| 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 | 47.5 | Very low | 42.9 | Very low | 237 Ų | 237 | 175.2 Ų | 175.2 | 100% | 1.167 | 91% | 0.907 | S | S | * | * | 0 | 118.6 | 0 | -71.3 | 175.1 | 177.4 | 0 | 0 | 108.2 | |||||
| 2 | M | 38.7 | Very low | 43.1 | Very low | 196 Ų | 196 | 167.1 Ų | 167.1 | 97% | 0.966 | 90% | 0.899 | S | S | * | * | trans | 178.4 | 100.9 | 148.9 | -100 | 155.4 | 161 | 0 | 0 | 107.5 | ||||
| 3 | T | 43.3 | Very low | 43.6 | Very low | 140 Ų | 140 | 161.9 Ų | 161.9 | 86% | 0.859 | 87% | 0.871 | S | S | * | * | trans | -81.9 | 129.8 | 178.6 | 43.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 4 | K | 51.6 | Low | 44.2 | Very low | 206 Ų | 206 | 158.8 Ų | 158.8 | 90% | 0.896 | 86% | 0.86 | S | S | * | * | trans | -108.5 | 117.7 | 162.5 | -85.5 | -178.4 | 175.9 | 177.1 | 0 | 108.7 | ||||
| 5 | R | 40.8 | Very low | 44.7 | Very low | 243 Ų | 243 | 153.7 Ų | 153.7 | 92% | 0.917 | 84% | 0.841 | S | S | * | * | trans | -66.3 | 139 | 179.4 | -93.2 | -178.3 | 171.1 | 179.5 | -2.4 | 111.2 | ||||
| 6 | F | 36.8 | Very low | 45.2 | Very low | 214 Ų | 214 | 153.1 Ų | 153.1 | 94% | 0.939 | 83% | 0.83 | S | S | * | * | trans | -69.5 | 133.7 | 161 | -76.9 | -94.5 | 0 | 0 | 0 | 110.5 | ||||
| 7 | G | 40.2 | Very low | 45.6 | Very low | 75 Ų | 75 | 152.8 Ų | 152.8 | 77% | 0.773 | 83% | 0.827 | S | S | * | * | trans | -119.2 | 132.7 | 168.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 8 | K | 39.4 | Very low | 45.9 | Very low | 205 Ų | 205 | 150.2 Ų | 150.2 | 89% | 0.891 | 82% | 0.817 | S | S | * | * | trans | -53.6 | 149.8 | -179 | -78.8 | 172 | 163.3 | 175.4 | 0 | 114.2 | ||||
| 9 | P | 46.9 | Very low | 46.1 | Very low | 135 Ų | 135 | 146.9 Ų | 146.9 | 88% | 0.877 | 81% | 0.806 | S | S | * | * | trans | -82.4 | 123.3 | 159.1 | 32.6 | -27.6 | 0 | 0 | 0 | 109.9 | ||||
| 10 | G | 36 | Very low | 46.1 | Very low | 72 Ų | 72 | 144.6 Ų | 144.6 | 74% | 0.742 | 80% | 0.801 | S | S | * | * | trans | -109.8 | 122.5 | 168.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 11 | E | 50.4 | Low | 46.1 | Very low | 204 Ų | 204 | 143.8 Ų | 143.8 | 95% | 0.953 | 80% | 0.795 | S | S | * | * | trans | 44.1 | 99.5 | 132.3 | -156.3 | 170 | -177.5 | 0 | 0 | 117.3 | ||||
| 12 | G | 45.3 | Very low | 46.1 | Very low | 78 Ų | 78 | 136.3 Ų | 136.3 | 80% | 0.804 | 77% | 0.771 | S | S | * | * | trans | -179.1 | 98.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 13 | D | 50.4 | Low | 46.7 | Very low | 100 Ų | 100 | 138.4 Ų | 138.4 | 54% | 0.535 | 77% | 0.768 | S | S | . | * | trans | 78.6 | 75.6 | 158.2 | -148.3 | 5.6 | 0 | 0 | 0 | 119.5 | S15 E16 | D13-S15 PolarHBondContact OD1-N 3.37Å; D13-E16 PolarHBondContact OD1-N 3.42Å | ||
| 14 | V | 50.8 | Low | 46.8 | Very low | 118 Ų | 118 | 138.9 Ų | 138.9 | 72% | 0.715 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -97.9 | 0.4 | 157.6 | -66.6 | 0 | 0 | 0 | 0 | 112.1 | V18 | V14-V18 WeakPolarHBondContact O-CG2 3.42Š|
| 15 | S | 51.8 | Low | 46.6 | Very low | 83 Ų | 83 | 136.4 Ų | 136.4 | 58% | 0.58 | 76% | 0.761 | S | S | * | * | H | α-helix | trans | -80.2 | -29.2 | -173.7 | -60 | 0 | 0 | 0 | 0 | 112.1 | D13 S19 | D13-S15 PolarHBondContact OD1-N 3.37Å; S15-S19 PolarHBondContact O-N 3.5Å; S15-S19 PolarHBondContact O-OG 3.22Å; S15-S19 VanDerWaalsContact O-OG 3.04Å |
| 16 | E | 52.5 | Low | 47.1 | Very low | 144 Ų | 144 | 133.9 Ų | 133.9 | 67% | 0.673 | 76% | 0.759 | S | S | * | * | H | α-helix | trans | -73.3 | -31.4 | 177.1 | -148.2 | -178.8 | -165 | 0 | 0 | 112.7 | D13 | D13-E16 PolarHBondContact OD1-N 3.42Å |
| 17 | L | 52.1 | Low | 47.5 | Very low | 147 Ų | 147 | 131.1 Ų | 131.1 | 77% | 0.77 | 76% | 0.755 | S | S | * | * | H | α-helix | trans | -74.4 | -30.4 | 178.5 | -114.6 | 130.8 | 0 | 0 | 0 | 113 | ||
| 18 | V | 51.6 | Low | 47.5 | Very low | 107 Ų | 107 | 136 Ų | 136 | 65% | 0.648 | 76% | 0.762 | S | S | * | * | H | α-helix | trans | -78.4 | -29.2 | 177.8 | 173.9 | 0 | 0 | 0 | 0 | 111.8 | V14 S20 L21 | V14-V18 WeakPolarHBondContact O-CG2 3.42Å; V18-S20 VanDerWaalsContact C-N 3.3Å; V18-S20 PolarHBondContact O-N 3.37Å; V18-L21 PolarHBondContact O-N 3.23Å |
| 19 | S | 50.6 | Low | 47.3 | Very low | 88 Ų | 88 | 131.5 Ų | 131.5 | 62% | 0.615 | 76% | 0.756 | S | S | * | * | H | α-helix | trans | -71.4 | -22.3 | 178.8 | -60.4 | 0 | 0 | 0 | 0 | 113.6 | S15 L21 | S15-S19 PolarHBondContact O-N 3.5Å; S15-S19 PolarHBondContact O-OG 3.22Å; S15-S19 VanDerWaalsContact O-OG 3.04Å; S19-L21 VanDerWaalsContact C-N 3.29Å; S19-L21 PolarHBondContact O-N 3.01Å |
| 20 | S | 46.1 | Very low | 46.8 | Very low | 100 Ų | 100 | 131.4 Ų | 131.4 | 70% | 0.699 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | -5.8 | 177 | -63.9 | 0 | 0 | 0 | 0 | 113.9 | V18 | V18-S20 VanDerWaalsContact C-N 3.3Å; V18-S20 PolarHBondContact O-N 3.37Å |
| 21 | L | 44.8 | Very low | 47.1 | Very low | 128 Ų | 128 | 136.6 Ų | 136.6 | 67% | 0.67 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.6 | 2.9 | -175.4 | -145.6 | 69.9 | 0 | 0 | 0 | 113.9 | V18 S19 W23 | V18-L21 PolarHBondContact O-N 3.23Å; S19-L21 VanDerWaalsContact C-N 3.29Å; S19-L21 PolarHBondContact O-N 3.01Å; L21-W23 PolarHBondContact O-N 2.84Å |
| 22 | A | 47.6 | Very low | 46.6 | Very low | 80 Ų | 80 | 135 Ų | 135 | 66% | 0.661 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | 7.5 | -174.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 23 | W | 50.7 | Low | 46.2 | Very low | 240 Ų | 240 | 134.5 Ų | 134.5 | 91% | 0.909 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | 6.3 | -179 | -70 | 85.1 | 0 | 0 | 0 | 114.1 | L21 | L21-W23 PolarHBondContact O-N 2.84Š|
| 24 | L | 47.1 | Very low | 45.7 | Very low | 150 Ų | 150 | 138.8 Ų | 138.8 | 79% | 0.785 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -126.9 | 6 | -170.1 | -79.2 | 170.9 | 0 | 0 | 0 | 116.3 | ||
| 25 | D | 46.5 | Very low | 45 | Very low | 153 Ų | 153 | 144.7 Ų | 144.7 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -123.3 | 15.6 | -171.6 | -113.4 | -71 | 0 | 0 | 0 | 116.6 | ||||
| 26 | E | 51.4 | Low | 44.1 | Very low | 190 Ų | 190 | 143.8 Ų | 143.8 | 89% | 0.888 | 79% | 0.786 | S | S | * | * | trans | -114.8 | 76.6 | 169.9 | -72.3 | -160 | 140.1 | 0 | 0 | 110.8 | ||||
| 27 | D | 44.9 | Very low | 44.1 | Very low | 157 Ų | 157 | 142.6 Ų | 142.6 | 84% | 0.84 | 79% | 0.791 | S | S | * | * | trans | -172.9 | 82.9 | 151.5 | -97.9 | -27.5 | 0 | 0 | 0 | 108.7 | ||||
| 28 | L | 40.8 | Very low | 43.3 | Very low | 178 Ų | 178 | 144.1 Ų | 144.1 | 93% | 0.932 | 79% | 0.794 | S | S | * | * | trans | -175.1 | 104.7 | 147.3 | -79 | -160.9 | 0 | 0 | 0 | 109.3 | ||||
| 29 | S | 36.1 | Very low | 42.6 | Very low | 109 Ų | 109 | 148.1 Ų | 148.1 | 76% | 0.762 | 81% | 0.808 | S | S | * | * | trans | 170.3 | 95.7 | 135.6 | -171.9 | 0 | 0 | 0 | 0 | 111 | ||||
| 30 | S | 35.9 | Very low | 41.7 | Very low | 133 Ų | 133 | 148 Ų | 148 | 93% | 0.93 | 82% | 0.821 | S | S | * | * | trans | -89.7 | 113.3 | 155.3 | -80.6 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 31 | Q | 42 | Very low | 41 | Very low | 182 Ų | 182 | 147.1 Ų | 147.1 | 85% | 0.85 | 83% | 0.828 | S | S | * | * | trans | -104.9 | 110.3 | 177.2 | -175 | 170.4 | 31.6 | 0 | 0 | 108.9 | ||||
| 32 | D | 40 | Very low | 40.8 | Very low | 169 Ų | 169 | 152.7 Ų | 152.7 | 90% | 0.904 | 84% | 0.84 | S | S | * | * | trans | -68.2 | 147.4 | 165.8 | -91.7 | -38.2 | 0 | 0 | 0 | 111.5 | ||||
| 33 | G | 36.8 | Very low | 40.5 | Very low | 68 Ų | 68 | 159.8 Ų | 159.8 | 70% | 0.701 | 85% | 0.851 | S | S | * | * | trans | 143 | 93.6 | 154.7 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 34 | E | 40.3 | Very low | 39.7 | Very low | 190 Ų | 190 | 151.3 Ų | 151.3 | 89% | 0.888 | 84% | 0.839 | S | S | * | * | trans | 53.4 | 112.9 | 131.8 | -61.7 | -70.3 | 144 | 0 | 0 | 121.2 | ||||
| 35 | R | 36.1 | Very low | 39.4 | Very low | 243 Ų | 243 | 153 Ų | 153 | 92% | 0.917 | 85% | 0.847 | S | S | * | * | 176.6 | 116.5 | 125.3 | -174.8 | 169.2 | -69.9 | -117.6 | 2.2 | 111.8 | |||||
| 36 | G | 33.4 | Very low | 38.8 | Very low | 63 Ų | 63 | 149.1 Ų | 149.1 | 65% | 0.649 | 84% | 0.844 | S | S | * | * | trans | -86.6 | -174.4 | 159.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 37 | P | 51.4 | Low | 38.5 | Very low | 120 Ų | 120 | 146.8 Ų | 146.8 | 78% | 0.779 | 85% | 0.845 | S | S | * | * | cis | -143 | 177.8 | 12.5 | 45.4 | -26.3 | 0 | 0 | 0 | 116.7 | ||||
| 38 | E | 34.6 | Very low | 37.9 | Very low | 178 Ų | 178 | 143 Ų | 143 | 83% | 0.832 | 84% | 0.844 | S | S | * | * | trans | 56.7 | 113.3 | 156.5 | -42.6 | -153.2 | 152 | 0 | 0 | 122.8 | ||||
| 39 | M | 36.9 | Very low | 37.8 | Very low | 191 Ų | 191 | 138.3 Ų | 138.3 | 94% | 0.941 | 84% | 0.837 | S | S | * | * | 171.5 | 124.8 | 110 | -104.3 | -149.7 | -166.7 | 0 | 0 | 112.2 | |||||
| 40 | G | 32.5 | Very low | 38.1 | Very low | 85 Ų | 85 | 145 Ų | 145 | 88% | 0.876 | 85% | 0.846 | S | S | * | * | trans | 79.1 | 120.1 | 134.2 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 41 | G | 31.4 | Very low | 38 | Very low | 82 Ų | 82 | 142.1 Ų | 142.1 | 85% | 0.845 | 84% | 0.838 | S | S | * | * | trans | 137.4 | 101 | 146.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 42 | R | 40.9 | Very low | 37.9 | Very low | 246 Ų | 246 | 138.5 Ų | 138.5 | 93% | 0.928 | 83% | 0.832 | S | S | * | * | trans | -71.2 | 128.3 | 172.4 | -69.9 | 172.6 | 164 | -149.9 | -2.8 | 113.2 | ||||
| 43 | Y | 39.8 | Very low | 37.9 | Very low | 228 Ų | 228 | 138.8 Ų | 138.8 | 89% | 0.894 | 83% | 0.828 | S | S | * | * | 178.5 | 134.3 | 127.6 | 59.5 | -95.7 | 0 | 0 | 0 | 105.2 | |||||
| 44 | G | 35.4 | Very low | 38 | Very low | 63 Ų | 63 | 142.2 Ų | 142.2 | 65% | 0.649 | 83% | 0.831 | S | S | * | * | cis | 116.2 | 117.6 | 39.8 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 45 | L | 40.3 | Very low | 38.5 | Very low | 185 Ų | 185 | 141.8 Ų | 141.8 | 97% | 0.969 | 83% | 0.831 | S | S | * | * | trans | 102.8 | 113.9 | 168.8 | -53.8 | 169.1 | 0 | 0 | 0 | 117.4 | ||||
| 46 | G | 33.2 | Very low | 38.9 | Very low | 72 Ų | 72 | 138.5 Ų | 138.5 | 74% | 0.742 | 83% | 0.826 | S | S | * | * | trans | -88.1 | -155.7 | 166.3 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 47 | P | 44.7 | Very low | 39.2 | Very low | 140 Ų | 140 | 140.4 Ų | 140.4 | 91% | 0.909 | 82% | 0.821 | S | S | * | * | -111.4 | 144.2 | -103.6 | 36 | -28.3 | 0 | 0 | 0 | 113.7 | |||||
| 48 | G | 32.8 | Very low | 38.8 | Very low | 79 Ų | 79 | 142 Ų | 142 | 81% | 0.814 | 82% | 0.818 | S | S | * | * | trans | -128.3 | 120.9 | 156.6 | 0 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 49 | G | 38.9 | Very low | 39.5 | Very low | 78 Ų | 78 | 142.1 Ų | 142.1 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | 95.3 | 77.3 | 57 | 0 | 0 | 0 | 0 | 0 | 107.9 | |||||
| 50 | R | 42.6 | Very low | 39.9 | Very low | 249 Ų | 249 | 139.8 Ų | 139.8 | 94% | 0.94 | 81% | 0.806 | S | S | * | * | trans | -141.6 | 93.8 | 161 | -77.2 | -168.4 | 178.2 | -112.7 | -1.3 | 108 | S52 | R50-S52 PolarHBondContact O-N 2.98Š| ||
| 51 | G | 34.5 | Very low | 40.9 | Very low | 74 Ų | 74 | 144.8 Ų | 144.8 | 76% | 0.763 | 81% | 0.806 | S | S | * | * | trans | -61.8 | 127.6 | 161.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | E53 | G51-E53 PolarHBondContact O-N 3.21Š| ||
| 52 | S | 39 | Very low | 41.6 | Very low | 105 Ų | 105 | 144.3 Ų | 144.3 | 73% | 0.734 | 78% | 0.784 | S | S | * | * | trans | -72.6 | 114.9 | 161.8 | -178.9 | 0 | 0 | 0 | 0 | 106.1 | R50 D54 | R50-S52 PolarHBondContact O-N 2.98Å; S52-D54 PolarHBondContact O-N 3.3Å | ||
| 53 | E | 39.8 | Very low | 42.1 | Very low | 175 Ų | 175 | 139.9 Ų | 139.9 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | trans | -70.6 | 98.7 | 174.7 | -66 | 173.3 | 164.7 | 0 | 0 | 108 | G51 M55 | G51-E53 PolarHBondContact O-N 3.21Å; E53-M55 PolarHBondContact O-N 3.03Å | ||
| 54 | D | 39.6 | Very low | 42.7 | Very low | 141 Ų | 141 | 134.3 Ų | 134.3 | 75% | 0.754 | 76% | 0.757 | S | S | * | * | trans | -60.3 | 101.5 | 162.2 | -74.6 | -41.9 | 0 | 0 | 0 | 108 | S52 E56 | S52-D54 PolarHBondContact O-N 3.3Å; D54-E56 VanDerWaalsContact C-N 3.33Å; D54-E56 PolarHBondContact O-N 3.27Å | ||
| 55 | M | 50.6 | Low | 43.1 | Very low | 181 Ų | 181 | 138.9 Ų | 138.9 | 89% | 0.892 | 77% | 0.767 | S | S | * | * | trans | -68.6 | 93 | 168.7 | -84.1 | -172.4 | 178 | 0 | 0 | 108.8 | E53 D57 | E53-M55 PolarHBondContact O-N 3.03Å; M55-D57 PolarHBondContact O-N 3.21Å | ||
| 56 | E | 43.8 | Very low | 43.8 | Very low | 174 Ų | 174 | 136.8 Ų | 136.8 | 81% | 0.813 | 76% | 0.757 | S | S | * | * | trans | -59 | 101.4 | 163.5 | -65.7 | -179.9 | 171.8 | 0 | 0 | 109 | D54 Q58 | D54-E56 VanDerWaalsContact C-N 3.33Å; D54-E56 PolarHBondContact O-N 3.27Å; E56-Q58 PolarHBondContact O-N 3.39Å | ||
| 57 | D | 40.6 | Very low | 44.3 | Very low | 103 Ų | 103 | 138.5 Ų | 138.5 | 55% | 0.551 | 75% | 0.749 | S | S | * | * | trans | -68.2 | 94.6 | 172.8 | -161.6 | 28.5 | 0 | 0 | 0 | 107 | M55 E59 R97 R101 | M55-D57 PolarHBondContact O-N 3.21Å; D57-E59 PolarHBondContact O-N 3.21Å; D57-E59 VanDerWaalsContact O-N 3.07Å; D57-R97 IonicContact OD1-NH2 3.01Å; D57-R97 PolarHBondContact OD1-NH2 3.23Å; D57-R97 IonicContact OD2-NH2 3.13Å; D57-R101 IonicContact OD1-NH2 3.92Å; D57-R101 IonicContact OD2-NH2 2.66Å; D57-R101 PolarHBondContact OD2-NH2 3.39Å | ||
| 58 | Q | 43.4 | Very low | 44.4 | Very low | 152 Ų | 152 | 138.6 Ų | 138.6 | 71% | 0.71 | 74% | 0.742 | S | S | * | * | trans | -52.1 | 116.2 | 175.3 | -79.2 | 171.3 | 20.4 | 0 | 0 | 109.9 | E56 E60 | E56-Q58 PolarHBondContact O-N 3.39Å; Q58-E60 VanDerWaalsContact C-N 3.27Å; Q58-E60 PolarHBondContact O-N 3.05Å | ||
| 59 | E | 49.2 | Very low | 44.9 | Very low | 182 Ų | 182 | 141.9 Ų | 141.9 | 85% | 0.85 | 74% | 0.736 | S | S | * | * | trans | -72.9 | 80.9 | 173.6 | -62.8 | -172.6 | 169.7 | 0 | 0 | 109.1 | D57 E61 | D57-E59 PolarHBondContact O-N 3.21Å; D57-E59 VanDerWaalsContact O-N 3.07Å; E59-E61 PolarHBondContact O-N 3.39Å; E59-E61 VanDerWaalsContact O-N 3.09Å | ||
| 60 | E | 45.4 | Very low | 45.5 | Very low | 141 Ų | 141 | 147.4 Ų | 147.4 | 66% | 0.659 | 74% | 0.741 | S | S | * | * | trans | -68.8 | 101.8 | 162.2 | -72.1 | -93.1 | 160.7 | 0 | 0 | 107.7 | Q58 D62 | Q58-E60 VanDerWaalsContact C-N 3.27Å; Q58-E60 PolarHBondContact O-N 3.05Å; E60-D62 VanDerWaalsContact C-N 3.26Å; E60-D62 PolarHBondContact O-N 3.09Å | ||
| 61 | E | 52 | Low | 45.4 | Very low | 190 Ų | 190 | 140.9 Ų | 140.9 | 89% | 0.888 | 73% | 0.729 | S | S | * | * | trans | -62.8 | 82.6 | 168.3 | -82.7 | -168.4 | 152.9 | 0 | 0 | 110.2 | E59 N63 | E59-E61 PolarHBondContact O-N 3.39Å; E59-E61 VanDerWaalsContact O-N 3.09Å; E61-N63 PolarHBondContact O-N 2.98Å | ||
| 62 | D | 47.4 | Very low | 45.8 | Very low | 73 Ų | 73 | 140.7 Ų | 140.7 | 39% | 0.39 | 73% | 0.727 | S | S | . | * | trans | -82 | 105.6 | 163.6 | -76.8 | -38.6 | 0 | 0 | 0 | 108.7 | E60 Y64 R94 | E60-D62 VanDerWaalsContact C-N 3.26Å; E60-D62 PolarHBondContact O-N 3.09Å; D62-Y64 HydrophobicContact CB-CD2 4.48Å; D62-Y64 HydrophobicContact CB-CE2 3.71Å; D62-Y64 WeakPolarHBondContact O-CD2 3.42Å; D62-Y64 WeakPolarHBondContact O-CE2 3.44Å; D62-Y64 PolarHBondContact O-N 3.11Å; D62-R94 IonicContact OD1-NH2 3.12Å; D62-R94 IonicContact OD2-CZ 2.69Å; D62-R94 IonicContact OD2-NE 3.95Å; D62-R94 IonicContact OD2-NH2 3.74Å; D62-R94 PolarHBondContact OD2-NH2 2.7Å | ||
| 63 | N | 51.9 | Low | 46 | Very low | 153 Ų | 153 | 144.7 Ų | 144.7 | 82% | 0.818 | 74% | 0.736 | S | S | * | * | trans | -61.9 | 112.9 | 171.1 | -175.2 | -2.5 | 0 | 0 | 0 | 110.3 | E61 | E61-N63 PolarHBondContact O-N 2.98Š| ||
| 64 | Y | 50.7 | Low | 45.9 | Very low | 110 Ų | 110 | 143.7 Ų | 143.7 | 43% | 0.431 | 74% | 0.736 | S | S | . | * | trans | -100.1 | 107 | -179.4 | -66.8 | -85.1 | 0 | 0 | 0 | 110.8 | D62 D66 R94 | D62-Y64 HydrophobicContact CB-CD2 4.48Å; D62-Y64 HydrophobicContact CB-CE2 3.71Å; D62-Y64 WeakPolarHBondContact O-CD2 3.42Å; D62-Y64 WeakPolarHBondContact O-CE2 3.44Å; D62-Y64 PolarHBondContact O-N 3.11Å; Y64-D66 PolarHBondContact O-N 3.12Å; Y64-R94 VanDerWaalsContact OH-CZ 3.27Å; Y64-R94 PolarHBondContact OH-NH2 3.47Å | ||
| 65 | N | 45.5 | Very low | 46 | Very low | 160 Ų | 160 | 140 Ų | 140 | 86% | 0.856 | 73% | 0.732 | S | S | * | * | trans | -71.4 | 113.3 | 153.9 | -92.1 | -51.7 | 0 | 0 | 0 | 108.1 | ||||
| 66 | D | 53.5 | Low | 45.8 | Very low | 141 Ų | 141 | 140.3 Ų | 140.3 | 75% | 0.754 | 73% | 0.731 | S | S | * | * | trans | -75.2 | 119.5 | 170 | -172.2 | 52.4 | 0 | 0 | 0 | 108.7 | Y64 | Y64-D66 PolarHBondContact O-N 3.12Š| ||
| 67 | D | 43.7 | Very low | 45.6 | Very low | 108 Ų | 108 | 140 Ų | 140 | 58% | 0.578 | 74% | 0.735 | S | S | * | * | trans | -153.1 | 77.5 | 170 | -164.4 | 45.3 | 0 | 0 | 0 | 106.8 | E69 K87 | D67-E69 PolarHBondContact O-N 2.93Å; D67-K87 IonicContact OD2-NZ 2.84Å; D67-K87 PolarHBondContact OD2-NZ 2.88Å; D67-K87 VanDerWaalsContact OD2-NZ 3.12Å | ||
| 68 | D | 47.4 | Very low | 46.2 | Very low | 142 Ų | 142 | 144.6 Ų | 144.6 | 76% | 0.759 | 75% | 0.753 | S | S | * | * | trans | -83.6 | 86.2 | 178.8 | -141.7 | -17.4 | 0 | 0 | 0 | 108.2 | ||||
| 69 | E | 44.4 | Very low | 46.7 | Very low | 148 Ų | 148 | 141 Ų | 141 | 69% | 0.692 | 75% | 0.749 | S | S | * | * | trans | -102.9 | 96.3 | 162 | -74.7 | -150.5 | -173.4 | 0 | 0 | 109.7 | D67 T71 | D67-E69 PolarHBondContact O-N 2.93Å; E69-T71 PolarHBondContact O-N 3.48Å; E69-T71 VanDerWaalsContact O-N 3.1Å | ||
| 70 | E | 49.7 | Very low | 46.8 | Very low | 193 Ų | 193 | 138.4 Ų | 138.4 | 90% | 0.902 | 75% | 0.748 | S | S | * | * | trans | -72.3 | 91.1 | 164.3 | -162.4 | -172.2 | -142.2 | 0 | 0 | 108.6 | ||||
| 71 | T | 41.6 | Very low | 47.3 | Very low | 113 Ų | 113 | 141.2 Ų | 141.2 | 69% | 0.693 | 76% | 0.758 | S | S | * | * | trans | -95.7 | 116.5 | 170.1 | 9.2 | 0 | 0 | 0 | 0 | 110.4 | E69 | E69-T71 PolarHBondContact O-N 3.48Å; E69-T71 VanDerWaalsContact O-N 3.1Å | ||
| 72 | G | 42.5 | Very low | 47.5 | Very low | 70 Ų | 70 | 143.7 Ų | 143.7 | 72% | 0.722 | 76% | 0.76 | S | S | * | * | trans | -54.6 | 147.3 | 168.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 73 | M | 42.8 | Very low | 48 | Very low | 189 Ų | 189 | 152.3 Ų | 152.3 | 93% | 0.931 | 79% | 0.787 | S | S | * | * | trans | -111.6 | 98.6 | -174.8 | -153.5 | 89.8 | 117.2 | 0 | 0 | 109.5 | ||||
| 74 | D | 39.4 | Very low | 49 | Very low | 153 Ų | 153 | 147.5 Ų | 147.5 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | trans | -140.5 | 123.4 | 152.7 | 61.3 | -51.8 | 0 | 0 | 0 | 109.1 | ||||
| 75 | G | 40.4 | Very low | 49.9 | Very low | 64 Ų | 64 | 148.6 Ų | 148.6 | 66% | 0.66 | 79% | 0.794 | S | S | * | * | trans | -69.8 | 158.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 76 | E | 45.9 | Very low | 50.8 | Low | 188 Ų | 188 | 150.8 Ų | 150.8 | 88% | 0.879 | 80% | 0.796 | S | S | * | * | -170.9 | 119.3 | 58.7 | 47.9 | -159.4 | 131.6 | 0 | 0 | 111 | |||||
| 77 | N | 39.6 | Very low | 51.4 | Low | 168 Ų | 168 | 151.9 Ų | 151.9 | 90% | 0.898 | 79% | 0.794 | S | S | * | * | trans | -162.3 | 126.7 | 150.6 | -125.4 | -40.2 | 0 | 0 | 0 | 109.9 | A79 | N77-A79 PolarHBondContact O-N 3.3Š| ||
| 78 | E | 54.2 | Low | 52.7 | Low | 199 Ų | 199 | 156.2 Ų | 156.2 | 93% | 0.93 | 81% | 0.807 | S | S | * | * | trans | -72.4 | 116 | -178.3 | -66.8 | -151.8 | 154.1 | 0 | 0 | 111.3 | ||||
| 79 | A | 52.8 | Low | 53.9 | Low | 76 Ų | 76 | 158.8 Ų | 158.8 | 63% | 0.628 | 81% | 0.812 | S | S | * | * | trans | -130 | 140.4 | 163.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | N77 K81 | N77-A79 PolarHBondContact O-N 3.3Å; A79-K81 PolarHBondContact O-N 3.02Å; A79-K81 VanDerWaalsContact O-N 3.12Å | ||
| 80 | P | 51.3 | Low | 55.4 | Low | 128 Ų | 128 | 156.2 Ų | 156.2 | 83% | 0.831 | 80% | 0.801 | S | S | * | * | trans | -68.5 | 113.6 | -171.5 | 26.8 | -32.6 | 0 | 0 | 0 | 110.6 | R82 | P80-R82 PolarHBondContact O-N 3.37Å; P80-R82 VanDerWaalsContact O-N 3.11Å | ||
| 81 | K | 56.4 | Low | 57.2 | Low | 199 Ų | 199 | 150.5 Ų | 150.5 | 87% | 0.865 | 79% | 0.786 | S | S | * | * | trans | -68.1 | 106.9 | -177.9 | -67.4 | 175.4 | -179.1 | 173.9 | 0 | 110.5 | A79 R83 | A79-K81 PolarHBondContact O-N 3.02Å; A79-K81 VanDerWaalsContact O-N 3.12Å; K81-R83 PolarHBondContact O-N 2.98Å | ||
| 82 | R | 56.6 | Low | 59.3 | Low | 243 Ų | 243 | 155.4 Ų | 155.4 | 92% | 0.917 | 79% | 0.792 | S | S | * | * | trans | -57.6 | 126.4 | 168.5 | -64.3 | 175.4 | 74.9 | -165.9 | 3.1 | 108.8 | P80 G84 | P80-R82 PolarHBondContact O-N 3.37Å; P80-R82 VanDerWaalsContact O-N 3.11Å; R82-G84 PolarHBondContact O-N 3.49Å | ||
| 83 | R | 58.3 | Low | 61.5 | Low | 254 Ų | 254 | 154.3 Ų | 154.3 | 96% | 0.958 | 78% | 0.781 | S | S | * | * | trans | -71.5 | 85.6 | -176.7 | -65.5 | 176.6 | 174.9 | -179.4 | -2.1 | 110.6 | K81 | K81-R83 PolarHBondContact O-N 2.98Š| ||
| 84 | G | 72.1 | Confident | 63.7 | Low | 51 Ų | 51 | 149.9 Ų | 149.9 | 53% | 0.526 | 75% | 0.754 | S | S | . | * | trans | -88.4 | 155.9 | 159.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | R82 K86 | R82-G84 PolarHBondContact O-N 3.49Å; G84-K86 PolarHBondContact O-N 3.17Å; G84-K86 VanDerWaalsContact O-N 3.13Å | ||
| 85 | P | 69.2 | Low | 66.1 | Low | 134 Ų | 134 | 145.5 Ų | 145.5 | 87% | 0.87 | 73% | 0.728 | S | S | * | * | trans | -53.6 | 120.1 | 172.9 | -20.9 | 31.2 | 0 | 0 | 0 | 109.7 | K87 | P85-K87 PolarHBondContact O-N 2.69Š| ||
| 86 | K | 64.4 | Low | 68.7 | Low | 206 Ų | 206 | 148.6 Ų | 148.6 | 90% | 0.896 | 73% | 0.726 | S | S | * | * | trans | -59.1 | 114.5 | 176.9 | -80.8 | 179.2 | 173.2 | 177.2 | 0 | 108.5 | G84 K88 | G84-K86 PolarHBondContact O-N 3.17Å; G84-K86 VanDerWaalsContact O-N 3.13Å; K86-K88 PolarHBondContact O-N 3.4Å | ||
| 87 | K | 65.8 | Low | 71 | Confident | 164 Ų | 164 | 145.4 Ų | 145.4 | 71% | 0.713 | 71% | 0.706 | S | S | * | * | trans | -52.4 | 105.9 | 167.9 | -71.5 | -175.4 | 179.8 | -179.9 | 0 | 107.1 | D67 P85 K89 | D67-K87 IonicContact OD2-NZ 2.84Å; D67-K87 PolarHBondContact OD2-NZ 2.88Å; D67-K87 VanDerWaalsContact OD2-NZ 3.12Å; P85-K87 PolarHBondContact O-N 2.69Å; K87-K89 PolarHBondContact O-N 3.34Å | ||
| 88 | K | 72.9 | Confident | 73.6 | Confident | 199 Ų | 199 | 141.3 Ų | 141.3 | 87% | 0.865 | 68% | 0.68 | S | S | * | * | trans | -67.4 | 115.9 | 178.9 | -174.4 | 178.4 | 179.5 | -178.6 | 0 | 106.8 | K86 M90 | K86-K88 PolarHBondContact O-N 3.4Å; K88-M90 PolarHBondContact O-N 3.31Å | ||
| 89 | K | 72.4 | Confident | 75.6 | Confident | 196 Ų | 196 | 137 Ų | 137 | 85% | 0.852 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 129.9 | 175.2 | -70.6 | -173.3 | 177.1 | -173.4 | 0 | 108.7 | K87 A91 | K87-K89 PolarHBondContact O-N 3.34Å; K89-A91 PolarHBondContact O-N 3.35Å |
| 90 | M | 74.8 | Confident | 77.7 | Confident | 94 Ų | 94 | 136.2 Ų | 136.2 | 46% | 0.463 | 65% | 0.652 | S | S | . | * | P | Polyproline II helix | trans | -58 | 138.4 | 179.4 | -53.8 | -158.8 | -101.9 | 0 | 0 | 109.5 | K88 R94 Q95 | K88-M90 PolarHBondContact O-N 3.31Å; M90-R94 PolarHBondContact SD-NH1 3.21Å; M90-Q95 VanDerWaalsContact CE-OE1 3.28Å |
| 91 | A | 86.9 | Confident | 79.9 | Confident | 72 Ų | 72 | 135.2 Ų | 135.2 | 60% | 0.595 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 139.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | K89 G93 R94 Q95 | K89-A91 PolarHBondContact O-N 3.35Å; A91-G93 VanDerWaalsContact C-N 3.26Å; A91-G93 PolarHBondContact O-N 3.17Å; A91-G93 VanDerWaalsContact O-N 3.16Å; A91-R94 WeakPolarHBondContact O-CA 3.29Å; A91-R94 WeakPolarHBondContact O-CB 3.43Å; A91-R94 PolarHBondContact O-N 3.12Å; A91-Q95 PolarHBondContact O-N 3.03Å; A91-Q95 VanDerWaalsContact O-N 3.13Å |
| 92 | R | 86 | Confident | 81.9 | Confident | 216 Ų | 216 | 132.6 Ų | 132.6 | 82% | 0.815 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -51.9 | -42.1 | -174.1 | -74.3 | -173 | 172.1 | -174.8 | -2.1 | 113.2 | R94 Q95 E96 | R92-R94 VanDerWaalsContact C-N 3.35Å; R92-R94 PolarHBondContact O-N 3.43Å; R92-Q95 WeakPolarHBondContact O-CB 3.4Å; R92-Q95 PolarHBondContact O-N 3.38Å; R92-Q95 VanDerWaalsContact O-N 3.13Å; R92-E96 WeakPolarHBondContact O-CG 3.35Å; R92-E96 PolarHBondContact O-N 2.95Å |
| 93 | G | 88.4 | Confident | 83.8 | Confident | 47 Ų | 47 | 125.2 Ų | 125.2 | 49% | 0.485 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -62.8 | -35.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | A91 E96 R97 | A91-G93 VanDerWaalsContact C-N 3.26Å; A91-G93 PolarHBondContact O-N 3.17Å; A91-G93 VanDerWaalsContact O-N 3.16Å; G93-E96 PolarHBondContact O-N 3.38Å; G93-R97 PolarHBondContact O-N 3.3Å |
| 94 | R | 89.4 | Confident | 85.7 | Confident | 96 Ų | 96 | 119.6 Ų | 119.6 | 36% | 0.362 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -67.9 | -39.1 | 174 | -171 | 173.9 | -177 | -105.5 | 12 | 110.9 | D62 Y64 M90 A91 R92 E96 R97 F98 | D62-R94 IonicContact OD1-NH2 3.12Å; D62-R94 IonicContact OD2-CZ 2.69Å; D62-R94 IonicContact OD2-NE 3.95Å; D62-R94 IonicContact OD2-NH2 3.74Å; D62-R94 PolarHBondContact OD2-NH2 2.7Å; Y64-R94 VanDerWaalsContact OH-CZ 3.27Å; Y64-R94 PolarHBondContact OH-NH2 3.47Å; M90-R94 PolarHBondContact SD-NH1 3.21Å; A91-R94 WeakPolarHBondContact O-CA 3.29Å; A91-R94 WeakPolarHBondContact O-CB 3.43Å; A91-R94 PolarHBondContact O-N 3.12Å; R92-R94 VanDerWaalsContact C-N 3.35Å; R92-R94 PolarHBondContact O-N 3.43Å; R94-E96 VanDerWaalsContact C-N 3.35Å; R94-R97 PolarHBondContact O-N 3.14Å; R94-F98 WeakPolarHBondContact O-CB 3.32Å; R94-F98 PolarHBondContact O-N 2.87Å |
| 95 | Q | 91.2 | Very high | 87 | Confident | 61 Ų | 61 | 119.2 Ų | 119.2 | 29% | 0.285 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -64.2 | -40.2 | 176.2 | -166.2 | 65.3 | 18.9 | 0 | 0 | 111.9 | M90 A91 R92 F98 K99 | M90-Q95 VanDerWaalsContact CE-OE1 3.28Å; A91-Q95 PolarHBondContact O-N 3.03Å; A91-Q95 VanDerWaalsContact O-N 3.13Å; R92-Q95 WeakPolarHBondContact O-CB 3.4Å; R92-Q95 PolarHBondContact O-N 3.38Å; R92-Q95 VanDerWaalsContact O-N 3.13Å; Q95-F98 PolarHBondContact O-N 3.26Å; Q95-K99 VanDerWaalsContact O-CG 3.31Å; Q95-K99 WeakPolarHBondContact O-CG 3.33Å; Q95-K99 PolarHBondContact O-N 2.91Å |
| 96 | E | 93.6 | Very high | 88.4 | Confident | 129 Ų | 129 | 116.4 Ų | 116.4 | 60% | 0.603 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -66.5 | -45.2 | 177.1 | -74.1 | 167.3 | -168.2 | 0 | 0 | 111.9 | R92 G93 R94 F98 K99 A100 | R92-E96 WeakPolarHBondContact O-CG 3.35Å; R92-E96 PolarHBondContact O-N 2.95Å; G93-E96 PolarHBondContact O-N 3.38Å; R94-E96 VanDerWaalsContact C-N 3.35Å; E96-F98 VanDerWaalsContact C-N 3.31Å; E96-F98 PolarHBondContact O-N 3.23Å; E96-K99 PolarHBondContact O-N 3.28Å; E96-A100 WeakPolarHBondContact O-CB 3.46Å; E96-A100 PolarHBondContact O-N 3.04Å |
| 97 | R | 94.3 | Very high | 90 | Very high | 122 Ų | 122 | 109 Ų | 109 | 46% | 0.46 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.4 | -42.1 | 174.8 | -171 | 179.3 | -177.5 | -142.2 | 12.4 | 111.6 | D57 G93 R94 A100 R101 | D57-R97 IonicContact OD1-NH2 3.01Å; D57-R97 PolarHBondContact OD1-NH2 3.23Å; D57-R97 IonicContact OD2-NH2 3.13Å; G93-R97 PolarHBondContact O-N 3.3Å; R94-R97 PolarHBondContact O-N 3.14Å; R97-A100 PolarHBondContact O-N 2.96Å; R97-R101 WeakPolarHBondContact O-CG 3.26Å; R97-R101 PolarHBondContact O-N 3.27Å |
| 98 | F | 94.5 | Very high | 91.6 | Very high | 81 Ų | 81 | 107.9 Ų | 107.9 | 36% | 0.355 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.1 | -48.1 | 175.7 | -179.4 | -96.6 | 0 | 0 | 0 | 112 | R94 Q95 E96 A100 R101 R102 | R94-F98 WeakPolarHBondContact O-CB 3.32Å; R94-F98 PolarHBondContact O-N 2.87Å; Q95-F98 PolarHBondContact O-N 3.26Å; E96-F98 VanDerWaalsContact C-N 3.31Å; E96-F98 PolarHBondContact O-N 3.23Å; F98-A100 VanDerWaalsContact C-N 3.32Å; F98-A100 PolarHBondContact O-N 3.44Å; F98-R101 PolarHBondContact O-N 2.87Å; F98-R102 PolarHBondContact O-N 3.15Å |
| 99 | K | 95.9 | Very high | 92.8 | Very high | 109 Ų | 109 | 102.4 Ų | 102.4 | 47% | 0.474 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.6 | -43.7 | 175.7 | -74.4 | 174.2 | 178.8 | -178.1 | 0 | 111.7 | Q95 E96 R102 T103 | Q95-K99 VanDerWaalsContact O-CG 3.31Å; Q95-K99 WeakPolarHBondContact O-CG 3.33Å; Q95-K99 PolarHBondContact O-N 2.91Å; E96-K99 PolarHBondContact O-N 3.28Å; K99-R102 PolarHBondContact O-N 3.15Å; K99-T103 PolarHBondContact O-N 3.5Å; K99-T103 PolarHBondContact O-OG1 3.47Å; K99-T103 VanDerWaalsContact O-OG1 3.06Å |
| 100 | A | 96.4 | Very high | 94 | Very high | 60 Ų | 60 | 100.6 Ų | 100.6 | 50% | 0.496 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62 | -45.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | E96 R97 F98 R102 T103 K104 | E96-A100 WeakPolarHBondContact O-CB 3.46Å; E96-A100 PolarHBondContact O-N 3.04Å; R97-A100 PolarHBondContact O-N 2.96Å; F98-A100 VanDerWaalsContact C-N 3.32Å; F98-A100 PolarHBondContact O-N 3.44Å; A100-R102 PolarHBondContact O-N 3.07Å; A100-T103 PolarHBondContact O-N 3.36Å; A100-K104 PolarHBondContact O-N 3.43Å |
| 101 | R | 97.8 | Very high | 95.2 | Very high | 106 Ų | 106 | 100 Ų | 100 | 40% | 0.4 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59 | -45.3 | 175.3 | -75.4 | 176.6 | 167.7 | -161.8 | -11 | 111.6 | D57 R97 F98 K104 A105 | D57-R101 IonicContact OD1-NH2 3.92Å; D57-R101 IonicContact OD2-NH2 2.66Å; D57-R101 PolarHBondContact OD2-NH2 3.39Å; R97-R101 WeakPolarHBondContact O-CG 3.26Å; R97-R101 PolarHBondContact O-N 3.27Å; F98-R101 PolarHBondContact O-N 2.87Å; R101-K104 PolarHBondContact O-N 3.29Å; R101-A105 PolarHBondContact O-N 3.32Å |
| 102 | R | 98.1 | Very high | 95.7 | Very high | 145 Ų | 145 | 104 Ų | 104 | 55% | 0.547 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.6 | -45.3 | 176.3 | -169.9 | 175.2 | 71 | 172 | 3 | 112.1 | F98 K99 A100 K104 A105 N106 | F98-R102 PolarHBondContact O-N 3.15Å; K99-R102 PolarHBondContact O-N 3.15Å; A100-R102 PolarHBondContact O-N 3.07Å; R102-K104 PolarHBondContact O-N 3.31Å; R102-A105 PolarHBondContact O-N 3.36Å; R102-N106 VanDerWaalsContact O-CG 3.28Å; R102-N106 PolarHBondContact O-N 2.85Å |
| 103 | T | 97.9 | Very high | 96.3 | Very high | 88 Ų | 88 | 96.7 Ų | 96.7 | 54% | 0.54 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.1 | -42.8 | 177.3 | -60.8 | 0 | 0 | 0 | 0 | 111.8 | K99 A100 A105 N106 A107 | K99-T103 PolarHBondContact O-N 3.5Å; K99-T103 PolarHBondContact O-OG1 3.47Å; K99-T103 VanDerWaalsContact O-OG1 3.06Å; A100-T103 PolarHBondContact O-N 3.36Å; T103-A105 PolarHBondContact O-N 3.11Å; T103-N106 PolarHBondContact O-N 2.97Å; T103-A107 PolarHBondContact O-N 2.99Å |
| 104 | K | 98.2 | Very high | 96.8 | Very high | 135 Ų | 135 | 100 Ų | 100 | 59% | 0.587 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -62.4 | -41.8 | 175.8 | -168.8 | -179.3 | -177.2 | 175.7 | 0 | 111.8 | A100 R101 R102 A107 R108 | A100-K104 PolarHBondContact O-N 3.43Å; R101-K104 PolarHBondContact O-N 3.29Å; R102-K104 PolarHBondContact O-N 3.31Å; K104-A107 PolarHBondContact O-N 3.44Å; K104-R108 WeakPolarHBondContact O-CG 3.41Å; K104-R108 PolarHBondContact O-N 2.91Å; K104-R108 VanDerWaalsContact O-N 3.17Å; K104-R108 PolarHBondContact O-NE 2.96Å |
| 105 | A | 98.3 | Very high | 97.3 | Very high | 43 Ų | 43 | 97.3 Ų | 97.3 | 36% | 0.355 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62.4 | -46.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | R101 R102 T103 A107 R108 E109 | R101-A105 PolarHBondContact O-N 3.32Å; R102-A105 PolarHBondContact O-N 3.36Å; T103-A105 PolarHBondContact O-N 3.11Å; A105-A107 VanDerWaalsContact C-N 3.33Å; A105-A107 PolarHBondContact O-N 3.42Å; A105-R108 WeakPolarHBondContact O-CB 3.45Å; A105-R108 PolarHBondContact O-N 3.49Å; A105-E109 PolarHBondContact O-N 3.45Å |
| 106 | N | 98.6 | Very high | 97.6 | Very high | 75 Ų | 75 | 99 Ų | 99 | 40% | 0.401 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.8 | -38.4 | 177.9 | -71 | -8.5 | 0 | 0 | 0 | 112.5 | R102 T103 R108 E109 R110 | R102-N106 VanDerWaalsContact O-CG 3.28Å; R102-N106 PolarHBondContact O-N 2.85Å; T103-N106 PolarHBondContact O-N 2.97Å; N106-R108 VanDerWaalsContact C-N 3.34Å; N106-E109 PolarHBondContact O-N 3.04Å; N106-R110 WeakPolarHBondContact O-CG 3.31Å; N106-R110 PolarHBondContact O-N 2.98Å |
| 107 | A | 98.6 | Very high | 97.8 | Very high | 52 Ų | 52 | 95.3 Ų | 95.3 | 43% | 0.43 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.2 | -42.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | T103 K104 A105 R110 S111 | T103-A107 PolarHBondContact O-N 2.99Å; K104-A107 PolarHBondContact O-N 3.44Å; A105-A107 VanDerWaalsContact C-N 3.33Å; A105-A107 PolarHBondContact O-N 3.42Å; A107-R110 PolarHBondContact O-N 3.14Å; A107-S111 PolarHBondContact O-N 3.29Å |
| 108 | R | 98.7 | Very high | 98 | Very high | 139 Ų | 139 | 94.2 Ų | 94.2 | 53% | 0.525 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -63 | -44.7 | 175.8 | -72.8 | 179.9 | -73.6 | -138.4 | 2.2 | 112.4 | K104 A105 N106 R110 S111 R112 | K104-R108 WeakPolarHBondContact O-CG 3.41Å; K104-R108 PolarHBondContact O-N 2.91Å; K104-R108 VanDerWaalsContact O-N 3.17Å; K104-R108 PolarHBondContact O-NE 2.96Å; A105-R108 WeakPolarHBondContact O-CB 3.45Å; A105-R108 PolarHBondContact O-N 3.49Å; N106-R108 VanDerWaalsContact C-N 3.34Å; R108-R110 VanDerWaalsContact C-N 3.33Å; R108-R110 PolarHBondContact O-N 3.34Å; R108-S111 WeakPolarHBondContact O-CB 3.44Å; R108-S111 PolarHBondContact O-N 2.82Å; R108-R112 PolarHBondContact O-N 3.28Å |
| 109 | E | 98.6 | Very high | 98.2 | Very high | 84 Ų | 84 | 93.1 Ų | 93.1 | 39% | 0.393 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.1 | -36.3 | 179 | 179.2 | 55.6 | -167.1 | 0 | 0 | 112 | A105 N106 R112 M113 | A105-E109 PolarHBondContact O-N 3.45Å; N106-E109 PolarHBondContact O-N 3.04Å; E109-R112 VanDerWaalsContact CD-NH1 3.33Å; E109-R112 PolarHBondContact O-N 3.09Å; E109-R112 IonicContact OE1-NH1 3.71Å; E109-R112 PolarHBondContact OE1-NH1 2.95Å; E109-R112 WeakPolarHBondContact OE2-CD 3.46Å; E109-R112 IonicContact OE2-CZ 2.77Å; E109-R112 IonicContact OE2-NH1 3.63Å; E109-R112 PolarHBondContact OE2-NH1 3.14Å; E109-M113 WeakPolarHBondContact O-CB 3.15Å; E109-M113 WeakPolarHBondContact O-CG 3.36Å; E109-M113 PolarHBondContact O-N 3.42Å; E109-M113 WeakPolarHBondContact OE1-CG 3.5Å |
| 110 | R | 98.7 | Very high | 98.3 | Very high | 158 Ų | 158 | 89 Ų | 89 | 60% | 0.596 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -60.5 | -47.6 | 171.4 | -71.6 | 177.8 | -166.4 | 140.2 | 0.3 | 111.5 | N106 A107 R108 R112 M113 H114 | N106-R110 WeakPolarHBondContact O-CG 3.31Å; N106-R110 PolarHBondContact O-N 2.98Å; A107-R110 PolarHBondContact O-N 3.14Å; R108-R110 VanDerWaalsContact C-N 3.33Å; R108-R110 PolarHBondContact O-N 3.34Å; R110-R112 VanDerWaalsContact C-N 3.35Å; R110-R112 PolarHBondContact O-N 3.39Å; R110-M113 PolarHBondContact O-N 3.28Å; R110-M113 VanDerWaalsContact O-N 3.17Å; R110-H114 PolarHBondContact O-CD2 3.26Å; R110-H114 PolarHBondContact O-N 3.46Å |
| 111 | S | 98.6 | Very high | 98.3 | Very high | 83 Ų | 83 | 88 Ų | 88 | 58% | 0.58 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -58.7 | -45 | 177.3 | 178.1 | 0 | 0 | 0 | 0 | 111.9 | A107 R108 M113 H114 G115 | A107-S111 PolarHBondContact O-N 3.29Å; R108-S111 WeakPolarHBondContact O-CB 3.44Å; R108-S111 PolarHBondContact O-N 2.82Å; S111-M113 VanDerWaalsContact C-N 3.34Å; S111-M113 PolarHBondContact O-N 3.3Å; S111-H114 WeakPolarHBondContact O-CB 3.48Å; S111-H114 PolarHBondContact O-N 3.48Å; S111-G115 PolarHBondContact O-N 3.46Å |
| 112 | R | 98.7 | Very high | 98.2 | Very high | 156 Ų | 156 | 87.1 Ų | 87.1 | 59% | 0.589 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -58.6 | -44.8 | 174.1 | -180 | 177.8 | 159.2 | -81 | -7.6 | 112 | R108 E109 R110 G115 L116 | R108-R112 PolarHBondContact O-N 3.28Å; E109-R112 VanDerWaalsContact CD-NH1 3.33Å; E109-R112 PolarHBondContact O-N 3.09Å; E109-R112 IonicContact OE1-NH1 3.71Å; E109-R112 PolarHBondContact OE1-NH1 2.95Å; E109-R112 WeakPolarHBondContact OE2-CD 3.46Å; E109-R112 IonicContact OE2-CZ 2.77Å; E109-R112 IonicContact OE2-NH1 3.63Å; E109-R112 PolarHBondContact OE2-NH1 3.14Å; R110-R112 VanDerWaalsContact C-N 3.35Å; R110-R112 PolarHBondContact O-N 3.39Å; R112-G115 PolarHBondContact O-N 2.66Å; R112-L116 PolarHBondContact O-N 3.33Å; R112-L116 VanDerWaalsContact O-N 3.11Å |
| 113 | M | 98.7 | Very high | 98.2 | Very high | 61 Ų | 61 | 82.7 Ų | 82.7 | 30% | 0.3 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -67.4 | -33.3 | 177.8 | -74.9 | -58.2 | -58 | 0 | 0 | 113.1 | E109 R110 S111 L116 N117 | E109-M113 WeakPolarHBondContact O-CB 3.15Å; E109-M113 WeakPolarHBondContact O-CG 3.36Å; E109-M113 PolarHBondContact O-N 3.42Å; E109-M113 WeakPolarHBondContact OE1-CG 3.5Å; R110-M113 PolarHBondContact O-N 3.28Å; R110-M113 VanDerWaalsContact O-N 3.17Å; S111-M113 VanDerWaalsContact C-N 3.34Å; S111-M113 PolarHBondContact O-N 3.3Å; M113-L116 HydrophobicContact CE-CD2 4.2Å; M113-L116 PolarHBondContact O-N 2.99Å; M113-L116 HydrophobicContact SD-CD2 4.23Å; M113-N117 VanDerWaalsContact O-CG 3.27Å; M113-N117 PolarHBondContact O-N 3.37Å; M113-N117 PolarHBondContact O-ND2 3.06Å |
| 114 | H | 98.6 | Very high | 98.1 | Very high | 116 Ų | 116 | 80.5 Ų | 80.5 | 54% | 0.537 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -61.6 | -50 | 171.5 | -72.4 | -59.4 | 0 | 0 | 0 | 110.7 | R110 S111 L116 N117 D118 | R110-H114 PolarHBondContact O-CD2 3.26Å; R110-H114 PolarHBondContact O-N 3.46Å; S111-H114 WeakPolarHBondContact O-CB 3.48Å; S111-H114 PolarHBondContact O-N 3.48Å; H114-L116 VanDerWaalsContact C-N 3.29Å; H114-L116 PolarHBondContact O-N 3.03Å; H114-N117 PolarHBondContact O-N 2.77Å; H114-D118 VanDerWaalsContact O-CG 3.26Å; H114-D118 PolarHBondContact O-N 3.22Å |
| 115 | G | 98.4 | Very high | 97.9 | Very high | 41 Ų | 41 | 81.5 Ų | 81.5 | 42% | 0.423 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -57.6 | -38.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | S111 R112 D118 A119 | S111-G115 PolarHBondContact O-N 3.46Å; R112-G115 PolarHBondContact O-N 2.66Å; G115-D118 PolarHBondContact O-N 2.92Å; G115-A119 PolarHBondContact O-N 3.31Å |
| 116 | L | 98.4 | Very high | 97.7 | Very high | 96 Ų | 96 | 83.9 Ų | 83.9 | 50% | 0.503 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -65.1 | -42.9 | 174.8 | 179.4 | 63.5 | 0 | 0 | 0 | 112.5 | R112 M113 H114 D118 A119 L120 | R112-L116 PolarHBondContact O-N 3.33Å; R112-L116 VanDerWaalsContact O-N 3.11Å; M113-L116 HydrophobicContact CE-CD2 4.2Å; M113-L116 PolarHBondContact O-N 2.99Å; M113-L116 HydrophobicContact SD-CD2 4.23Å; H114-L116 VanDerWaalsContact C-N 3.29Å; H114-L116 PolarHBondContact O-N 3.03Å; L116-D118 VanDerWaalsContact C-N 3.32Å; L116-A119 PolarHBondContact O-N 3.38Å; L116-L120 PolarHBondContact O-N 3.4Å |
| 117 | N | 98.3 | Very high | 97.5 | Very high | 52 Ų | 52 | 80.9 Ų | 80.9 | 28% | 0.278 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -68.4 | -35.1 | 179.1 | -69.2 | -38.3 | 0 | 0 | 0 | 111.4 | M113 H114 L120 D121 K138 | M113-N117 VanDerWaalsContact O-CG 3.27Å; M113-N117 PolarHBondContact O-N 3.37Å; M113-N117 PolarHBondContact O-ND2 3.06Å; H114-N117 PolarHBondContact O-N 2.77Å; N117-L120 PolarHBondContact O-N 2.92Å; N117-D121 PolarHBondContact O-N 2.91Å; N117-K138 WeakPolarHBondContact OD1-CE 3.47Å; N117-K138 PolarHBondContact OD1-NZ 2.94Å |
| 118 | D | 98.3 | Very high | 96.9 | Very high | 98 Ų | 98 | 79.9 Ų | 79.9 | 52% | 0.524 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -64.7 | -44.5 | 175.2 | -66.2 | -20.9 | 0 | 0 | 0 | 111.1 | H114 G115 L116 L120 D121 V122 | H114-D118 VanDerWaalsContact O-CG 3.26Å; H114-D118 PolarHBondContact O-N 3.22Å; G115-D118 PolarHBondContact O-N 2.92Å; L116-D118 VanDerWaalsContact C-N 3.32Å; D118-L120 VanDerWaalsContact C-N 3.32Å; D118-L120 PolarHBondContact O-N 3.31Å; D118-D121 PolarHBondContact O-N 3.04Å; D118-D121 VanDerWaalsContact O-N 3.14Å; D118-V122 WeakPolarHBondContact O-CG2 3.35Å; D118-V122 PolarHBondContact O-N 3.08Å |
| 119 | A | 98.4 | Very high | 96.1 | Very high | 59 Ų | 59 | 73.4 Ų | 73.4 | 49% | 0.488 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -60.4 | -40.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | G115 L116 D121 V122 L123 | G115-A119 PolarHBondContact O-N 3.31Å; L116-A119 PolarHBondContact O-N 3.38Å; A119-D121 VanDerWaalsContact C-N 3.33Å; A119-D121 PolarHBondContact O-N 3.39Å; A119-V122 PolarHBondContact O-N 3Å; A119-L123 PolarHBondContact O-N 3.12Å |
| 120 | L | 98.1 | Very high | 95.2 | Very high | 22 Ų | 22 | 72 Ų | 72 | 12% | 0.115 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -65 | -37.2 | 174.8 | -175.1 | 68.3 | 0 | 0 | 0 | 112 | L116 N117 D118 L123 R124 K138 T141 | L116-L120 PolarHBondContact O-N 3.4Å; N117-L120 PolarHBondContact O-N 2.92Å; D118-L120 VanDerWaalsContact C-N 3.32Å; D118-L120 PolarHBondContact O-N 3.31Å; L120-L123 HydrophobicContact CD1-CD2 4.31Å; L120-L123 WeakPolarHBondContact O-CB 3.43Å; L120-L123 PolarHBondContact O-N 3.05Å; L120-R124 WeakPolarHBondContact O-CG 3.42Å; L120-R124 PolarHBondContact O-N 3.42Å; L120-K138 HydrophobicContact CD2-CB 4.14Å; L120-K138 HydrophobicContact CD2-CD 4.17Å; L120-K138 HydrophobicContact CD2-CG 3.65Å; L120-T141 HydrophobicContact CD1-CG2 3.81Å |
| 121 | D | 96.1 | Very high | 94.3 | Very high | 40 Ų | 40 | 66.5 Ų | 66.5 | 21% | 0.214 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -67.9 | -35.8 | 174.8 | -87.3 | -16.3 | 0 | 0 | 0 | 112.1 | N117 D118 A119 L123 R124 K125 K135 | N117-D121 PolarHBondContact O-N 2.91Å; D118-D121 PolarHBondContact O-N 3.04Å; D118-D121 VanDerWaalsContact O-N 3.14Å; A119-D121 VanDerWaalsContact C-N 3.33Å; A119-D121 PolarHBondContact O-N 3.39Å; D121-L123 VanDerWaalsContact C-N 3.35Å; D121-R124 PolarHBondContact O-N 3.07Å; D121-R124 IonicContact OD1-CZ 3.58Å; D121-R124 IonicContact OD1-NH1 2.76Å; D121-R124 PolarHBondContact OD1-NH1 3.32Å; D121-K125 WeakPolarHBondContact O-CG 3.47Å; D121-K125 PolarHBondContact O-N 3.11Å; D121-K135 IonicContact OD1-NZ 3.88Å; D121-K135 PolarHBondContact OD1-NZ 3.48Å; D121-K135 IonicContact OD2-NZ 2.95Å; D121-K135 PolarHBondContact OD2-NZ 3.21Å |
| 122 | V | 96.6 | Very high | 93.2 | Very high | 86 Ų | 86 | 73 Ų | 73 | 52% | 0.521 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -62 | -43.8 | 169.6 | 174.2 | 0 | 0 | 0 | 0 | 110.6 | D118 A119 R124 K125 | D118-V122 WeakPolarHBondContact O-CG2 3.35Å; D118-V122 PolarHBondContact O-N 3.08Å; A119-V122 PolarHBondContact O-N 3Å; V122-R124 VanDerWaalsContact C-N 3.32Å; V122-R124 PolarHBondContact O-N 3.46Å; V122-K125 WeakPolarHBondContact O-CB 3.4Å; V122-K125 PolarHBondContact O-N 3.45Å; V122-K125 VanDerWaalsContact O-N 3.12Å |
| 123 | L | 97.4 | Very high | 92.2 | Very high | 52 Ų | 52 | 72.1 Ų | 72.1 | 27% | 0.272 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -59.3 | -41.8 | 175.7 | -178.4 | 62.7 | 0 | 0 | 0 | 111.9 | A119 L120 D121 K125 V126 M127 T141 L142 A145 | A119-L123 PolarHBondContact O-N 3.12Å; L120-L123 HydrophobicContact CD1-CD2 4.31Å; L120-L123 WeakPolarHBondContact O-CB 3.43Å; L120-L123 PolarHBondContact O-N 3.05Å; D121-L123 VanDerWaalsContact C-N 3.35Å; L123-K125 PolarHBondContact O-N 3.4Å; L123-V126 HydrophobicContact CD1-CG2 4.13Å; L123-V126 WeakPolarHBondContact O-CG2 3.28Å; L123-V126 PolarHBondContact O-N 3.45Å; L123-M127 HydrophobicContact CD1-CE 3.66Å; L123-M127 HydrophobicContact CG-CE 4.17Å; L123-M127 WeakPolarHBondContact O-CG 3.41Å; L123-T141 HydrophobicContact CD2-CG2 3.94Å; L123-T141 HydrophobicContact CG-CG2 4.07Å; L123-L142 HydrophobicContact CD2-CD2 4.41Å; L123-A145 HydrophobicContact CD1-CB 4.2Å; L123-A145 HydrophobicContact CD2-CB 4.12Å; L123-A145 HydrophobicContact CG-CB 4.47Å |
| 124 | R | 95.9 | Very high | 91.6 | Very high | 43 Ų | 43 | 74.2 Ų | 74.2 | 16% | 0.162 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -60.1 | -31.5 | 176.9 | -72.6 | 174.6 | 179.2 | 125.2 | -1.3 | 113.3 | L120 D121 V122 V126 M127 A130 L136 T141 | L120-R124 WeakPolarHBondContact O-CG 3.42Å; L120-R124 PolarHBondContact O-N 3.42Å; D121-R124 PolarHBondContact O-N 3.07Å; D121-R124 IonicContact OD1-CZ 3.58Å; D121-R124 IonicContact OD1-NH1 2.76Å; D121-R124 PolarHBondContact OD1-NH1 3.32Å; V122-R124 VanDerWaalsContact C-N 3.32Å; V122-R124 PolarHBondContact O-N 3.46Å; R124-V126 VanDerWaalsContact C-N 3.3Å; R124-V126 PolarHBondContact O-N 3.35Å; R124-M127 PolarHBondContact O-N 2.9Å; R124-A130 WeakPolarHBondContact O-CB 3.43Å; R124-L136 VanDerWaalsContact CZ-O 3.28Å; R124-L136 PolarHBondContact NE-O 3.21Å; R124-L136 PolarHBondContact NH2-O 3.47Å; R124-T141 HydrophobicContact CG-CG2 3.69Å; R124-T141 PolarHBondContact NE-OG1 3.26Å |
| 125 | K | 93.8 | Very high | 91.3 | Very high | 156 Ų | 156 | 75.3 Ų | 75.3 | 68% | 0.678 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -68.8 | -28.4 | -180 | -67.5 | 170.9 | -173 | 175 | 0 | 112.9 | D121 V122 L123 | D121-K125 WeakPolarHBondContact O-CG 3.47Å; D121-K125 PolarHBondContact O-N 3.11Å; V122-K125 WeakPolarHBondContact O-CB 3.4Å; V122-K125 PolarHBondContact O-N 3.45Å; V122-K125 VanDerWaalsContact O-N 3.12Å; L123-K125 PolarHBondContact O-N 3.4Å |
| 126 | V | 94 | Very high | 91.1 | Very high | 92 Ų | 92 | 74.1 Ų | 74.1 | 56% | 0.558 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95 | 3.5 | -179.2 | -59 | 0 | 0 | 0 | 0 | 113.2 | L123 R124 | L123-V126 HydrophobicContact CD1-CG2 4.13Å; L123-V126 WeakPolarHBondContact O-CG2 3.28Å; L123-V126 PolarHBondContact O-N 3.45Å; R124-V126 VanDerWaalsContact C-N 3.3Å; R124-V126 PolarHBondContact O-N 3.35Å |
| 127 | M | 93.6 | Very high | 91 | Very high | 13 Ų | 13 | 72.4 Ų | 72.4 | 6% | 0.064 | 39% | 0.392 | C | S | . | . | S | Bend | trans | -75.2 | 146.5 | 175.9 | -66.8 | -62.2 | 95.2 | 0 | 0 | 111.6 | L123 R124 C129 A130 L144 A145 Y148 | L123-M127 HydrophobicContact CD1-CE 3.66Å; L123-M127 HydrophobicContact CG-CE 4.17Å; L123-M127 WeakPolarHBondContact O-CG 3.41Å; R124-M127 PolarHBondContact O-N 2.9Å; M127-C129 PolarHBondContact O-N 3.05Å; M127-A130 PolarHBondContact O-N 2.84Å; M127-A130 VanDerWaalsContact O-N 3.14Å; M127-L144 HydrophobicContact CB-CD2 4.02Å; M127-L144 HydrophobicContact CG-CD2 4.18Å; M127-L144 HydrophobicContact SD-CB 4.32Å; M127-L144 HydrophobicContact SD-CD2 4.09Å; M127-L144 HydrophobicContact SD-CG 3.96Å; M127-A145 HydrophobicContact CE-CB 3.92Å; M127-A145 HydrophobicContact SD-CB 3.95Å; M127-Y148 HydrophobicContact CE-CD1 4.31Å |
| 128 | P | 87.6 | Confident | 91 | Very high | 30 Ų | 30 | 74.9 Ų | 74.9 | 20% | 0.195 | 40% | 0.401 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.4 | -5 | -176.7 | 24.2 | -33.1 | 0 | 0 | 0 | 115 | L144 Y148 L171 L187 | P128-L144 HydrophobicContact CG-CD1 4.39Å; P128-Y148 HydrophobicContact CG-CD1 4.39Å; P128-Y148 HydrophobicContact CG-CD2 4.21Å; P128-Y148 HydrophobicContact CG-CE2 4.39Å; P128-Y148 HydrophobicContact CG-CG 4.21Å; P128-L171 HydrophobicContact CB-CD1 4.34Å; P128-L171 HydrophobicContact CG-CD1 3.91Å; P128-L171 HydrophobicContact CG-CD2 4.25Å; P128-L187 HydrophobicContact CB-CD2 4.36Å |
| 129 | C | 81.2 | Confident | 91 | Very high | 3 Ų | 3 | 74.4 Ų | 74.4 | 2% | 0.02 | 40% | 0.397 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -131.8 | 35.2 | 176.8 | 63.8 | 0 | 0 | 0 | 0 | 112.6 | M127 S131 L144 L182 V183 C186 | M127-C129 PolarHBondContact O-N 3.05Å; C129-S131 PolarHBondContact O-N 3.07Å; C129-L144 WeakPolarHBondContact SG-CD2 3.46Å; C129-L182 HydrophobicContact CB-CG 4.3Å; C129-V183 HydrophobicContact CB-CG2 4.09Å; C129-V183 VanDerWaalsContact SG-CG2 3.52Å; C129-C186 HydrophobicContact CB-CB 3.8Å |
| 130 | A | 79.3 | Confident | 90.9 | Very high | 56 Ų | 56 | 72.1 Ų | 72.1 | 46% | 0.463 | 38% | 0.377 | S | S | . | . | trans | -55.9 | 103 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | R124 M127 | R124-A130 WeakPolarHBondContact O-CB 3.43Å; M127-A130 PolarHBondContact O-N 2.84Å; M127-A130 VanDerWaalsContact O-N 3.14Å | ||
| 131 | S | 80.6 | Confident | 90.9 | Very high | 42 Ų | 42 | 71.1 Ų | 71.1 | 29% | 0.294 | 37% | 0.371 | S | S | . | . | trans | -89.5 | 137.5 | 176.6 | 173 | 0 | 0 | 0 | 0 | 110.9 | C129 T133 Q134 | C129-S131 PolarHBondContact O-N 3.07Å; S131-T133 VanDerWaalsContact C-N 3.33Å; S131-T133 PolarHBondContact OG-N 3.05Å; S131-T133 PolarHBondContact OG-OG1 3.31Å; S131-Q134 WeakPolarHBondContact CB-O 3.28Å; S131-Q134 PolarHBondContact OG-N 3.06Å; S131-Q134 VanDerWaalsContact OG-N 3.15Å | ||
| 132 | K | 74.7 | Confident | 91 | Very high | 218 Ų | 218 | 74 Ų | 74 | 95% | 0.948 | 39% | 0.386 | S | S | * | . | S | Bend | trans | -73.3 | -26.7 | 176.3 | -65.4 | -179.5 | -179 | 178.3 | 0 | 112.6 | ||
| 133 | T | 78.6 | Confident | 91 | Very high | 139 Ų | 139 | 75.1 Ų | 75.1 | 85% | 0.853 | 38% | 0.381 | S | S | * | . | S | Bend | trans | -106.5 | -23.6 | -171.9 | 55.1 | 0 | 0 | 0 | 0 | 112.9 | S131 | S131-T133 VanDerWaalsContact C-N 3.33Å; S131-T133 PolarHBondContact OG-N 3.05Å; S131-T133 PolarHBondContact OG-OG1 3.31Å |
| 134 | Q | 86 | Confident | 91 | Very high | 105 Ų | 105 | 72.7 Ų | 72.7 | 49% | 0.491 | 37% | 0.368 | S | S | . | . | trans | -126.1 | 117.8 | -176.6 | -172.2 | 178.6 | -3.9 | 0 | 0 | 111.3 | S131 | S131-Q134 WeakPolarHBondContact CB-O 3.28Å; S131-Q134 PolarHBondContact OG-N 3.06Å; S131-Q134 VanDerWaalsContact OG-N 3.15Å | ||
| 135 | K | 91.9 | Very high | 91.1 | Very high | 138 Ų | 138 | 71.2 Ų | 71.2 | 60% | 0.6 | 37% | 0.365 | S | S | * | . | P | Polyproline II helix | trans | -84.5 | 133.2 | 171.5 | -65.2 | -171.2 | 177 | -167.4 | 0 | 110.1 | D121 | D121-K135 IonicContact OD1-NZ 3.88Å; D121-K135 PolarHBondContact OD1-NZ 3.48Å; D121-K135 IonicContact OD2-NZ 2.95Å; D121-K135 PolarHBondContact OD2-NZ 3.21Å |
| 136 | L | 94.3 | Very high | 91.3 | Very high | 16 Ų | 16 | 72.8 Ų | 72.8 | 8% | 0.084 | 37% | 0.367 | C | S | . | . | P | Polyproline II helix | trans | -64.7 | 147.8 | 167.9 | -63.2 | -178.4 | 0 | 0 | 0 | 110.6 | R124 E140 T141 L144 T179 L182 | R124-L136 VanDerWaalsContact CZ-O 3.28Å; R124-L136 PolarHBondContact NE-O 3.21Å; R124-L136 PolarHBondContact NH2-O 3.47Å; L136-E140 HydrophobicContact CB-CB 4.37Å; L136-T141 WeakPolarHBondContact CB-OG1 3.49Å; L136-L144 HydrophobicContact CD1-CD2 3.7Å; L136-T179 HydrophobicContact CD1-CG2 4.43Å; L136-T179 HydrophobicContact CD2-CG2 3.67Å; L136-L182 HydrophobicContact CD2-CD2 4.12Å |
| 137 | S | 96.4 | Very high | 91.5 | Very high | 60 Ų | 60 | 69.2 Ų | 69.2 | 42% | 0.42 | 35% | 0.345 | S | S | . | . | P | Polyproline II helix | trans | -62.6 | 164.4 | 173.2 | 80.1 | 0 | 0 | 0 | 0 | 111 | I139 E140 T141 | S137-I139 VanDerWaalsContact C-N 3.31Å; S137-I139 PolarHBondContact O-N 3.28Å; S137-I139 WeakPolarHBondContact OG-CG2 3.44Å; S137-E140 PolarHBondContact O-N 3.17Å; S137-E140 WeakPolarHBondContact OG-CB 3.4Å; S137-E140 WeakPolarHBondContact OG-CG 3.31Å; S137-E140 PolarHBondContact OG-N 2.99Å; S137-T141 WeakPolarHBondContact O-CB 3.4Å; S137-T141 PolarHBondContact O-N 3.43Å; S137-T141 PolarHBondContact O-OG1 3.44Å |
| 138 | K | 97.8 | Very high | 91.6 | Very high | 105 Ų | 105 | 71.7 Ų | 71.7 | 46% | 0.457 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -56.8 | -46.4 | 180 | -60.7 | -164.9 | 168.9 | -173.9 | 0 | 111.4 | N117 L120 L142 | N117-K138 WeakPolarHBondContact OD1-CE 3.47Å; N117-K138 PolarHBondContact OD1-NZ 2.94Å; L120-K138 HydrophobicContact CD2-CB 4.14Å; L120-K138 HydrophobicContact CD2-CD 4.17Å; L120-K138 HydrophobicContact CD2-CG 3.65Å; K138-L142 WeakPolarHBondContact O-CG 3.49Å; K138-L142 PolarHBondContact O-N 2.92Å; K138-L142 VanDerWaalsContact O-N 3.17Å |
| 139 | I | 97.9 | Very high | 92.1 | Very high | 88 Ų | 88 | 75.8 Ų | 75.8 | 45% | 0.451 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -68.2 | -42.3 | -178.9 | -175.5 | 59.3 | 0 | 0 | 0 | 112.4 | S137 T141 L142 R143 | S137-I139 VanDerWaalsContact C-N 3.31Å; S137-I139 PolarHBondContact O-N 3.28Å; S137-I139 WeakPolarHBondContact OG-CG2 3.44Å; I139-T141 VanDerWaalsContact C-N 3.32Å; I139-T141 PolarHBondContact O-N 2.9Å; I139-L142 PolarHBondContact O-N 3.45Å; I139-R143 HydrophobicContact CD1-CG 4.24Å; I139-R143 HydrophobicContact CG1-CG 4.39Å; I139-R143 WeakPolarHBondContact O-CB 3.29Å; I139-R143 WeakPolarHBondContact O-CG 3.5Å; I139-R143 PolarHBondContact O-N 3.46Å |
| 140 | E | 97.3 | Very high | 92.8 | Very high | 11 Ų | 11 | 82.5 Ų | 82.5 | 5% | 0.051 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -66.8 | -37.6 | 180 | -64.9 | -68.2 | 101.7 | 0 | 0 | 111 | L136 S137 R143 L144 S176 T179 | L136-E140 HydrophobicContact CB-CB 4.37Å; S137-E140 PolarHBondContact O-N 3.17Å; S137-E140 WeakPolarHBondContact OG-CB 3.4Å; S137-E140 WeakPolarHBondContact OG-CG 3.31Å; S137-E140 PolarHBondContact OG-N 2.99Å; E140-R143 PolarHBondContact O-N 3.5Å; E140-R143 IonicContact OE1-NH1 3.22Å; E140-R143 PolarHBondContact OE1-NH1 2.91Å; E140-R143 VanDerWaalsContact OE1-NH1 3.13Å; E140-L144 VanDerWaalsContact O-CB 3.28Å; E140-L144 WeakPolarHBondContact O-CB 3.48Å; E140-L144 PolarHBondContact O-N 2.99Å; E140-S176 WeakPolarHBondContact OE2-CB 3.41Å; E140-S176 PolarHBondContact OE2-N 3.28Å; E140-S176 PolarHBondContact OE2-OG 3.12Å; E140-T179 WeakPolarHBondContact OE2-CB 3.48Å; E140-T179 PolarHBondContact OE2-OG1 3.39Å |
| 141 | T | 97.4 | Very high | 93.5 | Very high | 0 Ų | 0 | 79.9 Ų | 79.9 | 0% | 0 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -60.5 | -46.9 | 174.2 | -51.6 | 0 | 0 | 0 | 0 | 110.9 | L120 L123 R124 L136 S137 I139 A145 | L120-T141 HydrophobicContact CD1-CG2 3.81Å; L123-T141 HydrophobicContact CD2-CG2 3.94Å; L123-T141 HydrophobicContact CG-CG2 4.07Å; R124-T141 HydrophobicContact CG-CG2 3.69Å; R124-T141 PolarHBondContact NE-OG1 3.26Å; L136-T141 WeakPolarHBondContact CB-OG1 3.49Å; S137-T141 WeakPolarHBondContact O-CB 3.4Å; S137-T141 PolarHBondContact O-N 3.43Å; S137-T141 PolarHBondContact O-OG1 3.44Å; I139-T141 VanDerWaalsContact C-N 3.32Å; I139-T141 PolarHBondContact O-N 2.9Å; T141-A145 VanDerWaalsContact O-CB 3.29Å; T141-A145 WeakPolarHBondContact O-CB 3.44Å; T141-A145 PolarHBondContact O-N 3.39Å |
| 142 | L | 98.3 | Very high | 94.1 | Very high | 102 Ų | 102 | 81 Ų | 81 | 53% | 0.534 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -67.8 | -38.8 | -179.7 | -66.9 | 175.5 | 0 | 0 | 0 | 112.6 | L123 K138 I139 R146 | L123-L142 HydrophobicContact CD2-CD2 4.41Å; K138-L142 WeakPolarHBondContact O-CG 3.49Å; K138-L142 PolarHBondContact O-N 2.92Å; K138-L142 VanDerWaalsContact O-N 3.17Å; I139-L142 PolarHBondContact O-N 3.45Å; L142-R146 PolarHBondContact O-N 3.38Å; L142-R146 VanDerWaalsContact O-N 3.12Å |
| 143 | R | 97.9 | Very high | 95.1 | Very high | 109 Ų | 109 | 72.8 Ų | 72.8 | 41% | 0.411 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -64.3 | -49.5 | 175.3 | -75 | 174.7 | 174.4 | 169.4 | -6.2 | 111.4 | I139 E140 A145 R146 N147 G174 L175 | I139-R143 HydrophobicContact CD1-CG 4.24Å; I139-R143 HydrophobicContact CG1-CG 4.39Å; I139-R143 WeakPolarHBondContact O-CB 3.29Å; I139-R143 WeakPolarHBondContact O-CG 3.5Å; I139-R143 PolarHBondContact O-N 3.46Å; E140-R143 PolarHBondContact O-N 3.5Å; E140-R143 IonicContact OE1-NH1 3.22Å; E140-R143 PolarHBondContact OE1-NH1 2.91Å; E140-R143 VanDerWaalsContact OE1-NH1 3.13Å; R143-A145 VanDerWaalsContact C-N 3.33Å; R143-A145 PolarHBondContact O-N 2.97Å; R143-R146 PolarHBondContact O-N 3.38Å; R143-N147 VanDerWaalsContact O-CG 3.27Å; R143-N147 PolarHBondContact O-N 3.4Å; R143-N147 PolarHBondContact O-OD1 2.88Å; R143-G174 PolarHBondContact NH1-O 2.82Å; R143-L175 HydrophobicContact CB-CD2 3.57Å |
| 144 | L | 97.2 | Very high | 95.8 | Very high | 0 Ų | 0 | 70.2 Ų | 70.2 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -62.6 | -40.5 | 178.9 | -179.5 | 62.5 | 0 | 0 | 0 | 111.4 | M127 P128 C129 L136 E140 R146 N147 Y148 L171 L175 V183 | M127-L144 HydrophobicContact CB-CD2 4.02Å; M127-L144 HydrophobicContact CG-CD2 4.18Å; M127-L144 HydrophobicContact SD-CB 4.32Å; M127-L144 HydrophobicContact SD-CD2 4.09Å; M127-L144 HydrophobicContact SD-CG 3.96Å; P128-L144 HydrophobicContact CG-CD1 4.39Å; C129-L144 WeakPolarHBondContact SG-CD2 3.46Å; L136-L144 HydrophobicContact CD1-CD2 3.7Å; E140-L144 VanDerWaalsContact O-CB 3.28Å; E140-L144 WeakPolarHBondContact O-CB 3.48Å; E140-L144 PolarHBondContact O-N 2.99Å; L144-R146 PolarHBondContact O-N 3.39Å; L144-N147 PolarHBondContact O-N 2.74Å; L144-Y148 VanDerWaalsContact O-CB 3.28Å; L144-Y148 WeakPolarHBondContact O-CB 3.48Å; L144-Y148 PolarHBondContact O-N 3.16Å; L144-L171 HydrophobicContact CD1-CB 4.23Å; L144-L171 HydrophobicContact CD1-CD2 4.13Å; L144-L175 HydrophobicContact CB-CD1 4.18Å; L144-L175 HydrophobicContact CB-CD2 4.32Å; L144-L175 HydrophobicContact CD1-CD1 3.88Å; L144-V183 HydrophobicContact CD1-CG2 4.17Å; L144-V183 HydrophobicContact CD2-CG2 4.38Å |
| 145 | A | 98.1 | Very high | 96 | Very high | 12 Ų | 12 | 66.7 Ų | 66.7 | 10% | 0.099 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -61 | -44.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L123 M127 T141 R143 Y148 I149 | L123-A145 HydrophobicContact CD1-CB 4.2Å; L123-A145 HydrophobicContact CD2-CB 4.12Å; L123-A145 HydrophobicContact CG-CB 4.47Å; M127-A145 HydrophobicContact CE-CB 3.92Å; M127-A145 HydrophobicContact SD-CB 3.95Å; T141-A145 VanDerWaalsContact O-CB 3.29Å; T141-A145 WeakPolarHBondContact O-CB 3.44Å; T141-A145 PolarHBondContact O-N 3.39Å; R143-A145 VanDerWaalsContact C-N 3.33Å; R143-A145 PolarHBondContact O-N 2.97Å; A145-Y148 PolarHBondContact O-N 3.46Å; A145-I149 WeakPolarHBondContact O-CG1 3.28Å; A145-I149 PolarHBondContact O-N 3.16Å |
| 146 | R | 98.1 | Very high | 96 | Very high | 189 Ų | 189 | 67.2 Ų | 67.2 | 71% | 0.713 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -58.9 | -49.4 | 174.5 | -179.4 | -169.4 | -61.9 | -163 | -2.3 | 111.4 | L142 R143 L144 Y148 I149 W150 | L142-R146 PolarHBondContact O-N 3.38Å; L142-R146 VanDerWaalsContact O-N 3.12Å; R143-R146 PolarHBondContact O-N 3.38Å; L144-R146 PolarHBondContact O-N 3.39Å; R146-Y148 VanDerWaalsContact C-N 3.26Å; R146-Y148 PolarHBondContact O-N 3.33Å; R146-I149 PolarHBondContact O-N 2.82Å; R146-W150 PolarHBondContact O-N 3.38Å; R146-W150 VanDerWaalsContact O-N 3.14Å |
| 147 | N | 97.4 | Very high | 95.9 | Very high | 17 Ų | 17 | 74 Ų | 74 | 9% | 0.091 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -62.2 | -38.1 | -179.8 | -66.1 | -6.3 | 0 | 0 | 0 | 111.1 | R143 L144 W150 A151 M170 L171 K173 | R143-N147 VanDerWaalsContact O-CG 3.27Å; R143-N147 PolarHBondContact O-N 3.4Å; R143-N147 PolarHBondContact O-OD1 2.88Å; L144-N147 PolarHBondContact O-N 2.74Å; N147-W150 PolarHBondContact O-N 2.94Å; N147-A151 VanDerWaalsContact O-CB 3.28Å; N147-A151 WeakPolarHBondContact O-CB 3.28Å; N147-A151 PolarHBondContact O-N 2.79Å; N147-M170 WeakPolarHBondContact CB-O 3.35Å; N147-M170 PolarHBondContact ND2-O 2.84Å; N147-L171 PolarHBondContact ND2-O 3.2Å; N147-K173 PolarHBondContact ND2-O 3.13Å |
| 148 | Y | 96.6 | Very high | 95.5 | Very high | 65 Ų | 65 | 73.4 Ų | 73.4 | 26% | 0.255 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -69 | -43.1 | -179.5 | -173 | -147.6 | 0 | 0 | 0 | 112.5 | M127 P128 L144 A145 R146 W150 A151 L152 F167 L171 | M127-Y148 HydrophobicContact CE-CD1 4.31Å; P128-Y148 HydrophobicContact CG-CD1 4.39Å; P128-Y148 HydrophobicContact CG-CD2 4.21Å; P128-Y148 HydrophobicContact CG-CE2 4.39Å; P128-Y148 HydrophobicContact CG-CG 4.21Å; L144-Y148 VanDerWaalsContact O-CB 3.28Å; L144-Y148 WeakPolarHBondContact O-CB 3.48Å; L144-Y148 PolarHBondContact O-N 3.16Å; A145-Y148 PolarHBondContact O-N 3.46Å; R146-Y148 VanDerWaalsContact C-N 3.26Å; R146-Y148 PolarHBondContact O-N 3.33Å; Y148-W150 VanDerWaalsContact C-N 3.32Å; Y148-W150 PolarHBondContact O-N 2.65Å; Y148-A151 PolarHBondContact O-N 3.28Å; Y148-L152 HydrophobicContact CD1-CD1 4.43Å; Y148-L152 HydrophobicContact CD2-CD1 3.95Å; Y148-L152 HydrophobicContact CD2-CD2 4.38Å; Y148-L152 HydrophobicContact CD2-CG 3.8Å; Y148-L152 HydrophobicContact CE1-CD1 4.09Å; Y148-L152 HydrophobicContact CE2-CD1 3.56Å; Y148-L152 HydrophobicContact CE2-CD2 3.72Å; Y148-L152 HydrophobicContact CE2-CG 3.54Å; Y148-L152 HydrophobicContact CG-CD1 4.38Å; Y148-L152 WeakPolarHBondContact O-CB 3.37Å; Y148-L152 VanDerWaalsContact O-CG 3.32Å; Y148-L152 WeakPolarHBondContact O-CG 3.36Å; Y148-L152 PolarHBondContact O-N 2.91Å; Y148-F167 HydrophobicContact CD2-CZ 4.21Å; Y148-F167 HydrophobicContact CE2-CZ 4.04Å; Y148-L171 HydrophobicContact CD2-CD2 3.91Å; Y148-L171 HydrophobicContact CG-CD2 4.22Å |
| 149 | I | 97.1 | Very high | 94.7 | Very high | 116 Ų | 116 | 71.8 Ų | 71.8 | 60% | 0.595 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -56.5 | -49.8 | 173.1 | -68.1 | 165.9 | 0 | 0 | 0 | 109.8 | A145 R146 L152 S153 | A145-I149 WeakPolarHBondContact O-CG1 3.28Å; A145-I149 PolarHBondContact O-N 3.16Å; R146-I149 PolarHBondContact O-N 2.82Å; I149-L152 PolarHBondContact O-N 3.39Å; I149-S153 PolarHBondContact O-N 3.04Å; I149-S153 PolarHBondContact O-OG 3.05Å; I149-S153 VanDerWaalsContact O-OG 3.11Å |
| 150 | W | 95.9 | Very high | 93.5 | Very high | 145 Ų | 145 | 73.9 Ų | 73.9 | 55% | 0.549 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -62.3 | -46.8 | 179.7 | -175 | 6.8 | 0 | 0 | 0 | 112.2 | R146 N147 Y148 L152 S153 E154 | R146-W150 PolarHBondContact O-N 3.38Å; R146-W150 VanDerWaalsContact O-N 3.14Å; N147-W150 PolarHBondContact O-N 2.94Å; Y148-W150 VanDerWaalsContact C-N 3.32Å; Y148-W150 PolarHBondContact O-N 2.65Å; W150-L152 VanDerWaalsContact C-N 3.28Å; W150-L152 PolarHBondContact O-N 3.34Å; W150-S153 WeakPolarHBondContact O-CB 3.46Å; W150-S153 PolarHBondContact O-N 3.18Å; W150-S153 VanDerWaalsContact O-N 3.12Å; W150-E154 PolarHBondContact O-N 3.4Å |
| 151 | A | 93.9 | Very high | 92.5 | Very high | 0 Ų | 0 | 76.5 Ų | 76.5 | 0% | 0 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -61.3 | -37.1 | -180 | 0 | 0 | 0 | 0 | 0 | 112.2 | N147 Y148 V155 F167 M170 L171 | N147-A151 VanDerWaalsContact O-CB 3.28Å; N147-A151 WeakPolarHBondContact O-CB 3.28Å; N147-A151 PolarHBondContact O-N 2.79Å; Y148-A151 PolarHBondContact O-N 3.28Å; A151-V155 VanDerWaalsContact O-CG2 3.31Å; A151-V155 WeakPolarHBondContact O-CG2 3.44Å; A151-V155 PolarHBondContact O-N 2.92Å; A151-F167 HydrophobicContact CB-CD2 3.8Å; A151-F167 HydrophobicContact CB-CE2 3.49Å; A151-F167 VanDerWaalsContact CB-CE2 3.49Å; A151-F167 HydrophobicContact CB-CZ 4.27Å; A151-M170 HydrophobicContact CB-CB 4.28Å; A151-M170 HydrophobicContact CB-CE 4.06Å; A151-L171 HydrophobicContact CB-CD2 4.35Å |
| 152 | L | 94.1 | Very high | 91.3 | Very high | 65 Ų | 65 | 79.4 Ų | 79.4 | 34% | 0.34 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -70.5 | -38.9 | 173.9 | -69.6 | 178.7 | 0 | 0 | 0 | 112.5 | Y148 I149 W150 E154 V155 L156 F167 | Y148-L152 HydrophobicContact CD1-CD1 4.43Å; Y148-L152 HydrophobicContact CD2-CD1 3.95Å; Y148-L152 HydrophobicContact CD2-CD2 4.38Å; Y148-L152 HydrophobicContact CD2-CG 3.8Å; Y148-L152 HydrophobicContact CE1-CD1 4.09Å; Y148-L152 HydrophobicContact CE2-CD1 3.56Å; Y148-L152 HydrophobicContact CE2-CD2 3.72Å; Y148-L152 HydrophobicContact CE2-CG 3.54Å; Y148-L152 HydrophobicContact CG-CD1 4.38Å; Y148-L152 WeakPolarHBondContact O-CB 3.37Å; Y148-L152 VanDerWaalsContact O-CG 3.32Å; Y148-L152 WeakPolarHBondContact O-CG 3.36Å; Y148-L152 PolarHBondContact O-N 2.91Å; I149-L152 PolarHBondContact O-N 3.39Å; W150-L152 VanDerWaalsContact C-N 3.28Å; W150-L152 PolarHBondContact O-N 3.34Å; L152-E154 VanDerWaalsContact C-N 3.33Å; L152-E154 PolarHBondContact O-N 2.93Å; L152-V155 PolarHBondContact O-N 3.43Å; L152-L156 WeakPolarHBondContact O-CG 3.48Å; L152-L156 PolarHBondContact O-N 2.96Å; L152-F167 HydrophobicContact CD2-CE2 4.45Å |
| 153 | S | 95.1 | Very high | 89.9 | Confident | 47 Ų | 47 | 82.2 Ų | 82.2 | 33% | 0.329 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -57.3 | -46.9 | 173.2 | -65.4 | 0 | 0 | 0 | 0 | 111.3 | I149 W150 V155 L156 E157 | I149-S153 PolarHBondContact O-N 3.04Å; I149-S153 PolarHBondContact O-OG 3.05Å; I149-S153 VanDerWaalsContact O-OG 3.11Å; W150-S153 WeakPolarHBondContact O-CB 3.46Å; W150-S153 PolarHBondContact O-N 3.18Å; W150-S153 VanDerWaalsContact O-N 3.12Å; S153-V155 VanDerWaalsContact C-N 3.33Å; S153-V155 PolarHBondContact O-N 3.17Å; S153-L156 PolarHBondContact O-N 2.97Å; S153-L156 VanDerWaalsContact O-N 3.17Å; S153-E157 WeakPolarHBondContact O-CG 3.49Å; S153-E157 PolarHBondContact O-N 3.44Å |
| 154 | E | 91.9 | Very high | 88.8 | Confident | 84 Ų | 84 | 79.4 Ų | 79.4 | 39% | 0.393 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -62.1 | -40 | 178.6 | -170 | 67.6 | -156.4 | 0 | 0 | 112.1 | W150 L152 L156 E157 S158 | W150-E154 PolarHBondContact O-N 3.4Å; L152-E154 VanDerWaalsContact C-N 3.33Å; L152-E154 PolarHBondContact O-N 2.93Å; E154-L156 VanDerWaalsContact C-N 3.34Å; E154-L156 PolarHBondContact O-N 3.17Å; E154-E157 PolarHBondContact O-N 3.04Å; E154-S158 VanDerWaalsContact O-CB 3.26Å; E154-S158 WeakPolarHBondContact O-CB 3.48Å; E154-S158 PolarHBondContact O-N 3.45Å; E154-S158 PolarHBondContact O-OG 3.39Å |
| 155 | V | 91.5 | Very high | 88 | Confident | 31 Ų | 31 | 85.8 Ų | 85.8 | 19% | 0.188 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -62.9 | -40.8 | 176 | 161.8 | 0 | 0 | 0 | 0 | 111.3 | A151 L152 S153 G159 Q160 P162 F167 | A151-V155 VanDerWaalsContact O-CG2 3.31Å; A151-V155 WeakPolarHBondContact O-CG2 3.44Å; A151-V155 PolarHBondContact O-N 2.92Å; L152-V155 PolarHBondContact O-N 3.43Å; S153-V155 VanDerWaalsContact C-N 3.33Å; S153-V155 PolarHBondContact O-N 3.17Å; V155-G159 WeakPolarHBondContact O-CA 3.36Å; V155-G159 PolarHBondContact O-N 3.21Å; V155-Q160 WeakPolarHBondContact CG1-O 3.34Å; V155-P162 HydrophobicContact CG2-CB 4.14Å; V155-F167 HydrophobicContact CG2-CD2 4.13Å; V155-F167 HydrophobicContact CG2-CE2 4.31Å |
| 156 | L | 92.6 | Very high | 87.4 | Confident | 149 Ų | 149 | 86.7 Ų | 86.7 | 78% | 0.78 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -69.6 | -35.6 | 177.9 | -68.7 | 172.6 | 0 | 0 | 0 | 112.5 | L152 S153 E154 | L152-L156 WeakPolarHBondContact O-CG 3.48Å; L152-L156 PolarHBondContact O-N 2.96Å; S153-L156 PolarHBondContact O-N 2.97Å; S153-L156 VanDerWaalsContact O-N 3.17Å; E154-L156 VanDerWaalsContact C-N 3.34Å; E154-L156 PolarHBondContact O-N 3.17Å |
| 157 | E | 92.1 | Very high | 87 | Confident | 158 Ų | 158 | 78.2 Ų | 78.2 | 74% | 0.738 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -77.3 | -42.9 | 179.7 | -72.3 | 176.2 | -159.3 | 0 | 0 | 112.7 | S153 E154 | S153-E157 WeakPolarHBondContact O-CG 3.49Å; S153-E157 PolarHBondContact O-N 3.44Å; E154-E157 PolarHBondContact O-N 3.04Å |
| 158 | S | 86.9 | Confident | 86.6 | Confident | 48 Ų | 48 | 78.4 Ų | 78.4 | 34% | 0.336 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -82.7 | -18.3 | -177.8 | 65.9 | 0 | 0 | 0 | 0 | 113.7 | E154 Q160 | E154-S158 VanDerWaalsContact O-CB 3.26Å; E154-S158 WeakPolarHBondContact O-CB 3.48Å; E154-S158 PolarHBondContact O-N 3.45Å; E154-S158 PolarHBondContact O-OG 3.39Å; S158-Q160 PolarHBondContact O-N 2.9Å; S158-Q160 PolarHBondContact OG-N 3.43Å |
| 159 | G | 81 | Confident | 86.4 | Confident | 71 Ų | 71 | 81.6 Ų | 81.6 | 73% | 0.732 | 44% | 0.442 | S | S | * | . | trans | 64.1 | 13.9 | -172.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | V155 | V155-G159 WeakPolarHBondContact O-CA 3.36Å; V155-G159 PolarHBondContact O-N 3.21Å | ||
| 160 | Q | 73.7 | Confident | 86.2 | Confident | 132 Ų | 132 | 79 Ų | 79 | 62% | 0.617 | 43% | 0.428 | S | S | * | . | trans | -87.3 | 146.2 | -178.4 | -63.8 | -175.1 | 2.3 | 0 | 0 | 111.4 | V155 S158 | V155-Q160 WeakPolarHBondContact CG1-O 3.34Å; S158-Q160 PolarHBondContact O-N 2.9Å; S158-Q160 PolarHBondContact OG-N 3.43Å | ||
| 161 | S | 74.9 | Confident | 86.1 | Confident | 67 Ų | 67 | 72 Ų | 72 | 47% | 0.469 | 40% | 0.402 | S | S | . | . | trans | -64.4 | 138.7 | 178.7 | 177.8 | 0 | 0 | 0 | 0 | 111.7 | E163 | S161-E163 PolarHBondContact O-N 2.95Å; S161-E163 WeakPolarHBondContact OG-CG 3.36Å; S161-E163 PolarHBondContact OG-N 3.25Å | ||
| 162 | P | 73.3 | Confident | 86.1 | Confident | 60 Ų | 60 | 73.2 Ų | 73.2 | 39% | 0.39 | 41% | 0.41 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.3 | 1 | 175 | 29.1 | -36 | 0 | 0 | 0 | 114.2 | V155 S164 F167 | V155-P162 HydrophobicContact CG2-CB 4.14Å; P162-S164 PolarHBondContact O-N 3.03Å; P162-F167 HydrophobicContact CB-CD1 4.42Å; P162-F167 HydrophobicContact CB-CD2 4.03Å; P162-F167 HydrophobicContact CB-CE1 4.45Å; P162-F167 HydrophobicContact CB-CE2 4.06Å; P162-F167 HydrophobicContact CB-CG 4.21Å; P162-F167 HydrophobicContact CB-CZ 4.29Å; P162-F167 VanDerWaalsContact O-CB 3.29Å; P162-F167 WeakPolarHBondContact O-CB 3.41Å; P162-F167 WeakPolarHBondContact O-CD1 3.34Å; P162-F167 WeakPolarHBondContact O-CG 3.48Å |
| 163 | E | 68.1 | Low | 86.2 | Confident | 161 Ų | 161 | 76.4 Ų | 76.4 | 75% | 0.752 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.6 | 9.5 | 179.5 | -65 | -179.6 | 171.5 | 0 | 0 | 114 | S161 | S161-E163 PolarHBondContact O-N 2.95Å; S161-E163 WeakPolarHBondContact OG-CG 3.36Å; S161-E163 PolarHBondContact OG-N 3.25Å |
| 164 | S | 74.4 | Confident | 86.2 | Confident | 50 Ų | 50 | 76.8 Ų | 76.8 | 35% | 0.35 | 43% | 0.432 | S | S | . | . | S | Bend | trans | -83.2 | 149.3 | -178.8 | 73.3 | 0 | 0 | 0 | 0 | 112.8 | P162 G166 F167 | P162-S164 PolarHBondContact O-N 3.03Å; S164-G166 PolarHBondContact O-N 3.13Å; S164-F167 WeakPolarHBondContact O-CB 3.49Å; S164-F167 PolarHBondContact O-N 3.37Å; S164-F167 PolarHBondContact OG-N 3.21Å |
| 165 | H | 80.7 | Confident | 86.4 | Confident | 134 Ų | 134 | 73.7 Ų | 73.7 | 62% | 0.62 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -54 | -34.7 | 167.9 | -176.3 | -85.5 | 0 | 0 | 0 | 112.2 | F167 T168 E169 L189 | H165-F167 VanDerWaalsContact C-N 3.3Å; H165-F167 PolarHBondContact O-N 3.25Å; H165-T168 PolarHBondContact O-N 3.33Å; H165-E169 PolarHBondContact O-N 3.02Å; H165-L189 HydrophobicContact CB-CD1 4.02Å |
| 166 | G | 85.9 | Confident | 86.6 | Confident | 31 Ų | 31 | 74.4 Ų | 74.4 | 32% | 0.32 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -60.8 | -35.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | S164 E169 M170 | S164-G166 PolarHBondContact O-N 3.13Å; G166-E169 PolarHBondContact O-N 3.37Å; G166-M170 VanDerWaalsContact O-CG 3.31Å; G166-M170 WeakPolarHBondContact O-CG 3.37Å; G166-M170 PolarHBondContact O-N 3.32Å |
| 167 | F | 89.5 | Confident | 86.7 | Confident | 12 Ų | 12 | 73.6 Ų | 73.6 | 5% | 0.053 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -63.3 | -45.1 | 176.3 | -175.4 | -97.8 | 0 | 0 | 0 | 112.1 | Y148 A151 L152 V155 P162 S164 H165 M170 L171 L187 | Y148-F167 HydrophobicContact CD2-CZ 4.21Å; Y148-F167 HydrophobicContact CE2-CZ 4.04Å; A151-F167 HydrophobicContact CB-CD2 3.8Å; A151-F167 HydrophobicContact CB-CE2 3.49Å; A151-F167 VanDerWaalsContact CB-CE2 3.49Å; A151-F167 HydrophobicContact CB-CZ 4.27Å; L152-F167 HydrophobicContact CD2-CE2 4.45Å; V155-F167 HydrophobicContact CG2-CD2 4.13Å; V155-F167 HydrophobicContact CG2-CE2 4.31Å; P162-F167 HydrophobicContact CB-CD1 4.42Å; P162-F167 HydrophobicContact CB-CD2 4.03Å; P162-F167 HydrophobicContact CB-CE1 4.45Å; P162-F167 HydrophobicContact CB-CE2 4.06Å; P162-F167 HydrophobicContact CB-CG 4.21Å; P162-F167 HydrophobicContact CB-CZ 4.29Å; P162-F167 VanDerWaalsContact O-CB 3.29Å; P162-F167 WeakPolarHBondContact O-CB 3.41Å; P162-F167 WeakPolarHBondContact O-CD1 3.34Å; P162-F167 WeakPolarHBondContact O-CG 3.48Å; S164-F167 WeakPolarHBondContact O-CB 3.49Å; S164-F167 PolarHBondContact O-N 3.37Å; S164-F167 PolarHBondContact OG-N 3.21Å; H165-F167 VanDerWaalsContact C-N 3.3Å; H165-F167 PolarHBondContact O-N 3.25Å; F167-M170 HydrophobicContact CD2-CE 4.37Å; F167-M170 PolarHBondContact O-N 3.01Å; F167-L171 HydrophobicContact CD1-CD1 3.9Å; F167-L171 HydrophobicContact CD1-CG 4.46Å; F167-L171 HydrophobicContact CE1-CD1 3.42Å; F167-L171 VanDerWaalsContact CE1-CD1 3.42Å; F167-L171 HydrophobicContact CE1-CG 4.17Å; F167-L171 HydrophobicContact CZ-CD1 4.03Å; F167-L171 HydrophobicContact CZ-CG 4.45Å; F167-L171 WeakPolarHBondContact O-CG 3.38Å; F167-L171 PolarHBondContact O-N 2.94Å; F167-L171 VanDerWaalsContact O-N 3.09Å; F167-L187 HydrophobicContact CE1-CD1 4.45Å |
| 168 | T | 90.2 | Very high | 86.8 | Confident | 21 Ų | 21 | 70.3 Ų | 70.3 | 13% | 0.129 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -66 | -39.9 | 177.2 | -59.7 | 0 | 0 | 0 | 0 | 111.4 | H165 L171 C172 A184 | H165-T168 PolarHBondContact O-N 3.33Å; T168-L171 PolarHBondContact O-N 3.32Å; T168-C172 WeakPolarHBondContact O-CB 3.49Å; T168-C172 PolarHBondContact O-N 3.29Å; T168-C172 PolarHBondContact O-SG 2.96Å; T168-A184 HydrophobicContact CG2-CB 4.46Å |
| 169 | E | 90.8 | Very high | 87.1 | Confident | 131 Ų | 131 | 68.5 Ų | 68.5 | 61% | 0.612 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -61.3 | -44 | 176.2 | -173.6 | 176.6 | 176.8 | 0 | 0 | 112 | H165 G166 L171 C172 K173 | H165-E169 PolarHBondContact O-N 3.02Å; G166-E169 PolarHBondContact O-N 3.37Å; E169-L171 PolarHBondContact O-N 3.5Å; E169-C172 PolarHBondContact O-N 3.46Å; E169-K173 PolarHBondContact O-N 2.93Å |
| 170 | M | 92.9 | Very high | 87.7 | Confident | 61 Ų | 61 | 66 Ų | 66 | 30% | 0.3 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -59.7 | -44.2 | 174.8 | -73.6 | -171.6 | -67.3 | 0 | 0 | 111.9 | N147 A151 G166 F167 C172 K173 | N147-M170 WeakPolarHBondContact CB-O 3.35Å; N147-M170 PolarHBondContact ND2-O 2.84Å; A151-M170 HydrophobicContact CB-CB 4.28Å; A151-M170 HydrophobicContact CB-CE 4.06Å; G166-M170 VanDerWaalsContact O-CG 3.31Å; G166-M170 WeakPolarHBondContact O-CG 3.37Å; G166-M170 PolarHBondContact O-N 3.32Å; F167-M170 HydrophobicContact CD2-CE 4.37Å; F167-M170 PolarHBondContact O-N 3.01Å; M170-C172 PolarHBondContact O-N 2.94Å; M170-K173 WeakPolarHBondContact O-CB 3.2Å; M170-K173 PolarHBondContact O-N 3.48Å |
| 171 | L | 94.3 | Very high | 88.5 | Confident | 0 Ų | 0 | 64.3 Ų | 64.3 | 0% | 0 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -62.9 | -42.2 | 177.8 | -71.7 | 179.2 | 0 | 0 | 0 | 112.7 | P128 L144 N147 Y148 A151 F167 T168 E169 K173 L175 V183 L187 | P128-L171 HydrophobicContact CB-CD1 4.34Å; P128-L171 HydrophobicContact CG-CD1 3.91Å; P128-L171 HydrophobicContact CG-CD2 4.25Å; L144-L171 HydrophobicContact CD1-CB 4.23Å; L144-L171 HydrophobicContact CD1-CD2 4.13Å; N147-L171 PolarHBondContact ND2-O 3.2Å; Y148-L171 HydrophobicContact CD2-CD2 3.91Å; Y148-L171 HydrophobicContact CG-CD2 4.22Å; A151-L171 HydrophobicContact CB-CD2 4.35Å; F167-L171 HydrophobicContact CD1-CD1 3.9Å; F167-L171 HydrophobicContact CD1-CG 4.46Å; F167-L171 HydrophobicContact CE1-CD1 3.42Å; F167-L171 VanDerWaalsContact CE1-CD1 3.42Å; F167-L171 HydrophobicContact CE1-CG 4.17Å; F167-L171 HydrophobicContact CZ-CD1 4.03Å; F167-L171 HydrophobicContact CZ-CG 4.45Å; F167-L171 WeakPolarHBondContact O-CG 3.38Å; F167-L171 PolarHBondContact O-N 2.94Å; F167-L171 VanDerWaalsContact O-N 3.09Å; T168-L171 PolarHBondContact O-N 3.32Å; E169-L171 PolarHBondContact O-N 3.5Å; L171-K173 VanDerWaalsContact C-N 3.29Å; L171-K173 PolarHBondContact O-N 3.29Å; L171-L175 VanDerWaalsContact O-CD1 3.28Å; L171-L175 WeakPolarHBondContact O-CD1 3.42Å; L171-V183 HydrophobicContact CB-CG1 4.05Å; L171-V183 HydrophobicContact CD1-CG1 4.23Å; L171-L187 HydrophobicContact CD1-CD1 3.46Å; L171-L187 VanDerWaalsContact CD1-CD1 3.46Å |
| 172 | C | 94.9 | Very high | 89.3 | Confident | 24 Ų | 24 | 62.8 Ų | 62.8 | 16% | 0.162 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -77 | -10.7 | -175.9 | -69.8 | 0 | 0 | 0 | 0 | 114.2 | T168 E169 M170 G174 L175 | T168-C172 WeakPolarHBondContact O-CB 3.49Å; T168-C172 PolarHBondContact O-N 3.29Å; T168-C172 PolarHBondContact O-SG 2.96Å; E169-C172 PolarHBondContact O-N 3.46Å; M170-C172 PolarHBondContact O-N 2.94Å; C172-G174 PolarHBondContact O-N 3.4Å; C172-G174 VanDerWaalsContact O-N 3.16Å; C172-L175 PolarHBondContact O-N 3.46Å; C172-L175 VanDerWaalsContact O-N 3.13Å |
| 173 | K | 95.3 | Very high | 90.1 | Very high | 132 Ų | 132 | 60 Ų | 60 | 57% | 0.574 | 33% | 0.331 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | 118.8 | -175.5 | -173.1 | 176.5 | 179.7 | 176.4 | 0 | 112.4 | N147 E169 M170 L171 L175 | N147-K173 PolarHBondContact ND2-O 3.13Å; E169-K173 PolarHBondContact O-N 2.93Å; M170-K173 WeakPolarHBondContact O-CB 3.2Å; M170-K173 PolarHBondContact O-N 3.48Å; L171-K173 VanDerWaalsContact C-N 3.29Å; L171-K173 PolarHBondContact O-N 3.29Å; K173-L175 PolarHBondContact O-N 3.21Å |
| 174 | G | 95.9 | Very high | 91.1 | Very high | 55 Ų | 55 | 54.6 Ų | 54.6 | 57% | 0.567 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.9 | 9.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | R143 C172 | R143-G174 PolarHBondContact NH1-O 2.82Å; C172-G174 PolarHBondContact O-N 3.4Å; C172-G174 VanDerWaalsContact O-N 3.16Å |
| 175 | L | 96.3 | Very high | 91.6 | Very high | 19 Ų | 19 | 54 Ų | 54 | 10% | 0.099 | 32% | 0.316 | C | S | . | . | trans | -82.9 | 156.7 | 168.5 | -61.3 | -178 | 0 | 0 | 0 | 110.6 | R143 L144 L171 C172 K173 T179 V183 | R143-L175 HydrophobicContact CB-CD2 3.57Å; L144-L175 HydrophobicContact CB-CD1 4.18Å; L144-L175 HydrophobicContact CB-CD2 4.32Å; L144-L175 HydrophobicContact CD1-CD1 3.88Å; L171-L175 VanDerWaalsContact O-CD1 3.28Å; L171-L175 WeakPolarHBondContact O-CD1 3.42Å; C172-L175 PolarHBondContact O-N 3.46Å; C172-L175 VanDerWaalsContact O-N 3.13Å; K173-L175 PolarHBondContact O-N 3.21Å; L175-T179 HydrophobicContact CB-CG2 4.26Å; L175-T179 HydrophobicContact CD1-CG2 3.87Å; L175-T179 HydrophobicContact CG-CG2 4.45Å; L175-V183 HydrophobicContact CD1-CG2 4.32Å | ||
| 176 | S | 96.1 | Very high | 91.9 | Very high | 47 Ų | 47 | 50.3 Ų | 50.3 | 33% | 0.329 | 31% | 0.305 | S | S | . | . | trans | -63.9 | 147.8 | 171.3 | 58.5 | 0 | 0 | 0 | 0 | 111.1 | E140 P178 T179 S180 | E140-S176 WeakPolarHBondContact OE2-CB 3.41Å; E140-S176 PolarHBondContact OE2-N 3.28Å; E140-S176 PolarHBondContact OE2-OG 3.12Å; S176-P178 VanDerWaalsContact C-CD 3.44Å; S176-P178 VanDerWaalsContact C-N 3.34Å; S176-T179 WeakPolarHBondContact O-CA 3.5Å; S176-T179 WeakPolarHBondContact O-CB 3.38Å; S176-T179 PolarHBondContact O-N 2.95Å; S176-T179 WeakPolarHBondContact OG-CB 3.48Å; S176-T179 PolarHBondContact OG-OG1 2.97Å; S176-S180 PolarHBondContact O-N 3.35Å; S176-S180 PolarHBondContact O-OG 3.4Å | ||
| 177 | Q | 94.4 | Very high | 91.6 | Very high | 132 Ų | 132 | 51.7 Ų | 51.7 | 62% | 0.617 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -50.7 | -44.3 | 179.7 | -171 | 65.4 | 48.6 | 0 | 0 | 113.9 | T179 S180 N181 | Q177-T179 VanDerWaalsContact C-N 3.29Å; Q177-T179 PolarHBondContact O-N 3.07Å; Q177-S180 PolarHBondContact O-N 2.97Å; Q177-N181 PolarHBondContact NE2-OD1 3.47Å; Q177-N181 PolarHBondContact O-N 3.23Å; Q177-N181 PolarHBondContact O-OD1 2.98Å |
| 178 | P | 93.1 | Very high | 90.7 | Very high | 88 Ų | 88 | 56 Ų | 56 | 57% | 0.571 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -63.5 | -35.7 | 177.6 | -21.6 | 34.8 | 0 | 0 | 0 | 112.8 | S176 L182 | S176-P178 VanDerWaalsContact C-CD 3.44Å; S176-P178 VanDerWaalsContact C-N 3.34Å; P178-L182 PolarHBondContact O-N 3.03Å; P178-L182 VanDerWaalsContact O-N 3.08Å |
| 179 | T | 94.1 | Very high | 89 | Confident | 11 Ų | 11 | 59.6 Ų | 59.6 | 7% | 0.067 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -72.6 | -42.1 | 179.1 | -57.8 | 0 | 0 | 0 | 0 | 110.9 | L136 E140 L175 S176 Q177 N181 L182 V183 | L136-T179 HydrophobicContact CD1-CG2 4.43Å; L136-T179 HydrophobicContact CD2-CG2 3.67Å; E140-T179 WeakPolarHBondContact OE2-CB 3.48Å; E140-T179 PolarHBondContact OE2-OG1 3.39Å; L175-T179 HydrophobicContact CB-CG2 4.26Å; L175-T179 HydrophobicContact CD1-CG2 3.87Å; L175-T179 HydrophobicContact CG-CG2 4.45Å; S176-T179 WeakPolarHBondContact O-CA 3.5Å; S176-T179 WeakPolarHBondContact O-CB 3.38Å; S176-T179 PolarHBondContact O-N 2.95Å; S176-T179 WeakPolarHBondContact OG-CB 3.48Å; S176-T179 PolarHBondContact OG-OG1 2.97Å; Q177-T179 VanDerWaalsContact C-N 3.29Å; Q177-T179 PolarHBondContact O-N 3.07Å; T179-N181 VanDerWaalsContact C-N 3.29Å; T179-N181 PolarHBondContact O-N 2.96Å; T179-L182 WeakPolarHBondContact O-CB 3.02Å; T179-L182 PolarHBondContact O-N 2.95Å; T179-L182 VanDerWaalsContact O-N 3.12Å; T179-V183 WeakPolarHBondContact O-CG2 2.87Å; T179-V183 PolarHBondContact O-N 2.76Å |
| 180 | S | 93.3 | Very high | 87 | Confident | 17 Ų | 17 | 56.8 Ų | 56.8 | 12% | 0.119 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -60.2 | -40.1 | 174.2 | -57.5 | 0 | 0 | 0 | 0 | 111.6 | S176 Q177 L182 V183 A184 | S176-S180 PolarHBondContact O-N 3.35Å; S176-S180 PolarHBondContact O-OG 3.4Å; Q177-S180 PolarHBondContact O-N 2.97Å; S180-L182 VanDerWaalsContact C-N 3.34Å; S180-L182 PolarHBondContact O-N 2.86Å; S180-V183 PolarHBondContact O-N 3.33Å; S180-A184 WeakPolarHBondContact O-CB 3.31Å; S180-A184 PolarHBondContact O-N 2.99Å |
| 181 | N | 91.3 | Very high | 84.6 | Confident | 97 Ų | 97 | 57.7 Ų | 57.7 | 52% | 0.519 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.4 | -39.5 | 174.3 | -68.2 | -7 | 0 | 0 | 0 | 112 | Q177 T179 G185 | Q177-N181 PolarHBondContact NE2-OD1 3.47Å; Q177-N181 PolarHBondContact O-N 3.23Å; Q177-N181 PolarHBondContact O-OD1 2.98Å; T179-N181 VanDerWaalsContact C-N 3.29Å; T179-N181 PolarHBondContact O-N 2.96Å; N181-G185 PolarHBondContact O-N 3.3Å |
| 182 | L | 90.6 | Very high | 82.3 | Confident | 36 Ų | 36 | 63.2 Ų | 63.2 | 19% | 0.188 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -63.6 | -45.6 | 174.9 | 179.7 | 65.7 | 0 | 0 | 0 | 111.2 | C129 L136 P178 T179 S180 G185 C186 | C129-L182 HydrophobicContact CB-CG 4.3Å; L136-L182 HydrophobicContact CD2-CD2 4.12Å; P178-L182 PolarHBondContact O-N 3.03Å; P178-L182 VanDerWaalsContact O-N 3.08Å; T179-L182 WeakPolarHBondContact O-CB 3.02Å; T179-L182 PolarHBondContact O-N 2.95Å; T179-L182 VanDerWaalsContact O-N 3.12Å; S180-L182 VanDerWaalsContact C-N 3.34Å; S180-L182 PolarHBondContact O-N 2.86Å; L182-G185 CarbonylContact O-C 3.51Å; L182-G185 PolarHBondContact O-N 3.39Å; L182-C186 PolarHBondContact O-N 2.91Å; L182-C186 PolarHBondContact O-SG 2.9Å |
| 183 | V | 90.9 | Very high | 79.9 | Confident | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -60.3 | -50.9 | 177.5 | 174 | 0 | 0 | 0 | 0 | 110.9 | C129 L144 L171 L175 T179 S180 G185 C186 L187 | C129-V183 HydrophobicContact CB-CG2 4.09Å; C129-V183 VanDerWaalsContact SG-CG2 3.52Å; L144-V183 HydrophobicContact CD1-CG2 4.17Å; L144-V183 HydrophobicContact CD2-CG2 4.38Å; L171-V183 HydrophobicContact CB-CG1 4.05Å; L171-V183 HydrophobicContact CD1-CG1 4.23Å; L175-V183 HydrophobicContact CD1-CG2 4.32Å; T179-V183 WeakPolarHBondContact O-CG2 2.87Å; T179-V183 PolarHBondContact O-N 2.76Å; S180-V183 PolarHBondContact O-N 3.33Å; V183-G185 VanDerWaalsContact C-N 3.27Å; V183-G185 PolarHBondContact O-N 3.06Å; V183-C186 PolarHBondContact O-N 3.19Å; V183-C186 VanDerWaalsContact O-N 3.07Å; V183-L187 HydrophobicContact CG1-CD1 3.77Å; V183-L187 WeakPolarHBondContact O-CG 3.44Å; V183-L187 PolarHBondContact O-N 3.13Å |
| 184 | A | 87.9 | Confident | 77.3 | Confident | 48 Ų | 48 | 64 Ų | 64 | 40% | 0.397 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -59.5 | -40.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | T168 S180 C186 L187 Q188 | T168-A184 HydrophobicContact CG2-CB 4.46Å; S180-A184 WeakPolarHBondContact O-CB 3.31Å; S180-A184 PolarHBondContact O-N 2.99Å; A184-C186 VanDerWaalsContact C-N 3.3Å; A184-C186 PolarHBondContact O-N 3.09Å; A184-L187 PolarHBondContact O-N 3.13Å; A184-Q188 PolarHBondContact O-N 2.91Å; A184-Q188 VanDerWaalsContact O-N 3.09Å |
| 185 | G | 85.9 | Confident | 74.6 | Confident | 38 Ų | 38 | 70.6 Ų | 70.6 | 39% | 0.392 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -71.8 | -15.8 | 176 | 0 | 0 | 0 | 0 | 0 | 114.9 | N181 L182 V183 Q188 | N181-G185 PolarHBondContact O-N 3.3Å; L182-G185 CarbonylContact O-C 3.51Å; L182-G185 PolarHBondContact O-N 3.39Å; V183-G185 VanDerWaalsContact C-N 3.27Å; V183-G185 PolarHBondContact O-N 3.06Å; G185-Q188 PolarHBondContact O-NE2 3.42Å; G185-Q188 PolarHBondContact O-OE1 3.16Å; G185-Q188 VanDerWaalsContact O-OE1 3.11Å |
| 186 | C | 85.8 | Confident | 72.2 | Confident | 57 Ų | 57 | 77.2 Ų | 77.2 | 39% | 0.385 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -92.6 | -30.3 | 173 | -71.7 | 0 | 0 | 0 | 0 | 112.4 | C129 L182 V183 A184 | C129-C186 HydrophobicContact CB-CB 3.8Å; L182-C186 PolarHBondContact O-N 2.91Å; L182-C186 PolarHBondContact O-SG 2.9Å; V183-C186 PolarHBondContact O-N 3.19Å; V183-C186 VanDerWaalsContact O-N 3.07Å; A184-C186 VanDerWaalsContact C-N 3.3Å; A184-C186 PolarHBondContact O-N 3.09Å |
| 187 | L | 81.1 | Confident | 69.8 | Low | 60 Ų | 60 | 80.8 Ų | 80.8 | 31% | 0.314 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -93.8 | -13.4 | -175 | -65.2 | 174.3 | 0 | 0 | 0 | 114 | P128 F167 L171 V183 A184 L189 | P128-L187 HydrophobicContact CB-CD2 4.36Å; F167-L187 HydrophobicContact CE1-CD1 4.45Å; L171-L187 HydrophobicContact CD1-CD1 3.46Å; L171-L187 VanDerWaalsContact CD1-CD1 3.46Å; V183-L187 HydrophobicContact CG1-CD1 3.77Å; V183-L187 WeakPolarHBondContact O-CG 3.44Å; V183-L187 PolarHBondContact O-N 3.13Å; A184-L187 PolarHBondContact O-N 3.13Å; L187-L189 PolarHBondContact O-N 3.4Å |
| 188 | Q | 70.6 | Confident | 67.1 | Low | 101 Ų | 101 | 82.1 Ų | 82.1 | 47% | 0.472 | 50% | 0.502 | S | S | . | . | trans | 43.3 | 67.3 | 167.3 | -110.8 | 94.2 | 55.4 | 0 | 0 | 115 | A184 G185 G190 | A184-Q188 PolarHBondContact O-N 2.91Å; A184-Q188 VanDerWaalsContact O-N 3.09Å; G185-Q188 PolarHBondContact O-NE2 3.42Å; G185-Q188 PolarHBondContact O-OE1 3.16Å; G185-Q188 VanDerWaalsContact O-OE1 3.11Å; Q188-G190 PolarHBondContact O-N 2.95Å | ||
| 189 | L | 54.8 | Low | 64.6 | Low | 97 Ų | 97 | 85.5 Ų | 85.5 | 51% | 0.508 | 51% | 0.507 | S | S | . | . | S | Bend | trans | -71.5 | 86.7 | 150.8 | -72.1 | 165.2 | 0 | 0 | 0 | 108.3 | H165 L187 | H165-L189 HydrophobicContact CB-CD1 4.02Å; L187-L189 PolarHBondContact O-N 3.4Å |
| 190 | G | 47 | Very low | 62.1 | Low | 73 Ų | 73 | 92.9 Ų | 92.9 | 75% | 0.753 | 55% | 0.546 | S | S | * | . | S | Bend | trans | 76.4 | 82.5 | 159 | 0 | 0 | 0 | 0 | 0 | 118.2 | Q188 | Q188-G190 PolarHBondContact O-N 2.95Š|
| 191 | A | 42.3 | Very low | 59.5 | Low | 80 Ų | 80 | 98.9 Ų | 98.9 | 66% | 0.661 | 58% | 0.577 | S | S | * | * | trans | 170.6 | 107.5 | 131 | 0 | 0 | 0 | 0 | 0 | 109.9 | A193 | A191-A193 PolarHBondContact O-N 3.48Š| ||
| 192 | S | 47.5 | Very low | 57 | Low | 116 Ų | 116 | 101.2 Ų | 101.2 | 81% | 0.811 | 59% | 0.589 | S | S | * | * | trans | 24 | 86.3 | 149.9 | 170.3 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 193 | A | 43.2 | Very low | 54.8 | Low | 66 Ų | 66 | 108.4 Ų | 108.4 | 55% | 0.545 | 62% | 0.619 | S | S | . | * | trans | -72 | 129.5 | 151.2 | 0 | 0 | 0 | 0 | 0 | 108.1 | A191 K195 | A191-A193 PolarHBondContact O-N 3.48Å; A193-K195 PolarHBondContact O-N 3.03Å | ||
| 194 | P | 41.5 | Very low | 52.3 | Low | 105 Ų | 105 | 114.5 Ų | 114.5 | 68% | 0.682 | 66% | 0.658 | S | S | * | * | trans | -67.3 | 123.4 | 177 | 28.9 | -30.9 | 0 | 0 | 0 | 107.8 | L196 | P194-L196 PolarHBondContact O-N 3.36Š| ||
| 195 | K | 40.1 | Very low | 49.8 | Very low | 194 Ų | 194 | 122.6 Ų | 122.6 | 84% | 0.843 | 69% | 0.685 | S | S | * | * | trans | -52.6 | 110.1 | 164.4 | -68.5 | 173.8 | 178.3 | 175.4 | 0 | 107.3 | A193 I197 | A193-K195 PolarHBondContact O-N 3.03Å; K195-I197 PolarHBondContact O-N 2.69Å | ||
| 196 | L | 44.7 | Very low | 47.2 | Very low | 158 Ų | 158 | 124.3 Ų | 124.3 | 83% | 0.827 | 70% | 0.702 | S | S | * | * | trans | -68.7 | 87.3 | 162 | -66.3 | -173.1 | 0 | 0 | 0 | 107.1 | P194 N198 | P194-L196 PolarHBondContact O-N 3.36Å; L196-N198 PolarHBondContact O-N 3.25Å | ||
| 197 | I | 45.9 | Very low | 44.6 | Very low | 122 Ų | 122 | 125.4 Ų | 125.4 | 63% | 0.626 | 72% | 0.724 | S | S | * | * | trans | -75.2 | 97.7 | 166.2 | -128.3 | 165.7 | 0 | 0 | 0 | 105.4 | K195 K199 | K195-I197 PolarHBondContact O-N 2.69Å; I197-K199 HydrophobicContact CG1-CG 4.31Å; I197-K199 HydrophobicContact CG2-CB 4.27Å; I197-K199 HydrophobicContact CG2-CG 4.25Å; I197-K199 PolarHBondContact O-N 2.96Å | ||
| 198 | N | 38.5 | Very low | 42.4 | Very low | 160 Ų | 160 | 127.1 Ų | 127.1 | 86% | 0.856 | 75% | 0.747 | S | S | * | * | trans | -75.7 | 76.6 | 156.3 | -87.7 | 47.2 | 0 | 0 | 0 | 106.6 | L196 | L196-N198 PolarHBondContact O-N 3.25Š| ||
| 199 | K | 39.1 | Very low | 41.3 | Very low | 159 Ų | 159 | 128.5 Ų | 128.5 | 69% | 0.691 | 76% | 0.764 | S | S | * | * | trans | -84.3 | 108.1 | 154.5 | -83.4 | -170.2 | 172.3 | -169.2 | 0 | 105.9 | I197 D201 | I197-K199 HydrophobicContact CG1-CG 4.31Å; I197-K199 HydrophobicContact CG2-CB 4.27Å; I197-K199 HydrophobicContact CG2-CG 4.25Å; I197-K199 PolarHBondContact O-N 2.96Å; K199-D201 PolarHBondContact O-N 3.13Å | ||
| 200 | L | 42.4 | Very low | 40.2 | Very low | 166 Ų | 166 | 127.2 Ų | 127.2 | 87% | 0.869 | 77% | 0.774 | S | S | * | * | trans | -82.2 | 109.4 | 163.2 | -167.7 | 70.1 | 0 | 0 | 0 | 106.2 | ||||
| 201 | D | 38.4 | Very low | 39.9 | Very low | 144 Ų | 144 | 131 Ų | 131 | 77% | 0.77 | 78% | 0.782 | S | S | * | * | trans | -66.4 | 129.8 | 170.9 | -74.1 | -82.8 | 0 | 0 | 0 | 111 | K199 | K199-D201 PolarHBondContact O-N 3.13Š| ||
| 202 | D | 38.4 | Very low | 39.3 | Very low | 146 Ų | 146 | 130.3 Ų | 130.3 | 78% | 0.781 | 78% | 0.783 | S | S | * | * | trans | -120.8 | 110.6 | 157.6 | -101 | -52.9 | 0 | 0 | 0 | 110 | ||||
| 203 | K | 44.2 | Very low | 38.7 | Very low | 187 Ų | 187 | 131.2 Ų | 131.2 | 81% | 0.813 | 79% | 0.789 | S | S | * | * | trans | 34.7 | 128.1 | 154.1 | -111.3 | 80.2 | 171.4 | -175.6 | 0 | 120.7 | ||||
| 204 | P | 39.1 | Very low | 38.2 | Very low | 128 Ų | 128 | 131.6 Ų | 131.6 | 83% | 0.831 | 80% | 0.8 | S | S | * | * | trans | -91.8 | 135.8 | 158.2 | 34.8 | -26.3 | 0 | 0 | 0 | 111.1 | ||||
| 205 | F | 34.7 | Very low | 37.9 | Very low | 218 Ų | 218 | 134 Ų | 134 | 96% | 0.956 | 81% | 0.813 | S | S | * | * | trans | -132.8 | 128.4 | 162.8 | -159.7 | -90.6 | 0 | 0 | 0 | 109.9 | ||||
| 206 | G | 32.3 | Very low | 37.7 | Very low | 73 Ų | 73 | 129.6 Ų | 129.6 | 75% | 0.753 | 81% | 0.812 | S | S | * | * | trans | 112.4 | 114.8 | 152.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 207 | G | 31 | Very low | 37.2 | Very low | 81 Ų | 81 | 125.8 Ų | 125.8 | 84% | 0.835 | 81% | 0.811 | S | S | * | * | trans | 126.1 | 82.8 | 144.4 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 208 | A | 35.8 | Very low | 36.7 | Very low | 96 Ų | 96 | 128.7 Ų | 128.7 | 79% | 0.793 | 82% | 0.822 | S | S | * | * | trans | -71 | -175.8 | 150.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 209 | P | 46.9 | Very low | 37.1 | Very low | 130 Ų | 130 | 126.4 Ų | 126.4 | 84% | 0.844 | 82% | 0.816 | S | S | * | * | cis | -146.2 | -172.9 | 7.1 | 39.5 | -17.1 | 0 | 0 | 0 | 116.4 | ||||
| 210 | G | 30.6 | Very low | 36.6 | Very low | 69 Ų | 69 | 122.8 Ų | 122.8 | 71% | 0.711 | 82% | 0.824 | S | S | * | * | trans | 102.7 | 134.7 | 161.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 211 | V | 40.6 | Very low | 36.1 | Very low | 152 Ų | 152 | 117.7 Ų | 117.7 | 92% | 0.921 | 81% | 0.811 | S | S | * | * | cis | -163.3 | 133.5 | 30.2 | -143.1 | 0 | 0 | 0 | 0 | 104 | ||||
| 212 | G | 30.2 | Very low | 36 | Very low | 67 Ų | 67 | 118.8 Ų | 118.8 | 69% | 0.691 | 81% | 0.811 | S | S | * | * | 97.8 | 129.7 | 79.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 213 | S | 36 | Very low | 36.3 | Very low | 134 Ų | 134 | 120.1 Ų | 120.1 | 94% | 0.937 | 81% | 0.813 | S | S | * | * | trans | 81.4 | 121.7 | 172.5 | -64.1 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 214 | G | 31.5 | Very low | 36.4 | Very low | 75 Ų | 75 | 116.8 Ų | 116.8 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | cis | 114.3 | 107.4 | 15.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 215 | V | 35.5 | Very low | 36.3 | Very low | 156 Ų | 156 | 118.4 Ų | 118.4 | 95% | 0.945 | 81% | 0.811 | S | S | * | * | 169 | 150.9 | 126.8 | 84.2 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 216 | A | 35.9 | Very low | 36.4 | Very low | 100 Ų | 100 | 114 Ų | 114 | 83% | 0.826 | 81% | 0.807 | S | S | * | * | trans | -76.8 | 167.6 | -164.1 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 217 | G | 33.3 | Very low | 36.5 | Very low | 79 Ų | 79 | 113.2 Ų | 113.2 | 81% | 0.814 | 80% | 0.799 | S | S | * | * | trans | 143.2 | 98.1 | 151.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 218 | Q | 36 | Very low | 36.7 | Very low | 183 Ų | 183 | 118 Ų | 118 | 86% | 0.855 | 80% | 0.8 | S | S | * | * | trans | -97.8 | 172.6 | 152.7 | -117.7 | -159.1 | 36.7 | 0 | 0 | 108 | ||||
| 219 | P | 46.3 | Very low | 36.8 | Very low | 111 Ų | 111 | 124.8 Ų | 124.8 | 72% | 0.721 | 81% | 0.806 | S | S | * | * | cis | -134.1 | 173.8 | -17 | 27.4 | -5.5 | 0 | 0 | 0 | 114 | ||||
| 220 | G | 30.4 | Very low | 37 | Very low | 84 Ų | 84 | 124.5 Ų | 124.5 | 87% | 0.866 | 80% | 0.804 | S | S | * | * | trans | 114.4 | 118.6 | 147.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 221 | G | 31.2 | Very low | 37.5 | Very low | 58 Ų | 58 | 126.6 Ų | 126.6 | 60% | 0.598 | 81% | 0.808 | S | S | * | * | trans | 125.2 | 117.2 | 147.8 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 222 | H | 36.5 | Very low | 38.1 | Very low | 167 Ų | 167 | 125.4 Ų | 125.4 | 77% | 0.773 | 80% | 0.803 | S | S | * | * | trans | 77.9 | 103.9 | 137.1 | -45.9 | -72.5 | 0 | 0 | 0 | 120.5 | ||||
| 223 | H | 43.7 | Very low | 38.7 | Very low | 174 Ų | 174 | 125.7 Ų | 125.7 | 81% | 0.806 | 81% | 0.807 | S | S | * | * | trans | 50.8 | 140.4 | 144.1 | -40.7 | -74.1 | 0 | 0 | 0 | 122.2 | ||||
| 224 | P | 46.1 | Very low | 39.6 | Very low | 118 Ų | 118 | 127.3 Ų | 127.3 | 77% | 0.766 | 80% | 0.804 | S | S | * | * | trans | -123.1 | 124.1 | 141.8 | 25.6 | -8.4 | 0 | 0 | 0 | 112.3 | ||||
| 225 | L | 37.9 | Very low | 40.6 | Very low | 161 Ų | 161 | 129.7 Ų | 129.7 | 84% | 0.843 | 81% | 0.806 | S | S | * | * | 62.9 | 111.2 | 98.9 | -59.2 | 177.5 | 0 | 0 | 0 | 113.4 | |||||
| 226 | S | 36.8 | Very low | 41 | Very low | 126 Ų | 126 | 127.4 Ų | 127.4 | 88% | 0.881 | 80% | 0.797 | S | S | * | * | 40.3 | 125.9 | 79.1 | -147.1 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 227 | G | 33.5 | Very low | 41.6 | Very low | 57 Ų | 57 | 128.2 Ų | 128.2 | 59% | 0.588 | 79% | 0.794 | S | S | * | * | cis | 173.7 | 148.5 | 8.1 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 228 | H | 36.3 | Very low | 42.7 | Very low | 182 Ų | 182 | 130.4 Ų | 130.4 | 84% | 0.843 | 79% | 0.794 | S | S | * | * | trans | 51.7 | 115.9 | 147.1 | -67.8 | 72.4 | 0 | 0 | 0 | 122.8 | ||||
| 229 | Y | 37.3 | Very low | 43 | Very low | 238 Ų | 238 | 133.1 Ų | 133.1 | 93% | 0.933 | 80% | 0.798 | S | S | * | * | -144.6 | 137.7 | 128.3 | -88.8 | -80.5 | 0 | 0 | 0 | 109.6 | |||||
| 230 | P | 52 | Low | 42.9 | Very low | 123 Ų | 123 | 131.1 Ų | 131.1 | 80% | 0.799 | 80% | 0.798 | S | S | * | * | trans | -94.8 | 145.1 | -172.2 | 36 | -31.2 | 0 | 0 | 0 | 113 | ||||
| 231 | S | 40.3 | Very low | 43.4 | Very low | 113 Ų | 113 | 132.7 Ų | 132.7 | 79% | 0.79 | 80% | 0.795 | S | S | * | * | trans | -121.4 | 127.8 | 167.1 | -171.2 | 0 | 0 | 0 | 0 | 108.5 | G233 | S231-G233 PolarHBondContact O-N 3.36Å; S231-G233 VanDerWaalsContact O-N 3.15Å | ||
| 232 | P | 53.6 | Low | 44.2 | Very low | 127 Ų | 127 | 138 Ų | 138 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | trans | -76.3 | 106.4 | 179.9 | -2.5 | 19 | 0 | 0 | 0 | 109.5 | ||||
| 233 | G | 42.1 | Very low | 44.3 | Very low | 74 Ų | 74 | 139 Ų | 139 | 76% | 0.763 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 130.1 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | S231 | S231-G233 PolarHBondContact O-N 3.36Å; S231-G233 VanDerWaalsContact O-N 3.15Å |
| 234 | L | 54.5 | Low | 44.1 | Very low | 167 Ų | 167 | 134.4 Ų | 134.4 | 87% | 0.874 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 138.4 | 167.9 | -66.5 | 166 | 0 | 0 | 0 | 109.5 | ||
| 235 | P | 53.2 | Low | 44.2 | Very low | 125 Ų | 125 | 133.8 Ų | 133.8 | 81% | 0.812 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 126 | 176.9 | 28.4 | -31.9 | 0 | 0 | 0 | 111.7 | ||
| 236 | S | 45.1 | Very low | 44.5 | Very low | 109 Ų | 109 | 134.8 Ų | 134.8 | 76% | 0.762 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 144.4 | 169.2 | -56.8 | 0 | 0 | 0 | 0 | 111.6 | ||
| 237 | P | 46.7 | Very low | 44.8 | Very low | 116 Ų | 116 | 136.4 Ų | 136.4 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 141.3 | 177.1 | -12.3 | 26.6 | 0 | 0 | 0 | 111.6 | Y239 | P237-Y239 PolarHBondContact O-N 3.48Š|
| 238 | P | 57.3 | Low | 45.3 | Very low | 126 Ų | 126 | 142.1 Ų | 142.1 | 82% | 0.818 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 122.9 | 178.3 | 29 | -31.6 | 0 | 0 | 0 | 110.5 | G240 | P238-G240 PolarHBondContact O-N 3.49Š|
| 239 | Y | 42.1 | Very low | 45.7 | Very low | 239 Ų | 239 | 140.6 Ų | 140.6 | 94% | 0.937 | 81% | 0.812 | S | S | * | * | trans | -65.5 | 110.3 | 162.5 | -111.6 | -96.7 | 0 | 0 | 0 | 108.4 | P237 | P237-Y239 PolarHBondContact O-N 3.48Š| ||
| 240 | G | 44 | Very low | 46.1 | Very low | 70 Ų | 70 | 137.9 Ų | 137.9 | 72% | 0.722 | 81% | 0.81 | S | S | * | * | trans | -103.5 | 133.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | P238 | P238-G240 PolarHBondContact O-N 3.49Š| ||
| 241 | S | 40.7 | Very low | 45.3 | Very low | 117 Ų | 117 | 140.5 Ų | 140.5 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | trans | -59.4 | 156 | -177.2 | -179.4 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 242 | L | 49.2 | Very low | 45.1 | Very low | 168 Ų | 168 | 140.6 Ų | 140.6 | 88% | 0.88 | 81% | 0.81 | S | S | * | * | trans | -32.3 | 133.8 | 168.3 | -68.3 | 150.3 | 0 | 0 | 0 | 115 | ||||
| 243 | E | 37.7 | Very low | 44.2 | Very low | 188 Ų | 188 | 144.6 Ų | 144.6 | 88% | 0.879 | 81% | 0.814 | S | S | * | * | 158.5 | 137.1 | 118.2 | -168.6 | 154.1 | -159.4 | 0 | 0 | 113.2 | |||||
| 244 | A | 38.8 | Very low | 43.9 | Very low | 79 Ų | 79 | 150.1 Ų | 150.1 | 65% | 0.653 | 82% | 0.82 | S | S | * | * | trans | 51 | 110.1 | 157.4 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 245 | S | 49.2 | Very low | 42.9 | Very low | 105 Ų | 105 | 146.1 Ų | 146.1 | 73% | 0.734 | 82% | 0.82 | S | S | * | * | 24.5 | 113.9 | 122.3 | -45.4 | 0 | 0 | 0 | 0 | 117.8 | |||||
| 246 | H | 43.6 | Very low | 41.9 | Very low | 182 Ų | 182 | 143.7 Ų | 143.7 | 84% | 0.843 | 82% | 0.817 | S | S | * | * | trans | -169.4 | 110.4 | 138.4 | -86.8 | -59.5 | 0 | 0 | 0 | 111.9 | ||||
| 247 | L | 44.2 | Very low | 42.1 | Very low | 160 Ų | 160 | 144.1 Ų | 144.1 | 84% | 0.838 | 82% | 0.818 | S | S | * | * | trans | 36.8 | 121.8 | 137.5 | -74.8 | 149.2 | 0 | 0 | 0 | 121.1 | H249 | L247-H249 PolarHBondContact O-N 3.38Š| ||
| 248 | L | 43.4 | Very low | 41.6 | Very low | 176 Ų | 176 | 148.5 Ų | 148.5 | 92% | 0.921 | 82% | 0.821 | S | S | * | * | trans | -55.7 | 124 | 165.7 | -59.7 | 167.4 | 0 | 0 | 0 | 112 | ||||
| 249 | H | 44.5 | Very low | 40.5 | Very low | 150 Ų | 150 | 151 Ų | 151 | 69% | 0.694 | 82% | 0.822 | S | S | * | * | trans | -128.9 | 105.9 | 162.1 | -163.9 | 79.7 | 0 | 0 | 0 | 109 | L247 | L247-H249 PolarHBondContact O-N 3.38Š| ||
| 250 | M | 46 | Very low | 40.2 | Very low | 182 Ų | 182 | 147.3 Ų | 147.3 | 90% | 0.897 | 81% | 0.813 | S | S | * | * | trans | -85.9 | 120.3 | 165.6 | -77.6 | -76.2 | 101 | 0 | 0 | 108.4 | ||||
| 251 | K | 35 | Very low | 40.1 | Very low | 177 Ų | 177 | 152.7 Ų | 152.7 | 77% | 0.77 | 82% | 0.819 | S | S | * | * | trans | -130 | 108.8 | 167.6 | -170.9 | 125.7 | 175.5 | 177.7 | 0 | 109.2 | ||||
| 252 | S | 35.8 | Very low | 40.6 | Very low | 116 Ų | 116 | 153 Ų | 153 | 81% | 0.811 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 149.8 | 169.3 | -60.1 | 0 | 0 | 0 | 0 | 111 | ||
| 253 | F | 36.3 | Very low | 40 | Very low | 211 Ų | 211 | 150.4 Ų | 150.4 | 93% | 0.925 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -79.8 | 155.1 | -172.9 | -138.8 | -99.6 | 0 | 0 | 0 | 113.1 | ||
| 254 | E | 35.8 | Very low | 40.7 | Very low | 189 Ų | 189 | 146.3 Ų | 146.3 | 88% | 0.883 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 162.1 | -175.3 | -105.9 | -168.6 | 138.7 | 0 | 0 | 116.3 | ||
| 255 | G | 31.7 | Very low | 40.5 | Very low | 84 Ų | 84 | 149.5 Ų | 149.5 | 87% | 0.866 | 81% | 0.81 | S | S | * | * | trans | 114.6 | 125.9 | 145.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 256 | G | 32.4 | Very low | 39.8 | Very low | 74 Ų | 74 | 152.5 Ų | 152.5 | 76% | 0.763 | 81% | 0.812 | S | S | * | * | cis | -178.3 | -171.3 | 16.1 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 257 | P | 49.1 | Very low | 39.2 | Very low | 118 Ų | 118 | 149.3 Ų | 149.3 | 77% | 0.766 | 81% | 0.809 | S | S | * | * | trans | -126.1 | 179.6 | -139.4 | 40.6 | -26 | 0 | 0 | 0 | 119 | ||||
| 258 | Y | 36.4 | Very low | 38.9 | Very low | 208 Ų | 208 | 147.8 Ų | 147.8 | 82% | 0.816 | 81% | 0.812 | S | S | * | * | trans | 80.7 | 136.3 | 169.5 | -83.9 | -100 | 0 | 0 | 0 | 117.5 | ||||
| 259 | E | 35.7 | Very low | 38.7 | Very low | 179 Ų | 179 | 144.5 Ų | 144.5 | 84% | 0.836 | 80% | 0.804 | S | S | * | * | cis | -156.1 | 179.6 | 39.4 | -127.6 | -172.8 | 160.3 | 0 | 0 | 114 | ||||
| 260 | Q | 35.7 | Very low | 38.6 | Very low | 161 Ų | 161 | 144.8 Ų | 144.8 | 75% | 0.752 | 81% | 0.81 | S | S | * | * | trans | -87.4 | 161.5 | -159.2 | -78.8 | 152.7 | -11.5 | 0 | 0 | 119.1 | ||||
| 261 | H | 41.1 | Very low | 38.4 | Very low | 183 Ų | 183 | 139.7 Ų | 139.7 | 85% | 0.847 | 81% | 0.805 | S | S | * | * | trans | -44.2 | 177.4 | 174.5 | -59.8 | -90.8 | 0 | 0 | 0 | 118.7 | ||||
| 262 | P | 50.1 | Low | 39 | Very low | 123 Ų | 123 | 137.9 Ų | 137.9 | 80% | 0.799 | 81% | 0.808 | S | S | * | * | cis | -144.8 | 176.3 | 15.3 | 36.9 | -12.2 | 0 | 0 | 0 | 120 | ||||
| 263 | S | 36.6 | Very low | 40.2 | Very low | 114 Ų | 114 | 137.7 Ų | 137.7 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | trans | -7.9 | 177.8 | 163.2 | -128.9 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 264 | P | 54 | Low | 40.9 | Very low | 102 Ų | 102 | 133.8 Ų | 133.8 | 66% | 0.662 | 80% | 0.8 | S | S | * | * | cis | -140.2 | -173.4 | -6.2 | 35 | -11.5 | 0 | 0 | 0 | 117 | ||||
| 265 | N | 34.5 | Very low | 41.4 | Very low | 146 Ų | 146 | 134.7 Ų | 134.7 | 78% | 0.781 | 80% | 0.797 | S | S | * | * | trans | 79.3 | 136.9 | 159 | -82.8 | 21.4 | 0 | 0 | 0 | 118.3 | ||||
| 266 | E | 33.6 | Very low | 42.6 | Very low | 167 Ų | 167 | 138.4 Ų | 138.4 | 78% | 0.78 | 80% | 0.797 | S | S | * | * | cis | -153.3 | 150.8 | 21.9 | -62.1 | -170 | 113.3 | 0 | 0 | 114.1 | ||||
| 267 | C | 32.4 | Very low | 44 | Very low | 115 Ų | 115 | 136.8 Ų | 136.8 | 78% | 0.777 | 78% | 0.78 | S | S | * | * | trans | 30.6 | 121.9 | 139.1 | -61.2 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 268 | S | 37.6 | Very low | 44.1 | Very low | 129 Ų | 129 | 136.8 Ų | 136.8 | 90% | 0.902 | 78% | 0.78 | S | S | * | * | -171.6 | 140.8 | 104 | -82.1 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 269 | S | 39 | Very low | 44.9 | Very low | 107 Ų | 107 | 134.9 Ų | 134.9 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | trans | -81.3 | 140.1 | -171.4 | -178.8 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 270 | N | 42.2 | Very low | 46 | Very low | 155 Ų | 155 | 132.5 Ų | 132.5 | 83% | 0.829 | 78% | 0.781 | S | S | * | * | 169 | 120.7 | 120.7 | -86.1 | 13.4 | 0 | 0 | 0 | 110.6 | |||||
| 271 | G | 41.1 | Very low | 46.7 | Very low | 76 Ų | 76 | 130.2 Ų | 130.2 | 78% | 0.784 | 78% | 0.78 | S | S | * | * | trans | -84.1 | 160.3 | -165.4 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 272 | T | 47.2 | Very low | 47.4 | Very low | 138 Ų | 138 | 127.1 Ų | 127.1 | 85% | 0.847 | 78% | 0.776 | S | S | * | * | trans | -155.9 | 133.3 | 149.2 | -40.8 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 273 | P | 60.6 | Low | 47.3 | Very low | 112 Ų | 112 | 129.4 Ų | 129.4 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | trans | -75.4 | 154.8 | -169.5 | 31.2 | -34.8 | 0 | 0 | 0 | 112 | Y275 | P273-Y275 PolarHBondContact O-N 3.27Š| ||
| 274 | P | 52.5 | Low | 47.8 | Very low | 129 Ų | 129 | 129.2 Ų | 129.2 | 84% | 0.838 | 78% | 0.78 | S | S | * | * | trans | -70.6 | 125.7 | 170.5 | 28.6 | -29.6 | 0 | 0 | 0 | 109.5 | D276 | P274-D276 PolarHBondContact O-N 3.32Š| ||
| 275 | Y | 46.9 | Very low | 47.3 | Very low | 209 Ų | 209 | 132.2 Ų | 132.2 | 82% | 0.82 | 79% | 0.788 | S | S | * | * | trans | -66.2 | 108.5 | 172.4 | 177.3 | -96.7 | 0 | 0 | 0 | 109.5 | P273 G277 | P273-Y275 PolarHBondContact O-N 3.27Å; Y275-G277 PolarHBondContact O-N 3.2Å | ||
| 276 | D | 55.6 | Low | 47.6 | Very low | 162 Ų | 162 | 129.9 Ų | 129.9 | 87% | 0.866 | 78% | 0.784 | S | S | * | * | trans | -80.6 | 102 | 171.1 | -127.4 | -18 | 0 | 0 | 0 | 108.1 | P274 | P274-D276 PolarHBondContact O-N 3.32Š| ||
| 277 | G | 61.3 | Low | 47.9 | Very low | 39 Ų | 39 | 124.8 Ų | 124.8 | 40% | 0.402 | 78% | 0.776 | S | S | . | * | P | Polyproline II helix | trans | -69.5 | 145.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y275 L279 | Y275-G277 PolarHBondContact O-N 3.2Å; G277-L279 PolarHBondContact O-N 3.33Å |
| 278 | P | 52.8 | Low | 48.2 | Very low | 119 Ų | 119 | 126.4 Ų | 126.4 | 77% | 0.773 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -67 | 125.1 | -175.1 | 26.4 | -32.3 | 0 | 0 | 0 | 111.2 | T280 | P278-T280 PolarHBondContact O-N 3.1Š|
| 279 | L | 53.3 | Low | 48.3 | Very low | 168 Ų | 168 | 130.3 Ų | 130.3 | 88% | 0.88 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 121.7 | 170 | -66.2 | 163.7 | 0 | 0 | 0 | 110 | G277 | G277-L279 PolarHBondContact O-N 3.33Š|
| 280 | T | 57.8 | Low | 48.3 | Very low | 129 Ų | 129 | 129.8 Ų | 129.8 | 79% | 0.791 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -49.8 | 130.1 | 165.4 | 32.5 | 0 | 0 | 0 | 0 | 110.6 | P278 | P278-T280 PolarHBondContact O-N 3.1Š|
| 281 | P | 50.7 | Low | 48.1 | Very low | 113 Ų | 113 | 130.4 Ų | 130.4 | 73% | 0.734 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 145.7 | 176.1 | 28.3 | -32.9 | 0 | 0 | 0 | 110.9 | ||
| 282 | P | 55.8 | Low | 47.8 | Very low | 118 Ų | 118 | 136.5 Ų | 136.5 | 77% | 0.766 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 134.1 | -178.8 | 27.6 | -33.2 | 0 | 0 | 0 | 111.4 | S284 | P282-S284 PolarHBondContact O-N 3.27Å; P282-S284 VanDerWaalsContact O-N 3.13Å |
| 283 | L | 47.2 | Very low | 47.2 | Very low | 170 Ų | 170 | 138.5 Ų | 138.5 | 89% | 0.89 | 79% | 0.787 | S | S | * | * | trans | -64.9 | 108.7 | 171.4 | -63.3 | 172.3 | 0 | 0 | 0 | 109.3 | I285 | L283-I285 PolarHBondContact O-N 3.35Š| ||
| 284 | S | 46.8 | Very low | 45.7 | Very low | 111 Ų | 111 | 141.4 Ų | 141.4 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | trans | -77.1 | 106.2 | 168.7 | -68.1 | 0 | 0 | 0 | 0 | 109.8 | P282 S286 | P282-S284 PolarHBondContact O-N 3.27Å; P282-S284 VanDerWaalsContact O-N 3.13Å; S284-S286 PolarHBondContact O-N 3.08Å | ||
| 285 | I | 45 | Very low | 44.9 | Very low | 165 Ų | 165 | 140.8 Ų | 140.8 | 85% | 0.846 | 79% | 0.787 | S | S | * | * | trans | -80.8 | 94.4 | 161.9 | -69 | 169.7 | 0 | 0 | 0 | 106.8 | L283 | L283-I285 PolarHBondContact O-N 3.35Š| ||
| 286 | S | 40.8 | Very low | 44.1 | Very low | 97 Ų | 97 | 135.8 Ų | 135.8 | 68% | 0.678 | 78% | 0.782 | S | S | * | * | trans | -93.4 | 94.4 | 158.6 | 44.5 | 0 | 0 | 0 | 0 | 108.2 | S284 N288 | S284-S286 PolarHBondContact O-N 3.08Å; S286-N288 PolarHBondContact O-N 2.9Å | ||
| 287 | G | 40.3 | Very low | 43.4 | Very low | 60 Ų | 60 | 133.6 Ų | 133.6 | 62% | 0.619 | 78% | 0.777 | S | S | * | * | trans | -73.4 | 104.7 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 288 | N | 37.7 | Very low | 42.1 | Very low | 149 Ų | 149 | 139.2 Ų | 139.2 | 80% | 0.797 | 79% | 0.793 | S | S | * | * | trans | -99.8 | 81 | 168.6 | -66.2 | 0.7 | 0 | 0 | 0 | 109 | S286 A290 | S286-N288 PolarHBondContact O-N 2.9Å; N288-A290 PolarHBondContact O-N 3.06Å | ||
| 289 | F | 39.3 | Very low | 41.3 | Very low | 210 Ų | 210 | 141.6 Ų | 141.6 | 92% | 0.921 | 79% | 0.793 | S | S | * | * | trans | -89.3 | 94.5 | 162.6 | -85.3 | -85.5 | 0 | 0 | 0 | 108.6 | ||||
| 290 | A | 39.2 | Very low | 40.6 | Very low | 96 Ų | 96 | 138.6 Ų | 138.6 | 79% | 0.793 | 79% | 0.793 | S | S | * | * | trans | -87.4 | 109.4 | 162 | 0 | 0 | 0 | 0 | 0 | 108.1 | N288 K292 | N288-A290 PolarHBondContact O-N 3.06Å; A290-K292 PolarHBondContact O-N 3.12Å | ||
| 291 | L | 37.4 | Very low | 39.5 | Very low | 168 Ų | 168 | 140 Ų | 140 | 88% | 0.88 | 79% | 0.79 | S | S | * | * | trans | -64.6 | 96.8 | 172.5 | -150.1 | 90.2 | 0 | 0 | 0 | 108.3 | Q293 | L291-Q293 PolarHBondContact O-N 3.36Š| ||
| 292 | K | 36.2 | Very low | 38.9 | Very low | 205 Ų | 205 | 144.3 Ų | 144.3 | 89% | 0.891 | 79% | 0.792 | S | S | * | * | trans | -76.1 | 105 | 169 | -114.4 | 176.5 | 171.6 | -177.2 | 0 | 107.5 | A290 E294 | A290-K292 PolarHBondContact O-N 3.12Å; K292-E294 PolarHBondContact O-N 3.28Å | ||
| 293 | Q | 33.3 | Very low | 37.7 | Very low | 179 Ų | 179 | 146 Ų | 146 | 84% | 0.836 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 122.2 | 164.7 | -88.1 | 178.7 | -7.2 | 0 | 0 | 109.1 | L291 | L291-Q293 PolarHBondContact O-N 3.36Š|
| 294 | E | 29.5 | Very low | 37.2 | Very low | 174 Ų | 174 | 148.3 Ų | 148.3 | 81% | 0.813 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 125 | 166.7 | -162.8 | -143.2 | 179.3 | 0 | 0 | 108.6 | K292 | K292-E294 PolarHBondContact O-N 3.28Š|
| 295 | P | 36.4 | Very low | 37.1 | Very low | 116 Ų | 116 | 148.8 Ų | 148.8 | 75% | 0.753 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -86.8 | 119.9 | 166.4 | 29.5 | -27.5 | 0 | 0 | 0 | 111 | ||
| 296 | S | 30.3 | Very low | 36.5 | Very low | 103 Ų | 103 | 145.7 Ų | 145.7 | 72% | 0.72 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -48 | 150 | 170.9 | -177.1 | 0 | 0 | 0 | 0 | 114.4 | ||
| 297 | P | 41.2 | Very low | 36.3 | Very low | 116 Ų | 116 | 149.2 Ų | 149.2 | 75% | 0.753 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 119.1 | -176.4 | 34.2 | -29.7 | 0 | 0 | 0 | 111.4 | ||
| 298 | H | 33.5 | Very low | 36.7 | Very low | 158 Ų | 158 | 151.6 Ų | 151.6 | 73% | 0.731 | 80% | 0.796 | S | S | * | * | trans | -138.7 | 118.6 | 162.8 | -141.2 | -78.9 | 0 | 0 | 0 | 110.4 | ||||
| 299 | E | 34.8 | Very low | 36.6 | Very low | 168 Ų | 168 | 149.4 Ų | 149.4 | 79% | 0.785 | 79% | 0.793 | S | S | * | * | trans | 33.7 | 123.9 | 151.4 | -60.6 | -179.4 | 152.6 | 0 | 0 | 120.6 | ||||
| 300 | A | 39.3 | Very low | 36.6 | Very low | 105 Ų | 105 | 148.6 Ų | 148.6 | 87% | 0.868 | 79% | 0.791 | S | S | * | * | trans | -163 | 125.4 | 130.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 301 | E | 34.8 | Very low | 36.5 | Very low | 160 Ų | 160 | 154.6 Ų | 154.6 | 75% | 0.748 | 80% | 0.795 | S | S | * | * | trans | -68.8 | 155.7 | 174.5 | -77.3 | -169.7 | 115.3 | 0 | 0 | 114.7 | ||||
| 302 | R | 38.7 | Very low | 36.6 | Very low | 203 Ų | 203 | 154.4 Ų | 154.4 | 77% | 0.766 | 79% | 0.794 | S | S | * | * | trans | 64.4 | 120.7 | 146.1 | -73.2 | -172.2 | -149.8 | -154.7 | 10.8 | 121.2 | ||||
| 303 | N | 30.9 | Very low | 36.3 | Very low | 154 Ų | 154 | 149.7 Ų | 149.7 | 82% | 0.824 | 79% | 0.787 | S | S | * | * | 174.1 | 134.5 | 103.7 | -98.3 | -1.9 | 0 | 0 | 0 | 113.1 | |||||
| 304 | Y | 35.3 | Very low | 36.4 | Very low | 218 Ų | 218 | 146.8 Ų | 146.8 | 86% | 0.855 | 79% | 0.786 | S | S | * | * | trans | -72.4 | 153.6 | 160.5 | -103.5 | -89.4 | 0 | 0 | 0 | 110.4 | ||||
| 305 | P | 46.2 | Very low | 37.1 | Very low | 120 Ų | 120 | 145.3 Ų | 145.3 | 78% | 0.779 | 78% | 0.783 | S | S | * | * | -148.3 | 142.2 | 89.7 | 33.4 | -12.6 | 0 | 0 | 0 | 115 | |||||
| 306 | S | 30.6 | Very low | 37.6 | Very low | 100 Ų | 100 | 145.3 Ų | 145.3 | 70% | 0.699 | 78% | 0.783 | S | S | * | * | 68.3 | 113.4 | 102.4 | -161.7 | 0 | 0 | 0 | 0 | 117.9 | |||||
| 307 | H | 38.2 | Very low | 37.8 | Very low | 172 Ų | 172 | 148.2 Ų | 148.2 | 80% | 0.796 | 79% | 0.785 | S | S | * | * | trans | -27.1 | 168.9 | 160.7 | -62.1 | -67.6 | 0 | 0 | 0 | 118.4 | ||||
| 308 | P | 47.9 | Very low | 37.5 | Very low | 110 Ų | 110 | 153.6 Ų | 153.6 | 71% | 0.714 | 79% | 0.792 | S | S | * | * | cis | -154 | 176.6 | 36.9 | 40.5 | -15.9 | 0 | 0 | 0 | 121.4 | ||||
| 309 | S | 35.8 | Very low | 38.3 | Very low | 103 Ų | 103 | 151.5 Ų | 151.5 | 72% | 0.72 | 79% | 0.792 | S | S | * | * | trans | -20.2 | 141.4 | 163.6 | -48.9 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 310 | H | 39 | Very low | 39 | Very low | 193 Ų | 193 | 149 Ų | 149 | 89% | 0.894 | 79% | 0.79 | S | S | * | * | trans | -134.9 | 121.8 | 147.8 | -74.9 | -74.6 | 0 | 0 | 0 | 111.5 | ||||
| 311 | Y | 36.8 | Very low | 38.8 | Very low | 221 Ų | 221 | 149.3 Ų | 149.3 | 87% | 0.867 | 79% | 0.786 | S | S | * | * | trans | -60.5 | 145.9 | 159.2 | -93.6 | -110.5 | 0 | 0 | 0 | 109.8 | ||||
| 312 | L | 38.9 | Very low | 38.7 | Very low | 165 Ų | 165 | 147 Ų | 147 | 86% | 0.864 | 79% | 0.788 | S | S | * | * | 178.5 | 139.3 | 116.5 | -92.9 | 165.4 | 0 | 0 | 0 | 113.2 | |||||
| 313 | S | 31.4 | Very low | 38.7 | Very low | 106 Ų | 106 | 145.7 Ų | 145.7 | 74% | 0.741 | 80% | 0.796 | S | S | * | * | trans | -60 | 145.8 | 171.6 | -175.4 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 314 | S | 35.9 | Very low | 38.9 | Very low | 117 Ų | 117 | 143.4 Ų | 143.4 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -166.9 | 120.3 | 143.4 | 10.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 315 | L | 42.6 | Very low | 38.8 | Very low | 144 Ų | 144 | 136.9 Ų | 136.9 | 75% | 0.754 | 80% | 0.797 | S | S | * | * | trans | -71.8 | 154.8 | 167.1 | -134.3 | 72.4 | 0 | 0 | 0 | 111.2 | ||||
| 316 | P | 47.2 | Very low | 38.4 | Very low | 116 Ų | 116 | 139.3 Ų | 139.3 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | -137.3 | 122.3 | 128.8 | 30.8 | -15.2 | 0 | 0 | 0 | 111.4 | |||||
| 317 | H | 34.3 | Very low | 39.1 | Very low | 163 Ų | 163 | 140.6 Ų | 140.6 | 76% | 0.755 | 81% | 0.808 | S | S | * | * | 54.6 | 102.5 | 89.3 | -73.3 | 84 | 0 | 0 | 0 | 115.1 | |||||
| 318 | Y | 36.1 | Very low | 38.9 | Very low | 229 Ų | 229 | 135.4 Ų | 135.4 | 90% | 0.898 | 80% | 0.802 | S | S | * | * | trans | -70.9 | 157.5 | 165.3 | -91.4 | -95.2 | 0 | 0 | 0 | 112.3 | ||||
| 319 | P | 50.4 | Low | 38.9 | Very low | 114 Ų | 114 | 136 Ų | 136 | 74% | 0.74 | 81% | 0.806 | S | S | * | * | trans | -120.9 | 147.4 | 140.7 | 35 | -26.5 | 0 | 0 | 0 | 112.7 | ||||
| 320 | P | 48.8 | Very low | 38.9 | Very low | 115 Ų | 115 | 139.6 Ų | 139.6 | 75% | 0.747 | 81% | 0.811 | S | S | * | * | trans | -107.1 | 170.9 | 178.9 | 38.9 | -30.9 | 0 | 0 | 0 | 114.3 | ||||
| 321 | S | 35 | Very low | 38.8 | Very low | 112 Ų | 112 | 133.7 Ų | 133.7 | 78% | 0.783 | 80% | 0.802 | S | S | * | * | trans | 89.5 | 141 | 164.7 | -41.1 | 0 | 0 | 0 | 0 | 115 | ||||
| 322 | S | 33.4 | Very low | 38.9 | Very low | 113 Ų | 113 | 130.8 Ų | 130.8 | 79% | 0.79 | 80% | 0.796 | S | S | * | * | cis | -172.2 | 153.4 | 13.1 | 19 | 0 | 0 | 0 | 0 | 111 | ||||
| 323 | L | 38.3 | Very low | 38.8 | Very low | 175 Ų | 175 | 131.4 Ų | 131.4 | 92% | 0.916 | 80% | 0.799 | S | S | * | * | trans | -2 | 128.2 | 155.6 | -81.9 | 137.3 | 0 | 0 | 0 | 121.4 | ||||
| 324 | A | 35.8 | Very low | 39.1 | Very low | 106 Ų | 106 | 136 Ų | 136 | 88% | 0.876 | 81% | 0.806 | S | S | * | * | trans | -174.9 | 121 | 135 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 325 | G | 33 | Very low | 39.2 | Very low | 81 Ų | 81 | 139.3 Ų | 139.3 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | 116.9 | 100.1 | 68.4 | 0 | 0 | 0 | 0 | 0 | 108.5 | |||||
| 326 | L | 37.8 | Very low | 38.8 | Very low | 171 Ų | 171 | 136.6 Ų | 136.6 | 90% | 0.895 | 81% | 0.807 | S | S | * | * | trans | -64.8 | 157 | 167.9 | -84.4 | 171.5 | 0 | 0 | 0 | 110.5 | ||||
| 327 | P | 44.8 | Very low | 38.2 | Very low | 126 Ų | 126 | 136.2 Ų | 136.2 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | -146.6 | 160.3 | 62.4 | 34.9 | -12.6 | 0 | 0 | 0 | 117.5 | |||||
| 328 | G | 34.6 | Very low | 38.2 | Very low | 64 Ų | 64 | 139.4 Ų | 139.4 | 66% | 0.66 | 81% | 0.813 | S | S | * | * | trans | -86.4 | -152.1 | 166.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 329 | P | 46.3 | Very low | 38.2 | Very low | 122 Ų | 122 | 139 Ų | 139 | 79% | 0.792 | 81% | 0.811 | S | S | * | * | cis | -126.2 | 157.3 | -30.6 | 36.8 | -21.5 | 0 | 0 | 0 | 111.9 | ||||
| 330 | Q | 37.2 | Very low | 37.6 | Very low | 178 Ų | 178 | 142.2 Ų | 142.2 | 83% | 0.832 | 82% | 0.816 | S | S | * | * | trans | -135.5 | 114.2 | 164.4 | -76.1 | -90.9 | -46.7 | 0 | 0 | 108 | ||||
| 331 | G | 36.2 | Very low | 37.4 | Very low | 69 Ų | 69 | 143.8 Ų | 143.8 | 71% | 0.711 | 82% | 0.817 | S | S | * | * | trans | -83.6 | 142.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 332 | H | 39.1 | Very low | 37.7 | Very low | 161 Ų | 161 | 143.9 Ų | 143.9 | 75% | 0.745 | 82% | 0.816 | S | S | * | * | trans | -130 | 105.8 | 160.7 | -68.3 | -68.1 | 0 | 0 | 0 | 108 | F334 | H332-F334 PolarHBondContact O-N 3.33Š| ||
| 333 | L | 37.5 | Very low | 38.2 | Very low | 177 Ų | 177 | 145.5 Ų | 145.5 | 93% | 0.927 | 81% | 0.814 | S | S | * | * | trans | -58.3 | 120.1 | 169.1 | -110.1 | 67.1 | 0 | 0 | 0 | 109 | ||||
| 334 | F | 37.9 | Very low | 38.3 | Very low | 202 Ų | 202 | 145 Ų | 145 | 89% | 0.886 | 81% | 0.813 | S | S | * | * | trans | -82.8 | 115.9 | 158 | -83 | -85.6 | 0 | 0 | 0 | 108.5 | H332 A336 | H332-F334 PolarHBondContact O-N 3.33Å; F334-A336 PolarHBondContact O-N 3.3Å | ||
| 335 | Q | 37.2 | Very low | 38.7 | Very low | 188 Ų | 188 | 147 Ų | 147 | 88% | 0.879 | 81% | 0.807 | S | S | * | * | trans | -71.7 | 105.6 | 172.5 | -171 | 172.4 | 3 | 0 | 0 | 108.5 | S337 | Q335-S337 PolarHBondContact O-N 3.25Š| ||
| 336 | A | 33.6 | Very low | 39.2 | Very low | 86 Ų | 86 | 151.6 Ų | 151.6 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | trans | -73.4 | 113.2 | 167.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | F334 R338 | F334-A336 PolarHBondContact O-N 3.3Å; A336-R338 PolarHBondContact O-N 3.49Å; A336-R338 VanDerWaalsContact O-N 3.08Å | ||
| 337 | S | 34.5 | Very low | 39.5 | Very low | 108 Ų | 108 | 148.1 Ų | 148.1 | 76% | 0.755 | 80% | 0.803 | S | S | * | * | trans | -59.8 | 109 | 167.6 | -82 | 0 | 0 | 0 | 0 | 109.4 | Q335 | Q335-S337 PolarHBondContact O-N 3.25Š| ||
| 338 | R | 34.7 | Very low | 39.1 | Very low | 231 Ų | 231 | 151.9 Ų | 151.9 | 87% | 0.872 | 81% | 0.807 | S | S | * | * | trans | -82.4 | 116.1 | 166.9 | -64.3 | -136.1 | -76 | -129 | 2.8 | 108.5 | A336 E340 | A336-R338 PolarHBondContact O-N 3.49Å; A336-R338 VanDerWaalsContact O-N 3.08Å; R338-E340 PolarHBondContact O-N 2.99Å | ||
| 339 | Y | 36.5 | Very low | 39.2 | Very low | 220 Ų | 220 | 156.6 Ų | 156.6 | 86% | 0.863 | 81% | 0.811 | S | S | * | * | trans | -74.1 | 107.2 | 164.8 | 22.4 | -94.2 | 0 | 0 | 0 | 108 | ||||
| 340 | E | 36.5 | Very low | 38.6 | Very low | 182 Ų | 182 | 156.4 Ų | 156.4 | 85% | 0.85 | 81% | 0.813 | S | S | * | * | trans | -81.8 | 123.1 | 165.5 | -93.4 | -95.5 | 144.7 | 0 | 0 | 108.3 | R338 | R338-E340 PolarHBondContact O-N 2.99Š| ||
| 341 | L | 45.5 | Very low | 38.8 | Very low | 147 Ų | 147 | 156.4 Ų | 156.4 | 77% | 0.77 | 81% | 0.811 | S | S | * | * | trans | -105.4 | 123.2 | 171.6 | -166.1 | 78.1 | 0 | 0 | 0 | 107.9 | L343 | L341-L343 PolarHBondContact O-N 3.24Š| ||
| 342 | P | 40.6 | Very low | 39.7 | Very low | 115 Ų | 115 | 158.2 Ų | 158.2 | 75% | 0.747 | 81% | 0.81 | S | S | * | * | trans | -66.4 | 115.1 | 176.7 | -20.2 | 32.4 | 0 | 0 | 0 | 111.1 | ||||
| 343 | L | 44.4 | Very low | 39.9 | Very low | 146 Ų | 146 | 156.3 Ų | 156.3 | 76% | 0.764 | 81% | 0.812 | S | S | * | * | trans | -93.2 | 106 | 166.5 | -85.6 | 154.9 | 0 | 0 | 0 | 108.1 | L341 I345 | L341-L343 PolarHBondContact O-N 3.24Å; L343-I345 VanDerWaalsContact C-N 3.31Å; L343-I345 HydrophobicContact CB-CG1 4.43Å; L343-I345 PolarHBondContact O-N 3.39Å | ||
| 344 | D | 40.7 | Very low | 40.5 | Very low | 164 Ų | 164 | 153.8 Ų | 153.8 | 88% | 0.877 | 81% | 0.806 | S | S | * | * | trans | -66.7 | 91.7 | 163.6 | -90 | -39.9 | 0 | 0 | 0 | 108.9 | Q346 | D344-Q346 PolarHBondContact O-N 3.4Š| ||
| 345 | I | 43.5 | Very low | 40.7 | Very low | 148 Ų | 148 | 151.9 Ų | 151.9 | 76% | 0.759 | 80% | 0.799 | S | S | * | * | trans | -80.4 | 90.9 | 168.1 | -65.7 | 169 | 0 | 0 | 0 | 106.7 | L343 A347 | L343-I345 VanDerWaalsContact C-N 3.31Å; L343-I345 HydrophobicContact CB-CG1 4.43Å; L343-I345 PolarHBondContact O-N 3.39Å; I345-A347 PolarHBondContact O-N 3.13Å | ||
| 346 | Q | 43.5 | Very low | 41 | Very low | 179 Ų | 179 | 150.6 Ų | 150.6 | 84% | 0.836 | 80% | 0.796 | S | S | * | * | trans | -67.3 | 120.5 | 162.4 | -86.8 | 178.2 | -30.2 | 0 | 0 | 108.8 | D344 F348 | D344-Q346 PolarHBondContact O-N 3.4Å; Q346-F348 PolarHBondContact O-N 3.23Å | ||
| 347 | A | 44.5 | Very low | 41.5 | Very low | 97 Ų | 97 | 153.3 Ų | 153.3 | 80% | 0.802 | 80% | 0.803 | S | S | * | * | trans | -49 | 117.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | I345 | I345-A347 PolarHBondContact O-N 3.13Š| ||
| 348 | F | 36.7 | Very low | 41.8 | Very low | 206 Ų | 206 | 152.3 Ų | 152.3 | 90% | 0.904 | 80% | 0.801 | S | S | * | * | trans | -89.2 | 115.9 | 160.3 | -118.6 | -90.5 | 0 | 0 | 0 | 108.1 | Q346 S350 | Q346-F348 PolarHBondContact O-N 3.23Å; F348-S350 PolarHBondContact O-N 3.25Å | ||
| 349 | E | 36.8 | Very low | 42.2 | Very low | 162 Ų | 162 | 146 Ų | 146 | 76% | 0.757 | 79% | 0.793 | S | S | * | * | trans | -63.8 | 122.3 | -179.1 | -150.9 | 170.9 | -169.9 | 0 | 0 | 110.2 | F351 | E349-F351 PolarHBondContact O-N 3.13Š| ||
| 350 | S | 33.5 | Very low | 42.7 | Very low | 119 Ų | 119 | 144.5 Ų | 144.5 | 83% | 0.832 | 79% | 0.793 | S | S | * | * | trans | -80.7 | 112.2 | 179.3 | -133 | 0 | 0 | 0 | 0 | 109.8 | F348 | F348-S350 PolarHBondContact O-N 3.25Š| ||
| 351 | F | 41.8 | Very low | 43.2 | Very low | 177 Ų | 177 | 143.9 Ų | 143.9 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -86 | 127.4 | 168.3 | -88.2 | -88.9 | 0 | 0 | 0 | 110.4 | E349 | E349-F351 PolarHBondContact O-N 3.13Š|
| 352 | P | 54.7 | Low | 43.1 | Very low | 107 Ų | 107 | 140.4 Ų | 140.4 | 70% | 0.695 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 155.1 | 177.7 | 32.8 | -33.2 | 0 | 0 | 0 | 112 | ||
| 353 | P | 43.4 | Very low | 43.3 | Very low | 121 Ų | 121 | 142 Ų | 142 | 79% | 0.786 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -86.3 | 138 | -175.9 | 34.1 | -31.2 | 0 | 0 | 0 | 111.4 | ||
| 354 | P | 49.8 | Very low | 43.6 | Very low | 124 Ų | 124 | 142.4 Ų | 142.4 | 81% | 0.805 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -90.2 | 129.8 | 162.6 | 32.8 | -25.8 | 0 | 0 | 0 | 110.2 | ||
| 355 | H | 43 | Very low | 43.8 | Very low | 162 Ų | 162 | 145.3 Ų | 145.3 | 75% | 0.75 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 150.2 | 176.5 | 49.2 | -84.3 | 0 | 0 | 0 | 111.6 | ||
| 356 | M | 43.8 | Very low | 43.9 | Very low | 162 Ų | 162 | 144 Ų | 144 | 80% | 0.798 | 81% | 0.806 | S | S | * | * | trans | 57 | 102.3 | 149.2 | -54.3 | -126.8 | 72.3 | 0 | 0 | 119.6 | ||||
| 357 | V | 42.6 | Very low | 43.8 | Very low | 143 Ų | 143 | 148.5 Ų | 148.5 | 87% | 0.867 | 83% | 0.827 | S | S | * | * | trans | -128.6 | 109.1 | 141.5 | -175.1 | 0 | 0 | 0 | 0 | 107.9 | S359 | V357-S359 PolarHBondContact O-N 2.96Š| ||
| 358 | A | 41.7 | Very low | 43.7 | Very low | 86 Ų | 86 | 151.1 Ų | 151.1 | 71% | 0.711 | 83% | 0.828 | S | S | * | * | trans | -68.6 | 112.2 | 170 | 0 | 0 | 0 | 0 | 0 | 108.8 | Q360 | A358-Q360 PolarHBondContact O-N 3.33Š| ||
| 359 | S | 42.9 | Very low | 44.1 | Very low | 100 Ų | 100 | 148.2 Ų | 148.2 | 70% | 0.699 | 82% | 0.824 | S | S | * | * | trans | -85.1 | 101.8 | 170.5 | -152.8 | 0 | 0 | 0 | 0 | 108.6 | V357 M361 | V357-S359 PolarHBondContact O-N 2.96Å; S359-M361 PolarHBondContact O-N 3.37Å | ||
| 360 | Q | 47.5 | Very low | 44.5 | Very low | 188 Ų | 188 | 147.4 Ų | 147.4 | 88% | 0.879 | 83% | 0.828 | S | S | * | * | trans | -63.7 | 110.4 | 163 | -75.5 | -178.9 | 18.1 | 0 | 0 | 108 | A358 | A358-Q360 PolarHBondContact O-N 3.33Š| ||
| 361 | M | 46 | Very low | 45.2 | Very low | 169 Ų | 169 | 149.1 Ų | 149.1 | 83% | 0.833 | 83% | 0.828 | S | S | * | * | trans | -103.7 | 102.6 | 163.2 | -67.3 | -70.4 | -107.8 | 0 | 0 | 107 | S359 T363 | S359-M361 PolarHBondContact O-N 3.37Å; M361-T363 PolarHBondContact O-N 3.11Å | ||
| 362 | G | 42.8 | Very low | 45.4 | Very low | 74 Ų | 74 | 147.4 Ų | 147.4 | 76% | 0.763 | 83% | 0.831 | S | S | * | * | trans | -65.3 | 122.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111 | I364 | G362-I364 PolarHBondContact O-N 3.12Š| ||
| 363 | T | 45 | Very low | 44.8 | Very low | 148 Ų | 148 | 150.1 Ų | 150.1 | 91% | 0.908 | 84% | 0.84 | S | S | * | * | trans | -71.3 | 107.1 | 160.4 | 15.4 | 0 | 0 | 0 | 0 | 108.6 | M361 | M361-T363 PolarHBondContact O-N 3.11Š| ||
| 364 | I | 51.5 | Low | 44.9 | Very low | 155 Ų | 155 | 152.1 Ų | 152.1 | 80% | 0.795 | 84% | 0.844 | S | S | * | * | trans | -99.5 | 106.8 | 159.7 | -58.5 | 174.8 | 0 | 0 | 0 | 105.7 | G362 | G362-I364 PolarHBondContact O-N 3.12Š| ||
| 365 | Y | 45.8 | Very low | 44.5 | Very low | 224 Ų | 224 | 154.3 Ų | 154.3 | 88% | 0.878 | 85% | 0.847 | S | S | * | * | trans | -170.5 | 133.4 | 149.3 | -98.5 | -70.1 | 0 | 0 | 0 | 110.7 | ||||
| 366 | S | 44 | Very low | 44.6 | Very low | 122 Ų | 122 | 153.7 Ų | 153.7 | 85% | 0.853 | 86% | 0.855 | S | S | * | * | trans | 80.1 | 118.5 | 177.1 | -38.3 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 367 | E | 41.6 | Very low | 44.7 | Very low | 273 Ų | 273 | 152.9 Ų | 152.9 | 100% | 1.276 | 86% | 0.86 | S | S | * | * | cis | -147.1 | 0 | 39.4 | -173.6 | -179.1 | 128.3 | 0 | 0 | 111 |
Retrieved 367 of 367 residues in 618.3 ms
(Link to these results)