| 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 | 42.5 | Very low | 52.2 | Low | 211 Ų | 211 | 145.6 Ų | 145.6 | 100% | 1.039 | 82% | 0.819 | S | S | * | * | 0 | 128.9 | 0 | -55.8 | 78.4 | 172.8 | 0 | 0 | 106.8 | |||||
| 2 | Q | 50.6 | Low | 52.9 | Low | 166 Ų | 166 | 141 Ų | 141 | 78% | 0.776 | 81% | 0.813 | S | S | * | * | cis | 66.1 | 133.4 | 44.1 | -57.2 | 149.4 | -30.3 | 0 | 0 | 109.5 | ||||
| 3 | D | 49 | Very low | 53.5 | Low | 154 Ų | 154 | 138.5 Ų | 138.5 | 82% | 0.824 | 80% | 0.804 | S | S | * | * | cis | -130.4 | 169.8 | 35.6 | -69 | -62.5 | 0 | 0 | 0 | 117.4 | ||||
| 4 | R | 51.2 | Low | 53.8 | Low | 235 Ų | 235 | 137.9 Ų | 137.9 | 89% | 0.887 | 81% | 0.807 | S | S | * | * | trans | -86.1 | 158.2 | 155.4 | -77.7 | 179.7 | 169.2 | -178.1 | -3.8 | 109.3 | ||||
| 5 | P | 60.3 | Low | 53.6 | Low | 125 Ų | 125 | 145.1 Ų | 145.1 | 81% | 0.812 | 82% | 0.816 | S | S | * | * | -117.2 | 157.2 | 123.7 | -9.8 | 29 | 0 | 0 | 0 | 115.4 | |||||
| 6 | T | 61.1 | Low | 52.8 | Low | 120 Ų | 120 | 140.6 Ų | 140.6 | 74% | 0.736 | 81% | 0.812 | S | S | * | * | trans | -39.6 | 142.1 | 175.9 | 46.6 | 0 | 0 | 0 | 0 | 119 | ||||
| 7 | D | 49.8 | Very low | 52.1 | Low | 149 Ų | 149 | 138.1 Ų | 138.1 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | trans | -52.7 | 148.4 | 149.5 | 168.4 | 40.5 | 0 | 0 | 0 | 112.3 | ||||
| 8 | N | 53.7 | Low | 51.5 | Low | 148 Ų | 148 | 135.8 Ų | 135.8 | 79% | 0.791 | 80% | 0.797 | S | S | * | * | trans | -167.3 | 109.3 | 162.4 | -104.8 | -53 | 0 | 0 | 0 | 112.9 | ||||
| 9 | G | 45.8 | Very low | 51.2 | Low | 68 Ų | 68 | 138.4 Ų | 138.4 | 70% | 0.701 | 80% | 0.798 | S | S | * | * | trans | 59.7 | 89.5 | 141.2 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 10 | A | 54.5 | Low | 50.8 | Low | 101 Ų | 101 | 139.7 Ų | 139.7 | 84% | 0.835 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -91 | 131.5 | 166.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 11 | P | 55.8 | Low | 50.6 | Low | 125 Ų | 125 | 141.3 Ų | 141.3 | 81% | 0.812 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -86.3 | 126.1 | 162 | 32.2 | -29.9 | 0 | 0 | 0 | 110.8 | ||
| 12 | A | 60.5 | Low | 50.7 | Low | 90 Ų | 90 | 139.4 Ų | 139.4 | 74% | 0.744 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 151.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 13 | P | 60.8 | Low | 50.2 | Low | 108 Ų | 108 | 137.2 Ų | 137.2 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 147.6 | -178.6 | 27.7 | -35.7 | 0 | 0 | 0 | 112.8 | R15 | P13-R15 PolarHBondContact O-N 3.47Š|
| 14 | P | 57.6 | Low | 50.1 | Low | 131 Ų | 131 | 137.8 Ų | 137.8 | 85% | 0.851 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 116.5 | -179 | 26.3 | -34.1 | 0 | 0 | 0 | 111.6 | G16 | P14-G16 PolarHBondContact O-N 3.32Š|
| 15 | R | 50.9 | Low | 49.8 | Very low | 246 Ų | 246 | 135 Ų | 135 | 93% | 0.928 | 78% | 0.784 | S | S | * | * | trans | -79.1 | 85.8 | 179.6 | -69.5 | 177.7 | 175.3 | -109.1 | 0.9 | 111 | P13 S17 | P13-R15 PolarHBondContact O-N 3.47Å; R15-S17 PolarHBondContact O-N 3.14Å | ||
| 16 | G | 41.5 | Very low | 48.9 | Very low | 73 Ų | 73 | 133.7 Ų | 133.7 | 75% | 0.753 | 78% | 0.778 | S | S | * | * | trans | -64.5 | 126.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | P14 | P14-G16 PolarHBondContact O-N 3.32Š| ||
| 17 | S | 41.2 | Very low | 47.7 | Very low | 98 Ų | 98 | 138 Ų | 138 | 69% | 0.685 | 79% | 0.787 | S | S | * | * | trans | 54.3 | 80.6 | 150.5 | -158.4 | 0 | 0 | 0 | 0 | 118.7 | R15 F19 | R15-S17 PolarHBondContact O-N 3.14Å; S17-F19 VanDerWaalsContact OG-CD2 3.28Å; S17-F19 WeakPolarHBondContact OG-CD2 3.22Å; S17-F19 WeakPolarHBondContact OG-CE2 3.45Å | ||
| 18 | S | 40.4 | Very low | 47 | Very low | 97 Ų | 97 | 134.7 Ų | 134.7 | 68% | 0.678 | 79% | 0.788 | S | S | * | * | trans | -105.1 | 83.7 | 157.2 | 178.6 | 0 | 0 | 0 | 0 | 109 | F20 | S18-F20 WeakPolarHBondContact O-CD2 3.3Å; S18-F20 PolarHBondContact O-N 2.69Å; S18-F20 VanDerWaalsContact O-N 3.08Å | ||
| 19 | F | 46.5 | Very low | 46.1 | Very low | 184 Ų | 184 | 139.3 Ų | 139.3 | 81% | 0.807 | 80% | 0.795 | S | S | * | * | trans | -65.6 | 106.7 | 171.9 | -86.9 | -86.9 | 0 | 0 | 0 | 110.4 | S17 | S17-F19 VanDerWaalsContact OG-CD2 3.28Å; S17-F19 WeakPolarHBondContact OG-CD2 3.22Å; S17-F19 WeakPolarHBondContact OG-CE2 3.45Å | ||
| 20 | F | 43.5 | Very low | 45.7 | Very low | 165 Ų | 165 | 145.1 Ų | 145.1 | 72% | 0.724 | 80% | 0.804 | S | S | * | * | trans | -75 | 124.1 | 164 | -78.4 | -104.7 | 0 | 0 | 0 | 108.6 | S18 | S18-F20 WeakPolarHBondContact O-CD2 3.3Å; S18-F20 PolarHBondContact O-N 2.69Å; S18-F20 VanDerWaalsContact O-N 3.08Å | ||
| 21 | I | 45.6 | Very low | 44.9 | Very low | 174 Ų | 174 | 150.1 Ų | 150.1 | 89% | 0.892 | 81% | 0.806 | S | S | * | * | trans | -106.3 | 100 | 161.1 | -59.6 | 178.7 | 0 | 0 | 0 | 106.3 | ||||
| 22 | E | 44.4 | Very low | 43.8 | Very low | 171 Ų | 171 | 156 Ų | 156 | 80% | 0.799 | 81% | 0.813 | S | S | * | * | trans | -140.6 | 157.9 | 171.5 | -172.9 | 159.1 | -164.8 | 0 | 0 | 108.5 | ||||
| 23 | N | 39.6 | Very low | 42.4 | Very low | 120 Ų | 120 | 155.2 Ų | 155.2 | 64% | 0.642 | 81% | 0.813 | S | S | * | * | trans | 65.7 | 75.8 | -176.1 | -171.9 | 51.6 | 0 | 0 | 0 | 116.9 | ||||
| 24 | L | 47.5 | Very low | 41.1 | Very low | 166 Ų | 166 | 155.5 Ų | 155.5 | 87% | 0.869 | 82% | 0.818 | S | S | * | * | S | Bend | trans | -133.2 | 149.1 | 135.2 | -93.6 | 168.6 | 0 | 0 | 0 | 107.5 | ||
| 25 | L | 44.6 | Very low | 39.9 | Very low | 175 Ų | 175 | 154.1 Ų | 154.1 | 92% | 0.916 | 82% | 0.817 | S | S | * | * | S | Bend | trans | 72.4 | 38.1 | -179.2 | -60.3 | 161.5 | 0 | 0 | 0 | 117.6 | ||
| 26 | S | 41.3 | Very low | 38.9 | Very low | 98 Ų | 98 | 147.6 Ų | 147.6 | 69% | 0.685 | 81% | 0.809 | S | S | * | * | trans | -136.5 | 77 | 161.9 | -82.6 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 27 | K | 37.4 | Very low | 38.7 | Very low | 211 Ų | 211 | 148.3 Ų | 148.3 | 92% | 0.917 | 81% | 0.808 | S | S | * | * | trans | -178.2 | 142.5 | 161.6 | -100.8 | 150.1 | -171.8 | -176.6 | 0 | 108.8 | ||||
| 28 | G | 33.6 | Very low | 38.1 | Very low | 80 Ų | 80 | 152.4 Ų | 152.4 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | trans | 136.6 | 32.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 29 | W | 34.7 | Very low | 37.8 | Very low | 245 Ų | 245 | 151.7 Ų | 151.7 | 93% | 0.928 | 82% | 0.816 | S | S | * | * | trans | -136.2 | 66.8 | 167.4 | 66 | -78.4 | 0 | 0 | 0 | 112.8 | ||||
| 30 | E | 38 | Very low | 37.2 | Very low | 189 Ų | 189 | 151.1 Ų | 151.1 | 88% | 0.883 | 82% | 0.816 | S | S | * | * | trans | -106.2 | 91.7 | 175.4 | -71.9 | -173.1 | 113.4 | 0 | 0 | 112.3 | ||||
| 31 | K | 38.1 | Very low | 36.7 | Very low | 206 Ų | 206 | 149.3 Ų | 149.3 | 90% | 0.896 | 81% | 0.81 | S | S | * | * | 29.7 | 96.8 | 122.3 | -168.1 | -178.2 | -175.1 | -178.7 | 0 | 116.2 | |||||
| 32 | R | 33.3 | Very low | 36.2 | Very low | 249 Ų | 249 | 149 Ų | 149 | 94% | 0.94 | 80% | 0.802 | S | S | * | * | trans | -120.6 | 137.8 | 148.1 | -93.4 | -158.5 | -71.7 | -110.5 | 2.9 | 110.3 | ||||
| 33 | G | 30.8 | Very low | 35.5 | Very low | 73 Ų | 73 | 146.7 Ų | 146.7 | 75% | 0.753 | 81% | 0.805 | S | S | * | * | trans | -116.5 | 179.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 34 | S | 33.2 | Very low | 35.5 | Very low | 115 Ų | 115 | 145 Ų | 145 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | trans | -34.1 | 141.1 | -179.7 | -166.6 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 35 | A | 32.9 | Very low | 35.1 | Very low | 102 Ų | 102 | 145.2 Ų | 145.2 | 84% | 0.843 | 80% | 0.804 | S | S | * | * | trans | -146.4 | 148.2 | 145.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 36 | S | 29 | Very low | 34.6 | Very low | 108 Ų | 108 | 142.7 Ų | 142.7 | 76% | 0.755 | 79% | 0.791 | S | S | * | * | trans | -117.5 | -178.6 | -171.6 | -53.2 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 37 | A | 36.3 | Very low | 35 | Very low | 89 Ų | 89 | 144.3 Ų | 144.3 | 74% | 0.736 | 80% | 0.798 | S | S | * | * | trans | 73.3 | 139.1 | 160.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 38 | E | 30.1 | Very low | 34.8 | Very low | 184 Ų | 184 | 141.4 Ų | 141.4 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | cis | -144 | -154.8 | -19 | -86.8 | -61.4 | 24.6 | 0 | 0 | 106.9 | ||||
| 39 | A | 32.9 | Very low | 35.3 | Very low | 81 Ų | 81 | 147.5 Ų | 147.5 | 67% | 0.669 | 80% | 0.796 | S | S | * | * | cis | -164.3 | 179.5 | 12.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 40 | E | 34.6 | Very low | 35.6 | Very low | 173 Ų | 173 | 140.5 Ų | 140.5 | 81% | 0.808 | 79% | 0.785 | S | S | * | * | trans | 11.8 | 158.3 | 144 | -68.3 | -166.1 | 123.7 | 0 | 0 | 123.5 | ||||
| 41 | E | 31.9 | Very low | 36.4 | Very low | 127 Ų | 127 | 136.8 Ų | 136.8 | 59% | 0.593 | 78% | 0.776 | S | S | * | * | cis | -170.2 | 144 | -19.9 | 178.4 | 173.7 | 92.1 | 0 | 0 | 112.4 | ||||
| 42 | K | 36.1 | Very low | 36.4 | Very low | 167 Ų | 167 | 132.5 Ų | 132.5 | 73% | 0.726 | 77% | 0.772 | S | S | * | * | trans | 54.6 | 156.7 | 156.2 | -74.6 | 166.4 | -160.8 | 145.8 | 0 | 124.7 | ||||
| 43 | S | 29.5 | Very low | 36.6 | Very low | 122 Ų | 122 | 124.8 Ų | 124.8 | 85% | 0.853 | 76% | 0.762 | S | S | * | * | trans | 93 | 132.7 | 144.6 | -145 | 0 | 0 | 0 | 0 | 118 | ||||
| 44 | A | 39.3 | Very low | 37.3 | Very low | 86 Ų | 86 | 128.8 Ų | 128.8 | 71% | 0.711 | 77% | 0.766 | S | S | * | * | cis | -168.3 | -176.6 | -16.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 45 | H | 40.4 | Very low | 37.4 | Very low | 169 Ų | 169 | 128.8 Ų | 128.8 | 78% | 0.782 | 76% | 0.756 | S | S | * | * | trans | 72.7 | 117.3 | 171 | -124.9 | -76.4 | 0 | 0 | 0 | 115.6 | ||||
| 46 | D | 33.9 | Very low | 37.6 | Very low | 122 Ų | 122 | 133.3 Ų | 133.3 | 65% | 0.652 | 75% | 0.752 | S | S | * | * | cis | 90.1 | 108.9 | 32.5 | -165.8 | -66 | 0 | 0 | 0 | 114.6 | ||||
| 47 | T | 49.9 | Very low | 37.7 | Very low | 133 Ų | 133 | 133.4 Ų | 133.4 | 82% | 0.816 | 75% | 0.751 | S | S | * | * | trans | -177.9 | 152.2 | 130.9 | 21.1 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 48 | D | 33.1 | Very low | 37.7 | Very low | 150 Ų | 150 | 134.7 Ų | 134.7 | 80% | 0.802 | 76% | 0.755 | S | S | * | * | trans | -69.6 | 145.9 | -169.1 | -83.2 | -79.4 | 0 | 0 | 0 | 118.1 | ||||
| 49 | K | 42.9 | Very low | 38.1 | Very low | 207 Ų | 207 | 130.5 Ų | 130.5 | 90% | 0.9 | 75% | 0.752 | S | S | * | * | -154.3 | 126.6 | 121.4 | -150.9 | 136.2 | -171.5 | 171 | 0 | 114.6 | |||||
| 50 | S | 41.8 | Very low | 38.4 | Very low | 99 Ų | 99 | 133.6 Ų | 133.6 | 69% | 0.692 | 76% | 0.762 | S | S | * | * | trans | -123.8 | 178.9 | 173.2 | -124.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 51 | P | 55.2 | Low | 38.9 | Very low | 110 Ų | 110 | 130.2 Ų | 130.2 | 71% | 0.714 | 76% | 0.758 | S | S | * | * | cis | -136.3 | 160.2 | -17.2 | 37.4 | -21.5 | 0 | 0 | 0 | 114.9 | ||||
| 52 | S | 38.2 | Very low | 39 | Very low | 116 Ų | 116 | 135.7 Ų | 135.7 | 81% | 0.811 | 77% | 0.773 | S | S | * | * | trans | -176.7 | 118.7 | 138.9 | 16.3 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 53 | A | 36.4 | Very low | 39 | Very low | 88 Ų | 88 | 133.7 Ų | 133.7 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | 62.2 | 117.2 | 54.2 | 0 | 0 | 0 | 0 | 0 | 111 | |||||
| 54 | L | 45.8 | Very low | 39.2 | Very low | 157 Ų | 157 | 133.1 Ų | 133.1 | 82% | 0.822 | 78% | 0.775 | S | S | * | * | cis | -141.9 | 156.6 | 22.1 | -66.7 | 163.2 | 0 | 0 | 0 | 112.9 | ||||
| 55 | D | 35.2 | Very low | 38.9 | Very low | 114 Ų | 114 | 138.3 Ų | 138.3 | 61% | 0.61 | 78% | 0.777 | S | S | * | * | trans | 47.8 | 144.9 | 141.1 | -89.4 | -38.7 | 0 | 0 | 0 | 123 | ||||
| 56 | R | 36 | Very low | 39 | Very low | 197 Ų | 197 | 141.2 Ų | 141.2 | 74% | 0.743 | 78% | 0.782 | S | S | * | * | cis | -158.4 | 130.3 | 1.1 | -173.8 | 160.8 | -72.5 | -167.2 | 4 | 113.3 | ||||
| 57 | C | 32.8 | Very low | 39.1 | Very low | 110 Ų | 110 | 141.4 Ų | 141.4 | 74% | 0.743 | 78% | 0.783 | S | S | * | * | trans | 46.4 | 161.5 | 148.9 | -59.8 | 0 | 0 | 0 | 0 | 125.2 | ||||
| 58 | S | 36.6 | Very low | 38.4 | Very low | 117 Ų | 117 | 144 Ų | 144 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | 82.5 | 82.5 | 150.6 | -60.9 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 59 | A | 36.9 | Very low | 38.8 | Very low | 96 Ų | 96 | 141.6 Ų | 141.6 | 79% | 0.793 | 78% | 0.775 | S | S | * | * | trans | -59.7 | 149 | 157.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 60 | T | 39.5 | Very low | 38.8 | Very low | 145 Ų | 145 | 140.8 Ų | 140.8 | 89% | 0.89 | 78% | 0.777 | S | S | * | * | trans | -138.1 | 146.4 | 144.9 | 42.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 61 | S | 45.2 | Very low | 38.5 | Very low | 103 Ų | 103 | 144 Ų | 144 | 72% | 0.72 | 78% | 0.781 | S | S | * | * | trans | -89.5 | 142 | -173.4 | -37.3 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 62 | R | 33.7 | Very low | 37.6 | Very low | 242 Ų | 242 | 149.8 Ų | 149.8 | 91% | 0.913 | 79% | 0.789 | S | S | * | * | -166.2 | 155.5 | 113.2 | -111.5 | 157.9 | -81.7 | -155 | -2.8 | 116.2 | |||||
| 63 | C | 36.9 | Very low | 37.8 | Very low | 124 Ų | 124 | 150.8 Ų | 150.8 | 84% | 0.838 | 79% | 0.79 | S | S | * | * | trans | -64 | 146.5 | 176.8 | 174.9 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 64 | S | 32.9 | Very low | 37.9 | Very low | 110 Ų | 110 | 157.7 Ų | 157.7 | 77% | 0.769 | 80% | 0.797 | S | S | * | * | trans | -133 | 120.5 | 151.5 | 56.1 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 65 | Y | 33.2 | Very low | 37.7 | Very low | 196 Ų | 196 | 158 Ų | 158 | 77% | 0.769 | 80% | 0.8 | S | S | * | * | trans | -12.3 | 123.3 | 150.5 | -154.1 | -107.9 | 0 | 0 | 0 | 115.7 | D67 | Y65-D67 WeakPolarHBondContact CD1-OD2 3.49Å; Y65-D67 WeakPolarHBondContact CE1-OD2 3.39Å; Y65-D67 PolarHBondContact O-N 2.84Å | ||
| 66 | R | 43.4 | Very low | 38 | Very low | 230 Ų | 230 | 155.3 Ų | 155.3 | 87% | 0.868 | 80% | 0.8 | S | S | * | * | trans | -91.3 | 95.2 | 167.1 | -93.7 | -165.4 | 166.4 | -153.9 | -4.7 | 110.9 | ||||
| 67 | D | 34.7 | Very low | 38.2 | Very low | 126 Ų | 126 | 152 Ų | 152 | 67% | 0.674 | 80% | 0.801 | S | S | * | * | trans | -65.7 | 145.1 | 163.2 | -99.9 | -61.5 | 0 | 0 | 0 | 111.7 | Y65 | Y65-D67 WeakPolarHBondContact CD1-OD2 3.49Å; Y65-D67 WeakPolarHBondContact CE1-OD2 3.39Å; Y65-D67 PolarHBondContact O-N 2.84Å | ||
| 68 | F | 35 | Very low | 38.6 | Very low | 186 Ų | 186 | 153.6 Ų | 153.6 | 82% | 0.816 | 81% | 0.808 | S | S | * | * | trans | -110.1 | 101.4 | 171 | -92.1 | -88.5 | 0 | 0 | 0 | 109.6 | M70 | F68-M70 PolarHBondContact O-N 2.82Š| ||
| 69 | P | 43 | Very low | 38.8 | Very low | 100 Ų | 100 | 153.1 Ų | 153.1 | 65% | 0.649 | 80% | 0.8 | S | S | * | * | trans | -74.8 | 110.1 | 177.2 | 28.9 | -32.9 | 0 | 0 | 0 | 110.8 | Q71 | P69-Q71 PolarHBondContact O-N 3.15Å; P69-Q71 VanDerWaalsContact O-N 3.09Å | ||
| 70 | M | 42.3 | Very low | 38.9 | Very low | 190 Ų | 190 | 155.7 Ų | 155.7 | 94% | 0.936 | 80% | 0.8 | S | S | * | * | trans | -74.2 | 99.5 | 171.2 | -127.6 | -177.6 | -173.3 | 0 | 0 | 109.7 | F68 | F68-M70 PolarHBondContact O-N 2.82Š| ||
| 71 | Q | 36.2 | Very low | 38.8 | Very low | 167 Ų | 167 | 155.8 Ų | 155.8 | 78% | 0.78 | 79% | 0.793 | S | S | * | * | trans | -75.9 | 123.6 | -178 | -66.4 | 155.9 | 86.4 | 0 | 0 | 110.4 | P69 | P69-Q71 PolarHBondContact O-N 3.15Å; P69-Q71 VanDerWaalsContact O-N 3.09Å | ||
| 72 | W | 36.1 | Very low | 38.3 | Very low | 231 Ų | 231 | 154 Ų | 154 | 88% | 0.875 | 79% | 0.791 | S | S | * | * | trans | -99.5 | 89.1 | 168.7 | 56 | -82.3 | 0 | 0 | 0 | 109.5 | R74 | W72-R74 PolarHBondContact O-N 3.21Š| ||
| 73 | T | 42.8 | Very low | 38.2 | Very low | 137 Ų | 137 | 147.7 Ų | 147.7 | 84% | 0.84 | 79% | 0.791 | S | S | * | * | trans | -73 | 121.9 | 166.3 | 39.3 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 74 | R | 38.3 | Very low | 38.1 | Very low | 233 Ų | 233 | 150.8 Ų | 150.8 | 88% | 0.879 | 79% | 0.79 | S | S | * | * | trans | -131.8 | 111.2 | 159.2 | -177.6 | 170 | -179.2 | 151.9 | 2.6 | 108 | W72 | W72-R74 PolarHBondContact O-N 3.21Š| ||
| 75 | D | 41 | Very low | 38.2 | Very low | 163 Ų | 163 | 152.7 Ų | 152.7 | 87% | 0.872 | 79% | 0.787 | S | S | * | * | trans | -68.1 | 159 | -176.5 | -140.3 | -39 | 0 | 0 | 0 | 112.3 | ||||
| 76 | G | 40.8 | Very low | 38.3 | Very low | 59 Ų | 59 | 150 Ų | 150 | 61% | 0.608 | 79% | 0.791 | S | S | * | * | trans | -85.6 | 145 | -165.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 77 | T | 40.7 | Very low | 38.3 | Very low | 127 Ų | 127 | 144.5 Ų | 144.5 | 78% | 0.779 | 79% | 0.785 | S | S | * | * | trans | -151.9 | 110.7 | 152.9 | -36.1 | 0 | 0 | 0 | 0 | 109.8 | V79 | T77-V79 HydrophobicContact CG2-CG2 3.73Š| ||
| 78 | V | 40.9 | Very low | 38 | Very low | 144 Ų | 144 | 148.9 Ų | 148.9 | 87% | 0.873 | 79% | 0.792 | S | S | * | * | trans | -92.4 | 95.3 | 167.2 | 177.1 | 0 | 0 | 0 | 0 | 107.6 | N80 | V78-N80 PolarHBondContact O-N 3.4Š| ||
| 79 | V | 41.6 | Very low | 37.9 | Very low | 107 Ų | 107 | 145.1 Ų | 145.1 | 65% | 0.648 | 79% | 0.789 | S | S | * | * | trans | -83.5 | 100.2 | 173.7 | -169.8 | 0 | 0 | 0 | 0 | 108.3 | T77 I81 | T77-V79 HydrophobicContact CG2-CG2 3.73Å; V79-I81 HydrophobicContact CG1-CD1 4.39Å; V79-I81 HydrophobicContact CG1-CG1 3.93Å; V79-I81 PolarHBondContact O-N 3.23Å | ||
| 80 | N | 38.8 | Very low | 37.4 | Very low | 150 Ų | 150 | 148.2 Ų | 148.2 | 80% | 0.802 | 80% | 0.795 | S | S | * | * | trans | -78.8 | 100.8 | 175.4 | -172 | 12.5 | 0 | 0 | 0 | 109.7 | V78 | V78-N80 PolarHBondContact O-N 3.4Š| ||
| 81 | I | 36.9 | Very low | 37 | Very low | 147 Ų | 147 | 144.7 Ų | 144.7 | 75% | 0.754 | 79% | 0.789 | S | S | * | * | trans | -93.7 | 111.1 | 176.2 | -59.8 | -177.2 | 0 | 0 | 0 | 108.5 | V79 | V79-I81 HydrophobicContact CG1-CD1 4.39Å; V79-I81 HydrophobicContact CG1-CG1 3.93Å; V79-I81 PolarHBondContact O-N 3.23Å | ||
| 82 | G | 34.3 | Very low | 36.9 | Very low | 65 Ų | 65 | 141.8 Ų | 141.8 | 67% | 0.67 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 153.3 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 83 | A | 33 | Very low | 37 | Very low | 109 Ų | 109 | 135.6 Ų | 135.6 | 90% | 0.901 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -84 | 150.5 | 165.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 84 | F | 33.9 | Very low | 36.7 | Very low | 190 Ų | 190 | 137.4 Ų | 137.4 | 83% | 0.833 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 168.8 | -168.5 | -175.6 | -104.2 | 0 | 0 | 0 | 113.7 | ||
| 85 | E | 34.7 | Very low | 36.8 | Very low | 149 Ų | 149 | 135.5 Ų | 135.5 | 70% | 0.696 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 163.4 | -167.4 | -49.6 | -178.2 | 106.3 | 0 | 0 | 116.1 | ||
| 86 | T | 35.2 | Very low | 36.5 | Very low | 139 Ų | 139 | 131.6 Ų | 131.6 | 85% | 0.853 | 79% | 0.787 | S | S | * | * | -171.4 | 166.2 | 119.4 | 21.3 | 0 | 0 | 0 | 0 | 111 | |||||
| 87 | P | 44.4 | Very low | 36.5 | Very low | 115 Ų | 115 | 138.7 Ų | 138.7 | 75% | 0.747 | 80% | 0.801 | S | S | * | * | trans | -123.4 | 171.2 | -140.7 | 44.9 | -37.1 | 0 | 0 | 0 | 118.9 | ||||
| 88 | R | 28.4 | Very low | 36.2 | Very low | 218 Ų | 218 | 137.5 Ų | 137.5 | 82% | 0.823 | 80% | 0.798 | S | S | * | * | trans | 44.9 | 110.1 | 141.5 | -174.7 | -171.9 | 179.1 | 171.2 | 1.3 | 120.1 | ||||
| 89 | S | 31.8 | Very low | 36.1 | Very low | 108 Ų | 108 | 140 Ų | 140 | 76% | 0.755 | 80% | 0.797 | S | S | * | * | -170.8 | 120.3 | 127.1 | 58.9 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 90 | E | 34.2 | Very low | 36.2 | Very low | 165 Ų | 165 | 146.6 Ų | 146.6 | 77% | 0.771 | 81% | 0.81 | S | S | * | * | trans | 16 | 126 | 143.8 | -65.7 | 162.1 | -166.3 | 0 | 0 | 122.7 | ||||
| 91 | S | 32.3 | Very low | 36.5 | Very low | 115 Ų | 115 | 145.4 Ų | 145.4 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | 170.1 | 120.4 | 126.9 | 38.5 | 0 | 0 | 0 | 0 | 108.6 | |||||
| 92 | A | 34.4 | Very low | 36.9 | Very low | 106 Ų | 106 | 147.6 Ų | 147.6 | 88% | 0.876 | 82% | 0.815 | S | S | * | * | 66.9 | 114.4 | 65.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 93 | A | 39.1 | Very low | 37 | Very low | 101 Ų | 101 | 151.7 Ų | 151.7 | 84% | 0.835 | 82% | 0.821 | S | S | * | * | trans | -101.4 | 145.2 | -171 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 94 | E | 36.6 | Very low | 37.6 | Very low | 175 Ų | 175 | 153.7 Ų | 153.7 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | trans | -155.4 | 170.2 | 159.5 | -114.7 | -94 | 72.6 | 0 | 0 | 111.7 | ||||
| 95 | K | 40.4 | Very low | 37.8 | Very low | 194 Ų | 194 | 152.2 Ų | 152.2 | 84% | 0.843 | 82% | 0.816 | S | S | * | * | trans | -98.8 | 138.4 | -162.9 | -63.9 | 154.2 | -175.7 | 157.5 | 0 | 113.1 | ||||
| 96 | G | 34.8 | Very low | 38.2 | Very low | 81 Ų | 81 | 152.6 Ų | 152.6 | 84% | 0.835 | 82% | 0.821 | S | S | * | * | trans | -135.9 | 116.3 | 170.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 97 | K | 39.2 | Very low | 38.4 | Very low | 208 Ų | 208 | 154.3 Ų | 154.3 | 90% | 0.904 | 82% | 0.817 | S | S | * | * | trans | -106.8 | 117.8 | 174.6 | -74.5 | 178.3 | 176.9 | 175.1 | 0 | 111.2 | ||||
| 98 | S | 34.5 | Very low | 38.6 | Very low | 102 Ų | 102 | 156.6 Ų | 156.6 | 71% | 0.713 | 82% | 0.821 | S | S | * | * | trans | -176.4 | 138.8 | 140.1 | -94.6 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 99 | K | 39.9 | Very low | 39.1 | Very low | 197 Ų | 197 | 153 Ų | 153 | 86% | 0.857 | 82% | 0.818 | S | S | * | * | trans | 50.7 | 101.9 | 134.6 | -57 | 171.8 | -175 | 177.2 | 0 | 118.9 | ||||
| 100 | R | 43.2 | Very low | 39.6 | Very low | 244 Ų | 244 | 159.3 Ų | 159.3 | 92% | 0.921 | 83% | 0.826 | S | S | * | * | trans | -96 | 139.9 | 151.6 | -74.2 | -178.1 | 167.7 | -166.2 | -4.1 | 110.7 | ||||
| 101 | P | 46.2 | Very low | 39.8 | Very low | 126 Ų | 126 | 159.4 Ų | 159.4 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | trans | -74.9 | 177.2 | 157.3 | 32.1 | -32.2 | 0 | 0 | 0 | 111.7 | ||||
| 102 | K | 44.1 | Very low | 40.3 | Very low | 192 Ų | 192 | 159.1 Ų | 159.1 | 84% | 0.835 | 83% | 0.829 | S | S | * | * | trans | -112.8 | -177.2 | -168.6 | -64.8 | -179.1 | 176.5 | 178.3 | 0 | 113.2 | ||||
| 103 | L | 36.6 | Very low | 41.3 | Very low | 152 Ų | 152 | 159.6 Ų | 159.6 | 80% | 0.796 | 82% | 0.824 | S | S | * | * | trans | 79.8 | 131.8 | 173.2 | -77.4 | 81.1 | 0 | 0 | 0 | 115.2 | ||||
| 104 | L | 45.7 | Very low | 41.4 | Very low | 150 Ų | 150 | 159.5 Ų | 159.5 | 79% | 0.785 | 82% | 0.823 | S | S | * | * | cis | -142.9 | 144.8 | -15.2 | -86.2 | 175.5 | 0 | 0 | 0 | 108.9 | ||||
| 105 | N | 37.3 | Very low | 41.7 | Very low | 159 Ų | 159 | 158 Ų | 158 | 85% | 0.85 | 83% | 0.825 | S | S | * | * | trans | -114 | 119.5 | 165.8 | -101.9 | 77.4 | 0 | 0 | 0 | 109.3 | ||||
| 106 | I | 43.6 | Very low | 42.1 | Very low | 157 Ų | 157 | 153.3 Ų | 153.3 | 81% | 0.805 | 82% | 0.817 | S | S | * | * | trans | -73.6 | 131.1 | 168.5 | -63.8 | 173 | 0 | 0 | 0 | 107.9 | ||||
| 107 | K | 39.9 | Very low | 42.7 | Very low | 176 Ų | 176 | 157.2 Ų | 157.2 | 77% | 0.765 | 81% | 0.813 | S | S | * | * | trans | -92.1 | 145.2 | 170 | -65.4 | 179.5 | 179.3 | -178.7 | 0 | 109.2 | ||||
| 108 | I | 49.2 | Very low | 43.1 | Very low | 162 Ų | 162 | 152.9 Ų | 152.9 | 83% | 0.831 | 81% | 0.806 | S | S | * | * | trans | -119.4 | 112 | 163.8 | -63.8 | 175.9 | 0 | 0 | 0 | 105.5 | ||||
| 109 | D | 38.8 | Very low | 43.7 | Very low | 143 Ų | 143 | 155 Ų | 155 | 77% | 0.765 | 81% | 0.808 | S | S | * | * | trans | -72.5 | 137.6 | 179.5 | -66.4 | -71.5 | 0 | 0 | 0 | 110.9 | ||||
| 110 | R | 42.3 | Very low | 43.8 | Very low | 241 Ų | 241 | 152.4 Ų | 152.4 | 91% | 0.909 | 81% | 0.809 | S | S | * | * | trans | -126 | 73.1 | 179.4 | -169.6 | 178.8 | -174.6 | 170 | 2.2 | 109 | ||||
| 111 | N | 37.9 | Very low | 43.9 | Very low | 166 Ų | 166 | 149.6 Ų | 149.6 | 89% | 0.888 | 81% | 0.806 | S | S | * | * | trans | -77 | 132.1 | -173.8 | -143.3 | 39.9 | 0 | 0 | 0 | 111.1 | ||||
| 112 | S | 43.7 | Very low | 43.3 | Very low | 109 Ų | 109 | 149.1 Ų | 149.1 | 76% | 0.762 | 81% | 0.806 | S | S | * | * | trans | -146.3 | 112.1 | 178.8 | -175.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 113 | P | 54.9 | Low | 43.2 | Very low | 117 Ų | 117 | 144.4 Ų | 144.4 | 76% | 0.76 | 80% | 0.797 | S | S | * | * | trans | -92.8 | 143.3 | 173.5 | 34.4 | -30 | 0 | 0 | 0 | 111.3 | ||||
| 114 | A | 40.6 | Very low | 43.6 | Very low | 99 Ų | 99 | 143.7 Ų | 143.7 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | trans | -124.5 | 139.5 | 165.1 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 115 | V | 43.7 | Very low | 43.6 | Very low | 143 Ų | 143 | 144.9 Ų | 144.9 | 87% | 0.867 | 80% | 0.796 | S | S | * | * | trans | -143.4 | 149.1 | 172.7 | -175.8 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 116 | S | 48 | Very low | 44.2 | Very low | 95 Ų | 95 | 142.1 Ų | 142.1 | 66% | 0.664 | 80% | 0.795 | S | S | * | * | trans | -123.4 | 171.3 | -163.5 | -49.9 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 117 | E | 46.6 | Very low | 44.2 | Very low | 164 Ų | 164 | 140.9 Ų | 140.9 | 77% | 0.766 | 79% | 0.79 | S | S | * | * | trans | 70.1 | 159.8 | 164.1 | -53.5 | -45.5 | 123.6 | 0 | 0 | 118.4 | ||||
| 118 | P | 48.4 | Very low | 45 | Very low | 117 Ų | 117 | 140.7 Ų | 140.7 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | cis | -129.2 | -173.2 | -19.2 | 24.5 | -0.9 | 0 | 0 | 0 | 114.2 | ||||
| 119 | I | 47.5 | Very low | 45 | Very low | 147 Ų | 147 | 140.6 Ų | 140.6 | 75% | 0.754 | 79% | 0.786 | S | S | * | * | trans | -77.6 | 143.4 | 177.3 | -22.5 | 171.1 | 0 | 0 | 0 | 113.2 | ||||
| 120 | T | 42.4 | Very low | 45.2 | Very low | 142 Ų | 142 | 139.7 Ų | 139.7 | 87% | 0.871 | 79% | 0.785 | S | S | * | * | trans | -153 | 158 | 143.3 | 39.1 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 121 | E | 43.9 | Very low | 45.8 | Very low | 184 Ų | 184 | 133.1 Ų | 133.1 | 86% | 0.86 | 78% | 0.782 | S | S | * | * | trans | -118.4 | 145 | -179.3 | -52 | 173.2 | 159.1 | 0 | 0 | 109.4 | ||||
| 122 | S | 35 | Very low | 46.2 | Very low | 116 Ų | 116 | 132.7 Ų | 132.7 | 81% | 0.811 | 78% | 0.78 | S | S | * | * | trans | 168.7 | 111.5 | 151.5 | 174.7 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 123 | S | 42.3 | Very low | 46.6 | Very low | 94 Ų | 94 | 131.1 Ų | 131.1 | 66% | 0.657 | 78% | 0.781 | S | S | * | * | 55.6 | 146 | 124.7 | -130 | 0 | 0 | 0 | 0 | 125.8 | |||||
| 124 | D | 44.6 | Very low | 46.3 | Very low | 137 Ų | 137 | 129.9 Ų | 129.9 | 73% | 0.733 | 78% | 0.775 | S | S | * | * | trans | 79 | 107.4 | 149.2 | -60.4 | -55.9 | 0 | 0 | 0 | 124.2 | ||||
| 125 | E | 45.5 | Very low | 46.4 | Very low | 175 Ų | 175 | 132.2 Ų | 132.2 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | 41.5 | 125 | 125.8 | -67.7 | -70.8 | 87.6 | 0 | 0 | 123 | |||||
| 126 | A | 50 | Low | 46.5 | Very low | 101 Ų | 101 | 131.2 Ų | 131.2 | 84% | 0.835 | 77% | 0.768 | S | S | * | * | -166.5 | 135.1 | 124.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 127 | D | 44.2 | Very low | 46.5 | Very low | 131 Ų | 131 | 133.9 Ų | 133.9 | 70% | 0.701 | 77% | 0.774 | S | S | * | * | trans | -62.6 | 146.5 | 177.6 | -179.4 | -104.5 | 0 | 0 | 0 | 115.8 | ||||
| 128 | Q | 54.6 | Low | 46.4 | Very low | 172 Ų | 172 | 133.6 Ų | 133.6 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | 159.4 | 153.5 | 135 | -87.2 | 158.6 | 106.9 | 0 | 0 | 112.5 | ||||
| 129 | K | 50.8 | Low | 46.4 | Very low | 160 Ų | 160 | 135.5 Ų | 135.5 | 70% | 0.696 | 78% | 0.777 | S | S | * | * | cis | -174.5 | 129.5 | -23.8 | 167.5 | 167.6 | 176 | 179.3 | 0 | 110.2 | ||||
| 130 | T | 41.9 | Very low | 46.4 | Very low | 123 Ų | 123 | 137.2 Ų | 137.2 | 76% | 0.755 | 78% | 0.782 | S | S | * | * | trans | 34 | 126.8 | 162.4 | 61.4 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 131 | A | 55 | Low | 46.8 | Very low | 103 Ų | 103 | 137.8 Ų | 137.8 | 85% | 0.851 | 78% | 0.779 | S | S | * | * | -163.3 | 144.4 | 113.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 132 | D | 46.4 | Very low | 47.1 | Very low | 158 Ų | 158 | 132.9 Ų | 132.9 | 85% | 0.845 | 77% | 0.77 | S | S | * | * | trans | -91.2 | 162.3 | 168.2 | 175.9 | -131 | 0 | 0 | 0 | 110.5 | ||||
| 133 | G | 52.2 | Low | 47.7 | Very low | 75 Ų | 75 | 132.4 Ų | 132.4 | 77% | 0.773 | 77% | 0.767 | S | S | * | * | trans | -177 | 65.9 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 134 | S | 48.8 | Very low | 47.8 | Very low | 92 Ų | 92 | 133.4 Ų | 133.4 | 64% | 0.643 | 77% | 0.774 | S | S | * | * | trans | -96.1 | 171.9 | 177.8 | -166.7 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 135 | L | 41.7 | Very low | 47.3 | Very low | 147 Ų | 147 | 130.4 Ų | 130.4 | 77% | 0.77 | 78% | 0.776 | S | S | * | * | trans | 74 | 111.6 | 170.5 | -50.7 | -175.6 | 0 | 0 | 0 | 115.1 | ||||
| 136 | T | 46.3 | Very low | 47.7 | Very low | 123 Ų | 123 | 127.9 Ų | 127.9 | 76% | 0.755 | 77% | 0.774 | S | S | * | * | 79.8 | 113.2 | 63.5 | 62.7 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 137 | D | 49.2 | Very low | 47.3 | Very low | 150 Ų | 150 | 130.4 Ų | 130.4 | 80% | 0.802 | 77% | 0.774 | S | S | * | * | trans | -159 | 108.9 | 156.6 | -149.8 | -140.7 | 0 | 0 | 0 | 104.3 | ||||
| 138 | E | 43.2 | Very low | 47.3 | Very low | 158 Ų | 158 | 129 Ų | 129 | 74% | 0.738 | 78% | 0.78 | S | S | * | * | 55.5 | 105.8 | 67.1 | -57.6 | -69.8 | 77.8 | 0 | 0 | 111.5 | |||||
| 139 | N | 48.1 | Very low | 47 | Very low | 158 Ų | 158 | 130.1 Ų | 130.1 | 85% | 0.845 | 78% | 0.777 | S | S | * | * | trans | -133.3 | 80.1 | -179.4 | -151.4 | -109.5 | 0 | 0 | 0 | 111.5 | ||||
| 140 | E | 48.2 | Very low | 46.7 | Very low | 183 Ų | 183 | 134.1 Ų | 134.1 | 86% | 0.855 | 79% | 0.788 | S | S | * | * | trans | -97.1 | 114.1 | 174.5 | -68.9 | -81.2 | 124.7 | 0 | 0 | 109.5 | ||||
| 141 | D | 51.7 | Low | 47 | Very low | 153 Ų | 153 | 135 Ų | 135 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -124.1 | 122 | 163.8 | 178.4 | 40.8 | 0 | 0 | 0 | 110.1 | ||||
| 142 | A | 50.3 | Low | 46.6 | Very low | 81 Ų | 81 | 141.4 Ų | 141.4 | 67% | 0.669 | 79% | 0.786 | S | S | * | * | trans | -158.8 | 79.8 | -170.2 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 143 | S | 47.3 | Very low | 46.4 | Very low | 106 Ų | 106 | 137.6 Ų | 137.6 | 74% | 0.741 | 78% | 0.783 | S | S | * | * | trans | -174.4 | 158 | 155.1 | -94.4 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 144 | S | 44.6 | Very low | 46.1 | Very low | 115 Ų | 115 | 139.3 Ų | 139.3 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | cis | -169 | 145.9 | -22 | -99.6 | 0 | 0 | 0 | 0 | 108 | ||||
| 145 | G | 33.8 | Very low | 46.2 | Very low | 75 Ų | 75 | 140.4 Ų | 140.4 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | trans | -170.6 | 107.1 | 180 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 146 | P | 53.8 | Low | 46.4 | Very low | 121 Ų | 121 | 138.4 Ų | 138.4 | 79% | 0.786 | 80% | 0.796 | S | S | * | * | trans | -105 | 165 | -166.2 | 38.2 | -35.7 | 0 | 0 | 0 | 116.4 | ||||
| 147 | N | 41.5 | Very low | 46.7 | Very low | 155 Ų | 155 | 136.3 Ų | 136.3 | 83% | 0.829 | 80% | 0.8 | S | S | * | * | trans | 71.9 | 109.5 | 152.2 | -103.4 | -35.7 | 0 | 0 | 0 | 121.1 | ||||
| 148 | A | 43.9 | Very low | 46.7 | Very low | 100 Ų | 100 | 134.2 Ų | 134.2 | 83% | 0.826 | 80% | 0.797 | S | S | * | * | trans | -152.6 | 84.4 | 148.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | R150 | A148-R150 PolarHBondContact O-N 3.21Š| ||
| 149 | R | 49 | Very low | 46.8 | Very low | 196 Ų | 196 | 132.2 Ų | 132.2 | 74% | 0.74 | 80% | 0.799 | S | S | * | * | trans | -63 | 117.9 | 178.6 | -177.2 | -175.5 | -169.3 | -85.5 | -8.3 | 112 | E151 | R149-E151 IonicContact CZ-OE2 3.62Å; R149-E151 IonicContact NH1-OE2 3.66Å; R149-E151 IonicContact NH2-OE2 3.45Å; R149-E151 PolarHBondContact NH2-OE2 2.75Å | ||
| 150 | R | 44.8 | Very low | 47 | Very low | 244 Ų | 244 | 130.4 Ų | 130.4 | 92% | 0.921 | 80% | 0.798 | S | S | * | * | trans | -136.1 | 93.1 | 162.5 | -78.7 | -164.9 | 174.1 | -165.4 | -0.7 | 112.5 | A148 | A148-R150 PolarHBondContact O-N 3.21Š| ||
| 151 | E | 47 | Very low | 47.4 | Very low | 143 Ų | 143 | 124.2 Ų | 124.2 | 67% | 0.668 | 78% | 0.783 | S | S | * | * | trans | -71.2 | 135.4 | 154.7 | -69.3 | -175.5 | 119.4 | 0 | 0 | 110 | R149 | R149-E151 IonicContact CZ-OE2 3.62Å; R149-E151 IonicContact NH1-OE2 3.66Å; R149-E151 IonicContact NH2-OE2 3.45Å; R149-E151 PolarHBondContact NH2-OE2 2.75Å | ||
| 152 | R | 46.2 | Very low | 48 | Very low | 237 Ų | 237 | 128.3 Ų | 128.3 | 89% | 0.894 | 79% | 0.788 | S | S | * | * | trans | -152.2 | 102.7 | 147.7 | -173.4 | 158.1 | -68.8 | -105 | -2.4 | 108.7 | ||||
| 153 | G | 43.9 | Very low | 48.9 | Very low | 77 Ų | 77 | 133.8 Ų | 133.8 | 79% | 0.794 | 80% | 0.796 | S | S | * | * | trans | -63.7 | 140.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 154 | S | 46 | Very low | 50.4 | Low | 112 Ų | 112 | 138.4 Ų | 138.4 | 78% | 0.783 | 80% | 0.803 | S | S | * | * | trans | -147.8 | 103.5 | 158.1 | -170.1 | 0 | 0 | 0 | 0 | 108.3 | S156 | S154-S156 PolarHBondContact O-N 3.23Å; S154-S156 VanDerWaalsContact O-N 3.14Å | ||
| 155 | A | 50.3 | Low | 52.2 | Low | 115 Ų | 115 | 142.6 Ų | 142.6 | 95% | 0.95 | 81% | 0.807 | S | S | * | * | trans | -77.3 | 98 | 177.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 156 | S | 46.4 | Very low | 54.8 | Low | 104 Ų | 104 | 145.3 Ų | 145.3 | 73% | 0.727 | 81% | 0.808 | S | S | * | * | trans | -124.6 | 118.5 | 167.4 | -174.2 | 0 | 0 | 0 | 0 | 109.2 | S154 S158 | S154-S156 PolarHBondContact O-N 3.23Å; S154-S156 VanDerWaalsContact O-N 3.14Å; S156-S158 VanDerWaalsContact C-N 3.27Å; S156-S158 PolarHBondContact O-N 3.41Å | ||
| 157 | G | 51.3 | Low | 56.6 | Low | 80 Ų | 80 | 150.2 Ų | 150.2 | 83% | 0.825 | 81% | 0.811 | S | S | * | * | trans | -73.5 | 72.7 | -173.3 | 0 | 0 | 0 | 0 | 0 | 113 | C159 | G157-C159 VanDerWaalsContact C-N 3.31Å; G157-C159 PolarHBondContact O-N 2.9Å | ||
| 158 | S | 49.8 | Very low | 59 | Low | 106 Ų | 106 | 147.5 Ų | 147.5 | 74% | 0.741 | 80% | 0.8 | S | S | * | * | trans | -63.5 | 96.1 | 162.8 | -175.4 | 0 | 0 | 0 | 0 | 108.3 | S156 S160 | S156-S158 VanDerWaalsContact C-N 3.27Å; S156-S158 PolarHBondContact O-N 3.41Å; S158-S160 PolarHBondContact O-N 2.71Å; S158-S160 VanDerWaalsContact O-N 3.17Å | ||
| 159 | C | 45.4 | Very low | 61.4 | Low | 116 Ų | 116 | 149.2 Ų | 149.2 | 78% | 0.784 | 80% | 0.8 | S | S | * | * | trans | -62.4 | 119.5 | 175.6 | 55 | 0 | 0 | 0 | 0 | 108.6 | G157 G161 | G157-C159 VanDerWaalsContact C-N 3.31Å; G157-C159 PolarHBondContact O-N 2.9Å; C159-G161 PolarHBondContact O-N 2.97Å | ||
| 160 | S | 51.8 | Low | 63.8 | Low | 119 Ų | 119 | 142.5 Ų | 142.5 | 83% | 0.832 | 78% | 0.776 | S | S | * | * | trans | -71.8 | 53.2 | 178 | -63.4 | 0 | 0 | 0 | 0 | 112.1 | S158 R162 | S158-S160 PolarHBondContact O-N 2.71Å; S158-S160 VanDerWaalsContact O-N 3.17Å; S160-R162 PolarHBondContact O-N 3.17Å | ||
| 161 | G | 56.5 | Low | 66.3 | Low | 53 Ų | 53 | 134.1 Ų | 134.1 | 55% | 0.546 | 76% | 0.756 | S | S | . | * | trans | -59.1 | 106.5 | 174 | 0 | 0 | 0 | 0 | 0 | 109.1 | C159 K163 | C159-G161 PolarHBondContact O-N 2.97Å; G161-K163 VanDerWaalsContact C-N 3.33Å; G161-K163 PolarHBondContact O-N 2.77Å | ||
| 162 | R | 64.3 | Low | 68.8 | Low | 240 Ų | 240 | 137.1 Ų | 137.1 | 91% | 0.906 | 76% | 0.761 | S | S | * | * | trans | -57.3 | 92.9 | -179.9 | -70.1 | -179.6 | -81.2 | -169.4 | -4.6 | 109.5 | S160 K164 | S160-R162 PolarHBondContact O-N 3.17Å; R162-K164 PolarHBondContact O-N 3.17Å | ||
| 163 | K | 70.5 | Confident | 71.3 | Confident | 195 Ų | 195 | 129 Ų | 129 | 85% | 0.848 | 74% | 0.74 | S | S | * | * | trans | -54 | 108.3 | -174.9 | -65 | -179.2 | -178.9 | 177.8 | 0 | 109.1 | G161 K165 | G161-K163 VanDerWaalsContact C-N 3.33Å; G161-K163 PolarHBondContact O-N 2.77Å; K163-K165 PolarHBondContact O-N 3.46Å; K163-K165 VanDerWaalsContact O-N 3.08Å | ||
| 164 | K | 78.8 | Confident | 73.9 | Confident | 204 Ų | 204 | 127.3 Ų | 127.3 | 89% | 0.887 | 71% | 0.712 | S | S | * | * | trans | -59.7 | 115 | 178 | -85.6 | -179.2 | 174.3 | 174.9 | 0 | 108.2 | R162 T166 | R162-K164 PolarHBondContact O-N 3.17Å; K164-T166 PolarHBondContact O-N 3.29Å | ||
| 165 | K | 81.6 | Confident | 76.4 | Confident | 202 Ų | 202 | 123.7 Ų | 123.7 | 88% | 0.878 | 69% | 0.685 | S | S | * | * | trans | -66.6 | 113.3 | 178.2 | -72 | 136.7 | 70 | 168.9 | 0 | 108.6 | K163 R167 | K163-K165 PolarHBondContact O-N 3.46Å; K163-K165 VanDerWaalsContact O-N 3.08Å; K165-R167 PolarHBondContact O-N 3.08Å | ||
| 166 | T | 89.1 | Confident | 78.7 | Confident | 132 Ų | 132 | 124.8 Ų | 124.8 | 81% | 0.81 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 135.3 | 178 | -56.2 | 0 | 0 | 0 | 0 | 110.1 | K164 T168 | K164-T166 PolarHBondContact O-N 3.29Å; T166-T168 PolarHBondContact O-N 2.94Å |
| 167 | R | 91.6 | Very high | 81.2 | Confident | 225 Ų | 225 | 123.3 Ų | 123.3 | 85% | 0.849 | 65% | 0.65 | S | S | * | * | P | Polyproline II helix | trans | -71 | 118.6 | -178.6 | -173.5 | 178.3 | -174.7 | 173.6 | 2.3 | 109.7 | K165 | K165-R167 PolarHBondContact O-N 3.08Š|
| 168 | T | 90.6 | Very high | 83.4 | Confident | 97 Ų | 97 | 119.5 Ų | 119.5 | 60% | 0.595 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 146.6 | 173.1 | 51.1 | 0 | 0 | 0 | 0 | 111.2 | T166 | T166-T168 PolarHBondContact O-N 2.94Š|
| 169 | V | 95.6 | Very high | 85.8 | Confident | 136 Ų | 136 | 117.2 Ų | 117.2 | 82% | 0.824 | 59% | 0.588 | S | S | * | * | trans | -110.5 | 148.6 | 170 | -68 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 170 | F | 98.1 | Very high | 88.3 | Confident | 55 Ų | 55 | 114.5 Ų | 114.5 | 24% | 0.241 | 57% | 0.57 | C | S | . | * | trans | -95.7 | 148 | 176.7 | -58.3 | -42.1 | 0 | 0 | 0 | 110.7 | Q174 V175 L178 L202 Q206 W210 | F170-Q174 HydrophobicContact CB-CB 4.26Å; F170-V175 HydrophobicContact CB-CG2 3.96Å; F170-L178 HydrophobicContact CD2-CD1 4.41Å; F170-L202 HydrophobicContact CD1-CD1 4.43Å; F170-L202 HydrophobicContact CD1-CD2 3.76Å; F170-L202 HydrophobicContact CE1-CD1 4.37Å; F170-L202 HydrophobicContact CE1-CD2 3.64Å; F170-L202 HydrophobicContact CZ-CD2 4.5Å; F170-Q206 HydrophobicContact CE1-CB 4.41Å; F170-Q206 HydrophobicContact CE1-CG 4.35Å; F170-Q206 HydrophobicContact CZ-CB 3.96Å; F170-Q206 HydrophobicContact CZ-CG 4.14Å; F170-W210 AromaticContact CD2-CD1 3.85Å; F170-W210 HydrophobicContact CE2-CB 4.36Å; F170-W210 AromaticContact CE2-CD1 3.79Å; F170-W210 HydrophobicContact CE2-CG 4.42Å | ||
| 171 | S | 98.6 | Very high | 90.5 | Very high | 69 Ų | 69 | 110.8 Ų | 110.8 | 48% | 0.483 | 54% | 0.543 | S | S | . | . | trans | -63.2 | 152.1 | 175.5 | 175.4 | 0 | 0 | 0 | 0 | 111.5 | S173 Q174 V175 | S171-S173 PolarHBondContact O-N 3.04Å; S171-Q174 WeakPolarHBondContact O-CB 3.39Å; S171-Q174 PolarHBondContact O-N 3.21Å; S171-V175 PolarHBondContact O-N 2.78Å | ||
| 172 | R | 98.4 | Very high | 92.6 | Very high | 206 Ų | 206 | 108.3 Ų | 108.3 | 78% | 0.777 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -57.7 | -34.5 | 179.1 | -174.6 | 59.5 | 177.2 | -89.2 | 1.6 | 112.5 | F176 | R172-F176 WeakPolarHBondContact O-CB 3.19Å; R172-F176 PolarHBondContact O-N 2.94Å |
| 173 | S | 98.4 | Very high | 94.2 | Very high | 67 Ų | 67 | 100.8 Ų | 100.8 | 47% | 0.469 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -66.8 | -43.2 | 174.3 | 176.6 | 0 | 0 | 0 | 0 | 112.4 | S171 V175 F176 Q177 | S171-S173 PolarHBondContact O-N 3.04Å; S173-V175 PolarHBondContact O-N 3Å; S173-F176 PolarHBondContact O-N 3.38Å; S173-Q177 WeakPolarHBondContact O-CG 3.45Å; S173-Q177 PolarHBondContact O-N 3.17Å; S173-Q177 PolarHBondContact OG-NE2 3.08Å |
| 174 | Q | 98.6 | Very high | 95.5 | Very high | 40 Ų | 40 | 98.6 Ų | 98.6 | 19% | 0.187 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -62.1 | -44.4 | 175.3 | -68.2 | 170.8 | -41 | 0 | 0 | 111 | F170 S171 Q177 L178 L200 | F170-Q174 HydrophobicContact CB-CB 4.26Å; S171-Q174 WeakPolarHBondContact O-CB 3.39Å; S171-Q174 PolarHBondContact O-N 3.21Å; Q174-Q177 PolarHBondContact O-N 3.37Å; Q174-L178 WeakPolarHBondContact O-CB 3.38Å; Q174-L178 WeakPolarHBondContact O-CD1 3.07Å; Q174-L178 WeakPolarHBondContact O-CG 3.41Å; Q174-L178 PolarHBondContact O-N 2.94Å; Q174-L200 HydrophobicContact CG-CB 4.48Å; Q174-L200 PolarHBondContact NE2-O 3.49Å |
| 175 | V | 98.6 | Very high | 96.4 | Very high | 36 Ų | 36 | 93.2 Ų | 93.2 | 22% | 0.218 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -62.4 | -45.9 | 177 | 176.7 | 0 | 0 | 0 | 0 | 111.3 | F170 S171 S173 Q177 L178 E179 | F170-V175 HydrophobicContact CB-CG2 3.96Å; S171-V175 PolarHBondContact O-N 2.78Å; S173-V175 PolarHBondContact O-N 3Å; V175-Q177 PolarHBondContact O-N 3.47Å; V175-L178 PolarHBondContact O-N 3.06Å; V175-E179 HydrophobicContact CG1-CG 4.27Å; V175-E179 WeakPolarHBondContact O-CB 3.26Å; V175-E179 WeakPolarHBondContact O-CG 3.45Å; V175-E179 PolarHBondContact O-N 3.02Å |
| 176 | F | 98.6 | Very high | 97.2 | Very high | 139 Ų | 139 | 87.7 Ų | 87.7 | 61% | 0.61 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -58.7 | -45 | 178.5 | 174.1 | -103.1 | 0 | 0 | 0 | 112.6 | R172 S173 E179 S180 | R172-F176 WeakPolarHBondContact O-CB 3.19Å; R172-F176 PolarHBondContact O-N 2.94Å; S173-F176 PolarHBondContact O-N 3.38Å; F176-E179 PolarHBondContact O-N 3.39Å; F176-S180 WeakPolarHBondContact O-CB 3.35Å; F176-S180 PolarHBondContact O-N 2.9Å |
| 177 | Q | 98.7 | Very high | 97.7 | Very high | 73 Ų | 73 | 88.5 Ų | 88.5 | 34% | 0.341 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -67.3 | -41.1 | 177.9 | -69.5 | 179.7 | 70.4 | 0 | 0 | 112 | S173 Q174 V175 E179 S180 T181 L200 | S173-Q177 WeakPolarHBondContact O-CG 3.45Å; S173-Q177 PolarHBondContact O-N 3.17Å; S173-Q177 PolarHBondContact OG-NE2 3.08Å; Q174-Q177 PolarHBondContact O-N 3.37Å; V175-Q177 PolarHBondContact O-N 3.47Å; Q177-E179 VanDerWaalsContact C-N 3.34Å; Q177-E179 PolarHBondContact O-N 2.88Å; Q177-S180 PolarHBondContact O-N 2.94Å; Q177-T181 PolarHBondContact O-N 3.42Å; Q177-T181 PolarHBondContact O-OG1 3.24Å; Q177-T181 VanDerWaalsContact O-OG1 3.12Å; Q177-L200 HydrophobicContact CB-CD1 4.48Å; Q177-L200 HydrophobicContact CB-CD2 3.76Å; Q177-L200 VanDerWaalsContact CD-CD2 3.44Å; Q177-L200 HydrophobicContact CG-CD2 4.2Å |
| 178 | L | 98.8 | Very high | 98 | Very high | 0 Ų | 0 | 79.2 Ų | 79.2 | 0% | 0 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -61.4 | -39.3 | 173.7 | -72.4 | 165 | 0 | 0 | 0 | 112.4 | F170 Q174 V175 F182 L196 L200 L202 V207 W210 F211 | F170-L178 HydrophobicContact CD2-CD1 4.41Å; Q174-L178 WeakPolarHBondContact O-CB 3.38Å; Q174-L178 WeakPolarHBondContact O-CD1 3.07Å; Q174-L178 WeakPolarHBondContact O-CG 3.41Å; Q174-L178 PolarHBondContact O-N 2.94Å; V175-L178 PolarHBondContact O-N 3.06Å; L178-F182 VanDerWaalsContact O-CB 3.27Å; L178-F182 WeakPolarHBondContact O-CB 3.39Å; L178-F182 PolarHBondContact O-N 3.3Å; L178-L196 HydrophobicContact CD2-CD2 4Å; L178-L200 HydrophobicContact CD1-CD1 4.37Å; L178-L200 HydrophobicContact CD2-CD1 3.79Å; L178-L200 HydrophobicContact CG-CD1 3.68Å; L178-L202 HydrophobicContact CD1-CD1 4.17Å; L178-V207 HydrophobicContact CD2-CG1 4.35Å; L178-W210 VanDerWaalsContact C-CH2 3.47Å; L178-W210 HydrophobicContact CB-CD2 3.92Å; L178-W210 HydrophobicContact CB-CE3 3.88Å; L178-W210 HydrophobicContact CB-CH2 3.76Å; L178-W210 HydrophobicContact CB-CZ2 3.76Å; L178-W210 HydrophobicContact CB-CZ3 3.81Å; L178-W210 HydrophobicContact CD1-CD2 3.97Å; L178-W210 HydrophobicContact CD1-CG 3.93Å; L178-W210 HydrophobicContact CD2-CD2 4.39Å; L178-W210 HydrophobicContact CD2-CE3 4.23Å; L178-W210 HydrophobicContact CG-CD2 4.32Å; L178-W210 HydrophobicContact CG-CE3 4.46Å; L178-W210 WeakPolarHBondContact O-CH2 3.46Å; L178-W210 WeakPolarHBondContact O-CZ3 3.36Å; L178-F211 HydrophobicContact CD2-CD2 4.5Å; L178-F211 HydrophobicContact CD2-CE2 3.97Å |
| 179 | E | 98.8 | Very high | 98.4 | Very high | 58 Ų | 58 | 76.9 Ų | 76.9 | 27% | 0.271 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -68 | -48.2 | 175.2 | -70.8 | -175.3 | 126.1 | 0 | 0 | 111.5 | V175 F176 Q177 T181 F182 D183 W210 R214 | V175-E179 HydrophobicContact CG1-CG 4.27Å; V175-E179 WeakPolarHBondContact O-CB 3.26Å; V175-E179 WeakPolarHBondContact O-CG 3.45Å; V175-E179 PolarHBondContact O-N 3.02Å; F176-E179 PolarHBondContact O-N 3.39Å; Q177-E179 VanDerWaalsContact C-N 3.34Å; Q177-E179 PolarHBondContact O-N 2.88Å; E179-T181 PolarHBondContact O-N 3.06Å; E179-F182 WeakPolarHBondContact O-CB 3.38Å; E179-F182 PolarHBondContact O-N 3.36Å; E179-F182 VanDerWaalsContact O-N 3.1Å; E179-D183 VanDerWaalsContact O-CG 3.28Å; E179-D183 PolarHBondContact O-N 3.15Å; E179-W210 HydrophobicContact CB-CH2 4.45Å; E179-W210 HydrophobicContact CG-CH2 3.76Å; E179-W210 HydrophobicContact CG-CZ2 3.69Å; E179-R214 IonicContact OE1-CZ 2.62Å; E179-R214 IonicContact OE1-NH1 3.68Å; E179-R214 PolarHBondContact OE1-NH1 3.29Å; E179-R214 IonicContact OE1-NH2 3.49Å |
| 180 | S | 98.6 | Very high | 98.5 | Very high | 58 Ų | 58 | 73.7 Ų | 73.7 | 41% | 0.406 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -55.7 | -48.8 | 175.8 | 179 | 0 | 0 | 0 | 0 | 112.5 | F176 Q177 F182 D183 L184 | F176-S180 WeakPolarHBondContact O-CB 3.35Å; F176-S180 PolarHBondContact O-N 2.9Å; Q177-S180 PolarHBondContact O-N 2.94Å; S180-F182 VanDerWaalsContact C-N 3.34Å; S180-F182 PolarHBondContact O-N 2.86Å; S180-D183 PolarHBondContact O-N 2.62Å; S180-L184 WeakPolarHBondContact O-CG 3.23Å; S180-L184 PolarHBondContact O-N 3.01Å |
| 181 | T | 98.6 | Very high | 98.5 | Very high | 41 Ų | 41 | 75.3 Ų | 75.3 | 25% | 0.252 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -66.1 | -34.9 | 176.2 | -53.3 | 0 | 0 | 0 | 0 | 112.5 | Q177 E179 K185 L188 L196 F211 | Q177-T181 PolarHBondContact O-N 3.42Å; Q177-T181 PolarHBondContact O-OG1 3.24Å; Q177-T181 VanDerWaalsContact O-OG1 3.12Å; E179-T181 PolarHBondContact O-N 3.06Å; T181-K185 PolarHBondContact O-N 3.39Å; T181-L188 HydrophobicContact CG2-CD1 4.35Å; T181-L188 HydrophobicContact CG2-CD2 4.16Å; T181-L196 HydrophobicContact CG2-CD2 4.02Å; T181-F211 HydrophobicContact CG2-CZ 4.29Å |
| 182 | F | 98.8 | Very high | 98.5 | Very high | 2 Ų | 2 | 75.2 Ų | 75.2 | 1% | 0.009 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -66.9 | -41.9 | 175.8 | 174.6 | -95.1 | 0 | 0 | 0 | 112.5 | L178 E179 S180 L184 K185 R186 W210 F211 R214 R215 W218 | L178-F182 VanDerWaalsContact O-CB 3.27Å; L178-F182 WeakPolarHBondContact O-CB 3.39Å; L178-F182 PolarHBondContact O-N 3.3Å; E179-F182 WeakPolarHBondContact O-CB 3.38Å; E179-F182 PolarHBondContact O-N 3.36Å; E179-F182 VanDerWaalsContact O-N 3.1Å; S180-F182 VanDerWaalsContact C-N 3.34Å; S180-F182 PolarHBondContact O-N 2.86Å; F182-L184 VanDerWaalsContact C-N 3.26Å; F182-L184 PolarHBondContact O-N 2.97Å; F182-K185 CarbonylContact O-C 3.43Å; F182-K185 VanDerWaalsContact O-C 3.23Å; F182-K185 PolarHBondContact O-N 2.92Å; F182-K185 VanDerWaalsContact O-N 3.17Å; F182-R186 VanDerWaalsContact CE1-CD 3.4Å; F182-R186 HydrophobicContact CE2-CB 3.96Å; F182-R186 HydrophobicContact CE2-CG 4.4Å; F182-R186 HydrophobicContact CZ-CB 4.32Å; F182-R186 HydrophobicContact CZ-CG 4.32Å; F182-R186 WeakPolarHBondContact O-CD 3.39Å; F182-R186 PolarHBondContact O-N 3.48Å; F182-R186 PolarHBondContact O-NE 3.11Å; F182-W210 HydrophobicContact CB-CH2 4.28Å; F182-W210 HydrophobicContact CB-CZ3 3.98Å; F182-W210 HydrophobicContact CG-CZ3 4.46Å; F182-F211 HydrophobicContact CB-CE1 3.88Å; F182-F211 HydrophobicContact CB-CZ 4.08Å; F182-F211 AromaticContact CD2-CD1 3.88Å; F182-F211 HydrophobicContact CD2-CD1 3.88Å; F182-F211 AromaticContact CD2-CE1 3.85Å; F182-F211 HydrophobicContact CD2-CE1 3.85Å; F182-F211 HydrophobicContact CG-CE1 4.38Å; F182-R214 HydrophobicContact CB-CG 4.3Å; F182-R214 HydrophobicContact CD1-CG 3.49Å; F182-R214 VanDerWaalsContact CD1-CG 3.49Å; F182-R214 VanDerWaalsContact CD1-NE 3.35Å; F182-R214 HydrophobicContact CD2-CB 4.21Å; F182-R214 HydrophobicContact CD2-CG 3.53Å; F182-R214 HydrophobicContact CE1-CG 3.56Å; F182-R214 HydrophobicContact CE2-CB 4.21Å; F182-R214 HydrophobicContact CE2-CG 3.61Å; F182-R214 HydrophobicContact CG-CG 3.47Å; F182-R214 VanDerWaalsContact CG-CG 3.47Å; F182-R214 HydrophobicContact CZ-CG 3.61Å; F182-R215 HydrophobicContact CE2-CG 3.75Å; F182-R215 HydrophobicContact CZ-CG 4.37Å; F182-W218 HydrophobicContact CZ-CB 4.37Å |
| 183 | D | 98.4 | Very high | 98.6 | Very high | 81 Ų | 81 | 67.5 Ų | 67.5 | 43% | 0.433 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -65.8 | -34.5 | -177.8 | -66.4 | -24.6 | 0 | 0 | 0 | 110.4 | E179 S180 R186 R214 | E179-D183 VanDerWaalsContact O-CG 3.28Å; E179-D183 PolarHBondContact O-N 3.15Å; S180-D183 PolarHBondContact O-N 2.62Å; D183-R186 PolarHBondContact O-NE 3.47Å; D183-R186 PolarHBondContact O-NH2 3.37Å; D183-R214 IonicContact OD1-NH2 2.69Å; D183-R214 PolarHBondContact OD1-NH2 3.45Å; D183-R214 IonicContact OD2-NH2 3.46Å |
| 184 | L | 98.2 | Very high | 98.6 | Very high | 150 Ų | 150 | 66.2 Ų | 66.2 | 79% | 0.785 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -66.6 | -50.1 | 165.8 | -65.3 | 173 | 0 | 0 | 0 | 113.4 | S180 F182 | S180-L184 WeakPolarHBondContact O-CG 3.23Å; S180-L184 PolarHBondContact O-N 3.01Å; F182-L184 VanDerWaalsContact C-N 3.26Å; F182-L184 PolarHBondContact O-N 2.97Å |
| 185 | K | 98.2 | Very high | 98.6 | Very high | 91 Ų | 91 | 68 Ų | 68 | 40% | 0.396 | 36% | 0.361 | S | S | . | . | trans | -141.6 | 109.8 | -173.3 | -158.4 | -175.4 | -174.3 | -173.4 | 0 | 112.5 | T181 F182 Y187 L188 E192 F211 | T181-K185 PolarHBondContact O-N 3.39Å; F182-K185 CarbonylContact O-C 3.43Å; F182-K185 VanDerWaalsContact O-C 3.23Å; F182-K185 PolarHBondContact O-N 2.92Å; F182-K185 VanDerWaalsContact O-N 3.17Å; K185-Y187 VanDerWaalsContact C-N 3.26Å; K185-Y187 WeakPolarHBondContact CD-O 3.5Å; K185-Y187 VanDerWaalsContact CE-O 3.25Å; K185-Y187 WeakPolarHBondContact CE-O 3.4Å; K185-Y187 WeakPolarHBondContact CG-O 3.37Å; K185-Y187 PolarHBondContact O-N 2.86Å; K185-L188 HydrophobicContact CB-CD2 4.16Å; K185-L188 HydrophobicContact CD-CD2 4.05Å; K185-L188 HydrophobicContact CG-CD2 4.39Å; K185-E192 IonicContact NZ-OE1 2.63Å; K185-E192 PolarHBondContact NZ-OE1 3.42Å; K185-E192 IonicContact NZ-OE2 2.73Å; K185-E192 PolarHBondContact NZ-OE2 2.94Å; K185-F211 WeakPolarHBondContact O-CE1 3.46Å | ||
| 186 | R | 98.2 | Very high | 98.6 | Very high | 85 Ų | 85 | 67.1 Ų | 67.1 | 32% | 0.321 | 36% | 0.355 | S | S | . | . | S | Bend | trans | -69.9 | -17.8 | -174.3 | -49.1 | -63.9 | 149.7 | 106.8 | -1.7 | 114.4 | F182 D183 R215 | F182-R186 VanDerWaalsContact CE1-CD 3.4Å; F182-R186 HydrophobicContact CE2-CB 3.96Å; F182-R186 HydrophobicContact CE2-CG 4.4Å; F182-R186 HydrophobicContact CZ-CB 4.32Å; F182-R186 HydrophobicContact CZ-CG 4.32Å; F182-R186 WeakPolarHBondContact O-CD 3.39Å; F182-R186 PolarHBondContact O-N 3.48Å; F182-R186 PolarHBondContact O-NE 3.11Å; D183-R186 PolarHBondContact O-NE 3.47Å; D183-R186 PolarHBondContact O-NH2 3.37Å; R186-R215 VanDerWaalsContact O-CD 3.29Å; R186-R215 WeakPolarHBondContact O-CD 3.45Å |
| 187 | Y | 98.4 | Very high | 98.6 | Very high | 150 Ų | 150 | 60.8 Ų | 60.8 | 59% | 0.588 | 33% | 0.328 | S | S | * | . | S | Bend | trans | -136.8 | 124.5 | -179.2 | -66.7 | -100.1 | 0 | 0 | 0 | 109.9 | K185 R215 | K185-Y187 VanDerWaalsContact C-N 3.26Å; K185-Y187 WeakPolarHBondContact CD-O 3.5Å; K185-Y187 VanDerWaalsContact CE-O 3.25Å; K185-Y187 WeakPolarHBondContact CE-O 3.4Å; K185-Y187 WeakPolarHBondContact CG-O 3.37Å; K185-Y187 PolarHBondContact O-N 2.86Å; Y187-R215 VanDerWaalsContact CE1-CD 3.45Å; Y187-R215 VanDerWaalsContact CE1-NH1 3.29Å |
| 188 | L | 98.5 | Very high | 98.6 | Very high | 30 Ų | 30 | 60.5 Ų | 60.5 | 16% | 0.157 | 34% | 0.338 | C | S | . | . | trans | -104.6 | 143.2 | 179.4 | -60 | -172 | 0 | 0 | 0 | 112 | T181 K185 E192 R193 L196 V207 F211 | T181-L188 HydrophobicContact CG2-CD1 4.35Å; T181-L188 HydrophobicContact CG2-CD2 4.16Å; K185-L188 HydrophobicContact CB-CD2 4.16Å; K185-L188 HydrophobicContact CD-CD2 4.05Å; K185-L188 HydrophobicContact CG-CD2 4.39Å; L188-E192 WeakPolarHBondContact CA-OE2 3.48Å; L188-E192 HydrophobicContact CB-CB 4.01Å; L188-E192 HydrophobicContact CD2-CB 4.28Å; L188-R193 HydrophobicContact CB-CG 3.68Å; L188-R193 HydrophobicContact CD1-CG 4.14Å; L188-L196 HydrophobicContact CD1-CD2 3.82Å; L188-V207 HydrophobicContact CD1-CG1 4.49Å; L188-F211 HydrophobicContact CD1-CD1 4.45Å; L188-F211 HydrophobicContact CD1-CD2 4.29Å; L188-F211 HydrophobicContact CD1-CE1 3.9Å; L188-F211 HydrophobicContact CD1-CE2 3.73Å; L188-F211 HydrophobicContact CD1-CZ 3.52Å; L188-F211 HydrophobicContact CD2-CE1 4.24Å; L188-F211 HydrophobicContact CD2-CZ 4.42Å; L188-F211 HydrophobicContact CG-CD1 4.14Å; L188-F211 HydrophobicContact CG-CE1 3.7Å; L188-F211 HydrophobicContact CG-CE2 4.41Å; L188-F211 HydrophobicContact CG-CZ 3.87Å | ||
| 189 | S | 98.6 | Very high | 98.6 | Very high | 48 Ų | 48 | 64.2 Ų | 64.2 | 34% | 0.336 | 36% | 0.364 | S | S | . | . | trans | -66.7 | -179 | 169.2 | 82.3 | 0 | 0 | 0 | 0 | 111.7 | S191 E192 R193 | S189-S191 PolarHBondContact OG-N 2.82Å; S189-S191 PolarHBondContact OG-OG 2.64Å; S189-E192 PolarHBondContact N-OE2 3.27Å; S189-E192 WeakPolarHBondContact OG-CB 3.27Å; S189-E192 WeakPolarHBondContact OG-CG 3.4Å; S189-E192 PolarHBondContact OG-N 3.45Å; S189-E192 PolarHBondContact OG-OE2 3.41Å; S189-R193 VanDerWaalsContact O-CG 3.3Å; S189-R193 WeakPolarHBondContact O-CG 3.49Å; S189-R193 PolarHBondContact O-N 2.86Å; S189-R193 PolarHBondContact O-NE 3.12Å | ||
| 190 | S | 98.6 | Very high | 98.5 | Very high | 68 Ų | 68 | 61.8 Ų | 61.8 | 48% | 0.476 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -71.6 | -42.8 | 172.4 | -137.7 | 0 | 0 | 0 | 0 | 112.8 | E192 R193 A194 E204 | S190-E192 PolarHBondContact O-N 3.42Å; S190-R193 PolarHBondContact O-N 3.1Å; S190-R193 PolarHBondContact OG-NH2 3.08Å; S190-A194 WeakPolarHBondContact O-CB 3.5Å; S190-A194 PolarHBondContact O-N 3.28Å; S190-E204 PolarHBondContact OG-OE2 3.42Å |
| 191 | S | 98.6 | Very high | 98.5 | Very high | 89 Ų | 89 | 67.4 Ų | 67.4 | 62% | 0.622 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -64.4 | -40 | 177.6 | 48 | 0 | 0 | 0 | 0 | 112.5 | S189 R193 A194 S195 | S189-S191 PolarHBondContact OG-N 2.82Å; S189-S191 PolarHBondContact OG-OG 2.64Å; S191-R193 PolarHBondContact O-N 3.03Å; S191-A194 PolarHBondContact O-N 3.23Å; S191-S195 WeakPolarHBondContact O-CB 3.5Å; S191-S195 PolarHBondContact O-N 3.5Å |
| 192 | E | 98.6 | Very high | 98.5 | Very high | 68 Ų | 68 | 66.5 Ų | 66.5 | 32% | 0.318 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.8 | -40.3 | 175.1 | -70.2 | 171.9 | 150.3 | 0 | 0 | 111.8 | K185 L188 S189 S190 L196 | K185-E192 IonicContact NZ-OE1 2.63Å; K185-E192 PolarHBondContact NZ-OE1 3.42Å; K185-E192 IonicContact NZ-OE2 2.73Å; K185-E192 PolarHBondContact NZ-OE2 2.94Å; L188-E192 WeakPolarHBondContact CA-OE2 3.48Å; L188-E192 HydrophobicContact CB-CB 4.01Å; L188-E192 HydrophobicContact CD2-CB 4.28Å; S189-E192 PolarHBondContact N-OE2 3.27Å; S189-E192 WeakPolarHBondContact OG-CB 3.27Å; S189-E192 WeakPolarHBondContact OG-CG 3.4Å; S189-E192 PolarHBondContact OG-N 3.45Å; S189-E192 PolarHBondContact OG-OE2 3.41Å; S190-E192 PolarHBondContact O-N 3.42Å; E192-L196 WeakPolarHBondContact O-CB 3.45Å; E192-L196 PolarHBondContact O-N 2.92Å; E192-L196 VanDerWaalsContact O-N 3.08Å |
| 193 | R | 98.8 | Very high | 98.5 | Very high | 44 Ų | 44 | 70 Ų | 70 | 17% | 0.166 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -67.7 | -39.4 | 174.6 | -74.8 | -175.1 | -64 | 93.4 | 3.8 | 112.5 | L188 S189 S190 S191 A197 E204 V207 | L188-R193 HydrophobicContact CB-CG 3.68Å; L188-R193 HydrophobicContact CD1-CG 4.14Å; S189-R193 VanDerWaalsContact O-CG 3.3Å; S189-R193 WeakPolarHBondContact O-CG 3.49Å; S189-R193 PolarHBondContact O-N 2.86Å; S189-R193 PolarHBondContact O-NE 3.12Å; S190-R193 PolarHBondContact O-N 3.1Å; S190-R193 PolarHBondContact OG-NH2 3.08Å; S191-R193 PolarHBondContact O-N 3.03Å; R193-A197 WeakPolarHBondContact O-CB 3.42Å; R193-A197 PolarHBondContact O-N 3.32Å; R193-E204 HydrophobicContact CB-CG 4.34Å; R193-E204 IonicContact CZ-OE2 2.64Å; R193-E204 IonicContact NH1-OE2 3.47Å; R193-E204 PolarHBondContact NH1-OE2 3.47Å; R193-E204 IonicContact NH2-OE2 3.95Å; R193-V207 HydrophobicContact CG-CG1 4.15Å |
| 194 | A | 98.8 | Very high | 98.5 | Very high | 39 Ų | 39 | 69.6 Ų | 69.6 | 32% | 0.322 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64.1 | -45.9 | 178 | 0 | 0 | 0 | 0 | 0 | 111.6 | S190 S191 A197 A198 E204 | S190-A194 WeakPolarHBondContact O-CB 3.5Å; S190-A194 PolarHBondContact O-N 3.28Å; S191-A194 PolarHBondContact O-N 3.23Å; A194-A197 PolarHBondContact O-N 3.23Å; A194-A198 PolarHBondContact O-N 3.09Å; A194-E204 HydrophobicContact CB-CG 4.28Å |
| 195 | S | 98.7 | Very high | 98.5 | Very high | 78 Ų | 78 | 66.7 Ų | 66.7 | 55% | 0.545 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -59.5 | -51.1 | 175.3 | 179.8 | 0 | 0 | 0 | 0 | 112 | S191 A197 A198 S199 | S191-S195 WeakPolarHBondContact O-CB 3.5Å; S191-S195 PolarHBondContact O-N 3.5Å; S195-A197 VanDerWaalsContact C-N 3.32Å; S195-A197 PolarHBondContact O-N 3.2Å; S195-A198 PolarHBondContact O-N 3.14Å; S195-S199 PolarHBondContact O-N 3.22Å; S195-S199 VanDerWaalsContact O-N 3.08Å; S195-S199 PolarHBondContact O-OG 2.99Å |
| 196 | L | 98.6 | Very high | 98.5 | Very high | 18 Ų | 18 | 65 Ų | 65 | 9% | 0.094 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -66.3 | -32.9 | 179.2 | -171.9 | 62.8 | 0 | 0 | 0 | 112.9 | L178 T181 L188 E192 L200 V207 F211 | L178-L196 HydrophobicContact CD2-CD2 4Å; T181-L196 HydrophobicContact CG2-CD2 4.02Å; L188-L196 HydrophobicContact CD1-CD2 3.82Å; E192-L196 WeakPolarHBondContact O-CB 3.45Å; E192-L196 PolarHBondContact O-N 2.92Å; E192-L196 VanDerWaalsContact O-N 3.08Å; L196-L200 HydrophobicContact CD1-CD1 3.83Å; L196-L200 HydrophobicContact CD1-CG 4.14Å; L196-L200 HydrophobicContact CG-CD1 3.96Å; L196-L200 HydrophobicContact CG-CG 4.5Å; L196-L200 WeakPolarHBondContact O-CB 3.24Å; L196-L200 VanDerWaalsContact O-CG 3.26Å; L196-L200 WeakPolarHBondContact O-CG 3.34Å; L196-L200 PolarHBondContact O-N 2.81Å; L196-V207 HydrophobicContact CD2-CG1 4.12Å; L196-F211 HydrophobicContact CD2-CE2 3.94Å; L196-F211 HydrophobicContact CD2-CZ 4.31Å |
| 197 | A | 98.8 | Very high | 98.5 | Very high | 6 Ų | 6 | 61 Ų | 61 | 5% | 0.05 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -63.8 | -47.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | R193 A194 S195 L200 H201 L202 E204 V207 | R193-A197 WeakPolarHBondContact O-CB 3.42Å; R193-A197 PolarHBondContact O-N 3.32Å; A194-A197 PolarHBondContact O-N 3.23Å; S195-A197 VanDerWaalsContact C-N 3.32Å; S195-A197 PolarHBondContact O-N 3.2Å; A197-L200 PolarHBondContact O-N 3.05Å; A197-H201 PolarHBondContact O-N 2.91Å; A197-H201 VanDerWaalsContact O-N 3.15Å; A197-L202 CarbonylContact C-O 3.59Å; A197-L202 WeakPolarHBondContact CB-O 3.38Å; A197-L202 PolarHBondContact O-N 3.32Å; A197-L202 VanDerWaalsContact O-O 3.09Å; A197-E204 HydrophobicContact CB-CG 4.25Å; A197-V207 HydrophobicContact CB-CG2 4Å |
| 198 | A | 98.6 | Very high | 98.5 | Very high | 66 Ų | 66 | 60 Ų | 60 | 55% | 0.545 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -59.9 | -50.6 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | A194 S195 L200 H201 | A194-A198 PolarHBondContact O-N 3.09Å; S195-A198 PolarHBondContact O-N 3.14Å; A198-L200 PolarHBondContact O-N 3.25Å; A198-H201 PolarHBondContact O-N 3.37Å |
| 199 | S | 98.4 | Very high | 98.5 | Very high | 79 Ų | 79 | 63.1 Ų | 63.1 | 55% | 0.552 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -62.4 | -24.3 | -179.1 | -59.5 | 0 | 0 | 0 | 0 | 114.5 | S195 | S195-S199 PolarHBondContact O-N 3.22Å; S195-S199 VanDerWaalsContact O-N 3.08Å; S195-S199 PolarHBondContact O-OG 2.99Å |
| 200 | L | 98.3 | Very high | 98.5 | Very high | 6 Ų | 6 | 62.5 Ų | 62.5 | 3% | 0.031 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -103.5 | -0.3 | -179.2 | -62 | -176.6 | 0 | 0 | 0 | 113.9 | Q174 Q177 L178 L196 A197 A198 L202 | Q174-L200 HydrophobicContact CG-CB 4.48Å; Q174-L200 PolarHBondContact NE2-O 3.49Å; Q177-L200 HydrophobicContact CB-CD1 4.48Å; Q177-L200 HydrophobicContact CB-CD2 3.76Å; Q177-L200 VanDerWaalsContact CD-CD2 3.44Å; Q177-L200 HydrophobicContact CG-CD2 4.2Å; L178-L200 HydrophobicContact CD1-CD1 4.37Å; L178-L200 HydrophobicContact CD2-CD1 3.79Å; L178-L200 HydrophobicContact CG-CD1 3.68Å; L196-L200 HydrophobicContact CD1-CD1 3.83Å; L196-L200 HydrophobicContact CD1-CG 4.14Å; L196-L200 HydrophobicContact CG-CD1 3.96Å; L196-L200 HydrophobicContact CG-CG 4.5Å; L196-L200 WeakPolarHBondContact O-CB 3.24Å; L196-L200 VanDerWaalsContact O-CG 3.26Å; L196-L200 WeakPolarHBondContact O-CG 3.34Å; L196-L200 PolarHBondContact O-N 2.81Å; A197-L200 PolarHBondContact O-N 3.05Å; A198-L200 PolarHBondContact O-N 3.25Å; L200-L202 VanDerWaalsContact C-N 3.26Å; L200-L202 HydrophobicContact CB-CB 4.47Å; L200-L202 HydrophobicContact CB-CD1 4.04Å; L200-L202 HydrophobicContact CB-CG 4Å; L200-L202 HydrophobicContact CD1-CD1 4.27Å; L200-L202 PolarHBondContact O-N 3.14Å |
| 201 | H | 98.4 | Very high | 98.5 | Very high | 177 Ų | 177 | 59.5 Ų | 59.5 | 82% | 0.819 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.1 | 45 | -168.7 | -51.4 | -51.5 | 0 | 0 | 0 | 112.6 | A197 A198 | A197-H201 PolarHBondContact O-N 2.91Å; A197-H201 VanDerWaalsContact O-N 3.15Å; A198-H201 PolarHBondContact O-N 3.37Å |
| 202 | L | 98.1 | Very high | 98.6 | Very high | 22 Ų | 22 | 59.1 Ų | 59.1 | 12% | 0.115 | 32% | 0.321 | C | S | . | . | trans | -116.5 | 164.6 | 175.1 | -65.1 | 179.6 | 0 | 0 | 0 | 110.1 | F170 L178 A197 L200 Q206 V207 | F170-L202 HydrophobicContact CD1-CD1 4.43Å; F170-L202 HydrophobicContact CD1-CD2 3.76Å; F170-L202 HydrophobicContact CE1-CD1 4.37Å; F170-L202 HydrophobicContact CE1-CD2 3.64Å; F170-L202 HydrophobicContact CZ-CD2 4.5Å; L178-L202 HydrophobicContact CD1-CD1 4.17Å; A197-L202 CarbonylContact C-O 3.59Å; A197-L202 WeakPolarHBondContact CB-O 3.38Å; A197-L202 PolarHBondContact O-N 3.32Å; A197-L202 VanDerWaalsContact O-O 3.09Å; L200-L202 VanDerWaalsContact C-N 3.26Å; L200-L202 HydrophobicContact CB-CB 4.47Å; L200-L202 HydrophobicContact CB-CD1 4.04Å; L200-L202 HydrophobicContact CB-CG 4Å; L200-L202 HydrophobicContact CD1-CD1 4.27Å; L200-L202 PolarHBondContact O-N 3.14Å; L202-Q206 HydrophobicContact CB-CB 4.46Å; L202-V207 HydrophobicContact CB-CG2 4.27Å | ||
| 203 | T | 98.5 | Very high | 98.5 | Very high | 74 Ų | 74 | 60.2 Ų | 60.2 | 45% | 0.454 | 33% | 0.329 | S | S | . | . | trans | -83.8 | 150.3 | 168.8 | 59.9 | 0 | 0 | 0 | 0 | 111.2 | T205 Q206 V207 | T203-T205 PolarHBondContact O-N 2.89Å; T203-T205 VanDerWaalsContact O-N 3.11Å; T203-Q206 WeakPolarHBondContact O-CB 3.39Å; T203-Q206 PolarHBondContact O-N 3.37Å; T203-Q206 WeakPolarHBondContact OG1-CB 3.44Å; T203-Q206 VanDerWaalsContact OG1-CD 3.31Å; T203-Q206 VanDerWaalsContact OG1-CG 3.3Å; T203-Q206 WeakPolarHBondContact OG1-CG 3.16Å; T203-Q206 PolarHBondContact OG1-N 3.01Å; T203-Q206 PolarHBondContact OG1-OE1 3.4Å; T203-V207 PolarHBondContact O-N 3.46Å | ||
| 204 | E | 98.6 | Very high | 98.5 | Very high | 73 Ų | 73 | 60 Ų | 60 | 34% | 0.341 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -50.7 | -36.1 | 170.7 | -89 | -166 | -114.4 | 0 | 0 | 112.7 | S190 R193 A194 A197 V207 K208 | S190-E204 PolarHBondContact OG-OE2 3.42Å; R193-E204 HydrophobicContact CB-CG 4.34Å; R193-E204 IonicContact CZ-OE2 2.64Å; R193-E204 IonicContact NH1-OE2 3.47Å; R193-E204 PolarHBondContact NH1-OE2 3.47Å; R193-E204 IonicContact NH2-OE2 3.95Å; A194-E204 HydrophobicContact CB-CG 4.28Å; A197-E204 HydrophobicContact CB-CG 4.25Å; E204-V207 PolarHBondContact O-N 3.44Å; E204-K208 VanDerWaalsContact O-CB 3.24Å; E204-K208 WeakPolarHBondContact O-CB 3.34Å; E204-K208 PolarHBondContact O-N 3.23Å |
| 205 | T | 98.4 | Very high | 98.5 | Very high | 89 Ų | 89 | 60.4 Ų | 60.4 | 55% | 0.546 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -66.5 | -40.5 | 177.5 | -57.6 | 0 | 0 | 0 | 0 | 112 | T203 K208 I209 | T203-T205 PolarHBondContact O-N 2.89Å; T203-T205 VanDerWaalsContact O-N 3.11Å; T205-K208 PolarHBondContact O-N 2.83Å; T205-I209 HydrophobicContact CG2-CD1 3.9Å; T205-I209 WeakPolarHBondContact O-CB 3.49Å; T205-I209 VanDerWaalsContact O-CG1 3.23Å; T205-I209 WeakPolarHBondContact O-CG1 3.3Å; T205-I209 PolarHBondContact O-N 3.31Å |
| 206 | Q | 98.3 | Very high | 98.5 | Very high | 56 Ų | 56 | 59.5 Ų | 59.5 | 26% | 0.262 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -64.6 | -43.9 | 173.3 | -78.4 | 161.1 | -46.7 | 0 | 0 | 111.5 | F170 L202 T203 I209 W210 | F170-Q206 HydrophobicContact CE1-CB 4.41Å; F170-Q206 HydrophobicContact CE1-CG 4.35Å; F170-Q206 HydrophobicContact CZ-CB 3.96Å; F170-Q206 HydrophobicContact CZ-CG 4.14Å; L202-Q206 HydrophobicContact CB-CB 4.46Å; T203-Q206 WeakPolarHBondContact O-CB 3.39Å; T203-Q206 PolarHBondContact O-N 3.37Å; T203-Q206 WeakPolarHBondContact OG1-CB 3.44Å; T203-Q206 VanDerWaalsContact OG1-CD 3.31Å; T203-Q206 VanDerWaalsContact OG1-CG 3.3Å; T203-Q206 WeakPolarHBondContact OG1-CG 3.16Å; T203-Q206 PolarHBondContact OG1-N 3.01Å; T203-Q206 PolarHBondContact OG1-OE1 3.4Å; Q206-I209 PolarHBondContact O-N 2.91Å; Q206-W210 WeakPolarHBondContact O-CB 3.43Å; Q206-W210 PolarHBondContact O-N 3.17Å |
| 207 | V | 98.7 | Very high | 98.5 | Very high | 0 Ų | 0 | 64.1 Ų | 64.1 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -61.7 | -47.3 | 175.3 | 179.8 | 0 | 0 | 0 | 0 | 110.7 | L178 L188 R193 L196 A197 L202 T203 E204 I209 W210 F211 | L178-V207 HydrophobicContact CD2-CG1 4.35Å; L188-V207 HydrophobicContact CD1-CG1 4.49Å; R193-V207 HydrophobicContact CG-CG1 4.15Å; L196-V207 HydrophobicContact CD2-CG1 4.12Å; A197-V207 HydrophobicContact CB-CG2 4Å; L202-V207 HydrophobicContact CB-CG2 4.27Å; T203-V207 PolarHBondContact O-N 3.46Å; E204-V207 PolarHBondContact O-N 3.44Å; V207-I209 PolarHBondContact O-N 2.88Å; V207-W210 PolarHBondContact O-N 3.23Å; V207-F211 HydrophobicContact CG1-CD2 3.85Å; V207-F211 HydrophobicContact CG1-CE2 4.04Å; V207-F211 WeakPolarHBondContact O-CD2 3.47Å; V207-F211 PolarHBondContact O-N 2.78Å |
| 208 | K | 98.5 | Very high | 98.4 | Very high | 131 Ų | 131 | 68.5 Ų | 68.5 | 57% | 0.57 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -55.9 | -47.3 | 175.6 | 179.1 | 179.2 | 178.1 | 177.8 | 0 | 112.1 | E204 T205 Q212 | E204-K208 VanDerWaalsContact O-CB 3.24Å; E204-K208 WeakPolarHBondContact O-CB 3.34Å; E204-K208 PolarHBondContact O-N 3.23Å; T205-K208 PolarHBondContact O-N 2.83Å; K208-Q212 WeakPolarHBondContact O-CB 3.48Å; K208-Q212 PolarHBondContact O-N 3.34Å |
| 209 | I | 98.5 | Very high | 98.3 | Very high | 94 Ų | 94 | 72 Ų | 72 | 48% | 0.482 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -65.8 | -43 | 177.9 | -71.4 | 167.6 | 0 | 0 | 0 | 111 | T205 Q206 V207 Q212 N213 | T205-I209 HydrophobicContact CG2-CD1 3.9Å; T205-I209 WeakPolarHBondContact O-CB 3.49Å; T205-I209 VanDerWaalsContact O-CG1 3.23Å; T205-I209 WeakPolarHBondContact O-CG1 3.3Å; T205-I209 PolarHBondContact O-N 3.31Å; Q206-I209 PolarHBondContact O-N 2.91Å; V207-I209 PolarHBondContact O-N 2.88Å; I209-Q212 PolarHBondContact O-N 3.49Å; I209-N213 WeakPolarHBondContact O-CB 3.48Å; I209-N213 VanDerWaalsContact O-CG 3.26Å; I209-N213 PolarHBondContact O-N 3.46Å; I209-N213 PolarHBondContact O-ND2 3.07Å |
| 210 | W | 98.6 | Very high | 98.1 | Very high | 35 Ų | 35 | 77.2 Ų | 77.2 | 13% | 0.133 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -62.6 | -47.6 | 178.1 | -171 | 99.2 | 0 | 0 | 0 | 111.4 | F170 L178 E179 F182 Q206 V207 Q212 N213 R214 | F170-W210 AromaticContact CD2-CD1 3.85Å; F170-W210 HydrophobicContact CE2-CB 4.36Å; F170-W210 AromaticContact CE2-CD1 3.79Å; F170-W210 HydrophobicContact CE2-CG 4.42Å; L178-W210 VanDerWaalsContact C-CH2 3.47Å; L178-W210 HydrophobicContact CB-CD2 3.92Å; L178-W210 HydrophobicContact CB-CE3 3.88Å; L178-W210 HydrophobicContact CB-CH2 3.76Å; L178-W210 HydrophobicContact CB-CZ2 3.76Å; L178-W210 HydrophobicContact CB-CZ3 3.81Å; L178-W210 HydrophobicContact CD1-CD2 3.97Å; L178-W210 HydrophobicContact CD1-CG 3.93Å; L178-W210 HydrophobicContact CD2-CD2 4.39Å; L178-W210 HydrophobicContact CD2-CE3 4.23Å; L178-W210 HydrophobicContact CG-CD2 4.32Å; L178-W210 HydrophobicContact CG-CE3 4.46Å; L178-W210 WeakPolarHBondContact O-CH2 3.46Å; L178-W210 WeakPolarHBondContact O-CZ3 3.36Å; E179-W210 HydrophobicContact CB-CH2 4.45Å; E179-W210 HydrophobicContact CG-CH2 3.76Å; E179-W210 HydrophobicContact CG-CZ2 3.69Å; F182-W210 HydrophobicContact CB-CH2 4.28Å; F182-W210 HydrophobicContact CB-CZ3 3.98Å; F182-W210 HydrophobicContact CG-CZ3 4.46Å; Q206-W210 WeakPolarHBondContact O-CB 3.43Å; Q206-W210 PolarHBondContact O-N 3.17Å; V207-W210 PolarHBondContact O-N 3.23Å; W210-Q212 VanDerWaalsContact C-N 3.31Å; W210-Q212 PolarHBondContact O-N 2.73Å; W210-N213 PolarHBondContact O-N 2.63Å; W210-N213 VanDerWaalsContact O-N 3.14Å; W210-R214 HydrophobicContact CE3-CB 4.01Å; W210-R214 HydrophobicContact CH2-CB 3.94Å; W210-R214 HydrophobicContact CH2-CG 3.69Å; W210-R214 HydrophobicContact CZ2-CB 4.5Å; W210-R214 HydrophobicContact CZ2-CG 4.48Å; W210-R214 HydrophobicContact CZ3-CB 3.68Å; W210-R214 HydrophobicContact CZ3-CG 3.74Å; W210-R214 WeakPolarHBondContact O-CB 3.28Å; W210-R214 PolarHBondContact O-N 3.02Å |
| 211 | F | 98.8 | Very high | 98 | Very high | 5 Ų | 5 | 80.9 Ų | 80.9 | 2% | 0.022 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -62.9 | -35.5 | 176.5 | -91.5 | -101 | 0 | 0 | 0 | 112.6 | L178 T181 F182 K185 L188 L196 V207 R215 | L178-F211 HydrophobicContact CD2-CD2 4.5Å; L178-F211 HydrophobicContact CD2-CE2 3.97Å; T181-F211 HydrophobicContact CG2-CZ 4.29Å; F182-F211 HydrophobicContact CB-CE1 3.88Å; F182-F211 HydrophobicContact CB-CZ 4.08Å; F182-F211 AromaticContact CD2-CD1 3.88Å; F182-F211 HydrophobicContact CD2-CD1 3.88Å; F182-F211 AromaticContact CD2-CE1 3.85Å; F182-F211 HydrophobicContact CD2-CE1 3.85Å; F182-F211 HydrophobicContact CG-CE1 4.38Å; K185-F211 WeakPolarHBondContact O-CE1 3.46Å; L188-F211 HydrophobicContact CD1-CD1 4.45Å; L188-F211 HydrophobicContact CD1-CD2 4.29Å; L188-F211 HydrophobicContact CD1-CE1 3.9Å; L188-F211 HydrophobicContact CD1-CE2 3.73Å; L188-F211 HydrophobicContact CD1-CZ 3.52Å; L188-F211 HydrophobicContact CD2-CE1 4.24Å; L188-F211 HydrophobicContact CD2-CZ 4.42Å; L188-F211 HydrophobicContact CG-CD1 4.14Å; L188-F211 HydrophobicContact CG-CE1 3.7Å; L188-F211 HydrophobicContact CG-CE2 4.41Å; L188-F211 HydrophobicContact CG-CZ 3.87Å; L196-F211 HydrophobicContact CD2-CE2 3.94Å; L196-F211 HydrophobicContact CD2-CZ 4.31Å; V207-F211 HydrophobicContact CG1-CD2 3.85Å; V207-F211 HydrophobicContact CG1-CE2 4.04Å; V207-F211 WeakPolarHBondContact O-CD2 3.47Å; V207-F211 PolarHBondContact O-N 2.78Å; F211-R215 WeakPolarHBondContact O-CB 3.45Å; F211-R215 WeakPolarHBondContact O-CG 3.49Å; F211-R215 PolarHBondContact O-N 3.08Å; F211-R215 PolarHBondContact O-NE 2.95Å |
| 212 | Q | 98.8 | Very high | 97.6 | Very high | 81 Ų | 81 | 76.8 Ų | 76.8 | 38% | 0.379 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -68 | -38.4 | 174 | -171.4 | 57.6 | 67.6 | 0 | 0 | 112.2 | K208 I209 W210 R215 N216 | K208-Q212 WeakPolarHBondContact O-CB 3.48Å; K208-Q212 PolarHBondContact O-N 3.34Å; I209-Q212 PolarHBondContact O-N 3.49Å; W210-Q212 VanDerWaalsContact C-N 3.31Å; W210-Q212 PolarHBondContact O-N 2.73Å; Q212-R215 VanDerWaalsContact OE1-CZ 3.32Å; Q212-R215 VanDerWaalsContact OE1-NH1 3.11Å; Q212-N216 PolarHBondContact NE2-ND2 2.86Å; Q212-N216 VanDerWaalsContact NE2-ND2 3.18Å; Q212-N216 WeakPolarHBondContact O-CB 3.29Å; Q212-N216 PolarHBondContact O-N 2.92Å; Q212-N216 VanDerWaalsContact O-N 3.15Å; Q212-N216 PolarHBondContact O-ND2 3.42Å |
| 213 | N | 98.4 | Very high | 97.3 | Very high | 91 Ų | 91 | 78.3 Ų | 78.3 | 49% | 0.487 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -69.1 | -41.2 | 174.7 | -71.3 | -28.5 | 0 | 0 | 0 | 111.8 | I209 W210 N216 K217 | I209-N213 WeakPolarHBondContact O-CB 3.48Å; I209-N213 VanDerWaalsContact O-CG 3.26Å; I209-N213 PolarHBondContact O-N 3.46Å; I209-N213 PolarHBondContact O-ND2 3.07Å; W210-N213 PolarHBondContact O-N 2.63Å; W210-N213 VanDerWaalsContact O-N 3.14Å; N213-N216 PolarHBondContact O-N 3.48Å; N213-K217 PolarHBondContact O-N 3.25Å |
| 214 | R | 98.6 | Very high | 96.9 | Very high | 40 Ų | 40 | 77.4 Ų | 77.4 | 15% | 0.151 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -63.4 | -45.9 | 177.5 | -176.9 | 65.2 | 174.5 | -160.9 | -6.1 | 111.7 | E179 F182 D183 W210 N216 K217 W218 | E179-R214 IonicContact OE1-CZ 2.62Å; E179-R214 IonicContact OE1-NH1 3.68Å; E179-R214 PolarHBondContact OE1-NH1 3.29Å; E179-R214 IonicContact OE1-NH2 3.49Å; F182-R214 HydrophobicContact CB-CG 4.3Å; F182-R214 HydrophobicContact CD1-CG 3.49Å; F182-R214 VanDerWaalsContact CD1-CG 3.49Å; F182-R214 VanDerWaalsContact CD1-NE 3.35Å; F182-R214 HydrophobicContact CD2-CB 4.21Å; F182-R214 HydrophobicContact CD2-CG 3.53Å; F182-R214 HydrophobicContact CE1-CG 3.56Å; F182-R214 HydrophobicContact CE2-CB 4.21Å; F182-R214 HydrophobicContact CE2-CG 3.61Å; F182-R214 HydrophobicContact CG-CG 3.47Å; F182-R214 VanDerWaalsContact CG-CG 3.47Å; F182-R214 HydrophobicContact CZ-CG 3.61Å; D183-R214 IonicContact OD1-NH2 2.69Å; D183-R214 PolarHBondContact OD1-NH2 3.45Å; D183-R214 IonicContact OD2-NH2 3.46Å; W210-R214 HydrophobicContact CE3-CB 4.01Å; W210-R214 HydrophobicContact CH2-CB 3.94Å; W210-R214 HydrophobicContact CH2-CG 3.69Å; W210-R214 HydrophobicContact CZ2-CB 4.5Å; W210-R214 HydrophobicContact CZ2-CG 4.48Å; W210-R214 HydrophobicContact CZ3-CB 3.68Å; W210-R214 HydrophobicContact CZ3-CG 3.74Å; W210-R214 WeakPolarHBondContact O-CB 3.28Å; W210-R214 PolarHBondContact O-N 3.02Å; R214-N216 VanDerWaalsContact C-N 3.33Å; R214-N216 PolarHBondContact O-N 2.98Å; R214-K217 PolarHBondContact O-N 3.2Å; R214-W218 WeakPolarHBondContact O-CB 3.49Å; R214-W218 PolarHBondContact O-N 2.97Å |
| 215 | R | 98.6 | Very high | 96.3 | Very high | 48 Ų | 48 | 78.9 Ų | 78.9 | 18% | 0.181 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -59 | -41.3 | 172.1 | -76.7 | -175.5 | -79.1 | 122.7 | 4.9 | 112.6 | F182 R186 Y187 F211 Q212 W218 K219 | F182-R215 HydrophobicContact CE2-CG 3.75Å; F182-R215 HydrophobicContact CZ-CG 4.37Å; R186-R215 VanDerWaalsContact O-CD 3.29Å; R186-R215 WeakPolarHBondContact O-CD 3.45Å; Y187-R215 VanDerWaalsContact CE1-CD 3.45Å; Y187-R215 VanDerWaalsContact CE1-NH1 3.29Å; F211-R215 WeakPolarHBondContact O-CB 3.45Å; F211-R215 WeakPolarHBondContact O-CG 3.49Å; F211-R215 PolarHBondContact O-N 3.08Å; F211-R215 PolarHBondContact O-NE 2.95Å; Q212-R215 VanDerWaalsContact OE1-CZ 3.32Å; Q212-R215 VanDerWaalsContact OE1-NH1 3.11Å; R215-W218 PolarHBondContact O-N 3.18Å; R215-K219 WeakPolarHBondContact O-CB 3.47Å; R215-K219 PolarHBondContact O-N 2.88Å |
| 216 | N | 98.3 | Very high | 95.5 | Very high | 59 Ų | 59 | 79.6 Ų | 79.6 | 32% | 0.316 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -67.8 | -37.8 | 176.4 | -83.6 | -53.9 | 0 | 0 | 0 | 113.1 | Q212 N213 R214 R220 | Q212-N216 PolarHBondContact NE2-ND2 2.86Å; Q212-N216 VanDerWaalsContact NE2-ND2 3.18Å; Q212-N216 WeakPolarHBondContact O-CB 3.29Å; Q212-N216 PolarHBondContact O-N 2.92Å; Q212-N216 VanDerWaalsContact O-N 3.15Å; Q212-N216 PolarHBondContact O-ND2 3.42Å; N213-N216 PolarHBondContact O-N 3.48Å; R214-N216 VanDerWaalsContact C-N 3.33Å; R214-N216 PolarHBondContact O-N 2.98Å; N216-R220 WeakPolarHBondContact O-CG 3.37Å; N216-R220 PolarHBondContact O-N 3.06Å |
| 217 | K | 97.6 | Very high | 94.6 | Very high | 115 Ų | 115 | 82.9 Ų | 82.9 | 50% | 0.5 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -62.1 | -51.1 | 172.4 | -171 | -163.6 | 171.3 | -172.3 | 0 | 110.4 | N213 R214 K219 R220 Q221 | N213-K217 PolarHBondContact O-N 3.25Å; R214-K217 PolarHBondContact O-N 3.2Å; K217-K219 PolarHBondContact O-N 3.26Å; K217-R220 WeakPolarHBondContact O-CB 3.45Å; K217-R220 PolarHBondContact O-N 3.43Å; K217-Q221 WeakPolarHBondContact O-CG 3.25Å; K217-Q221 PolarHBondContact O-N 3.15Å |
| 218 | W | 96.9 | Very high | 93.5 | Very high | 97 Ų | 97 | 85.9 Ų | 85.9 | 37% | 0.367 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -57.5 | -46.7 | 179.9 | 177 | 59.4 | 0 | 0 | 0 | 112.4 | F182 R214 R215 R220 Q221 L222 | F182-W218 HydrophobicContact CZ-CB 4.37Å; R214-W218 WeakPolarHBondContact O-CB 3.49Å; R214-W218 PolarHBondContact O-N 2.97Å; R215-W218 PolarHBondContact O-N 3.18Å; W218-R220 VanDerWaalsContact C-N 3.28Å; W218-R220 PolarHBondContact O-N 2.95Å; W218-Q221 WeakPolarHBondContact O-CB 3.35Å; W218-Q221 PolarHBondContact O-N 3.02Å; W218-Q221 VanDerWaalsContact O-N 3.1Å; W218-L222 HydrophobicContact CD2-CD1 4.23Å; W218-L222 HydrophobicContact CH2-CD1 4.25Å; W218-L222 HydrophobicContact CZ2-CD1 3.76Å; W218-L222 PolarHBondContact O-N 3.45Å |
| 219 | K | 96.6 | Very high | 92 | Very high | 139 Ų | 139 | 84 Ų | 84 | 60% | 0.604 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -59.5 | -35.9 | 175.1 | -170.1 | 177.1 | 70.6 | 165.2 | 0 | 113 | R215 K217 A223 | R215-K219 WeakPolarHBondContact O-CB 3.47Å; R215-K219 PolarHBondContact O-N 2.88Å; K217-K219 PolarHBondContact O-N 3.26Å; K219-A223 PolarHBondContact O-N 2.77Å |
| 220 | R | 95.8 | Very high | 90.2 | Very high | 190 Ų | 190 | 86.1 Ų | 86.1 | 72% | 0.717 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -72.2 | -31.6 | 176 | -73.3 | 173.8 | 179.2 | 179.6 | -1.1 | 112.9 | N216 K217 W218 A224 | N216-R220 WeakPolarHBondContact O-CG 3.37Å; N216-R220 PolarHBondContact O-N 3.06Å; K217-R220 WeakPolarHBondContact O-CB 3.45Å; K217-R220 PolarHBondContact O-N 3.43Å; W218-R220 VanDerWaalsContact C-N 3.28Å; W218-R220 PolarHBondContact O-N 2.95Å; R220-A224 WeakPolarHBondContact O-CB 3.24Å; R220-A224 PolarHBondContact O-N 2.86Å |
| 221 | Q | 94.5 | Very high | 88.3 | Confident | 83 Ų | 83 | 89.6 Ų | 89.6 | 39% | 0.388 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.8 | -54 | 173.9 | -67.7 | 173 | -99.1 | 0 | 0 | 109.6 | K217 W218 A223 A224 D225 | K217-Q221 WeakPolarHBondContact O-CG 3.25Å; K217-Q221 PolarHBondContact O-N 3.15Å; W218-Q221 WeakPolarHBondContact O-CB 3.35Å; W218-Q221 PolarHBondContact O-N 3.02Å; W218-Q221 VanDerWaalsContact O-N 3.1Å; Q221-A223 PolarHBondContact O-N 3.42Å; Q221-A223 VanDerWaalsContact O-N 3.09Å; Q221-A224 WeakPolarHBondContact O-CA 3.34Å; Q221-A224 PolarHBondContact O-N 2.95Å; Q221-D225 PolarHBondContact O-N 2.83Å; Q221-D225 VanDerWaalsContact O-OD2 3.1Å |
| 222 | L | 91.3 | Very high | 86 | Confident | 91 Ų | 91 | 94.8 Ų | 94.8 | 48% | 0.476 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -54.2 | -35.4 | 176.9 | -63 | 179 | 0 | 0 | 0 | 113.8 | W218 L226 | W218-L222 HydrophobicContact CD2-CD1 4.23Å; W218-L222 HydrophobicContact CH2-CD1 4.25Å; W218-L222 HydrophobicContact CZ2-CD1 3.76Å; W218-L222 PolarHBondContact O-N 3.45Å; L222-L226 PolarHBondContact O-N 2.94Å |
| 223 | A | 90.5 | Very high | 83.9 | Confident | 53 Ų | 53 | 99 Ų | 99 | 44% | 0.438 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -72.1 | -45.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | K219 Q221 D225 L226 E227 | K219-A223 PolarHBondContact O-N 2.77Å; Q221-A223 PolarHBondContact O-N 3.42Å; Q221-A223 VanDerWaalsContact O-N 3.09Å; A223-D225 VanDerWaalsContact C-N 3.31Å; A223-D225 PolarHBondContact O-N 3.43Å; A223-L226 WeakPolarHBondContact O-CB 3.33Å; A223-L226 PolarHBondContact O-N 2.96Å; A223-E227 WeakPolarHBondContact O-CG 3.5Å; A223-E227 PolarHBondContact O-N 3.1Å |
| 224 | A | 90 | Very high | 81.7 | Confident | 56 Ų | 56 | 98.7 Ų | 98.7 | 46% | 0.463 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.1 | -35.4 | 178 | 0 | 0 | 0 | 0 | 0 | 112.7 | R220 Q221 L226 E227 A228 | R220-A224 WeakPolarHBondContact O-CB 3.24Å; R220-A224 PolarHBondContact O-N 2.86Å; Q221-A224 WeakPolarHBondContact O-CA 3.34Å; Q221-A224 PolarHBondContact O-N 2.95Å; A224-L226 VanDerWaalsContact C-N 3.3Å; A224-L226 PolarHBondContact O-N 2.88Å; A224-E227 PolarHBondContact O-N 3.37Å; A224-A228 VanDerWaalsContact O-CB 3.24Å; A224-A228 WeakPolarHBondContact O-CB 3.35Å; A224-A228 PolarHBondContact O-N 3.5Å |
| 225 | D | 86.1 | Confident | 79.6 | Confident | 104 Ų | 104 | 102.2 Ų | 102.2 | 56% | 0.556 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -67.3 | -32.4 | 176.8 | -56.5 | -28.5 | 0 | 0 | 0 | 111.2 | Q221 A223 | Q221-D225 PolarHBondContact O-N 2.83Å; Q221-D225 VanDerWaalsContact O-OD2 3.1Å; A223-D225 VanDerWaalsContact C-N 3.31Å; A223-D225 PolarHBondContact O-N 3.43Å |
| 226 | L | 82.6 | Confident | 77.4 | Confident | 104 Ų | 104 | 108.5 Ų | 108.5 | 55% | 0.545 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -71 | -44.9 | 172.3 | -167.6 | 88.4 | 0 | 0 | 0 | 111.9 | L222 A223 A224 A228 S229 H230 | L222-L226 PolarHBondContact O-N 2.94Å; A223-L226 WeakPolarHBondContact O-CB 3.33Å; A223-L226 PolarHBondContact O-N 2.96Å; A224-L226 VanDerWaalsContact C-N 3.3Å; A224-L226 PolarHBondContact O-N 2.88Å; L226-A228 VanDerWaalsContact C-N 3.32Å; L226-A228 PolarHBondContact O-N 3.3Å; L226-S229 PolarHBondContact O-OG 3.09Å; L226-H230 PolarHBondContact O-ND1 3.22Å |
| 227 | E | 78.4 | Confident | 75.6 | Confident | 124 Ų | 124 | 115.7 Ų | 115.7 | 58% | 0.579 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -64.9 | -38.6 | 176.6 | -61.2 | -62.7 | 117 | 0 | 0 | 111 | A223 A224 S229 H230 I231 | A223-E227 WeakPolarHBondContact O-CG 3.5Å; A223-E227 PolarHBondContact O-N 3.1Å; A224-E227 PolarHBondContact O-N 3.37Å; E227-S229 VanDerWaalsContact C-N 3.29Å; E227-S229 PolarHBondContact O-N 3.07Å; E227-H230 CarbonylContact O-C 3.23Å; E227-H230 PolarHBondContact O-N 2.86Å; E227-I231 WeakPolarHBondContact O-CG1 3.43Å; E227-I231 PolarHBondContact O-N 2.8Å |
| 228 | A | 76 | Confident | 73.7 | Confident | 64 Ų | 64 | 114.2 Ų | 114.2 | 53% | 0.529 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -62 | -31.8 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | A224 L226 H230 | A224-A228 VanDerWaalsContact O-CB 3.24Å; A224-A228 WeakPolarHBondContact O-CB 3.35Å; A224-A228 PolarHBondContact O-N 3.5Å; L226-A228 VanDerWaalsContact C-N 3.32Å; L226-A228 PolarHBondContact O-N 3.3Å; A228-H230 VanDerWaalsContact C-N 3.3Å |
| 229 | S | 67.1 | Low | 71.5 | Confident | 90 Ų | 90 | 118.2 Ų | 118.2 | 63% | 0.629 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -77.7 | -13.5 | 174.6 | 60.3 | 0 | 0 | 0 | 0 | 113.9 | L226 E227 | L226-S229 PolarHBondContact O-OG 3.09Å; E227-S229 VanDerWaalsContact C-N 3.29Å; E227-S229 PolarHBondContact O-N 3.07Å |
| 230 | H | 60.9 | Low | 70 | Confident | 139 Ų | 139 | 121.3 Ų | 121.3 | 64% | 0.644 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.4 | 5.4 | 178.9 | -65.5 | 88.4 | 0 | 0 | 0 | 113.8 | L226 E227 A228 P232 | L226-H230 PolarHBondContact O-ND1 3.22Å; E227-H230 CarbonylContact O-C 3.23Å; E227-H230 PolarHBondContact O-N 2.86Å; A228-H230 VanDerWaalsContact C-N 3.3Å; H230-P232 WeakPolarHBondContact O-CD 3.46Å |
| 231 | I | 58.4 | Low | 68.3 | Low | 108 Ų | 108 | 117.9 Ų | 117.9 | 55% | 0.554 | 63% | 0.627 | S | S | * | * | trans | -93.8 | 105.5 | 172.6 | -65.6 | 163.6 | 0 | 0 | 0 | 109.1 | E227 N233 | E227-I231 WeakPolarHBondContact O-CG1 3.43Å; E227-I231 PolarHBondContact O-N 2.8Å; I231-N233 PolarHBondContact O-N 3.27Å | ||
| 232 | P | 51.2 | Low | 66.7 | Low | 114 Ų | 114 | 119 Ų | 119 | 74% | 0.74 | 64% | 0.642 | S | S | * | * | trans | -76.1 | 68.5 | 175.8 | 32.7 | -37.1 | 0 | 0 | 0 | 111.6 | H230 S234 | H230-P232 WeakPolarHBondContact O-CD 3.46Å; P232-S234 WeakPolarHBondContact O-CB 3.43Å; P232-S234 PolarHBondContact O-N 2.99Å | ||
| 233 | N | 54.4 | Low | 65.4 | Low | 169 Ų | 169 | 120.6 Ų | 120.6 | 90% | 0.904 | 65% | 0.649 | S | S | * | * | S | Bend | trans | 47.1 | 27.7 | 162.3 | -146.2 | 15.2 | 0 | 0 | 0 | 117.4 | I231 | I231-N233 PolarHBondContact O-N 3.27Š|
| 234 | S | 52 | Low | 64.1 | Low | 85 Ų | 85 | 125.6 Ų | 125.6 | 59% | 0.594 | 67% | 0.668 | S | S | * | * | trans | -124.6 | 150.1 | -169.6 | -173 | 0 | 0 | 0 | 0 | 112.7 | P232 | P232-S234 WeakPolarHBondContact O-CB 3.43Å; P232-S234 PolarHBondContact O-N 2.99Å | ||
| 235 | T | 54.2 | Low | 62.7 | Low | 115 Ų | 115 | 132.6 Ų | 132.6 | 71% | 0.706 | 68% | 0.683 | S | S | * | * | trans | 56 | 80.8 | -171.3 | 28.3 | 0 | 0 | 0 | 0 | 115.3 | R237 | T235-R237 PolarHBondContact O-N 3.49Š| ||
| 236 | Q | 53.4 | Low | 61.2 | Low | 179 Ų | 179 | 136.4 Ų | 136.4 | 84% | 0.836 | 70% | 0.698 | S | S | * | * | trans | -57.8 | 101.7 | 150.5 | -67.7 | -175.4 | 8.3 | 0 | 0 | 109 | V238 | Q236-V238 PolarHBondContact O-N 3.3Š| ||
| 237 | R | 59.3 | Low | 59.7 | Low | 211 Ų | 211 | 138.4 Ų | 138.4 | 80% | 0.796 | 70% | 0.704 | S | S | * | * | trans | -74.6 | 77.6 | 174.7 | -75.5 | -174.4 | 174.3 | 168.4 | -0.3 | 110.6 | T235 F239 | T235-R237 PolarHBondContact O-N 3.49Å; R237-F239 WeakPolarHBondContact O-CD2 3.17Å; R237-F239 PolarHBondContact O-N 3.04Å | ||
| 238 | V | 58.2 | Low | 58 | Low | 83 Ų | 83 | 143.5 Ų | 143.5 | 50% | 0.503 | 72% | 0.718 | S | S | . | * | trans | -65 | 92.7 | 172.6 | -82.6 | 0 | 0 | 0 | 0 | 111 | Q236 R240 | Q236-V238 PolarHBondContact O-N 3.3Å; V238-R240 VanDerWaalsContact C-N 3.32Å; V238-R240 PolarHBondContact O-N 2.8Å | ||
| 239 | F | 51 | Low | 56.3 | Low | 182 Ų | 182 | 147.9 Ų | 147.9 | 80% | 0.798 | 73% | 0.727 | S | S | * | * | trans | -64.4 | 91.2 | 166.3 | -81.1 | -89.8 | 0 | 0 | 0 | 109.9 | R237 V241 | R237-F239 WeakPolarHBondContact O-CD2 3.17Å; R237-F239 PolarHBondContact O-N 3.04Å; F239-V241 PolarHBondContact O-N 2.97Å | ||
| 240 | R | 64.8 | Low | 55.3 | Low | 203 Ų | 203 | 149.5 Ų | 149.5 | 77% | 0.766 | 73% | 0.734 | S | S | * | * | trans | -77.7 | 100.4 | 168.2 | -61.8 | -57.1 | -176.6 | -154.9 | -0.3 | 108.5 | V238 P242 | V238-R240 VanDerWaalsContact C-N 3.32Å; V238-R240 PolarHBondContact O-N 2.8Å; R240-P242 WeakPolarHBondContact O-CD 3.33Å | ||
| 241 | V | 60.8 | Low | 54.3 | Low | 119 Ų | 119 | 147.4 Ų | 147.4 | 72% | 0.721 | 74% | 0.735 | S | S | * | * | trans | -66.8 | 122.3 | 171.6 | 179.5 | 0 | 0 | 0 | 0 | 108.4 | F239 I243 | F239-V241 PolarHBondContact O-N 2.97Å; V241-I243 PolarHBondContact O-N 3.21Å; V241-I243 VanDerWaalsContact O-N 3.14Å | ||
| 242 | P | 59.4 | Low | 53.4 | Low | 107 Ų | 107 | 149 Ų | 149 | 70% | 0.695 | 75% | 0.75 | S | S | * | * | trans | -68 | 110.9 | 174.1 | -18.6 | 32.8 | 0 | 0 | 0 | 109.8 | R240 L244 | R240-P242 WeakPolarHBondContact O-CD 3.33Å; P242-L244 PolarHBondContact O-N 3.38Å; P242-L244 VanDerWaalsContact O-N 3.09Å | ||
| 243 | I | 63.9 | Low | 53.1 | Low | 123 Ų | 123 | 146.9 Ų | 146.9 | 63% | 0.631 | 75% | 0.749 | S | S | * | * | trans | -81.9 | 90.2 | 176.1 | -47.2 | 178.8 | 0 | 0 | 0 | 108.2 | V241 Y245 | V241-I243 PolarHBondContact O-N 3.21Å; V241-I243 VanDerWaalsContact O-N 3.14Å; I243-Y245 VanDerWaalsContact C-N 3.28Å; I243-Y245 HydrophobicContact CB-CD2 4.26Å; I243-Y245 HydrophobicContact CB-CE2 3.99Å; I243-Y245 HydrophobicContact CG2-CD2 3.68Å; I243-Y245 HydrophobicContact CG2-CE1 4.46Å; I243-Y245 HydrophobicContact CG2-CE2 3.33Å; I243-Y245 HydrophobicContact CG2-CG 4.38Å; I243-Y245 PolarHBondContact O-N 3.02Å | ||
| 244 | L | 64.3 | Low | 52.6 | Low | 159 Ų | 159 | 145.4 Ų | 145.4 | 83% | 0.832 | 75% | 0.745 | S | S | * | * | trans | -72.4 | 83.2 | 172.4 | -69.4 | 175.7 | 0 | 0 | 0 | 110.1 | P242 H246 | P242-L244 PolarHBondContact O-N 3.38Å; P242-L244 VanDerWaalsContact O-N 3.09Å; L244-H246 PolarHBondContact O-N 3.03Å | ||
| 245 | Y | 59.9 | Low | 52.4 | Low | 202 Ų | 202 | 149.5 Ų | 149.5 | 79% | 0.792 | 76% | 0.76 | S | S | * | * | trans | -64 | 118.2 | 164 | -74.2 | -81.3 | 0 | 0 | 0 | 109.2 | I243 | I243-Y245 VanDerWaalsContact C-N 3.28Å; I243-Y245 HydrophobicContact CB-CD2 4.26Å; I243-Y245 HydrophobicContact CB-CE2 3.99Å; I243-Y245 HydrophobicContact CG2-CD2 3.68Å; I243-Y245 HydrophobicContact CG2-CE1 4.46Å; I243-Y245 HydrophobicContact CG2-CE2 3.33Å; I243-Y245 HydrophobicContact CG2-CG 4.38Å; I243-Y245 PolarHBondContact O-N 3.02Å | ||
| 246 | H | 54.7 | Low | 51.7 | Low | 185 Ų | 185 | 147.1 Ų | 147.1 | 86% | 0.856 | 76% | 0.758 | S | S | * | * | trans | -95.5 | 93.6 | 174.3 | -134.5 | 70.6 | 0 | 0 | 0 | 108.6 | L244 R248 | L244-H246 PolarHBondContact O-N 3.03Å; H246-R248 PolarHBondContact O-N 3.25Å | ||
| 247 | E | 51.5 | Low | 51 | Low | 145 Ų | 145 | 148.1 Ų | 148.1 | 68% | 0.678 | 76% | 0.76 | S | S | * | * | trans | -72 | 120.3 | 179.1 | -168.8 | -178.7 | 121.9 | 0 | 0 | 110.5 | Q249 | E247-Q249 HydrophobicContact CG-CG 4.27Å; E247-Q249 PolarHBondContact O-N 3.25Å; E247-Q249 WeakPolarHBondContact OE1-CG 3.46Å; E247-Q249 PolarHBondContact OE1-NE2 2.91Å | ||
| 248 | R | 42.4 | Very low | 50.4 | Low | 231 Ų | 231 | 143.5 Ų | 143.5 | 87% | 0.872 | 76% | 0.76 | S | S | * | * | trans | -83.8 | 89.6 | 171.8 | -90.4 | -174.4 | 167.7 | 175.3 | -4 | 110 | H246 T250 | H246-R248 PolarHBondContact O-N 3.25Å; R248-T250 PolarHBondContact O-N 3.24Å | ||
| 249 | Q | 39.6 | Very low | 49.8 | Very low | 156 Ų | 156 | 147.2 Ų | 147.2 | 73% | 0.729 | 78% | 0.777 | S | S | * | * | trans | -77.7 | 115.8 | 163.1 | -65.8 | -169 | 3.3 | 0 | 0 | 109.9 | E247 | E247-Q249 HydrophobicContact CG-CG 4.27Å; E247-Q249 PolarHBondContact O-N 3.25Å; E247-Q249 WeakPolarHBondContact OE1-CG 3.46Å; E247-Q249 PolarHBondContact OE1-NE2 2.91Å | ||
| 250 | T | 45.7 | Very low | 49.6 | Very low | 125 Ų | 125 | 146 Ų | 146 | 77% | 0.767 | 78% | 0.779 | S | S | * | * | trans | -111.2 | 84.6 | 177.4 | 52 | 0 | 0 | 0 | 0 | 111.3 | R248 | R248-T250 PolarHBondContact O-N 3.24Š| ||
| 251 | S | 41.6 | Very low | 48.4 | Very low | 95 Ų | 95 | 139.8 Ų | 139.8 | 66% | 0.664 | 78% | 0.777 | S | S | * | * | trans | -167.8 | 133.8 | 167.1 | 52.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 252 | T | 39.3 | Very low | 47.7 | Very low | 142 Ų | 142 | 142.3 Ų | 142.3 | 87% | 0.871 | 79% | 0.785 | S | S | * | * | trans | 32.2 | 113.6 | 143.5 | 58.8 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 253 | G | 44.4 | Very low | 47.3 | Very low | 69 Ų | 69 | 143.2 Ų | 143.2 | 71% | 0.711 | 79% | 0.792 | S | S | * | * | cis | 125.9 | 148.6 | 35 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 254 | V | 43.8 | Very low | 46.9 | Very low | 137 Ų | 137 | 143.9 Ų | 143.9 | 83% | 0.83 | 80% | 0.801 | S | S | * | * | trans | 81.2 | 133.1 | 162.1 | -171.7 | 0 | 0 | 0 | 0 | 118 | ||||
| 255 | L | 47.1 | Very low | 46.7 | Very low | 171 Ų | 171 | 141.3 Ų | 141.3 | 90% | 0.895 | 80% | 0.796 | S | S | * | * | trans | 60.9 | 124.4 | -174 | -45 | -170.5 | 0 | 0 | 0 | 115.9 | ||||
| 256 | G | 40.3 | Very low | 46.3 | Very low | 66 Ų | 66 | 137.8 Ų | 137.8 | 68% | 0.68 | 80% | 0.798 | S | S | * | * | cis | 127.5 | 97 | -8.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 257 | F | 39.3 | Very low | 45.8 | Very low | 200 Ų | 200 | 133.7 Ų | 133.7 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | trans | -157 | 115.9 | 158.4 | -108.4 | -73 | 0 | 0 | 0 | 110.1 | ||||
| 258 | S | 45.6 | Very low | 45.4 | Very low | 114 Ų | 114 | 137.3 Ų | 137.3 | 80% | 0.797 | 80% | 0.798 | S | S | * | * | trans | -103.7 | 125.7 | 163 | -65.5 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 259 | L | 46.8 | Very low | 45.5 | Very low | 161 Ų | 161 | 130.6 Ų | 130.6 | 84% | 0.843 | 79% | 0.786 | S | S | * | * | trans | -135.9 | 138.1 | 162.5 | -97.2 | 166.4 | 0 | 0 | 0 | 109.1 | ||||
| 260 | N | 45.2 | Very low | 46.1 | Very low | 157 Ų | 157 | 127.9 Ų | 127.9 | 84% | 0.84 | 78% | 0.78 | S | S | * | * | trans | -99.2 | 144.1 | -169 | -65.9 | -30.3 | 0 | 0 | 0 | 111.8 | ||||
| 261 | G | 41.2 | Very low | 46.1 | Very low | 71 Ų | 71 | 128.6 Ų | 128.6 | 73% | 0.732 | 78% | 0.779 | S | S | * | * | trans | 80.2 | 116.9 | 146 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 262 | L | 46.3 | Very low | 46.6 | Very low | 172 Ų | 172 | 132 Ų | 132 | 90% | 0.901 | 78% | 0.784 | S | S | * | * | 179.4 | 138.2 | 110.4 | -92.5 | 167.4 | 0 | 0 | 0 | 109.2 | |||||
| 263 | P | 51.1 | Low | 47.6 | Very low | 127 Ų | 127 | 131.2 Ų | 131.2 | 83% | 0.825 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -82.7 | 124.2 | 173.8 | 32.1 | -30.8 | 0 | 0 | 0 | 110.6 | ||
| 264 | V | 54.7 | Low | 47.9 | Very low | 137 Ų | 137 | 136.1 Ų | 136.1 | 83% | 0.83 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -100.6 | 135.1 | 170.5 | 72.7 | 0 | 0 | 0 | 0 | 110.6 | ||
| 265 | S | 59.5 | Low | 48.3 | Very low | 105 Ų | 105 | 134.9 Ų | 134.9 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 133.3 | -177 | -56 | 0 | 0 | 0 | 0 | 112.2 | S267 | S265-S267 PolarHBondContact O-N 3.49Š|
| 266 | P | 52.9 | Low | 48.6 | Very low | 127 Ų | 127 | 132.2 Ų | 132.2 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | trans | -74.8 | 93.7 | 171.8 | 30.3 | -33.2 | 0 | 0 | 0 | 110.5 | ||||
| 267 | S | 44.3 | Very low | 49 | Very low | 99 Ų | 99 | 136.7 Ų | 136.7 | 69% | 0.692 | 78% | 0.782 | S | S | * | * | trans | -70.1 | 129.1 | 167.4 | -169.7 | 0 | 0 | 0 | 0 | 110 | S265 S269 | S265-S267 PolarHBondContact O-N 3.49Å; S267-S269 VanDerWaalsContact C-N 3.3Å; S267-S269 PolarHBondContact O-N 3.31Å | ||
| 268 | W | 43.2 | Very low | 49.1 | Very low | 221 Ų | 221 | 131.7 Ų | 131.7 | 84% | 0.837 | 78% | 0.777 | S | S | * | * | trans | -85.3 | 64.7 | -175.1 | 49.9 | -84.2 | 0 | 0 | 0 | 111.6 | V270 | W268-V270 HydrophobicContact CE3-CG2 4.15Å; W268-V270 HydrophobicContact CZ3-CG2 4.39Å; W268-V270 PolarHBondContact O-N 3.09Å | ||
| 269 | S | 43 | Very low | 49.2 | Very low | 90 Ų | 90 | 133.5 Ų | 133.5 | 63% | 0.629 | 77% | 0.773 | S | S | * | * | trans | -68.1 | 94.3 | 176.5 | -64.4 | 0 | 0 | 0 | 0 | 112 | S267 N271 | S267-S269 VanDerWaalsContact C-N 3.3Å; S267-S269 PolarHBondContact O-N 3.31Å; S269-N271 PolarHBondContact O-N 3.18Å; S269-N271 PolarHBondContact O-ND2 3.21Å | ||
| 270 | V | 52.5 | Low | 49.4 | Very low | 99 Ų | 99 | 130.9 Ų | 130.9 | 60% | 0.6 | 77% | 0.768 | S | S | * | * | trans | -55.5 | 120 | 169.9 | 179.6 | 0 | 0 | 0 | 0 | 109.5 | W268 | W268-V270 HydrophobicContact CE3-CG2 4.15Å; W268-V270 HydrophobicContact CZ3-CG2 4.39Å; W268-V270 PolarHBondContact O-N 3.09Å | ||
| 271 | N | 45.3 | Very low | 50.1 | Low | 140 Ų | 140 | 129.5 Ų | 129.5 | 75% | 0.749 | 77% | 0.765 | S | S | * | * | trans | -134.5 | 113.4 | 174.1 | -82.4 | -71.1 | 0 | 0 | 0 | 109.8 | S269 | S269-N271 PolarHBondContact O-N 3.18Å; S269-N271 PolarHBondContact O-ND2 3.21Å | ||
| 272 | H | 52 | Low | 50.7 | Low | 167 Ų | 167 | 133.5 Ų | 133.5 | 77% | 0.773 | 77% | 0.77 | S | S | * | * | trans | -93.7 | 118.4 | 171.9 | -69.3 | -86.3 | 0 | 0 | 0 | 109.8 | L274 | H272-L274 PolarHBondContact O-N 3.43Š| ||
| 273 | P | 61.4 | Low | 51.1 | Low | 125 Ų | 125 | 133.5 Ų | 133.5 | 81% | 0.812 | 77% | 0.767 | S | S | * | * | trans | -81.2 | 93.2 | 169.3 | 31.7 | -31.8 | 0 | 0 | 0 | 110.3 | ||||
| 274 | L | 50.1 | Low | 51.3 | Low | 173 Ų | 173 | 135.7 Ų | 135.7 | 91% | 0.906 | 77% | 0.771 | S | S | * | * | trans | -71.7 | 134.6 | 151.5 | -71.6 | 171.5 | 0 | 0 | 0 | 107.8 | H272 | H272-L274 PolarHBondContact O-N 3.43Š| ||
| 275 | S | 52.8 | Low | 51 | Low | 110 Ų | 110 | 134.7 Ų | 134.7 | 77% | 0.769 | 77% | 0.77 | S | S | * | * | trans | -141.3 | 126.2 | 174.1 | -171.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 276 | P | 53.6 | Low | 50.4 | Low | 115 Ų | 115 | 133.8 Ų | 133.8 | 75% | 0.747 | 76% | 0.764 | S | S | * | * | trans | -85.6 | 144.7 | -178.3 | 33.6 | -33.9 | 0 | 0 | 0 | 113 | ||||
| 277 | F | 47.1 | Very low | 50.3 | Low | 160 Ų | 160 | 136.1 Ų | 136.1 | 70% | 0.702 | 76% | 0.764 | S | S | * | * | trans | 6.8 | 119.1 | 140.5 | -172.2 | -90.9 | 0 | 0 | 0 | 118.1 | H279 | F277-H279 AromaticContact CE2-CE1 3.33Å; F277-H279 WeakPolarHBondContact CE2-CE1 3.43Å; F277-H279 AromaticContact CE2-ND1 3.81Å; F277-H279 AromaticContact CE2-NE2 3.5Å; F277-H279 AromaticContact CZ-CD2 3.43Å; F277-H279 VanDerWaalsContact CZ-CD2 3.43Å; F277-H279 WeakPolarHBondContact CZ-CD2 3.36Å; F277-H279 AromaticContact CZ-CE1 3.52Å; F277-H279 AromaticContact CZ-CG 3.76Å; F277-H279 AromaticContact CZ-ND1 3.81Å; F277-H279 AromaticContact CZ-NE2 3.28Å; F277-H279 VanDerWaalsContact CZ-NE2 3.28Å; F277-H279 WeakPolarHBondContact CZ-NE2 3.28Å | ||
| 278 | A | 42.7 | Very low | 50.7 | Low | 95 Ų | 95 | 139.4 Ų | 139.4 | 79% | 0.785 | 77% | 0.77 | S | S | * | * | trans | -140.2 | 119.8 | 155.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 279 | H | 47.9 | Very low | 51.6 | Low | 153 Ų | 153 | 135.5 Ų | 135.5 | 71% | 0.708 | 77% | 0.771 | S | S | * | * | trans | -81.9 | 126.1 | 167.5 | -74.8 | -18.8 | 0 | 0 | 0 | 109.5 | F277 | F277-H279 AromaticContact CE2-CE1 3.33Å; F277-H279 WeakPolarHBondContact CE2-CE1 3.43Å; F277-H279 AromaticContact CE2-ND1 3.81Å; F277-H279 AromaticContact CE2-NE2 3.5Å; F277-H279 AromaticContact CZ-CD2 3.43Å; F277-H279 VanDerWaalsContact CZ-CD2 3.43Å; F277-H279 WeakPolarHBondContact CZ-CD2 3.36Å; F277-H279 AromaticContact CZ-CE1 3.52Å; F277-H279 AromaticContact CZ-CG 3.76Å; F277-H279 AromaticContact CZ-ND1 3.81Å; F277-H279 AromaticContact CZ-NE2 3.28Å; F277-H279 VanDerWaalsContact CZ-NE2 3.28Å; F277-H279 WeakPolarHBondContact CZ-NE2 3.28Å | ||
| 280 | S | 50.8 | Low | 52.4 | Low | 106 Ų | 106 | 134.8 Ų | 134.8 | 74% | 0.741 | 78% | 0.778 | S | S | * | * | trans | -104.7 | 108.1 | 168.9 | -171 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 281 | V | 58.8 | Low | 52.4 | Low | 127 Ų | 127 | 137.9 Ų | 137.9 | 77% | 0.77 | 79% | 0.79 | S | S | * | * | trans | -79.2 | 119.2 | 168.2 | -73.3 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 282 | N | 55 | Low | 52.9 | Low | 155 Ų | 155 | 141.3 Ų | 141.3 | 83% | 0.829 | 82% | 0.816 | S | S | * | * | trans | -111.9 | 142.4 | 173.2 | -100.8 | -14.6 | 0 | 0 | 0 | 110.6 | ||||
| 283 | M | 54.2 | Low | 52.9 | Low | 172 Ų | 172 | 140.1 Ų | 140.1 | 85% | 0.847 | 82% | 0.818 | S | S | * | * | trans | -82.5 | 155.7 | -157.7 | -77.1 | -69.3 | 175.7 | 0 | 0 | 114.9 | S285 | M283-S285 PolarHBondContact O-N 3.47Š| ||
| 284 | L | 54.9 | Low | 52.5 | Low | 174 Ų | 174 | 140.8 Ų | 140.8 | 91% | 0.911 | 82% | 0.818 | S | S | * | * | trans | -53.5 | 128.5 | 165.8 | 177.8 | 69.9 | 0 | 0 | 0 | 111.3 | ||||
| 285 | S | 49.4 | Very low | 52.6 | Low | 115 Ų | 115 | 139.1 Ų | 139.1 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | trans | -149 | 138.1 | 155.8 | -168.6 | 0 | 0 | 0 | 0 | 109.8 | M283 | M283-S285 PolarHBondContact O-N 3.47Š| ||
| 286 | S | 46.7 | Very low | 52.6 | Low | 87 Ų | 87 | 140.8 Ų | 140.8 | 61% | 0.608 | 82% | 0.816 | S | S | * | * | trans | -84.2 | 154.5 | 179.5 | -171.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 287 | Q | 51.3 | Low | 52.6 | Low | 175 Ų | 175 | 142.4 Ų | 142.4 | 82% | 0.818 | 82% | 0.82 | S | S | * | * | -154.3 | 145.3 | 114.9 | -91.3 | -54.7 | 24.5 | 0 | 0 | 111.3 | |||||
| 288 | M | 52.5 | Low | 52.9 | Low | 168 Ų | 168 | 141.2 Ų | 141.2 | 83% | 0.828 | 83% | 0.828 | S | S | * | * | trans | -95.5 | 134.8 | 168.5 | -67.1 | 174 | 63.3 | 0 | 0 | 110.1 | ||||
| 289 | T | 61.5 | Low | 53.7 | Low | 140 Ų | 140 | 144.5 Ų | 144.5 | 86% | 0.859 | 83% | 0.831 | S | S | * | * | trans | -140.2 | 99 | 162.8 | 55.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 290 | G | 60.4 | Low | 54.1 | Low | 75 Ų | 75 | 143.8 Ų | 143.8 | 77% | 0.773 | 84% | 0.841 | S | S | * | * | trans | -105 | 142.5 | 158.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 291 | L | 52.2 | Low | 54.4 | Low | 163 Ų | 163 | 147 Ų | 147 | 85% | 0.853 | 85% | 0.849 | S | S | * | * | trans | -154.7 | 121.8 | 176.6 | -110.7 | 170.9 | 0 | 0 | 0 | 110.1 | ||||
| 292 | V | 55.6 | Low | 54 | Low | 213 Ų | 213 | 148.8 Ų | 148.8 | 100% | 1.291 | 86% | 0.857 | S | S | * | * | trans | 45.5 | 0 | 166 | -177.8 | 0 | 0 | 0 | 0 | 116.2 |
Retrieved 292 of 292 residues in 82.4 ms
(Link to these results)