | -179.6 | -176.4 | 0.3 | 109.7 | P192 R196 | P192-R194 PolarHBondContact O-N 3.33Å; R194-R196 PolarHBondContact O-N 2.92Å |
| 195 | I | 78.8 | Confident | 78.7 | Confident | 162 Ų | 162 | 122.8 Ų | 122.8 | 83% | 0.831 | 63% | 0.628 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 128.7 | 177.1 | -63.1 | 169.4 | 0 | 0 | 0 | 107.7 | K193 | K193-I195 PolarHBondContact O-N 3.25Š|
| 196 | R | 84.9 | Confident | 81 | Confident | 240 Ų | 240 | 120.1 Ų | 120.1 | 91% | 0.906 | 61% | 0.612 | S | S | * | * | P | Polyproline II helix | trans | -79.8 | 123 | 174 | -69.2 | -175.7 | 175 | -177.9 | -1.2 | 108.3 | R194 | R194-R196 PolarHBondContact O-N 2.92Š|
| 197 | T | 84.8 | Confident | 83.5 | Confident | 101 Ų | 101 | 117.9 Ų | 117.9 | 62% | 0.62 | 59% | 0.589 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 125.7 | 171.5 | 55.6 | 0 | 0 | 0 | 0 | 109.5 | ||
| 198 | A | 92.7 | Very high | 85.4 | Confident | 97 Ų | 97 | 114.8 Ų | 114.8 | 80% | 0.802 | 56% | 0.563 | S | S | * | * | P | Polyproline II helix | trans | -93.1 | 143.3 | 171 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||
| 199 | F | 96.7 | Very high | 87.5 | Confident | 52 Ų | 52 | 112.6 Ų | 112.6 | 23% | 0.228 | 55% | 0.55 | C | S | . | . | P | Polyproline II helix | trans | -88.8 | 145 | 172.1 | -59.1 | -51.5 | 0 | 0 | 0 | 110 | Q203 L204 L231 Q235 W239 | F199-Q203 HydrophobicContact CB-CB 4.4Å; F199-L204 HydrophobicContact CB-CD2 3.89Å; F199-L204 HydrophobicContact CB-CG 4.11Å; F199-L204 HydrophobicContact CD2-CD2 4.14Å; F199-L204 HydrophobicContact CG-CD2 4.49Å; F199-L231 HydrophobicContact CD1-CD1 4.08Å; F199-L231 HydrophobicContact CD1-CD2 3.77Å; F199-L231 HydrophobicContact CE1-CD1 4.04Å; F199-L231 HydrophobicContact CE1-CD2 3.71Å; F199-Q235 HydrophobicContact CE1-CB 4.21Å; F199-Q235 HydrophobicContact CE1-CG 4.35Å; F199-Q235 HydrophobicContact CZ-CB 4.03Å; F199-Q235 HydrophobicContact CZ-CG 4.31Å; F199-W239 AromaticContact CD2-CD1 3.67Å; F199-W239 HydrophobicContact CE2-CB 4.28Å; F199-W239 AromaticContact CE2-CD1 3.6Å; F199-W239 HydrophobicContact CE2-CG 4.31Å |
| 200 | S | 97.5 | Very high | 89.2 | Confident | 51 Ų | 51 | 111.5 Ų | 111.5 | 36% | 0.357 | 54% | 0.541 | S | S | . | . | P | Polyproline II helix | trans | -65 | 148.7 | 173.5 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | S202 Q203 L204 | S200-S202 PolarHBondContact O-N 3.21Å; S200-S202 PolarHBondContact OG-OG 3.41Å; S200-Q203 WeakPolarHBondContact O-CB 3.3Å; S200-Q203 PolarHBondContact O-N 3.33Å; S200-L204 PolarHBondContact O-N 3.25Å |
| 201 | P | 97.1 | Very high | 90.8 | Very high | 103 Ų | 103 | 100.5 Ų | 100.5 | 67% | 0.669 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -52.9 | -37.3 | 175.3 | -27.2 | 35.1 | 0 | 0 | 0 | 113.7 | Q203 L204 L205 | P201-Q203 VanDerWaalsContact C-N 3.32Å; P201-Q203 PolarHBondContact O-N 3.37Å; P201-L204 PolarHBondContact O-N 3.22Å; P201-L205 PolarHBondContact O-N 3.09Å |
| 202 | S | 97.3 | Very high | 92 | Very high | 68 Ų | 68 | 98.8 Ų | 98.8 | 48% | 0.476 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -69.1 | -30 | 178 | 64.5 | 0 | 0 | 0 | 0 | 113 | S200 R206 | S200-S202 PolarHBondContact O-N 3.21Å; S200-S202 PolarHBondContact OG-OG 3.41Å; S202-R206 PolarHBondContact O-N 2.91Å |
| 203 | Q | 97.8 | Very high | 93.2 | Very high | 33 Ų | 33 | 101.4 Ų | 101.4 | 15% | 0.154 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -71.5 | -44.7 | 173.7 | -68.1 | 172.4 | -39.2 | 0 | 0 | 110.4 | F199 S200 P201 L205 R206 L207 L229 | F199-Q203 HydrophobicContact CB-CB 4.4Å; S200-Q203 WeakPolarHBondContact O-CB 3.3Å; S200-Q203 PolarHBondContact O-N 3.33Å; P201-Q203 VanDerWaalsContact C-N 3.32Å; P201-Q203 PolarHBondContact O-N 3.37Å; Q203-L205 PolarHBondContact O-N 2.96Å; Q203-R206 PolarHBondContact O-N 3.34Å; Q203-L207 VanDerWaalsContact O-CG 3.27Å; Q203-L207 WeakPolarHBondContact O-CG 3.47Å; Q203-L207 PolarHBondContact O-N 3.39Å; Q203-L229 HydrophobicContact CB-CD2 4.32Å; Q203-L229 HydrophobicContact CG-CD2 4.39Å; Q203-L229 PolarHBondContact NE2-O 3.2Å |
| 204 | L | 98 | Very high | 94.2 | Very high | 54 Ų | 54 | 94.7 Ų | 94.7 | 28% | 0.283 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -57.9 | -49.2 | 177.1 | -66.3 | 175.6 | 0 | 0 | 0 | 111.3 | F199 S200 P201 R206 L207 E208 W239 | F199-L204 HydrophobicContact CB-CD2 3.89Å; F199-L204 HydrophobicContact CB-CG 4.11Å; F199-L204 HydrophobicContact CD2-CD2 4.14Å; F199-L204 HydrophobicContact CG-CD2 4.49Å; S200-L204 PolarHBondContact O-N 3.25Å; P201-L204 PolarHBondContact O-N 3.22Å; L204-R206 VanDerWaalsContact C-N 3.28Å; L204-R206 PolarHBondContact O-N 3.06Å; L204-L207 CarbonylContact O-C 3.56Å; L204-L207 WeakPolarHBondContact O-CA 3.31Å; L204-L207 WeakPolarHBondContact O-CB 3.29Å; L204-L207 PolarHBondContact O-N 3.01Å; L204-E208 PolarHBondContact O-N 3.02Å; L204-W239 VanDerWaalsContact CD2-NE1 3.34Å |
| 205 | L | 98 | Very high | 95.2 | Very high | 82 Ų | 82 | 86.7 Ų | 86.7 | 43% | 0.429 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -56.6 | -42.2 | 179.8 | -177.7 | 64.5 | 0 | 0 | 0 | 112.6 | P201 Q203 E208 R209 | P201-L205 PolarHBondContact O-N 3.09Å; Q203-L205 PolarHBondContact O-N 2.96Å; L205-E208 WeakPolarHBondContact CA-OE2 3.49Å; L205-E208 PolarHBondContact N-OE2 3.22Å; L205-E208 PolarHBondContact O-N 3.06Å; L205-R209 WeakPolarHBondContact O-CG 3.22Å; L205-R209 PolarHBondContact O-N 2.72Å |
| 206 | R | 97.7 | Very high | 96.1 | Very high | 98 Ų | 98 | 85.9 Ų | 85.9 | 37% | 0.37 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -69.6 | -37.6 | 177.4 | -73.7 | -166.2 | -76.6 | 160.5 | -4.2 | 112.2 | S202 Q203 L204 A210 S228 L229 | S202-R206 PolarHBondContact O-N 2.91Å; Q203-R206 PolarHBondContact O-N 3.34Å; L204-R206 VanDerWaalsContact C-N 3.28Å; L204-R206 PolarHBondContact O-N 3.06Å; R206-A210 PolarHBondContact O-N 2.89Å; R206-S228 PolarHBondContact NH1-O 3.41Å; R206-S228 PolarHBondContact NH2-O 2.99Å; R206-L229 HydrophobicContact CB-CD2 3.52Å; R206-L229 HydrophobicContact CG-CD2 4.22Å |
| 207 | L | 98.4 | Very high | 96.7 | Very high | 0 Ų | 0 | 74.8 Ų | 74.8 | 0% | 0 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -65.1 | -40.7 | 174 | -70.7 | 163.9 | 0 | 0 | 0 | 111.6 | Q203 L204 A210 F211 L225 L229 L231 V236 W239 F240 | Q203-L207 VanDerWaalsContact O-CG 3.27Å; Q203-L207 WeakPolarHBondContact O-CG 3.47Å; Q203-L207 PolarHBondContact O-N 3.39Å; L204-L207 CarbonylContact O-C 3.56Å; L204-L207 WeakPolarHBondContact O-CA 3.31Å; L204-L207 WeakPolarHBondContact O-CB 3.29Å; L204-L207 PolarHBondContact O-N 3.01Å; L207-A210 PolarHBondContact O-N 3.15Å; L207-F211 WeakPolarHBondContact O-CB 3.46Å; L207-F211 PolarHBondContact O-N 2.94Å; L207-L225 HydrophobicContact CD2-CD2 4.01Å; L207-L225 HydrophobicContact CD2-CG 4.35Å; L207-L229 HydrophobicContact CD1-CD1 4.37Å; L207-L229 HydrophobicContact CD2-CD1 3.48Å; L207-L229 VanDerWaalsContact CD2-CD1 3.48Å; L207-L229 HydrophobicContact CG-CD1 3.63Å; L207-L231 HydrophobicContact CD1-CD1 4.22Å; L207-V236 HydrophobicContact CD2-CG1 4.39Å; L207-W239 VanDerWaalsContact C-CH2 3.46Å; L207-W239 HydrophobicContact CB-CD2 3.92Å; L207-W239 HydrophobicContact CB-CE3 3.87Å; L207-W239 HydrophobicContact CB-CH2 3.53Å; L207-W239 HydrophobicContact CB-CZ2 3.55Å; L207-W239 HydrophobicContact CB-CZ3 3.68Å; L207-W239 HydrophobicContact CD1-CD2 3.84Å; L207-W239 HydrophobicContact CD1-CE3 4.46Å; L207-W239 HydrophobicContact CD1-CG 3.87Å; L207-W239 HydrophobicContact CD1-CZ2 4.46Å; L207-W239 HydrophobicContact CD2-CD2 4.35Å; L207-W239 HydrophobicContact CD2-CE3 4.2Å; L207-W239 HydrophobicContact CG-CD2 4.26Å; L207-W239 HydrophobicContact CG-CE3 4.41Å; L207-F240 HydrophobicContact CD2-CE2 4.01Å |
| 208 | E | 98.3 | Very high | 97.3 | Very high | 64 Ų | 64 | 74.5 Ų | 74.5 | 30% | 0.299 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -62.9 | -47.6 | 174.9 | -85.2 | 116.3 | -148.7 | 0 | 0 | 111.9 | L204 L205 A210 F211 E212 W239 | L204-E208 PolarHBondContact O-N 3.02Å; L205-E208 WeakPolarHBondContact CA-OE2 3.49Å; L205-E208 PolarHBondContact N-OE2 3.22Å; L205-E208 PolarHBondContact O-N 3.06Å; E208-A210 VanDerWaalsContact C-N 3.29Å; E208-A210 PolarHBondContact O-N 2.98Å; E208-F211 WeakPolarHBondContact O-CA 3.44Å; E208-F211 WeakPolarHBondContact O-CB 3.45Å; E208-F211 PolarHBondContact O-N 3.38Å; E208-E212 WeakPolarHBondContact O-CG 3.42Å; E208-E212 PolarHBondContact O-N 2.8Å; E208-W239 HydrophobicContact CG-CH2 4.13Å; E208-W239 HydrophobicContact CG-CZ2 4.18Å |
| 209 | R | 98 | Very high | 97.4 | Very high | 139 Ų | 139 | 72.2 Ų | 72.2 | 53% | 0.525 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -60 | -37.5 | 175.7 | -73.8 | 175.2 | -178.4 | 165.7 | 0.3 | 113 | L205 | L205-R209 WeakPolarHBondContact O-CG 3.22Å; L205-R209 PolarHBondContact O-N 2.72Å |
| 210 | A | 97.3 | Very high | 97.4 | Very high | 15 Ų | 15 | 73.4 Ų | 73.4 | 12% | 0.124 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -68.6 | -40.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | R206 L207 E208 E212 K213 N214 L225 F240 | R206-A210 PolarHBondContact O-N 2.89Å; L207-A210 PolarHBondContact O-N 3.15Å; E208-A210 VanDerWaalsContact C-N 3.29Å; E208-A210 PolarHBondContact O-N 2.98Å; A210-E212 PolarHBondContact O-N 3.22Å; A210-K213 PolarHBondContact O-N 2.95Å; A210-N214 PolarHBondContact O-N 3.39Å; A210-L225 HydrophobicContact CB-CD1 4.24Å; A210-L225 HydrophobicContact CB-CD2 3.89Å; A210-F240 HydrophobicContact CB-CZ 4.18Å |
| 211 | F | 98.3 | Very high | 97.4 | Very high | 5 Ų | 5 | 74.2 Ų | 74.2 | 2% | 0.022 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -61.4 | -43.1 | 177.9 | -173.1 | -97.1 | 0 | 0 | 0 | 112.3 | L207 E208 K213 N214 H215 W239 F240 R243 R244 Y247 | L207-F211 WeakPolarHBondContact O-CB 3.46Å; L207-F211 PolarHBondContact O-N 2.94Å; E208-F211 WeakPolarHBondContact O-CA 3.44Å; E208-F211 WeakPolarHBondContact O-CB 3.45Å; E208-F211 PolarHBondContact O-N 3.38Å; F211-K213 PolarHBondContact O-N 3.22Å; F211-N214 WeakPolarHBondContact CA-O 3.35Å; F211-N214 CarbonylContact O-C 3.46Å; F211-N214 PolarHBondContact O-N 3.27Å; F211-H215 AromaticContact CD1-CD2 3.51Å; F211-H215 AromaticContact CD1-NE2 3.86Å; F211-H215 AromaticContact CE1-CD2 3.16Å; F211-H215 WeakPolarHBondContact CE1-CD2 3.16Å; F211-H215 AromaticContact CE1-NE2 3.35Å; F211-H215 WeakPolarHBondContact CE1-NE2 3.35Å; F211-H215 HydrophobicContact CE2-CB 3.96Å; F211-H215 AromaticContact CE2-CD2 3.74Å; F211-H215 AromaticContact CG-CD2 3.95Å; F211-H215 HydrophobicContact CZ-CB 4.09Å; F211-H215 AromaticContact CZ-CD2 3.28Å; F211-H215 WeakPolarHBondContact CZ-CD2 3.47Å; F211-H215 AromaticContact CZ-CG 3.73Å; F211-H215 AromaticContact CZ-NE2 3.82Å; F211-H215 PolarHBondContact O-CD2 3.09Å; F211-H215 PolarHBondContact O-N 3.48Å; F211-W239 HydrophobicContact CB-CH2 4.36Å; F211-W239 HydrophobicContact CB-CZ3 4.16Å; F211-W239 HydrophobicContact CD2-CZ3 4.41Å; F211-F240 HydrophobicContact CB-CE1 4.22Å; F211-F240 HydrophobicContact CB-CZ 4.49Å; F211-F240 AromaticContact CD2-CD1 3.82Å; F211-F240 HydrophobicContact CD2-CD1 3.82Å; F211-F240 AromaticContact CD2-CE1 3.83Å; F211-F240 HydrophobicContact CD2-CE1 3.83Å; F211-F240 HydrophobicContact CE2-CD1 4.45Å; F211-R243 HydrophobicContact CD1-CG 3.85Å; F211-R243 HydrophobicContact CD2-CB 4.14Å; F211-R243 HydrophobicContact CD2-CG 3.62Å; F211-R243 HydrophobicContact CE1-CG 3.84Å; F211-R243 HydrophobicContact CE2-CB 4.01Å; F211-R243 HydrophobicContact CE2-CG 3.63Å; F211-R243 HydrophobicContact CG-CG 3.74Å; F211-R243 HydrophobicContact CZ-CB 4.44Å; F211-R243 HydrophobicContact CZ-CG 3.75Å; F211-R244 HydrophobicContact CE2-CG 3.78Å; F211-R244 HydrophobicContact CZ-CG 4.16Å; F211-Y247 HydrophobicContact CE1-CD2 4.35Å; F211-Y247 HydrophobicContact CE1-CG 4.39Å; F211-Y247 HydrophobicContact CZ-CG 4.46Å |
| 212 | E | 97.6 | Very high | 97.5 | Very high | 151 Ų | 151 | 71.9 Ų | 71.9 | 71% | 0.706 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -57.3 | -34.7 | 176.9 | -72.4 | 167.1 | -176.1 | 0 | 0 | 112.9 | E208 A210 | E208-E212 WeakPolarHBondContact O-CG 3.42Å; E208-E212 PolarHBondContact O-N 2.8Å; A210-E212 PolarHBondContact O-N 3.22Å |
| 213 | K | 96.9 | Very high | 97.5 | Very high | 184 Ų | 184 | 75.4 Ų | 75.4 | 80% | 0.8 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -76.1 | -43.3 | 176.4 | -62.9 | 175 | -176.8 | -176.9 | 0 | 111.7 | A210 F211 | A210-K213 PolarHBondContact O-N 2.95Å; F211-K213 PolarHBondContact O-N 3.22Å |
| 214 | N | 96.7 | Very high | 97.5 | Very high | 58 Ų | 58 | 81 Ų | 81 | 31% | 0.31 | 40% | 0.397 | S | S | . | . | trans | -149.3 | 120.8 | -178.2 | -177 | 3.4 | 0 | 0 | 0 | 111.1 | A210 F211 Y216 E221 F240 | A210-N214 PolarHBondContact O-N 3.39Å; F211-N214 WeakPolarHBondContact CA-O 3.35Å; F211-N214 CarbonylContact O-C 3.46Å; F211-N214 PolarHBondContact O-N 3.27Å; N214-Y216 PolarHBondContact ND2-O 2.85Å; N214-Y216 PolarHBondContact O-N 3.49Å; N214-Y216 PolarHBondContact OD1-N 3.43Å; N214-Y216 PolarHBondContact OD1-O 2.89Å; N214-E221 PolarHBondContact ND2-OE2 3.2Å; N214-F240 WeakPolarHBondContact O-CE1 3.28Å | ||
| 215 | H | 97.1 | Very high | 97.5 | Very high | 63 Ų | 63 | 79.5 Ų | 79.5 | 29% | 0.292 | 39% | 0.389 | S | S | . | . | S | Bend | trans | -71.8 | -8.7 | 177.6 | -65.3 | 162.8 | 0 | 0 | 0 | 114 | F211 R244 Y247 | F211-H215 AromaticContact CD1-CD2 3.51Å; F211-H215 AromaticContact CD1-NE2 3.86Å; F211-H215 AromaticContact CE1-CD2 3.16Å; F211-H215 WeakPolarHBondContact CE1-CD2 3.16Å; F211-H215 AromaticContact CE1-NE2 3.35Å; F211-H215 WeakPolarHBondContact CE1-NE2 3.35Å; F211-H215 HydrophobicContact CE2-CB 3.96Å; F211-H215 AromaticContact CE2-CD2 3.74Å; F211-H215 AromaticContact CG-CD2 3.95Å; F211-H215 HydrophobicContact CZ-CB 4.09Å; F211-H215 AromaticContact CZ-CD2 3.28Å; F211-H215 WeakPolarHBondContact CZ-CD2 3.47Å; F211-H215 AromaticContact CZ-CG 3.73Å; F211-H215 AromaticContact CZ-NE2 3.82Å; F211-H215 PolarHBondContact O-CD2 3.09Å; F211-H215 PolarHBondContact O-N 3.48Å; H215-R244 WeakPolarHBondContact O-CD 3.49Å; H215-R244 PolarHBondContact O-NH1 3.47Å; H215-Y247 AromaticContact CE1-CE1 3.91Å; H215-Y247 AromaticContact CE1-CZ 3.85Å |
| 216 | Y | 97.7 | Very high | 97.5 | Very high | 146 Ų | 146 | 75.8 Ų | 75.8 | 57% | 0.573 | 37% | 0.37 | S | S | * | . | trans | -135.7 | 101.1 | -176.9 | -64 | -92.1 | 0 | 0 | 0 | 112.7 | N214 R244 | N214-Y216 PolarHBondContact ND2-O 2.85Å; N214-Y216 PolarHBondContact O-N 3.49Å; N214-Y216 PolarHBondContact OD1-N 3.43Å; N214-Y216 PolarHBondContact OD1-O 2.89Å; Y216-R244 VanDerWaalsContact CD1-CZ 3.46Å; Y216-R244 VanDerWaalsContact CE1-CZ 3.46Å; Y216-R244 VanDerWaalsContact CE1-NE 3.32Å | ||
| 217 | V | 96.8 | Very high | 97.5 | Very high | 6 Ų | 6 | 73.8 Ų | 73.8 | 4% | 0.036 | 38% | 0.38 | C | S | . | . | trans | -86.2 | 129.4 | 173.4 | -65.5 | 0 | 0 | 0 | 0 | 112.7 | E221 R222 L225 V236 F240 | V217-E221 HydrophobicContact CG1-CG 4.16Å; V217-R222 HydrophobicContact CB-CB 4.45Å; V217-R222 HydrophobicContact CG2-CB 4.44Å; V217-R222 PolarHBondContact O-NH2 2.92Å; V217-L225 HydrophobicContact CG1-CD2 4.39Å; V217-V236 HydrophobicContact CG2-CG1 4.01Å; V217-F240 HydrophobicContact CB-CD1 4.46Å; V217-F240 HydrophobicContact CB-CE1 4.26Å; V217-F240 HydrophobicContact CB-CZ 4.3Å; V217-F240 HydrophobicContact CG1-CD1 4.07Å; V217-F240 HydrophobicContact CG1-CE1 3.42Å; V217-F240 VanDerWaalsContact CG1-CE1 3.42Å; V217-F240 HydrophobicContact CG1-CE2 3.93Å; V217-F240 HydrophobicContact CG1-CZ 3.34Å; V217-F240 HydrophobicContact CG2-CB 4.3Å; V217-F240 HydrophobicContact CG2-CD1 3.8Å; V217-F240 HydrophobicContact CG2-CD2 3.57Å; V217-F240 HydrophobicContact CG2-CE1 3.97Å; V217-F240 HydrophobicContact CG2-CE2 3.76Å; V217-F240 HydrophobicContact CG2-CG 3.6Å; V217-F240 HydrophobicContact CG2-CZ 3.96Å | ||
| 218 | V | 96.6 | Very high | 97.5 | Very high | 95 Ų | 95 | 76.7 Ų | 76.7 | 58% | 0.576 | 40% | 0.4 | S | S | * | . | trans | -128.9 | 152.7 | -176 | -65.4 | 0 | 0 | 0 | 0 | 111.9 | A220 E221 R222 | V218-A220 PolarHBondContact O-N 3.06Å; V218-E221 PolarHBondContact O-N 3.23Å; V218-R222 PolarHBondContact O-N 2.74Å | ||
| 219 | G | 96.2 | Very high | 97.4 | Very high | 50 Ų | 50 | 73.7 Ų | 73.7 | 52% | 0.515 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | 37.8 | -105.2 | 170.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | K223 | G219-K223 PolarHBondContact O-N 3.32Å; G219-K223 VanDerWaalsContact O-N 3.16Å |
| 220 | A | 96.9 | Very high | 97.4 | Very high | 76 Ų | 76 | 72.3 Ų | 72.3 | 63% | 0.628 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -65.7 | -44.3 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | V218 R222 K223 Q224 | V218-A220 PolarHBondContact O-N 3.06Å; A220-R222 VanDerWaalsContact C-N 3.29Å; A220-R222 PolarHBondContact O-N 3.36Å; A220-K223 PolarHBondContact O-N 3.49Å; A220-Q224 WeakPolarHBondContact O-CG 3.36Å; A220-Q224 PolarHBondContact O-N 2.81Å |
| 221 | E | 96.9 | Very high | 97.3 | Very high | 69 Ų | 69 | 72.6 Ų | 72.6 | 32% | 0.322 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.7 | -41.5 | -180 | -173.7 | -175 | -173.2 | 0 | 0 | 110.7 | N214 V217 V218 K223 Q224 L225 | N214-E221 PolarHBondContact ND2-OE2 3.2Å; V217-E221 HydrophobicContact CG1-CG 4.16Å; V218-E221 PolarHBondContact O-N 3.23Å; E221-K223 PolarHBondContact O-N 3.26Å; E221-Q224 PolarHBondContact O-N 3.28Å; E221-L225 WeakPolarHBondContact O-CB 3.37Å; E221-L225 PolarHBondContact O-N 3.35Å |
| 222 | R | 98.4 | Very high | 97.3 | Very high | 53 Ų | 53 | 74.9 Ų | 74.9 | 20% | 0.2 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -61.6 | -45.7 | 175.6 | -175 | -172.1 | -59.1 | 156.5 | 7.8 | 111.5 | V217 V218 A220 L225 A226 E233 V236 | V217-R222 HydrophobicContact CB-CB 4.45Å; V217-R222 HydrophobicContact CG2-CB 4.44Å; V217-R222 PolarHBondContact O-NH2 2.92Å; V218-R222 PolarHBondContact O-N 2.74Å; A220-R222 VanDerWaalsContact C-N 3.29Å; A220-R222 PolarHBondContact O-N 3.36Å; R222-L225 PolarHBondContact O-N 2.83Å; R222-A226 WeakPolarHBondContact O-CB 3.5Å; R222-A226 PolarHBondContact O-N 3.48Å; R222-E233 WeakPolarHBondContact CD-O 3.4Å; R222-E233 HydrophobicContact CG-CB 4.15Å; R222-E233 HydrophobicContact CG-CG 4.27Å; R222-V236 HydrophobicContact CG-CB 4.31Å; R222-V236 HydrophobicContact CG-CG1 4.12Å |
| 223 | K | 98.2 | Very high | 97.3 | Very high | 142 Ų | 142 | 71.6 Ų | 71.6 | 62% | 0.617 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -63.2 | -42.4 | -179.7 | -170.8 | 175.2 | -178.1 | 179.5 | 0 | 111.6 | G219 A220 E221 G227 | G219-K223 PolarHBondContact O-N 3.32Å; G219-K223 VanDerWaalsContact O-N 3.16Å; A220-K223 PolarHBondContact O-N 3.49Å; E221-K223 PolarHBondContact O-N 3.26Å; K223-G227 PolarHBondContact O-N 3.48Å |
| 224 | Q | 98 | Very high | 97.3 | Very high | 150 Ų | 150 | 67.4 Ų | 67.4 | 70% | 0.701 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -63.9 | -46.4 | 175.7 | -72.9 | -172.9 | -22.3 | 0 | 0 | 112.2 | A220 E221 A226 G227 S228 | A220-Q224 WeakPolarHBondContact O-CG 3.36Å; A220-Q224 PolarHBondContact O-N 2.81Å; E221-Q224 PolarHBondContact O-N 3.28Å; Q224-A226 PolarHBondContact O-N 3.31Å; Q224-G227 PolarHBondContact O-N 3.47Å; Q224-S228 PolarHBondContact O-N 3.04Å |
| 225 | L | 97.6 | Very high | 97.4 | Very high | 23 Ų | 23 | 67.3 Ų | 67.3 | 12% | 0.12 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -63.2 | -44.6 | 179.6 | -172.1 | 57.9 | 0 | 0 | 0 | 111.4 | L207 A210 V217 E221 R222 S228 L229 V236 F240 | L207-L225 HydrophobicContact CD2-CD2 4.01Å; L207-L225 HydrophobicContact CD2-CG 4.35Å; A210-L225 HydrophobicContact CB-CD1 4.24Å; A210-L225 HydrophobicContact CB-CD2 3.89Å; V217-L225 HydrophobicContact CG1-CD2 4.39Å; E221-L225 WeakPolarHBondContact O-CB 3.37Å; E221-L225 PolarHBondContact O-N 3.35Å; R222-L225 PolarHBondContact O-N 2.83Å; L225-S228 PolarHBondContact O-N 3.49Å; L225-S228 PolarHBondContact O-OG 3.45Å; L225-L229 HydrophobicContact CD1-CD1 3.67Å; L225-L229 HydrophobicContact CD1-CG 4.25Å; L225-L229 HydrophobicContact CG-CD1 3.77Å; L225-L229 WeakPolarHBondContact O-CB 3.27Å; L225-L229 VanDerWaalsContact O-CG 3.31Å; L225-L229 WeakPolarHBondContact O-CG 3.4Å; L225-L229 PolarHBondContact O-N 3.36Å; L225-L229 VanDerWaalsContact O-N 3.11Å; L225-V236 HydrophobicContact CD2-CG1 3.96Å; L225-V236 HydrophobicContact CG-CG1 4.44Å; L225-F240 HydrophobicContact CD2-CE2 3.67Å; L225-F240 HydrophobicContact CD2-CZ 3.97Å |
| 226 | A | 98 | Very high | 97.4 | Very high | 5 Ų | 5 | 64.3 Ų | 64.3 | 4% | 0.041 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -55.8 | -50.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | R222 Q224 S228 L229 S230 L231 E233 V236 | R222-A226 WeakPolarHBondContact O-CB 3.5Å; R222-A226 PolarHBondContact O-N 3.48Å; Q224-A226 PolarHBondContact O-N 3.31Å; A226-S228 PolarHBondContact O-N 3.33Å; A226-L229 PolarHBondContact O-N 3.48Å; A226-S230 PolarHBondContact O-N 3.42Å; A226-S230 VanDerWaalsContact O-N 3.11Å; A226-L231 CarbonylContact C-O 3.15Å; A226-L231 VanDerWaalsContact CB-O 3.3Å; A226-L231 WeakPolarHBondContact CB-O 3.46Å; A226-L231 PolarHBondContact O-N 3.24Å; A226-E233 HydrophobicContact CB-CG 4.04Å; A226-V236 HydrophobicContact CB-CG2 4.02Å |
| 227 | G | 97.8 | Very high | 97.4 | Very high | 56 Ų | 56 | 63 Ų | 63 | 58% | 0.577 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -60.1 | -43.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | K223 Q224 L229 S230 | K223-G227 PolarHBondContact O-N 3.48Å; Q224-G227 PolarHBondContact O-N 3.47Å; G227-L229 VanDerWaalsContact C-N 3.29Å; G227-L229 PolarHBondContact O-N 2.92Å; G227-S230 PolarHBondContact O-N 3.21Å |
| 228 | S | 97.4 | Very high | 97.4 | Very high | 60 Ų | 60 | 66.4 Ų | 66.4 | 42% | 0.42 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -66.9 | -29 | -179.7 | 76.6 | 0 | 0 | 0 | 0 | 113.8 | R206 Q224 L225 A226 | R206-S228 PolarHBondContact NH1-O 3.41Å; R206-S228 PolarHBondContact NH2-O 2.99Å; Q224-S228 PolarHBondContact O-N 3.04Å; L225-S228 PolarHBondContact O-N 3.49Å; L225-S228 PolarHBondContact O-OG 3.45Å; A226-S228 PolarHBondContact O-N 3.33Å |
| 229 | L | 96.9 | Very high | 97.5 | Very high | 1 Ų | 1 | 63 Ų | 63 | 1% | 0.005 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -97.7 | -3.9 | -175.4 | -65.7 | 169.3 | 0 | 0 | 0 | 113.4 | Q203 R206 L207 L225 A226 G227 L231 | Q203-L229 HydrophobicContact CB-CD2 4.32Å; Q203-L229 HydrophobicContact CG-CD2 4.39Å; Q203-L229 PolarHBondContact NE2-O 3.2Å; R206-L229 HydrophobicContact CB-CD2 3.52Å; R206-L229 HydrophobicContact CG-CD2 4.22Å; L207-L229 HydrophobicContact CD1-CD1 4.37Å; L207-L229 HydrophobicContact CD2-CD1 3.48Å; L207-L229 VanDerWaalsContact CD2-CD1 3.48Å; L207-L229 HydrophobicContact CG-CD1 3.63Å; L225-L229 HydrophobicContact CD1-CD1 3.67Å; L225-L229 HydrophobicContact CD1-CG 4.25Å; L225-L229 HydrophobicContact CG-CD1 3.77Å; L225-L229 WeakPolarHBondContact O-CB 3.27Å; L225-L229 VanDerWaalsContact O-CG 3.31Å; L225-L229 WeakPolarHBondContact O-CG 3.4Å; L225-L229 PolarHBondContact O-N 3.36Å; L225-L229 VanDerWaalsContact O-N 3.11Å; A226-L229 PolarHBondContact O-N 3.48Å; G227-L229 VanDerWaalsContact C-N 3.29Å; G227-L229 PolarHBondContact O-N 2.92Å; L229-L231 HydrophobicContact CB-CB 4.34Å; L229-L231 HydrophobicContact CB-CD1 3.95Å; L229-L231 HydrophobicContact CB-CG 3.87Å; L229-L231 HydrophobicContact CD1-CD1 4.2Å; L229-L231 PolarHBondContact O-N 3.38Å |
| 230 | S | 97.5 | Very high | 97.6 | Very high | 110 Ų | 110 | 60.8 Ų | 60.8 | 77% | 0.769 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.4 | 43.5 | -168.8 | -51.7 | 0 | 0 | 0 | 0 | 112 | A226 G227 | A226-S230 PolarHBondContact O-N 3.42Å; A226-S230 VanDerWaalsContact O-N 3.11Å; G227-S230 PolarHBondContact O-N 3.21Å |
| 231 | L | 96.9 | Very high | 97.6 | Very high | 21 Ų | 21 | 61.6 Ų | 61.6 | 11% | 0.11 | 33% | 0.334 | C | S | . | . | trans | -117.4 | 157.2 | 176.8 | -64 | -179.7 | 0 | 0 | 0 | 110 | F199 L207 A226 L229 Q235 V236 | F199-L231 HydrophobicContact CD1-CD1 4.08Å; F199-L231 HydrophobicContact CD1-CD2 3.77Å; F199-L231 HydrophobicContact CE1-CD1 4.04Å; F199-L231 HydrophobicContact CE1-CD2 3.71Å; L207-L231 HydrophobicContact CD1-CD1 4.22Å; A226-L231 CarbonylContact C-O 3.15Å; A226-L231 VanDerWaalsContact CB-O 3.3Å; A226-L231 WeakPolarHBondContact CB-O 3.46Å; A226-L231 PolarHBondContact O-N 3.24Å; L229-L231 HydrophobicContact CB-CB 4.34Å; L229-L231 HydrophobicContact CB-CD1 3.95Å; L229-L231 HydrophobicContact CB-CG 3.87Å; L229-L231 HydrophobicContact CD1-CD1 4.2Å; L229-L231 PolarHBondContact O-N 3.38Å; L231-Q235 HydrophobicContact CB-CB 4.48Å; L231-V236 HydrophobicContact CB-CG2 4.17Å | ||
| 232 | S | 97.9 | Very high | 97.7 | Very high | 54 Ų | 54 | 63.2 Ų | 63.2 | 38% | 0.378 | 35% | 0.345 | S | S | . | . | trans | -74.4 | 150.2 | 169.4 | 64.7 | 0 | 0 | 0 | 0 | 111.5 | T234 Q235 V236 | S232-T234 PolarHBondContact O-N 2.87Å; S232-T234 VanDerWaalsContact O-N 3.16Å; S232-Q235 WeakPolarHBondContact O-CB 3.48Å; S232-Q235 PolarHBondContact O-N 2.94Å; S232-Q235 WeakPolarHBondContact OG-CB 3.34Å; S232-Q235 VanDerWaalsContact OG-CD 3.31Å; S232-Q235 VanDerWaalsContact OG-CG 3.22Å; S232-Q235 WeakPolarHBondContact OG-CG 3.45Å; S232-Q235 PolarHBondContact OG-N 3.15Å; S232-Q235 VanDerWaalsContact OG-N 3.16Å; S232-Q235 PolarHBondContact OG-OE1 3.37Å; S232-V236 PolarHBondContact O-N 3.24Å | ||
| 233 | E | 97.8 | Very high | 97.7 | Very high | 81 Ų | 81 | 63.3 Ų | 63.3 | 38% | 0.379 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -54.4 | -35.4 | 173.3 | -70.5 | -171.8 | -134 | 0 | 0 | 112.2 | R222 A226 V236 K237 | R222-E233 WeakPolarHBondContact CD-O 3.4Å; R222-E233 HydrophobicContact CG-CB 4.15Å; R222-E233 HydrophobicContact CG-CG 4.27Å; A226-E233 HydrophobicContact CB-CG 4.04Å; E233-V236 PolarHBondContact O-N 3.4Å; E233-K237 VanDerWaalsContact O-CB 3.31Å; E233-K237 WeakPolarHBondContact O-CB 3.34Å; E233-K237 PolarHBondContact O-N 3.49Å |
| 234 | T | 97.1 | Very high | 97.6 | Very high | 96 Ų | 96 | 58.6 Ų | 58.6 | 59% | 0.589 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -65.3 | -43.2 | 176 | -58.5 | 0 | 0 | 0 | 0 | 111.8 | S232 K237 V238 | S232-T234 PolarHBondContact O-N 2.87Å; S232-T234 VanDerWaalsContact O-N 3.16Å; T234-K237 WeakPolarHBondContact O-CB 3.27Å; T234-K237 PolarHBondContact O-N 3.05Å; T234-V238 HydrophobicContact CG2-CG2 4.42Å; T234-V238 WeakPolarHBondContact O-CB 3.5Å; T234-V238 VanDerWaalsContact O-CG2 3.29Å; T234-V238 WeakPolarHBondContact O-CG2 3.14Å; T234-V238 PolarHBondContact O-N 3.45Å |
| 235 | Q | 97.2 | Very high | 97.6 | Very high | 57 Ų | 57 | 54.4 Ų | 54.4 | 27% | 0.266 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -62 | -43.8 | 175.4 | -77.9 | 164.4 | -47.4 | 0 | 0 | 111.4 | F199 L231 S232 V238 W239 | F199-Q235 HydrophobicContact CE1-CB 4.21Å; F199-Q235 HydrophobicContact CE1-CG 4.35Å; F199-Q235 HydrophobicContact CZ-CB 4.03Å; F199-Q235 HydrophobicContact CZ-CG 4.31Å; L231-Q235 HydrophobicContact CB-CB 4.48Å; S232-Q235 WeakPolarHBondContact O-CB 3.48Å; S232-Q235 PolarHBondContact O-N 2.94Å; S232-Q235 WeakPolarHBondContact OG-CB 3.34Å; S232-Q235 VanDerWaalsContact OG-CD 3.31Å; S232-Q235 VanDerWaalsContact OG-CG 3.22Å; S232-Q235 WeakPolarHBondContact OG-CG 3.45Å; S232-Q235 PolarHBondContact OG-N 3.15Å; S232-Q235 VanDerWaalsContact OG-N 3.16Å; S232-Q235 PolarHBondContact OG-OE1 3.37Å; Q235-V238 PolarHBondContact O-N 3.19Å; Q235-W239 WeakPolarHBondContact O-CB 3.49Å; Q235-W239 PolarHBondContact O-N 3.1Å |
| 236 | V | 97.9 | Very high | 97.5 | Very high | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -61.2 | -46.7 | 175 | 177.8 | 0 | 0 | 0 | 0 | 110.4 | L207 V217 R222 L225 A226 L231 S232 E233 V238 W239 F240 | L207-V236 HydrophobicContact CD2-CG1 4.39Å; V217-V236 HydrophobicContact CG2-CG1 4.01Å; R222-V236 HydrophobicContact CG-CB 4.31Å; R222-V236 HydrophobicContact CG-CG1 4.12Å; L225-V236 HydrophobicContact CD2-CG1 3.96Å; L225-V236 HydrophobicContact CG-CG1 4.44Å; A226-V236 HydrophobicContact CB-CG2 4.02Å; L231-V236 HydrophobicContact CB-CG2 4.17Å; S232-V236 PolarHBondContact O-N 3.24Å; E233-V236 PolarHBondContact O-N 3.4Å; V236-V238 PolarHBondContact O-N 3.42Å; V236-W239 PolarHBondContact O-N 2.8Å; V236-F240 HydrophobicContact CG1-CD2 3.85Å; V236-F240 HydrophobicContact CG1-CE2 3.92Å; V236-F240 WeakPolarHBondContact O-CD2 3.36Å; V236-F240 PolarHBondContact O-N 3Å |
| 237 | K | 97.3 | Very high | 97.4 | Very high | 119 Ų | 119 | 63.7 Ų | 63.7 | 52% | 0.517 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -56.7 | -48.1 | 176.7 | -179.5 | -176.3 | 178.4 | -178.3 | 0 | 112 | E233 T234 F240 Q241 | E233-K237 VanDerWaalsContact O-CB 3.31Å; E233-K237 WeakPolarHBondContact O-CB 3.34Å; E233-K237 PolarHBondContact O-N 3.49Å; T234-K237 WeakPolarHBondContact O-CB 3.27Å; T234-K237 PolarHBondContact O-N 3.05Å; K237-F240 PolarHBondContact O-N 3.34Å; K237-Q241 PolarHBondContact O-N 2.97Å |
| 238 | V | 97.6 | Very high | 97.3 | Very high | 76 Ų | 76 | 67.5 Ų | 67.5 | 46% | 0.461 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -65.3 | -42.7 | 179.3 | 170.7 | 0 | 0 | 0 | 0 | 110.8 | T234 Q235 V236 F240 Q241 N242 | T234-V238 HydrophobicContact CG2-CG2 4.42Å; T234-V238 WeakPolarHBondContact O-CB 3.5Å; T234-V238 VanDerWaalsContact O-CG2 3.29Å; T234-V238 WeakPolarHBondContact O-CG2 3.14Å; T234-V238 PolarHBondContact O-N 3.45Å; Q235-V238 PolarHBondContact O-N 3.19Å; V236-V238 PolarHBondContact O-N 3.42Å; V238-F240 PolarHBondContact O-N 2.98Å; V238-Q241 PolarHBondContact O-N 3.07Å; V238-N242 VanDerWaalsContact O-CG 3.31Å; V238-N242 PolarHBondContact O-N 3.3Å; V238-N242 PolarHBondContact O-ND2 3.26Å |
| 239 | W | 97.8 | Very high | 97.1 | Very high | 25 Ų | 25 | 73.4 Ų | 73.4 | 10% | 0.095 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -60.2 | -47.3 | 177.4 | -172.6 | 98.1 | 0 | 0 | 0 | 111.4 | F199 L204 L207 E208 F211 Q235 V236 Q241 N242 R243 | F199-W239 AromaticContact CD2-CD1 3.67Å; F199-W239 HydrophobicContact CE2-CB 4.28Å; F199-W239 AromaticContact CE2-CD1 3.6Å; F199-W239 HydrophobicContact CE2-CG 4.31Å; L204-W239 VanDerWaalsContact CD2-NE1 3.34Å; L207-W239 VanDerWaalsContact C-CH2 3.46Å; L207-W239 HydrophobicContact CB-CD2 3.92Å; L207-W239 HydrophobicContact CB-CE3 3.87Å; L207-W239 HydrophobicContact CB-CH2 3.53Å; L207-W239 HydrophobicContact CB-CZ2 3.55Å; L207-W239 HydrophobicContact CB-CZ3 3.68Å; L207-W239 HydrophobicContact CD1-CD2 3.84Å; L207-W239 HydrophobicContact CD1-CE3 4.46Å; L207-W239 HydrophobicContact CD1-CG 3.87Å; L207-W239 HydrophobicContact CD1-CZ2 4.46Å; L207-W239 HydrophobicContact CD2-CD2 4.35Å; L207-W239 HydrophobicContact CD2-CE3 4.2Å; L207-W239 HydrophobicContact CG-CD2 4.26Å; L207-W239 HydrophobicContact CG-CE3 4.41Å; E208-W239 HydrophobicContact CG-CH2 4.13Å; E208-W239 HydrophobicContact CG-CZ2 4.18Å; F211-W239 HydrophobicContact CB-CH2 4.36Å; F211-W239 HydrophobicContact CB-CZ3 4.16Å; F211-W239 HydrophobicContact CD2-CZ3 4.41Å; Q235-W239 WeakPolarHBondContact O-CB 3.49Å; Q235-W239 PolarHBondContact O-N 3.1Å; V236-W239 PolarHBondContact O-N 2.8Å; W239-Q241 VanDerWaalsContact C-N 3.32Å; W239-Q241 PolarHBondContact O-N 3.33Å; W239-N242 PolarHBondContact O-N 3.2Å; W239-R243 HydrophobicContact CE3-CB 4.03Å; W239-R243 HydrophobicContact CH2-CB 4.06Å; W239-R243 HydrophobicContact CH2-CG 3.75Å; W239-R243 HydrophobicContact CZ2-CG 4.43Å; W239-R243 HydrophobicContact CZ3-CB 3.77Å; W239-R243 HydrophobicContact CZ3-CG 3.82Å; W239-R243 WeakPolarHBondContact O-CB 3.44Å; W239-R243 PolarHBondContact O-N 2.9Å |
| 240 | F | 98.4 | Very high | 96.8 | Very high | 2 Ų | 2 | 77.3 Ų | 77.3 | 1% | 0.009 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -62.3 | -38.4 | 177.2 | -90.6 | -102 | 0 | 0 | 0 | 112.4 | L207 A210 F211 N214 V217 L225 V236 K237 V238 R243 R244 | L207-F240 HydrophobicContact CD2-CE2 4.01Å; A210-F240 HydrophobicContact CB-CZ 4.18Å; F211-F240 HydrophobicContact CB-CE1 4.22Å; F211-F240 HydrophobicContact CB-CZ 4.49Å; F211-F240 AromaticContact CD2-CD1 3.82Å; F211-F240 HydrophobicContact CD2-CD1 3.82Å; F211-F240 AromaticContact CD2-CE1 3.83Å; F211-F240 HydrophobicContact CD2-CE1 3.83Å; F211-F240 HydrophobicContact CE2-CD1 4.45Å; N214-F240 WeakPolarHBondContact O-CE1 3.28Å; V217-F240 HydrophobicContact CB-CD1 4.46Å; V217-F240 HydrophobicContact CB-CE1 4.26Å; V217-F240 HydrophobicContact CB-CZ 4.3Å; V217-F240 HydrophobicContact CG1-CD1 4.07Å; V217-F240 HydrophobicContact CG1-CE1 3.42Å; V217-F240 VanDerWaalsContact CG1-CE1 3.42Å; V217-F240 HydrophobicContact CG1-CE2 3.93Å; V217-F240 HydrophobicContact CG1-CZ 3.34Å; V217-F240 HydrophobicContact CG2-CB 4.3Å; V217-F240 HydrophobicContact CG2-CD1 3.8Å; V217-F240 HydrophobicContact CG2-CD2 3.57Å; V217-F240 HydrophobicContact CG2-CE1 3.97Å; V217-F240 HydrophobicContact CG2-CE2 3.76Å; V217-F240 HydrophobicContact CG2-CG 3.6Å; V217-F240 HydrophobicContact CG2-CZ 3.96Å; L225-F240 HydrophobicContact CD2-CE2 3.67Å; L225-F240 HydrophobicContact CD2-CZ 3.97Å; V236-F240 HydrophobicContact CG1-CD2 3.85Å; V236-F240 HydrophobicContact CG1-CE2 3.92Å; V236-F240 WeakPolarHBondContact O-CD2 3.36Å; V236-F240 PolarHBondContact O-N 3Å; K237-F240 PolarHBondContact O-N 3.34Å; V238-F240 PolarHBondContact O-N 2.98Å; F240-R243 PolarHBondContact O-N 3.16Å; F240-R244 WeakPolarHBondContact O-CG 3.36Å; F240-R244 PolarHBondContact O-N 3.24Å |
| 241 | Q | 98.1 | Very high | 96.3 | Very high | 93 Ų | 93 | 77.7 Ų | 77.7 | 44% | 0.435 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.5 | -44.6 | 175.5 | -173.4 | 58.2 | 51.5 | 0 | 0 | 112 | K237 V238 W239 T245 | K237-Q241 PolarHBondContact O-N 2.97Å; V238-Q241 PolarHBondContact O-N 3.07Å; W239-Q241 VanDerWaalsContact C-N 3.32Å; W239-Q241 PolarHBondContact O-N 3.33Å; Q241-T245 PolarHBondContact O-N 2.97Å; Q241-T245 VanDerWaalsContact O-N 3.15Å; Q241-T245 PolarHBondContact O-OG1 3.39Å |
| 242 | N | 97.6 | Very high | 95.7 | Very high | 103 Ų | 103 | 82.6 Ų | 82.6 | 55% | 0.551 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -64.8 | -42.2 | 176.3 | -70.5 | -17.6 | 0 | 0 | 0 | 111 | V238 W239 T245 K246 | V238-N242 VanDerWaalsContact O-CG 3.31Å; V238-N242 PolarHBondContact O-N 3.3Å; V238-N242 PolarHBondContact O-ND2 3.26Å; W239-N242 PolarHBondContact O-N 3.2Å; N242-T245 WeakPolarHBondContact O-CB 3.38Å; N242-T245 PolarHBondContact O-N 2.91Å; N242-K246 PolarHBondContact O-N 3.13Å |
| 243 | R | 98 | Very high | 94.9 | Very high | 55 Ų | 55 | 85.4 Ų | 85.4 | 21% | 0.208 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -62.7 | -45.2 | 179.1 | -172.3 | 65.3 | -175.1 | 116.3 | -5.9 | 112 | F211 W239 F240 T245 K246 Y247 | F211-R243 HydrophobicContact CD1-CG 3.85Å; F211-R243 HydrophobicContact CD2-CB 4.14Å; F211-R243 HydrophobicContact CD2-CG 3.62Å; F211-R243 HydrophobicContact CE1-CG 3.84Å; F211-R243 HydrophobicContact CE2-CB 4.01Å; F211-R243 HydrophobicContact CE2-CG 3.63Å; F211-R243 HydrophobicContact CG-CG 3.74Å; F211-R243 HydrophobicContact CZ-CB 4.44Å; F211-R243 HydrophobicContact CZ-CG 3.75Å; W239-R243 HydrophobicContact CE3-CB 4.03Å; W239-R243 HydrophobicContact CH2-CB 4.06Å; W239-R243 HydrophobicContact CH2-CG 3.75Å; W239-R243 HydrophobicContact CZ2-CG 4.43Å; W239-R243 HydrophobicContact CZ3-CB 3.77Å; W239-R243 HydrophobicContact CZ3-CG 3.82Å; W239-R243 WeakPolarHBondContact O-CB 3.44Å; W239-R243 PolarHBondContact O-N 2.9Å; F240-R243 PolarHBondContact O-N 3.16Å; R243-T245 VanDerWaalsContact C-N 3.3Å; R243-T245 PolarHBondContact O-N 3.01Å; R243-K246 PolarHBondContact O-N 3.08Å; R243-Y247 WeakPolarHBondContact O-CB 3.33Å; R243-Y247 PolarHBondContact O-N 3.08Å |
| 244 | R | 97.7 | Very high | 93.9 | Very high | 44 Ų | 44 | 89.1 Ų | 89.1 | 17% | 0.166 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -59.2 | -40.2 | 173.7 | -74.8 | -167.9 | -65.3 | -97.6 | 4.4 | 112.7 | F211 H215 Y216 F240 Y247 K248 | F211-R244 HydrophobicContact CE2-CG 3.78Å; F211-R244 HydrophobicContact CZ-CG 4.16Å; H215-R244 WeakPolarHBondContact O-CD 3.49Å; H215-R244 PolarHBondContact O-NH1 3.47Å; Y216-R244 VanDerWaalsContact CD1-CZ 3.46Å; Y216-R244 VanDerWaalsContact CE1-CZ 3.46Å; Y216-R244 VanDerWaalsContact CE1-NE 3.32Å; F240-R244 WeakPolarHBondContact O-CG 3.36Å; F240-R244 PolarHBondContact O-N 3.24Å; R244-Y247 PolarHBondContact O-N 2.75Å; R244-K248 WeakPolarHBondContact O-CB 3.44Å; R244-K248 PolarHBondContact O-N 3.03Å |
| 245 | T | 97.3 | Very high | 92.5 | Very high | 62 Ų | 62 | 91.9 Ų | 91.9 | 38% | 0.38 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63.7 | -44.9 | 177.7 | -55 | 0 | 0 | 0 | 0 | 111 | Q241 N242 R243 K248 R249 | Q241-T245 PolarHBondContact O-N 2.97Å; Q241-T245 VanDerWaalsContact O-N 3.15Å; Q241-T245 PolarHBondContact O-OG1 3.39Å; N242-T245 WeakPolarHBondContact O-CB 3.38Å; N242-T245 PolarHBondContact O-N 2.91Å; R243-T245 VanDerWaalsContact C-N 3.3Å; R243-T245 PolarHBondContact O-N 3.01Å; T245-K248 PolarHBondContact O-N 2.9Å; T245-R249 WeakPolarHBondContact O-CG 3.46Å; T245-R249 PolarHBondContact O-N 2.75Å; T245-R249 VanDerWaalsContact O-N 3.1Å |
| 246 | K | 95.8 | Very high | 90.8 | Very high | 119 Ų | 119 | 90.1 Ų | 90.1 | 52% | 0.517 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.8 | -46.3 | 175 | -173 | -179.2 | 177 | -173.3 | 0 | 111.3 | N242 R243 K248 R249 Q250 | N242-K246 PolarHBondContact O-N 3.13Å; R243-K246 PolarHBondContact O-N 3.08Å; K246-K248 PolarHBondContact O-N 2.91Å; K246-R249 WeakPolarHBondContact O-CB 3.4Å; K246-R249 PolarHBondContact O-N 3.01Å; K246-R249 VanDerWaalsContact O-N 3.15Å; K246-Q250 WeakPolarHBondContact O-CG 3.46Å; K246-Q250 PolarHBondContact O-N 2.74Å |
| 247 | Y | 95.9 | Very high | 89 | Confident | 103 Ų | 103 | 95.8 Ų | 95.8 | 40% | 0.404 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -58.6 | -46.4 | 178.5 | 179.8 | -98.9 | 0 | 0 | 0 | 112.1 | F211 H215 R243 R244 R249 Q250 K251 | F211-Y247 HydrophobicContact CE1-CD2 4.35Å; F211-Y247 HydrophobicContact CE1-CG 4.39Å; F211-Y247 HydrophobicContact CZ-CG 4.46Å; H215-Y247 AromaticContact CE1-CE1 3.91Å; H215-Y247 AromaticContact CE1-CZ 3.85Å; R243-Y247 WeakPolarHBondContact O-CB 3.33Å; R243-Y247 PolarHBondContact O-N 3.08Å; R244-Y247 PolarHBondContact O-N 2.75Å; Y247-R249 VanDerWaalsContact C-N 3.31Å; Y247-R249 PolarHBondContact O-N 3.48Å; Y247-Q250 PolarHBondContact O-N 2.9Å; Y247-K251 PolarHBondContact O-N 2.88Å |
| 248 | K | 95.4 | Very high | 87 | Confident | 137 Ų | 137 | 99.5 Ų | 99.5 | 60% | 0.596 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -60.2 | -40.4 | 175.6 | -173.3 | 176.4 | 67.4 | 175.1 | 0 | 112.3 | R244 T245 K246 L252 | R244-K248 WeakPolarHBondContact O-CB 3.44Å; R244-K248 PolarHBondContact O-N 3.03Å; T245-K248 PolarHBondContact O-N 2.9Å; K246-K248 PolarHBondContact O-N 2.91Å; K248-L252 HydrophobicContact CG-CD1 4.42Å; K248-L252 WeakPolarHBondContact O-CG 2.96Å; K248-L252 PolarHBondContact O-N 3.2Å |
| 249 | R | 92.9 | Very high | 84.7 | Confident | 184 Ų | 184 | 100.9 Ų | 100.9 | 69% | 0.694 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -65.4 | -40.2 | 176.6 | -73.4 | 178.5 | 65.6 | 165.8 | 1.4 | 112.1 | T245 K246 Y247 L252 E253 | T245-R249 WeakPolarHBondContact O-CG 3.46Å; T245-R249 PolarHBondContact O-N 2.75Å; T245-R249 VanDerWaalsContact O-N 3.1Å; K246-R249 WeakPolarHBondContact O-CB 3.4Å; K246-R249 PolarHBondContact O-N 3.01Å; K246-R249 VanDerWaalsContact O-N 3.15Å; Y247-R249 VanDerWaalsContact C-N 3.31Å; Y247-R249 PolarHBondContact O-N 3.48Å; R249-L252 PolarHBondContact O-N 3.44Å; R249-E253 PolarHBondContact O-N 2.86Å |
| 250 | Q | 90.6 | Very high | 82.6 | Confident | 83 Ų | 83 | 107.2 Ų | 107.2 | 39% | 0.388 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.9 | -45.4 | 177.4 | -71.7 | 175.6 | -45.8 | 0 | 0 | 111.2 | K246 Y247 L252 E253 E254 | K246-Q250 WeakPolarHBondContact O-CG 3.46Å; K246-Q250 PolarHBondContact O-N 2.74Å; Y247-Q250 PolarHBondContact O-N 2.9Å; Q250-L252 VanDerWaalsContact C-N 3.3Å; Q250-L252 PolarHBondContact O-N 3.17Å; Q250-E253 PolarHBondContact O-N 3.48Å; Q250-E253 VanDerWaalsContact O-N 3.08Å; Q250-E254 PolarHBondContact O-N 3.15Å; Q250-E254 VanDerWaalsContact O-N 3.16Å |
| 251 | K | 87.8 | Confident | 80.4 | Confident | 117 Ų | 117 | 112.7 Ų | 112.7 | 51% | 0.509 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61 | -36.7 | 177.2 | -169.4 | 178.1 | -179.5 | -179.3 | 0 | 113.2 | Y247 E253 E255 | Y247-K251 PolarHBondContact O-N 2.88Å; K251-E253 VanDerWaalsContact C-N 3.3Å; K251-E253 PolarHBondContact O-N 3.4Å; K251-E255 VanDerWaalsContact O-CG 3.27Å; K251-E255 WeakPolarHBondContact O-CG 3.33Å; K251-E255 PolarHBondContact O-N 3.12Å |
| 252 | L | 84.7 | Confident | 78.3 | Confident | 124 Ų | 124 | 117.5 Ų | 117.5 | 65% | 0.649 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -72.7 | -22 | 177.2 | -70.7 | 170.5 | 0 | 0 | 0 | 113.5 | K248 R249 Q250 | K248-L252 HydrophobicContact CG-CD1 4.42Å; K248-L252 WeakPolarHBondContact O-CG 2.96Å; K248-L252 PolarHBondContact O-N 3.2Å; R249-L252 PolarHBondContact O-N 3.44Å; Q250-L252 VanDerWaalsContact C-N 3.3Å; Q250-L252 PolarHBondContact O-N 3.17Å |
| 253 | E | 81.2 | Confident | 76.2 | Confident | 113 Ų | 113 | 120.6 Ų | 120.6 | 53% | 0.528 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -82.4 | -32 | 177.2 | -173.4 | 169.7 | -163 | 0 | 0 | 111.6 | R249 Q250 K251 | R249-E253 PolarHBondContact O-N 2.86Å; Q250-E253 PolarHBondContact O-N 3.48Å; Q250-E253 VanDerWaalsContact O-N 3.08Å; K251-E253 VanDerWaalsContact C-N 3.3Å; K251-E253 PolarHBondContact O-N 3.4Å |
| 254 | E | 75.3 | Confident | 74.2 | Confident | 160 Ų | 160 | 126 Ų | 126 | 75% | 0.748 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -74.5 | -31.4 | 177.6 | -171.1 | 174.3 | -168.5 | 0 | 0 | 113.1 | Q250 | Q250-E254 PolarHBondContact O-N 3.15Å; Q250-E254 VanDerWaalsContact O-N 3.16Å |
| 255 | E | 68.8 | Low | 72.2 | Confident | 153 Ų | 153 | 125.9 Ų | 125.9 | 72% | 0.715 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.9 | 3.8 | -178.6 | -59.6 | -84.5 | 161 | 0 | 0 | 113.3 | K251 | K251-E255 VanDerWaalsContact O-CG 3.27Å; K251-E255 WeakPolarHBondContact O-CG 3.33Å; K251-E255 PolarHBondContact O-N 3.12Å |
| 256 | G | 60.7 | Low | 70.4 | Confident | 20 Ų | 20 | 125.8 Ų | 125.8 | 21% | 0.206 | 61% | 0.611 | C | S | . | * | S | Bend | trans | -101.5 | 150 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | E258 | G256-E258 PolarHBondContact O-N 3.4Š|
| 257 | P | 60.2 | Low | 68.5 | Low | 120 Ų | 120 | 126 Ų | 126 | 78% | 0.779 | 61% | 0.613 | S | S | * | * | trans | -56.9 | 116.5 | 177.1 | 24.1 | -32.5 | 0 | 0 | 0 | 110.2 | S259 | P257-S259 PolarHBondContact O-N 3.47Š| ||
| 258 | E | 55.8 | Low | 67 | Low | 197 Ų | 197 | 127.2 Ų | 127.2 | 92% | 0.921 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | 8.5 | -156.4 | -154.9 | -168.1 | 140 | 0 | 0 | 116.9 | G256 | G256-E258 PolarHBondContact O-N 3.4Š|
| 259 | S | 49.7 | Very low | 65.6 | Low | 105 Ų | 105 | 125.1 Ų | 125.1 | 73% | 0.734 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.2 | -10.7 | -159.9 | 54.2 | 0 | 0 | 0 | 0 | 118.3 | P257 | P257-S259 PolarHBondContact O-N 3.47Š|
| 260 | E | 53 | Low | 64.5 | Low | 158 Ų | 158 | 119.5 Ų | 119.5 | 74% | 0.738 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -127.5 | -12.5 | -169.2 | -71.4 | -161.5 | 110.9 | 0 | 0 | 118.3 | ||
| 261 | Q | 53 | Low | 63.4 | Low | 116 Ų | 116 | 123.7 Ų | 123.7 | 54% | 0.542 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -83.6 | -26.6 | -166.2 | -85.3 | 167.7 | -108.5 | 0 | 0 | 116.1 | K263 K264 | Q261-K263 PolarHBondContact O-N 3.22Å; Q261-K264 PolarHBondContact O-N 2.9Å; Q261-K264 VanDerWaalsContact O-N 3.12Å |
| 262 | K | 52.7 | Low | 62.6 | Low | 195 Ų | 195 | 126 Ų | 126 | 85% | 0.848 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -62.9 | -26 | 177.2 | -156.3 | 172.7 | -176.2 | 177.5 | 0 | 112.3 | ||
| 263 | K | 53.7 | Low | 62 | Low | 168 Ų | 168 | 126.7 Ų | 126.7 | 73% | 0.73 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -75 | -35.6 | 175.5 | -68.7 | -175.9 | 179.1 | 174.5 | 0 | 112.7 | Q261 S266 H267 | Q261-K263 PolarHBondContact O-N 3.22Å; K263-S266 PolarHBondContact O-N 2.82Å; K263-H267 WeakPolarHBondContact O-CB 3.38Å; K263-H267 PolarHBondContact O-N 3.33Å |
| 264 | K | 55.9 | Low | 61.4 | Low | 168 Ų | 168 | 127.9 Ų | 127.9 | 73% | 0.73 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -74.9 | -38.2 | -171.6 | -156.2 | 166.2 | -174 | 171.1 | 0 | 113.7 | Q261 H267 H268 | Q261-K264 PolarHBondContact O-N 2.9Å; Q261-K264 VanDerWaalsContact O-N 3.12Å; K264-H267 PolarHBondContact O-N 2.95Å; K264-H268 PolarHBondContact O-N 3.37Å; K264-H268 VanDerWaalsContact O-N 3.17Å |
| 265 | G | 55.4 | Low | 61 | Low | 42 Ų | 42 | 124.4 Ų | 124.4 | 43% | 0.433 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -66.1 | -43.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112 | H267 H268 I269 | G265-H267 VanDerWaalsContact C-N 3.35Å; G265-H267 PolarHBondContact O-N 3.02Å; G265-H268 PolarHBondContact O-N 3.2Å; G265-I269 WeakPolarHBondContact O-CD1 3.19Å; G265-I269 PolarHBondContact O-N 3.33Å; G265-I269 VanDerWaalsContact O-N 3.15Å |
| 266 | S | 59.7 | Low | 61.1 | Low | 60 Ų | 60 | 120 Ų | 120 | 42% | 0.42 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -60.2 | -42.4 | 173.5 | -173.5 | 0 | 0 | 0 | 0 | 112 | K263 H268 I269 N270 | K263-S266 PolarHBondContact O-N 2.82Å; S266-H268 PolarHBondContact O-N 3.13Å; S266-I269 PolarHBondContact O-N 3.36Å; S266-N270 VanDerWaalsContact O-CB 3.31Å; S266-N270 WeakPolarHBondContact O-CB 3.48Å; S266-N270 VanDerWaalsContact O-CG 3.27Å; S266-N270 PolarHBondContact O-N 2.68Å |
| 267 | H | 57.2 | Low | 61.1 | Low | 122 Ų | 122 | 127.2 Ų | 127.2 | 57% | 0.565 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -66.4 | -35.7 | -179.7 | -138.5 | -58.7 | 0 | 0 | 0 | 113.4 | K263 K264 G265 R271 | K263-H267 WeakPolarHBondContact O-CB 3.38Å; K263-H267 PolarHBondContact O-N 3.33Å; K264-H267 PolarHBondContact O-N 2.95Å; G265-H267 VanDerWaalsContact C-N 3.35Å; G265-H267 PolarHBondContact O-N 3.02Å; H267-R271 WeakPolarHBondContact O-CB 3.4Å; H267-R271 PolarHBondContact O-N 2.83Å |
| 268 | H | 63.1 | Low | 60.7 | Low | 130 Ų | 130 | 129.4 Ų | 129.4 | 60% | 0.602 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -69.4 | -44.7 | 175 | 173 | 68.3 | 0 | 0 | 0 | 111.8 | K264 G265 S266 R271 W272 | K264-H268 PolarHBondContact O-N 3.37Å; K264-H268 VanDerWaalsContact O-N 3.17Å; G265-H268 PolarHBondContact O-N 3.2Å; S266-H268 PolarHBondContact O-N 3.13Å; H268-R271 PolarHBondContact O-N 3.36Å; H268-W272 WeakPolarHBondContact O-CB 3.39Å; H268-W272 PolarHBondContact O-N 3.43Å |
| 269 | I | 65.7 | Low | 60.1 | Low | 92 Ų | 92 | 124 Ų | 124 | 47% | 0.472 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -63.7 | -41.8 | 176.1 | -85.2 | 136.7 | 0 | 0 | 0 | 111.4 | G265 S266 W272 R273 | G265-I269 WeakPolarHBondContact O-CD1 3.19Å; G265-I269 PolarHBondContact O-N 3.33Å; G265-I269 VanDerWaalsContact O-N 3.15Å; S266-I269 PolarHBondContact O-N 3.36Å; I269-W272 PolarHBondContact O-N 2.9Å; I269-R273 WeakPolarHBondContact O-CB 3.31Å; I269-R273 PolarHBondContact O-N 2.91Å |
| 270 | N | 69.6 | Low | 59.9 | Low | 66 Ų | 66 | 126.9 Ų | 126.9 | 35% | 0.353 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -65.9 | -43.1 | 174.7 | -73.3 | -0.8 | 0 | 0 | 0 | 111.5 | S266 W272 R273 I274 | S266-N270 VanDerWaalsContact O-CB 3.31Å; S266-N270 WeakPolarHBondContact O-CB 3.48Å; S266-N270 VanDerWaalsContact O-CG 3.27Å; S266-N270 PolarHBondContact O-N 2.68Å; N270-W272 VanDerWaalsContact C-N 3.34Å; N270-W272 PolarHBondContact O-N 3.2Å; N270-R273 PolarHBondContact O-N 3.44Å; N270-R273 PolarHBondContact OD1-NH1 3.45Å; N270-I274 WeakPolarHBondContact O-CG1 3.14Å; N270-I274 PolarHBondContact O-N 2.92Å |
| 271 | R | 69 | Low | 59.9 | Low | 172 Ų | 172 | 122.5 Ų | 122.5 | 65% | 0.649 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -60.2 | -42.9 | 175.5 | -176 | -174.7 | -64.8 | -92.7 | 1.2 | 111.8 | H267 H268 A275 | H267-R271 WeakPolarHBondContact O-CB 3.4Å; H267-R271 PolarHBondContact O-N 2.83Å; H268-R271 PolarHBondContact O-N 3.36Å; R271-A275 VanDerWaalsContact O-CB 3.29Å; R271-A275 WeakPolarHBondContact O-CB 3.4Å; R271-A275 PolarHBondContact O-N 3.34Å |
| 272 | W | 71.1 | Confident | 59.7 | Low | 164 Ų | 164 | 126.2 Ų | 126.2 | 62% | 0.621 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -65.4 | -41 | 175.6 | -171.9 | 79.4 | 0 | 0 | 0 | 111.7 | H268 I269 N270 A275 T276 | H268-W272 WeakPolarHBondContact O-CB 3.39Å; H268-W272 PolarHBondContact O-N 3.43Å; I269-W272 PolarHBondContact O-N 2.9Å; N270-W272 VanDerWaalsContact C-N 3.34Å; N270-W272 PolarHBondContact O-N 3.2Å; W272-A275 PolarHBondContact O-N 2.98Å; W272-T276 HydrophobicContact CD2-CG2 4.4Å; W272-T276 HydrophobicContact CE3-CG2 4.1Å; W272-T276 HydrophobicContact CH2-CG2 4.31Å; W272-T276 HydrophobicContact CZ3-CG2 4.06Å; W272-T276 WeakPolarHBondContact O-CB 3.29Å; W272-T276 WeakPolarHBondContact O-CG2 3.21Å; W272-T276 PolarHBondContact O-N 3.21Å |
| 273 | R | 71.5 | Confident | 59.6 | Low | 140 Ų | 140 | 123.5 Ų | 123.5 | 53% | 0.528 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -61.9 | -43.1 | 176.5 | -165.7 | -175.5 | -59.3 | 108.5 | 1.4 | 112.6 | I269 N270 K277 | I269-R273 WeakPolarHBondContact O-CB 3.31Å; I269-R273 PolarHBondContact O-N 2.91Å; N270-R273 PolarHBondContact O-N 3.44Å; N270-R273 PolarHBondContact OD1-NH1 3.45Å; R273-K277 PolarHBondContact O-N 2.89Å |
| 274 | I | 68.3 | Low | 59.4 | Low | 137 Ų | 137 | 123.4 Ų | 123.4 | 70% | 0.703 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -66.5 | -44.6 | 176.9 | -59.2 | -91.7 | 0 | 0 | 0 | 109.9 | N270 T276 K277 | N270-I274 WeakPolarHBondContact O-CG1 3.14Å; N270-I274 PolarHBondContact O-N 2.92Å; I274-T276 VanDerWaalsContact C-N 3.33Å; I274-T276 PolarHBondContact O-N 3.33Å; I274-K277 PolarHBondContact O-N 3.43Å |
| 275 | A | 66.3 | Low | 59 | Low | 87 Ų | 87 | 121 Ų | 121 | 72% | 0.719 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -67.8 | -29.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | R271 W272 | R271-A275 VanDerWaalsContact O-CB 3.29Å; R271-A275 WeakPolarHBondContact O-CB 3.4Å; R271-A275 PolarHBondContact O-N 3.34Å; W272-A275 PolarHBondContact O-N 2.98Å |
| 276 | T | 70.6 | Confident | 58.7 | Low | 60 Ų | 60 | 125 Ų | 125 | 37% | 0.368 | 65% | 0.65 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -94.6 | 3.9 | 178.5 | -163.1 | 0 | 0 | 0 | 0 | 113.9 | W272 I274 Q278 | W272-T276 HydrophobicContact CD2-CG2 4.4Å; W272-T276 HydrophobicContact CE3-CG2 4.1Å; W272-T276 HydrophobicContact CH2-CG2 4.31Å; W272-T276 HydrophobicContact CZ3-CG2 4.06Å; W272-T276 WeakPolarHBondContact O-CB 3.29Å; W272-T276 WeakPolarHBondContact O-CG2 3.21Å; W272-T276 PolarHBondContact O-N 3.21Å; I274-T276 VanDerWaalsContact C-N 3.33Å; I274-T276 PolarHBondContact O-N 3.33Å; T276-Q278 VanDerWaalsContact C-N 3.33Å; T276-Q278 PolarHBondContact O-N 2.89Å |
| 277 | K | 60.9 | Low | 58.1 | Low | 172 Ų | 172 | 128 Ų | 128 | 75% | 0.748 | 67% | 0.666 | S | S | * | * | trans | 5.4 | 76.5 | -177.8 | -155.9 | -176 | -176 | -157.8 | 0 | 113.1 | R273 I274 A279 | R273-K277 PolarHBondContact O-N 2.89Å; I274-K277 PolarHBondContact O-N 3.43Å; K277-A279 PolarHBondContact O-N 3.37Å | ||
| 278 | Q | 51.9 | Low | 58 | Low | 166 Ų | 166 | 127.1 Ų | 127.1 | 78% | 0.776 | 67% | 0.674 | S | S | * | * | trans | -73.5 | 87.3 | 158.4 | -72.8 | -168.5 | 68.8 | 0 | 0 | 105.3 | T276 N280 | T276-Q278 VanDerWaalsContact C-N 3.33Å; T276-Q278 PolarHBondContact O-N 2.89Å; Q278-N280 PolarHBondContact O-N 2.99Å | ||
| 279 | A | 44.6 | Very low | 57.5 | Low | 83 Ų | 83 | 127.6 Ų | 127.6 | 69% | 0.686 | 68% | 0.681 | S | S | * | * | trans | -66.9 | 117.7 | 165.1 | 0 | 0 | 0 | 0 | 0 | 106.6 | K277 | K277-A279 PolarHBondContact O-N 3.37Š| ||
| 280 | N | 45.7 | Very low | 56.6 | Low | 166 Ų | 166 | 134 Ų | 134 | 89% | 0.888 | 72% | 0.716 | S | S | * | * | trans | -132.2 | 129.1 | 166.9 | -136.9 | 11.3 | 0 | 0 | 0 | 107 | Q278 | Q278-N280 PolarHBondContact O-N 2.99Š| ||
| 281 | G | 51.7 | Low | 56 | Low | 66 Ų | 66 | 137.4 Ų | 137.4 | 68% | 0.68 | 74% | 0.735 | S | S | * | * | S | Bend | trans | 98.6 | 126.5 | 166.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 282 | E | 49.9 | Very low | 55.3 | Low | 195 Ų | 195 | 135.6 Ų | 135.6 | 91% | 0.911 | 74% | 0.739 | S | S | * | * | trans | 85.3 | 83.2 | 160.5 | -49.9 | -177 | 156.2 | 0 | 0 | 115.4 | ||||
| 283 | D | 49.1 | Very low | 54.4 | Low | 137 Ų | 137 | 134 Ų | 134 | 73% | 0.733 | 75% | 0.746 | S | S | * | * | 170.3 | 101.1 | 99.5 | -147.5 | -102.3 | 0 | 0 | 0 | 108.5 | |||||
| 284 | I | 50.4 | Low | 53.4 | Low | 166 Ų | 166 | 133.6 Ų | 133.6 | 85% | 0.851 | 76% | 0.759 | S | S | * | * | trans | -107.3 | 84.2 | 164.6 | 2.2 | 162.2 | 0 | 0 | 0 | 104.3 | V286 | I284-V286 VanDerWaalsContact C-N 3.28Å; I284-V286 PolarHBondContact O-N 3.04Å | ||
| 285 | D | 46.8 | Very low | 52.5 | Low | 119 Ų | 119 | 133.4 Ų | 133.4 | 64% | 0.636 | 76% | 0.762 | S | S | * | * | trans | -66.6 | 94.6 | 168.4 | -152.4 | -76.2 | 0 | 0 | 0 | 107.2 | T287 | D285-T287 PolarHBondContact O-N 2.94Š| ||
| 286 | V | 49.5 | Very low | 51.6 | Low | 124 Ų | 124 | 136.5 Ų | 136.5 | 75% | 0.752 | 77% | 0.765 | S | S | * | * | trans | -74.3 | 88.7 | 167.1 | 179.3 | 0 | 0 | 0 | 0 | 105.4 | I284 S288 | I284-V286 VanDerWaalsContact C-N 3.28Å; I284-V286 PolarHBondContact O-N 3.04Å; V286-S288 PolarHBondContact O-N 2.96Å | ||
| 287 | T | 47.1 | Very low | 50.2 | Low | 123 Ų | 123 | 142 Ų | 142 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | trans | -63 | 106.5 | 172.8 | -37.9 | 0 | 0 | 0 | 0 | 107.9 | D285 N289 | D285-T287 PolarHBondContact O-N 2.94Å; T287-N289 PolarHBondContact O-N 3.5Å | ||
| 288 | S | 55 | Low | 49.4 | Very low | 104 Ų | 104 | 139.7 Ų | 139.7 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | -69.4 | 121.7 | 174 | -178.5 | 0 | 0 | 0 | 0 | 109.8 | V286 | V286-S288 PolarHBondContact O-N 2.96Š| ||
| 289 | N | 52.4 | Low | 49.2 | Very low | 141 Ų | 141 | 137.5 Ų | 137.5 | 75% | 0.754 | 80% | 0.798 | S | S | * | * | trans | 24.7 | 109.9 | 138.7 | -165.7 | 97.8 | 0 | 0 | 0 | 118.7 | T287 | T287-N289 PolarHBondContact O-N 3.5Š| ||
| 290 | D | 47.9 | Very low | 49.6 | Very low | 226 Ų | 226 | 142.5 Ų | 142.5 | 100% | 1.209 | 81% | 0.809 | S | S | * | * | -152 | 0 | 124 | -161.9 | -118 | 0 | 0 | 0 | 109.6 |
Retrieved 290 of 290 residues in 551.8 ms
(Link to these results)