| 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 | 38.8 | Very low | 43.2 | Very low | 231 Ų | 231 | 139.8 Ų | 139.8 | 100% | 1.138 | 80% | 0.803 | S | S | * | * | 0 | 73.9 | 0 | -63.9 | 173.1 | 83.6 | 0 | 0 | 105.1 | |||||
| 2 | D | 38.6 | Very low | 43.2 | Very low | 141 Ų | 141 | 136.1 Ų | 136.1 | 75% | 0.754 | 80% | 0.802 | S | S | * | * | 104.3 | 101.9 | 83.8 | -107.9 | -75.5 | 0 | 0 | 0 | 106.8 | |||||
| 3 | T | 43.4 | Very low | 43.2 | Very low | 119 Ų | 119 | 136 Ų | 136 | 73% | 0.73 | 80% | 0.804 | S | S | * | * | 71.4 | 128.2 | 89.2 | -31.4 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 4 | G | 47.3 | Very low | 42.9 | Very low | 69 Ų | 69 | 132.8 Ų | 132.8 | 71% | 0.711 | 79% | 0.792 | S | S | * | * | trans | 138.5 | 57.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 5 | D | 46 | Very low | 42.7 | Very low | 132 Ų | 132 | 140.1 Ų | 140.1 | 71% | 0.706 | 80% | 0.8 | S | S | * | * | 45.5 | 105.3 | 84.6 | -97.6 | -41.2 | 0 | 0 | 0 | 114 | |||||
| 6 | T | 48 | Very low | 42.2 | Very low | 122 Ų | 122 | 137.6 Ų | 137.6 | 75% | 0.748 | 79% | 0.794 | S | S | * | * | 67.2 | 127 | 91 | -36.7 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 7 | A | 43.2 | Very low | 41.7 | Very low | 70 Ų | 70 | 133.6 Ų | 133.6 | 58% | 0.579 | 79% | 0.789 | S | S | * | * | 173 | 148.3 | 69 | 0 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 8 | L | 41.8 | Very low | 41.3 | Very low | 178 Ų | 178 | 135.8 Ų | 135.8 | 93% | 0.932 | 79% | 0.79 | S | S | * | * | trans | 72.8 | 138.6 | 139.5 | -54.6 | 165.3 | 0 | 0 | 0 | 119.5 | ||||
| 9 | G | 39.2 | Very low | 41 | Very low | 68 Ų | 68 | 135.3 Ų | 135.3 | 70% | 0.701 | 79% | 0.79 | S | S | * | * | cis | 175.7 | 137.7 | 5.8 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 10 | Q | 44.1 | Very low | 40.7 | Very low | 199 Ų | 199 | 136.2 Ų | 136.2 | 93% | 0.93 | 79% | 0.791 | S | S | * | * | trans | -69.9 | 145 | 169.8 | -64 | 170 | -50.4 | 0 | 0 | 110.1 | ||||
| 11 | K | 44.2 | Very low | 40.3 | Very low | 209 Ų | 209 | 135 Ų | 135 | 91% | 0.909 | 79% | 0.79 | S | S | * | * | trans | -150.2 | 120.9 | 144 | 50.8 | 174.2 | 177.4 | -82.8 | 0 | 110.7 | ||||
| 12 | A | 43.3 | Very low | 40.4 | Very low | 95 Ų | 95 | 130.9 Ų | 130.9 | 79% | 0.785 | 78% | 0.778 | S | S | * | * | trans | -95.7 | 176 | 164.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 13 | T | 43.8 | Very low | 40.2 | Very low | 135 Ų | 135 | 129.5 Ų | 129.5 | 83% | 0.828 | 78% | 0.779 | S | S | * | * | trans | 93.8 | 128 | 169.7 | -138.8 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 14 | S | 39 | Very low | 39.6 | Very low | 91 Ų | 91 | 126.4 Ų | 126.4 | 64% | 0.636 | 77% | 0.771 | S | S | * | * | cis | -159.3 | 140.8 | 34.1 | -55.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 15 | R | 39.5 | Very low | 38.8 | Very low | 242 Ų | 242 | 134.3 Ų | 134.3 | 91% | 0.913 | 78% | 0.78 | S | S | * | * | 71.1 | 125.6 | 95.3 | -149.5 | -177.7 | 152.2 | -159.7 | -7 | 111.8 | |||||
| 16 | S | 35.5 | Very low | 37.9 | Very low | 101 Ų | 101 | 139.5 Ų | 139.5 | 71% | 0.706 | 79% | 0.79 | S | S | * | * | -175.7 | 154.4 | 51.6 | 52.1 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 17 | G | 32.9 | Very low | 37.1 | Very low | 69 Ų | 69 | 144 Ų | 144 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | trans | 62.9 | 148.3 | 146.2 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 18 | E | 35.2 | Very low | 36.5 | Very low | 173 Ų | 173 | 147.6 Ų | 147.6 | 81% | 0.808 | 80% | 0.798 | S | S | * | * | cis | -178.6 | 143 | 15.7 | 50.2 | -160.7 | 80.3 | 0 | 0 | 108.3 | ||||
| 19 | T | 35.9 | Very low | 36.1 | Very low | 127 Ų | 127 | 146.8 Ų | 146.8 | 78% | 0.779 | 79% | 0.789 | S | S | * | * | trans | 66.9 | 119 | 152.9 | 60.5 | 0 | 0 | 0 | 0 | 123 | ||||
| 20 | D | 34.4 | Very low | 35.8 | Very low | 153 Ų | 153 | 153 Ų | 153 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | trans | -16.3 | 140.7 | 142.1 | -75.3 | -67.5 | 0 | 0 | 0 | 117.9 | ||||
| 21 | S | 31.8 | Very low | 35.1 | Very low | 111 Ų | 111 | 147.6 Ų | 147.6 | 78% | 0.776 | 78% | 0.784 | S | S | * | * | 170 | 138.4 | 99.6 | 48.5 | 0 | 0 | 0 | 0 | 113 | |||||
| 22 | V | 40.7 | Very low | 34.7 | Very low | 144 Ų | 144 | 142.4 Ų | 142.4 | 87% | 0.873 | 78% | 0.781 | S | S | * | * | trans | -56.6 | 138.6 | 157.6 | 165.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 23 | S | 34 | Very low | 34.1 | Very low | 112 Ų | 112 | 143.5 Ų | 143.5 | 78% | 0.783 | 78% | 0.777 | S | S | * | * | trans | -154 | 124.6 | 161.5 | -152.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 24 | G | 31.3 | Very low | 33.8 | Very low | 55 Ų | 55 | 144.4 Ų | 144.4 | 57% | 0.567 | 78% | 0.776 | S | S | * | * | cis | 92.7 | 95.3 | 16.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 25 | R | 31.2 | Very low | 33.7 | Very low | 234 Ų | 234 | 148.6 Ų | 148.6 | 88% | 0.883 | 78% | 0.783 | S | S | * | * | trans | 71.4 | 121.7 | 158.3 | -97.9 | -179.4 | -81.3 | -121.6 | 0 | 119.7 | ||||
| 26 | W | 26.6 | Very low | 33.3 | Very low | 242 Ų | 242 | 144.8 Ų | 144.8 | 92% | 0.917 | 78% | 0.777 | S | S | * | * | 36.3 | 117.8 | 126.1 | -72.2 | 85.8 | 0 | 0 | 0 | 119.5 | |||||
| 27 | R | 31.1 | Very low | 33 | Very low | 215 Ų | 215 | 145.6 Ų | 145.6 | 81% | 0.811 | 78% | 0.783 | S | S | * | * | trans | -163.4 | 119.6 | 140.9 | -123.3 | -156.3 | -126.2 | -76.9 | -10.2 | 114.5 | ||||
| 28 | Q | 30.8 | Very low | 33.2 | Very low | 146 Ų | 146 | 149.5 Ų | 149.5 | 68% | 0.682 | 79% | 0.794 | S | S | * | * | 70.5 | 111.7 | 114.7 | -164.1 | 151.7 | 28.6 | 0 | 0 | 120.9 | |||||
| 29 | E | 32.6 | Very low | 33 | Very low | 162 Ų | 162 | 150.6 Ų | 150.6 | 76% | 0.757 | 80% | 0.796 | S | S | * | * | trans | -12.8 | 139.2 | 147.6 | -97.6 | 176.5 | 88.2 | 0 | 0 | 117.6 | S31 | E29-S31 PolarHBondContact OE1-OG 2.96Š| ||
| 30 | Q | 32.9 | Very low | 32.7 | Very low | 197 Ų | 197 | 148.3 Ų | 148.3 | 92% | 0.921 | 79% | 0.785 | S | S | * | * | trans | -114.4 | 110 | 144.5 | -70.3 | -152.4 | -14.1 | 0 | 0 | 109.5 | ||||
| 31 | S | 30.3 | Very low | 32.5 | Very low | 86 Ų | 86 | 146.2 Ų | 146.2 | 60% | 0.601 | 78% | 0.782 | S | S | * | * | trans | -73.4 | 128.2 | 165.1 | -44.3 | 0 | 0 | 0 | 0 | 109.5 | E29 | E29-S31 PolarHBondContact OE1-OG 2.96Š| ||
| 32 | A | 34.7 | Very low | 32.5 | Very low | 101 Ų | 101 | 149.2 Ų | 149.2 | 84% | 0.835 | 78% | 0.784 | S | S | * | * | trans | -80.9 | 116.6 | 168.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 33 | V | 31.6 | Very low | 32 | Very low | 118 Ų | 118 | 150.5 Ų | 150.5 | 72% | 0.715 | 78% | 0.781 | S | S | * | * | trans | -85.4 | 112.3 | 174.8 | 173.5 | 0 | 0 | 0 | 0 | 109.2 | K35 | V33-K35 HydrophobicContact CG1-CG 4.07Š| ||
| 34 | L | 38.2 | Very low | 32 | Very low | 154 Ų | 154 | 148.7 Ų | 148.7 | 81% | 0.806 | 78% | 0.779 | S | S | * | * | trans | -96 | 110.2 | 160.6 | -86.3 | 146.8 | 0 | 0 | 0 | 108.1 | M36 | L34-M36 HydrophobicContact CD2-CE 4.04Š| ||
| 35 | K | 36.1 | Very low | 32.4 | Very low | 178 Ų | 178 | 151.8 Ų | 151.8 | 77% | 0.774 | 79% | 0.789 | S | S | * | * | trans | -83.4 | 116.3 | 172.6 | -75.5 | 177.9 | 173.7 | 173.3 | 0 | 109.8 | V33 | V33-K35 HydrophobicContact CG1-CG 4.07Š| ||
| 36 | M | 32.2 | Very low | 32.3 | Very low | 162 Ų | 162 | 152.3 Ų | 152.3 | 80% | 0.798 | 79% | 0.791 | S | S | * | * | trans | -125.5 | 122.9 | 156.5 | -56.7 | -56.8 | 137.5 | 0 | 0 | 109.5 | L34 | L34-M36 HydrophobicContact CD2-CE 4.04Š| ||
| 37 | S | 28.8 | Very low | 32.6 | Very low | 119 Ų | 119 | 148.4 Ų | 148.4 | 83% | 0.832 | 78% | 0.783 | S | S | * | * | trans | -71.1 | 137.3 | -179.7 | -58.8 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 38 | T | 37.3 | Very low | 32.8 | Very low | 151 Ų | 151 | 144 Ų | 144 | 93% | 0.926 | 78% | 0.782 | S | S | * | * | trans | -142 | 155.2 | 143 | 50.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 39 | F | 30.5 | Very low | 32.7 | Very low | 196 Ų | 196 | 144.2 Ų | 144.2 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | trans | -79.9 | 157.9 | -155.2 | -177.7 | -96.9 | 0 | 0 | 0 | 114.3 | ||||
| 40 | S | 29.3 | Very low | 32.6 | Very low | 79 Ų | 79 | 144.4 Ų | 144.4 | 55% | 0.552 | 79% | 0.788 | S | S | * | * | trans | -63.9 | 145.1 | -175.7 | 44 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 41 | S | 29.4 | Very low | 32.5 | Very low | 109 Ų | 109 | 141.4 Ų | 141.4 | 76% | 0.762 | 78% | 0.778 | S | S | * | * | -173.3 | 115.7 | 126 | -77.8 | 0 | 0 | 0 | 0 | 108.2 | |||||
| 42 | Q | 33.1 | Very low | 32.9 | Very low | 174 Ų | 174 | 142.4 Ų | 142.4 | 81% | 0.813 | 78% | 0.783 | S | S | * | * | 53.1 | 125.7 | 92.3 | -107.3 | -165.5 | 49.7 | 0 | 0 | 111.1 | |||||
| 43 | E | 30.1 | Very low | 32.8 | Very low | 171 Ų | 171 | 146.8 Ų | 146.8 | 80% | 0.799 | 79% | 0.786 | S | S | * | * | cis | -161.9 | 164.9 | 33.4 | -53.8 | -175.7 | 99 | 0 | 0 | 109.5 | ||||
| 44 | G | 32.7 | Very low | 32.9 | Very low | 73 Ų | 73 | 148.7 Ų | 148.7 | 75% | 0.753 | 79% | 0.787 | S | S | * | * | trans | -83.2 | -147.2 | -174 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 45 | P | 40.9 | Very low | 32.7 | Very low | 120 Ų | 120 | 149.9 Ų | 149.9 | 78% | 0.779 | 79% | 0.792 | S | S | * | * | -110.1 | 168.2 | -109.1 | 38.2 | -30.8 | 0 | 0 | 0 | 114 | |||||
| 46 | R | 29.5 | Very low | 32.4 | Very low | 245 Ų | 245 | 143.6 Ų | 143.6 | 93% | 0.925 | 78% | 0.778 | S | S | * | * | trans | -167.4 | 121.2 | 153.8 | -108.2 | 168.1 | -168.1 | 100 | -3.3 | 113.2 | ||||
| 47 | Q | 32.5 | Very low | 32.3 | Very low | 160 Ų | 160 | 143.7 Ų | 143.7 | 75% | 0.748 | 78% | 0.782 | S | S | * | * | trans | -74.3 | 170.3 | 149.6 | -71.2 | -168.2 | -65.4 | 0 | 0 | 109.7 | ||||
| 48 | P | 35.9 | Very low | 32.5 | Very low | 122 Ų | 122 | 142.4 Ų | 142.4 | 79% | 0.792 | 78% | 0.779 | S | S | * | * | -140 | 149.3 | 98.8 | 28.2 | -9.7 | 0 | 0 | 0 | 116 | |||||
| 49 | Q | 27.7 | Very low | 32.1 | Very low | 151 Ų | 151 | 139.5 Ų | 139.5 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | trans | -64.8 | 139.8 | 155.5 | -80.7 | -96.8 | -0.1 | 0 | 0 | 111.5 | ||||
| 50 | I | 30.7 | Very low | 32.2 | Very low | 166 Ų | 166 | 136.1 Ų | 136.1 | 85% | 0.851 | 77% | 0.771 | S | S | * | * | trans | -140.7 | 136.1 | 150.7 | -59.9 | -179.6 | 0 | 0 | 0 | 108.6 | ||||
| 51 | D | 29.8 | Very low | 32.4 | Very low | 134 Ų | 134 | 136.5 Ų | 136.5 | 72% | 0.717 | 78% | 0.779 | S | S | * | * | trans | -73.5 | 163.6 | -164 | -148.2 | -96.1 | 0 | 0 | 0 | 116.1 | ||||
| 52 | P | 39.3 | Very low | 32.5 | Very low | 108 Ų | 108 | 139.3 Ų | 139.3 | 70% | 0.701 | 78% | 0.78 | S | S | * | * | trans | -93.9 | 123.8 | 169.4 | 33.8 | -30 | 0 | 0 | 0 | 113.9 | Q54 | P52-Q54 PolarHBondContact O-N 3.37Š| ||
| 53 | E | 32.9 | Very low | 32.7 | Very low | 193 Ų | 193 | 139.6 Ų | 139.6 | 90% | 0.902 | 79% | 0.786 | S | S | * | * | trans | -84.9 | 109.9 | 170.7 | -95.7 | -169 | 96.8 | 0 | 0 | 113.2 | ||||
| 54 | Q | 32.9 | Very low | 32.9 | Very low | 157 Ų | 157 | 140.6 Ų | 140.6 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | 23.5 | 120 | 125.7 | -67.2 | -80 | -6 | 0 | 0 | 119.4 | P52 | P52-Q54 PolarHBondContact O-N 3.37Š| |||
| 55 | I | 34.4 | Very low | 32.7 | Very low | 179 Ų | 179 | 140.2 Ų | 140.2 | 92% | 0.918 | 78% | 0.784 | S | S | * | * | -143.8 | 131.6 | 130 | -91.9 | 128.7 | 0 | 0 | 0 | 107.5 | |||||
| 56 | G | 29.9 | Very low | 32.5 | Very low | 46 Ų | 46 | 140.9 Ų | 140.9 | 47% | 0.474 | 79% | 0.792 | S | S | . | * | trans | -93.8 | 171.2 | -167.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 57 | N | 31.3 | Very low | 32.5 | Very low | 164 Ų | 164 | 133.1 Ų | 133.1 | 88% | 0.877 | 79% | 0.788 | S | S | * | * | trans | 92.8 | 103.1 | 139 | -59 | -22.6 | 0 | 0 | 0 | 119.8 | ||||
| 58 | A | 31.8 | Very low | 32.6 | Very low | 92 Ų | 92 | 135 Ų | 135 | 76% | 0.76 | 79% | 0.793 | S | S | * | * | 65.1 | 106.4 | 110.3 | 0 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 59 | A | 29.7 | Very low | 32.4 | Very low | 91 Ų | 91 | 137.4 Ų | 137.4 | 75% | 0.752 | 80% | 0.799 | S | S | * | * | 36.1 | 118.4 | 120.8 | 0 | 0 | 0 | 0 | 0 | 120.8 | |||||
| 60 | S | 33 | Very low | 32.5 | Very low | 124 Ų | 124 | 134.4 Ų | 134.4 | 87% | 0.867 | 80% | 0.8 | S | S | * | * | 53.6 | 110.6 | 127.1 | -52 | 0 | 0 | 0 | 0 | 120 | |||||
| 61 | A | 31.8 | Very low | 32.7 | Very low | 87 Ų | 87 | 132.1 Ų | 132.1 | 72% | 0.719 | 80% | 0.799 | S | S | * | * | trans | -161.4 | 119.9 | 139.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 62 | Q | 33.3 | Very low | 33.5 | Very low | 169 Ų | 169 | 131.8 Ų | 131.8 | 79% | 0.79 | 80% | 0.804 | S | S | * | * | trans | 36.7 | 112.6 | 133.2 | -58 | -178.4 | -87.9 | 0 | 0 | 118.8 | ||||
| 63 | L | 35.9 | Very low | 33.1 | Very low | 179 Ų | 179 | 129.7 Ų | 129.7 | 94% | 0.937 | 80% | 0.802 | S | S | * | * | trans | -108.2 | 123.6 | 152.8 | -80.9 | 172.1 | 0 | 0 | 0 | 110.5 | ||||
| 64 | F | 35.5 | Very low | 33 | Very low | 192 Ų | 192 | 130.2 Ų | 130.2 | 84% | 0.842 | 80% | 0.804 | S | S | * | * | trans | -61.1 | 146.3 | 171.3 | -79.4 | -101.2 | 0 | 0 | 0 | 111.5 | ||||
| 65 | G | 28.7 | Very low | 33 | Very low | 65 Ų | 65 | 126.1 Ų | 126.1 | 67% | 0.67 | 80% | 0.804 | S | S | * | * | trans | -87.2 | 170 | 169.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 66 | S | 35 | Very low | 32.6 | Very low | 135 Ų | 135 | 125.8 Ų | 125.8 | 94% | 0.944 | 80% | 0.803 | S | S | * | * | 164.6 | 135.6 | 124.9 | -80.1 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 67 | G | 29.3 | Very low | 32.7 | Very low | 82 Ų | 82 | 131.5 Ų | 131.5 | 85% | 0.845 | 82% | 0.817 | S | S | * | * | trans | 176.6 | 80.9 | 170.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 68 | K | 36.4 | Very low | 32.5 | Very low | 198 Ų | 198 | 131.7 Ų | 131.7 | 86% | 0.861 | 81% | 0.813 | S | S | * | * | trans | -73.3 | 169.2 | 179.3 | -97.8 | 178 | 171.2 | 178.8 | 0 | 113.7 | ||||
| 69 | L | 31.9 | Very low | 32.2 | Very low | 173 Ų | 173 | 132.7 Ų | 132.7 | 91% | 0.906 | 81% | 0.809 | S | S | * | * | trans | 111.4 | 134.7 | 154.7 | -66.6 | 152.4 | 0 | 0 | 0 | 112.7 | ||||
| 70 | A | 29.5 | Very low | 32.2 | Very low | 88 Ų | 88 | 133.6 Ų | 133.6 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | cis | -164.8 | 149.3 | -8.3 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 71 | S | 33.4 | Very low | 31.8 | Very low | 119 Ų | 119 | 134.6 Ų | 134.6 | 83% | 0.832 | 80% | 0.796 | S | S | * | * | trans | -72.4 | 170 | 162.3 | -103.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 72 | P | 47.7 | Very low | 31.8 | Very low | 127 Ų | 127 | 138.1 Ų | 138.1 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | cis | -133.5 | 169 | 37.3 | 27.8 | -2.8 | 0 | 0 | 0 | 112.8 | ||||
| 73 | G | 31.5 | Very low | 31.4 | Very low | 63 Ų | 63 | 138 Ų | 138 | 65% | 0.649 | 80% | 0.795 | S | S | * | * | cis | 107.9 | 115.8 | 39.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 74 | E | 30.9 | Very low | 31.2 | Very low | 205 Ų | 205 | 140.8 Ų | 140.8 | 96% | 0.958 | 80% | 0.795 | S | S | * | * | trans | 165.7 | 133.1 | 148.7 | -93.6 | 177.5 | 152.1 | 0 | 0 | 110.3 | ||||
| 75 | G | 31.1 | Very low | 31.5 | Very low | 71 Ų | 71 | 136.7 Ų | 136.7 | 73% | 0.732 | 79% | 0.788 | S | S | * | * | trans | -99.4 | 156.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 76 | L | 27.5 | Very low | 32.2 | Very low | 171 Ų | 171 | 139.6 Ų | 139.6 | 90% | 0.895 | 80% | 0.795 | S | S | * | * | trans | -162.5 | 153.1 | 143 | -150.4 | 69.7 | 0 | 0 | 0 | 110.2 | ||||
| 77 | H | 31.2 | Very low | 32.1 | Very low | 166 Ų | 166 | 142.4 Ų | 142.4 | 77% | 0.769 | 79% | 0.792 | S | S | * | * | trans | -74 | 167.9 | -174.4 | -69.1 | -151.2 | 0 | 0 | 0 | 114.9 | ||||
| 78 | Q | 28.3 | Very low | 32.3 | Very low | 168 Ų | 168 | 149.9 Ų | 149.9 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | trans | 101.4 | 123.5 | 137.2 | -89.8 | -176.1 | 18.3 | 0 | 0 | 120.4 | ||||
| 79 | V | 25.3 | Very low | 32.5 | Very low | 114 Ų | 114 | 145.9 Ų | 145.9 | 69% | 0.691 | 79% | 0.789 | S | S | * | * | 78.7 | 121.9 | 129.4 | 174.2 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 80 | T | 28.3 | Very low | 32.4 | Very low | 109 Ų | 109 | 143.1 Ų | 143.1 | 67% | 0.669 | 79% | 0.785 | S | S | * | * | -175.9 | 151.5 | 59.3 | -30.7 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 81 | E | 25.1 | Very low | 32.8 | Very low | 145 Ų | 145 | 143.4 Ų | 143.4 | 68% | 0.678 | 78% | 0.779 | S | S | * | * | trans | 73.8 | 144.7 | 132.8 | -110.3 | -169.3 | 113.5 | 0 | 0 | 124.3 | ||||
| 82 | K | 31.2 | Very low | 32.8 | Very low | 161 Ų | 161 | 148 Ų | 148 | 70% | 0.7 | 78% | 0.78 | S | S | * | * | trans | 93.1 | 102.4 | 151 | -69.9 | 165.9 | -169.7 | -176.4 | 0 | 116.7 | ||||
| 83 | Q | 26.1 | Very low | 32.2 | Very low | 167 Ų | 167 | 147.3 Ų | 147.3 | 78% | 0.78 | 78% | 0.775 | S | S | * | * | 98.4 | 102.4 | 76.2 | -164.6 | 96.8 | 6.8 | 0 | 0 | 108.4 | P85 | Q83-P85 WeakPolarHBondContact O-CD 3.47Š| |||
| 84 | Y | 31 | Very low | 32.2 | Very low | 237 Ų | 237 | 150.5 Ų | 150.5 | 93% | 0.929 | 79% | 0.786 | S | S | * | * | trans | -84.2 | 134.7 | 168.8 | -95.9 | -91.5 | 0 | 0 | 0 | 110.8 | ||||
| 85 | P | 42.2 | Very low | 32.2 | Very low | 107 Ų | 107 | 148.7 Ų | 148.7 | 70% | 0.695 | 78% | 0.777 | S | S | * | * | trans | -133.7 | 172.4 | 150.8 | 40.7 | -25.3 | 0 | 0 | 0 | 110.9 | Q83 | Q83-P85 WeakPolarHBondContact O-CD 3.47Š| ||
| 86 | P | 43.1 | Very low | 32.5 | Very low | 126 Ų | 126 | 154.1 Ų | 154.1 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | -107.4 | 164.6 | -116.5 | 16.7 | 6.3 | 0 | 0 | 0 | 114.7 | |||||
| 87 | H | 32.8 | Very low | 32.8 | Very low | 194 Ų | 194 | 150.5 Ų | 150.5 | 90% | 0.898 | 77% | 0.772 | S | S | * | * | trans | -64.5 | 128.4 | 170.1 | -83 | -95.1 | 0 | 0 | 0 | 112.4 | ||||
| 88 | R | 33.3 | Very low | 33 | Very low | 239 Ų | 239 | 151.1 Ų | 151.1 | 90% | 0.902 | 78% | 0.78 | S | S | * | * | trans | -121.1 | 158.3 | 158 | -110.7 | -146.7 | 173.3 | 162.8 | -0.9 | 109.5 | ||||
| 89 | P | 40.3 | Very low | 33.2 | Very low | 113 Ų | 113 | 148.2 Ų | 148.2 | 73% | 0.734 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -96.1 | 148.9 | -140.7 | 3.1 | 18.2 | 0 | 0 | 0 | 113.5 | ||
| 90 | S | 30.8 | Very low | 33.6 | Very low | 116 Ų | 116 | 151.9 Ų | 151.9 | 81% | 0.811 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 136.7 | 168.4 | -176.7 | 0 | 0 | 0 | 0 | 111 | ||
| 91 | P | 37.9 | Very low | 34.2 | Very low | 94 Ų | 94 | 152 Ų | 152 | 61% | 0.61 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -79 | 152.7 | 171.9 | 32.3 | -30.2 | 0 | 0 | 0 | 110.9 | ||
| 92 | Y | 34.3 | Very low | 34.6 | Very low | 215 Ų | 215 | 153.8 Ų | 153.8 | 84% | 0.843 | 80% | 0.797 | S | S | * | * | trans | 92.8 | 96.6 | 175 | -59.4 | -78.5 | 0 | 0 | 0 | 117.9 | ||||
| 93 | P | 34.5 | Very low | 34.8 | Very low | 112 Ų | 112 | 154.9 Ų | 154.9 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | trans | -82.1 | 125.7 | 161.2 | 30.7 | -29.2 | 0 | 0 | 0 | 111.5 | Q95 | P93-Q95 PolarHBondContact O-N 3.15Š| ||
| 94 | C | 31.7 | Very low | 35.1 | Very low | 130 Ų | 130 | 152.2 Ų | 152.2 | 88% | 0.878 | 80% | 0.804 | S | S | * | * | trans | -72.3 | 113.4 | 170.4 | -68.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 95 | Q | 30.8 | Very low | 35.3 | Very low | 167 Ų | 167 | 148.9 Ų | 148.9 | 78% | 0.78 | 80% | 0.801 | S | S | * | * | trans | -82.2 | 113.7 | 169.6 | -71.9 | -73.7 | -44 | 0 | 0 | 109.4 | P93 | P93-Q95 PolarHBondContact O-N 3.15Š| ||
| 96 | H | 37.2 | Very low | 34.8 | Very low | 185 Ų | 185 | 149.4 Ų | 149.4 | 86% | 0.856 | 81% | 0.807 | S | S | * | * | trans | -131 | 91.8 | 165.9 | -141.3 | -104.5 | 0 | 0 | 0 | 108 | ||||
| 97 | S | 32.8 | Very low | 34.5 | Very low | 95 Ų | 95 | 152.4 Ų | 152.4 | 66% | 0.664 | 81% | 0.81 | S | S | * | * | trans | -160.1 | 80.4 | 174.2 | -67.6 | 0 | 0 | 0 | 0 | 110.3 | S99 | S97-S99 PolarHBondContact O-N 2.95Š| ||
| 98 | L | 36.9 | Very low | 34.4 | Very low | 179 Ų | 179 | 147 Ų | 147 | 94% | 0.937 | 81% | 0.807 | S | S | * | * | trans | -80.1 | 94 | 162.4 | -71.4 | 175.4 | 0 | 0 | 0 | 108.1 | ||||
| 99 | S | 31.6 | Very low | 34.7 | Very low | 107 Ų | 107 | 143.7 Ų | 143.7 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -82 | 129.4 | 172.2 | -59.9 | 0 | 0 | 0 | 0 | 109.7 | S97 | S97-S99 PolarHBondContact O-N 2.95Š|
| 100 | F | 34.3 | Very low | 34.3 | Very low | 192 Ų | 192 | 144.9 Ų | 144.9 | 84% | 0.842 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 141.6 | 168.9 | -80.1 | -89.6 | 0 | 0 | 0 | 110.5 | Q102 | F100-Q102 PolarHBondContact O-N 2.89Š|
| 101 | P | 39.4 | Very low | 34.5 | Very low | 110 Ų | 110 | 147.5 Ų | 147.5 | 71% | 0.714 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 123.3 | 179.7 | -19.5 | 32.3 | 0 | 0 | 0 | 113 | ||
| 102 | Q | 33.6 | Very low | 33.9 | Very low | 184 Ų | 184 | 148.7 Ų | 148.7 | 86% | 0.86 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 117.2 | 165.5 | -70 | -82.2 | -36 | 0 | 0 | 108.6 | F100 | F100-Q102 PolarHBondContact O-N 2.89Š|
| 103 | H | 36.2 | Very low | 33.7 | Very low | 183 Ų | 183 | 147 Ų | 147 | 85% | 0.847 | 82% | 0.818 | S | S | * | * | trans | -92.2 | 104.1 | 163.7 | -85 | -87.1 | 0 | 0 | 0 | 109.1 | ||||
| 104 | S | 33.3 | Very low | 33.6 | Very low | 112 Ų | 112 | 150.9 Ų | 150.9 | 78% | 0.783 | 82% | 0.824 | S | S | * | * | trans | -69.9 | 134.8 | 169.2 | 42 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 105 | L | 35.3 | Very low | 34 | Very low | 166 Ų | 166 | 150.3 Ų | 150.3 | 87% | 0.869 | 82% | 0.819 | S | S | * | * | trans | -54 | 143.6 | 164.3 | -83 | 134.3 | 0 | 0 | 0 | 112.3 | ||||
| 106 | S | 30.8 | Very low | 34.3 | Very low | 118 Ų | 118 | 150.8 Ų | 150.8 | 83% | 0.825 | 82% | 0.82 | S | S | * | * | trans | -127.8 | 116.5 | 153.1 | 59.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 107 | Q | 37.5 | Very low | 34 | Very low | 190 Ų | 190 | 151.3 Ų | 151.3 | 89% | 0.888 | 82% | 0.823 | S | S | * | * | trans | -75.5 | 142.2 | 167.6 | -73.4 | 178.6 | -12.5 | 0 | 0 | 110.2 | ||||
| 108 | G | 29.8 | Very low | 33.9 | Very low | 81 Ų | 81 | 150.9 Ų | 150.9 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | trans | -170.9 | 102 | 170.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 109 | M | 39 | Very low | 33.9 | Very low | 168 Ų | 168 | 150.8 Ų | 150.8 | 83% | 0.828 | 82% | 0.82 | S | S | * | * | trans | -82.4 | 130.8 | -177.4 | -176.5 | 84.5 | 162.4 | 0 | 0 | 111.2 | ||||
| 110 | T | 31.8 | Very low | 34.1 | Very low | 139 Ų | 139 | 154.6 Ų | 154.6 | 85% | 0.853 | 83% | 0.826 | S | S | * | * | trans | -159.4 | 128.4 | 141.6 | 47.3 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 111 | H | 35 | Very low | 34.1 | Very low | 171 Ų | 171 | 148.6 Ų | 148.6 | 79% | 0.792 | 82% | 0.818 | S | S | * | * | trans | -56.2 | 142.7 | 166.6 | -117.6 | -112.8 | 0 | 0 | 0 | 112.4 | ||||
| 112 | S | 25.5 | Very low | 34.2 | Very low | 118 Ų | 118 | 149.2 Ų | 149.2 | 83% | 0.825 | 82% | 0.822 | S | S | * | * | -175.7 | 162.4 | 128.3 | -148.1 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 113 | H | 31.7 | Very low | 34.6 | Very low | 179 Ų | 179 | 145.6 Ų | 145.6 | 83% | 0.829 | 82% | 0.815 | S | S | * | * | trans | -56.8 | 156.8 | -166 | -91 | -131 | 0 | 0 | 0 | 119.9 | ||||
| 114 | K | 31.8 | Very low | 34.3 | Very low | 195 Ų | 195 | 149.1 Ų | 149.1 | 85% | 0.848 | 82% | 0.821 | S | S | * | * | trans | -47.9 | 173.2 | 160.2 | -66.2 | 177.3 | 175.7 | 177.9 | 0 | 113.7 | ||||
| 115 | P | 40.9 | Very low | 34.6 | Very low | 118 Ų | 118 | 150.8 Ų | 150.8 | 77% | 0.766 | 82% | 0.82 | S | S | * | * | cis | -143.8 | 170.7 | 16 | 33.8 | -9.4 | 0 | 0 | 0 | 119 | ||||
| 116 | H | 37.1 | Very low | 34.5 | Very low | 176 Ų | 176 | 152.5 Ų | 152.5 | 82% | 0.815 | 82% | 0.821 | S | S | * | * | trans | 15.6 | 127.2 | 149 | -138.5 | -104.3 | 0 | 0 | 0 | 121 | ||||
| 117 | Q | 29.6 | Very low | 35.1 | Very low | 196 Ų | 196 | 152.5 Ų | 152.5 | 92% | 0.916 | 82% | 0.818 | S | S | * | * | trans | -154.8 | 134.2 | 140.5 | -87.8 | -124.9 | 85.7 | 0 | 0 | 111.7 | ||||
| 118 | S | 31.3 | Very low | 35.1 | Very low | 87 Ų | 87 | 147 Ų | 147 | 61% | 0.608 | 81% | 0.812 | S | S | * | * | trans | -81.4 | 145.2 | -179.4 | -178 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 119 | L | 36.1 | Very low | 36 | Very low | 176 Ų | 176 | 148.6 Ų | 148.6 | 92% | 0.921 | 81% | 0.808 | S | S | * | * | trans | -136.7 | 113.5 | 161 | -93.9 | 166.3 | 0 | 0 | 0 | 109.1 | ||||
| 120 | E | 35.4 | Very low | 35.8 | Very low | 187 Ų | 187 | 148.7 Ų | 148.7 | 87% | 0.874 | 81% | 0.81 | S | S | * | * | trans | -63 | 150.3 | 173.8 | -74.9 | 164.8 | 90.1 | 0 | 0 | 112.5 | ||||
| 121 | G | 34.8 | Very low | 36.2 | Very low | 67 Ų | 67 | 147.7 Ų | 147.7 | 69% | 0.691 | 81% | 0.807 | S | S | * | * | trans | -121.1 | 152.9 | 159.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 122 | P | 42 | Very low | 36.7 | Very low | 123 Ų | 123 | 145.2 Ų | 145.2 | 80% | 0.799 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -90 | 169.4 | -157.8 | -3.6 | 24.2 | 0 | 0 | 0 | 115.6 | ||
| 123 | P | 41 | Very low | 37.1 | Very low | 107 Ų | 107 | 146 Ų | 146 | 70% | 0.695 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -99.8 | 151.4 | -156 | 38.3 | -32.4 | 0 | 0 | 0 | 113.6 | ||
| 124 | W | 31.3 | Very low | 37.5 | Very low | 258 Ų | 258 | 141.6 Ų | 141.6 | 98% | 0.977 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -98.8 | 116.2 | 164.9 | -69.4 | 95.9 | 0 | 0 | 0 | 109.7 | ||
| 125 | L | 38 | Very low | 37.7 | Very low | 146 Ų | 146 | 137.8 Ų | 137.8 | 76% | 0.764 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -103 | 137.4 | 172.7 | -75.6 | 165.2 | 0 | 0 | 0 | 109.4 | ||
| 126 | F | 34.5 | Very low | 38.1 | Very low | 203 Ų | 203 | 141.4 Ų | 141.4 | 89% | 0.89 | 81% | 0.807 | S | S | * | * | trans | -165.2 | 161.9 | 150.1 | -102.3 | -58.2 | 0 | 0 | 0 | 110 | ||||
| 127 | P | 43.4 | Very low | 38.2 | Very low | 118 Ų | 118 | 139.8 Ų | 139.8 | 77% | 0.766 | 81% | 0.805 | S | S | * | * | -108.7 | 167.5 | -111.5 | 39.5 | -28.2 | 0 | 0 | 0 | 115.6 | |||||
| 128 | G | 36.7 | Very low | 38.6 | Very low | 73 Ų | 73 | 137.8 Ų | 137.8 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | trans | -80.1 | -159.9 | -176.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 129 | P | 48.6 | Very low | 38.8 | Very low | 116 Ų | 116 | 141.1 Ų | 141.1 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | cis | -133.5 | 149.6 | 0 | 38.7 | -19.6 | 0 | 0 | 0 | 118.1 | ||||
| 130 | L | 35.8 | Very low | 38.8 | Very low | 169 Ų | 169 | 138.5 Ų | 138.5 | 89% | 0.885 | 80% | 0.797 | S | S | * | * | trans | 66.8 | 157.7 | 154.1 | -60.3 | 175.2 | 0 | 0 | 0 | 121.1 | ||||
| 131 | P | 40.5 | Very low | 39.1 | Very low | 119 Ų | 119 | 138.5 Ų | 138.5 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | cis | -125.7 | 170.5 | -4.6 | 36.7 | -18.2 | 0 | 0 | 0 | 115.7 | ||||
| 132 | S | 45.5 | Very low | 39.4 | Very low | 118 Ų | 118 | 141 Ų | 141 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | trans | -52.3 | 123.4 | 174.6 | 171.3 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 133 | V | 32.6 | Very low | 39.5 | Very low | 134 Ų | 134 | 143.4 Ų | 143.4 | 81% | 0.812 | 80% | 0.801 | S | S | * | * | trans | -139.4 | 120.5 | 151.4 | 154 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 134 | A | 41.1 | Very low | 39.3 | Very low | 88 Ų | 88 | 147.4 Ų | 147.4 | 73% | 0.727 | 81% | 0.81 | S | S | * | * | trans | -67.2 | 135.6 | 169.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 135 | S | 35.9 | Very low | 39.3 | Very low | 115 Ų | 115 | 138.4 Ų | 138.4 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | -166.1 | 122.9 | 149.3 | -78.6 | 0 | 0 | 0 | 0 | 109 | ||||
| 136 | E | 48.1 | Very low | 40.1 | Very low | 194 Ų | 194 | 140.9 Ų | 140.9 | 91% | 0.907 | 80% | 0.804 | S | S | * | * | trans | -59.7 | 122.6 | 167.4 | -57.9 | 174.6 | 98.1 | 0 | 0 | 109.4 | ||||
| 137 | D | 40.6 | Very low | 40.5 | Very low | 141 Ų | 141 | 137 Ų | 137 | 75% | 0.754 | 80% | 0.802 | S | S | * | * | trans | -176.1 | 157.3 | 140.6 | -119.4 | -44.4 | 0 | 0 | 0 | 111.4 | ||||
| 138 | L | 36.9 | Very low | 40 | Very low | 154 Ų | 154 | 134.3 Ų | 134.3 | 81% | 0.806 | 80% | 0.796 | S | S | * | * | trans | 104 | 74.4 | 172.6 | -53.8 | 169.5 | 0 | 0 | 0 | 117.4 | ||||
| 139 | F | 34.7 | Very low | 40.5 | Very low | 158 Ų | 158 | 134.7 Ų | 134.7 | 69% | 0.693 | 80% | 0.8 | S | S | * | * | trans | 26.2 | 120.4 | 133.3 | -65 | -85.7 | 0 | 0 | 0 | 120.5 | ||||
| 140 | P | 37.8 | Very low | 39.8 | Very low | 120 Ų | 120 | 139.4 Ų | 139.4 | 78% | 0.779 | 80% | 0.804 | S | S | * | * | trans | -94.5 | 126.7 | 141.4 | 23.2 | -8.4 | 0 | 0 | 0 | 109.9 | P142 | P140-P142 VanDerWaalsContact O-CD 3.31Å; P140-P142 WeakPolarHBondContact O-CD 3.47Å | ||
| 141 | F | 41.5 | Very low | 40.2 | Very low | 187 Ų | 187 | 137 Ų | 137 | 82% | 0.82 | 80% | 0.798 | S | S | * | * | trans | -81.2 | 128.2 | 165.2 | -73.7 | -86.5 | 0 | 0 | 0 | 110 | ||||
| 142 | P | 40 | Very low | 40.6 | Very low | 121 Ų | 121 | 140.8 Ų | 140.8 | 79% | 0.786 | 80% | 0.797 | S | S | * | * | trans | -113.4 | 122.4 | 146 | -6.2 | 26.3 | 0 | 0 | 0 | 111.5 | P140 | P140-P142 VanDerWaalsContact O-CD 3.31Å; P140-P142 WeakPolarHBondContact O-CD 3.47Å | ||
| 143 | M | 44.5 | Very low | 40.9 | Very low | 172 Ų | 172 | 143.9 Ų | 143.9 | 85% | 0.847 | 80% | 0.796 | S | S | * | * | trans | -68.7 | 126.2 | 162.4 | -70.8 | -80.1 | -83.7 | 0 | 0 | 109.4 | ||||
| 144 | H | 37.7 | Very low | 41.8 | Very low | 192 Ų | 192 | 146.9 Ų | 146.9 | 89% | 0.889 | 80% | 0.798 | S | S | * | * | trans | -159.8 | 132.7 | 154.3 | -113.4 | 78 | 0 | 0 | 0 | 112.6 | ||||
| 145 | G | 31.4 | Very low | 42.1 | Very low | 68 Ų | 68 | 149.1 Ų | 149.1 | 70% | 0.701 | 80% | 0.796 | S | S | * | * | trans | 82.4 | 99.3 | 134.1 | 0 | 0 | 0 | 0 | 0 | 117.9 | S147 | G145-S147 PolarHBondContact O-N 3.46Å; G145-S147 VanDerWaalsContact O-N 3.08Å | ||
| 146 | H | 53.3 | Low | 42.9 | Very low | 199 Ų | 199 | 148.6 Ų | 148.6 | 92% | 0.921 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -59.2 | 103.7 | 156.7 | -70.9 | -85.6 | 0 | 0 | 0 | 110.9 | ||
| 147 | S | 43.3 | Very low | 43.2 | Very low | 121 Ų | 121 | 146.9 Ų | 146.9 | 85% | 0.846 | 79% | 0.79 | S | S | * | * | trans | 165.2 | 106.5 | 142.2 | 56 | 0 | 0 | 0 | 0 | 109.3 | G145 | G145-S147 PolarHBondContact O-N 3.46Å; G145-S147 VanDerWaalsContact O-N 3.08Å | ||
| 148 | G | 33.9 | Very low | 44.2 | Very low | 62 Ų | 62 | 145.3 Ų | 145.3 | 64% | 0.639 | 78% | 0.781 | S | S | * | * | trans | 172.8 | 103.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | Y150 | G148-Y150 PolarHBondContact O-N 3.19Š| ||
| 149 | G | 45.8 | Very low | 45.2 | Very low | 80 Ų | 80 | 143.3 Ų | 143.3 | 83% | 0.825 | 77% | 0.771 | S | S | * | * | trans | -59.5 | 122.3 | 168.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 150 | Y | 34.9 | Very low | 46.6 | Very low | 216 Ų | 216 | 140.1 Ų | 140.1 | 85% | 0.847 | 77% | 0.766 | S | S | * | * | trans | -67.5 | 128.9 | 174.1 | -57.8 | -82.4 | 0 | 0 | 0 | 109.2 | G148 R152 | G148-Y150 PolarHBondContact O-N 3.19Å; Y150-R152 PolarHBondContact O-N 3.39Å | ||
| 151 | P | 43.8 | Very low | 47.7 | Very low | 117 Ų | 117 | 137.5 Ų | 137.5 | 76% | 0.76 | 76% | 0.755 | S | S | * | * | trans | -67.2 | 110.4 | 162.4 | 27.5 | -29.7 | 0 | 0 | 0 | 107 | K153 | P151-K153 VanDerWaalsContact C-N 3.3Å; P151-K153 PolarHBondContact O-N 3.26Å | ||
| 152 | R | 49.9 | Very low | 48.5 | Very low | 200 Ų | 200 | 135.6 Ų | 135.6 | 76% | 0.755 | 74% | 0.743 | S | S | * | * | trans | -63.5 | 93.6 | 174.8 | -164 | 178.5 | -168.7 | 169.2 | 3.2 | 107.6 | Y150 K154 | Y150-R152 PolarHBondContact O-N 3.39Å; R152-K154 PolarHBondContact O-N 3.26Å | ||
| 153 | K | 50.6 | Low | 49.6 | Very low | 183 Ų | 183 | 132.5 Ų | 132.5 | 80% | 0.796 | 72% | 0.724 | S | S | * | * | trans | -51.7 | 116.7 | 168.5 | -68.7 | 175.2 | -179.4 | 176.9 | 0 | 106.6 | P151 I155 | P151-K153 VanDerWaalsContact C-N 3.3Å; P151-K153 PolarHBondContact O-N 3.26Å; K153-I155 PolarHBondContact O-N 3.39Å | ||
| 154 | K | 51.2 | Low | 50.6 | Low | 197 Ų | 197 | 130 Ų | 130 | 86% | 0.857 | 71% | 0.711 | S | S | * | * | trans | -61.5 | 105.7 | 176.7 | -75.1 | -177.8 | 178.6 | 179.8 | 0 | 107.5 | R152 S156 | R152-K154 PolarHBondContact O-N 3.26Å; K154-S156 PolarHBondContact O-N 3.26Å; K154-S156 VanDerWaalsContact O-N 3.17Å; K154-S156 PolarHBondContact O-OG 3.41Å | ||
| 155 | I | 48.4 | Very low | 51.7 | Low | 134 Ų | 134 | 129.6 Ų | 129.6 | 69% | 0.687 | 70% | 0.702 | S | S | * | * | trans | -76.1 | 98 | 165.3 | -62.6 | 143.9 | 0 | 0 | 0 | 105 | K153 N157 | K153-I155 PolarHBondContact O-N 3.39Å; I155-N157 PolarHBondContact O-N 2.83Å | ||
| 156 | S | 52.1 | Low | 53.1 | Low | 105 Ų | 105 | 127.9 Ų | 127.9 | 73% | 0.734 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -72.9 | 27.2 | -171.6 | -44.3 | 0 | 0 | 0 | 0 | 114.7 | K154 | K154-S156 PolarHBondContact O-N 3.26Å; K154-S156 VanDerWaalsContact O-N 3.17Å; K154-S156 PolarHBondContact O-OG 3.41Å |
| 157 | N | 54.1 | Low | 53.5 | Low | 158 Ų | 158 | 123.5 Ų | 123.5 | 85% | 0.845 | 66% | 0.66 | S | S | * | * | trans | -148.1 | 50.9 | -178.6 | -94.1 | -34.1 | 0 | 0 | 0 | 112.7 | I155 | I155-N157 PolarHBondContact O-N 2.83Š| ||
| 158 | L | 62.9 | Low | 54.6 | Low | 107 Ų | 107 | 124.4 Ų | 124.4 | 56% | 0.56 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -103.3 | 135.8 | 161.6 | -77.5 | 163.2 | 0 | 0 | 0 | 109.2 | Y162 | L158-Y162 HydrophobicContact CD1-CD1 4.35Å; L158-Y162 HydrophobicContact CD2-CD1 4.48Å |
| 159 | N | 57.4 | Low | 55.8 | Low | 112 Ų | 112 | 124.8 Ų | 124.8 | 60% | 0.599 | 64% | 0.642 | S | S | * | * | trans | -45.7 | 128.5 | 178.2 | -177 | -26.3 | 0 | 0 | 0 | 110.5 | A161 Y162 | N159-A161 PolarHBondContact O-N 3.37Å; N159-A161 PolarHBondContact OD1-N 3.41Å; N159-Y162 WeakPolarHBondContact O-CB 3.15Å; N159-Y162 PolarHBondContact O-N 3.35Å | ||
| 160 | P | 64.5 | Low | 56.6 | Low | 92 Ų | 92 | 125.2 Ų | 125.2 | 60% | 0.597 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -54.6 | -24.5 | -174.6 | 17.3 | -30.6 | 0 | 0 | 0 | 114.3 | Q164 | P160-Q164 WeakPolarHBondContact O-CG 3.28Å; P160-Q164 PolarHBondContact O-N 3.48Å |
| 161 | A | 59.8 | Low | 57.8 | Low | 65 Ų | 65 | 120 Ų | 120 | 54% | 0.537 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -66.3 | -35.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | N159 Y165 | N159-A161 PolarHBondContact O-N 3.37Å; N159-A161 PolarHBondContact OD1-N 3.41Å; A161-Y165 PolarHBondContact O-N 3.25Å |
| 162 | Y | 59.3 | Low | 58.5 | Low | 147 Ų | 147 | 121.6 Ų | 121.6 | 58% | 0.576 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -75.1 | -34.2 | 179.8 | -170.5 | -99.4 | 0 | 0 | 0 | 112 | L158 N159 Y165 S166 | L158-Y162 HydrophobicContact CD1-CD1 4.35Å; L158-Y162 HydrophobicContact CD2-CD1 4.48Å; N159-Y162 WeakPolarHBondContact O-CB 3.15Å; N159-Y162 PolarHBondContact O-N 3.35Å; Y162-Y165 PolarHBondContact O-N 3.45Å; Y162-S166 VanDerWaalsContact O-CB 3.32Å; Y162-S166 WeakPolarHBondContact O-CB 3.06Å; Y162-S166 PolarHBondContact O-N 2.67Å |
| 163 | S | 62.5 | Low | 58.9 | Low | 56 Ų | 56 | 114.9 Ų | 114.9 | 39% | 0.392 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -65.9 | -39.8 | 175.9 | -168.8 | 0 | 0 | 0 | 0 | 112 | S166 Q167 | S163-S166 PolarHBondContact O-N 3.12Å; S163-Q167 WeakPolarHBondContact O-CB 3.5Å; S163-Q167 WeakPolarHBondContact O-CG 3.49Å; S163-Q167 PolarHBondContact O-N 3.4Å |
| 164 | Q | 65.1 | Low | 59.4 | Low | 120 Ų | 120 | 111.7 Ų | 111.7 | 56% | 0.561 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -68.7 | -36.7 | 179 | -70.2 | 179.9 | 18.2 | 0 | 0 | 112.7 | P160 K168 | P160-Q164 WeakPolarHBondContact O-CG 3.28Å; P160-Q164 PolarHBondContact O-N 3.48Å; Q164-K168 WeakPolarHBondContact O-CG 3.37Å; Q164-K168 PolarHBondContact O-N 3.4Å; Q164-K168 VanDerWaalsContact O-N 3.16Å |
| 165 | Y | 61.7 | Low | 59.7 | Low | 182 Ų | 182 | 106.1 Ų | 106.1 | 71% | 0.714 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -69.1 | -42.3 | 175.5 | -168.1 | -96.8 | 0 | 0 | 0 | 111.8 | A161 Y162 S169 | A161-Y165 PolarHBondContact O-N 3.25Å; Y162-Y165 PolarHBondContact O-N 3.45Å; Y165-S169 WeakPolarHBondContact O-CB 3.38Å; Y165-S169 PolarHBondContact O-N 2.75Å |
| 166 | S | 60.5 | Low | 60.1 | Low | 33 Ų | 33 | 102.1 Ų | 102.1 | 23% | 0.231 | 55% | 0.546 | C | S | . | . | H | α-helix | trans | -63.5 | -42 | 175.9 | 177.8 | 0 | 0 | 0 | 0 | 112.4 | Y162 S163 S169 I170 | Y162-S166 VanDerWaalsContact O-CB 3.32Å; Y162-S166 WeakPolarHBondContact O-CB 3.06Å; Y162-S166 PolarHBondContact O-N 2.67Å; S163-S166 PolarHBondContact O-N 3.12Å; S166-S169 PolarHBondContact O-N 3.36Å; S166-I170 WeakPolarHBondContact O-CD1 3.24Å; S166-I170 VanDerWaalsContact O-CG1 3.28Å; S166-I170 WeakPolarHBondContact O-CG1 3.39Å; S166-I170 PolarHBondContact O-N 3.05Å; S166-I170 VanDerWaalsContact O-N 3.11Å |
| 167 | Q | 62.7 | Low | 60.3 | Low | 106 Ų | 106 | 103.1 Ų | 103.1 | 50% | 0.495 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.5 | -45.9 | 177.2 | -79.5 | 176.7 | -55.2 | 0 | 0 | 112.4 | S163 S169 I170 E171 | S163-Q167 WeakPolarHBondContact O-CB 3.5Å; S163-Q167 WeakPolarHBondContact O-CG 3.49Å; S163-Q167 PolarHBondContact O-N 3.4Å; Q167-S169 VanDerWaalsContact C-N 3.29Å; Q167-S169 PolarHBondContact O-N 3.49Å; Q167-I170 PolarHBondContact O-N 2.71Å; Q167-I170 VanDerWaalsContact O-N 3.08Å; Q167-E171 WeakPolarHBondContact O-CG 3.48Å; Q167-E171 PolarHBondContact O-N 3.01Å |
| 168 | K | 64.9 | Low | 60.3 | Low | 140 Ų | 140 | 104 Ų | 104 | 61% | 0.609 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.8 | -36.1 | 175.9 | -75.4 | 176 | 178.2 | 178.1 | 0 | 112.9 | Q164 I170 E171 Q172 | Q164-K168 WeakPolarHBondContact O-CG 3.37Å; Q164-K168 PolarHBondContact O-N 3.4Å; Q164-K168 VanDerWaalsContact O-N 3.16Å; K168-I170 VanDerWaalsContact C-N 3.31Å; K168-I170 PolarHBondContact O-N 2.81Å; K168-E171 PolarHBondContact O-N 3.05Å; K168-Q172 WeakPolarHBondContact O-CB 3.45Å; K168-Q172 PolarHBondContact O-N 3.47Å |
| 169 | S | 59.9 | Low | 60 | Low | 71 Ų | 71 | 106.1 Ų | 106.1 | 50% | 0.497 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -67.4 | -30.9 | 175.2 | -176.2 | 0 | 0 | 0 | 0 | 112.8 | Y165 S166 Q167 A173 | Y165-S169 WeakPolarHBondContact O-CB 3.38Å; Y165-S169 PolarHBondContact O-N 2.75Å; S166-S169 PolarHBondContact O-N 3.36Å; Q167-S169 VanDerWaalsContact C-N 3.29Å; Q167-S169 PolarHBondContact O-N 3.49Å; S169-A173 VanDerWaalsContact O-CB 3.31Å; S169-A173 WeakPolarHBondContact O-CB 3.2Å; S169-A173 PolarHBondContact O-N 2.81Å |
| 170 | I | 61.6 | Low | 59.9 | Low | 88 Ų | 88 | 108.6 Ų | 108.6 | 45% | 0.451 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -76.4 | -40.7 | 175.2 | -66.9 | 164.3 | 0 | 0 | 0 | 110 | S166 Q167 K168 Q172 A173 E174 | S166-I170 WeakPolarHBondContact O-CD1 3.24Å; S166-I170 VanDerWaalsContact O-CG1 3.28Å; S166-I170 WeakPolarHBondContact O-CG1 3.39Å; S166-I170 PolarHBondContact O-N 3.05Å; S166-I170 VanDerWaalsContact O-N 3.11Å; Q167-I170 PolarHBondContact O-N 2.71Å; Q167-I170 VanDerWaalsContact O-N 3.08Å; K168-I170 VanDerWaalsContact C-N 3.31Å; K168-I170 PolarHBondContact O-N 2.81Å; I170-Q172 VanDerWaalsContact C-N 3.34Å; I170-Q172 PolarHBondContact O-N 3.05Å; I170-A173 PolarHBondContact O-N 3.29Å; I170-E174 WeakPolarHBondContact O-CG 3.08Å; I170-E174 PolarHBondContact O-N 3.02Å |
| 171 | E | 60.1 | Low | 59.1 | Low | 107 Ų | 107 | 111.1 Ų | 111.1 | 50% | 0.5 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.9 | -36.9 | 176.6 | -71.4 | 171.7 | 171.2 | 0 | 0 | 112.5 | Q167 K168 E174 D175 | Q167-E171 WeakPolarHBondContact O-CG 3.48Å; Q167-E171 PolarHBondContact O-N 3.01Å; K168-E171 PolarHBondContact O-N 3.05Å; E171-E174 VanDerWaalsContact CA-OE1 3.31Å; E171-E174 WeakPolarHBondContact CA-OE1 3.36Å; E171-E174 WeakPolarHBondContact CG-OE1 3.14Å; E171-E174 WeakPolarHBondContact O-CG 3.45Å; E171-D175 PolarHBondContact O-N 3.16Å |
| 172 | Q | 58.4 | Low | 59.1 | Low | 151 Ų | 151 | 116.5 Ų | 116.5 | 71% | 0.706 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -73.3 | -32.2 | 174.1 | -165.4 | 171.4 | -3.8 | 0 | 0 | 112.3 | K168 I170 A176 | K168-Q172 WeakPolarHBondContact O-CB 3.45Å; K168-Q172 PolarHBondContact O-N 3.47Å; I170-Q172 VanDerWaalsContact C-N 3.34Å; I170-Q172 PolarHBondContact O-N 3.05Å; Q172-A176 WeakPolarHBondContact O-CB 3.43Å; Q172-A176 PolarHBondContact O-N 3.14Å |
| 173 | A | 60 | Low | 58.7 | Low | 58 Ų | 58 | 115.1 Ų | 115.1 | 48% | 0.479 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -74.9 | -32.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | S169 I170 H177 | S169-A173 VanDerWaalsContact O-CB 3.31Å; S169-A173 WeakPolarHBondContact O-CB 3.2Å; S169-A173 PolarHBondContact O-N 2.81Å; I170-A173 PolarHBondContact O-N 3.29Å; A173-H177 VanDerWaalsContact O-CB 3.27Å; A173-H177 WeakPolarHBondContact O-CB 3.37Å; A173-H177 PolarHBondContact O-N 3.37Å |
| 174 | E | 60.2 | Low | 58.4 | Low | 117 Ų | 117 | 122.2 Ų | 122.2 | 55% | 0.547 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -74.8 | -34.1 | 175.4 | 67.7 | -177.9 | 158.1 | 0 | 0 | 112.7 | I170 E171 A176 H177 K178 | I170-E174 WeakPolarHBondContact O-CG 3.08Å; I170-E174 PolarHBondContact O-N 3.02Å; E171-E174 VanDerWaalsContact CA-OE1 3.31Å; E171-E174 WeakPolarHBondContact CA-OE1 3.36Å; E171-E174 WeakPolarHBondContact CG-OE1 3.14Å; E171-E174 WeakPolarHBondContact O-CG 3.45Å; E174-A176 VanDerWaalsContact C-N 3.33Å; E174-H177 PolarHBondContact O-N 2.81Å; E174-K178 VanDerWaalsContact O-CB 3.23Å; E174-K178 WeakPolarHBondContact O-CB 3.45Å; E174-K178 PolarHBondContact O-N 3.19Å |
| 175 | D | 57.9 | Low | 58.1 | Low | 79 Ų | 79 | 125 Ų | 125 | 42% | 0.422 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -66.2 | -37.8 | 171.5 | -171.5 | -105.2 | 0 | 0 | 0 | 111.3 | E171 K178 K179 | E171-D175 PolarHBondContact O-N 3.16Å; D175-K178 PolarHBondContact O-N 2.77Å; D175-K179 WeakPolarHBondContact O-CB 3.19Å; D175-K179 WeakPolarHBondContact O-CG 3.45Å; D175-K179 PolarHBondContact O-N 3.24Å; D175-K179 VanDerWaalsContact OD1-CE 3.31Å; D175-K179 WeakPolarHBondContact OD1-CE 3.39Å; D175-K179 IonicContact OD1-NZ 3.89Å; D175-K179 PolarHBondContact OD1-NZ 2.88Å |
| 176 | A | 57.3 | Low | 57.9 | Low | 51 Ų | 51 | 122 Ų | 122 | 42% | 0.421 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -64.3 | -44.4 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q172 E174 K178 K179 E180 | Q172-A176 WeakPolarHBondContact O-CB 3.43Å; Q172-A176 PolarHBondContact O-N 3.14Å; E174-A176 VanDerWaalsContact C-N 3.33Å; A176-K178 VanDerWaalsContact C-N 3.32Å; A176-K178 PolarHBondContact O-N 3.37Å; A176-K179 PolarHBondContact O-N 3.27Å; A176-E180 PolarHBondContact O-N 3.38Å |
| 177 | H | 55.8 | Low | 58 | Low | 126 Ų | 126 | 121.5 Ų | 121.5 | 58% | 0.583 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -66.4 | -32.7 | 178 | -170.7 | -90.9 | 0 | 0 | 0 | 112.6 | A173 E174 E180 H181 | A173-H177 VanDerWaalsContact O-CB 3.27Å; A173-H177 WeakPolarHBondContact O-CB 3.37Å; A173-H177 PolarHBondContact O-N 3.37Å; E174-H177 PolarHBondContact O-N 2.81Å; H177-E180 PolarHBondContact O-N 3.26Å; H177-H181 AromaticContact CE1-CD2 3.87Å |
| 178 | K | 52.9 | Low | 58.5 | Low | 176 Ų | 176 | 124.7 Ų | 124.7 | 77% | 0.765 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -75.5 | -28.3 | 176.5 | -166.4 | 178.5 | 179.3 | -169.8 | 0 | 112.4 | E174 D175 A176 E180 | E174-K178 VanDerWaalsContact O-CB 3.23Å; E174-K178 WeakPolarHBondContact O-CB 3.45Å; E174-K178 PolarHBondContact O-N 3.19Å; D175-K178 PolarHBondContact O-N 2.77Å; A176-K178 VanDerWaalsContact C-N 3.32Å; A176-K178 PolarHBondContact O-N 3.37Å; K178-E180 VanDerWaalsContact C-N 3.34Å |
| 179 | K | 58 | Low | 59.3 | Low | 151 Ų | 151 | 122.2 Ų | 122.2 | 66% | 0.657 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -77.7 | -17 | 173.6 | -77.7 | 172 | 177.9 | 159.1 | 0 | 113.8 | D175 A176 | D175-K179 WeakPolarHBondContact O-CB 3.19Å; D175-K179 WeakPolarHBondContact O-CG 3.45Å; D175-K179 PolarHBondContact O-N 3.24Å; D175-K179 VanDerWaalsContact OD1-CE 3.31Å; D175-K179 WeakPolarHBondContact OD1-CE 3.39Å; D175-K179 IonicContact OD1-NZ 3.89Å; D175-K179 PolarHBondContact OD1-NZ 2.88Å; A176-K179 PolarHBondContact O-N 3.27Å |
| 180 | E | 54 | Low | 60.6 | Low | 164 Ų | 164 | 124 Ų | 124 | 77% | 0.766 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -105.6 | -0.3 | -172.9 | -157.7 | 148.6 | -166.8 | 0 | 0 | 115 | A176 H177 K178 K182 | A176-E180 PolarHBondContact O-N 3.38Å; H177-E180 PolarHBondContact O-N 3.26Å; K178-E180 VanDerWaalsContact C-N 3.34Å; E180-K182 PolarHBondContact O-N 3.31Å |
| 181 | H | 49.4 | Very low | 61.9 | Low | 146 Ų | 146 | 119.9 Ų | 119.9 | 68% | 0.676 | 59% | 0.591 | S | S | * | * | trans | -87.3 | 52.4 | 164.2 | -98.6 | -79.8 | 0 | 0 | 0 | 111.8 | H177 | H177-H181 AromaticContact CE1-CD2 3.87Š| ||
| 182 | K | 57.9 | Low | 63.1 | Low | 177 Ų | 177 | 119.6 Ų | 119.6 | 77% | 0.77 | 60% | 0.598 | S | S | * | * | trans | -65.1 | 126.6 | 154.4 | -71.8 | -158.1 | 179.1 | -167.1 | 0 | 106.5 | E180 K184 | E180-K182 PolarHBondContact O-N 3.31Å; K182-K184 PolarHBondContact O-N 2.89Å | ||
| 183 | P | 52.1 | Low | 64.4 | Low | 119 Ų | 119 | 119.2 Ų | 119.2 | 77% | 0.773 | 59% | 0.591 | S | S | * | * | trans | -57.4 | 111.5 | 176.8 | 23.3 | -31.6 | 0 | 0 | 0 | 107.5 | K185 | P183-K185 PolarHBondContact O-N 3.18Š| ||
| 184 | K | 56.4 | Low | 65.8 | Low | 204 Ų | 204 | 119 Ų | 119 | 89% | 0.887 | 59% | 0.585 | S | S | * | * | trans | -51.4 | 115.6 | 166.3 | -90.9 | 172.9 | 177.1 | 160 | 0 | 105.1 | K182 | K182-K184 PolarHBondContact O-N 2.89Š| ||
| 185 | K | 57.8 | Low | 66.9 | Low | 180 Ų | 180 | 118.1 Ų | 118.1 | 78% | 0.783 | 59% | 0.592 | S | S | * | * | trans | -42.1 | 134.3 | 177 | -74.4 | 178.5 | 176.8 | 178.2 | 0 | 108.3 | P183 G187 | P183-K185 PolarHBondContact O-N 3.18Å; K185-G187 PolarHBondContact O-N 2.96Å; K185-G187 VanDerWaalsContact O-N 3.1Å | ||
| 186 | P | 57.7 | Low | 68.2 | Low | 117 Ų | 117 | 122.2 Ų | 122.2 | 76% | 0.76 | 60% | 0.602 | S | S | * | * | trans | -52.3 | 125.5 | 179.8 | 22.5 | -32.5 | 0 | 0 | 0 | 107.7 | K188 | P186-K188 PolarHBondContact O-N 3.42Š| ||
| 187 | G | 62.1 | Low | 69.6 | Low | 24 Ų | 24 | 122.6 Ų | 122.6 | 25% | 0.247 | 61% | 0.605 | C | S | . | * | trans | -59.2 | 105.4 | -175.5 | 0 | 0 | 0 | 0 | 0 | 109 | K185 Y189 C198 | K185-G187 PolarHBondContact O-N 2.96Å; K185-G187 VanDerWaalsContact O-N 3.1Å; G187-Y189 PolarHBondContact O-N 3.27Å; G187-Y189 VanDerWaalsContact O-N 3.11Å; G187-C198 CarbonylContact C-O 3.51Å; G187-C198 VanDerWaalsContact CA-O 3.23Å; G187-C198 WeakPolarHBondContact CA-O 3.49Å | ||
| 188 | K | 74.1 | Confident | 71 | Confident | 172 Ų | 172 | 116.9 Ų | 116.9 | 75% | 0.748 | 58% | 0.579 | S | S | * | * | S | Bend | trans | -63.6 | -15.9 | -175.9 | -69.5 | 173.9 | 175.8 | -97.4 | 0 | 112.8 | P186 | P186-K188 PolarHBondContact O-N 3.42Š|
| 189 | Y | 81.9 | Confident | 72.5 | Confident | 89 Ų | 89 | 112.3 Ų | 112.3 | 35% | 0.349 | 57% | 0.574 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -112.9 | 106.9 | -170.4 | -58.1 | -78.3 | 0 | 0 | 0 | 110.6 | G187 A197 C198 P201 | G187-Y189 PolarHBondContact O-N 3.27Å; G187-Y189 VanDerWaalsContact O-N 3.11Å; Y189-A197 CarbonylContact O-C 3.53Å; Y189-C198 PolarHBondContact N-O 2.94Å; Y189-C198 WeakPolarHBondContact O-CB 3.34Å; Y189-C198 PolarHBondContact O-N 2.9Å; Y189-P201 HydrophobicContact CD1-CB 4Å; Y189-P201 HydrophobicContact CE1-CB 3.77Å; Y189-P201 HydrophobicContact CE1-CG 4.23Å; Y189-P201 HydrophobicContact CE2-CB 4.43Å; Y189-P201 VanDerWaalsContact CE2-CD 3.47Å; Y189-P201 HydrophobicContact CE2-CG 4.32Å; Y189-P201 HydrophobicContact CG-CB 4.41Å |
| 190 | I | 86.5 | Confident | 73.8 | Confident | 107 Ų | 107 | 108.8 Ų | 108.8 | 55% | 0.549 | 56% | 0.559 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -98.8 | 136.7 | -176 | -59.4 | 173 | 0 | 0 | 0 | 109.7 | ||
| 191 | C | 89 | Confident | 75.2 | Confident | 2 Ų | 2 | 104.3 Ų | 104.3 | 1% | 0.014 | 54% | 0.544 | C | S | . | . | trans | -71.5 | 127.3 | 174.1 | -175.7 | 0 | 0 | 0 | 0 | 111.9 | Y193 C194 S195 R196 L204 H207 | C191-Y193 PolarHBondContact O-N 3.3Å; C191-C194 VanDerWaalsContact SG-SG 3.68Å; C191-S195 WeakPolarHBondContact O-CA 3.43Å; C191-S195 PolarHBondContact O-N 3.47Å; C191-R196 HydrophobicContact CB-CB 4.31Å; C191-R196 PolarHBondContact N-O 3.27Å; C191-L204 HydrophobicContact CB-CD1 3.84Å; C191-H207 PolarHBondContact SG-CD2 2.88Å; C191-H207 PolarHBondContact SG-NE2 3.49Å | ||
| 192 | P | 85.1 | Confident | 76.9 | Confident | 101 Ų | 101 | 98.9 Ų | 98.9 | 66% | 0.656 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.6 | -22.2 | 179.4 | 27.3 | -34 | 0 | 0 | 0 | 113.1 | ||
| 193 | Y | 86.5 | Confident | 78.2 | Confident | 144 Ų | 144 | 93.8 Ų | 93.8 | 57% | 0.565 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | -28.6 | -176 | -60.6 | -76.2 | 0 | 0 | 0 | 114.1 | C191 I208 H211 | C191-Y193 PolarHBondContact O-N 3.3Å; Y193-I208 HydrophobicContact CE2-CG2 3.95Å; Y193-H211 HydrophobicContact CD1-CB 4.5Å; Y193-H211 HydrophobicContact CD2-CB 3.85Å; Y193-H211 AromaticContact CD2-CD2 3.85Å; Y193-H211 AromaticContact CD2-CG 3.93Å; Y193-H211 HydrophobicContact CE2-CB 4.37Å; Y193-H211 HydrophobicContact CG-CB 3.94Å; Y193-H211 AromaticContact CG-CG 3.85Å |
| 194 | C | 88.1 | Confident | 79.8 | Confident | 53 Ų | 53 | 89.2 Ų | 89.2 | 36% | 0.358 | 48% | 0.475 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -140.5 | 12.3 | -175.4 | 68.2 | 0 | 0 | 0 | 0 | 114.3 | C191 R196 H207 H211 | C191-C194 VanDerWaalsContact SG-SG 3.68Å; C194-R196 PolarHBondContact O-N 2.87Å; C194-H207 PolarHBondContact SG-NE2 3.47Å; C194-H211 PolarHBondContact SG-NE2 2.59Å; C194-H211 VanDerWaalsContact SG-NE2 3.41Å |
| 195 | S | 85.2 | Confident | 81.2 | Confident | 99 Ų | 99 | 86.3 Ų | 86.3 | 69% | 0.692 | 46% | 0.463 | S | S | * | . | trans | 56.4 | 12.9 | 178.4 | 66.7 | 0 | 0 | 0 | 0 | 115.8 | C191 A197 | C191-S195 WeakPolarHBondContact O-CA 3.43Å; C191-S195 PolarHBondContact O-N 3.47Å; S195-A197 PolarHBondContact O-N 3.27Å | ||
| 196 | R | 84.6 | Confident | 82.6 | Confident | 164 Ų | 164 | 81.2 Ų | 81.2 | 62% | 0.619 | 44% | 0.44 | S | S | * | . | trans | -69.2 | 124 | 178.8 | -178.7 | 167.7 | 168.1 | 166.4 | -4.6 | 110.8 | C191 C194 | C191-R196 HydrophobicContact CB-CB 4.31Å; C191-R196 PolarHBondContact N-O 3.27Å; C194-R196 PolarHBondContact O-N 2.87Å | ||
| 197 | A | 86.7 | Confident | 84 | Confident | 59 Ų | 59 | 77.1 Ų | 77.1 | 49% | 0.488 | 41% | 0.411 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.2 | 130.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y189 S195 | Y189-A197 CarbonylContact O-C 3.53Å; S195-A197 PolarHBondContact O-N 3.27Å |
| 198 | C | 84.2 | Confident | 85.1 | Confident | 7 Ų | 7 | 78.1 Ų | 78.1 | 5% | 0.047 | 41% | 0.41 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.3 | 142 | 176.8 | -65.3 | 0 | 0 | 0 | 0 | 109.3 | G187 Y189 K200 V203 L204 | G187-C198 CarbonylContact C-O 3.51Å; G187-C198 VanDerWaalsContact CA-O 3.23Å; G187-C198 WeakPolarHBondContact CA-O 3.49Å; Y189-C198 PolarHBondContact N-O 2.94Å; Y189-C198 WeakPolarHBondContact O-CB 3.34Å; Y189-C198 PolarHBondContact O-N 2.9Å; C198-K200 VanDerWaalsContact C-N 3.33Å; C198-V203 HydrophobicContact CB-CB 4.42Å; C198-V203 HydrophobicContact CB-CG1 4.23Å; C198-L204 HydrophobicContact CB-CB 3.98Å |
| 199 | A | 84.7 | Confident | 85.8 | Confident | 80 Ų | 80 | 72 Ų | 72 | 66% | 0.661 | 38% | 0.382 | S | S | * | . | S | Bend | trans | -75.3 | -21.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 200 | K | 85.1 | Confident | 85.9 | Confident | 77 Ų | 77 | 70.4 Ų | 70.4 | 34% | 0.335 | 39% | 0.385 | S | S | . | . | S | Bend | trans | -137.8 | 149.2 | -175.6 | -63.7 | -179.3 | -176.8 | 177.4 | 0 | 110.4 | C198 S202 V203 L204 H272 | C198-K200 VanDerWaalsContact C-N 3.33Å; K200-S202 VanDerWaalsContact C-N 3.34Å; K200-S202 PolarHBondContact O-N 3.49Å; K200-V203 HydrophobicContact CB-CB 4.43Å; K200-V203 HydrophobicContact CB-CG2 4.03Å; K200-V203 PolarHBondContact O-N 2.85Å; K200-L204 PolarHBondContact O-N 3.29Å; K200-L204 VanDerWaalsContact O-N 3.15Å; K200-H272 PolarHBondContact NZ-NE2 3.22Å |
| 201 | P | 83.6 | Confident | 85.8 | Confident | 69 Ų | 69 | 69.1 Ų | 69.1 | 45% | 0.448 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -67.3 | -35.3 | 179.3 | 26.9 | -31.5 | 0 | 0 | 0 | 111.8 | Y189 V203 L204 K205 | Y189-P201 HydrophobicContact CD1-CB 4Å; Y189-P201 HydrophobicContact CE1-CB 3.77Å; Y189-P201 HydrophobicContact CE1-CG 4.23Å; Y189-P201 HydrophobicContact CE2-CB 4.43Å; Y189-P201 VanDerWaalsContact CE2-CD 3.47Å; Y189-P201 HydrophobicContact CE2-CG 4.32Å; Y189-P201 HydrophobicContact CG-CB 4.41Å; P201-V203 VanDerWaalsContact C-N 3.28Å; P201-V203 PolarHBondContact O-N 3.19Å; P201-L204 WeakPolarHBondContact O-CB 3.48Å; P201-L204 PolarHBondContact O-N 2.89Å; P201-L204 VanDerWaalsContact O-N 3.14Å; P201-K205 PolarHBondContact O-N 3.08Å |
| 202 | S | 84.7 | Confident | 85.6 | Confident | 33 Ų | 33 | 71.8 Ų | 71.8 | 23% | 0.231 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -61.8 | -35.4 | 175.7 | 60.8 | 0 | 0 | 0 | 0 | 112.7 | K200 K206 | K200-S202 VanDerWaalsContact C-N 3.34Å; K200-S202 PolarHBondContact O-N 3.49Å; S202-K206 VanDerWaalsContact O-CG 3.29Å; S202-K206 WeakPolarHBondContact O-CG 3.3Å; S202-K206 PolarHBondContact O-N 3.48Å; S202-K206 VanDerWaalsContact O-N 3.09Å |
| 203 | V | 85.8 | Confident | 85.6 | Confident | 69 Ų | 69 | 68.6 Ų | 68.6 | 42% | 0.418 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -70.1 | -41.8 | 174.9 | 177.4 | 0 | 0 | 0 | 0 | 110.4 | C198 K200 P201 K206 H207 | C198-V203 HydrophobicContact CB-CB 4.42Å; C198-V203 HydrophobicContact CB-CG1 4.23Å; K200-V203 HydrophobicContact CB-CB 4.43Å; K200-V203 HydrophobicContact CB-CG2 4.03Å; K200-V203 PolarHBondContact O-N 2.85Å; P201-V203 VanDerWaalsContact C-N 3.28Å; P201-V203 PolarHBondContact O-N 3.19Å; V203-K206 PolarHBondContact O-N 3.34Å; V203-H207 VanDerWaalsContact O-CB 3.28Å; V203-H207 WeakPolarHBondContact O-CB 3.48Å; V203-H207 PolarHBondContact O-N 3.3Å |
| 204 | L | 87 | Confident | 85.5 | Confident | 24 Ų | 24 | 67.2 Ų | 67.2 | 13% | 0.126 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -60.8 | -46.1 | 174.7 | 175 | 59.9 | 0 | 0 | 0 | 111.4 | C191 C198 K200 P201 K206 H207 I208 | C191-L204 HydrophobicContact CB-CD1 3.84Å; C198-L204 HydrophobicContact CB-CB 3.98Å; K200-L204 PolarHBondContact O-N 3.29Å; K200-L204 VanDerWaalsContact O-N 3.15Å; P201-L204 WeakPolarHBondContact O-CB 3.48Å; P201-L204 PolarHBondContact O-N 2.89Å; P201-L204 VanDerWaalsContact O-N 3.14Å; L204-K206 PolarHBondContact O-N 3.27Å; L204-H207 CarbonylContact O-C 3.57Å; L204-H207 WeakPolarHBondContact O-CA 3.46Å; L204-H207 WeakPolarHBondContact O-CB 3.43Å; L204-H207 PolarHBondContact O-N 3.08Å; L204-H207 VanDerWaalsContact O-N 3.09Å; L204-I208 HydrophobicContact CD1-CD1 3.99Å; L204-I208 HydrophobicContact CD1-CG1 4.05Å; L204-I208 HydrophobicContact CD2-CD1 4.47Å; L204-I208 HydrophobicContact CG-CD1 3.88Å; L204-I208 HydrophobicContact CG-CG1 4.39Å; L204-I208 WeakPolarHBondContact O-CG1 3.34Å; L204-I208 PolarHBondContact O-N 3.3Å |
| 205 | K | 85.9 | Confident | 85.5 | Confident | 143 Ų | 143 | 71 Ų | 71 | 62% | 0.622 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -61.1 | -43.5 | 178.3 | -166.9 | 170.5 | -173.8 | 173.1 | 0 | 112.1 | P201 H207 I208 R209 | P201-K205 PolarHBondContact O-N 3.08Å; K205-H207 VanDerWaalsContact C-N 3.3Å; K205-H207 PolarHBondContact O-N 3.11Å; K205-I208 PolarHBondContact O-N 3.29Å; K205-R209 PolarHBondContact O-N 3.28Å |
| 206 | K | 85.6 | Confident | 85.5 | Confident | 72 Ų | 72 | 69.1 Ų | 69.1 | 31% | 0.313 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -62.8 | -37.5 | 173.4 | -71.4 | 170.6 | -174 | 171.9 | 0 | 111.8 | S202 V203 L204 T228 D274 | S202-K206 VanDerWaalsContact O-CG 3.29Å; S202-K206 WeakPolarHBondContact O-CG 3.3Å; S202-K206 PolarHBondContact O-N 3.48Å; S202-K206 VanDerWaalsContact O-N 3.09Å; V203-K206 PolarHBondContact O-N 3.34Å; L204-K206 PolarHBondContact O-N 3.27Å; K206-T228 HydrophobicContact CD-CG2 4.16Å; K206-T228 HydrophobicContact CG-CG2 4.14Å; K206-D274 IonicContact NZ-OD2 3.02Å |
| 207 | H | 86.8 | Confident | 85.7 | Confident | 31 Ų | 31 | 63.6 Ų | 63.6 | 14% | 0.144 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -69.9 | -38.6 | 176 | 174.4 | 62.4 | 0 | 0 | 0 | 112.3 | C191 C194 V203 L204 K205 R209 S210 H211 | C191-H207 PolarHBondContact SG-CD2 2.88Å; C191-H207 PolarHBondContact SG-NE2 3.49Å; C194-H207 PolarHBondContact SG-NE2 3.47Å; V203-H207 VanDerWaalsContact O-CB 3.28Å; V203-H207 WeakPolarHBondContact O-CB 3.48Å; V203-H207 PolarHBondContact O-N 3.3Å; L204-H207 CarbonylContact O-C 3.57Å; L204-H207 WeakPolarHBondContact O-CA 3.46Å; L204-H207 WeakPolarHBondContact O-CB 3.43Å; L204-H207 PolarHBondContact O-N 3.08Å; L204-H207 VanDerWaalsContact O-N 3.09Å; K205-H207 VanDerWaalsContact C-N 3.3Å; K205-H207 PolarHBondContact O-N 3.11Å; H207-R209 PolarHBondContact O-N 3.46Å; H207-S210 WeakPolarHBondContact O-CA 3.36Å; H207-S210 VanDerWaalsContact O-CB 3.28Å; H207-S210 WeakPolarHBondContact O-CB 3.37Å; H207-S210 PolarHBondContact O-N 2.99Å; H207-S210 PolarHBondContact O-OG 3.14Å; H207-H211 AromaticContact CE1-NE2 3.53Å; H207-H211 AromaticContact NE2-CD2 3.88Å; H207-H211 AromaticContact NE2-NE2 3.29Å; H207-H211 PolarHBondContact NE2-NE2 3.18Å |
| 208 | I | 86.3 | Confident | 85.6 | Confident | 46 Ų | 46 | 63.7 Ų | 63.7 | 24% | 0.236 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60.2 | -36.9 | 176.2 | -72.4 | 165.5 | 0 | 0 | 0 | 111.3 | Y193 L204 K205 S210 H211 T212 | Y193-I208 HydrophobicContact CE2-CG2 3.95Å; L204-I208 HydrophobicContact CD1-CD1 3.99Å; L204-I208 HydrophobicContact CD1-CG1 4.05Å; L204-I208 HydrophobicContact CD2-CD1 4.47Å; L204-I208 HydrophobicContact CG-CD1 3.88Å; L204-I208 HydrophobicContact CG-CG1 4.39Å; L204-I208 WeakPolarHBondContact O-CG1 3.34Å; L204-I208 PolarHBondContact O-N 3.3Å; K205-I208 PolarHBondContact O-N 3.29Å; I208-S210 PolarHBondContact O-N 3.41Å; I208-S210 VanDerWaalsContact O-N 3.08Å; I208-H211 WeakPolarHBondContact O-CA 3.28Å; I208-H211 WeakPolarHBondContact O-CB 3.46Å; I208-H211 PolarHBondContact O-N 2.73Å; I208-T212 HydrophobicContact CG2-CG2 4.16Å; I208-T212 PolarHBondContact O-N 2.85Å; I208-T212 VanDerWaalsContact O-N 3.08Å |
| 209 | R | 88 | Confident | 85.8 | Confident | 42 Ų | 42 | 63.4 Ų | 63.4 | 16% | 0.158 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -60 | -17.9 | 171.7 | -67.2 | 179.2 | 167.2 | 161.4 | 2.3 | 114 | K205 H207 H211 G213 E214 K227 | K205-R209 PolarHBondContact O-N 3.28Å; H207-R209 PolarHBondContact O-N 3.46Å; R209-H211 VanDerWaalsContact C-N 3.31Å; R209-G213 PolarHBondContact O-N 2.99Å; R209-E214 HydrophobicContact CG-CB 4.47Å; R209-K227 HydrophobicContact CB-CB 4.45Å; R209-K227 WeakPolarHBondContact CD-O 3.49Å; R209-K227 PolarHBondContact NH1-O 3.38Å; R209-K227 VanDerWaalsContact NH1-O 3.11Å; R209-K227 WeakPolarHBondContact O-CE 3.39Å |
| 210 | S | 84.9 | Confident | 85.8 | Confident | 57 Ų | 57 | 65 Ų | 65 | 40% | 0.399 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -70.6 | -31.6 | 171.6 | 77 | 0 | 0 | 0 | 0 | 112.5 | H207 I208 | H207-S210 WeakPolarHBondContact O-CA 3.36Å; H207-S210 VanDerWaalsContact O-CB 3.28Å; H207-S210 WeakPolarHBondContact O-CB 3.37Å; H207-S210 PolarHBondContact O-N 2.99Å; H207-S210 PolarHBondContact O-OG 3.14Å; I208-S210 PolarHBondContact O-N 3.41Å; I208-S210 VanDerWaalsContact O-N 3.08Å |
| 211 | H | 83.9 | Confident | 85.6 | Confident | 79 Ų | 79 | 64.3 Ų | 64.3 | 37% | 0.366 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -84 | -46.3 | 178.7 | -65.3 | -69.5 | 0 | 0 | 0 | 112.2 | Y193 C194 H207 I208 R209 G213 | Y193-H211 HydrophobicContact CD1-CB 4.5Å; Y193-H211 HydrophobicContact CD2-CB 3.85Å; Y193-H211 AromaticContact CD2-CD2 3.85Å; Y193-H211 AromaticContact CD2-CG 3.93Å; Y193-H211 HydrophobicContact CE2-CB 4.37Å; Y193-H211 HydrophobicContact CG-CB 3.94Å; Y193-H211 AromaticContact CG-CG 3.85Å; C194-H211 PolarHBondContact SG-NE2 2.59Å; C194-H211 VanDerWaalsContact SG-NE2 3.41Å; H207-H211 AromaticContact CE1-NE2 3.53Å; H207-H211 AromaticContact NE2-CD2 3.88Å; H207-H211 AromaticContact NE2-NE2 3.29Å; H207-H211 PolarHBondContact NE2-NE2 3.18Å; I208-H211 WeakPolarHBondContact O-CA 3.28Å; I208-H211 WeakPolarHBondContact O-CB 3.46Å; I208-H211 PolarHBondContact O-N 2.73Å; R209-H211 VanDerWaalsContact C-N 3.31Å; H211-G213 VanDerWaalsContact C-N 3.26Å; H211-G213 PolarHBondContact O-N 2.84Å |
| 212 | T | 85.1 | Confident | 85.6 | Confident | 58 Ų | 58 | 63.8 Ų | 63.8 | 36% | 0.356 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -76 | -15.4 | -178.2 | 61.7 | 0 | 0 | 0 | 0 | 113.4 | I208 E214 | I208-T212 HydrophobicContact CG2-CG2 4.16Å; I208-T212 PolarHBondContact O-N 2.85Å; I208-T212 VanDerWaalsContact O-N 3.08Å; T212-E214 PolarHBondContact O-N 3.36Å; T212-E214 VanDerWaalsContact O-N 3.14Å; T212-E214 WeakPolarHBondContact OG1-CG 3.46Å |
| 213 | G | 84.6 | Confident | 85.5 | Confident | 35 Ų | 35 | 64.8 Ų | 64.8 | 36% | 0.361 | 36% | 0.355 | S | S | . | . | trans | 71.2 | 1.7 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | R209 H211 R215 | R209-G213 PolarHBondContact O-N 2.99Å; H211-G213 VanDerWaalsContact C-N 3.26Å; H211-G213 PolarHBondContact O-N 2.84Å; G213-R215 PolarHBondContact O-N 3.29Å | ||
| 214 | E | 85.3 | Confident | 85.5 | Confident | 115 Ų | 115 | 66.5 Ų | 66.5 | 54% | 0.537 | 36% | 0.357 | S | S | . | . | trans | -59 | 129.2 | 179.6 | -73.9 | 179 | -175.5 | 0 | 0 | 112 | R209 T212 | R209-E214 HydrophobicContact CG-CB 4.47Å; T212-E214 PolarHBondContact O-N 3.36Å; T212-E214 VanDerWaalsContact O-N 3.14Å; T212-E214 WeakPolarHBondContact OG1-CG 3.46Å | ||
| 215 | R | 87.6 | Confident | 85.6 | Confident | 133 Ų | 133 | 67 Ų | 67 | 50% | 0.502 | 36% | 0.362 | S | S | . | . | trans | -126.7 | 80.8 | 179 | -72.7 | 168.1 | 155.2 | 122.8 | -3.3 | 109.6 | G213 Y217 S225 F226 K227 | G213-R215 PolarHBondContact O-N 3.29Å; R215-Y217 PolarHBondContact O-N 3.18Å; R215-S225 VanDerWaalsContact CB-CB 3.47Å; R215-S225 WeakPolarHBondContact CD-O 3.5Å; R215-S225 PolarHBondContact NE-O 3.27Å; R215-S225 WeakPolarHBondContact O-CB 3.21Å; R215-F226 CarbonylContact C-O 3.37Å; R215-F226 WeakPolarHBondContact CA-O 3.46Å; R215-K227 HydrophobicContact CG-CG 3.95Å | ||
| 216 | P | 85.8 | Confident | 85.6 | Confident | 59 Ų | 59 | 61.5 Ų | 61.5 | 38% | 0.383 | 34% | 0.338 | S | S | . | . | trans | -77.3 | -4.4 | -172.9 | 27.3 | -30.1 | 0 | 0 | 0 | 113.9 | P218 F226 | P216-P218 VanDerWaalsContact C-CD 3.45Å; P216-P218 WeakPolarHBondContact O-CD 3.33Å; P216-F226 WeakPolarHBondContact CD-O 3.36Å | ||
| 217 | Y | 87.6 | Confident | 85.7 | Confident | 48 Ų | 48 | 61 Ų | 61 | 19% | 0.188 | 34% | 0.336 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.2 | 83.8 | -176 | -58 | -65.2 | 0 | 0 | 0 | 111.1 | R215 S225 F226 K229 | R215-Y217 PolarHBondContact O-N 3.18Å; Y217-S225 CarbonylContact O-C 3.57Å; Y217-S225 WeakPolarHBondContact O-CA 3.26Å; Y217-F226 WeakPolarHBondContact CB-O 3.4Å; Y217-F226 PolarHBondContact N-O 3.4Å; Y217-F226 PolarHBondContact O-N 3.37Å; Y217-K229 HydrophobicContact CD1-CG 3.91Å; Y217-K229 HydrophobicContact CD2-CG 4.5Å; Y217-K229 HydrophobicContact CE1-CD 4.26Å; Y217-K229 HydrophobicContact CE1-CG 3.41Å; Y217-K229 VanDerWaalsContact CE1-CG 3.41Å; Y217-K229 HydrophobicContact CE2-CG 4.02Å; Y217-K229 HydrophobicContact CG-CG 4.43Å; Y217-K229 VanDerWaalsContact CZ-CG 3.46Å |
| 218 | P | 85.8 | Confident | 85.7 | Confident | 61 Ų | 61 | 60.6 Ų | 60.6 | 40% | 0.396 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.6 | 141 | 176 | 30.9 | -34.6 | 0 | 0 | 0 | 111.7 | P216 | P216-P218 VanDerWaalsContact C-CD 3.45Å; P216-P218 WeakPolarHBondContact O-CD 3.33Å |
| 219 | C | 87.8 | Confident | 85.7 | Confident | 0 Ų | 0 | 63.1 Ų | 63.1 | 0% | 0 | 35% | 0.345 | C | S | . | . | trans | -87.7 | 113 | 165.3 | -168.8 | 0 | 0 | 0 | 0 | 108.4 | P221 C222 G223 F224 F226 L232 H235 | C219-P221 VanDerWaalsContact SG-CD 3.53Å; C219-P221 VanDerWaalsContact SG-CG 3.54Å; C219-C222 WeakPolarHBondContact CB-SG 3.37Å; C219-C222 PolarHBondContact O-N 3Å; C219-G223 CarbonylContact O-C 3.57Å; C219-G223 WeakPolarHBondContact O-CA 3.4Å; C219-G223 PolarHBondContact O-N 3.13Å; C219-F224 VanDerWaalsContact CB-O 3.24Å; C219-F224 WeakPolarHBondContact CB-O 3.46Å; C219-F224 PolarHBondContact N-O 2.98Å; C219-F226 HydrophobicContact CB-CE2 4.25Å; C219-L232 HydrophobicContact CB-CD1 3.59Å; C219-H235 VanDerWaalsContact SG-CD2 3.53Å | ||
| 220 | I | 83.9 | Confident | 85.6 | Confident | 113 Ų | 113 | 64.1 Ų | 64.1 | 58% | 0.579 | 36% | 0.358 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.2 | -47 | 179.7 | -53.8 | -65.1 | 0 | 0 | 0 | 113.2 | C222 | I220-C222 VanDerWaalsContact C-N 3.35Å; I220-C222 PolarHBondContact O-N 3.36Å |
| 221 | P | 80.9 | Confident | 85.7 | Confident | 64 Ų | 64 | 65 Ų | 65 | 42% | 0.416 | 36% | 0.359 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.6 | -27.4 | -174.8 | 23.6 | -34.5 | 0 | 0 | 0 | 114.7 | C219 | C219-P221 VanDerWaalsContact SG-CD 3.53Å; C219-P221 VanDerWaalsContact SG-CG 3.54Å |
| 222 | C | 84.1 | Confident | 85.9 | Confident | 57 Ų | 57 | 62 Ų | 62 | 39% | 0.385 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -119.8 | -0.4 | -178.2 | 68.7 | 0 | 0 | 0 | 0 | 114.3 | C219 I220 F224 H235 | C219-C222 WeakPolarHBondContact CB-SG 3.37Å; C219-C222 PolarHBondContact O-N 3Å; I220-C222 VanDerWaalsContact C-N 3.35Å; I220-C222 PolarHBondContact O-N 3.36Å; C222-F224 PolarHBondContact O-N 3.36Å; C222-F224 VanDerWaalsContact SG-CB 3.57Å; C222-F224 PolarHBondContact SG-N 2.97Å; C222-H235 PolarHBondContact SG-NE2 3.1Å |
| 223 | G | 83.3 | Confident | 86.1 | Confident | 55 Ų | 55 | 65 Ų | 65 | 57% | 0.567 | 35% | 0.351 | S | S | * | . | trans | 67.2 | -2.1 | -175.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | C219 | C219-G223 CarbonylContact O-C 3.57Å; C219-G223 WeakPolarHBondContact O-CA 3.4Å; C219-G223 PolarHBondContact O-N 3.13Å | ||
| 224 | F | 86.2 | Confident | 86.2 | Confident | 105 Ų | 105 | 70.5 Ų | 70.5 | 46% | 0.461 | 37% | 0.365 | S | S | . | . | trans | -78.2 | 130.7 | -173.4 | -166 | -86.1 | 0 | 0 | 0 | 112.2 | C219 C222 F226 | C219-F224 VanDerWaalsContact CB-O 3.24Å; C219-F224 WeakPolarHBondContact CB-O 3.46Å; C219-F224 PolarHBondContact N-O 2.98Å; C222-F224 PolarHBondContact O-N 3.36Å; C222-F224 VanDerWaalsContact SG-CB 3.57Å; C222-F224 PolarHBondContact SG-N 2.97Å; F224-F226 HydrophobicContact CB-CE2 4.46Å; F224-F226 HydrophobicContact CD1-CD1 4.19Å; F224-F226 HydrophobicContact CD1-CD2 4.12Å; F224-F226 AromaticContact CD1-CE1 3.63Å; F224-F226 HydrophobicContact CD1-CE1 3.63Å; F224-F226 AromaticContact CD1-CE2 3.54Å; F224-F226 HydrophobicContact CD1-CE2 3.54Å; F224-F226 HydrophobicContact CD1-CG 4.42Å; F224-F226 AromaticContact CD1-CZ 3.25Å; F224-F226 HydrophobicContact CD1-CZ 3.25Å; F224-F226 HydrophobicContact CE1-CD1 4.02Å; F224-F226 AromaticContact CE1-CE1 3.57Å; F224-F226 HydrophobicContact CE1-CE1 3.57Å; F224-F226 HydrophobicContact CE1-CE2 4.32Å; F224-F226 AromaticContact CE1-CZ 3.72Å; F224-F226 HydrophobicContact CE1-CZ 3.72Å; F224-F226 HydrophobicContact CG-CE2 4.47Å; F224-F226 HydrophobicContact CG-CZ 4.28Å; F224-F226 WeakPolarHBondContact O-CE2 3.29Å | ||
| 225 | S | 88.8 | Confident | 86.3 | Confident | 34 Ų | 34 | 67 Ų | 67 | 24% | 0.238 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.2 | 140.5 | -175.5 | -55 | 0 | 0 | 0 | 0 | 114 | R215 Y217 | R215-S225 VanDerWaalsContact CB-CB 3.47Å; R215-S225 WeakPolarHBondContact CD-O 3.5Å; R215-S225 PolarHBondContact NE-O 3.27Å; R215-S225 WeakPolarHBondContact O-CB 3.21Å; Y217-S225 CarbonylContact O-C 3.57Å; Y217-S225 WeakPolarHBondContact O-CA 3.26Å |
| 226 | F | 86.2 | Confident | 86.2 | Confident | 28 Ų | 28 | 64.9 Ų | 64.9 | 12% | 0.123 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.7 | 154.5 | -176.8 | -60.8 | -87.7 | 0 | 0 | 0 | 112.5 | R215 P216 Y217 C219 F224 N231 L232 H235 | R215-F226 CarbonylContact C-O 3.37Å; R215-F226 WeakPolarHBondContact CA-O 3.46Å; P216-F226 WeakPolarHBondContact CD-O 3.36Å; Y217-F226 WeakPolarHBondContact CB-O 3.4Å; Y217-F226 PolarHBondContact N-O 3.4Å; Y217-F226 PolarHBondContact O-N 3.37Å; C219-F226 HydrophobicContact CB-CE2 4.25Å; F224-F226 HydrophobicContact CB-CE2 4.46Å; F224-F226 HydrophobicContact CD1-CD1 4.19Å; F224-F226 HydrophobicContact CD1-CD2 4.12Å; F224-F226 AromaticContact CD1-CE1 3.63Å; F224-F226 HydrophobicContact CD1-CE1 3.63Å; F224-F226 AromaticContact CD1-CE2 3.54Å; F224-F226 HydrophobicContact CD1-CE2 3.54Å; F224-F226 HydrophobicContact CD1-CG 4.42Å; F224-F226 AromaticContact CD1-CZ 3.25Å; F224-F226 HydrophobicContact CD1-CZ 3.25Å; F224-F226 HydrophobicContact CE1-CD1 4.02Å; F224-F226 AromaticContact CE1-CE1 3.57Å; F224-F226 HydrophobicContact CE1-CE1 3.57Å; F224-F226 HydrophobicContact CE1-CE2 4.32Å; F224-F226 AromaticContact CE1-CZ 3.72Å; F224-F226 HydrophobicContact CE1-CZ 3.72Å; F224-F226 HydrophobicContact CG-CE2 4.47Å; F224-F226 HydrophobicContact CG-CZ 4.28Å; F224-F226 WeakPolarHBondContact O-CE2 3.29Å; F226-N231 HydrophobicContact CB-CB 4.27Å; F226-N231 HydrophobicContact CD1-CB 3.89Å; F226-N231 HydrophobicContact CG-CB 4.33Å; F226-L232 HydrophobicContact CB-CB 4.26Å; F226-L232 HydrophobicContact CD2-CB 3.82Å; F226-L232 HydrophobicContact CD2-CD1 3.69Å; F226-L232 HydrophobicContact CD2-CG 4.37Å; F226-L232 HydrophobicContact CE2-CD1 3.89Å; F226-L232 HydrophobicContact CG-CB 4.22Å; F226-H235 HydrophobicContact CE1-CB 3.98Å; F226-H235 HydrophobicContact CE2-CB 3.77Å; F226-H235 AromaticContact CE2-CD2 3.37Å; F226-H235 WeakPolarHBondContact CE2-CD2 3.31Å; F226-H235 AromaticContact CE2-CG 3.6Å; F226-H235 HydrophobicContact CZ-CB 3.33Å; F226-H235 AromaticContact CZ-CD2 3.43Å; F226-H235 VanDerWaalsContact CZ-CD2 3.43Å; F226-H235 WeakPolarHBondContact CZ-CD2 3.37Å; F226-H235 AromaticContact CZ-CG 3.18Å; F226-H235 AromaticContact CZ-ND1 3.63Å; F226-H235 AromaticContact CZ-NE2 3.96Å |
| 227 | K | 86.3 | Confident | 86.3 | Confident | 61 Ų | 61 | 68.7 Ų | 68.7 | 27% | 0.265 | 35% | 0.351 | S | S | . | . | S | Bend | trans | -78.3 | -22.6 | 177.5 | -61.7 | -178.5 | 176.5 | 177.6 | 0 | 112.8 | R209 R215 | R209-K227 HydrophobicContact CB-CB 4.45Å; R209-K227 WeakPolarHBondContact CD-O 3.49Å; R209-K227 PolarHBondContact NH1-O 3.38Å; R209-K227 VanDerWaalsContact NH1-O 3.11Å; R209-K227 WeakPolarHBondContact O-CE 3.39Å; R215-K227 HydrophobicContact CG-CG 3.95Å |
| 228 | T | 86.7 | Confident | 86.2 | Confident | 22 Ų | 22 | 69.1 Ų | 69.1 | 14% | 0.135 | 36% | 0.361 | C | S | . | . | S | Bend | trans | -136.3 | 149.1 | -177.1 | 62.4 | 0 | 0 | 0 | 0 | 112.3 | K206 S230 N231 L232 | K206-T228 HydrophobicContact CD-CG2 4.16Å; K206-T228 HydrophobicContact CG-CG2 4.14Å; T228-S230 VanDerWaalsContact C-N 3.34Å; T228-S230 PolarHBondContact O-N 3.02Å; T228-S230 PolarHBondContact OG1-OG 3.41Å; T228-N231 PolarHBondContact O-N 2.76Å; T228-N231 WeakPolarHBondContact OG1-CB 3.47Å; T228-N231 PolarHBondContact OG1-N 2.74Å; T228-N231 PolarHBondContact OG1-ND2 2.87Å; T228-N231 PolarHBondContact OG1-OD1 3.09Å; T228-L232 PolarHBondContact O-N 2.84Å |
| 229 | K | 86.8 | Confident | 86.1 | Confident | 99 Ų | 99 | 68 Ų | 68 | 43% | 0.43 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -58.8 | -43.4 | 174.4 | -65.8 | 177.2 | -179 | 160.7 | 0 | 111.9 | Y217 N231 L232 Y233 D274 | Y217-K229 HydrophobicContact CD1-CG 3.91Å; Y217-K229 HydrophobicContact CD2-CG 4.5Å; Y217-K229 HydrophobicContact CE1-CD 4.26Å; Y217-K229 HydrophobicContact CE1-CG 3.41Å; Y217-K229 VanDerWaalsContact CE1-CG 3.41Å; Y217-K229 HydrophobicContact CE2-CG 4.02Å; Y217-K229 HydrophobicContact CG-CG 4.43Å; Y217-K229 VanDerWaalsContact CZ-CG 3.46Å; K229-N231 VanDerWaalsContact C-N 3.29Å; K229-N231 PolarHBondContact O-N 3.33Å; K229-L232 WeakPolarHBondContact O-CB 3.28Å; K229-L232 PolarHBondContact O-N 2.78Å; K229-L232 VanDerWaalsContact O-N 3.15Å; K229-Y233 PolarHBondContact O-N 3.3Å; K229-D274 IonicContact NZ-OD1 2.7Å; K229-D274 PolarHBondContact NZ-OD1 3.2Å |
| 230 | S | 86.7 | Confident | 85.8 | Confident | 63 Ų | 63 | 69.9 Ų | 69.9 | 44% | 0.441 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -60 | -36.2 | 179.7 | 56 | 0 | 0 | 0 | 0 | 113.3 | T228 Y233 K234 | T228-S230 VanDerWaalsContact C-N 3.34Å; T228-S230 PolarHBondContact O-N 3.02Å; T228-S230 PolarHBondContact OG1-OG 3.41Å; S230-Y233 PolarHBondContact O-N 3.15Å; S230-K234 WeakPolarHBondContact O-CG 3.49Å; S230-K234 PolarHBondContact O-N 3.44Å; S230-K234 VanDerWaalsContact O-N 3.09Å |
| 231 | N | 86.9 | Confident | 85.9 | Confident | 75 Ų | 75 | 71 Ų | 71 | 40% | 0.401 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -72.9 | -39.9 | 176.9 | -71.1 | -1.8 | 0 | 0 | 0 | 111.4 | F226 T228 K229 Y233 K234 H235 | F226-N231 HydrophobicContact CB-CB 4.27Å; F226-N231 HydrophobicContact CD1-CB 3.89Å; F226-N231 HydrophobicContact CG-CB 4.33Å; T228-N231 PolarHBondContact O-N 2.76Å; T228-N231 WeakPolarHBondContact OG1-CB 3.47Å; T228-N231 PolarHBondContact OG1-N 2.74Å; T228-N231 PolarHBondContact OG1-ND2 2.87Å; T228-N231 PolarHBondContact OG1-OD1 3.09Å; K229-N231 VanDerWaalsContact C-N 3.29Å; K229-N231 PolarHBondContact O-N 3.33Å; N231-Y233 VanDerWaalsContact C-N 3.31Å; N231-Y233 PolarHBondContact O-N 2.86Å; N231-K234 PolarHBondContact O-N 3.09Å; N231-H235 WeakPolarHBondContact O-CB 3.47Å; N231-H235 PolarHBondContact O-N 3.46Å |
| 232 | L | 88.9 | Confident | 85.9 | Confident | 16 Ų | 16 | 68.9 Ų | 68.9 | 8% | 0.084 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -59.9 | -42.5 | 172.2 | 173.6 | 64.3 | 0 | 0 | 0 | 111.2 | C219 F226 T228 K229 H235 R236 | C219-L232 HydrophobicContact CB-CD1 3.59Å; F226-L232 HydrophobicContact CB-CB 4.26Å; F226-L232 HydrophobicContact CD2-CB 3.82Å; F226-L232 HydrophobicContact CD2-CD1 3.69Å; F226-L232 HydrophobicContact CD2-CG 4.37Å; F226-L232 HydrophobicContact CE2-CD1 3.89Å; F226-L232 HydrophobicContact CG-CB 4.22Å; T228-L232 PolarHBondContact O-N 2.84Å; K229-L232 WeakPolarHBondContact O-CB 3.28Å; K229-L232 PolarHBondContact O-N 2.78Å; K229-L232 VanDerWaalsContact O-N 3.15Å; L232-H235 WeakPolarHBondContact O-CB 3.27Å; L232-H235 PolarHBondContact O-N 3.49Å; L232-R236 HydrophobicContact CD1-CG 4.26Å; L232-R236 WeakPolarHBondContact O-CG 3.48Å; L232-R236 PolarHBondContact O-N 3.34Å |
| 233 | Y | 87.7 | Confident | 85.8 | Confident | 121 Ų | 121 | 66.9 Ų | 66.9 | 48% | 0.475 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -62 | -49.7 | 178.4 | -179.4 | -103.4 | 0 | 0 | 0 | 112.3 | K229 S230 N231 H235 R236 K237 L260 | K229-Y233 PolarHBondContact O-N 3.3Å; S230-Y233 PolarHBondContact O-N 3.15Å; N231-Y233 VanDerWaalsContact C-N 3.31Å; N231-Y233 PolarHBondContact O-N 2.86Å; Y233-H235 PolarHBondContact O-N 3.35Å; Y233-R236 PolarHBondContact O-N 2.71Å; Y233-R236 VanDerWaalsContact O-N 3.14Å; Y233-K237 PolarHBondContact O-N 3.24Å; Y233-L260 HydrophobicContact CE2-CD2 3.53Å; Y233-L260 VanDerWaalsContact OH-CD2 3.26Å; Y233-L260 WeakPolarHBondContact OH-CD2 3.32Å |
| 234 | K | 87.9 | Confident | 85.7 | Confident | 152 Ų | 152 | 73 Ų | 73 | 66% | 0.661 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -57.3 | -39.8 | 174.8 | -71.7 | 177.8 | -178.2 | -176 | 0 | 111.8 | S230 N231 K237 S238 | S230-K234 WeakPolarHBondContact O-CG 3.49Å; S230-K234 PolarHBondContact O-N 3.44Å; S230-K234 VanDerWaalsContact O-N 3.09Å; N231-K234 PolarHBondContact O-N 3.09Å; K234-K237 WeakPolarHBondContact O-CB 3.23Å; K234-K237 PolarHBondContact O-N 3.1Å; K234-S238 PolarHBondContact O-N 3.35Å |
| 235 | H | 87.2 | Confident | 85.5 | Confident | 40 Ų | 40 | 70.7 Ų | 70.7 | 19% | 0.185 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -66.9 | -42.2 | 176.1 | 175.5 | 73.5 | 0 | 0 | 0 | 112.9 | C219 C222 F226 N231 L232 Y233 K237 S238 H239 | C219-H235 VanDerWaalsContact SG-CD2 3.53Å; C222-H235 PolarHBondContact SG-NE2 3.1Å; F226-H235 HydrophobicContact CE1-CB 3.98Å; F226-H235 HydrophobicContact CE2-CB 3.77Å; F226-H235 AromaticContact CE2-CD2 3.37Å; F226-H235 WeakPolarHBondContact CE2-CD2 3.31Å; F226-H235 AromaticContact CE2-CG 3.6Å; F226-H235 HydrophobicContact CZ-CB 3.33Å; F226-H235 AromaticContact CZ-CD2 3.43Å; F226-H235 VanDerWaalsContact CZ-CD2 3.43Å; F226-H235 WeakPolarHBondContact CZ-CD2 3.37Å; F226-H235 AromaticContact CZ-CG 3.18Å; F226-H235 AromaticContact CZ-ND1 3.63Å; F226-H235 AromaticContact CZ-NE2 3.96Å; N231-H235 WeakPolarHBondContact O-CB 3.47Å; N231-H235 PolarHBondContact O-N 3.46Å; L232-H235 WeakPolarHBondContact O-CB 3.27Å; L232-H235 PolarHBondContact O-N 3.49Å; Y233-H235 PolarHBondContact O-N 3.35Å; H235-K237 VanDerWaalsContact C-N 3.27Å; H235-K237 PolarHBondContact O-N 3.39Å; H235-S238 WeakPolarHBondContact O-CA 3.31Å; H235-S238 WeakPolarHBondContact O-CB 3.47Å; H235-S238 PolarHBondContact O-N 3.09Å; H235-S238 PolarHBondContact O-OG 3.45Å; H235-H239 AromaticContact CD2-CD2 3.86Å; H235-H239 AromaticContact CD2-NE2 3.58Å; H235-H239 AromaticContact CE1-CE1 3.99Å; H235-H239 AromaticContact CE1-NE2 3.38Å; H235-H239 PolarHBondContact CE1-NE2 2.9Å; H235-H239 AromaticContact NE2-CD2 3.63Å; H235-H239 AromaticContact NE2-CE1 3.83Å; H235-H239 AromaticContact NE2-NE2 2.88Å; H235-H239 PolarHBondContact NE2-NE2 3.08Å; H235-H239 PolarHBondContact O-N 3.47Å |
| 236 | R | 85.4 | Confident | 85 | Confident | 89 Ų | 89 | 71.7 Ų | 71.7 | 34% | 0.336 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -60.2 | -38.1 | 173.9 | -75.7 | -177.4 | -179 | -177.9 | 1.2 | 112.3 | L232 Y233 S238 H239 A240 L258 | L232-R236 HydrophobicContact CD1-CG 4.26Å; L232-R236 WeakPolarHBondContact O-CG 3.48Å; L232-R236 PolarHBondContact O-N 3.34Å; Y233-R236 PolarHBondContact O-N 2.71Å; Y233-R236 VanDerWaalsContact O-N 3.14Å; R236-S238 VanDerWaalsContact C-N 3.26Å; R236-S238 PolarHBondContact O-N 3.15Å; R236-H239 WeakPolarHBondContact O-CB 3.28Å; R236-H239 PolarHBondContact O-N 3.34Å; R236-H239 VanDerWaalsContact O-N 3.13Å; R236-A240 PolarHBondContact O-N 3.49Å; R236-A240 VanDerWaalsContact O-N 3.1Å; R236-L258 HydrophobicContact CB-CD2 3.83Å; R236-L258 HydrophobicContact CG-CD2 3.77Å |
| 237 | K | 87.8 | Confident | 84.6 | Confident | 139 Ų | 139 | 77 Ų | 77 | 60% | 0.604 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -62.1 | -33.7 | 172.6 | -168.5 | 175.1 | -179.1 | 175.6 | 0 | 112.5 | Y233 K234 H235 A240 H241 | Y233-K237 PolarHBondContact O-N 3.24Å; K234-K237 WeakPolarHBondContact O-CB 3.23Å; K234-K237 PolarHBondContact O-N 3.1Å; H235-K237 VanDerWaalsContact C-N 3.27Å; H235-K237 PolarHBondContact O-N 3.39Å; K237-A240 PolarHBondContact O-N 3.27Å; K237-H241 PolarHBondContact O-N 3.14Å |
| 238 | S | 85.4 | Confident | 83.8 | Confident | 58 Ų | 58 | 77 Ų | 77 | 41% | 0.406 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -67.2 | -34.8 | 174.3 | 76.7 | 0 | 0 | 0 | 0 | 112.7 | K234 H235 R236 H241 A242 | K234-S238 PolarHBondContact O-N 3.35Å; H235-S238 WeakPolarHBondContact O-CA 3.31Å; H235-S238 WeakPolarHBondContact O-CB 3.47Å; H235-S238 PolarHBondContact O-N 3.09Å; H235-S238 PolarHBondContact O-OG 3.45Å; R236-S238 VanDerWaalsContact C-N 3.26Å; R236-S238 PolarHBondContact O-N 3.15Å; S238-H241 PolarHBondContact O-N 2.88Å; S238-A242 WeakPolarHBondContact O-CB 3.49Å; S238-A242 PolarHBondContact O-N 3.11Å |
| 239 | H | 82.6 | Confident | 82.5 | Confident | 38 Ų | 38 | 81 Ų | 81 | 18% | 0.176 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -62.8 | -48 | 170.9 | -72.7 | -59.5 | 0 | 0 | 0 | 111.3 | H235 R236 H241 A242 I243 L258 | H235-H239 AromaticContact CD2-CD2 3.86Å; H235-H239 AromaticContact CD2-NE2 3.58Å; H235-H239 AromaticContact CE1-CE1 3.99Å; H235-H239 AromaticContact CE1-NE2 3.38Å; H235-H239 PolarHBondContact CE1-NE2 2.9Å; H235-H239 AromaticContact NE2-CD2 3.63Å; H235-H239 AromaticContact NE2-CE1 3.83Å; H235-H239 AromaticContact NE2-NE2 2.88Å; H235-H239 PolarHBondContact NE2-NE2 3.08Å; H235-H239 PolarHBondContact O-N 3.47Å; R236-H239 WeakPolarHBondContact O-CB 3.28Å; R236-H239 PolarHBondContact O-N 3.34Å; R236-H239 VanDerWaalsContact O-N 3.13Å; H239-H241 VanDerWaalsContact C-N 3.27Å; H239-H241 PolarHBondContact O-N 3.25Å; H239-A242 PolarHBondContact O-N 2.93Å; H239-I243 WeakPolarHBondContact O-CB 3.39Å; H239-I243 WeakPolarHBondContact O-CD1 3.23Å; H239-I243 WeakPolarHBondContact O-CG1 3.48Å; H239-I243 PolarHBondContact O-N 3.34Å; H239-L258 HydrophobicContact CB-CD1 3.8Å |
| 240 | A | 83.2 | Confident | 81 | Confident | 38 Ų | 38 | 83.1 Ų | 83.1 | 31% | 0.314 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -57.9 | -40.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | R236 K237 K244 | R236-A240 PolarHBondContact O-N 3.49Å; R236-A240 VanDerWaalsContact O-N 3.1Å; K237-A240 PolarHBondContact O-N 3.27Å; A240-K244 WeakPolarHBondContact O-CB 3.31Å; A240-K244 PolarHBondContact O-N 3.36Å |
| 241 | H | 84.3 | Confident | 79.5 | Confident | 136 Ų | 136 | 83.9 Ų | 83.9 | 63% | 0.63 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -67.7 | -43.5 | 175.9 | -173.5 | -90.8 | 0 | 0 | 0 | 112.7 | K237 S238 H239 I243 K244 A245 | K237-H241 PolarHBondContact O-N 3.14Å; S238-H241 PolarHBondContact O-N 2.88Å; H239-H241 VanDerWaalsContact C-N 3.27Å; H239-H241 PolarHBondContact O-N 3.25Å; H241-I243 VanDerWaalsContact C-N 3.32Å; H241-I243 PolarHBondContact O-N 2.87Å; H241-K244 PolarHBondContact O-N 3.03Å; H241-A245 WeakPolarHBondContact O-CB 3.19Å; H241-A245 PolarHBondContact O-N 3.48Å |
| 242 | A | 82.5 | Confident | 77.8 | Confident | 21 Ų | 21 | 88.5 Ų | 88.5 | 17% | 0.174 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -63.8 | -38.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112 | S238 H239 A245 G246 L247 V248 | S238-A242 WeakPolarHBondContact O-CB 3.49Å; S238-A242 PolarHBondContact O-N 3.11Å; H239-A242 PolarHBondContact O-N 2.93Å; A242-A245 PolarHBondContact O-N 2.99Å; A242-G246 PolarHBondContact O-N 3.31Å; A242-L247 PolarHBondContact O-N 3.41Å; A242-V248 HydrophobicContact CB-CG2 4.05Å |
| 243 | I | 82.1 | Confident | 76.1 | Confident | 14 Ų | 14 | 92.5 Ų | 92.5 | 7% | 0.072 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -65.9 | -47.3 | 174.1 | -66.2 | 164.2 | 0 | 0 | 0 | 110.2 | H239 H241 A245 G246 F250 V255 L258 | H239-I243 WeakPolarHBondContact O-CB 3.39Å; H239-I243 WeakPolarHBondContact O-CD1 3.23Å; H239-I243 WeakPolarHBondContact O-CG1 3.48Å; H239-I243 PolarHBondContact O-N 3.34Å; H241-I243 VanDerWaalsContact C-N 3.32Å; H241-I243 PolarHBondContact O-N 2.87Å; I243-A245 PolarHBondContact O-N 3.34Å; I243-G246 PolarHBondContact O-N 3.42Å; I243-F250 HydrophobicContact CG2-CD1 3.73Å; I243-F250 HydrophobicContact CG2-CE1 3.45Å; I243-F250 VanDerWaalsContact CG2-CE1 3.45Å; I243-F250 HydrophobicContact CG2-CE2 4.39Å; I243-F250 HydrophobicContact CG2-CG 4.33Å; I243-F250 HydrophobicContact CG2-CZ 3.81Å; I243-V255 HydrophobicContact CD1-CG2 4.06Å; I243-V255 HydrophobicContact CG2-CG2 4.1Å; I243-L258 HydrophobicContact CD1-CD1 4.36Å |
| 244 | K | 79.8 | Confident | 74.4 | Confident | 185 Ų | 185 | 87.5 Ų | 87.5 | 80% | 0.804 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -61.7 | -31.5 | 177.2 | -170.9 | 174 | -177.4 | 177.5 | 0 | 112.8 | A240 H241 G246 | A240-K244 WeakPolarHBondContact O-CB 3.31Å; A240-K244 PolarHBondContact O-N 3.36Å; H241-K244 PolarHBondContact O-N 3.03Å; K244-G246 VanDerWaalsContact C-N 3.26Å; K244-G246 PolarHBondContact O-N 3.1Å |
| 245 | A | 83.4 | Confident | 72.8 | Confident | 56 Ų | 56 | 83.4 Ų | 83.4 | 46% | 0.463 | 46% | 0.459 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.4 | -0.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | H241 A242 I243 L247 | H241-A245 WeakPolarHBondContact O-CB 3.19Å; H241-A245 PolarHBondContact O-N 3.48Å; A242-A245 PolarHBondContact O-N 2.99Å; I243-A245 PolarHBondContact O-N 3.34Å; A245-L247 HydrophobicContact CB-CD1 4.1Å; A245-L247 HydrophobicContact CB-CG 3.94Å; A245-L247 PolarHBondContact O-N 3.07Å |
| 246 | G | 78.1 | Confident | 71.1 | Confident | 55 Ų | 55 | 85.8 Ų | 85.8 | 57% | 0.567 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.1 | 15.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | A242 I243 K244 V248 | A242-G246 PolarHBondContact O-N 3.31Å; I243-G246 PolarHBondContact O-N 3.42Å; K244-G246 VanDerWaalsContact C-N 3.26Å; K244-G246 PolarHBondContact O-N 3.1Å; G246-V248 VanDerWaalsContact C-N 3.33Å |
| 247 | L | 76.6 | Confident | 69.5 | Low | 138 Ų | 138 | 89 Ų | 89 | 72% | 0.723 | 50% | 0.497 | S | S | * | . | trans | -80.6 | -16 | -177.2 | -62.8 | 178.1 | 0 | 0 | 0 | 113 | A242 A245 | A242-L247 PolarHBondContact O-N 3.41Å; A245-L247 HydrophobicContact CB-CD1 4.1Å; A245-L247 HydrophobicContact CB-CG 3.94Å; A245-L247 PolarHBondContact O-N 3.07Å | ||
| 248 | V | 70.2 | Confident | 68 | Low | 63 Ų | 63 | 83.4 Ų | 83.4 | 38% | 0.382 | 47% | 0.473 | S | S | . | . | S | Bend | trans | -128.9 | 133.3 | 177.9 | -176.5 | 0 | 0 | 0 | 0 | 107.6 | A242 G246 F250 | A242-V248 HydrophobicContact CB-CG2 4.05Å; G246-V248 VanDerWaalsContact C-N 3.33Å; V248-F250 PolarHBondContact O-N 2.96Å |
| 249 | P | 59.9 | Low | 66.3 | Low | 104 Ų | 104 | 87 Ų | 87 | 68% | 0.675 | 49% | 0.488 | S | S | * | . | trans | -56.6 | 131 | 177 | 21.7 | -31.5 | 0 | 0 | 0 | 109.9 | T251 | P249-T251 VanDerWaalsContact C-N 3.32Å; P249-T251 PolarHBondContact O-N 3.26Å | ||
| 250 | F | 53.7 | Low | 65.3 | Low | 145 Ų | 145 | 89.2 Ų | 89.2 | 64% | 0.636 | 50% | 0.501 | S | S | * | . | trans | -58.1 | 94.1 | 172.5 | -79.3 | -94.7 | 0 | 0 | 0 | 108.7 | I243 V248 V255 | I243-F250 HydrophobicContact CG2-CD1 3.73Å; I243-F250 HydrophobicContact CG2-CE1 3.45Å; I243-F250 VanDerWaalsContact CG2-CE1 3.45Å; I243-F250 HydrophobicContact CG2-CE2 4.39Å; I243-F250 HydrophobicContact CG2-CG 4.33Å; I243-F250 HydrophobicContact CG2-CZ 3.81Å; V248-F250 PolarHBondContact O-N 2.96Å; F250-V255 HydrophobicContact CD1-CG2 4.47Å | ||
| 251 | T | 56.6 | Low | 63.4 | Low | 78 Ų | 78 | 95.4 Ų | 95.4 | 48% | 0.479 | 52% | 0.523 | S | S | . | . | trans | -87.2 | 115 | 157.7 | 58.2 | 0 | 0 | 0 | 0 | 105.1 | P249 S253 S254 | P249-T251 VanDerWaalsContact C-N 3.32Å; P249-T251 PolarHBondContact O-N 3.26Å; T251-S253 PolarHBondContact O-N 2.98Å; T251-S254 PolarHBondContact O-N 3.06Å; T251-S254 PolarHBondContact O-OG 3.48Å; T251-S254 VanDerWaalsContact OG1-CB 3.28Å; T251-S254 WeakPolarHBondContact OG1-CB 3.44Å; T251-S254 PolarHBondContact OG1-OG 2.8Å; T251-S254 VanDerWaalsContact OG1-OG 3.05Å | ||
| 252 | E | 51.2 | Low | 61.7 | Low | 173 Ų | 173 | 94.3 Ų | 94.3 | 81% | 0.808 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -53 | -26.9 | 177.9 | -72.8 | -165.3 | 118.4 | 0 | 0 | 112 | S254 V255 S256 | E252-S254 VanDerWaalsContact C-N 3.31Å; E252-S254 PolarHBondContact O-N 2.87Å; E252-V255 PolarHBondContact O-N 3.19Å; E252-S256 WeakPolarHBondContact O-CB 3.33Å; E252-S256 PolarHBondContact O-N 3.05Å; E252-S256 VanDerWaalsContact O-N 3.12Å; E252-S256 PolarHBondContact O-OG 2.82Å |
| 253 | S | 52.9 | Low | 60.2 | Low | 99 Ų | 99 | 96.4 Ų | 96.4 | 69% | 0.692 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -65.3 | -24.6 | 172.6 | -179.5 | 0 | 0 | 0 | 0 | 114.9 | T251 | T251-S253 PolarHBondContact O-N 2.98Å |
| 254 | S | 52.7 | Low | 58.1 | Low | 17 Ų | 17 | 103.1 Ų | 103.1 | 12% | 0.119 | 59% | 0.59 | C | S | . | * | H | α-helix | trans | -84.8 | -26.4 | 178.2 | 65.8 | 0 | 0 | 0 | 0 | 112.4 | T251 E252 L258 | T251-S254 PolarHBondContact O-N 3.06Å; T251-S254 PolarHBondContact O-OG 3.48Å; T251-S254 VanDerWaalsContact OG1-CB 3.28Å; T251-S254 WeakPolarHBondContact OG1-CB 3.44Å; T251-S254 PolarHBondContact OG1-OG 2.8Å; T251-S254 VanDerWaalsContact OG1-OG 3.05Å; E252-S254 VanDerWaalsContact C-N 3.31Å; E252-S254 PolarHBondContact O-N 2.87Å; S254-L258 WeakPolarHBondContact O-CB 3.31Å; S254-L258 WeakPolarHBondContact O-CD1 3.43Å; S254-L258 WeakPolarHBondContact O-CG 3.42Å |
| 255 | V | 52.6 | Low | 56.4 | Low | 65 Ų | 65 | 98.8 Ų | 98.8 | 39% | 0.394 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -89.3 | -41.4 | -177.5 | -176.7 | 0 | 0 | 0 | 0 | 111.4 | I243 F250 E252 K257 L258 D259 | I243-V255 HydrophobicContact CD1-CG2 4.06Å; I243-V255 HydrophobicContact CG2-CG2 4.1Å; F250-V255 HydrophobicContact CD1-CG2 4.47Å; E252-V255 PolarHBondContact O-N 3.19Å; V255-K257 PolarHBondContact O-N 3.42Å; V255-K257 VanDerWaalsContact O-N 3.16Å; V255-L258 CarbonylContact O-C 3.41Å; V255-L258 PolarHBondContact O-N 3.49Å; V255-D259 PolarHBondContact O-N 3.24Å |
| 256 | S | 51.3 | Low | 54.2 | Low | 90 Ų | 90 | 100.8 Ų | 100.8 | 63% | 0.629 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | -17.1 | -177.9 | 45.2 | 0 | 0 | 0 | 0 | 114.6 | E252 | E252-S256 WeakPolarHBondContact O-CB 3.33Å; E252-S256 PolarHBondContact O-N 3.05Å; E252-S256 VanDerWaalsContact O-N 3.12Å; E252-S256 PolarHBondContact O-OG 2.82Å |
| 257 | K | 53.2 | Low | 52.7 | Low | 158 Ų | 158 | 103.5 Ų | 103.5 | 69% | 0.687 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107 | -1.9 | 174 | -153.6 | 157.3 | 179.9 | 171.6 | 0 | 113.6 | V255 | V255-K257 PolarHBondContact O-N 3.42Å; V255-K257 VanDerWaalsContact O-N 3.16Å |
| 258 | L | 56.1 | Low | 51 | Low | 21 Ų | 21 | 104.5 Ų | 104.5 | 11% | 0.11 | 58% | 0.584 | C | S | . | * | trans | -100.5 | 4.2 | 169.1 | -73.5 | -179.2 | 0 | 0 | 0 | 111.5 | R236 H239 I243 S254 V255 L260 | R236-L258 HydrophobicContact CB-CD2 3.83Å; R236-L258 HydrophobicContact CG-CD2 3.77Å; H239-L258 HydrophobicContact CB-CD1 3.8Å; I243-L258 HydrophobicContact CD1-CD1 4.36Å; S254-L258 WeakPolarHBondContact O-CB 3.31Å; S254-L258 WeakPolarHBondContact O-CD1 3.43Å; S254-L258 WeakPolarHBondContact O-CG 3.42Å; V255-L258 CarbonylContact O-C 3.41Å; V255-L258 PolarHBondContact O-N 3.49Å; L258-L260 VanDerWaalsContact C-N 3.28Å; L258-L260 VanDerWaalsContact O-CD1 3.3Å; L258-L260 WeakPolarHBondContact O-CD1 3.4Å; L258-L260 PolarHBondContact O-N 3.06Å | ||
| 259 | D | 49.8 | Very low | 49.8 | Very low | 133 Ų | 133 | 104.4 Ų | 104.4 | 71% | 0.711 | 59% | 0.59 | S | S | * | * | trans | -57.4 | 101.7 | 172.6 | -154.5 | 41 | 0 | 0 | 0 | 107.3 | V255 E261 | V255-D259 PolarHBondContact O-N 3.24Å; D259-E261 PolarHBondContact O-N 3.26Å | ||
| 260 | L | 60.6 | Low | 49.1 | Very low | 85 Ų | 85 | 102.4 Ų | 102.4 | 45% | 0.445 | 57% | 0.571 | S | S | . | * | trans | -69.2 | 86.8 | 173.4 | -78 | 106.4 | 0 | 0 | 0 | 103.9 | Y233 L258 A262 | Y233-L260 HydrophobicContact CE2-CD2 3.53Å; Y233-L260 VanDerWaalsContact OH-CD2 3.26Å; Y233-L260 WeakPolarHBondContact OH-CD2 3.32Å; L258-L260 VanDerWaalsContact C-N 3.28Å; L258-L260 VanDerWaalsContact O-CD1 3.3Å; L258-L260 WeakPolarHBondContact O-CD1 3.4Å; L258-L260 PolarHBondContact O-N 3.06Å; L260-A262 VanDerWaalsContact C-N 3.32Å; L260-A262 PolarHBondContact O-N 3.3Å | ||
| 261 | E | 42.9 | Very low | 48.7 | Very low | 167 Ų | 167 | 99.7 Ų | 99.7 | 78% | 0.78 | 56% | 0.563 | S | S | * | * | trans | -47.7 | 107.9 | 160.7 | 55 | -156.9 | 138.4 | 0 | 0 | 106.8 | D259 G263 | D259-E261 PolarHBondContact O-N 3.26Å; E261-G263 PolarHBondContact O-N 2.86Å | ||
| 262 | A | 49.7 | Very low | 48.1 | Very low | 114 Ų | 114 | 102.6 Ų | 102.6 | 94% | 0.942 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.3 | 51.5 | -169.9 | 0 | 0 | 0 | 0 | 0 | 111 | L260 | L260-A262 VanDerWaalsContact C-N 3.32Å; L260-A262 PolarHBondContact O-N 3.3Å |
| 263 | G | 50.1 | Low | 47.8 | Very low | 65 Ų | 65 | 98 Ų | 98 | 67% | 0.67 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -156.2 | 10.5 | -166.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | E261 | E261-G263 PolarHBondContact O-N 2.86Š|
| 264 | F | 38.5 | Very low | 47.3 | Very low | 155 Ų | 155 | 97.2 Ų | 97.2 | 68% | 0.68 | 55% | 0.545 | S | S | * | . | S | Bend | trans | -120.1 | 79.6 | 174.9 | -149.9 | -98.8 | 0 | 0 | 0 | 112.9 | E270 | F264-E270 WeakPolarHBondContact CE1-OE1 3.48Å; F264-E270 WeakPolarHBondContact CE1-OE2 3.49Å |
| 265 | I | 44 | Very low | 47 | Very low | 93 Ų | 93 | 98.6 Ų | 98.6 | 48% | 0.477 | 56% | 0.562 | S | S | . | * | trans | 63.1 | 119.7 | 144.1 | -47.3 | 166.4 | 0 | 0 | 0 | 118.1 | V267 A269 E270 | I265-V267 PolarHBondContact O-N 2.86Å; I265-A269 HydrophobicContact CG2-CB 4.34Å; I265-E270 WeakPolarHBondContact CB-OE2 3.4Å; I265-E270 HydrophobicContact CG2-CB 4.36Å | ||
| 266 | D | 37 | Very low | 46.7 | Very low | 98 Ų | 98 | 103.7 Ų | 103.7 | 52% | 0.524 | 58% | 0.582 | S | S | . | * | trans | -19 | 114 | 155.1 | -175.5 | 27.6 | 0 | 0 | 0 | 114.8 | E268 A269 E270 | D266-E268 PolarHBondContact O-N 3.2Å; D266-E268 PolarHBondContact OD1-N 3.18Å; D266-A269 HydrophobicContact CB-CB 4.26Å; D266-A269 PolarHBondContact O-N 2.93Å; D266-A269 PolarHBondContact OD2-N 3.41Å; D266-E270 PolarHBondContact O-N 3.17Å | ||
| 267 | V | 46.8 | Very low | 46.1 | Very low | 112 Ų | 112 | 109 Ų | 109 | 68% | 0.679 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.1 | -13.2 | 178.4 | 171.3 | 0 | 0 | 0 | 0 | 112 | I265 | I265-V267 PolarHBondContact O-N 2.86Š|
| 268 | E | 41.3 | Very low | 45.4 | Very low | 160 Ų | 160 | 107.1 Ų | 107.1 | 75% | 0.748 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | -27.1 | 176.3 | -59.4 | -164.1 | 143.8 | 0 | 0 | 113.8 | D266 | D266-E268 PolarHBondContact O-N 3.2Å; D266-E268 PolarHBondContact OD1-N 3.18Å |
| 269 | A | 43.9 | Very low | 44.7 | Very low | 61 Ų | 61 | 112.9 Ų | 112.9 | 50% | 0.504 | 64% | 0.64 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.5 | -26.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | I265 D266 I271 | I265-A269 HydrophobicContact CG2-CB 4.34Å; D266-A269 HydrophobicContact CB-CB 4.26Å; D266-A269 PolarHBondContact O-N 2.93Å; D266-A269 PolarHBondContact OD2-N 3.41Å; A269-I271 VanDerWaalsContact C-N 3.3Å; A269-I271 PolarHBondContact O-N 2.7Å |
| 270 | E | 45.6 | Very low | 43.8 | Very low | 61 Ų | 61 | 113 Ų | 113 | 29% | 0.285 | 64% | 0.64 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -92.2 | 29.1 | -174.5 | -149.4 | 170.8 | 137.4 | 0 | 0 | 114.3 | F264 I265 D266 | F264-E270 WeakPolarHBondContact CE1-OE1 3.48Å; F264-E270 WeakPolarHBondContact CE1-OE2 3.49Å; I265-E270 WeakPolarHBondContact CB-OE2 3.4Å; I265-E270 HydrophobicContact CG2-CB 4.36Å; D266-E270 PolarHBondContact O-N 3.17Å |
| 271 | I | 45.7 | Very low | 42.9 | Very low | 88 Ų | 88 | 115.6 Ų | 115.6 | 45% | 0.451 | 66% | 0.66 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83 | -7.4 | 172.5 | -43.6 | 178.8 | 0 | 0 | 0 | 110.7 | A269 | A269-I271 VanDerWaalsContact C-N 3.3Å; A269-I271 PolarHBondContact O-N 2.7Å |
| 272 | H | 45 | Very low | 42.5 | Very low | 140 Ų | 140 | 113.9 Ų | 113.9 | 65% | 0.648 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -123 | -8.8 | -174.4 | -62.8 | 110.1 | 0 | 0 | 0 | 115.9 | K200 | K200-H272 PolarHBondContact NZ-NE2 3.22Š|
| 273 | S | 43.4 | Very low | 42.4 | Very low | 77 Ų | 77 | 117.7 Ų | 117.7 | 54% | 0.538 | 66% | 0.655 | S | S | . | * | trans | -108.8 | 64.2 | -178.3 | -158.1 | 0 | 0 | 0 | 0 | 112 | G275 | S273-G275 VanDerWaalsContact C-N 3.28Å; S273-G275 PolarHBondContact O-N 2.92Å | ||
| 274 | D | 43.1 | Very low | 41.9 | Very low | 81 Ų | 81 | 122.5 Ų | 122.5 | 43% | 0.433 | 66% | 0.66 | S | S | . | * | trans | -89.9 | 84 | 151.2 | -74.8 | -48.3 | 0 | 0 | 0 | 105.3 | K206 K229 | K206-D274 IonicContact NZ-OD2 3.02Å; K229-D274 IonicContact NZ-OD1 2.7Å; K229-D274 PolarHBondContact NZ-OD1 3.2Å | ||
| 275 | G | 47 | Very low | 41.7 | Very low | 46 Ų | 46 | 119.5 Ų | 119.5 | 47% | 0.474 | 66% | 0.658 | S | S | . | * | trans | -52.1 | 133.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | S273 | S273-G275 VanDerWaalsContact C-N 3.28Å; S273-G275 PolarHBondContact O-N 2.92Å | ||
| 276 | E | 46 | Very low | 41.5 | Very low | 173 Ų | 173 | 120.8 Ų | 120.8 | 81% | 0.808 | 68% | 0.675 | S | S | * | * | trans | 12 | 122.3 | 155.6 | 50.7 | -113.2 | 86 | 0 | 0 | 120.6 | ||||
| 277 | Q | 38 | Very low | 41.3 | Very low | 201 Ų | 201 | 123.8 Ų | 123.8 | 94% | 0.939 | 69% | 0.69 | S | S | * | * | -143.9 | 90.5 | 115.3 | -78.1 | -167.9 | 23 | 0 | 0 | 107.4 | |||||
| 278 | S | 38.2 | Very low | 40.6 | Very low | 119 Ų | 119 | 128.8 Ų | 128.8 | 83% | 0.832 | 70% | 0.703 | S | S | * | * | trans | -124.1 | 93.8 | 162.2 | -83.1 | 0 | 0 | 0 | 0 | 106.3 | D280 | S278-D280 PolarHBondContact O-N 3.47Š| ||
| 279 | T | 41.9 | Very low | 40.3 | Very low | 141 Ų | 141 | 125.7 Ų | 125.7 | 87% | 0.865 | 71% | 0.705 | S | S | * | * | trans | -77.2 | 94.2 | 153 | 49.5 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 280 | D | 31.1 | Very low | 39.7 | Very low | 135 Ų | 135 | 132.1 Ų | 132.1 | 72% | 0.722 | 73% | 0.725 | S | S | * | * | trans | -139.8 | 110.1 | 156.6 | -133.2 | -86.6 | 0 | 0 | 0 | 107.2 | S278 | S278-D280 PolarHBondContact O-N 3.47Š| ||
| 281 | T | 41.2 | Very low | 39 | Very low | 140 Ų | 140 | 133.9 Ų | 133.9 | 86% | 0.859 | 75% | 0.749 | S | S | * | * | trans | -82.7 | 110.3 | 165.5 | 40.7 | 0 | 0 | 0 | 0 | 107 | ||||
| 282 | D | 34.7 | Very low | 38.4 | Very low | 131 Ų | 131 | 135.2 Ų | 135.2 | 70% | 0.701 | 77% | 0.767 | S | S | * | * | trans | -129.6 | 94.1 | 158.1 | 64 | -74 | 0 | 0 | 0 | 109.7 | E284 | D282-E284 PolarHBondContact O-N 3.42Š| ||
| 283 | E | 47 | Very low | 37.7 | Very low | 194 Ų | 194 | 135.3 Ų | 135.3 | 91% | 0.907 | 77% | 0.772 | S | S | * | * | trans | -74.3 | 105.3 | 154 | -71.2 | -81.7 | 118.5 | 0 | 0 | 107 | ||||
| 284 | E | 39.6 | Very low | 37.5 | Very low | 167 Ų | 167 | 141.4 Ų | 141.4 | 78% | 0.78 | 79% | 0.789 | S | S | * | * | trans | -146.3 | 109.1 | 158.7 | -109.5 | -116.6 | 89 | 0 | 0 | 111.2 | D282 | D282-E284 PolarHBondContact O-N 3.42Š| ||
| 285 | S | 34.3 | Very low | 37 | Very low | 92 Ų | 92 | 143.9 Ų | 143.9 | 64% | 0.643 | 81% | 0.807 | S | S | * | * | trans | 64.9 | 80.8 | 131.8 | -57.8 | 0 | 0 | 0 | 0 | 117.6 | L287 | S285-L287 PolarHBondContact O-N 2.9Š| ||
| 286 | S | 39.8 | Very low | 36.4 | Very low | 119 Ų | 119 | 147 Ų | 147 | 83% | 0.832 | 82% | 0.821 | S | S | * | * | trans | -60.8 | 120.9 | 136.8 | -71.5 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 287 | L | 34.5 | Very low | 36.4 | Very low | 162 Ų | 162 | 144.7 Ų | 144.7 | 85% | 0.848 | 82% | 0.821 | S | S | * | * | trans | 167.8 | 82.9 | 143.5 | -88 | 169.3 | 0 | 0 | 0 | 108.7 | S285 | S285-L287 PolarHBondContact O-N 2.9Š| ||
| 288 | F | 30.6 | Very low | 35.9 | Very low | 217 Ų | 217 | 138.7 Ų | 138.7 | 95% | 0.952 | 81% | 0.813 | S | S | * | * | trans | -110 | 104.6 | 151.6 | -89.1 | -80 | 0 | 0 | 0 | 107.6 | ||||
| 289 | A | 34.7 | Very low | 36.3 | Very low | 94 Ų | 94 | 139 Ų | 139 | 78% | 0.777 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 132.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||
| 290 | E | 31.9 | Very low | 36.6 | Very low | 197 Ų | 197 | 137.2 Ų | 137.2 | 92% | 0.921 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 131.9 | 169 | -167.8 | 163.5 | 88.1 | 0 | 0 | 109.3 | ||
| 291 | A | 30.5 | Very low | 36.7 | Very low | 97 Ų | 97 | 137.1 Ų | 137.1 | 80% | 0.802 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 133.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 292 | S | 33 | Very low | 37 | Very low | 117 Ų | 117 | 135.5 Ų | 135.5 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | -146.8 | 131.2 | 156.5 | -141.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 293 | D | 32.1 | Very low | 36.9 | Very low | 142 Ų | 142 | 136.9 Ų | 136.9 | 76% | 0.759 | 81% | 0.805 | S | S | * | * | trans | -44.6 | 141.4 | -178.3 | -66.1 | -106.6 | 0 | 0 | 0 | 116.6 | ||||
| 294 | K | 38.8 | Very low | 36.1 | Very low | 205 Ų | 205 | 134.2 Ų | 134.2 | 89% | 0.891 | 80% | 0.797 | S | S | * | * | 173.3 | 151.6 | 105.7 | -88 | -179.4 | -164.3 | -59.8 | 0 | 112 | |||||
| 295 | V | 31.9 | Very low | 35.8 | Very low | 133 Ų | 133 | 133.1 Ų | 133.1 | 81% | 0.806 | 80% | 0.795 | S | S | * | * | trans | -105.3 | 152.8 | -164.7 | 44.3 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 296 | S | 34.4 | Very low | 35.6 | Very low | 110 Ų | 110 | 132.9 Ų | 132.9 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | trans | 106.8 | 155 | 149.9 | -105.9 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 297 | P | 46.6 | Very low | 35.2 | Very low | 126 Ų | 126 | 133 Ų | 133 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | -136 | 171.5 | -112 | 35.3 | -12.7 | 0 | 0 | 0 | 116.8 | |||||
| 298 | G | 26.6 | Very low | 35.3 | Very low | 74 Ų | 74 | 137.8 Ų | 137.8 | 76% | 0.763 | 81% | 0.806 | S | S | * | * | trans | 144 | 127.4 | 156.9 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 299 | P | 46.5 | Very low | 35.4 | Very low | 126 Ų | 126 | 131.3 Ų | 131.3 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | trans | -107.5 | -168.7 | 175.1 | 43.7 | -33.6 | 0 | 0 | 0 | 112 | ||||
| 300 | P | 48.5 | Very low | 35.1 | Very low | 104 Ų | 104 | 130.4 Ų | 130.4 | 68% | 0.675 | 80% | 0.801 | S | S | * | * | cis | -144.8 | 165.9 | 8.8 | 42.8 | -21.9 | 0 | 0 | 0 | 120.2 | ||||
| 301 | V | 34.5 | Very low | 35.2 | Very low | 133 Ų | 133 | 132.3 Ų | 132.3 | 81% | 0.806 | 80% | 0.801 | S | S | * | * | trans | 44.2 | 170.3 | 144.8 | -70.7 | 0 | 0 | 0 | 0 | 125.1 | ||||
| 302 | P | 46.6 | Very low | 35.3 | Very low | 105 Ų | 105 | 136.9 Ų | 136.9 | 68% | 0.682 | 81% | 0.805 | S | S | * | * | cis | -140 | -176.2 | -25.4 | 28.2 | -4 | 0 | 0 | 0 | 116.8 | ||||
| 303 | L | 33.4 | Very low | 35.1 | Very low | 160 Ų | 160 | 134.4 Ų | 134.4 | 84% | 0.838 | 80% | 0.799 | S | S | * | * | trans | 121.5 | 150.1 | 155.3 | -92.8 | 95.1 | 0 | 0 | 0 | 114.4 | ||||
| 304 | D | 28.8 | Very low | 35.1 | Very low | 139 Ų | 139 | 132.4 Ų | 132.4 | 74% | 0.743 | 80% | 0.796 | S | S | * | * | cis | -174.6 | 165.2 | -38.5 | -156 | -49.9 | 0 | 0 | 0 | 105.5 | ||||
| 305 | I | 34 | Very low | 34.8 | Very low | 143 Ų | 143 | 129 Ų | 129 | 73% | 0.733 | 79% | 0.787 | S | S | * | * | trans | 92.7 | 96.7 | 155.7 | -54.4 | 161.2 | 0 | 0 | 0 | 120.6 | ||||
| 306 | A | 29.6 | Very low | 34.8 | Very low | 88 Ų | 88 | 129.8 Ų | 129.8 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | 59.6 | 128.3 | 119.7 | 0 | 0 | 0 | 0 | 0 | 125 | |||||
| 307 | S | 32.4 | Very low | 34.8 | Very low | 121 Ų | 121 | 132.2 Ų | 132.2 | 85% | 0.846 | 78% | 0.781 | S | S | * | * | -179 | 103.7 | 128.8 | -79.6 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 308 | R | 35.4 | Very low | 34.4 | Very low | 262 Ų | 262 | 131.4 Ų | 131.4 | 99% | 0.989 | 78% | 0.778 | S | S | * | * | 74.1 | 117.7 | 75.9 | -141.4 | -175 | -154.8 | -141.4 | 5.9 | 115.6 | |||||
| 309 | G | 32.2 | Very low | 35 | Very low | 82 Ų | 82 | 136.3 Ų | 136.3 | 85% | 0.845 | 79% | 0.786 | S | S | * | * | trans | 126.3 | 113 | 164.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 310 | G | 30.3 | Very low | 34.4 | Very low | 74 Ų | 74 | 134.4 Ų | 134.4 | 76% | 0.763 | 79% | 0.789 | S | S | * | * | cis | 126.6 | 95.2 | 12.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 311 | Y | 32.1 | Very low | 33.8 | Very low | 237 Ų | 237 | 132.9 Ų | 132.9 | 93% | 0.929 | 79% | 0.792 | S | S | * | * | trans | -165.3 | 134.4 | 144.8 | 53.8 | -93.1 | 0 | 0 | 0 | 110.4 | ||||
| 312 | H | 33.5 | Very low | 34.3 | Very low | 193 Ų | 193 | 132.5 Ų | 132.5 | 89% | 0.894 | 79% | 0.792 | S | S | * | * | trans | -133.4 | 145.4 | 174.6 | -172 | -86.7 | 0 | 0 | 0 | 107.2 | ||||
| 313 | G | 29.8 | Very low | 33.9 | Very low | 66 Ų | 66 | 136.2 Ų | 136.2 | 68% | 0.68 | 80% | 0.803 | S | S | * | * | trans | 139.8 | 92.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 314 | S | 30.4 | Very low | 34.3 | Very low | 100 Ų | 100 | 138.3 Ų | 138.3 | 70% | 0.699 | 81% | 0.805 | S | S | * | * | 72.5 | 127.3 | 63.6 | -166 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 315 | L | 32.9 | Very low | 34.8 | Very low | 133 Ų | 133 | 137.3 Ų | 137.3 | 70% | 0.696 | 80% | 0.804 | S | S | * | * | trans | 98.8 | 132.1 | 147.3 | -106.6 | 163.4 | 0 | 0 | 0 | 119.7 | ||||
| 316 | E | 32.5 | Very low | 35 | Very low | 150 Ų | 150 | 136.2 Ų | 136.2 | 70% | 0.701 | 81% | 0.806 | S | S | * | * | trans | 70.2 | 151.7 | 158.5 | -44.4 | -76.6 | 58.7 | 0 | 0 | 116.6 | ||||
| 317 | E | 33.3 | Very low | 35.6 | Very low | 160 Ų | 160 | 139 Ų | 139 | 75% | 0.748 | 81% | 0.808 | S | S | * | * | cis | 177.5 | 163.8 | -15.8 | 177.9 | 145.4 | 83.1 | 0 | 0 | 104 | ||||
| 318 | S | 39 | Very low | 35.9 | Very low | 110 Ų | 110 | 141.1 Ų | 141.1 | 77% | 0.769 | 81% | 0.808 | S | S | * | * | trans | 88.2 | 94.9 | 159.8 | -68.8 | 0 | 0 | 0 | 0 | 120 | ||||
| 319 | L | 39.5 | Very low | 36.3 | Very low | 177 Ų | 177 | 135.9 Ų | 135.9 | 93% | 0.927 | 80% | 0.799 | S | S | * | * | trans | -41.9 | 144.4 | 145.4 | -61.1 | 159.9 | 0 | 0 | 0 | 114.3 | ||||
| 320 | G | 34.4 | Very low | 36.8 | Very low | 86 Ų | 86 | 139.1 Ų | 139.1 | 89% | 0.887 | 80% | 0.795 | S | S | * | * | trans | 95.3 | 96.9 | 137.7 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 321 | G | 35.3 | Very low | 37.4 | Very low | 71 Ų | 71 | 141.1 Ų | 141.1 | 73% | 0.732 | 79% | 0.794 | S | S | * | * | trans | -150.5 | 132.4 | 163.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 322 | P | 44.8 | Very low | 37.6 | Very low | 125 Ų | 125 | 139.9 Ų | 139.9 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -83.7 | 141.5 | -157.7 | 31.4 | -35.7 | 0 | 0 | 0 | 115.3 | K324 | P322-K324 PolarHBondContact O-N 3.49Š|
| 323 | M | 38.3 | Very low | 37.9 | Very low | 183 Ų | 183 | 136.2 Ų | 136.2 | 90% | 0.901 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 126.2 | 169.2 | -78.1 | 169.9 | 61.2 | 0 | 0 | 111.5 | ||
| 324 | K | 41.2 | Very low | 38.1 | Very low | 204 Ų | 204 | 136.8 Ų | 136.8 | 89% | 0.887 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 123.3 | 168.8 | -107.2 | 78 | 161.9 | -172.7 | 0 | 109.6 | P322 | P322-K324 PolarHBondContact O-N 3.49Š|
| 325 | V | 40.3 | Very low | 38.6 | Very low | 118 Ų | 118 | 139.5 Ų | 139.5 | 72% | 0.715 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -97.2 | 126.7 | 169.1 | -165.3 | 0 | 0 | 0 | 0 | 107.8 | I327 | V325-I327 PolarHBondContact O-N 3.08Š|
| 326 | P | 38.7 | Very low | 38.8 | Very low | 121 Ų | 121 | 139 Ų | 139 | 79% | 0.786 | 81% | 0.806 | S | S | * | * | trans | -77.6 | 108.7 | 173.9 | 28.8 | -29.7 | 0 | 0 | 0 | 110 | ||||
| 327 | I | 40.8 | Very low | 38.7 | Very low | 147 Ų | 147 | 140.2 Ų | 140.2 | 75% | 0.754 | 82% | 0.816 | S | S | * | * | trans | -82 | 116.1 | 170.3 | -62.3 | 172.2 | 0 | 0 | 0 | 108 | V325 I329 | V325-I327 PolarHBondContact O-N 3.08Å; I327-I329 PolarHBondContact O-N 3.11Å | ||
| 328 | L | 38.4 | Very low | 38.6 | Very low | 165 Ų | 165 | 137.4 Ų | 137.4 | 86% | 0.864 | 82% | 0.82 | S | S | * | * | trans | -72.6 | 113.1 | 168.2 | -86.9 | 124.3 | 0 | 0 | 0 | 109.7 | ||||
| 329 | I | 44.1 | Very low | 38.2 | Very low | 152 Ų | 152 | 137.7 Ų | 137.7 | 78% | 0.779 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 117.6 | 172.4 | -61.2 | 171.5 | 0 | 0 | 0 | 108.2 | I327 | I327-I329 PolarHBondContact O-N 3.11Š|
| 330 | I | 42.9 | Very low | 37.8 | Very low | 149 Ų | 149 | 138.9 Ų | 138.9 | 76% | 0.764 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -92.2 | 118.6 | 170.2 | -58.8 | 170.8 | 0 | 0 | 0 | 107.9 | K332 | I330-K332 PolarHBondContact O-N 3.35Š|
| 331 | P | 42.8 | Very low | 37.8 | Very low | 117 Ų | 117 | 138.4 Ų | 138.4 | 76% | 0.76 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 118.3 | 171.6 | 27.8 | -29.1 | 0 | 0 | 0 | 110.6 | ||
| 332 | K | 35.8 | Very low | 37.7 | Very low | 210 Ų | 210 | 140.1 Ų | 140.1 | 91% | 0.913 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -77 | 116.9 | 167.4 | -98.3 | 176.2 | 164.2 | 173.1 | 0 | 109.2 | I330 | I330-K332 PolarHBondContact O-N 3.35Š|
| 333 | S | 41.1 | Very low | 37 | Very low | 117 Ų | 117 | 143.5 Ų | 143.5 | 82% | 0.818 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -78 | 124.6 | 165.3 | 45.3 | 0 | 0 | 0 | 0 | 110 | ||
| 334 | G | 34.3 | Very low | 36.6 | Very low | 78 Ų | 78 | 144.8 Ų | 144.8 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -86.2 | 139.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 335 | I | 40.1 | Very low | 36.2 | Very low | 157 Ų | 157 | 142.9 Ų | 142.9 | 81% | 0.805 | 82% | 0.819 | S | S | * | * | trans | -117.2 | 130.5 | 164.9 | -49.8 | 170.2 | 0 | 0 | 0 | 105.3 | ||||
| 336 | P | 37 | Very low | 35.5 | Very low | 122 Ų | 122 | 142.9 Ų | 142.9 | 79% | 0.792 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 128.8 | 176.8 | 30.1 | -29.9 | 0 | 0 | 0 | 110.7 | ||
| 337 | L | 31.6 | Very low | 35.3 | Very low | 175 Ų | 175 | 142 Ų | 142 | 92% | 0.916 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -93.2 | 138.7 | 162.9 | -79.6 | 172.2 | 0 | 0 | 0 | 109.6 | ||
| 338 | A | 29.3 | Very low | 34.8 | Very low | 101 Ų | 101 | 142.8 Ų | 142.8 | 84% | 0.835 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 143.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 339 | S | 31.9 | Very low | 34.6 | Very low | 116 Ų | 116 | 142.6 Ų | 142.6 | 81% | 0.811 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 134.2 | -179.5 | 50.8 | 0 | 0 | 0 | 0 | 113.4 | ||
| 340 | E | 31.1 | Very low | 34.3 | Very low | 202 Ų | 202 | 142.5 Ų | 142.5 | 94% | 0.944 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 130.1 | 160.5 | -72.8 | -175 | 117.8 | 0 | 0 | 110.5 | ||
| 341 | G | 33 | Very low | 34.3 | Very low | 77 Ų | 77 | 141.2 Ų | 141.2 | 79% | 0.794 | 82% | 0.82 | S | S | * | * | trans | -107.9 | 119.2 | 168.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 342 | S | 33.9 | Very low | 33.9 | Very low | 106 Ų | 106 | 142.5 Ų | 142.5 | 74% | 0.741 | 82% | 0.82 | S | S | * | * | trans | -62.4 | 134.4 | 169.8 | 175.8 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 343 | Q | 30.9 | Very low | 34 | Very low | 196 Ų | 196 | 138.7 Ų | 138.7 | 92% | 0.916 | 82% | 0.817 | S | S | * | * | trans | -142.6 | 119.3 | 147.2 | -68.6 | -168.1 | 10.9 | 0 | 0 | 110.9 | ||||
| 344 | Y | 30.2 | Very low | 33.6 | Very low | 211 Ų | 211 | 137.8 Ų | 137.8 | 83% | 0.827 | 81% | 0.811 | S | S | * | * | trans | -65 | 140.7 | 158.9 | -110.6 | -111.3 | 0 | 0 | 0 | 109.7 | ||||
| 345 | L | 32.9 | Very low | 33.9 | Very low | 163 Ų | 163 | 141.7 Ų | 141.7 | 85% | 0.853 | 81% | 0.812 | S | S | * | * | 168.3 | 140.7 | 122.4 | -88.3 | 171.4 | 0 | 0 | 0 | 112.9 | |||||
| 346 | S | 25.1 | Very low | 33.4 | Very low | 118 Ų | 118 | 141.7 Ų | 141.7 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | trans | 92.4 | 109.8 | 147.1 | -133.8 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 347 | S | 33.8 | Very low | 33.6 | Very low | 104 Ų | 104 | 139.5 Ų | 139.5 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | trans | -58.3 | 145.8 | 160.6 | 173.3 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 348 | E | 30.4 | Very low | 33.8 | Very low | 163 Ų | 163 | 140.5 Ų | 140.5 | 76% | 0.762 | 80% | 0.803 | S | S | * | * | 179.8 | 127.1 | 129.5 | -84.8 | -116.3 | 112.7 | 0 | 0 | 112.6 | |||||
| 349 | M | 34.4 | Very low | 34.6 | Very low | 160 Ų | 160 | 140.2 Ų | 140.2 | 79% | 0.788 | 80% | 0.8 | S | S | * | * | trans | 62.2 | 116 | 137.8 | -64.8 | -79.7 | 142.8 | 0 | 0 | 121.9 | ||||
| 350 | L | 38.1 | Very low | 34.8 | Very low | 150 Ų | 150 | 141.5 Ų | 141.5 | 79% | 0.785 | 80% | 0.798 | S | S | * | * | trans | -61.2 | 159.4 | 156.7 | -72.7 | 167.3 | 0 | 0 | 0 | 111.5 | ||||
| 351 | P | 42 | Very low | 35.8 | Very low | 122 Ų | 122 | 139.2 Ų | 139.2 | 79% | 0.792 | 79% | 0.793 | S | S | * | * | -142.3 | 150.5 | 85.7 | 31.4 | -12.1 | 0 | 0 | 0 | 115.6 | |||||
| 352 | N | 35.2 | Very low | 36.7 | Very low | 145 Ų | 145 | 139.6 Ų | 139.6 | 78% | 0.775 | 78% | 0.783 | S | S | * | * | trans | -53.8 | 157.8 | 162.4 | -77.2 | -37.9 | 0 | 0 | 0 | 112.2 | ||||
| 353 | P | 38.4 | Very low | 37.7 | Very low | 129 Ų | 129 | 140 Ų | 140 | 84% | 0.838 | 77% | 0.773 | S | S | * | * | -128.9 | 146.5 | 124.6 | 34.6 | -24.8 | 0 | 0 | 0 | 113 | |||||
| 354 | S | 32.6 | Very low | 39.2 | Very low | 99 Ų | 99 | 135 Ų | 135 | 69% | 0.692 | 76% | 0.756 | S | S | * | * | trans | -99.1 | 156.2 | 177.6 | -172.6 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 355 | L | 39 | Very low | 40.3 | Very low | 159 Ų | 159 | 131 Ų | 131 | 83% | 0.832 | 75% | 0.753 | S | S | * | * | trans | 76.8 | 116.9 | 160.4 | -45.2 | -178.4 | 0 | 0 | 0 | 118.3 | ||||
| 356 | N | 30.9 | Very low | 41.2 | Very low | 157 Ų | 157 | 131.8 Ų | 131.8 | 84% | 0.84 | 75% | 0.75 | S | S | * | * | -177.1 | 139.2 | 99.5 | -159.8 | -26.5 | 0 | 0 | 0 | 110.8 | |||||
| 357 | A | 41 | Very low | 42.6 | Very low | 76 Ų | 76 | 131.1 Ų | 131.1 | 63% | 0.628 | 73% | 0.734 | S | S | * | * | trans | -72.8 | 134.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 358 | K | 34.6 | Very low | 43.7 | Very low | 196 Ų | 196 | 133 Ų | 133 | 85% | 0.852 | 73% | 0.729 | S | S | * | * | trans | -150 | 130.3 | 133.7 | -71.8 | -52.7 | 166.9 | 178.9 | 0 | 109.8 | ||||
| 359 | A | 46.6 | Very low | 44.9 | Very low | 95 Ų | 95 | 130.6 Ų | 130.6 | 79% | 0.785 | 72% | 0.721 | S | S | * | * | trans | -66.2 | 127.7 | 170 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 360 | D | 37.3 | Very low | 46.1 | Very low | 143 Ų | 143 | 126.3 Ų | 126.3 | 77% | 0.765 | 71% | 0.711 | S | S | * | * | trans | -128.3 | 93.8 | 165.6 | -134.5 | -37.8 | 0 | 0 | 0 | 108 | S362 | D360-S362 PolarHBondContact O-N 3.42Š| ||
| 361 | D | 52.1 | Low | 47.1 | Very low | 154 Ų | 154 | 126.6 Ų | 126.6 | 82% | 0.824 | 71% | 0.712 | S | S | * | * | trans | -74.3 | 66.4 | 174.9 | -103 | -46.3 | 0 | 0 | 0 | 109.6 | ||||
| 362 | S | 50.7 | Low | 47.9 | Very low | 86 Ų | 86 | 131 Ų | 131 | 60% | 0.601 | 71% | 0.713 | S | S | * | * | trans | -112.3 | 48.9 | 175.1 | 73.6 | 0 | 0 | 0 | 0 | 111.7 | D360 T364 | D360-S362 PolarHBondContact O-N 3.42Å; S362-T364 PolarHBondContact O-N 3.06Å; S362-T364 VanDerWaalsContact O-N 3.15Å | ||
| 363 | H | 55.8 | Low | 48.5 | Very low | 114 Ų | 114 | 133.7 Ų | 133.7 | 53% | 0.528 | 73% | 0.727 | S | S | . | * | trans | -77.1 | 97.8 | 164.3 | -76.5 | -65.1 | 0 | 0 | 0 | 109.4 | V365 Q367 | H363-V365 PolarHBondContact O-N 3.16Å; H363-Q367 PolarHBondContact ND1-OE1 3.46Å | ||
| 364 | T | 61.3 | Low | 49 | Very low | 92 Ų | 92 | 134 Ų | 134 | 56% | 0.564 | 72% | 0.721 | S | S | * | * | trans | -54.4 | 138.2 | 170.9 | 63.1 | 0 | 0 | 0 | 0 | 109.7 | S362 K366 Q367 | S362-T364 PolarHBondContact O-N 3.06Å; S362-T364 VanDerWaalsContact O-N 3.15Å; T364-K366 PolarHBondContact O-N 2.92Å; T364-Q367 PolarHBondContact O-N 3.05Å | ||
| 365 | V | 55.1 | Low | 49.9 | Very low | 126 Ų | 126 | 135.8 Ų | 135.8 | 76% | 0.764 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -50.1 | -25.3 | -178.5 | 174.5 | 0 | 0 | 0 | 0 | 112.9 | H363 K368 L369 | H363-V365 PolarHBondContact O-N 3.16Å; V365-K368 PolarHBondContact O-N 3.49Å; V365-L369 PolarHBondContact O-N 3.34Å |
| 366 | K | 51.3 | Low | 50.5 | Low | 179 Ų | 179 | 134.5 Ų | 134.5 | 78% | 0.778 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -62.4 | -38.2 | 172.8 | -89.3 | -178.4 | 169.3 | 178.8 | 0 | 114.1 | T364 L369 A370 | T364-K366 PolarHBondContact O-N 2.92Å; K366-L369 PolarHBondContact O-N 3.31Å; K366-A370 PolarHBondContact O-N 2.86Å |
| 367 | Q | 54.8 | Low | 51.6 | Low | 105 Ų | 105 | 133.2 Ų | 133.2 | 49% | 0.491 | 71% | 0.709 | S | S | . | * | H | α-helix | trans | -70.6 | -33.5 | 178.7 | -117 | 178 | -8 | 0 | 0 | 112.1 | H363 T364 | H363-Q367 PolarHBondContact ND1-OE1 3.46Å; T364-Q367 PolarHBondContact O-N 3.05Å |
| 368 | K | 56.8 | Low | 52.3 | Low | 142 Ų | 142 | 136.8 Ų | 136.8 | 62% | 0.617 | 71% | 0.714 | S | S | * | * | H | α-helix | trans | -73.8 | -23.7 | 175.7 | -77.6 | -178 | 174.4 | 176 | 0 | 113.4 | V365 | V365-K368 PolarHBondContact O-N 3.49Å |
| 369 | L | 55.7 | Low | 53.5 | Low | 113 Ų | 113 | 132.8 Ų | 132.8 | 59% | 0.592 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -79.6 | -33.9 | 175.1 | -167.6 | 66.9 | 0 | 0 | 0 | 112 | V365 K366 L371 R372 | V365-L369 PolarHBondContact O-N 3.34Å; K366-L369 PolarHBondContact O-N 3.31Å; L369-L371 VanDerWaalsContact C-N 3.28Å; L369-L371 PolarHBondContact O-N 2.98Å; L369-R372 PolarHBondContact O-N 3.25Å |
| 370 | A | 57.9 | Low | 54 | Low | 71 Ų | 71 | 135.5 Ų | 135.5 | 59% | 0.587 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -70.8 | -19.3 | 179 | 0 | 0 | 0 | 0 | 0 | 114.3 | K366 | K366-A370 PolarHBondContact O-N 2.86Å |
| 371 | L | 59.8 | Low | 55.3 | Low | 155 Ų | 155 | 134.9 Ų | 134.9 | 81% | 0.812 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.4 | -1.2 | 175.6 | -74.8 | 164.6 | 0 | 0 | 0 | 113.3 | L369 | L369-L371 VanDerWaalsContact C-N 3.28Å; L369-L371 PolarHBondContact O-N 2.98Å |
| 372 | R | 59.6 | Low | 55.5 | Low | 215 Ų | 215 | 133.3 Ų | 133.3 | 81% | 0.811 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108 | -13.2 | -179.2 | -125.5 | -174.6 | -148.3 | 134.3 | 2.2 | 113.9 | L369 | L369-R372 PolarHBondContact O-N 3.25Š|
| 373 | L | 47.6 | Very low | 56 | Low | 202 Ų | 202 | 137.6 Ų | 137.6 | 100% | 1.058 | 69% | 0.691 | S | S | * | * | trans | -93.5 | 0 | 165.8 | -67.8 | 171.3 | 0 | 0 | 0 | 108 |
Retrieved 373 of 373 residues in 664 ms
(Link to these results)