| 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 | 44 | Very low | 45.2 | Very low | 258 Ų | 258 | 162.8 Ų | 162.8 | 100% | 1.271 | 85% | 0.851 | S | S | * | * | 0 | 129.5 | 0 | -84.4 | 149.6 | 164.2 | 0 | 0 | 108.5 | |||||
| 2 | K | 48.8 | Very low | 44.4 | Very low | 204 Ų | 204 | 160.1 Ų | 160.1 | 89% | 0.887 | 84% | 0.838 | S | S | * | * | trans | -118.8 | 126.2 | -167.6 | -172.3 | 177.9 | -175.2 | -179.8 | 0 | 106.9 | ||||
| 3 | R | 39.4 | Very low | 44.6 | Very low | 245 Ų | 245 | 156.4 Ų | 156.4 | 93% | 0.925 | 83% | 0.834 | S | S | * | * | trans | -154.8 | 103.5 | 159.7 | -72.6 | -167.7 | -161.9 | 106.3 | 3 | 106.2 | ||||
| 4 | A | 42.8 | Very low | 44.7 | Very low | 96 Ų | 96 | 157.6 Ų | 157.6 | 79% | 0.793 | 83% | 0.832 | S | S | * | * | 70.7 | 106.1 | 71.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 5 | H | 46.9 | Very low | 44.7 | Very low | 174 Ų | 174 | 159.1 Ų | 159.1 | 81% | 0.806 | 84% | 0.839 | S | S | * | * | trans | -65.3 | 156.1 | 153.8 | -112.2 | -88 | 0 | 0 | 0 | 109.4 | ||||
| 6 | P | 60.2 | Low | 44.7 | Very low | 115 Ų | 115 | 157.1 Ų | 157.1 | 75% | 0.747 | 83% | 0.829 | S | S | * | * | -150.8 | 176 | 95 | 35 | -13.6 | 0 | 0 | 0 | 116 | |||||
| 7 | D | 51 | Low | 44.4 | Very low | 138 Ų | 138 | 158.2 Ų | 158.2 | 74% | 0.738 | 83% | 0.829 | S | S | * | * | trans | -60.6 | 159.8 | -169.8 | -51.2 | -76.6 | 0 | 0 | 0 | 117.8 | ||||
| 8 | Y | 43 | Very low | 44.2 | Very low | 237 Ų | 237 | 154.9 Ų | 154.9 | 93% | 0.929 | 82% | 0.817 | S | S | * | * | trans | -149.2 | 129.9 | 142.1 | -124.6 | -90.1 | 0 | 0 | 0 | 112.1 | ||||
| 9 | S | 41.9 | Very low | 44.2 | Very low | 107 Ų | 107 | 154.4 Ų | 154.4 | 75% | 0.748 | 81% | 0.813 | S | S | * | * | trans | -88.1 | 148.5 | 174.7 | 168.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 10 | S | 38.4 | Very low | 44 | Very low | 104 Ų | 104 | 155 Ų | 155 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | trans | 170.2 | 128.8 | 136.2 | -172.6 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 11 | S | 40.6 | Very low | 44 | Very low | 113 Ų | 113 | 153.3 Ų | 153.3 | 79% | 0.79 | 81% | 0.807 | S | S | * | * | trans | 43.7 | 155.8 | 137.2 | -73.5 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 12 | D | 36.3 | Very low | 43.8 | Very low | 130 Ų | 130 | 150 Ų | 150 | 70% | 0.695 | 79% | 0.789 | S | S | * | * | cis | 172.6 | 141.6 | 0.3 | 171.6 | -108.7 | 0 | 0 | 0 | 102.8 | ||||
| 13 | S | 46.7 | Very low | 43.8 | Very low | 112 Ų | 112 | 149.9 Ų | 149.9 | 78% | 0.783 | 79% | 0.788 | S | S | * | * | trans | 164.5 | 97.3 | 150.8 | -74.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 14 | E | 45.3 | Very low | 43.8 | Very low | 173 Ų | 173 | 146.3 Ų | 146.3 | 81% | 0.808 | 78% | 0.782 | S | S | * | * | trans | -54 | 145.5 | 152.2 | -58.1 | 179.9 | 97.4 | 0 | 0 | 110.3 | ||||
| 15 | L | 45.5 | Very low | 43.7 | Very low | 180 Ų | 180 | 146.6 Ų | 146.6 | 94% | 0.942 | 78% | 0.778 | S | S | * | * | trans | -152.8 | 112.3 | 136.6 | -71.2 | -173.3 | 0 | 0 | 0 | 109.4 | ||||
| 16 | D | 43.9 | Very low | 43.5 | Very low | 127 Ų | 127 | 142.8 Ų | 142.8 | 68% | 0.679 | 78% | 0.777 | S | S | * | * | trans | -59.6 | 140.8 | 164.5 | -170.3 | 94.8 | 0 | 0 | 0 | 111.4 | T18 | D16-T18 PolarHBondContact OD1-OG1 3.37Å; D16-T18 VanDerWaalsContact OD2-CB 3.28Å; D16-T18 WeakPolarHBondContact OD2-CB 3.39Å; D16-T18 PolarHBondContact OD2-N 3.18Å; D16-T18 PolarHBondContact OD2-OG1 3.48Å | ||
| 17 | E | 40.4 | Very low | 42.9 | Very low | 176 Ų | 176 | 144.9 Ų | 144.9 | 82% | 0.822 | 78% | 0.782 | S | S | * | * | trans | -136.8 | 76.1 | 157 | -152.7 | 166.4 | 124.6 | 0 | 0 | 109.2 | I19 | E17-I19 HydrophobicContact CG-CG1 4.39Å; E17-I19 PolarHBondContact O-N 3.16Å | ||
| 18 | T | 41.1 | Very low | 42.8 | Very low | 100 Ų | 100 | 146.1 Ų | 146.1 | 61% | 0.613 | 78% | 0.783 | S | S | * | * | trans | -70.9 | 107.6 | 161.6 | -54 | 0 | 0 | 0 | 0 | 108.5 | D16 E20 | D16-T18 PolarHBondContact OD1-OG1 3.37Å; D16-T18 VanDerWaalsContact OD2-CB 3.28Å; D16-T18 WeakPolarHBondContact OD2-CB 3.39Å; D16-T18 PolarHBondContact OD2-N 3.18Å; D16-T18 PolarHBondContact OD2-OG1 3.48Å; T18-E20 PolarHBondContact O-N 2.59Å | ||
| 19 | I | 43.4 | Very low | 42.7 | Very low | 145 Ų | 145 | 142 Ų | 142 | 74% | 0.744 | 78% | 0.777 | S | S | * | * | trans | -85.5 | 105.9 | 174.7 | -62.2 | 172.2 | 0 | 0 | 0 | 108.7 | E17 | E17-I19 HydrophobicContact CG-CG1 4.39Å; E17-I19 PolarHBondContact O-N 3.16Å | ||
| 20 | E | 40.7 | Very low | 42.4 | Very low | 165 Ų | 165 | 140.2 Ų | 140.2 | 77% | 0.771 | 78% | 0.775 | S | S | * | * | trans | -70 | 132.3 | 171.9 | -80.8 | -176.3 | 140.1 | 0 | 0 | 112.6 | T18 | T18-E20 PolarHBondContact O-N 2.59Š| ||
| 21 | V | 43.4 | Very low | 42.5 | Very low | 121 Ų | 121 | 142 Ų | 142 | 73% | 0.733 | 78% | 0.777 | S | S | * | * | 38.4 | 121.6 | 126.7 | -170.9 | 0 | 0 | 0 | 0 | 119 | |||||
| 22 | E | 39.2 | Very low | 42.4 | Very low | 189 Ų | 189 | 143.5 Ų | 143.5 | 88% | 0.883 | 78% | 0.775 | S | S | * | * | trans | -142.8 | 107.1 | 136.1 | -113.3 | 170.5 | -175.7 | 0 | 0 | 110.8 | ||||
| 23 | K | 49.2 | Very low | 42.8 | Very low | 200 Ų | 200 | 142.8 Ų | 142.8 | 87% | 0.87 | 78% | 0.78 | S | S | * | * | trans | -104.9 | 101.2 | 168.1 | 178.5 | -175.9 | 179.3 | -177.3 | 0 | 105.2 | ||||
| 24 | E | 39.6 | Very low | 42.6 | Very low | 171 Ų | 171 | 142.9 Ų | 142.9 | 80% | 0.799 | 78% | 0.781 | S | S | * | * | trans | -110.2 | 129.8 | 175.5 | -169.5 | 177.8 | 169.9 | 0 | 0 | 110.7 | ||||
| 25 | S | 39.9 | Very low | 42.3 | Very low | 102 Ų | 102 | 138.8 Ų | 138.8 | 71% | 0.713 | 78% | 0.777 | S | S | * | * | trans | -57.5 | 138.4 | -179.4 | 38.9 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 26 | A | 42.8 | Very low | 42.6 | Very low | 94 Ų | 94 | 139 Ų | 139 | 78% | 0.777 | 78% | 0.778 | S | S | * | * | trans | -90.9 | 118.2 | 164 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 27 | D | 48.6 | Very low | 42.3 | Very low | 159 Ų | 159 | 135.8 Ų | 135.8 | 85% | 0.85 | 78% | 0.775 | S | S | * | * | trans | -149.3 | 141.1 | 154.7 | -89.4 | -38.4 | 0 | 0 | 0 | 111.1 | ||||
| 28 | E | 48.7 | Very low | 42.8 | Very low | 163 Ų | 163 | 132.6 Ų | 132.6 | 76% | 0.762 | 77% | 0.772 | S | S | * | * | trans | 73.6 | 99.2 | 158.7 | -69.7 | -120.4 | 86.7 | 0 | 0 | 122.5 | ||||
| 29 | N | 41.7 | Very low | 43.2 | Very low | 151 Ų | 151 | 135.6 Ų | 135.6 | 81% | 0.807 | 78% | 0.781 | S | S | * | * | 59.5 | 118.7 | 103.2 | -147.5 | 27.5 | 0 | 0 | 0 | 119.6 | |||||
| 30 | G | 35.7 | Very low | 43.5 | Very low | 69 Ų | 69 | 133.6 Ų | 133.6 | 71% | 0.711 | 78% | 0.78 | S | S | * | * | trans | 163 | 64.3 | 166.8 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 31 | N | 39.4 | Very low | 44.2 | Very low | 143 Ų | 143 | 130.6 Ų | 130.6 | 77% | 0.765 | 78% | 0.775 | S | S | * | * | trans | 46 | 141.3 | 130.3 | -150.5 | 19.7 | 0 | 0 | 0 | 123.1 | ||||
| 32 | L | 39.9 | Very low | 44.8 | Very low | 144 Ų | 144 | 129 Ų | 129 | 75% | 0.754 | 77% | 0.766 | S | S | * | * | trans | 94.9 | 102.4 | 152.6 | -48 | 174.2 | 0 | 0 | 0 | 120 | ||||
| 33 | S | 44.6 | Very low | 45.9 | Very low | 114 Ų | 114 | 125.9 Ų | 125.9 | 80% | 0.797 | 76% | 0.76 | S | S | * | * | trans | -36.3 | 137.2 | 154.4 | -47.5 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 34 | S | 41.5 | Very low | 46.5 | Very low | 115 Ų | 115 | 119.5 Ų | 119.5 | 80% | 0.804 | 74% | 0.74 | S | S | * | * | 154.8 | 143.7 | 107.5 | -64.2 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 35 | A | 40 | Very low | 48.1 | Very low | 87 Ų | 87 | 115 Ų | 115 | 72% | 0.719 | 73% | 0.727 | S | S | * | * | trans | 80.1 | 98.3 | 151.8 | 0 | 0 | 0 | 0 | 0 | 119.6 | G37 | A35-G37 PolarHBondContact O-N 3.22Š| ||
| 36 | L | 50.2 | Low | 49.7 | Very low | 184 Ų | 184 | 115.1 Ų | 115.1 | 96% | 0.963 | 72% | 0.717 | S | S | * | * | 45.4 | 78.7 | 120.4 | -67.1 | 160.8 | 0 | 0 | 0 | 116.4 | |||||
| 37 | G | 38 | Very low | 51.2 | Low | 60 Ų | 60 | 114.8 Ų | 114.8 | 62% | 0.619 | 71% | 0.705 | S | S | * | * | trans | -117.3 | 97.8 | 159.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | A35 M39 | A35-G37 PolarHBondContact O-N 3.22Å; G37-M39 PolarHBondContact O-N 3.39Å; G37-M39 VanDerWaalsContact O-N 3.12Å | ||
| 38 | S | 50.9 | Low | 52.7 | Low | 109 Ų | 109 | 112.3 Ų | 112.3 | 76% | 0.762 | 69% | 0.691 | S | S | * | * | trans | -43.1 | 109 | 168.2 | 165 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 39 | M | 49.6 | Very low | 53.9 | Low | 163 Ų | 163 | 107.4 Ų | 107.4 | 80% | 0.803 | 68% | 0.678 | S | S | * | * | trans | -140 | 100.7 | 159.3 | -44.1 | -69.2 | 153 | 0 | 0 | 106.9 | G37 | G37-M39 PolarHBondContact O-N 3.39Å; G37-M39 VanDerWaalsContact O-N 3.12Å | ||
| 40 | S | 50.6 | Low | 55.6 | Low | 102 Ų | 102 | 107.4 Ų | 107.4 | 71% | 0.713 | 67% | 0.667 | S | S | * | * | trans | -50.2 | 130.3 | 173.7 | -53.1 | 0 | 0 | 0 | 0 | 109.8 | T42 | S40-T42 PolarHBondContact O-N 3.26Š| ||
| 41 | P | 54.6 | Low | 57.8 | Low | 102 Ų | 102 | 111.3 Ų | 111.3 | 66% | 0.662 | 66% | 0.664 | S | S | * | * | trans | -71.7 | 86.7 | 164.4 | 27.8 | -28.1 | 0 | 0 | 0 | 106.9 | T43 | P41-T43 PolarHBondContact O-N 3.01Š| ||
| 42 | T | 55.9 | Low | 59.7 | Low | 89 Ų | 89 | 113.8 Ų | 113.8 | 55% | 0.546 | 66% | 0.663 | S | S | . | * | trans | 17.2 | 103.2 | 151.1 | -39.9 | 0 | 0 | 0 | 0 | 112.8 | S40 S44 S45 | S40-T42 PolarHBondContact O-N 3.26Å; T42-S44 PolarHBondContact O-N 2.92Å; T42-S45 PolarHBondContact O-N 3.16Å | ||
| 43 | T | 62.3 | Low | 61.8 | Low | 123 Ų | 123 | 115.8 Ų | 115.8 | 76% | 0.755 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -42.2 | -33.3 | 170.9 | 52.6 | 0 | 0 | 0 | 0 | 112.5 | P41 Q46 V47 | P41-T43 PolarHBondContact O-N 3.01Å; T43-Q46 PolarHBondContact O-N 2.98Å; T43-V47 WeakPolarHBondContact O-CB 3.15Å; T43-V47 WeakPolarHBondContact O-CG2 3.2Å; T43-V47 PolarHBondContact O-N 3.26Å |
| 44 | S | 62.8 | Low | 63.9 | Low | 65 Ų | 65 | 119.5 Ų | 119.5 | 46% | 0.455 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -57.2 | -43.5 | 172.2 | -168.5 | 0 | 0 | 0 | 0 | 114.8 | T42 V47 L48 | T42-S44 PolarHBondContact O-N 2.92Å; S44-V47 PolarHBondContact O-N 3.38Å; S44-L48 WeakPolarHBondContact O-CG 3.13Å; S44-L48 PolarHBondContact O-N 2.93Å |
| 45 | S | 72 | Confident | 66.4 | Low | 77 Ų | 77 | 115.9 Ų | 115.9 | 54% | 0.538 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -66.1 | -42.3 | -179.5 | -178.7 | 0 | 0 | 0 | 0 | 111.8 | T42 V47 L48 A49 | T42-S45 PolarHBondContact O-N 3.16Å; S45-V47 VanDerWaalsContact C-N 3.34Å; S45-V47 PolarHBondContact O-N 3.28Å; S45-L48 PolarHBondContact O-N 2.91Å; S45-A49 WeakPolarHBondContact O-CB 3.06Å; S45-A49 PolarHBondContact O-N 3.39Å |
| 46 | Q | 74.8 | Confident | 68.8 | Low | 104 Ų | 104 | 115.5 Ų | 115.5 | 49% | 0.486 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -64.9 | -37.1 | 172.1 | -73.6 | -160.4 | 27.9 | 0 | 0 | 112.4 | T43 A49 R50 | T43-Q46 PolarHBondContact O-N 2.98Å; Q46-A49 PolarHBondContact O-N 3.41Å; Q46-R50 WeakPolarHBondContact O-CB 3.5Å; Q46-R50 WeakPolarHBondContact O-CG 3.42Å; Q46-R50 PolarHBondContact O-N 2.98Å; Q46-R50 VanDerWaalsContact OE1-NH2 3.1Å |
| 47 | V | 73 | Confident | 70.9 | Confident | 88 Ų | 88 | 111.8 Ų | 111.8 | 53% | 0.533 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -65.8 | -42.9 | 176.9 | 169.5 | 0 | 0 | 0 | 0 | 111.2 | T43 S44 S45 R50 K51 | T43-V47 WeakPolarHBondContact O-CB 3.15Å; T43-V47 WeakPolarHBondContact O-CG2 3.2Å; T43-V47 PolarHBondContact O-N 3.26Å; S44-V47 PolarHBondContact O-N 3.38Å; S45-V47 VanDerWaalsContact C-N 3.34Å; S45-V47 PolarHBondContact O-N 3.28Å; V47-R50 PolarHBondContact O-N 2.9Å; V47-K51 WeakPolarHBondContact O-CB 3.25Å; V47-K51 PolarHBondContact O-N 3.44Å |
| 48 | L | 79.8 | Confident | 73.7 | Confident | 107 Ų | 107 | 111.1 Ų | 111.1 | 56% | 0.56 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -65.6 | -40.6 | 175.2 | -68.6 | 175.2 | 0 | 0 | 0 | 112.1 | S44 S45 K51 R52 | S44-L48 WeakPolarHBondContact O-CG 3.13Å; S44-L48 PolarHBondContact O-N 2.93Å; S45-L48 PolarHBondContact O-N 2.91Å; L48-K51 PolarHBondContact O-N 2.92Å; L48-R52 WeakPolarHBondContact O-CB 3.23Å; L48-R52 PolarHBondContact O-N 3.3Å |
| 49 | A | 75.4 | Confident | 75.8 | Confident | 59 Ų | 59 | 112.6 Ų | 112.6 | 49% | 0.488 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -62.7 | -42.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | S45 Q46 R52 R53 | S45-A49 WeakPolarHBondContact O-CB 3.06Å; S45-A49 PolarHBondContact O-N 3.39Å; Q46-A49 PolarHBondContact O-N 3.41Å; A49-R52 PolarHBondContact O-N 3.48Å; A49-R53 WeakPolarHBondContact O-CB 3.31Å; A49-R53 PolarHBondContact O-N 2.84Å |
| 50 | R | 76.4 | Confident | 78.1 | Confident | 151 Ų | 151 | 112.9 Ų | 112.9 | 57% | 0.57 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -63.7 | -41.3 | 173.5 | -70.9 | 171.6 | -167.9 | -172 | 4.3 | 111.4 | Q46 V47 R53 R54 | Q46-R50 WeakPolarHBondContact O-CB 3.5Å; Q46-R50 WeakPolarHBondContact O-CG 3.42Å; Q46-R50 PolarHBondContact O-N 2.98Å; Q46-R50 VanDerWaalsContact OE1-NH2 3.1Å; V47-R50 PolarHBondContact O-N 2.9Å; R50-R53 PolarHBondContact O-N 3.33Å; R50-R54 WeakPolarHBondContact O-CB 3.43Å; R50-R54 VanDerWaalsContact O-CG 3.29Å; R50-R54 WeakPolarHBondContact O-CG 3.35Å; R50-R54 PolarHBondContact O-N 2.97Å |
| 51 | K | 81.8 | Confident | 80.4 | Confident | 151 Ų | 151 | 114.3 Ų | 114.3 | 66% | 0.657 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -63.9 | -43.4 | 176 | -173.1 | 175.4 | 179.4 | -179.1 | 0 | 111.9 | V47 L48 R54 G55 | V47-K51 WeakPolarHBondContact O-CB 3.25Å; V47-K51 PolarHBondContact O-N 3.44Å; L48-K51 PolarHBondContact O-N 2.92Å; K51-R54 PolarHBondContact O-N 3.31Å; K51-G55 PolarHBondContact O-N 3.37Å |
| 52 | R | 80.6 | Confident | 82.4 | Confident | 196 Ų | 196 | 116.4 Ų | 116.4 | 74% | 0.74 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -61.6 | -45 | 174.5 | -173.3 | 177.9 | 178.3 | 174.8 | 0.1 | 111.5 | L48 A49 R54 G55 I56 | L48-R52 WeakPolarHBondContact O-CB 3.23Å; L48-R52 PolarHBondContact O-N 3.3Å; A49-R52 PolarHBondContact O-N 3.48Å; R52-R54 PolarHBondContact O-N 2.91Å; R52-G55 PolarHBondContact O-N 2.74Å; R52-I56 HydrophobicContact CG-CD1 4.49Å; R52-I56 WeakPolarHBondContact O-CG1 3.4Å; R52-I56 PolarHBondContact O-N 3.4Å |
| 53 | R | 82.3 | Confident | 84.4 | Confident | 185 Ų | 185 | 115.5 Ų | 115.5 | 70% | 0.698 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -61.7 | -43.1 | 176 | -171 | 179.6 | -73 | -152.9 | -1.1 | 111.8 | A49 R50 G55 I56 I57 | A49-R53 WeakPolarHBondContact O-CB 3.31Å; A49-R53 PolarHBondContact O-N 2.84Å; R50-R53 PolarHBondContact O-N 3.33Å; R53-G55 VanDerWaalsContact C-N 3.32Å; R53-G55 PolarHBondContact O-N 3.46Å; R53-I56 PolarHBondContact O-N 2.94Å; R53-I57 HydrophobicContact CG-CD1 4.35Å; R53-I57 WeakPolarHBondContact O-CG1 3.38Å; R53-I57 PolarHBondContact O-N 3.23Å |
| 54 | R | 89.9 | Confident | 86.1 | Confident | 192 Ų | 192 | 118.1 Ų | 118.1 | 73% | 0.725 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -59.8 | -41.5 | 173.2 | -73.4 | 175.8 | -178 | -153.1 | 0.8 | 111.7 | R50 K51 R52 I56 I57 E58 | R50-R54 WeakPolarHBondContact O-CB 3.43Å; R50-R54 VanDerWaalsContact O-CG 3.29Å; R50-R54 WeakPolarHBondContact O-CG 3.35Å; R50-R54 PolarHBondContact O-N 2.97Å; K51-R54 PolarHBondContact O-N 3.31Å; R52-R54 PolarHBondContact O-N 2.91Å; R54-I56 PolarHBondContact O-N 3.43Å; R54-I57 PolarHBondContact O-N 2.94Å; R54-E58 WeakPolarHBondContact O-CB 3.43Å; R54-E58 PolarHBondContact O-N 3.23Å |
| 55 | G | 92.6 | Very high | 87.8 | Confident | 40 Ų | 40 | 118.9 Ų | 118.9 | 41% | 0.412 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.3 | -40.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | K51 R52 R53 E58 K59 | K51-G55 PolarHBondContact O-N 3.37Å; R52-G55 PolarHBondContact O-N 2.74Å; R53-G55 VanDerWaalsContact C-N 3.32Å; R53-G55 PolarHBondContact O-N 3.46Å; G55-E58 PolarHBondContact O-N 3.15Å; G55-K59 WeakPolarHBondContact O-CB 3.35Å; G55-K59 PolarHBondContact O-N 3.45Å |
| 56 | I | 92 | Very high | 89 | Confident | 78 Ų | 78 | 118 Ų | 118 | 40% | 0.4 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.6 | -43.8 | 177.4 | -64.8 | 164.7 | 0 | 0 | 0 | 111.2 | R52 R53 R54 E58 K59 R60 | R52-I56 HydrophobicContact CG-CD1 4.49Å; R52-I56 WeakPolarHBondContact O-CG1 3.4Å; R52-I56 PolarHBondContact O-N 3.4Å; R53-I56 PolarHBondContact O-N 2.94Å; R54-I56 PolarHBondContact O-N 3.43Å; I56-E58 VanDerWaalsContact C-N 3.34Å; I56-K59 PolarHBondContact O-N 2.87Å; I56-R60 WeakPolarHBondContact O-CG 3.26Å; I56-R60 PolarHBondContact O-N 2.9Å; I56-R60 VanDerWaalsContact O-N 3.07Å |
| 57 | I | 94.2 | Very high | 90.1 | Very high | 106 Ų | 106 | 118.2 Ų | 118.2 | 54% | 0.544 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.9 | -44.7 | 178.5 | -65.5 | 166.8 | 0 | 0 | 0 | 110.3 | R53 R54 R60 R61 | R53-I57 HydrophobicContact CG-CD1 4.35Å; R53-I57 WeakPolarHBondContact O-CG1 3.38Å; R53-I57 PolarHBondContact O-N 3.23Å; R54-I57 PolarHBondContact O-N 2.94Å; I57-R60 PolarHBondContact O-N 2.9Å; I57-R61 PolarHBondContact O-N 3.42Å |
| 58 | E | 96.1 | Very high | 91.2 | Very high | 47 Ų | 47 | 117 Ų | 117 | 22% | 0.22 | 53% | 0.529 | C | S | . | . | H | α-helix | trans | -64.8 | -41.4 | 178.5 | 177.5 | 56.1 | -162.9 | 0 | 0 | 112.4 | R54 G55 I56 R60 R61 R62 | R54-E58 WeakPolarHBondContact O-CB 3.43Å; R54-E58 PolarHBondContact O-N 3.23Å; G55-E58 PolarHBondContact O-N 3.15Å; I56-E58 VanDerWaalsContact C-N 3.34Å; E58-R60 PolarHBondContact O-N 3.46Å; E58-R61 VanDerWaalsContact CD-CZ 3.46Å; E58-R61 WeakPolarHBondContact O-CB 3.44Å; E58-R61 PolarHBondContact O-N 3.49Å; E58-R61 IonicContact OE1-CZ 3.22Å; E58-R61 VanDerWaalsContact OE1-CZ 3.22Å; E58-R61 IonicContact OE1-NE 3.73Å; E58-R61 IonicContact OE1-NH1 3.58Å; E58-R61 IonicContact OE1-NH2 3.76Å; E58-R61 PolarHBondContact OE1-NH2 2.92Å; E58-R61 IonicContact OE2-CZ 2.62Å; E58-R61 IonicContact OE2-NE 2.86Å; E58-R61 PolarHBondContact OE2-NE 3.03Å; E58-R61 IonicContact OE2-NH1 3.34Å; E58-R61 PolarHBondContact OE2-NH1 3.42Å; E58-R61 IonicContact OE2-NH2 3.3Å; E58-R62 WeakPolarHBondContact O-CG 3.36Å; E58-R62 PolarHBondContact O-N 3.4Å; E58-R62 IonicContact OE1-CZ 3.06Å; E58-R62 IonicContact OE1-NE 2.97Å; E58-R62 PolarHBondContact OE1-NE 3.4Å; E58-R62 IonicContact OE1-NH2 3.61Å; E58-R62 PolarHBondContact OE1-NH2 3.11Å |
| 59 | K | 96.1 | Very high | 92 | Very high | 139 Ų | 139 | 112.7 Ų | 112.7 | 60% | 0.604 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -56.1 | -51.5 | 173.6 | -176.6 | 178.8 | 177.9 | -179.5 | 0 | 110.7 | G55 I56 R61 R62 D63 | G55-K59 WeakPolarHBondContact O-CB 3.35Å; G55-K59 PolarHBondContact O-N 3.45Å; I56-K59 PolarHBondContact O-N 2.87Å; K59-R61 VanDerWaalsContact C-N 3.27Å; K59-R61 PolarHBondContact O-N 3.48Å; K59-R62 PolarHBondContact O-N 3.04Å; K59-R62 VanDerWaalsContact O-N 3.08Å; K59-D63 VanDerWaalsContact O-CG 3.23Å; K59-D63 PolarHBondContact O-N 3.49Å |
| 60 | R | 97.3 | Very high | 92.9 | Very high | 169 Ų | 169 | 113 Ų | 113 | 64% | 0.638 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -58.2 | -37.7 | 177.1 | -70.3 | 178 | -176.5 | 168.2 | 0.3 | 112.6 | I56 I57 E58 R64 | I56-R60 WeakPolarHBondContact O-CG 3.26Å; I56-R60 PolarHBondContact O-N 2.9Å; I56-R60 VanDerWaalsContact O-N 3.07Å; I57-R60 PolarHBondContact O-N 2.9Å; E58-R60 PolarHBondContact O-N 3.46Å; R60-R64 WeakPolarHBondContact O-CG 3.42Å; R60-R64 PolarHBondContact O-N 3.01Å; R60-R64 VanDerWaalsContact O-N 3.09Å |
| 61 | R | 98.1 | Very high | 93.9 | Very high | 132 Ų | 132 | 110.7 Ų | 110.7 | 50% | 0.498 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.4 | -46.7 | 175 | -167.8 | -167.8 | 84.5 | -163.8 | 11.9 | 111.5 | I57 E58 K59 R64 I65 | I57-R61 PolarHBondContact O-N 3.42Å; E58-R61 VanDerWaalsContact CD-CZ 3.46Å; E58-R61 WeakPolarHBondContact O-CB 3.44Å; E58-R61 PolarHBondContact O-N 3.49Å; E58-R61 IonicContact OE1-CZ 3.22Å; E58-R61 VanDerWaalsContact OE1-CZ 3.22Å; E58-R61 IonicContact OE1-NE 3.73Å; E58-R61 IonicContact OE1-NH1 3.58Å; E58-R61 IonicContact OE1-NH2 3.76Å; E58-R61 PolarHBondContact OE1-NH2 2.92Å; E58-R61 IonicContact OE2-CZ 2.62Å; E58-R61 IonicContact OE2-NE 2.86Å; E58-R61 PolarHBondContact OE2-NE 3.03Å; E58-R61 IonicContact OE2-NH1 3.34Å; E58-R61 PolarHBondContact OE2-NH1 3.42Å; E58-R61 IonicContact OE2-NH2 3.3Å; K59-R61 VanDerWaalsContact C-N 3.27Å; K59-R61 PolarHBondContact O-N 3.48Å; R61-R64 PolarHBondContact O-N 3.19Å; R61-I65 HydrophobicContact CG-CD1 4.39Å; R61-I65 WeakPolarHBondContact O-CG1 3.46Å; R61-I65 PolarHBondContact O-N 2.71Å; R61-I65 VanDerWaalsContact O-N 3.1Å |
| 62 | R | 98 | Very high | 94.6 | Very high | 146 Ų | 146 | 105.8 Ų | 105.8 | 55% | 0.551 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -64 | -41.1 | 179 | -67.6 | 178 | -166 | -172.2 | 5.5 | 111.9 | E58 K59 R64 I65 N66 | E58-R62 WeakPolarHBondContact O-CG 3.36Å; E58-R62 PolarHBondContact O-N 3.4Å; E58-R62 IonicContact OE1-CZ 3.06Å; E58-R62 IonicContact OE1-NE 2.97Å; E58-R62 PolarHBondContact OE1-NE 3.4Å; E58-R62 IonicContact OE1-NH2 3.61Å; E58-R62 PolarHBondContact OE1-NH2 3.11Å; K59-R62 PolarHBondContact O-N 3.04Å; K59-R62 VanDerWaalsContact O-N 3.08Å; R62-R64 VanDerWaalsContact C-N 3.35Å; R62-R64 PolarHBondContact O-N 3.42Å; R62-I65 PolarHBondContact O-N 2.97Å; R62-N66 PolarHBondContact O-N 3.41Å; R62-N66 PolarHBondContact O-ND2 3.42Å |
| 63 | D | 97.8 | Very high | 95.2 | Very high | 71 Ų | 71 | 99.2 Ų | 99.2 | 38% | 0.38 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -61 | -45.4 | 177.2 | -62.8 | -22.4 | 0 | 0 | 0 | 110.5 | K59 I65 N66 N67 | K59-D63 VanDerWaalsContact O-CG 3.23Å; K59-D63 PolarHBondContact O-N 3.49Å; D63-I65 PolarHBondContact O-N 3.08Å; D63-N66 PolarHBondContact O-N 3.33Å; D63-N67 WeakPolarHBondContact O-CB 3.31Å; D63-N67 PolarHBondContact O-N 2.69Å; D63-N67 PolarHBondContact O-OD1 3.24Å |
| 64 | R | 98.1 | Very high | 95.8 | Very high | 177 Ų | 177 | 97.4 Ų | 97.4 | 67% | 0.668 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -57.6 | -44.8 | 173.6 | -72.8 | 179.2 | 64.7 | -119.3 | -3.8 | 112.9 | R60 R61 R62 N67 S68 | R60-R64 WeakPolarHBondContact O-CG 3.42Å; R60-R64 PolarHBondContact O-N 3.01Å; R60-R64 VanDerWaalsContact O-N 3.09Å; R61-R64 PolarHBondContact O-N 3.19Å; R62-R64 VanDerWaalsContact C-N 3.35Å; R62-R64 PolarHBondContact O-N 3.42Å; R64-N67 PolarHBondContact O-N 2.69Å; R64-S68 PolarHBondContact O-N 3.19Å; R64-S68 PolarHBondContact O-OG 3.48Å |
| 65 | I | 97.4 | Very high | 96 | Very high | 81 Ų | 81 | 92.8 Ų | 92.8 | 42% | 0.415 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -63.1 | -44.8 | 178 | -69.1 | 167.6 | 0 | 0 | 0 | 111.1 | R61 R62 D63 N67 S68 L69 | R61-I65 HydrophobicContact CG-CD1 4.39Å; R61-I65 WeakPolarHBondContact O-CG1 3.46Å; R61-I65 PolarHBondContact O-N 2.71Å; R61-I65 VanDerWaalsContact O-N 3.1Å; R62-I65 PolarHBondContact O-N 2.97Å; D63-I65 PolarHBondContact O-N 3.08Å; I65-N67 VanDerWaalsContact C-N 3.31Å; I65-N67 PolarHBondContact O-N 3.03Å; I65-S68 PolarHBondContact O-N 3.3Å; I65-L69 HydrophobicContact CG2-CD1 4.18Å; I65-L69 WeakPolarHBondContact O-CG 3.37Å; I65-L69 PolarHBondContact O-N 3.09Å |
| 66 | N | 97 | Very high | 96 | Very high | 59 Ų | 59 | 91 Ų | 91 | 32% | 0.316 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -66.6 | -35.3 | 179.8 | -70.1 | -30.2 | 0 | 0 | 0 | 111.7 | R62 D63 L69 S70 K90 | R62-N66 PolarHBondContact O-N 3.41Å; R62-N66 PolarHBondContact O-ND2 3.42Å; D63-N66 PolarHBondContact O-N 3.33Å; N66-L69 PolarHBondContact O-N 2.9Å; N66-S70 WeakPolarHBondContact O-CB 3.34Å; N66-S70 PolarHBondContact O-N 3.27Å; N66-S70 PolarHBondContact O-OG 3.33Å; N66-K90 WeakPolarHBondContact OD1-CE 3.36Å; N66-K90 PolarHBondContact OD1-NZ 2.89Å |
| 67 | N | 97.6 | Very high | 96 | Very high | 108 Ų | 108 | 89.7 Ų | 89.7 | 58% | 0.578 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -62 | -49.1 | 173 | -69.4 | -6.6 | 0 | 0 | 0 | 110.8 | D63 R64 I65 L69 S70 E71 | D63-N67 WeakPolarHBondContact O-CB 3.31Å; D63-N67 PolarHBondContact O-N 2.69Å; D63-N67 PolarHBondContact O-OD1 3.24Å; R64-N67 PolarHBondContact O-N 2.69Å; I65-N67 VanDerWaalsContact C-N 3.31Å; I65-N67 PolarHBondContact O-N 3.03Å; N67-L69 VanDerWaalsContact C-N 3.34Å; N67-L69 PolarHBondContact O-N 3.32Å; N67-S70 WeakPolarHBondContact O-CB 3.42Å; N67-S70 PolarHBondContact O-N 2.97Å; N67-S70 VanDerWaalsContact O-N 3.12Å; N67-E71 PolarHBondContact O-N 3.25Å |
| 68 | S | 97.7 | Very high | 95.8 | Very high | 64 Ų | 64 | 87 Ų | 87 | 45% | 0.448 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -59.3 | -42.1 | 176.4 | -59 | 0 | 0 | 0 | 0 | 112.5 | R64 I65 S70 E71 L72 | R64-S68 PolarHBondContact O-N 3.19Å; R64-S68 PolarHBondContact O-OG 3.48Å; I65-S68 PolarHBondContact O-N 3.3Å; S68-S70 VanDerWaalsContact C-N 3.3Å; S68-S70 PolarHBondContact O-N 2.78Å; S68-E71 PolarHBondContact O-N 3.4Å; S68-L72 WeakPolarHBondContact O-CG 3.49Å; S68-L72 PolarHBondContact O-N 3.18Å |
| 69 | L | 96 | Very high | 95.7 | Very high | 16 Ų | 16 | 84.8 Ų | 84.8 | 8% | 0.084 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -63.9 | -35.4 | 176.2 | -73.6 | 171.8 | 0 | 0 | 0 | 112.8 | I65 N66 N67 L72 R73 K90 I93 L94 | I65-L69 HydrophobicContact CG2-CD1 4.18Å; I65-L69 WeakPolarHBondContact O-CG 3.37Å; I65-L69 PolarHBondContact O-N 3.09Å; N66-L69 PolarHBondContact O-N 2.9Å; N67-L69 VanDerWaalsContact C-N 3.34Å; N67-L69 PolarHBondContact O-N 3.32Å; L69-L72 HydrophobicContact CD2-CD1 4.48Å; L69-R73 PolarHBondContact O-N 2.95Å; L69-R73 VanDerWaalsContact O-N 3.13Å; L69-K90 HydrophobicContact CD1-CB 4.35Å; L69-K90 HydrophobicContact CD1-CD 3.73Å; L69-K90 HydrophobicContact CD1-CG 3.88Å; L69-I93 HydrophobicContact CB-CD1 4.44Å; L69-I93 HydrophobicContact CD2-CB 4.49Å; L69-I93 HydrophobicContact CD2-CD1 4.49Å; L69-I93 HydrophobicContact CD2-CG2 4.21Å; L69-L94 HydrophobicContact CD2-CD2 3.86Å; L69-L94 HydrophobicContact CD2-CG 4.13Å |
| 70 | S | 94.8 | Very high | 95.5 | Very high | 65 Ų | 65 | 83.8 Ų | 83.8 | 46% | 0.455 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -70.4 | -37.9 | 177.1 | -54.6 | 0 | 0 | 0 | 0 | 111 | N66 N67 S68 R73 R74 | N66-S70 WeakPolarHBondContact O-CB 3.34Å; N66-S70 PolarHBondContact O-N 3.27Å; N66-S70 PolarHBondContact O-OG 3.33Å; N67-S70 WeakPolarHBondContact O-CB 3.42Å; N67-S70 PolarHBondContact O-N 2.97Å; N67-S70 VanDerWaalsContact O-N 3.12Å; S68-S70 VanDerWaalsContact C-N 3.3Å; S68-S70 PolarHBondContact O-N 2.78Å; S70-R73 PolarHBondContact O-N 3.43Å; S70-R74 PolarHBondContact O-N 3.06Å |
| 71 | E | 96.4 | Very high | 95.1 | Very high | 103 Ų | 103 | 83.5 Ų | 83.5 | 48% | 0.481 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -65.2 | -43.8 | 172.9 | -174.1 | 167.6 | -158.1 | 0 | 0 | 111.9 | N67 S68 R73 R74 L75 | N67-E71 PolarHBondContact O-N 3.25Å; S68-E71 PolarHBondContact O-N 3.4Å; E71-R73 VanDerWaalsContact C-N 3.33Å; E71-R73 PolarHBondContact O-N 2.88Å; E71-R74 WeakPolarHBondContact O-CB 3.47Å; E71-R74 PolarHBondContact O-N 3.46Å; E71-L75 HydrophobicContact CG-CD1 3.74Å; E71-L75 HydrophobicContact CG-CG 4.16Å; E71-L75 WeakPolarHBondContact O-CG 3.43Å; E71-L75 PolarHBondContact O-N 3Å |
| 72 | L | 96.8 | Very high | 94.4 | Very high | 47 Ų | 47 | 81.4 Ų | 81.4 | 25% | 0.246 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -58.4 | -42 | 175.4 | -72.6 | 178.2 | 0 | 0 | 0 | 112.6 | S68 L69 R74 L75 V76 I93 L94 T97 | S68-L72 WeakPolarHBondContact O-CG 3.49Å; S68-L72 PolarHBondContact O-N 3.18Å; L69-L72 HydrophobicContact CD2-CD1 4.48Å; L72-R74 PolarHBondContact O-N 3.49Å; L72-L75 PolarHBondContact O-N 3.2Å; L72-V76 WeakPolarHBondContact O-CB 2.96Å; L72-V76 WeakPolarHBondContact O-CG2 3.47Å; L72-V76 PolarHBondContact O-N 2.9Å; L72-I93 HydrophobicContact CB-CG2 3.89Å; L72-L94 HydrophobicContact CD1-CD2 4.37Å; L72-T97 HydrophobicContact CD1-CG2 4.32Å; L72-T97 HydrophobicContact CD2-CG2 3.75Å |
| 73 | R | 93.6 | Very high | 93.3 | Very high | 58 Ų | 58 | 80.1 Ų | 80.1 | 22% | 0.219 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -56.7 | -35.5 | 174 | -77 | -176.9 | -178.9 | 141.1 | -3.9 | 112.9 | L69 S70 E71 A79 F80 L88 I93 | L69-R73 PolarHBondContact O-N 2.95Å; L69-R73 VanDerWaalsContact O-N 3.13Å; S70-R73 PolarHBondContact O-N 3.43Å; E71-R73 VanDerWaalsContact C-N 3.33Å; E71-R73 PolarHBondContact O-N 2.88Å; R73-A79 CarbonylContact O-C 3.48Å; R73-F80 WeakPolarHBondContact O-CA 3.31Å; R73-F80 WeakPolarHBondContact O-CB 3.33Å; R73-F80 PolarHBondContact O-N 3.26Å; R73-F80 VanDerWaalsContact O-N 3.07Å; R73-L88 HydrophobicContact CG-CD1 4.31Å; R73-L88 PolarHBondContact NH2-O 2.62Å; R73-I93 HydrophobicContact CG-CD1 3.83Å; R73-I93 HydrophobicContact CG-CG1 3.76Å; R73-I93 HydrophobicContact CG-CG2 4.07Å; R73-I93 VanDerWaalsContact CZ-CD1 3.43Å |
| 74 | R | 94 | Very high | 92 | Very high | 148 Ų | 148 | 80.5 Ų | 80.5 | 56% | 0.558 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -80.1 | -33.9 | -179.8 | -169.1 | -177.1 | 64.7 | 82.1 | 1.7 | 112.6 | S70 E71 L72 | S70-R74 PolarHBondContact O-N 3.06Å; E71-R74 WeakPolarHBondContact O-CB 3.47Å; E71-R74 PolarHBondContact O-N 3.46Å; L72-R74 PolarHBondContact O-N 3.49Å |
| 75 | L | 93.5 | Very high | 90.2 | Very high | 94 Ų | 94 | 76 Ų | 76 | 49% | 0.492 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -85.5 | -28.2 | -174.9 | -68.1 | 179.1 | 0 | 0 | 0 | 113.7 | E71 L72 | E71-L75 HydrophobicContact CG-CD1 3.74Å; E71-L75 HydrophobicContact CG-CG 4.16Å; E71-L75 WeakPolarHBondContact O-CG 3.43Å; E71-L75 PolarHBondContact O-N 3Å; L72-L75 PolarHBondContact O-N 3.2Å |
| 76 | V | 93.1 | Very high | 88.9 | Confident | 4 Ų | 4 | 76.2 Ų | 76.2 | 2% | 0.024 | 42% | 0.424 | C | S | . | . | S | Bend | trans | -90.1 | 117.8 | -177.4 | 176.2 | 0 | 0 | 0 | 0 | 109.4 | L72 S78 A79 F80 M96 T97 H100 | L72-V76 WeakPolarHBondContact O-CB 2.96Å; L72-V76 WeakPolarHBondContact O-CG2 3.47Å; L72-V76 PolarHBondContact O-N 2.9Å; V76-S78 PolarHBondContact O-N 2.89Å; V76-A79 HydrophobicContact CB-CB 3.95Å; V76-A79 HydrophobicContact CG1-CB 4.07Å; V76-A79 PolarHBondContact O-N 3.43Å; V76-F80 PolarHBondContact O-N 3.34Å; V76-M96 HydrophobicContact CG1-CB 4.34Å; V76-T97 HydrophobicContact CG2-CG2 4.07Å; V76-H100 HydrophobicContact CG1-CB 3.95Å |
| 77 | P | 91.4 | Very high | 88.3 | Confident | 50 Ų | 50 | 82.8 Ų | 82.8 | 33% | 0.325 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -54.4 | -46.7 | -172.1 | -28.7 | 34.8 | 0 | 0 | 0 | 114.1 | A79 F80 E81 Y112 | P77-A79 VanDerWaalsContact C-N 3.33Å; P77-A79 PolarHBondContact O-N 2.86Å; P77-F80 PolarHBondContact O-N 2.7Å; P77-E81 PolarHBondContact O-N 3.49Å; P77-Y112 HydrophobicContact CG-CE2 4.45Å |
| 78 | S | 91.3 | Very high | 87.7 | Confident | 50 Ų | 50 | 78.2 Ų | 78.2 | 35% | 0.35 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -65.1 | -36.9 | 179.6 | 53.8 | 0 | 0 | 0 | 0 | 112.2 | V76 K82 M96 | V76-S78 PolarHBondContact O-N 2.89Å; S78-K82 PolarHBondContact O-N 3.19Å; S78-M96 VanDerWaalsContact CB-CE 3.45Å; S78-M96 WeakPolarHBondContact O-CE 3.41Å; S78-M96 WeakPolarHBondContact OG-CE 3.31Å |
| 79 | A | 92.7 | Very high | 87.5 | Confident | 0 Ų | 0 | 81.9 Ų | 81.9 | 0% | 0 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -74.3 | -34.1 | 179 | 0 | 0 | 0 | 0 | 0 | 111.5 | R73 V76 P77 Q83 L88 M96 | R73-A79 CarbonylContact O-C 3.48Å; V76-A79 HydrophobicContact CB-CB 3.95Å; V76-A79 HydrophobicContact CG1-CB 4.07Å; V76-A79 PolarHBondContact O-N 3.43Å; P77-A79 VanDerWaalsContact C-N 3.33Å; P77-A79 PolarHBondContact O-N 2.86Å; A79-Q83 PolarHBondContact O-N 3.37Å; A79-L88 HydrophobicContact CB-CD1 4.22Å; A79-L88 WeakPolarHBondContact O-CD1 3.35Å; A79-M96 HydrophobicContact CB-CB 4.47Å; A79-M96 HydrophobicContact CB-CE 4.13Å; A79-M96 HydrophobicContact CB-SD 4.1Å; A79-M96 VanDerWaalsContact N-CE 3.27Å |
| 80 | F | 92.1 | Very high | 87.4 | Confident | 117 Ų | 117 | 86.5 Ų | 86.5 | 51% | 0.513 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.4 | -45.3 | 176.1 | 178.8 | -101 | 0 | 0 | 0 | 111.3 | R73 V76 P77 K82 Q83 | R73-F80 WeakPolarHBondContact O-CA 3.31Å; R73-F80 WeakPolarHBondContact O-CB 3.33Å; R73-F80 PolarHBondContact O-N 3.26Å; R73-F80 VanDerWaalsContact O-N 3.07Å; V76-F80 PolarHBondContact O-N 3.34Å; P77-F80 PolarHBondContact O-N 2.7Å; F80-K82 VanDerWaalsContact C-N 3.29Å; F80-K82 PolarHBondContact O-N 3.36Å; F80-Q83 WeakPolarHBondContact O-CB 3.48Å; F80-Q83 PolarHBondContact O-N 3.25Å |
| 81 | E | 88.9 | Confident | 87.4 | Confident | 163 Ų | 163 | 86.7 Ų | 86.7 | 76% | 0.762 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -60.5 | -39.4 | 178.9 | -170.5 | 171.4 | -162.3 | 0 | 0 | 112.1 | P77 Q83 | P77-E81 PolarHBondContact O-N 3.49Å; E81-Q83 PolarHBondContact O-N 3Å |
| 82 | K | 84.3 | Confident | 87.4 | Confident | 88 Ų | 88 | 84.8 Ų | 84.8 | 38% | 0.383 | 45% | 0.451 | S | S | . | . | G | 310 helix | trans | -75.2 | -5 | 176.9 | -69.9 | -167.4 | 178.4 | -159.1 | 0 | 114.9 | S78 F80 G84 S85 L88 E92 M96 | S78-K82 PolarHBondContact O-N 3.19Å; F80-K82 VanDerWaalsContact C-N 3.29Å; F80-K82 PolarHBondContact O-N 3.36Å; K82-G84 PolarHBondContact O-N 3.41Å; K82-G84 VanDerWaalsContact O-N 3.13Å; K82-S85 PolarHBondContact O-N 2.79Å; K82-S85 VanDerWaalsContact O-N 3.1Å; K82-L88 HydrophobicContact CB-CD1 4.17Å; K82-L88 HydrophobicContact CB-CD2 3.84Å; K82-L88 HydrophobicContact CB-CG 4.31Å; K82-L88 HydrophobicContact CD-CD2 3.81Å; K82-E92 IonicContact NZ-OE1 3.69Å; K82-E92 PolarHBondContact NZ-OE1 2.93Å; K82-M96 HydrophobicContact CD-CE 3.88Å; K82-M96 HydrophobicContact CD-SD 4.4Å; K82-M96 HydrophobicContact CG-CE 4.38Å |
| 83 | Q | 75.1 | Confident | 87.3 | Confident | 119 Ų | 119 | 82.6 Ų | 82.6 | 56% | 0.556 | 44% | 0.44 | S | S | * | . | G | 310 helix | trans | -62 | -23.1 | -178.9 | -163.8 | 178.9 | -70.2 | 0 | 0 | 112.8 | A79 F80 E81 | A79-Q83 PolarHBondContact O-N 3.37Å; F80-Q83 WeakPolarHBondContact O-CB 3.48Å; F80-Q83 PolarHBondContact O-N 3.25Å; E81-Q83 PolarHBondContact O-N 3Å |
| 84 | G | 69 | Low | 87.5 | Confident | 80 Ų | 80 | 84.2 Ų | 84.2 | 83% | 0.825 | 45% | 0.452 | S | S | * | . | G | 310 helix | trans | -84 | -16.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | K82 | K82-G84 PolarHBondContact O-N 3.41Å; K82-G84 VanDerWaalsContact O-N 3.13Å |
| 85 | S | 61.3 | Low | 87.6 | Confident | 81 Ų | 81 | 82 Ų | 82 | 57% | 0.566 | 45% | 0.448 | S | S | * | . | S | Bend | trans | -125.2 | 95.4 | -175.5 | 68.3 | 0 | 0 | 0 | 0 | 110.5 | K82 | K82-S85 PolarHBondContact O-N 2.79Å; K82-S85 VanDerWaalsContact O-N 3.1Å |
| 86 | A | 70.4 | Confident | 87.7 | Confident | 87 Ų | 87 | 78.5 Ų | 78.5 | 72% | 0.719 | 43% | 0.429 | S | S | * | . | S | Bend | trans | 67 | 149.8 | 179 | 0 | 0 | 0 | 0 | 0 | 116.6 | L88 | A86-L88 PolarHBondContact O-N 3.22Å; A86-L88 VanDerWaalsContact O-N 3.09Å |
| 87 | K | 83.9 | Confident | 87.9 | Confident | 196 Ų | 196 | 79 Ų | 79 | 85% | 0.852 | 43% | 0.433 | S | S | * | . | trans | -71.3 | 102.3 | -178.3 | -177.2 | 180 | -178.5 | 177.7 | 0 | 109.8 | E89 | K87-E89 PolarHBondContact O-N 3.11Š| ||
| 88 | L | 85.9 | Confident | 88.1 | Confident | 12 Ų | 12 | 79.8 Ų | 79.8 | 6% | 0.063 | 44% | 0.436 | C | S | . | . | trans | -51.7 | 133.8 | 176.2 | -67.3 | 173.7 | 0 | 0 | 0 | 112.2 | R73 A79 K82 A86 E92 I93 M96 | R73-L88 HydrophobicContact CG-CD1 4.31Å; R73-L88 PolarHBondContact NH2-O 2.62Å; A79-L88 HydrophobicContact CB-CD1 4.22Å; A79-L88 WeakPolarHBondContact O-CD1 3.35Å; K82-L88 HydrophobicContact CB-CD1 4.17Å; K82-L88 HydrophobicContact CB-CD2 3.84Å; K82-L88 HydrophobicContact CB-CG 4.31Å; K82-L88 HydrophobicContact CD-CD2 3.81Å; A86-L88 PolarHBondContact O-N 3.22Å; A86-L88 VanDerWaalsContact O-N 3.09Å; L88-E92 HydrophobicContact CD2-CG 4.2Å; L88-E92 VanDerWaalsContact CD2-OE2 3.22Å; L88-E92 WeakPolarHBondContact CD2-OE2 3.27Å; L88-I93 HydrophobicContact CB-CG1 4.04Å; L88-M96 HydrophobicContact CD2-SD 4.44Å | ||
| 89 | E | 92.8 | Very high | 88.3 | Confident | 142 Ų | 142 | 80.9 Ų | 80.9 | 66% | 0.664 | 44% | 0.438 | S | S | * | . | trans | -71.7 | 156.9 | 174.5 | -63.3 | -166.8 | 150.1 | 0 | 0 | 111.7 | K87 A91 E92 I93 | K87-E89 PolarHBondContact O-N 3.11Å; E89-A91 VanDerWaalsContact C-N 3.29Å; E89-A91 PolarHBondContact O-N 3.11Å; E89-E92 HydrophobicContact CB-CB 4.35Å; E89-E92 PolarHBondContact O-N 3.19Å; E89-I93 WeakPolarHBondContact O-CG1 3.13Å; E89-I93 PolarHBondContact O-N 3.17Å; E89-I93 VanDerWaalsContact O-N 3.1Å | ||
| 90 | K | 93.9 | Very high | 88.2 | Confident | 113 Ų | 113 | 82.3 Ų | 82.3 | 49% | 0.491 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61 | -39.8 | 180 | -68.1 | -169.3 | 169.5 | -171.3 | 0 | 112.4 | N66 L69 L94 | N66-K90 WeakPolarHBondContact OD1-CE 3.36Å; N66-K90 PolarHBondContact OD1-NZ 2.89Å; L69-K90 HydrophobicContact CD1-CB 4.35Å; L69-K90 HydrophobicContact CD1-CD 3.73Å; L69-K90 HydrophobicContact CD1-CG 3.88Å; K90-L94 WeakPolarHBondContact O-CG 3.34Å; K90-L94 PolarHBondContact O-N 2.88Å |
| 91 | A | 95.7 | Very high | 88.3 | Confident | 69 Ų | 69 | 81.7 Ų | 81.7 | 57% | 0.57 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -65.6 | -40.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | E89 L94 Q95 | E89-A91 VanDerWaalsContact C-N 3.29Å; E89-A91 PolarHBondContact O-N 3.11Å; A91-L94 PolarHBondContact O-N 3.38Å; A91-Q95 WeakPolarHBondContact O-CB 3.42Å; A91-Q95 PolarHBondContact O-N 3.28Å |
| 92 | E | 95.1 | Very high | 88.4 | Confident | 63 Ų | 63 | 79.7 Ų | 79.7 | 29% | 0.294 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -62.3 | -46 | 177.8 | -168.5 | 179.2 | -176.1 | 0 | 0 | 111.6 | K82 L88 E89 L94 Q95 M96 | K82-E92 IonicContact NZ-OE1 3.69Å; K82-E92 PolarHBondContact NZ-OE1 2.93Å; L88-E92 HydrophobicContact CD2-CG 4.2Å; L88-E92 VanDerWaalsContact CD2-OE2 3.22Å; L88-E92 WeakPolarHBondContact CD2-OE2 3.27Å; E89-E92 HydrophobicContact CB-CB 4.35Å; E89-E92 PolarHBondContact O-N 3.19Å; E92-L94 VanDerWaalsContact C-N 3.29Å; E92-L94 PolarHBondContact O-N 3.36Å; E92-Q95 PolarHBondContact O-N 3.39Å; E92-M96 HydrophobicContact CG-CG 4.32Å; E92-M96 HydrophobicContact CG-SD 3.82Å; E92-M96 WeakPolarHBondContact O-CB 3.18Å; E92-M96 WeakPolarHBondContact O-CG 3.29Å; E92-M96 PolarHBondContact O-N 2.95Å |
| 93 | I | 95.1 | Very high | 88.5 | Confident | 1 Ų | 1 | 80 Ų | 80 | 1% | 0.005 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -56 | -46 | 175.9 | -58.2 | 159.8 | 0 | 0 | 0 | 110.9 | L69 L72 R73 L88 E89 T97 | L69-I93 HydrophobicContact CB-CD1 4.44Å; L69-I93 HydrophobicContact CD2-CB 4.49Å; L69-I93 HydrophobicContact CD2-CD1 4.49Å; L69-I93 HydrophobicContact CD2-CG2 4.21Å; L72-I93 HydrophobicContact CB-CG2 3.89Å; R73-I93 HydrophobicContact CG-CD1 3.83Å; R73-I93 HydrophobicContact CG-CG1 3.76Å; R73-I93 HydrophobicContact CG-CG2 4.07Å; R73-I93 VanDerWaalsContact CZ-CD1 3.43Å; L88-I93 HydrophobicContact CB-CG1 4.04Å; E89-I93 WeakPolarHBondContact O-CG1 3.13Å; E89-I93 PolarHBondContact O-N 3.17Å; E89-I93 VanDerWaalsContact O-N 3.1Å; I93-T97 WeakPolarHBondContact O-CB 3.48Å; I93-T97 PolarHBondContact O-N 3.17Å; I93-T97 PolarHBondContact O-OG1 3Å |
| 94 | L | 97.5 | Very high | 89 | Confident | 91 Ų | 91 | 76.1 Ų | 76.1 | 48% | 0.476 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -65.5 | -42.9 | -179.2 | -67.7 | 174.7 | 0 | 0 | 0 | 111.2 | L69 L72 K90 A91 E92 T97 V98 | L69-L94 HydrophobicContact CD2-CD2 3.86Å; L69-L94 HydrophobicContact CD2-CG 4.13Å; L72-L94 HydrophobicContact CD1-CD2 4.37Å; K90-L94 WeakPolarHBondContact O-CG 3.34Å; K90-L94 PolarHBondContact O-N 2.88Å; A91-L94 PolarHBondContact O-N 3.38Å; E92-L94 VanDerWaalsContact C-N 3.29Å; E92-L94 PolarHBondContact O-N 3.36Å; L94-T97 WeakPolarHBondContact O-CB 3.29Å; L94-T97 PolarHBondContact O-N 3.43Å; L94-V98 WeakPolarHBondContact O-CG2 3.48Å; L94-V98 PolarHBondContact O-N 3.06Å |
| 95 | Q | 96.6 | Very high | 89.6 | Confident | 101 Ų | 101 | 80 Ų | 80 | 47% | 0.472 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.4 | -50.9 | 177.7 | -174.3 | 57.6 | 54.1 | 0 | 0 | 111.3 | A91 E92 T97 V98 D99 | A91-Q95 WeakPolarHBondContact O-CB 3.42Å; A91-Q95 PolarHBondContact O-N 3.28Å; E92-Q95 PolarHBondContact O-N 3.39Å; Q95-T97 PolarHBondContact O-N 3.26Å; Q95-V98 PolarHBondContact O-N 3Å; Q95-V98 VanDerWaalsContact O-N 3.09Å; Q95-D99 VanDerWaalsContact NE2-CG 3.3Å; Q95-D99 PolarHBondContact NE2-OD1 3.07Å; Q95-D99 PolarHBondContact NE2-OD2 2.99Å; Q95-D99 PolarHBondContact O-N 2.89Å |
| 96 | M | 96.2 | Very high | 90.5 | Very high | 21 Ų | 21 | 82.3 Ų | 82.3 | 10% | 0.103 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -59.6 | -36.4 | 177.9 | -64.5 | 173.4 | 85.6 | 0 | 0 | 111.9 | V76 S78 A79 K82 L88 E92 H100 | V76-M96 HydrophobicContact CG1-CB 4.34Å; S78-M96 VanDerWaalsContact CB-CE 3.45Å; S78-M96 WeakPolarHBondContact O-CE 3.41Å; S78-M96 WeakPolarHBondContact OG-CE 3.31Å; A79-M96 HydrophobicContact CB-CB 4.47Å; A79-M96 HydrophobicContact CB-CE 4.13Å; A79-M96 HydrophobicContact CB-SD 4.1Å; A79-M96 VanDerWaalsContact N-CE 3.27Å; K82-M96 HydrophobicContact CD-CE 3.88Å; K82-M96 HydrophobicContact CD-SD 4.4Å; K82-M96 HydrophobicContact CG-CE 4.38Å; L88-M96 HydrophobicContact CD2-SD 4.44Å; E92-M96 HydrophobicContact CG-CG 4.32Å; E92-M96 HydrophobicContact CG-SD 3.82Å; E92-M96 WeakPolarHBondContact O-CB 3.18Å; E92-M96 WeakPolarHBondContact O-CG 3.29Å; E92-M96 PolarHBondContact O-N 2.95Å; M96-H100 WeakPolarHBondContact O-CB 3.41Å; M96-H100 PolarHBondContact O-N 3.28Å |
| 97 | T | 96.5 | Very high | 90.6 | Very high | 16 Ų | 16 | 81 Ų | 81 | 10% | 0.098 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -65.2 | -47.2 | 174.6 | -55.2 | 0 | 0 | 0 | 0 | 111.4 | L72 V76 I93 L94 Q95 D99 H100 L101 | L72-T97 HydrophobicContact CD1-CG2 4.32Å; L72-T97 HydrophobicContact CD2-CG2 3.75Å; V76-T97 HydrophobicContact CG2-CG2 4.07Å; I93-T97 WeakPolarHBondContact O-CB 3.48Å; I93-T97 PolarHBondContact O-N 3.17Å; I93-T97 PolarHBondContact O-OG1 3Å; L94-T97 WeakPolarHBondContact O-CB 3.29Å; L94-T97 PolarHBondContact O-N 3.43Å; Q95-T97 PolarHBondContact O-N 3.26Å; T97-D99 VanDerWaalsContact C-N 3.33Å; T97-D99 PolarHBondContact O-N 3.21Å; T97-H100 PolarHBondContact O-N 2.91Å; T97-L101 HydrophobicContact CG2-CD1 4.32Å; T97-L101 WeakPolarHBondContact O-CG 3.16Å; T97-L101 PolarHBondContact O-N 2.91Å |
| 98 | V | 96.4 | Very high | 89.9 | Confident | 66 Ų | 66 | 74.5 Ų | 74.5 | 40% | 0.4 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62.3 | -42.7 | 179 | 169.8 | 0 | 0 | 0 | 0 | 111 | L94 Q95 H100 L101 K102 | L94-V98 WeakPolarHBondContact O-CG2 3.48Å; L94-V98 PolarHBondContact O-N 3.06Å; Q95-V98 PolarHBondContact O-N 3Å; Q95-V98 VanDerWaalsContact O-N 3.09Å; V98-H100 VanDerWaalsContact C-N 3.33Å; V98-H100 PolarHBondContact O-N 3.37Å; V98-L101 PolarHBondContact O-N 2.93Å; V98-K102 HydrophobicContact CG1-CD 4.29Å; V98-K102 WeakPolarHBondContact O-CG 3.26Å; V98-K102 PolarHBondContact O-N 2.86Å |
| 99 | D | 94.3 | Very high | 88.9 | Confident | 73 Ų | 73 | 76.9 Ų | 76.9 | 39% | 0.39 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -65.7 | -38.6 | 178.8 | -65.4 | -27.8 | 0 | 0 | 0 | 111.5 | Q95 T97 K102 M103 | Q95-D99 VanDerWaalsContact NE2-CG 3.3Å; Q95-D99 PolarHBondContact NE2-OD1 3.07Å; Q95-D99 PolarHBondContact NE2-OD2 2.99Å; Q95-D99 PolarHBondContact O-N 2.89Å; T97-D99 VanDerWaalsContact C-N 3.33Å; T97-D99 PolarHBondContact O-N 3.21Å; D99-K102 PolarHBondContact O-N 3.17Å; D99-M103 WeakPolarHBondContact O-CB 3.49Å; D99-M103 PolarHBondContact O-N 3.05Å |
| 100 | H | 91.6 | Very high | 87.4 | Confident | 30 Ų | 30 | 75.5 Ų | 75.5 | 14% | 0.139 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -62.3 | -43.8 | 171.8 | -178.1 | -132.7 | 0 | 0 | 0 | 112.1 | V76 M96 T97 V98 K102 M103 L104 | V76-H100 HydrophobicContact CG1-CB 3.95Å; M96-H100 WeakPolarHBondContact O-CB 3.41Å; M96-H100 PolarHBondContact O-N 3.28Å; T97-H100 PolarHBondContact O-N 2.91Å; V98-H100 VanDerWaalsContact C-N 3.33Å; V98-H100 PolarHBondContact O-N 3.37Å; H100-K102 PolarHBondContact O-N 3.29Å; H100-M103 WeakPolarHBondContact O-CB 3.49Å; H100-M103 PolarHBondContact O-N 3.41Å; H100-L104 WeakPolarHBondContact O-CG 3.41Å; H100-L104 PolarHBondContact O-N 2.97Å |
| 101 | L | 93 | Very high | 85.8 | Confident | 104 Ų | 104 | 72.2 Ų | 72.2 | 55% | 0.545 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -64.3 | -39.5 | 176.6 | -68.6 | 175 | 0 | 0 | 0 | 112.3 | T97 V98 L104 H105 | T97-L101 HydrophobicContact CG2-CD1 4.32Å; T97-L101 WeakPolarHBondContact O-CG 3.16Å; T97-L101 PolarHBondContact O-N 2.91Å; V98-L101 PolarHBondContact O-N 2.93Å; L101-L104 HydrophobicContact CD2-CD1 4.44Å; L101-L104 PolarHBondContact O-N 3.34Å; L101-H105 WeakPolarHBondContact O-CB 3.37Å; L101-H105 PolarHBondContact O-N 3.35Å |
| 102 | K | 90.6 | Very high | 84 | Confident | 121 Ų | 121 | 76.7 Ų | 76.7 | 53% | 0.526 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -62.3 | -44.7 | 173.8 | -74.8 | 174.9 | 179.5 | 172.5 | 0 | 111.5 | V98 D99 H100 H105 T106 | V98-K102 HydrophobicContact CG1-CD 4.29Å; V98-K102 WeakPolarHBondContact O-CG 3.26Å; V98-K102 PolarHBondContact O-N 2.86Å; D99-K102 PolarHBondContact O-N 3.17Å; H100-K102 PolarHBondContact O-N 3.29Å; K102-H105 PolarHBondContact O-N 3.19Å; K102-T106 PolarHBondContact O-N 3.19Å; K102-T106 PolarHBondContact O-OG1 3.42Å; K102-T106 VanDerWaalsContact O-OG1 3.11Å |
| 103 | M | 86.9 | Confident | 82.6 | Confident | 93 Ų | 93 | 81.3 Ų | 81.3 | 46% | 0.458 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -58.9 | -47 | 175.2 | 173.8 | -121.9 | -69.6 | 0 | 0 | 111.1 | D99 H100 H105 T106 A107 | D99-M103 WeakPolarHBondContact O-CB 3.49Å; D99-M103 PolarHBondContact O-N 3.05Å; H100-M103 WeakPolarHBondContact O-CB 3.49Å; H100-M103 PolarHBondContact O-N 3.41Å; M103-H105 VanDerWaalsContact C-N 3.27Å; M103-H105 PolarHBondContact O-N 3.48Å; M103-T106 PolarHBondContact O-N 3.11Å; M103-A107 VanDerWaalsContact O-CB 3.31Å; M103-A107 WeakPolarHBondContact O-CB 3.24Å; M103-A107 PolarHBondContact O-N 2.86Å |
| 104 | L | 85.6 | Confident | 81.6 | Confident | 38 Ų | 38 | 83.6 Ų | 83.6 | 20% | 0.199 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -60 | -38 | 175.7 | -71.2 | 176.8 | 0 | 0 | 0 | 112.4 | H100 L101 A107 G108 G109 | H100-L104 WeakPolarHBondContact O-CG 3.41Å; H100-L104 PolarHBondContact O-N 2.97Å; L101-L104 HydrophobicContact CD2-CD1 4.44Å; L101-L104 PolarHBondContact O-N 3.34Å; L104-A107 PolarHBondContact O-N 3.08Å; L104-G108 PolarHBondContact O-N 3.36Å; L104-G109 WeakPolarHBondContact O-CA 3.44Å; L104-G109 PolarHBondContact O-N 2.95Å |
| 105 | H | 82.5 | Confident | 80.8 | Confident | 163 Ų | 163 | 82.6 Ų | 82.6 | 76% | 0.755 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -68.9 | -42.5 | 178.4 | -157.1 | -104.3 | 0 | 0 | 0 | 111.9 | L101 K102 M103 A107 G108 | L101-H105 WeakPolarHBondContact O-CB 3.37Å; L101-H105 PolarHBondContact O-N 3.35Å; K102-H105 PolarHBondContact O-N 3.19Å; M103-H105 VanDerWaalsContact C-N 3.27Å; M103-H105 PolarHBondContact O-N 3.48Å; H105-A107 VanDerWaalsContact C-N 3.31Å; H105-A107 PolarHBondContact O-N 2.92Å; H105-G108 PolarHBondContact O-N 3.06Å; H105-G108 VanDerWaalsContact O-N 3.17Å |
| 106 | T | 79.5 | Confident | 80.1 | Confident | 129 Ų | 129 | 83.6 Ų | 83.6 | 79% | 0.791 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -65.6 | -34.3 | 173.8 | -55.6 | 0 | 0 | 0 | 0 | 111.9 | K102 M103 G108 | K102-T106 PolarHBondContact O-N 3.19Å; K102-T106 PolarHBondContact O-OG1 3.42Å; K102-T106 VanDerWaalsContact O-OG1 3.11Å; M103-T106 PolarHBondContact O-N 3.11Å; T106-G108 PolarHBondContact O-N 2.91Å; T106-G108 VanDerWaalsContact O-N 3.17Å |
| 107 | A | 73.3 | Confident | 79.4 | Confident | 60 Ų | 60 | 84.4 Ų | 84.4 | 50% | 0.496 | 48% | 0.479 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.1 | 9.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | M103 L104 H105 | M103-A107 VanDerWaalsContact O-CB 3.31Å; M103-A107 WeakPolarHBondContact O-CB 3.24Å; M103-A107 PolarHBondContact O-N 2.86Å; L104-A107 PolarHBondContact O-N 3.08Å; H105-A107 VanDerWaalsContact C-N 3.31Å; H105-A107 PolarHBondContact O-N 2.92Å |
| 108 | G | 68.9 | Low | 78.9 | Confident | 59 Ų | 59 | 86.7 Ų | 86.7 | 61% | 0.608 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.1 | 24.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | L104 H105 T106 K110 | L104-G108 PolarHBondContact O-N 3.36Å; H105-G108 PolarHBondContact O-N 3.06Å; H105-G108 VanDerWaalsContact O-N 3.17Å; T106-G108 PolarHBondContact O-N 2.91Å; T106-G108 VanDerWaalsContact O-N 3.17Å; G108-K110 PolarHBondContact O-N 3.25Å |
| 109 | G | 65.4 | Low | 78.6 | Confident | 62 Ų | 62 | 86.1 Ų | 86.1 | 64% | 0.639 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.4 | -0.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | L104 G111 | L104-G109 WeakPolarHBondContact O-CA 3.44Å; L104-G109 PolarHBondContact O-N 2.95Å; G109-G111 PolarHBondContact O-N 2.96Å |
| 110 | K | 61.4 | Low | 78.3 | Confident | 112 Ų | 112 | 84.9 Ų | 84.9 | 49% | 0.487 | 49% | 0.485 | S | S | . | . | trans | -76.9 | 117.8 | 167.4 | -60.3 | -176.4 | 179.2 | -166.3 | 0 | 105.8 | G108 D114 | G108-K110 PolarHBondContact O-N 3.25Å; K110-D114 WeakPolarHBondContact CD-OD2 3.35Å; K110-D114 IonicContact NZ-OD2 2.9Å; K110-D114 PolarHBondContact NZ-OD2 2.91Å | ||
| 111 | G | 58.8 | Low | 78.1 | Confident | 44 Ų | 44 | 88 Ų | 88 | 45% | 0.454 | 50% | 0.503 | S | S | . | . | trans | -55.1 | -177 | -178 | 0 | 0 | 0 | 0 | 0 | 113.2 | G109 F113 | G109-G111 PolarHBondContact O-N 2.96Å; G111-F113 PolarHBondContact O-N 3.02Å | ||
| 112 | Y | 58.9 | Low | 78.1 | Confident | 163 Ų | 163 | 90.9 Ų | 90.9 | 64% | 0.639 | 51% | 0.507 | S | S | * | . | S | Bend | trans | -54.9 | 3.1 | 179.1 | -150.1 | -97 | 0 | 0 | 0 | 115.6 | P77 | P77-Y112 HydrophobicContact CG-CE2 4.45Š|
| 113 | F | 64.9 | Low | 78.2 | Confident | 161 Ų | 161 | 92.6 Ų | 92.6 | 71% | 0.706 | 51% | 0.51 | S | S | * | . | trans | -141.7 | 92.2 | 176.8 | -99.8 | -95.5 | 0 | 0 | 0 | 109.8 | G111 A115 L118 | G111-F113 PolarHBondContact O-N 3.02Å; F113-A115 VanDerWaalsContact C-N 3.34Å; F113-A115 PolarHBondContact O-N 2.97Å; F113-L118 HydrophobicContact CD1-CD1 3.71Å; F113-L118 HydrophobicContact CE1-CD1 3.89Å | ||
| 114 | D | 75.8 | Confident | 78.5 | Confident | 48 Ų | 48 | 88.9 Ų | 88.9 | 26% | 0.257 | 49% | 0.493 | S | S | . | . | trans | -83.2 | 88 | 158 | -171.2 | -7.3 | 0 | 0 | 0 | 107.9 | K110 H116 A117 L118 | K110-D114 WeakPolarHBondContact CD-OD2 3.35Å; K110-D114 IonicContact NZ-OD2 2.9Å; K110-D114 PolarHBondContact NZ-OD2 2.91Å; D114-H116 PolarHBondContact O-N 3.03Å; D114-H116 VanDerWaalsContact O-N 3.11Å; D114-H116 WeakPolarHBondContact OD1-CA 3.42Å; D114-H116 VanDerWaalsContact OD1-CB 3.26Å; D114-H116 WeakPolarHBondContact OD1-CB 3.32Å; D114-H116 PolarHBondContact OD1-N 3.47Å; D114-A117 HydrophobicContact CB-CB 3.73Å; D114-A117 PolarHBondContact O-N 3.02Å; D114-A117 PolarHBondContact OD1-N 3.31Å; D114-L118 PolarHBondContact O-N 3.49Å | ||
| 115 | A | 80.1 | Confident | 78.9 | Confident | 71 Ų | 71 | 90.1 Ų | 90.1 | 59% | 0.587 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -55.3 | -27.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | F113 A119 | F113-A115 VanDerWaalsContact C-N 3.34Å; F113-A115 PolarHBondContact O-N 2.97Å; A115-A119 VanDerWaalsContact O-CB 3.24Å; A115-A119 WeakPolarHBondContact O-CB 3.21Å; A115-A119 PolarHBondContact O-N 2.93Å |
| 116 | H | 81 | Confident | 79.6 | Confident | 121 Ų | 121 | 83.8 Ų | 83.8 | 56% | 0.56 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -74.4 | -44.1 | 175.9 | -176.6 | 69.8 | 0 | 0 | 0 | 111.7 | D114 A119 M120 | D114-H116 PolarHBondContact O-N 3.03Å; D114-H116 VanDerWaalsContact O-N 3.11Å; D114-H116 WeakPolarHBondContact OD1-CA 3.42Å; D114-H116 VanDerWaalsContact OD1-CB 3.26Å; D114-H116 WeakPolarHBondContact OD1-CB 3.32Å; D114-H116 PolarHBondContact OD1-N 3.47Å; H116-A119 PolarHBondContact O-N 3.37Å; H116-M120 WeakPolarHBondContact O-CG 3.43Å; H116-M120 PolarHBondContact O-N 3.48Å |
| 117 | A | 82.5 | Confident | 80.4 | Confident | 39 Ų | 39 | 80 Ų | 80 | 32% | 0.322 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -59.9 | -47.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | D114 A119 M120 D121 | D114-A117 HydrophobicContact CB-CB 3.73Å; D114-A117 PolarHBondContact O-N 3.02Å; D114-A117 PolarHBondContact OD1-N 3.31Å; A117-A119 VanDerWaalsContact C-N 3.33Å; A117-A119 PolarHBondContact O-N 2.89Å; A117-M120 WeakPolarHBondContact O-CB 3.09Å; A117-M120 PolarHBondContact O-N 3.23Å; A117-M120 VanDerWaalsContact O-N 3.08Å; A117-D121 PolarHBondContact O-N 3.25Å |
| 118 | L | 85.9 | Confident | 81.5 | Confident | 64 Ų | 64 | 83.8 Ų | 83.8 | 34% | 0.335 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -56.3 | -45.4 | 173.6 | -84.7 | 153.2 | 0 | 0 | 0 | 112 | F113 D114 M120 D121 Y122 | F113-L118 HydrophobicContact CD1-CD1 3.71Å; F113-L118 HydrophobicContact CE1-CD1 3.89Å; D114-L118 PolarHBondContact O-N 3.49Å; L118-M120 VanDerWaalsContact C-N 3.3Å; L118-M120 PolarHBondContact O-N 2.92Å; L118-D121 PolarHBondContact O-N 2.69Å; L118-Y122 HydrophobicContact CD2-CE2 4.18Å; L118-Y122 WeakPolarHBondContact O-CD2 3.46Å; L118-Y122 PolarHBondContact O-N 3.2Å |
| 119 | A | 88.9 | Confident | 82.9 | Confident | 54 Ų | 54 | 86.7 Ų | 86.7 | 45% | 0.446 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -63.7 | -35.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | A115 H116 A117 R123 | A115-A119 VanDerWaalsContact O-CB 3.24Å; A115-A119 WeakPolarHBondContact O-CB 3.21Å; A115-A119 PolarHBondContact O-N 2.93Å; H116-A119 PolarHBondContact O-N 3.37Å; A117-A119 VanDerWaalsContact C-N 3.33Å; A117-A119 PolarHBondContact O-N 2.89Å; A119-R123 VanDerWaalsContact O-CB 3.29Å; A119-R123 WeakPolarHBondContact O-CB 3.48Å; A119-R123 PolarHBondContact O-N 3.27Å |
| 120 | M | 88 | Confident | 84.4 | Confident | 46 Ų | 46 | 87.4 Ų | 87.4 | 23% | 0.227 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -66 | -43.9 | 174.2 | -64.2 | -89.8 | 76 | 0 | 0 | 111.1 | H116 A117 L118 R123 S124 | H116-M120 WeakPolarHBondContact O-CG 3.43Å; H116-M120 PolarHBondContact O-N 3.48Å; A117-M120 WeakPolarHBondContact O-CB 3.09Å; A117-M120 PolarHBondContact O-N 3.23Å; A117-M120 VanDerWaalsContact O-N 3.08Å; L118-M120 VanDerWaalsContact C-N 3.3Å; L118-M120 PolarHBondContact O-N 2.92Å; M120-R123 CarbonylContact O-C 3.59Å; M120-R123 PolarHBondContact O-N 2.94Å; M120-S124 PolarHBondContact O-N 3.44Å |
| 121 | D | 88.7 | Confident | 86.1 | Confident | 97 Ų | 97 | 82.9 Ų | 82.9 | 52% | 0.519 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -63.3 | -45.6 | 177.2 | -67.1 | -20.8 | 0 | 0 | 0 | 112 | A117 L118 R123 S124 L125 | A117-D121 PolarHBondContact O-N 3.25Å; L118-D121 PolarHBondContact O-N 2.69Å; D121-R123 VanDerWaalsContact C-N 3.26Å; D121-R123 PolarHBondContact O-N 2.86Å; D121-S124 PolarHBondContact O-N 2.91Å; D121-S124 PolarHBondContact O-OG 2.99Å; D121-L125 VanDerWaalsContact O-CB 3.29Å; D121-L125 WeakPolarHBondContact O-CB 3.45Å; D121-L125 PolarHBondContact O-N 2.91Å |
| 122 | Y | 92.9 | Very high | 88 | Confident | 163 Ų | 163 | 83.5 Ų | 83.5 | 64% | 0.639 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -62.4 | -37 | 174.9 | -82.5 | -67.3 | 0 | 0 | 0 | 111.7 | L118 G126 | L118-Y122 HydrophobicContact CD2-CE2 4.18Å; L118-Y122 WeakPolarHBondContact O-CD2 3.46Å; L118-Y122 PolarHBondContact O-N 3.2Å; Y122-G126 PolarHBondContact O-N 3.09Å |
| 123 | R | 92.9 | Very high | 89.9 | Confident | 158 Ų | 158 | 80 Ų | 80 | 60% | 0.596 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -71 | -30.9 | 176.8 | -162.4 | -165.8 | -110.6 | 147.3 | -1.3 | 112.4 | A119 M120 D121 F127 R165 | A119-R123 VanDerWaalsContact O-CB 3.29Å; A119-R123 WeakPolarHBondContact O-CB 3.48Å; A119-R123 PolarHBondContact O-N 3.27Å; M120-R123 CarbonylContact O-C 3.59Å; M120-R123 PolarHBondContact O-N 2.94Å; D121-R123 VanDerWaalsContact C-N 3.26Å; D121-R123 PolarHBondContact O-N 2.86Å; R123-F127 PolarHBondContact O-N 3.32Å; R123-R165 VanDerWaalsContact C-NH2 3.28Å; R123-R165 PolarHBondContact O-NH2 3.41Å |
| 124 | S | 93 | Very high | 91.4 | Very high | 14 Ų | 14 | 74.3 Ų | 74.3 | 10% | 0.098 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -77 | -40.2 | 175.9 | 67.4 | 0 | 0 | 0 | 0 | 111.1 | M120 D121 F127 R128 E166 | M120-S124 PolarHBondContact O-N 3.44Å; D121-S124 PolarHBondContact O-N 2.91Å; D121-S124 PolarHBondContact O-OG 2.99Å; S124-F127 PolarHBondContact O-N 3.26Å; S124-R128 PolarHBondContact O-N 3.3Å; S124-R128 VanDerWaalsContact O-N 3.11Å; S124-E166 WeakPolarHBondContact CB-OE1 3.4Å |
| 125 | L | 94.1 | Very high | 92.4 | Very high | 64 Ų | 64 | 73 Ų | 73 | 34% | 0.335 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -58.2 | -54 | 173.1 | 178.3 | 60.9 | 0 | 0 | 0 | 111.7 | D121 F127 R128 E129 | D121-L125 VanDerWaalsContact O-CB 3.29Å; D121-L125 WeakPolarHBondContact O-CB 3.45Å; D121-L125 PolarHBondContact O-N 2.91Å; L125-F127 VanDerWaalsContact C-N 3.26Å; L125-F127 PolarHBondContact O-N 3.26Å; L125-R128 WeakPolarHBondContact O-CB 3.37Å; L125-R128 PolarHBondContact O-N 3.1Å; L125-E129 PolarHBondContact O-N 3.36Å |
| 126 | G | 96.5 | Very high | 93.3 | Very high | 31 Ų | 31 | 74 Ų | 74 | 32% | 0.32 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.2 | -31 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y122 C130 | Y122-G126 PolarHBondContact O-N 3.09Å; G126-C130 WeakPolarHBondContact O-CB 3.35Å; G126-C130 PolarHBondContact O-N 2.94Å |
| 127 | F | 96.8 | Very high | 94.1 | Very high | 48 Ų | 48 | 73.2 Ų | 73.2 | 21% | 0.211 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -66.1 | -42.9 | 173 | -175.1 | -88.4 | 0 | 0 | 0 | 111.7 | R123 S124 L125 C130 L131 L158 Y161 A162 | R123-F127 PolarHBondContact O-N 3.32Å; S124-F127 PolarHBondContact O-N 3.26Å; L125-F127 VanDerWaalsContact C-N 3.26Å; L125-F127 PolarHBondContact O-N 3.26Å; F127-C130 PolarHBondContact O-N 3.21Å; F127-L131 HydrophobicContact CE1-CD1 4.27Å; F127-L131 WeakPolarHBondContact O-CB 3.38Å; F127-L131 PolarHBondContact O-N 3.35Å; F127-L158 HydrophobicContact CZ-CB 4.49Å; F127-L158 HydrophobicContact CZ-CD2 4.1Å; F127-Y161 HydrophobicContact CE1-CD1 4.42Å; F127-Y161 AromaticContact CE2-CD1 3.98Å; F127-Y161 HydrophobicContact CE2-CD1 3.98Å; F127-Y161 HydrophobicContact CE2-CE1 4.18Å; F127-Y161 AromaticContact CZ-CD1 3.68Å; F127-Y161 HydrophobicContact CZ-CD1 3.68Å; F127-Y161 HydrophobicContact CZ-CE1 4.34Å; F127-A162 HydrophobicContact CD1-CB 3.87Å; F127-A162 HydrophobicContact CE1-CB 3.72Å |
| 128 | R | 95.9 | Very high | 94.8 | Very high | 141 Ų | 141 | 72.2 Ų | 72.2 | 53% | 0.532 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -66.4 | -38.8 | 179.1 | -175.5 | 172.2 | 57 | -106.5 | 2 | 112 | S124 L125 L131 A132 | S124-R128 PolarHBondContact O-N 3.3Å; S124-R128 VanDerWaalsContact O-N 3.11Å; L125-R128 WeakPolarHBondContact O-CB 3.37Å; L125-R128 PolarHBondContact O-N 3.1Å; R128-L131 PolarHBondContact O-N 3.39Å; R128-A132 WeakPolarHBondContact O-CB 3.41Å; R128-A132 PolarHBondContact O-N 3.26Å |
| 129 | E | 97.8 | Very high | 95.3 | Very high | 120 Ų | 120 | 71.2 Ų | 71.2 | 56% | 0.561 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -62.7 | -46.4 | 172.8 | -69.8 | 176.4 | 161.2 | 0 | 0 | 111.3 | L125 L131 A132 E133 | L125-E129 PolarHBondContact O-N 3.36Å; E129-L131 VanDerWaalsContact C-N 3.35Å; E129-L131 PolarHBondContact O-N 3.45Å; E129-A132 PolarHBondContact O-N 2.68Å; E129-E133 WeakPolarHBondContact O-CB 3.34Å; E129-E133 PolarHBondContact O-N 2.89Å |
| 130 | C | 98 | Very high | 95.7 | Very high | 76 Ų | 76 | 73.9 Ų | 73.9 | 51% | 0.514 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -59.5 | -44 | 175.3 | 179.8 | 0 | 0 | 0 | 0 | 112 | G126 F127 E133 V134 | G126-C130 WeakPolarHBondContact O-CB 3.35Å; G126-C130 PolarHBondContact O-N 2.94Å; F127-C130 PolarHBondContact O-N 3.21Å; C130-E133 PolarHBondContact O-N 3.07Å; C130-V134 WeakPolarHBondContact O-CG2 3.22Å; C130-V134 PolarHBondContact O-N 3.3Å |
| 131 | L | 97.6 | Very high | 96 | Very high | 17 Ų | 17 | 76.3 Ų | 76.3 | 9% | 0.089 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -60.3 | -47.5 | 176.1 | -176.2 | 167.1 | 0 | 0 | 0 | 111.6 | F127 R128 E129 E133 V134 A135 V155 L158 N159 | F127-L131 HydrophobicContact CE1-CD1 4.27Å; F127-L131 WeakPolarHBondContact O-CB 3.38Å; F127-L131 PolarHBondContact O-N 3.35Å; R128-L131 PolarHBondContact O-N 3.39Å; E129-L131 VanDerWaalsContact C-N 3.35Å; E129-L131 PolarHBondContact O-N 3.45Å; L131-E133 PolarHBondContact O-N 3.03Å; L131-V134 WeakPolarHBondContact O-CB 3.42Å; L131-V134 PolarHBondContact O-N 3.48Å; L131-A135 PolarHBondContact O-N 2.98Å; L131-V155 HydrophobicContact CD2-CG1 4.33Å; L131-L158 HydrophobicContact CD1-CB 3.58Å; L131-L158 HydrophobicContact CG-CB 3.86Å; L131-L158 HydrophobicContact CG-CD1 4.39Å; L131-N159 HydrophobicContact CD1-CB 4.37Å |
| 132 | A | 97.6 | Very high | 96.3 | Very high | 57 Ų | 57 | 76.4 Ų | 76.4 | 47% | 0.471 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -58.8 | -40.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | R128 E129 A135 R136 | R128-A132 WeakPolarHBondContact O-CB 3.41Å; R128-A132 PolarHBondContact O-N 3.26Å; E129-A132 PolarHBondContact O-N 2.68Å; A132-A135 PolarHBondContact O-N 3.03Å; A132-R136 WeakPolarHBondContact O-CB 3.34Å; A132-R136 PolarHBondContact O-N 3.42Å |
| 133 | E | 98.3 | Very high | 96.4 | Very high | 90 Ų | 90 | 71.4 Ų | 71.4 | 42% | 0.421 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -67.2 | -39.2 | 176.6 | -175.6 | 58.4 | -165.5 | 0 | 0 | 112.6 | E129 C130 L131 A135 R136 Y137 | E129-E133 WeakPolarHBondContact O-CB 3.34Å; E129-E133 PolarHBondContact O-N 2.89Å; C130-E133 PolarHBondContact O-N 3.07Å; L131-E133 PolarHBondContact O-N 3.03Å; E133-A135 PolarHBondContact O-N 3.23Å; E133-R136 VanDerWaalsContact CD-NE 3.35Å; E133-R136 WeakPolarHBondContact O-CB 3.4Å; E133-R136 PolarHBondContact O-N 3.38Å; E133-R136 IonicContact OE1-CZ 3.63Å; E133-R136 VanDerWaalsContact OE1-CZ 3.3Å; E133-R136 IonicContact OE1-NE 3.22Å; E133-R136 PolarHBondContact OE1-NE 3.13Å; E133-R136 IonicContact OE1-NH2 3.44Å; E133-R136 PolarHBondContact OE1-NH2 3.31Å; E133-R136 IonicContact OE2-CZ 2.63Å; E133-R136 IonicContact OE2-NE 2.79Å; E133-R136 PolarHBondContact OE2-NE 3.25Å; E133-R136 IonicContact OE2-NH2 3.39Å; E133-Y137 VanDerWaalsContact O-CB 3.31Å; E133-Y137 WeakPolarHBondContact O-CB 3.46Å; E133-Y137 PolarHBondContact O-N 3.1Å |
| 134 | V | 98 | Very high | 96.5 | Very high | 42 Ų | 42 | 65.8 Ų | 65.8 | 26% | 0.255 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -59.3 | -47.2 | 171.4 | 169 | 0 | 0 | 0 | 0 | 110.5 | C130 L131 R136 Y137 L138 L154 L158 | C130-V134 WeakPolarHBondContact O-CG2 3.22Å; C130-V134 PolarHBondContact O-N 3.3Å; L131-V134 WeakPolarHBondContact O-CB 3.42Å; L131-V134 PolarHBondContact O-N 3.48Å; V134-R136 VanDerWaalsContact C-N 3.3Å; V134-R136 PolarHBondContact O-N 3.48Å; V134-Y137 PolarHBondContact O-N 3.43Å; V134-L138 HydrophobicContact CG1-CD1 4.28Å; V134-L138 VanDerWaalsContact O-CG 3.31Å; V134-L138 WeakPolarHBondContact O-CG 3.5Å; V134-L138 PolarHBondContact O-N 3.13Å; V134-L154 HydrophobicContact CG1-CD2 3.95Å; V134-L158 HydrophobicContact CG1-CD1 4.16Å |
| 135 | A | 97 | Very high | 96.5 | Very high | 19 Ų | 19 | 70 Ų | 70 | 16% | 0.157 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -61.6 | -40.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L131 A132 E133 S139 R151 V155 | L131-A135 PolarHBondContact O-N 2.98Å; A132-A135 PolarHBondContact O-N 3.03Å; E133-A135 PolarHBondContact O-N 3.23Å; A135-S139 PolarHBondContact O-N 2.95Å; A135-S139 PolarHBondContact O-OG 3.32Å; A135-R151 PolarHBondContact O-NH2 2.9Å; A135-V155 HydrophobicContact CB-CG2 3.92Å |
| 136 | R | 97.7 | Very high | 96.3 | Very high | 93 Ų | 93 | 70.2 Ų | 70.2 | 35% | 0.351 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -64.8 | -47.5 | 175.9 | -168.3 | -162.7 | 69.3 | 72.3 | 0.4 | 111.6 | A132 E133 V134 L138 S139 I140 | A132-R136 WeakPolarHBondContact O-CB 3.34Å; A132-R136 PolarHBondContact O-N 3.42Å; E133-R136 VanDerWaalsContact CD-NE 3.35Å; E133-R136 WeakPolarHBondContact O-CB 3.4Å; E133-R136 PolarHBondContact O-N 3.38Å; E133-R136 IonicContact OE1-CZ 3.63Å; E133-R136 VanDerWaalsContact OE1-CZ 3.3Å; E133-R136 IonicContact OE1-NE 3.22Å; E133-R136 PolarHBondContact OE1-NE 3.13Å; E133-R136 IonicContact OE1-NH2 3.44Å; E133-R136 PolarHBondContact OE1-NH2 3.31Å; E133-R136 IonicContact OE2-CZ 2.63Å; E133-R136 IonicContact OE2-NE 2.79Å; E133-R136 PolarHBondContact OE2-NE 3.25Å; E133-R136 IonicContact OE2-NH2 3.39Å; V134-R136 VanDerWaalsContact C-N 3.3Å; V134-R136 PolarHBondContact O-N 3.48Å; R136-L138 PolarHBondContact O-N 3.06Å; R136-S139 WeakPolarHBondContact O-CB 3.45Å; R136-S139 PolarHBondContact O-N 3.05Å; R136-I140 HydrophobicContact CG-CD1 3.67Å; R136-I140 HydrophobicContact CG-CG1 4.25Å; R136-I140 PolarHBondContact O-N 2.87Å |
| 137 | Y | 98.1 | Very high | 96.3 | Very high | 104 Ų | 104 | 73 Ų | 73 | 41% | 0.408 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -57.1 | -48.4 | 178.4 | 178.9 | -87.3 | 0 | 0 | 0 | 111.1 | E133 V134 S139 I140 I141 E142 | E133-Y137 VanDerWaalsContact O-CB 3.31Å; E133-Y137 WeakPolarHBondContact O-CB 3.46Å; E133-Y137 PolarHBondContact O-N 3.1Å; V134-Y137 PolarHBondContact O-N 3.43Å; Y137-S139 PolarHBondContact O-N 3.06Å; Y137-I140 PolarHBondContact O-N 3.27Å; Y137-I141 HydrophobicContact CD2-CB 3.89Å; Y137-I141 HydrophobicContact CD2-CG1 3.64Å; Y137-I141 HydrophobicContact CD2-CG2 4.27Å; Y137-I141 HydrophobicContact CE1-CB 4.47Å; Y137-I141 HydrophobicContact CE2-CB 3.77Å; Y137-I141 HydrophobicContact CE2-CG1 3.85Å; Y137-I141 HydrophobicContact CE2-CG2 3.62Å; Y137-I141 HydrophobicContact CG-CB 4.29Å; Y137-I141 HydrophobicContact CG-CG1 4.27Å; Y137-I141 WeakPolarHBondContact O-CA 3.2Å; Y137-I141 WeakPolarHBondContact O-CB 3.33Å; Y137-I141 PolarHBondContact O-N 2.71Å; Y137-E142 HydrophobicContact CD1-CG 4Å; Y137-E142 HydrophobicContact CE1-CG 3.5Å; Y137-E142 WeakPolarHBondContact CE1-OE1 3.16Å; Y137-E142 VanDerWaalsContact CZ-OE1 3.25Å; Y137-E142 PolarHBondContact O-N 3.09Å; Y137-E142 PolarHBondContact OH-OE1 2.92Å |
| 138 | L | 97.3 | Very high | 96.3 | Very high | 19 Ų | 19 | 72.7 Ų | 72.7 | 10% | 0.099 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -61.3 | -31.6 | 176.3 | -66.4 | 178.3 | 0 | 0 | 0 | 112.9 | V134 R136 E142 G143 L144 R151 L154 | V134-L138 HydrophobicContact CG1-CD1 4.28Å; V134-L138 VanDerWaalsContact O-CG 3.31Å; V134-L138 WeakPolarHBondContact O-CG 3.5Å; V134-L138 PolarHBondContact O-N 3.13Å; R136-L138 PolarHBondContact O-N 3.06Å; L138-E142 HydrophobicContact CD2-CG 4.2Å; L138-G143 PolarHBondContact O-N 3.41Å; L138-L144 HydrophobicContact CB-CD1 4.39Å; L138-L144 HydrophobicContact CD2-CD1 4Å; L138-L144 WeakPolarHBondContact O-CB 3.39Å; L138-L144 PolarHBondContact O-N 2.8Å; L138-R151 HydrophobicContact CB-CG 4.27Å; L138-R151 HydrophobicContact CD1-CB 4.23Å; L138-R151 HydrophobicContact CD1-CG 3.99Å; L138-L154 HydrophobicContact CD1-CD2 4.18Å |
| 139 | S | 96.5 | Very high | 96.3 | Very high | 42 Ų | 42 | 70.1 Ų | 70.1 | 29% | 0.294 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -75.4 | -51.5 | 177.6 | -39.5 | 0 | 0 | 0 | 0 | 112.6 | A135 R136 Y137 G143 R151 | A135-S139 PolarHBondContact O-N 2.95Å; A135-S139 PolarHBondContact O-OG 3.32Å; R136-S139 WeakPolarHBondContact O-CB 3.45Å; R136-S139 PolarHBondContact O-N 3.05Å; Y137-S139 PolarHBondContact O-N 3.06Å; S139-G143 WeakPolarHBondContact O-CA 3.47Å; S139-G143 PolarHBondContact O-N 3.47Å; S139-R151 VanDerWaalsContact CB-NH1 3.25Å; S139-R151 PolarHBondContact OG-NH1 2.97Å; S139-R151 PolarHBondContact OG-NH2 3.49Å |
| 140 | I | 96.8 | Very high | 96.2 | Very high | 111 Ų | 111 | 69.3 Ų | 69.3 | 57% | 0.569 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -93 | -38.9 | -162.8 | -59.8 | -173.9 | 0 | 0 | 0 | 110.7 | R136 Y137 | R136-I140 HydrophobicContact CG-CD1 3.67Å; R136-I140 HydrophobicContact CG-CG1 4.25Å; R136-I140 PolarHBondContact O-N 2.87Å; Y137-I140 PolarHBondContact O-N 3.27Å |
| 141 | I | 95.2 | Very high | 96.2 | Very high | 96 Ų | 96 | 67.7 Ų | 67.7 | 49% | 0.492 | 39% | 0.386 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.6 | -50.8 | -174.8 | -52.7 | -57.5 | 0 | 0 | 0 | 110.3 | Y137 G143 | Y137-I141 HydrophobicContact CD2-CB 3.89Å; Y137-I141 HydrophobicContact CD2-CG1 3.64Å; Y137-I141 HydrophobicContact CD2-CG2 4.27Å; Y137-I141 HydrophobicContact CE1-CB 4.47Å; Y137-I141 HydrophobicContact CE2-CB 3.77Å; Y137-I141 HydrophobicContact CE2-CG1 3.85Å; Y137-I141 HydrophobicContact CE2-CG2 3.62Å; Y137-I141 HydrophobicContact CG-CB 4.29Å; Y137-I141 HydrophobicContact CG-CG1 4.27Å; Y137-I141 WeakPolarHBondContact O-CA 3.2Å; Y137-I141 WeakPolarHBondContact O-CB 3.33Å; Y137-I141 PolarHBondContact O-N 2.71Å; I141-G143 VanDerWaalsContact C-N 3.32Å |
| 142 | E | 95 | Very high | 96.2 | Very high | 99 Ų | 99 | 70.6 Ų | 70.6 | 46% | 0.463 | 40% | 0.404 | S | S | . | . | S | Bend | trans | -82.5 | -12 | 179.7 | -57.5 | -63.2 | 147 | 0 | 0 | 112.8 | Y137 L138 L144 | Y137-E142 HydrophobicContact CD1-CG 4Å; Y137-E142 HydrophobicContact CE1-CG 3.5Å; Y137-E142 WeakPolarHBondContact CE1-OE1 3.16Å; Y137-E142 VanDerWaalsContact CZ-OE1 3.25Å; Y137-E142 PolarHBondContact O-N 3.09Å; Y137-E142 PolarHBondContact OH-OE1 2.92Å; L138-E142 HydrophobicContact CD2-CG 4.2Å; E142-L144 HydrophobicContact CB-CD1 4.41Å; E142-L144 HydrophobicContact CB-CG 3.94Å; E142-L144 PolarHBondContact O-N 3.41Å |
| 143 | G | 94.7 | Very high | 96.2 | Very high | 59 Ų | 59 | 76.5 Ų | 76.5 | 61% | 0.608 | 41% | 0.414 | S | S | * | . | trans | 66 | 18.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | L138 S139 I141 D145 | L138-G143 PolarHBondContact O-N 3.41Å; S139-G143 WeakPolarHBondContact O-CA 3.47Å; S139-G143 PolarHBondContact O-N 3.47Å; I141-G143 VanDerWaalsContact C-N 3.32Å; G143-D145 PolarHBondContact O-N 3.12Å | ||
| 144 | L | 95.2 | Very high | 96.2 | Very high | 40 Ų | 40 | 75.3 Ų | 75.3 | 21% | 0.209 | 41% | 0.411 | C | S | . | . | trans | -73.8 | 122.8 | -179.3 | -58.6 | -177.4 | 0 | 0 | 0 | 110.4 | L138 E142 D148 L150 R151 | L138-L144 HydrophobicContact CB-CD1 4.39Å; L138-L144 HydrophobicContact CD2-CD1 4Å; L138-L144 WeakPolarHBondContact O-CB 3.39Å; L138-L144 PolarHBondContact O-N 2.8Å; E142-L144 HydrophobicContact CB-CD1 4.41Å; E142-L144 HydrophobicContact CB-CG 3.94Å; E142-L144 PolarHBondContact O-N 3.41Å; L144-D148 HydrophobicContact CB-CB 4.04Å; L144-L150 HydrophobicContact CD1-CD2 4.33Å; L144-R151 HydrophobicContact CB-CB 4.39Å; L144-R151 HydrophobicContact CD1-CB 4.35Å; L144-R151 PolarHBondContact O-NH1 3.02Å | ||
| 145 | D | 92.4 | Very high | 96.1 | Very high | 102 Ų | 102 | 74.7 Ų | 74.7 | 55% | 0.545 | 41% | 0.407 | S | S | . | . | trans | -59.7 | 157 | 174.5 | -178.9 | 39.3 | 0 | 0 | 0 | 111.6 | G143 S147 D148 R151 | G143-D145 PolarHBondContact O-N 3.12Å; D145-S147 PolarHBondContact O-N 3.39Å; D145-S147 VanDerWaalsContact O-N 3.16Å; D145-S147 WeakPolarHBondContact OD2-CB 3.48Å; D145-S147 PolarHBondContact OD2-N 3.01Å; D145-S147 PolarHBondContact OD2-OG 3.41Å; D145-D148 VanDerWaalsContact O-CB 3.23Å; D145-D148 WeakPolarHBondContact O-CB 3.43Å; D145-D148 PolarHBondContact O-N 3.43Å; D145-R151 WeakPolarHBondContact O-CD 3.42Å | ||
| 146 | A | 90.8 | Very high | 96.2 | Very high | 68 Ų | 68 | 76.7 Ų | 76.7 | 56% | 0.562 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58 | -26.6 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | V152 | A146-V152 WeakPolarHBondContact O-CG2 3.49Š|
| 147 | S | 94.9 | Very high | 96.2 | Very high | 90 Ų | 90 | 78 Ų | 78 | 63% | 0.629 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86 | -4.8 | 177.3 | 70.3 | 0 | 0 | 0 | 0 | 114.4 | D145 | D145-S147 PolarHBondContact O-N 3.39Å; D145-S147 VanDerWaalsContact O-N 3.16Å; D145-S147 WeakPolarHBondContact OD2-CB 3.48Å; D145-S147 PolarHBondContact OD2-N 3.01Å; D145-S147 PolarHBondContact OD2-OG 3.41Å |
| 148 | D | 97.6 | Very high | 96.2 | Very high | 41 Ų | 41 | 74.8 Ų | 74.8 | 22% | 0.219 | 42% | 0.419 | C | S | . | . | trans | -61.1 | 127.7 | -177.7 | 176.8 | -88.1 | 0 | 0 | 0 | 111.3 | L144 D145 L150 R151 V152 | L144-D148 HydrophobicContact CB-CB 4.04Å; D145-D148 VanDerWaalsContact O-CB 3.23Å; D145-D148 WeakPolarHBondContact O-CB 3.43Å; D145-D148 PolarHBondContact O-N 3.43Å; D148-L150 VanDerWaalsContact C-N 3.28Å; D148-L150 PolarHBondContact O-N 2.63Å; D148-L150 WeakPolarHBondContact OD1-CA 3.4Å; D148-L150 VanDerWaalsContact OD1-CB 3.25Å; D148-L150 WeakPolarHBondContact OD1-CB 3.42Å; D148-L150 PolarHBondContact OD1-N 3.18Å; D148-R151 HydrophobicContact CB-CB 4.06Å; D148-R151 PolarHBondContact O-N 3.39Å; D148-R151 PolarHBondContact OD1-N 3.4Å; D148-V152 WeakPolarHBondContact O-CB 3.43Å; D148-V152 VanDerWaalsContact O-CG2 3.31Å; D148-V152 WeakPolarHBondContact O-CG2 3.29Å; D148-V152 PolarHBondContact O-N 3.22Å | ||
| 149 | P | 96.3 | Very high | 96.1 | Very high | 87 Ų | 87 | 77.5 Ų | 77.5 | 57% | 0.565 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -66.1 | -28.3 | -172.8 | 25.5 | -35.2 | 0 | 0 | 0 | 113.4 | R153 | P149-R153 WeakPolarHBondContact O-CB 3.38Å; P149-R153 PolarHBondContact O-N 3.1Å; P149-R153 VanDerWaalsContact O-N 3.16Å |
| 150 | L | 96.2 | Very high | 96.1 | Very high | 104 Ų | 104 | 80.2 Ų | 80.2 | 55% | 0.545 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -71.8 | -48.7 | 176.4 | 171 | 65.5 | 0 | 0 | 0 | 109.8 | L144 D148 R153 L154 | L144-L150 HydrophobicContact CD1-CD2 4.33Å; D148-L150 VanDerWaalsContact C-N 3.28Å; D148-L150 PolarHBondContact O-N 2.63Å; D148-L150 WeakPolarHBondContact OD1-CA 3.4Å; D148-L150 VanDerWaalsContact OD1-CB 3.25Å; D148-L150 WeakPolarHBondContact OD1-CB 3.42Å; D148-L150 PolarHBondContact OD1-N 3.18Å; L150-R153 PolarHBondContact O-N 2.91Å; L150-L154 WeakPolarHBondContact O-CB 3.47Å; L150-L154 PolarHBondContact O-N 2.89Å |
| 151 | R | 96.4 | Very high | 96 | Very high | 42 Ų | 42 | 80.5 Ų | 80.5 | 16% | 0.158 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -58.5 | -51.5 | 177.5 | -177.9 | -156.3 | 174.3 | 103.3 | 7.4 | 111.7 | A135 L138 S139 L144 D145 D148 R153 L154 V155 | A135-R151 PolarHBondContact O-NH2 2.9Å; L138-R151 HydrophobicContact CB-CG 4.27Å; L138-R151 HydrophobicContact CD1-CB 4.23Å; L138-R151 HydrophobicContact CD1-CG 3.99Å; S139-R151 VanDerWaalsContact CB-NH1 3.25Å; S139-R151 PolarHBondContact OG-NH1 2.97Å; S139-R151 PolarHBondContact OG-NH2 3.49Å; L144-R151 HydrophobicContact CB-CB 4.39Å; L144-R151 HydrophobicContact CD1-CB 4.35Å; L144-R151 PolarHBondContact O-NH1 3.02Å; D145-R151 WeakPolarHBondContact O-CD 3.42Å; D148-R151 HydrophobicContact CB-CB 4.06Å; D148-R151 PolarHBondContact O-N 3.39Å; D148-R151 PolarHBondContact OD1-N 3.4Å; R151-R153 VanDerWaalsContact C-N 3.32Å; R151-R153 PolarHBondContact O-N 3.04Å; R151-L154 PolarHBondContact O-N 3.34Å; R151-V155 HydrophobicContact CG-CG2 4.45Å; R151-V155 WeakPolarHBondContact O-CB 3.49Å; R151-V155 WeakPolarHBondContact O-CG2 3.4Å; R151-V155 PolarHBondContact O-N 3.44Å |
| 152 | V | 97.6 | Very high | 95.9 | Very high | 78 Ų | 78 | 77 Ų | 77 | 47% | 0.473 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -58.7 | -45.6 | -179.7 | 171.8 | 0 | 0 | 0 | 0 | 110.5 | A146 D148 S156 | A146-V152 WeakPolarHBondContact O-CG2 3.49Å; D148-V152 WeakPolarHBondContact O-CB 3.43Å; D148-V152 VanDerWaalsContact O-CG2 3.31Å; D148-V152 WeakPolarHBondContact O-CG2 3.29Å; D148-V152 PolarHBondContact O-N 3.22Å; V152-S156 WeakPolarHBondContact O-CB 3.2Å; V152-S156 PolarHBondContact O-N 3.31Å |
| 153 | R | 98.1 | Very high | 95.8 | Very high | 180 Ų | 180 | 76 Ų | 76 | 68% | 0.679 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -64.9 | -46.7 | -179.4 | -171.3 | -174.3 | -57.1 | 162.8 | 3.3 | 112 | P149 L150 R151 H157 | P149-R153 WeakPolarHBondContact O-CB 3.38Å; P149-R153 PolarHBondContact O-N 3.1Å; P149-R153 VanDerWaalsContact O-N 3.16Å; L150-R153 PolarHBondContact O-N 2.91Å; R151-R153 VanDerWaalsContact C-N 3.32Å; R151-R153 PolarHBondContact O-N 3.04Å; R153-H157 VanDerWaalsContact O-CB 3.26Å; R153-H157 WeakPolarHBondContact O-CB 3.42Å; R153-H157 PolarHBondContact O-N 3.48Å |
| 154 | L | 97.8 | Very high | 95.6 | Very high | 66 Ų | 66 | 80 Ų | 80 | 35% | 0.346 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -66.6 | -49.7 | -177.7 | -177.8 | 59.9 | 0 | 0 | 0 | 111.6 | V134 L138 L150 R151 S156 H157 L158 | V134-L154 HydrophobicContact CG1-CD2 3.95Å; L138-L154 HydrophobicContact CD1-CD2 4.18Å; L150-L154 WeakPolarHBondContact O-CB 3.47Å; L150-L154 PolarHBondContact O-N 2.89Å; R151-L154 PolarHBondContact O-N 3.34Å; L154-S156 VanDerWaalsContact C-N 3.32Å; L154-S156 PolarHBondContact O-N 3.37Å; L154-H157 PolarHBondContact O-N 3Å; L154-L158 HydrophobicContact CD1-CD1 4.2Å; L154-L158 HydrophobicContact CD1-CG 4.26Å; L154-L158 HydrophobicContact CG-CD1 4.14Å; L154-L158 WeakPolarHBondContact O-CG 3.48Å; L154-L158 PolarHBondContact O-N 3Å |
| 155 | V | 97.4 | Very high | 95.2 | Very high | 29 Ų | 29 | 80.7 Ų | 80.7 | 18% | 0.176 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -64.1 | -39.7 | -179.6 | 174.7 | 0 | 0 | 0 | 0 | 110.9 | L131 A135 R151 N159 | L131-V155 HydrophobicContact CD2-CG1 4.33Å; A135-V155 HydrophobicContact CB-CG2 3.92Å; R151-V155 HydrophobicContact CG-CG2 4.45Å; R151-V155 WeakPolarHBondContact O-CB 3.49Å; R151-V155 WeakPolarHBondContact O-CG2 3.4Å; R151-V155 PolarHBondContact O-N 3.44Å; V155-N159 WeakPolarHBondContact O-CB 3.39Å; V155-N159 PolarHBondContact O-N 3Å; V155-N159 PolarHBondContact O-ND2 2.93Å |
| 156 | S | 97.8 | Very high | 94.8 | Very high | 60 Ų | 60 | 79.9 Ų | 79.9 | 42% | 0.42 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -63.8 | -44.5 | 174.5 | -178.8 | 0 | 0 | 0 | 0 | 111.8 | V152 L154 L158 N159 N160 | V152-S156 WeakPolarHBondContact O-CB 3.2Å; V152-S156 PolarHBondContact O-N 3.31Å; L154-S156 VanDerWaalsContact C-N 3.32Å; L154-S156 PolarHBondContact O-N 3.37Å; S156-L158 PolarHBondContact O-N 3.26Å; S156-N159 PolarHBondContact O-N 2.79Å; S156-N160 PolarHBondContact O-N 3.08Å; S156-N160 PolarHBondContact O-ND2 3.31Å; S156-N160 PolarHBondContact OG-ND2 3.41Å |
| 157 | H | 98.1 | Very high | 94.5 | Very high | 120 Ų | 120 | 80.2 Ų | 80.2 | 56% | 0.556 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -59.8 | -47.5 | 177.8 | 178.8 | 69.7 | 0 | 0 | 0 | 112 | R153 L154 N159 N160 Y161 | R153-H157 VanDerWaalsContact O-CB 3.26Å; R153-H157 WeakPolarHBondContact O-CB 3.42Å; R153-H157 PolarHBondContact O-N 3.48Å; L154-H157 PolarHBondContact O-N 3Å; H157-N159 VanDerWaalsContact C-N 3.34Å; H157-N159 PolarHBondContact O-N 3.19Å; H157-N160 PolarHBondContact O-N 3.37Å; H157-Y161 WeakPolarHBondContact O-CB 3.4Å; H157-Y161 PolarHBondContact O-N 3.46Å |
| 158 | L | 97.5 | Very high | 93.6 | Very high | 37 Ų | 37 | 78.8 Ų | 78.8 | 19% | 0.194 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -64.1 | -37.6 | 178.8 | -66.2 | 173.2 | 0 | 0 | 0 | 112.3 | F127 L131 V134 L154 S156 Y161 A162 | F127-L158 HydrophobicContact CZ-CB 4.49Å; F127-L158 HydrophobicContact CZ-CD2 4.1Å; L131-L158 HydrophobicContact CD1-CB 3.58Å; L131-L158 HydrophobicContact CG-CB 3.86Å; L131-L158 HydrophobicContact CG-CD1 4.39Å; V134-L158 HydrophobicContact CG1-CD1 4.16Å; L154-L158 HydrophobicContact CD1-CD1 4.2Å; L154-L158 HydrophobicContact CD1-CG 4.26Å; L154-L158 HydrophobicContact CG-CD1 4.14Å; L154-L158 WeakPolarHBondContact O-CG 3.48Å; L154-L158 PolarHBondContact O-N 3Å; S156-L158 PolarHBondContact O-N 3.26Å; L158-Y161 PolarHBondContact O-N 3.35Å; L158-A162 PolarHBondContact O-N 2.92Å |
| 159 | N | 96.3 | Very high | 92.4 | Very high | 76 Ų | 76 | 79.2 Ų | 79.2 | 41% | 0.406 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -66.6 | -42.2 | 176 | -87.2 | -61.3 | 0 | 0 | 0 | 112.5 | L131 V155 S156 H157 Y161 A162 S163 | L131-N159 HydrophobicContact CD1-CB 4.37Å; V155-N159 WeakPolarHBondContact O-CB 3.39Å; V155-N159 PolarHBondContact O-N 3Å; V155-N159 PolarHBondContact O-ND2 2.93Å; S156-N159 PolarHBondContact O-N 2.79Å; H157-N159 VanDerWaalsContact C-N 3.34Å; H157-N159 PolarHBondContact O-N 3.19Å; N159-Y161 VanDerWaalsContact C-N 3.34Å; N159-A162 PolarHBondContact O-N 3.17Å; N159-S163 PolarHBondContact O-N 3.48Å; N159-S163 PolarHBondContact O-OG 3.05Å |
| 160 | N | 96.4 | Very high | 90.7 | Very high | 100 Ų | 100 | 77.8 Ų | 77.8 | 54% | 0.535 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -64.2 | -42.1 | 175.2 | -80 | -70.7 | 0 | 0 | 0 | 111.1 | S156 H157 S163 Q164 | S156-N160 PolarHBondContact O-N 3.08Å; S156-N160 PolarHBondContact O-ND2 3.31Å; S156-N160 PolarHBondContact OG-ND2 3.41Å; H157-N160 PolarHBondContact O-N 3.37Å; N160-S163 PolarHBondContact O-N 3.27Å; N160-Q164 WeakPolarHBondContact O-CB 3.46Å; N160-Q164 PolarHBondContact O-N 3.09Å |
| 161 | Y | 94.9 | Very high | 88.7 | Confident | 116 Ų | 116 | 76 Ų | 76 | 46% | 0.455 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -62.5 | -43.6 | 176.1 | -175.9 | -101.5 | 0 | 0 | 0 | 112.2 | F127 H157 L158 N159 S163 Q164 R165 | F127-Y161 HydrophobicContact CE1-CD1 4.42Å; F127-Y161 AromaticContact CE2-CD1 3.98Å; F127-Y161 HydrophobicContact CE2-CD1 3.98Å; F127-Y161 HydrophobicContact CE2-CE1 4.18Å; F127-Y161 AromaticContact CZ-CD1 3.68Å; F127-Y161 HydrophobicContact CZ-CD1 3.68Å; F127-Y161 HydrophobicContact CZ-CE1 4.34Å; H157-Y161 WeakPolarHBondContact O-CB 3.4Å; H157-Y161 PolarHBondContact O-N 3.46Å; L158-Y161 PolarHBondContact O-N 3.35Å; N159-Y161 VanDerWaalsContact C-N 3.34Å; Y161-S163 PolarHBondContact O-N 3.33Å; Y161-Q164 PolarHBondContact O-N 3.3Å; Y161-R165 WeakPolarHBondContact O-CB 3.15Å; Y161-R165 PolarHBondContact O-N 2.92Å |
| 162 | A | 93.2 | Very high | 86.5 | Confident | 23 Ų | 23 | 81.6 Ų | 81.6 | 19% | 0.19 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -56 | -51.6 | 173 | 0 | 0 | 0 | 0 | 0 | 111.1 | F127 L158 N159 Q164 R165 E166 | F127-A162 HydrophobicContact CD1-CB 3.87Å; F127-A162 HydrophobicContact CE1-CB 3.72Å; L158-A162 PolarHBondContact O-N 2.92Å; N159-A162 PolarHBondContact O-N 3.17Å; A162-Q164 PolarHBondContact O-N 3.4Å; A162-R165 PolarHBondContact O-N 3.46Å; A162-E166 WeakPolarHBondContact O-CG 3.44Å; A162-E166 PolarHBondContact O-N 3.37Å |
| 163 | S | 91.9 | Very high | 84.3 | Confident | 77 Ų | 77 | 82.1 Ų | 82.1 | 54% | 0.538 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -61.7 | -42.1 | -177.2 | -55.7 | 0 | 0 | 0 | 0 | 112.4 | N159 N160 Y161 R165 E166 A167 | N159-S163 PolarHBondContact O-N 3.48Å; N159-S163 PolarHBondContact O-OG 3.05Å; N160-S163 PolarHBondContact O-N 3.27Å; Y161-S163 PolarHBondContact O-N 3.33Å; S163-R165 VanDerWaalsContact C-N 3.33Å; S163-R165 PolarHBondContact O-N 3.41Å; S163-E166 PolarHBondContact O-N 2.92Å; S163-A167 PolarHBondContact O-N 3.07Å; S163-A167 VanDerWaalsContact O-N 3.15Å |
| 164 | Q | 90.7 | Very high | 82 | Confident | 144 Ų | 144 | 76.4 Ų | 76.4 | 67% | 0.673 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -65.8 | -37.4 | 178 | -172.1 | 171.8 | 83.5 | 0 | 0 | 111.9 | N160 Y161 A162 A167 A168 | N160-Q164 WeakPolarHBondContact O-CB 3.46Å; N160-Q164 PolarHBondContact O-N 3.09Å; Y161-Q164 PolarHBondContact O-N 3.3Å; A162-Q164 PolarHBondContact O-N 3.4Å; Q164-A167 PolarHBondContact O-N 2.83Å; Q164-A168 PolarHBondContact O-N 3.39Å; Q164-A168 VanDerWaalsContact O-N 3.11Å |
| 165 | R | 86.9 | Confident | 79.6 | Confident | 55 Ų | 55 | 80.5 Ų | 80.5 | 21% | 0.208 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -68.7 | -40.4 | 177.6 | -179.5 | 175.2 | 151.1 | -150.5 | -24.4 | 112.5 | R123 Y161 A162 S163 A167 A168 S169 | R123-R165 VanDerWaalsContact C-NH2 3.28Å; R123-R165 PolarHBondContact O-NH2 3.41Å; Y161-R165 WeakPolarHBondContact O-CB 3.15Å; Y161-R165 PolarHBondContact O-N 2.92Å; A162-R165 PolarHBondContact O-N 3.46Å; S163-R165 VanDerWaalsContact C-N 3.33Å; S163-R165 PolarHBondContact O-N 3.41Å; R165-A167 VanDerWaalsContact C-N 3.35Å; R165-A168 PolarHBondContact O-N 3.49Å; R165-S169 WeakPolarHBondContact O-CB 3.46Å; R165-S169 PolarHBondContact O-N 3.17Å; R165-S169 VanDerWaalsContact O-N 3.08Å; R165-S169 PolarHBondContact O-OG 2.87Å |
| 166 | E | 84.5 | Confident | 77.1 | Confident | 84 Ų | 84 | 82.6 Ų | 82.6 | 39% | 0.393 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.4 | -42.4 | 175.4 | -63.1 | -51.6 | 115 | 0 | 0 | 111.2 | S124 A162 S163 A168 S169 G170 | S124-E166 WeakPolarHBondContact CB-OE1 3.4Å; A162-E166 WeakPolarHBondContact O-CG 3.44Å; A162-E166 PolarHBondContact O-N 3.37Å; S163-E166 PolarHBondContact O-N 2.92Å; E166-A168 PolarHBondContact O-N 3.43Å; E166-S169 PolarHBondContact O-N 3.25Å; E166-G170 PolarHBondContact O-N 2.89Å |
| 167 | A | 83.2 | Confident | 74.4 | Confident | 75 Ų | 75 | 87.3 Ų | 87.3 | 62% | 0.62 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.8 | -38.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | S163 Q164 R165 | S163-A167 PolarHBondContact O-N 3.07Å; S163-A167 VanDerWaalsContact O-N 3.15Å; Q164-A167 PolarHBondContact O-N 2.83Å; R165-A167 VanDerWaalsContact C-N 3.35Å |
| 168 | A | 77.9 | Confident | 71.9 | Confident | 61 Ų | 61 | 88.8 Ų | 88.8 | 50% | 0.504 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -71.6 | -31.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q164 R165 E166 | Q164-A168 PolarHBondContact O-N 3.39Å; Q164-A168 VanDerWaalsContact O-N 3.11Å; R165-A168 PolarHBondContact O-N 3.49Å; E166-A168 PolarHBondContact O-N 3.43Å |
| 169 | S | 71.1 | Confident | 69.4 | Low | 50 Ų | 50 | 91.5 Ų | 91.5 | 35% | 0.35 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -74.6 | -31.3 | -178.1 | -53.7 | 0 | 0 | 0 | 0 | 112.2 | R165 E166 A171 | R165-S169 WeakPolarHBondContact O-CB 3.46Å; R165-S169 PolarHBondContact O-N 3.17Å; R165-S169 VanDerWaalsContact O-N 3.08Å; R165-S169 PolarHBondContact O-OG 2.87Å; E166-S169 PolarHBondContact O-N 3.25Å; S169-A171 VanDerWaalsContact C-N 3.31Å; S169-A171 PolarHBondContact O-N 3.02Å |
| 170 | G | 61.3 | Low | 67.4 | Low | 57 Ų | 57 | 100 Ų | 100 | 59% | 0.588 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -69 | -22.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | E166 | E166-G170 PolarHBondContact O-N 2.89Å |
| 171 | A | 54.5 | Low | 65 | Low | 65 Ų | 65 | 98.3 Ų | 98.3 | 54% | 0.537 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -79.1 | -28 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | S169 | S169-A171 VanDerWaalsContact C-N 3.31Å; S169-A171 PolarHBondContact O-N 3.02Å |
| 172 | H | 49.8 | Very low | 62.6 | Low | 160 Ų | 160 | 98.7 Ų | 98.7 | 74% | 0.741 | 61% | 0.612 | S | S | * | * | G | 310 helix | trans | -83.4 | -12.6 | -177.8 | -94.6 | -69.2 | 0 | 0 | 0 | 114.5 | G174 | H172-G174 VanDerWaalsContact C-N 3.29Å; H172-G174 PolarHBondContact O-N 3.47Å |
| 173 | A | 51.7 | Low | 60.2 | Low | 89 Ų | 89 | 102 Ų | 102 | 74% | 0.736 | 64% | 0.64 | S | S | * | * | G | 310 helix | trans | -75.3 | -15.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 174 | G | 49.2 | Very low | 58 | Low | 61 Ų | 61 | 109 Ų | 109 | 63% | 0.629 | 66% | 0.661 | S | S | * | * | G | 310 helix | trans | -91.8 | -5.7 | -173.3 | 0 | 0 | 0 | 0 | 0 | 117 | H172 | H172-G174 VanDerWaalsContact C-N 3.29Å; H172-G174 PolarHBondContact O-N 3.47Å |
| 175 | L | 47.3 | Very low | 55.5 | Low | 152 Ų | 152 | 104.8 Ų | 104.8 | 80% | 0.796 | 66% | 0.656 | S | S | * | * | trans | -110.1 | 28.8 | -170.3 | -65.5 | 177.8 | 0 | 0 | 0 | 114.9 | ||||
| 176 | G | 44.3 | Very low | 53.2 | Low | 73 Ų | 73 | 110.9 Ų | 110.9 | 75% | 0.753 | 69% | 0.687 | S | S | * | * | trans | -92.2 | 3.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | I178 | G176-I178 PolarHBondContact O-N 2.95Å; G176-I178 VanDerWaalsContact O-N 3.07Å | ||
| 177 | H | 41.6 | Very low | 51.1 | Low | 158 Ų | 158 | 115.8 Ų | 115.8 | 73% | 0.731 | 71% | 0.709 | S | S | * | * | trans | -83.5 | 83.3 | -176.7 | -157.4 | -97.4 | 0 | 0 | 0 | 111 | P179 | H177-P179 WeakPolarHBondContact O-CD 3.35Š| ||
| 178 | I | 44.8 | Very low | 49.1 | Very low | 152 Ų | 152 | 116.5 Ų | 116.5 | 78% | 0.779 | 71% | 0.708 | S | S | * | * | trans | -81.1 | 108.7 | 153.5 | -58.6 | 168.5 | 0 | 0 | 0 | 105.4 | G176 W180 | G176-I178 PolarHBondContact O-N 2.95Å; G176-I178 VanDerWaalsContact O-N 3.07Å; I178-W180 PolarHBondContact O-N 3.5Å | ||
| 179 | P | 46.8 | Very low | 47.7 | Very low | 93 Ų | 93 | 121.8 Ų | 121.8 | 60% | 0.604 | 72% | 0.722 | S | S | * | * | trans | -78.8 | 90.3 | 177.4 | 23.1 | -13.2 | 0 | 0 | 0 | 108.4 | H177 G181 | H177-P179 WeakPolarHBondContact O-CD 3.35Å; P179-G181 PolarHBondContact O-N 3.46Å | ||
| 180 | W | 52.9 | Low | 46.2 | Very low | 256 Ų | 256 | 125.7 Ų | 125.7 | 97% | 0.97 | 74% | 0.743 | S | S | * | * | trans | -74.3 | 84.2 | 157.7 | -168.4 | -76.4 | 0 | 0 | 0 | 107.7 | I178 | I178-W180 PolarHBondContact O-N 3.5Š| ||
| 181 | G | 46.4 | Very low | 44.9 | Very low | 64 Ų | 64 | 127.3 Ų | 127.3 | 66% | 0.66 | 75% | 0.75 | S | S | * | * | trans | -170 | 20.5 | -174 | 0 | 0 | 0 | 0 | 0 | 116 | P179 | P179-G181 PolarHBondContact O-N 3.46Š| ||
| 182 | S | 43.5 | Very low | 44.2 | Very low | 123 Ų | 123 | 133.2 Ų | 133.2 | 86% | 0.86 | 77% | 0.767 | S | S | * | * | trans | -143.8 | 79.5 | 171.2 | -77.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 183 | A | 43.7 | Very low | 43.5 | Very low | 94 Ų | 94 | 131 Ų | 131 | 78% | 0.777 | 77% | 0.767 | S | S | * | * | trans | -143.1 | 55.9 | 161.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 184 | F | 46.3 | Very low | 42.6 | Very low | 223 Ų | 223 | 135 Ų | 135 | 98% | 0.978 | 78% | 0.775 | S | S | * | * | trans | -125.1 | 99.8 | 152.7 | -73.7 | -72.4 | 0 | 0 | 0 | 106.8 | ||||
| 185 | G | 38.3 | Very low | 42 | Very low | 55 Ų | 55 | 139.9 Ų | 139.9 | 57% | 0.567 | 79% | 0.785 | S | S | * | * | S | Bend | trans | 159.3 | 97.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 186 | H | 37.4 | Very low | 41.5 | Very low | 184 Ų | 184 | 140.2 Ų | 140.2 | 85% | 0.852 | 79% | 0.787 | S | S | * | * | trans | 80.9 | 104.9 | 151.9 | -48.5 | 91.6 | 0 | 0 | 0 | 117.5 | P188 | H186-P188 VanDerWaalsContact O-CD 3.27Å; H186-P188 WeakPolarHBondContact O-CD 3.28Å | ||
| 187 | H | 41.8 | Very low | 41.7 | Very low | 187 Ų | 187 | 141.7 Ų | 141.7 | 87% | 0.866 | 78% | 0.784 | S | S | * | * | trans | -58.4 | 130.1 | 152 | -107.1 | -59.1 | 0 | 0 | 0 | 110.2 | ||||
| 188 | P | 40.5 | Very low | 41.4 | Very low | 90 Ų | 90 | 142.9 Ų | 142.9 | 58% | 0.584 | 79% | 0.79 | S | S | * | * | trans | -113.1 | 120.4 | 139.8 | 30.7 | -17.3 | 0 | 0 | 0 | 108.9 | H186 V190 | H186-P188 VanDerWaalsContact O-CD 3.27Å; H186-P188 WeakPolarHBondContact O-CD 3.28Å; P188-V190 PolarHBondContact O-N 2.96Å | ||
| 189 | H | 48.7 | Very low | 40.8 | Very low | 172 Ų | 172 | 142.9 Ų | 142.9 | 80% | 0.796 | 79% | 0.791 | S | S | * | * | trans | -33.4 | 114.3 | 151.4 | 35.3 | -81.7 | 0 | 0 | 0 | 111.6 | ||||
| 190 | V | 39.7 | Very low | 40.1 | Very low | 132 Ų | 132 | 141.4 Ų | 141.4 | 80% | 0.8 | 79% | 0.792 | S | S | * | * | trans | -114.3 | 120.4 | 161.9 | -178.1 | 0 | 0 | 0 | 0 | 107.5 | P188 | P188-V190 PolarHBondContact O-N 2.96Š| ||
| 191 | A | 34.1 | Very low | 39.2 | Very low | 90 Ų | 90 | 138 Ų | 138 | 74% | 0.744 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 140.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 192 | H | 38.5 | Very low | 38.5 | Very low | 189 Ų | 189 | 138.5 Ų | 138.5 | 88% | 0.875 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 133.3 | 166.2 | -70 | -82.7 | 0 | 0 | 0 | 110.4 | ||
| 193 | P | 36.6 | Very low | 38 | Very low | 115 Ų | 115 | 140.3 Ų | 140.3 | 75% | 0.747 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -96.6 | 140.9 | 161.3 | 31.7 | -22 | 0 | 0 | 0 | 111.1 | ||
| 194 | L | 32.9 | Very low | 37.6 | Very low | 173 Ų | 173 | 140.4 Ų | 140.4 | 91% | 0.906 | 79% | 0.792 | S | S | * | * | trans | 98.4 | 87.4 | 163.1 | -57.4 | 173.9 | 0 | 0 | 0 | 117.7 | ||||
| 195 | L | 36 | Very low | 37 | Very low | 162 Ų | 162 | 132.6 Ų | 132.6 | 85% | 0.848 | 78% | 0.775 | S | S | * | * | trans | -88.7 | 135.8 | 139.8 | -83 | 165.9 | 0 | 0 | 0 | 109 | ||||
| 196 | L | 36.5 | Very low | 36.7 | Very low | 159 Ų | 159 | 136 Ų | 136 | 83% | 0.832 | 79% | 0.785 | S | S | * | * | -177 | 170.3 | 113 | -130.6 | 77.1 | 0 | 0 | 0 | 110.9 | |||||
| 197 | P | 47.9 | Very low | 36.5 | Very low | 105 Ų | 105 | 133.7 Ų | 133.7 | 68% | 0.682 | 78% | 0.784 | S | S | * | * | -128.5 | 168.5 | -101.9 | 43.2 | -26.4 | 0 | 0 | 0 | 113.7 | |||||
| 198 | Q | 35.9 | Very low | 36.2 | Very low | 183 Ų | 183 | 129.1 Ų | 129.1 | 86% | 0.855 | 78% | 0.778 | S | S | * | * | trans | 170.6 | 112.2 | 144.5 | -101.5 | -170.1 | 28.7 | 0 | 0 | 107.8 | ||||
| 199 | N | 31.7 | Very low | 35.9 | Very low | 152 Ų | 152 | 130 Ų | 130 | 81% | 0.813 | 79% | 0.787 | S | S | * | * | 62 | 110.8 | 80.9 | -151.7 | 53.2 | 0 | 0 | 0 | 113.3 | |||||
| 200 | G | 32.1 | Very low | 36 | Very low | 61 Ų | 61 | 127 Ų | 127 | 63% | 0.629 | 78% | 0.782 | S | S | * | * | trans | 147.7 | 86.4 | 162.9 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 201 | H | 34.2 | Very low | 35.9 | Very low | 186 Ų | 186 | 127 Ų | 127 | 86% | 0.861 | 78% | 0.783 | S | S | * | * | trans | 32.4 | 132.5 | 134.9 | -57.4 | 85.3 | 0 | 0 | 0 | 121.3 | ||||
| 202 | G | 31.9 | Very low | 35.7 | Very low | 73 Ų | 73 | 131.2 Ų | 131.2 | 75% | 0.753 | 79% | 0.787 | S | S | * | * | 128.7 | 95.7 | 129.5 | 0 | 0 | 0 | 0 | 0 | 117.4 | |||||
| 203 | N | 34.2 | Very low | 35.9 | Very low | 161 Ų | 161 | 126.9 Ų | 126.9 | 86% | 0.861 | 78% | 0.776 | S | S | * | * | 65.3 | 128.5 | 123 | -134.7 | 45.4 | 0 | 0 | 0 | 122 | |||||
| 204 | A | 34.6 | Very low | 35.8 | Very low | 96 Ų | 96 | 128.5 Ų | 128.5 | 79% | 0.793 | 77% | 0.773 | S | S | * | * | trans | 56.7 | 141 | 146.4 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 205 | G | 32.7 | Very low | 35.8 | Very low | 59 Ų | 59 | 126.5 Ų | 126.5 | 61% | 0.608 | 76% | 0.759 | S | S | * | * | cis | 157.3 | 138.1 | 15.2 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 206 | T | 33.1 | Very low | 35.6 | Very low | 128 Ų | 128 | 127.9 Ų | 127.9 | 79% | 0.785 | 76% | 0.761 | S | S | * | * | trans | 52.3 | 123.1 | 141.8 | 52.8 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 207 | T | 33.9 | Very low | 35.3 | Very low | 134 Ų | 134 | 123.7 Ų | 123.7 | 82% | 0.822 | 76% | 0.757 | S | S | * | * | 90.8 | 133.1 | 125.5 | 58.4 | 0 | 0 | 0 | 0 | 121.9 | |||||
| 208 | A | 34.3 | Very low | 34.5 | Very low | 91 Ų | 91 | 129.6 Ų | 129.6 | 75% | 0.752 | 77% | 0.765 | S | S | * | * | trans | 87.6 | 102.4 | 137 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 209 | S | 33.8 | Very low | 34.3 | Very low | 110 Ų | 110 | 127.5 Ų | 127.5 | 77% | 0.769 | 76% | 0.759 | S | S | * | * | trans | -45.7 | -178.4 | 135.1 | 44.7 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 210 | P | 51.2 | Low | 34.4 | Very low | 107 Ų | 107 | 124.7 Ų | 124.7 | 70% | 0.695 | 76% | 0.757 | S | S | * | * | cis | -132.5 | -161.7 | -30.2 | 27.1 | -2.7 | 0 | 0 | 0 | 111.8 | ||||
| 211 | T | 36.7 | Very low | 34.3 | Very low | 133 Ų | 133 | 127.7 Ų | 127.7 | 82% | 0.816 | 77% | 0.768 | S | S | * | * | trans | 94.9 | 117.7 | 155.9 | 54.9 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 212 | E | 30.7 | Very low | 34.2 | Very low | 178 Ų | 178 | 122.5 Ų | 122.5 | 83% | 0.832 | 76% | 0.757 | S | S | * | * | trans | -24.2 | 175.4 | 144.3 | -112.2 | -155.6 | 117.1 | 0 | 0 | 117.2 | ||||
| 213 | P | 42.9 | Very low | 34.5 | Very low | 98 Ų | 98 | 127.8 Ų | 127.8 | 64% | 0.636 | 76% | 0.762 | S | S | * | * | cis | -143.5 | 179.7 | -0.4 | 39.6 | -18.3 | 0 | 0 | 0 | 116.6 | ||||
| 214 | H | 33.8 | Very low | 35.5 | Very low | 150 Ų | 150 | 125.3 Ų | 125.3 | 69% | 0.694 | 76% | 0.755 | S | S | * | * | trans | 80.7 | 138 | 137.5 | -129.1 | 21 | 0 | 0 | 0 | 124.1 | ||||
| 215 | H | 33.8 | Very low | 35.4 | Very low | 130 Ų | 130 | 130 Ų | 130 | 60% | 0.602 | 76% | 0.76 | S | S | * | * | trans | 92.1 | 110.3 | 151.2 | -43.5 | -77.5 | 0 | 0 | 0 | 124 | ||||
| 216 | Q | 31.5 | Very low | 35.5 | Very low | 192 Ų | 192 | 131 Ų | 131 | 90% | 0.897 | 76% | 0.763 | S | S | * | * | 46.1 | 132 | 119.6 | -72.5 | 167.3 | -28.6 | 0 | 0 | 123.4 | |||||
| 217 | G | 30.1 | Very low | 36.2 | Very low | 71 Ų | 71 | 130.6 Ų | 130.6 | 73% | 0.732 | 76% | 0.763 | S | S | * | * | trans | 145.6 | 103.2 | 148 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 218 | R | 30.5 | Very low | 36.1 | Very low | 229 Ų | 229 | 128.1 Ų | 128.1 | 86% | 0.864 | 76% | 0.756 | S | S | * | * | 51.6 | 131.3 | 91.6 | -99.4 | -158.9 | 170.8 | -147.7 | -0.4 | 112.9 | |||||
| 219 | L | 33.2 | Very low | 36.1 | Very low | 139 Ų | 139 | 131.7 Ų | 131.7 | 73% | 0.728 | 76% | 0.761 | S | S | * | * | cis | -168.3 | 155.8 | 14 | -80.8 | 162 | 0 | 0 | 0 | 109.1 | ||||
| 220 | A | 32.4 | Very low | 36.2 | Very low | 92 Ų | 92 | 138.2 Ų | 138.2 | 76% | 0.76 | 77% | 0.769 | S | S | * | * | trans | 177.2 | 111.6 | 138.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 221 | S | 31 | Very low | 35.4 | Very low | 124 Ų | 124 | 137.3 Ų | 137.3 | 87% | 0.867 | 77% | 0.771 | S | S | * | * | 68.3 | 127.4 | 81.5 | -167.9 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 222 | A | 32.3 | Very low | 35.9 | Very low | 77 Ų | 77 | 136.8 Ų | 136.8 | 64% | 0.636 | 77% | 0.77 | S | S | * | * | cis | -164.6 | 141.6 | 12.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 223 | H | 38.7 | Very low | 36.7 | Very low | 184 Ų | 184 | 133.6 Ų | 133.6 | 85% | 0.852 | 77% | 0.765 | S | S | * | * | 46 | 162.4 | 117.3 | -83 | -70.3 | 0 | 0 | 0 | 120.6 | |||||
| 224 | P | 54 | Low | 36.5 | Very low | 110 Ų | 110 | 134.8 Ų | 134.8 | 71% | 0.714 | 78% | 0.775 | S | S | * | * | cis | -125.9 | 173.7 | -15 | 28.8 | -5.4 | 0 | 0 | 0 | 111.6 | ||||
| 225 | E | 33.5 | Very low | 36.6 | Very low | 193 Ų | 193 | 131.5 Ų | 131.5 | 90% | 0.902 | 78% | 0.782 | S | S | * | * | 179.8 | 147.5 | 82.1 | -145.4 | -174.1 | 132 | 0 | 0 | 108.9 | |||||
| 226 | A | 33.4 | Very low | 36.6 | Very low | 81 Ų | 81 | 131.2 Ų | 131.2 | 67% | 0.669 | 80% | 0.795 | S | S | * | * | trans | -122.7 | 168.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 227 | P | 47.9 | Very low | 37.1 | Very low | 119 Ų | 119 | 130.1 Ų | 130.1 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | -155.5 | 160.4 | 58.1 | 38.3 | -15.2 | 0 | 0 | 0 | 119.1 | |||||
| 228 | A | 32.3 | Very low | 37.6 | Very low | 83 Ų | 83 | 129.6 Ų | 129.6 | 69% | 0.686 | 79% | 0.789 | S | S | * | * | trans | 55.8 | 137.3 | 135.3 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 229 | L | 35.1 | Very low | 38.1 | Very low | 165 Ų | 165 | 125 Ų | 125 | 86% | 0.864 | 79% | 0.789 | S | S | * | * | -166.4 | 144.8 | 65 | -82.1 | 164.7 | 0 | 0 | 0 | 113.8 | |||||
| 230 | R | 36.4 | Very low | 38.4 | Very low | 247 Ų | 247 | 125 Ų | 125 | 93% | 0.932 | 79% | 0.794 | S | S | * | * | trans | 93 | 109.6 | 143.3 | -129.4 | 168.5 | -175.5 | 156.7 | 0 | 120.4 | ||||
| 231 | A | 34.3 | Very low | 38.9 | Very low | 89 Ų | 89 | 128.2 Ų | 128.2 | 74% | 0.736 | 80% | 0.798 | S | S | * | * | trans | -79.2 | -169.5 | 169.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 232 | P | 46.5 | Very low | 39.4 | Very low | 121 Ų | 121 | 128 Ų | 128 | 79% | 0.786 | 79% | 0.793 | S | S | * | * | cis | -142.2 | -148.5 | 6.6 | 47 | -24.1 | 0 | 0 | 0 | 113.4 | ||||
| 233 | P | 47.5 | Very low | 39.6 | Very low | 112 Ų | 112 | 130.5 Ų | 130.5 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | -116.5 | 166.9 | -121.1 | 33.6 | -11.7 | 0 | 0 | 0 | 114.2 | |||||
| 234 | S | 37.9 | Very low | 39.5 | Very low | 122 Ų | 122 | 127.8 Ų | 127.8 | 85% | 0.853 | 80% | 0.796 | S | S | * | * | trans | 176.8 | 134.9 | 138.1 | -83 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 235 | G | 35.3 | Very low | 38.7 | Very low | 81 Ų | 81 | 128.3 Ų | 128.3 | 84% | 0.835 | 80% | 0.798 | S | S | * | * | trans | -65.2 | 154.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 236 | S | 34.7 | Very low | 38.8 | Very low | 125 Ų | 125 | 124.6 Ų | 124.6 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | trans | -140.9 | 120.4 | 161.3 | -159.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 237 | L | 41.6 | Very low | 39 | Very low | 168 Ų | 168 | 125.5 Ų | 125.5 | 88% | 0.88 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 142.9 | 176.2 | -64.7 | 161.4 | 0 | 0 | 0 | 108.9 | ||
| 238 | G | 41.2 | Very low | 38.4 | Very low | 61 Ų | 61 | 125.8 Ų | 125.8 | 63% | 0.629 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 154.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | V240 | G238-V240 PolarHBondContact O-N 2.94Š|
| 239 | P | 41.1 | Very low | 38.8 | Very low | 133 Ų | 133 | 131.3 Ų | 131.3 | 86% | 0.864 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 116.3 | -179.9 | 28.7 | -29.8 | 0 | 0 | 0 | 111.2 | ||
| 240 | V | 40.3 | Very low | 38.7 | Very low | 138 Ų | 138 | 131.1 Ų | 131.1 | 84% | 0.836 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -83.4 | 129.1 | 167.3 | 176.5 | 0 | 0 | 0 | 0 | 108.6 | G238 | G238-V240 PolarHBondContact O-N 2.94Š|
| 241 | L | 42.4 | Very low | 38.7 | Very low | 160 Ų | 160 | 124.6 Ų | 124.6 | 84% | 0.838 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 133.7 | 174.6 | -63.8 | 168.7 | 0 | 0 | 0 | 110.5 | V243 | L241-V243 PolarHBondContact O-N 3.18Š|
| 242 | P | 41.2 | Very low | 39.1 | Very low | 119 Ų | 119 | 125.6 Ų | 125.6 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | trans | -81.1 | 115.5 | 171.8 | 29.5 | -30.2 | 0 | 0 | 0 | 111.3 | ||||
| 243 | V | 36.3 | Very low | 39 | Very low | 129 Ų | 129 | 125.7 Ų | 125.7 | 78% | 0.782 | 81% | 0.805 | S | S | * | * | trans | -73.7 | 124.5 | 156.8 | 126.5 | 0 | 0 | 0 | 0 | 107.5 | L241 T245 | L241-V243 PolarHBondContact O-N 3.18Å; V243-T245 HydrophobicContact CG1-CG2 4.33Å | ||
| 244 | V | 36.8 | Very low | 38.7 | Very low | 127 Ų | 127 | 128.3 Ų | 128.3 | 77% | 0.77 | 81% | 0.812 | S | S | * | * | trans | -111.5 | 104.7 | 165.7 | 177 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 245 | T | 36.8 | Very low | 38.9 | Very low | 122 Ų | 122 | 131.1 Ų | 131.1 | 75% | 0.748 | 82% | 0.816 | S | S | * | * | trans | -80.9 | 125.3 | 160.3 | 46.6 | 0 | 0 | 0 | 0 | 108.5 | V243 | V243-T245 HydrophobicContact CG1-CG2 4.33Š| ||
| 246 | S | 34.8 | Very low | 38.9 | Very low | 115 Ų | 115 | 132.6 Ų | 132.6 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | trans | -145 | 114.4 | 157.1 | -81.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 247 | A | 39.5 | Very low | 38.9 | Very low | 99 Ų | 99 | 131.1 Ų | 131.1 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | -85.8 | 132.8 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 248 | S | 35.1 | Very low | 39 | Very low | 126 Ų | 126 | 130.4 Ų | 130.4 | 88% | 0.881 | 81% | 0.806 | S | S | * | * | trans | -155.8 | 122.3 | 150.4 | -86.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 249 | K | 39.2 | Very low | 39 | Very low | 199 Ų | 199 | 130.9 Ų | 130.9 | 87% | 0.865 | 80% | 0.804 | S | S | * | * | trans | -69.9 | 139.1 | 167.9 | -86.1 | 170.9 | 163.5 | 175.2 | 0 | 109 | ||||
| 250 | L | 34 | Very low | 39.2 | Very low | 160 Ų | 160 | 129.7 Ų | 129.7 | 84% | 0.838 | 80% | 0.799 | S | S | * | * | 170.4 | 124.3 | 114 | -84.8 | 168.7 | 0 | 0 | 0 | 112 | |||||
| 251 | S | 36.1 | Very low | 39.4 | Very low | 110 Ų | 110 | 132 Ų | 132 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | trans | 80.1 | 148.2 | 148.1 | -57.2 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 252 | P | 43.8 | Very low | 39.5 | Very low | 110 Ų | 110 | 130 Ų | 130 | 71% | 0.714 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -95.3 | 159.2 | -147.8 | 37.1 | -34.2 | 0 | 0 | 0 | 114.6 | ||
| 253 | P | 43.7 | Very low | 39.6 | Very low | 123 Ų | 123 | 128.6 Ų | 128.6 | 80% | 0.799 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 125.7 | 173.3 | 31.7 | -30.5 | 0 | 0 | 0 | 110.8 | ||
| 254 | L | 40.8 | Very low | 39.7 | Very low | 168 Ų | 168 | 132 Ų | 132 | 88% | 0.88 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 133.2 | 166.7 | -66.8 | 171.3 | 0 | 0 | 0 | 109.4 | S256 | L254-S256 PolarHBondContact O-N 2.91Š|
| 255 | L | 42.1 | Very low | 40.4 | Very low | 180 Ų | 180 | 131.2 Ų | 131.2 | 94% | 0.942 | 81% | 0.805 | S | S | * | * | trans | -61.7 | 103.9 | 171.5 | -66.1 | 168.1 | 0 | 0 | 0 | 108.9 | ||||
| 256 | S | 34.7 | Very low | 40.5 | Very low | 112 Ų | 112 | 133.6 Ų | 133.6 | 78% | 0.783 | 81% | 0.806 | S | S | * | * | trans | -88.4 | 117.2 | 167.3 | -165.1 | 0 | 0 | 0 | 0 | 109.4 | L254 V258 | L254-S256 PolarHBondContact O-N 2.91Å; S256-V258 PolarHBondContact O-N 3.42Å | ||
| 257 | S | 36.2 | Very low | 40.7 | Very low | 94 Ų | 94 | 134 Ų | 134 | 66% | 0.657 | 81% | 0.808 | S | S | * | * | trans | -41.2 | 122.3 | 171 | -172.1 | 0 | 0 | 0 | 0 | 113.6 | A259 | S257-A259 PolarHBondContact OG-N 2.8Š| ||
| 258 | V | 43.4 | Very low | 40.9 | Very low | 154 Ų | 154 | 137.7 Ų | 137.7 | 93% | 0.933 | 81% | 0.806 | S | S | * | * | trans | -114.2 | 60.1 | 154.1 | -69.9 | 0 | 0 | 0 | 0 | 108.6 | S256 | S256-V258 PolarHBondContact O-N 3.42Š| ||
| 259 | A | 41.3 | Very low | 41.1 | Very low | 71 Ų | 71 | 136.3 Ų | 136.3 | 59% | 0.587 | 80% | 0.796 | S | S | * | * | trans | -105.8 | 129.4 | 161.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | S257 | S257-A259 PolarHBondContact OG-N 2.8Š| ||
| 260 | S | 44.8 | Very low | 41.2 | Very low | 108 Ų | 108 | 131.8 Ų | 131.8 | 76% | 0.755 | 79% | 0.79 | S | S | * | * | trans | 92.2 | 79.2 | 164.9 | -44.2 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 261 | L | 45.2 | Very low | 41.6 | Very low | 186 Ų | 186 | 133.2 Ų | 133.2 | 97% | 0.974 | 79% | 0.789 | S | S | * | * | trans | -130.2 | 69.9 | 138.5 | -70.6 | 178.3 | 0 | 0 | 0 | 108.6 | ||||
| 262 | S | 44 | Very low | 41.7 | Very low | 118 Ų | 118 | 136.2 Ų | 136.2 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | trans | -129.4 | 79.1 | 163.5 | 62.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 263 | A | 43.1 | Very low | 41.5 | Very low | 90 Ų | 90 | 139.3 Ų | 139.3 | 74% | 0.744 | 80% | 0.801 | S | S | * | * | trans | -147.2 | 81.4 | 164.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 264 | F | 39.3 | Very low | 41.2 | Very low | 201 Ų | 201 | 141.6 Ų | 141.6 | 88% | 0.882 | 81% | 0.805 | S | S | * | * | trans | -128.2 | 128 | 152.9 | -84.9 | -71.8 | 0 | 0 | 0 | 109.2 | F266 | F264-F266 PolarHBondContact O-N 2.76Š| ||
| 265 | P | 50.9 | Low | 41.1 | Very low | 109 Ų | 109 | 138.8 Ų | 138.8 | 71% | 0.708 | 80% | 0.8 | S | S | * | * | trans | -93.2 | 88.2 | -177 | 35.6 | -29.2 | 0 | 0 | 0 | 109.2 | ||||
| 266 | F | 38.2 | Very low | 41.3 | Very low | 173 Ų | 173 | 135.9 Ų | 135.9 | 76% | 0.759 | 79% | 0.792 | S | S | * | * | trans | -136.7 | 89.3 | 157.6 | -85.6 | -76.4 | 0 | 0 | 0 | 109 | F264 F268 | F264-F266 PolarHBondContact O-N 2.76Å; F266-F268 HydrophobicContact CB-CD2 4.5Å; F266-F268 HydrophobicContact CB-CE2 4.3Å; F266-F268 PolarHBondContact O-N 3.12Å | ||
| 267 | S | 38.9 | Very low | 41.5 | Very low | 122 Ų | 122 | 136.2 Ų | 136.2 | 85% | 0.853 | 79% | 0.794 | S | S | * | * | trans | -70.7 | 106.9 | 157.2 | -73.4 | 0 | 0 | 0 | 0 | 107.5 | S269 | S267-S269 VanDerWaalsContact C-N 3.29Å; S267-S269 PolarHBondContact O-N 3.47Å; S267-S269 VanDerWaalsContact O-N 3.09Å | ||
| 268 | F | 43.8 | Very low | 41.7 | Very low | 177 Ų | 177 | 138 Ų | 138 | 78% | 0.776 | 80% | 0.801 | S | S | * | * | trans | -77.3 | 92.4 | 159.8 | -83.1 | -83.2 | 0 | 0 | 0 | 107.6 | F266 | F266-F268 HydrophobicContact CB-CD2 4.5Å; F266-F268 HydrophobicContact CB-CE2 4.3Å; F266-F268 PolarHBondContact O-N 3.12Å | ||
| 269 | S | 38.7 | Very low | 42 | Very low | 97 Ų | 97 | 136.2 Ų | 136.2 | 68% | 0.678 | 79% | 0.793 | S | S | * | * | trans | -58.8 | 138.3 | 168.2 | -171.2 | 0 | 0 | 0 | 0 | 109.7 | S267 F271 | S267-S269 VanDerWaalsContact C-N 3.29Å; S267-S269 PolarHBondContact O-N 3.47Å; S267-S269 VanDerWaalsContact O-N 3.09Å; S269-F271 PolarHBondContact O-N 3.32Å | ||
| 270 | S | 42.2 | Very low | 41.8 | Very low | 104 Ų | 104 | 139.4 Ų | 139.4 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | trans | -50.6 | 125.3 | 172.4 | -55 | 0 | 0 | 0 | 0 | 111.3 | H272 | S270-H272 PolarHBondContact O-N 3.44Š| ||
| 271 | F | 43.1 | Very low | 41.5 | Very low | 190 Ų | 190 | 143.6 Ų | 143.6 | 83% | 0.833 | 81% | 0.813 | S | S | * | * | trans | -70.3 | 114.9 | 170.4 | -68.7 | -76.9 | 0 | 0 | 0 | 109.7 | S269 L273 | S269-F271 PolarHBondContact O-N 3.32Å; F271-L273 PolarHBondContact O-N 2.69Å | ||
| 272 | H | 38 | Very low | 41.1 | Very low | 174 Ų | 174 | 139.2 Ų | 139.2 | 81% | 0.806 | 80% | 0.803 | S | S | * | * | trans | -67.2 | 123.1 | 163.5 | -83.8 | -90.8 | 0 | 0 | 0 | 109.3 | S270 L274 | S270-H272 PolarHBondContact O-N 3.44Å; H272-L274 PolarHBondContact O-N 2.96Å | ||
| 273 | L | 38.9 | Very low | 40.9 | Very low | 175 Ų | 175 | 138.1 Ų | 138.1 | 92% | 0.916 | 80% | 0.802 | S | S | * | * | trans | -68 | 107.9 | 168.8 | -70.8 | 170 | 0 | 0 | 0 | 109.3 | F271 | F271-L273 PolarHBondContact O-N 2.69Š| ||
| 274 | L | 36.7 | Very low | 40.5 | Very low | 170 Ų | 170 | 141 Ų | 141 | 89% | 0.89 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 122.8 | 164.9 | -119.2 | 76.3 | 0 | 0 | 0 | 108.8 | H272 | H272-L274 PolarHBondContact O-N 2.96Š|
| 275 | S | 40.7 | Very low | 40.7 | Very low | 110 Ų | 110 | 139.3 Ų | 139.3 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 138.4 | 170 | -173.1 | 0 | 0 | 0 | 0 | 109.7 | ||
| 276 | P | 45.7 | Very low | 40.1 | Very low | 119 Ų | 119 | 137.4 Ų | 137.4 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -83.2 | 140.4 | 178.8 | 31.7 | -30.4 | 0 | 0 | 0 | 112.2 | ||
| 277 | S | 37.8 | Very low | 40.8 | Very low | 118 Ų | 118 | 139 Ų | 139 | 83% | 0.825 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 147.6 | 177.6 | 43.3 | 0 | 0 | 0 | 0 | 113.3 | ||
| 278 | T | 41.6 | Very low | 41.6 | Very low | 131 Ų | 131 | 139.2 Ų | 139.2 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | -116.3 | 147.2 | 160 | 43.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 279 | P | 48.3 | Very low | 41.8 | Very low | 118 Ų | 118 | 139.7 Ų | 139.7 | 77% | 0.766 | 81% | 0.807 | S | S | * | * | trans | -98.3 | 141.5 | -178.9 | 35.9 | -28.8 | 0 | 0 | 0 | 111.4 | ||||
| 280 | T | 38.3 | Very low | 42.8 | Very low | 137 Ų | 137 | 145.2 Ų | 145.2 | 84% | 0.84 | 81% | 0.813 | S | S | * | * | trans | -162.9 | 110.9 | 154.3 | 3.7 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 281 | Q | 37.3 | Very low | 43.4 | Very low | 196 Ų | 196 | 146 Ų | 146 | 92% | 0.916 | 82% | 0.816 | S | S | * | * | trans | 57 | 137.7 | 134.8 | -144.4 | 167 | 89.1 | 0 | 0 | 122.8 | ||||
| 282 | A | 37.9 | Very low | 43.8 | Very low | 94 Ų | 94 | 147.9 Ų | 147.9 | 78% | 0.777 | 82% | 0.818 | S | S | * | * | trans | -74.5 | 153.7 | -173 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 283 | A | 39.1 | Very low | 44.5 | Very low | 96 Ų | 96 | 142.4 Ų | 142.4 | 79% | 0.793 | 81% | 0.808 | S | S | * | * | trans | -173 | 120.9 | 131.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 284 | N | 36.2 | Very low | 45.2 | Very low | 150 Ų | 150 | 140.3 Ų | 140.3 | 80% | 0.802 | 80% | 0.802 | S | S | * | * | trans | 51.3 | 122.6 | 136.7 | -99.8 | -35.4 | 0 | 0 | 0 | 124.1 | ||||
| 285 | L | 42.3 | Very low | 45.9 | Very low | 166 Ų | 166 | 139.4 Ų | 139.4 | 87% | 0.869 | 79% | 0.793 | S | S | * | * | 83.6 | 115.7 | 120.6 | -148.2 | 72.3 | 0 | 0 | 0 | 120.6 | |||||
| 286 | G | 38.3 | Very low | 46.1 | Very low | 69 Ų | 69 | 141.9 Ų | 141.9 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | trans | 120.8 | 90.7 | 138.9 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 287 | K | 52.6 | Low | 46.2 | Very low | 205 Ų | 205 | 139.3 Ų | 139.3 | 89% | 0.891 | 79% | 0.792 | S | S | * | * | trans | 37.8 | 143 | 140.7 | -63.5 | 158 | -176.3 | 175.2 | 0 | 121.9 | ||||
| 288 | P | 56.4 | Low | 46.8 | Very low | 128 Ų | 128 | 138 Ų | 138 | 83% | 0.831 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -87 | 142.6 | -170.3 | 35.1 | -34.5 | 0 | 0 | 0 | 114.6 | ||
| 289 | Y | 48 | Very low | 47 | Very low | 186 Ų | 186 | 145.6 Ų | 145.6 | 73% | 0.729 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -102 | 133.9 | 169.9 | -175.3 | -104.5 | 0 | 0 | 0 | 111.2 | W292 | Y289-W292 PolarHBondContact OH-NE1 3.36Š|
| 290 | R | 60 | Low | 46.9 | Very low | 213 Ų | 213 | 147 Ų | 147 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 156.5 | 179.1 | -95.1 | -173.9 | -175.7 | -102.8 | 2.9 | 111.9 | ||
| 291 | P | 55.6 | Low | 47.4 | Very low | 120 Ų | 120 | 147.5 Ų | 147.5 | 78% | 0.779 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 137.9 | 178.1 | 33.5 | -32 | 0 | 0 | 0 | 111.3 | ||
| 292 | W | 50.9 | Low | 47.9 | Very low | 231 Ų | 231 | 144.8 Ų | 144.8 | 88% | 0.875 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 136.6 | 166.2 | -80.2 | -8.1 | 0 | 0 | 0 | 110.5 | Y289 | Y289-W292 PolarHBondContact OH-NE1 3.36Š|
| 293 | G | 52.1 | Low | 48.5 | Very low | 58 Ų | 58 | 147.8 Ų | 147.8 | 60% | 0.598 | 81% | 0.807 | S | S | * | * | trans | -107.9 | 170 | 162.3 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 294 | T | 52.9 | Low | 49.1 | Very low | 131 Ų | 131 | 151.1 Ų | 151.1 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | trans | 68 | 137.4 | 166.9 | 1.2 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 295 | E | 51.9 | Low | 50 | Low | 151 Ų | 151 | 151.1 Ų | 151.1 | 71% | 0.706 | 81% | 0.808 | S | S | * | * | cis | 178.7 | 146.7 | 44.6 | 41.5 | -141.9 | 117.7 | 0 | 0 | 112.6 | ||||
| 296 | I | 44.8 | Very low | 50.5 | Low | 162 Ų | 162 | 150.1 Ų | 150.1 | 83% | 0.831 | 80% | 0.804 | S | S | * | * | trans | 69.6 | 135.9 | 137.3 | -59.4 | 157.9 | 0 | 0 | 0 | 122.5 | ||||
| 297 | G | 48.9 | Very low | 51.5 | Low | 65 Ų | 65 | 156.3 Ų | 156.3 | 67% | 0.67 | 81% | 0.811 | S | S | * | * | trans | 128.9 | 92.6 | 143.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 298 | A | 49.3 | Very low | 51.4 | Low | 91 Ų | 91 | 152.3 Ų | 152.3 | 75% | 0.752 | 81% | 0.805 | S | S | * | * | 62.2 | 104.3 | 82.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 299 | F | 45.5 | Very low | 50.9 | Low | 291 Ų | 291 | 154.5 Ų | 154.5 | 100% | 1.276 | 80% | 0.802 | S | S | * | * | -160.5 | 0 | 127.3 | -93.7 | -71.8 | 0 | 0 | 0 | 108.8 |
Retrieved 299 of 299 residues in 60.3 ms
(Link to these results)